USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 242 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 Set 1.1: A 5 DT C7 :methyl 150:sc= -10.4! (180deg=-10.3!) USER MOD Set 1.2: A 7 DT C7 :methyl -30:sc= -9.77! (180deg=-11!) USER MOD Set 2.1: A 1 DT C7 :methyl -30:sc= -6.81! (180deg=-5.63!) USER MOD Set 2.2: A 12 DT C7 :methyl -30:sc= -10.8! (180deg=-5.53!) USER MOD Single : A 1 DT O5' : rot -164:sc= -0.58 USER MOD Single : A 6 DT C7 :methyl -30:sc= -1.82! (180deg=-6.34!) USER MOD Single : A 11 DT C7 :methyl 150:sc= -11.4! (180deg=-11.4!) USER MOD Single : A 16 DT C7 :methyl 150:sc= -0.815 (180deg=-0.815) USER MOD Single : A 17 DT C7 :methyl -30:sc= -14.9! (180deg=-20.2!) USER MOD Single : A 18 DT C7 :methyl -30:sc= -9.11! (180deg=-11.6!) USER MOD Single : A 21 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -3.777 -3.087 5.266 1.00 0.23 O ATOM 2 C5' DT A 1 -2.518 -3.720 5.489 1.00 0.17 C ATOM 3 C4' DT A 1 -2.692 -5.151 6.008 1.00 0.16 C ATOM 4 O4' DT A 1 -3.295 -5.948 4.990 1.00 0.20 O ATOM 5 C3' DT A 1 -1.376 -5.826 6.394 1.00 0.20 C ATOM 6 O3' DT A 1 -1.306 -5.974 7.819 1.00 0.24 O ATOM 7 C2' DT A 1 -1.417 -7.210 5.742 1.00 0.30 C ATOM 8 C1' DT A 1 -2.785 -7.278 5.069 1.00 0.24 C ATOM 9 N1 DT A 1 -2.735 -7.809 3.691 1.00 0.22 N ATOM 10 C2 DT A 1 -3.302 -9.046 3.447 1.00 0.27 C ATOM 11 O2 DT A 1 -3.849 -9.709 4.326 1.00 0.34 O ATOM 12 N3 DT A 1 -3.229 -9.497 2.144 1.00 0.31 N ATOM 13 C4 DT A 1 -2.651 -8.830 1.079 1.00 0.30 C ATOM 14 O4 DT A 1 -2.642 -9.332 -0.042 1.00 0.38 O ATOM 15 C5 DT A 1 -2.092 -7.545 1.427 1.00 0.24 C ATOM 16 C7 DT A 1 -1.475 -6.670 0.339 1.00 0.29 C ATOM 17 C6 DT A 1 -2.144 -7.086 2.692 1.00 0.21 C ATOM 0 H5' DT A 1 -1.940 -3.139 6.208 1.00 0.17 H new ATOM 0 H5'' DT A 1 -1.948 -3.736 4.560 1.00 0.17 H new ATOM 0 H4' DT A 1 -3.310 -5.077 6.903 1.00 0.16 H new ATOM 0 H3' DT A 1 -0.513 -5.244 6.070 1.00 0.20 H new ATOM 0 H2' DT A 1 -0.612 -7.331 5.017 1.00 0.30 H new ATOM 0 H2'' DT A 1 -1.300 -8.001 6.483 1.00 0.30 H new ATOM 0 HO5' DT A 1 -3.650 -2.294 4.704 1.00 0.23 H new ATOM 0 H1' DT A 1 -3.407 -7.948 5.663 1.00 0.24 H new ATOM 0 H3 DT A 1 -3.641 -10.409 1.948 1.00 0.31 H new ATOM 0 H71 DT A 1 -1.063 -7.303 -0.447 1.00 0.29 H new ATOM 0 H72 DT A 1 -2.241 -6.020 -0.083 1.00 0.29 H new ATOM 0 H73 DT A 1 -0.680 -6.061 0.769 1.00 0.29 H new ATOM 0 H6 DT A 1 -1.709 -6.125 2.923 1.00 0.21 H new ATOM 31 P DG A 2 -0.516 -4.902 8.734 1.00 0.19 P ATOM 32 OP1 DG A 2 -0.765 -5.234 10.155 1.00 0.29 O ATOM 33 OP2 DG A 2 -0.828 -3.546 8.234 1.00 0.22 O ATOM 34 O5' DG A 2 1.031 -5.209 8.409 1.00 0.22 O ATOM 35 C5' DG A 2 1.782 -6.113 9.230 1.00 0.27 C ATOM 36 C4' DG A 2 3.056 -6.597 8.537 1.00 0.26 C ATOM 37 O4' DG A 2 2.766 -7.085 7.246 1.00 0.27 O ATOM 38 C3' DG A 2 4.126 -5.550 8.308 1.00 0.26 C ATOM 39 O3' DG A 2 4.811 -5.256 9.536 1.00 0.32 O ATOM 40 C2' DG A 2 5.030 -6.291 7.361 1.00 0.30 C ATOM 41 C1' DG A 2 3.995 -7.053 6.515 1.00 0.28 C ATOM 42 N9 DG A 2 3.734 -6.428 5.219 1.00 0.27 N ATOM 43 C8 DG A 2 4.332 -6.735 4.063 1.00 0.33 C ATOM 44 N7 DG A 2 3.902 -6.067 3.033 1.00 0.34 N ATOM 45 C5 DG A 2 2.929 -5.231 3.571 1.00 0.27 C ATOM 46 C6 DG A 2 2.107 -4.265 2.937 1.00 0.27 C ATOM 47 O6 DG A 2 2.076 -3.956 1.751 1.00 0.34 O ATOM 48 N1 DG A 2 1.262 -3.630 3.834 1.00 0.22 N ATOM 49 C2 DG A 2 1.221 -3.901 5.224 1.00 0.18 C ATOM 50 N2 DG A 2 0.413 -3.187 6.057 1.00 0.23 N ATOM 51 N3 DG A 2 2.001 -4.824 5.794 1.00 0.19 N ATOM 52 C4 DG A 2 2.821 -5.442 4.919 1.00 0.22 C ATOM 0 H5' DG A 2 1.161 -6.971 9.486 1.00 0.27 H new ATOM 0 H5'' DG A 2 2.044 -5.619 10.166 1.00 0.27 H new ATOM 0 H4' DG A 2 3.433 -7.347 9.232 1.00 0.26 H new ATOM 0 H3' DG A 2 3.762 -4.591 7.939 1.00 0.26 H new ATOM 0 H2' DG A 2 5.641 -5.617 6.760 1.00 0.30 H new ATOM 0 H2'' DG A 2 5.714 -6.962 7.881 1.00 0.30 H new ATOM 0 H1' DG A 2 4.398 -8.047 6.322 1.00 0.28 H new ATOM 0 H8 DG A 2 5.111 -7.479 3.990 1.00 0.33 H new ATOM 0 H1 DG A 2 0.627 -2.920 3.469 1.00 0.22 H new ATOM 0 H21 DG A 2 0.397 -3.397 7.055 1.00 0.23 H new ATOM 0 H22 DG A 2 -0.176 -2.443 5.682 1.00 0.23 H new ATOM 64 P DG A 3 4.515 -3.903 10.365 1.00 0.32 P ATOM 65 OP1 DG A 3 4.727 -4.186 11.803 1.00 0.40 O ATOM 66 OP2 DG A 3 3.222 -3.344 9.909 1.00 0.34 O ATOM 67 O5' DG A 3 5.692 -2.923 9.863 1.00 0.30 O ATOM 68 C5' DG A 3 5.861 -2.652 8.467 1.00 0.25 C ATOM 69 C4' DG A 3 7.097 -1.797 8.195 1.00 0.21 C ATOM 70 O4' DG A 3 7.280 -1.682 6.790 1.00 0.22 O ATOM 71 C3' DG A 3 7.010 -0.381 8.759 1.00 0.24 C ATOM 72 O3' DG A 3 8.270 0.031 9.334 1.00 0.31 O ATOM 73 C2' DG A 3 6.644 0.488 7.579 1.00 0.19 C ATOM 74 C1' DG A 3 7.181 -0.314 6.401 1.00 0.17 C ATOM 75 N9 DG A 3 6.331 -0.280 5.213 1.00 0.15 N ATOM 76 C8 DG A 3 6.746 -0.236 3.935 1.00 0.14 C ATOM 77 N7 DG A 3 5.785 -0.231 3.056 1.00 0.14 N ATOM 78 C5 DG A 3 4.632 -0.275 3.834 1.00 0.12 C ATOM 79 C6 DG A 3 3.275 -0.289 3.437 1.00 0.13 C ATOM 80 O6 DG A 3 2.820 -0.266 2.301 1.00 0.18 O ATOM 81 N1 DG A 3 2.413 -0.333 4.519 1.00 0.12 N ATOM 82 C2 DG A 3 2.819 -0.365 5.874 1.00 0.12 C ATOM 83 N2 DG A 3 1.898 -0.426 6.887 1.00 0.15 N ATOM 84 N3 DG A 3 4.113 -0.352 6.224 1.00 0.14 N ATOM 85 C4 DG A 3 4.953 -0.306 5.163 1.00 0.13 C ATOM 0 H5' DG A 3 4.976 -2.141 8.087 1.00 0.25 H new ATOM 0 H5'' DG A 3 5.944 -3.593 7.923 1.00 0.25 H new ATOM 0 H4' DG A 3 7.926 -2.301 8.691 1.00 0.21 H new ATOM 0 H3' DG A 3 6.277 -0.309 9.563 1.00 0.24 H new ATOM 0 H2' DG A 3 5.567 0.643 7.507 1.00 0.19 H new ATOM 0 H2'' DG A 3 7.105 1.474 7.643 1.00 0.19 H new ATOM 0 H1' DG A 3 8.138 0.139 6.143 1.00 0.17 H new ATOM 0 H8 DG A 3 7.790 -0.207 3.660 1.00 0.14 H new ATOM 0 H1 DG A 3 1.412 -0.343 4.325 1.00 0.12 H new ATOM 0 H21 DG A 3 2.209 -0.448 7.858 1.00 0.15 H new ATOM 0 H22 DG A 3 0.902 -0.449 6.670 1.00 0.15 H new ATOM 97 P DG A 4 9.706 -0.274 8.640 1.00 0.33 P ATOM 98 OP1 DG A 4 9.758 -1.706 8.267 1.00 0.37 O ATOM 99 OP2 DG A 4 10.759 0.289 9.513 1.00 0.44 O ATOM 100 O5' DG A 4 9.659 0.604 7.286 1.00 0.27 O ATOM 101 C5' DG A 4 9.624 2.037 7.339 1.00 0.26 C ATOM 102 C4' DG A 4 9.503 2.656 5.945 1.00 0.21 C ATOM 103 O4' DG A 4 8.421 2.070 5.231 1.00 0.19 O ATOM 104 C3' DG A 4 9.219 4.155 5.953 1.00 0.21 C ATOM 105 O3' DG A 4 10.444 4.916 5.998 1.00 0.25 O ATOM 106 C2' DG A 4 8.497 4.395 4.630 1.00 0.19 C ATOM 107 C1' DG A 4 7.979 3.008 4.240 1.00 0.16 C ATOM 108 N9 DG A 4 6.517 2.925 4.178 1.00 0.14 N ATOM 109 C8 DG A 4 5.623 2.956 5.200 1.00 0.16 C ATOM 110 N7 DG A 4 4.378 2.871 4.822 1.00 0.17 N ATOM 111 C5 DG A 4 4.468 2.780 3.436 1.00 0.14 C ATOM 112 C6 DG A 4 3.444 2.671 2.465 1.00 0.15 C ATOM 113 O6 DG A 4 2.231 2.632 2.645 1.00 0.19 O ATOM 114 N1 DG A 4 3.958 2.610 1.177 1.00 0.14 N ATOM 115 C2 DG A 4 5.346 2.651 0.868 1.00 0.13 C ATOM 116 N2 DG A 4 5.794 2.585 -0.405 1.00 0.16 N ATOM 117 N3 DG A 4 6.280 2.754 1.801 1.00 0.14 N ATOM 118 C4 DG A 4 5.777 2.812 3.043 1.00 0.13 C ATOM 0 H5' DG A 4 10.529 2.405 7.822 1.00 0.26 H new ATOM 0 H5'' DG A 4 8.782 2.357 7.953 1.00 0.26 H new ATOM 0 H4' DG A 4 10.472 2.471 5.482 1.00 0.21 H new ATOM 0 H3' DG A 4 8.638 4.463 6.822 1.00 0.21 H new ATOM 0 H2' DG A 4 7.682 5.109 4.743 1.00 0.19 H new ATOM 0 H2'' DG A 4 9.171 4.798 3.874 1.00 0.19 H new ATOM 0 H1' DG A 4 8.366 2.793 3.244 1.00 0.16 H new ATOM 0 H8 DG A 4 5.918 3.043 6.235 1.00 0.16 H new ATOM 0 H1 DG A 4 3.299 2.531 0.403 1.00 0.14 H new ATOM 0 H21 DG A 4 6.796 2.617 -0.595 1.00 0.16 H new ATOM 0 H22 DG A 4 5.131 2.503 -1.175 1.00 0.16 H new ATOM 130 P DT A 5 11.783 4.479 5.199 1.00 0.27 P ATOM 131 OP1 DT A 5 12.174 3.121 5.639 1.00 0.32 O ATOM 132 OP2 DT A 5 12.758 5.588 5.308 1.00 0.35 O ATOM 133 O5' DT A 5 11.287 4.393 3.666 1.00 0.24 O ATOM 134 C5' DT A 5 11.497 5.481 2.760 1.00 0.23 C ATOM 135 C4' DT A 5 10.669 5.330 1.483 1.00 0.17 C ATOM 136 O4' DT A 5 9.291 5.547 1.765 1.00 0.16 O ATOM 137 C3' DT A 5 11.055 6.306 0.387 1.00 0.19 C ATOM 138 O3' DT A 5 11.162 5.602 -0.851 1.00 0.23 O ATOM 139 C2' DT A 5 9.905 7.286 0.328 1.00 0.17 C ATOM 140 C1' DT A 5 8.763 6.420 0.772 1.00 0.14 C ATOM 141 N1 DT A 5 7.617 7.074 1.377 1.00 0.16 N ATOM 142 C2 DT A 5 7.463 8.455 1.380 1.00 0.19 C ATOM 143 O2 DT A 5 8.269 9.227 0.877 1.00 0.25 O ATOM 144 N3 DT A 5 6.301 8.911 1.972 1.00 0.20 N ATOM 145 C4 DT A 5 5.311 8.122 2.532 1.00 0.18 C ATOM 146 O4 DT A 5 4.305 8.627 3.025 1.00 0.23 O ATOM 147 C5 DT A 5 5.593 6.706 2.461 1.00 0.15 C ATOM 148 C7 DT A 5 4.612 5.701 3.012 1.00 0.15 C ATOM 149 C6 DT A 5 6.716 6.259 1.897 1.00 0.14 C ATOM 0 H5' DT A 5 12.554 5.539 2.502 1.00 0.23 H new ATOM 0 H5'' DT A 5 11.237 6.418 3.252 1.00 0.23 H new ATOM 0 H4' DT A 5 10.864 4.317 1.131 1.00 0.17 H new ATOM 0 H3' DT A 5 12.008 6.801 0.573 1.00 0.19 H new ATOM 0 H2' DT A 5 10.056 8.139 0.990 1.00 0.17 H new ATOM 0 H2'' DT A 5 9.754 7.684 -0.676 1.00 0.17 H new ATOM 0 H1' DT A 5 8.382 5.959 -0.139 1.00 0.14 H new ATOM 0 H3 DT A 5 6.160 9.921 1.999 1.00 0.20 H new ATOM 0 H71 DT A 5 4.685 4.773 2.445 1.00 0.15 H new ATOM 0 H72 DT A 5 4.841 5.506 4.060 1.00 0.15 H new ATOM 0 H73 DT A 5 3.600 6.098 2.930 1.00 0.15 H new ATOM 0 H6 DT A 5 6.895 5.194 1.864 1.00 0.14 H new ATOM 162 P DT A 6 12.353 5.920 -1.881 1.00 0.30 P ATOM 163 OP1 DT A 6 13.078 4.660 -2.153 1.00 0.43 O ATOM 164 OP2 DT A 6 13.093 7.102 -1.389 1.00 0.37 O ATOM 165 O5' DT A 6 11.558 6.343 -3.213 1.00 0.29 O ATOM 166 C5' DT A 6 10.586 5.466 -3.786 1.00 0.24 C ATOM 167 C4' DT A 6 9.484 6.250 -4.496 1.00 0.19 C ATOM 168 O4' DT A 6 8.630 5.363 -5.209 1.00 0.21 O ATOM 169 C3' DT A 6 8.609 7.072 -3.553 1.00 0.17 C ATOM 170 O3' DT A 6 8.503 8.419 -4.055 1.00 0.21 O ATOM 171 C2' DT A 6 7.239 6.380 -3.560 1.00 0.16 C ATOM 172 C1' DT A 6 7.459 5.132 -4.438 1.00 0.18 C ATOM 173 N1 DT A 6 7.682 3.859 -3.711 1.00 0.16 N ATOM 174 C2 DT A 6 7.606 2.695 -4.449 1.00 0.20 C ATOM 175 O2 DT A 6 7.307 2.693 -5.639 1.00 0.24 O ATOM 176 N3 DT A 6 7.889 1.525 -3.776 1.00 0.22 N ATOM 177 C4 DT A 6 8.245 1.414 -2.449 1.00 0.20 C ATOM 178 O4 DT A 6 8.480 0.314 -1.956 1.00 0.25 O ATOM 179 C5 DT A 6 8.302 2.679 -1.753 1.00 0.17 C ATOM 180 C7 DT A 6 8.746 2.719 -0.294 1.00 0.21 C ATOM 181 C6 DT A 6 8.015 3.833 -2.385 1.00 0.15 C ATOM 0 H5' DT A 6 10.148 4.844 -3.005 1.00 0.24 H new ATOM 0 H5'' DT A 6 11.071 4.794 -4.494 1.00 0.24 H new ATOM 0 H4' DT A 6 10.003 6.937 -5.164 1.00 0.19 H new ATOM 0 H3' DT A 6 9.018 7.129 -2.544 1.00 0.17 H new ATOM 0 H2' DT A 6 6.923 6.109 -2.553 1.00 0.16 H new ATOM 0 H2'' DT A 6 6.466 7.028 -3.973 1.00 0.16 H new ATOM 0 H1' DT A 6 6.540 5.006 -5.010 1.00 0.18 H new ATOM 0 H3 DT A 6 7.829 0.659 -4.311 1.00 0.22 H new ATOM 0 H71 DT A 6 8.472 1.785 0.196 1.00 0.21 H new ATOM 0 H72 DT A 6 9.827 2.850 -0.246 1.00 0.21 H new ATOM 0 H73 DT A 6 8.257 3.551 0.212 1.00 0.21 H new ATOM 0 H6 DT A 6 8.049 4.760 -1.832 1.00 0.15 H new ATOM 194 P DT A 7 7.802 8.769 -5.473 1.00 0.23 P ATOM 195 OP1 DT A 7 7.869 7.581 -6.349 1.00 0.27 O ATOM 196 OP2 DT A 7 8.349 10.061 -5.944 1.00 0.32 O ATOM 197 O5' DT A 7 6.267 8.998 -5.041 1.00 0.25 O ATOM 198 C5' DT A 7 5.204 8.364 -5.758 1.00 0.21 C ATOM 199 C4' DT A 7 3.836 8.797 -5.244 1.00 0.19 C ATOM 200 O4' DT A 7 3.323 7.828 -4.357 1.00 0.18 O ATOM 201 C3' DT A 7 3.848 10.121 -4.488 1.00 0.19 C ATOM 202 O3' DT A 7 3.418 11.196 -5.355 1.00 0.25 O ATOM 203 C2' DT A 7 2.872 9.924 -3.322 1.00 0.19 C ATOM 204 C1' DT A 7 2.427 8.471 -3.451 1.00 0.17 C ATOM 205 N1 DT A 7 2.506 7.707 -2.207 1.00 0.16 N ATOM 206 C2 DT A 7 1.433 7.722 -1.332 1.00 0.20 C ATOM 207 O2 DT A 7 0.441 8.419 -1.511 1.00 0.26 O ATOM 208 N3 DT A 7 1.555 6.899 -0.230 1.00 0.21 N ATOM 209 C4 DT A 7 2.637 6.084 0.058 1.00 0.19 C ATOM 210 O4 DT A 7 2.633 5.364 1.049 1.00 0.24 O ATOM 211 C5 DT A 7 3.695 6.162 -0.922 1.00 0.16 C ATOM 212 C7 DT A 7 4.942 5.323 -0.796 1.00 0.17 C ATOM 213 C6 DT A 7 3.598 6.944 -1.977 1.00 0.15 C ATOM 0 H5' DT A 7 5.300 7.282 -5.668 1.00 0.21 H new ATOM 0 H5'' DT A 7 5.287 8.604 -6.818 1.00 0.21 H new ATOM 0 H4' DT A 7 3.222 8.914 -6.137 1.00 0.19 H new ATOM 0 H3' DT A 7 4.843 10.389 -4.134 1.00 0.19 H new ATOM 0 H2' DT A 7 3.355 10.109 -2.362 1.00 0.19 H new ATOM 0 H2'' DT A 7 2.026 10.608 -3.391 1.00 0.19 H new ATOM 0 H1' DT A 7 1.386 8.493 -3.773 1.00 0.17 H new ATOM 0 H3 DT A 7 0.778 6.891 0.431 1.00 0.21 H new ATOM 0 H71 DT A 7 5.151 5.138 0.258 1.00 0.17 H new ATOM 0 H72 DT A 7 4.795 4.373 -1.309 1.00 0.17 H new ATOM 0 H73 DT A 7 5.783 5.851 -1.245 1.00 0.17 H new ATOM 0 H6 DT A 7 4.417 6.977 -2.681 1.00 0.15 H new ATOM 226 P DG A 8 1.958 11.243 -6.070 1.00 0.28 P ATOM 227 OP1 DG A 8 2.034 12.208 -7.189 1.00 0.40 O ATOM 228 OP2 DG A 8 0.922 11.419 -5.028 1.00 0.37 O ATOM 229 O5' DG A 8 1.801 9.769 -6.702 1.00 0.27 O ATOM 230 C5' DG A 8 0.566 9.344 -7.302 1.00 0.26 C ATOM 231 C4' DG A 8 0.513 7.835 -7.404 1.00 0.21 C ATOM 232 O4' DG A 8 0.891 7.287 -6.158 1.00 0.21 O ATOM 233 C3' DG A 8 -0.869 7.244 -7.750 1.00 0.21 C ATOM 234 O3' DG A 8 -0.789 6.473 -8.968 1.00 0.25 O ATOM 235 C2' DG A 8 -1.180 6.318 -6.572 1.00 0.20 C ATOM 236 C1' DG A 8 0.212 6.065 -6.027 1.00 0.17 C ATOM 237 N9 DG A 8 0.324 5.687 -4.628 1.00 0.16 N ATOM 238 C8 DG A 8 1.479 5.460 -3.969 1.00 0.16 C ATOM 239 N7 DG A 8 1.332 5.210 -2.710 1.00 0.14 N ATOM 240 C5 DG A 8 -0.042 5.268 -2.523 1.00 0.14 C ATOM 241 C6 DG A 8 -0.780 5.068 -1.345 1.00 0.14 C ATOM 242 O6 DG A 8 -0.334 4.801 -0.256 1.00 0.17 O ATOM 243 N1 DG A 8 -2.155 5.194 -1.534 1.00 0.14 N ATOM 244 C2 DG A 8 -2.743 5.503 -2.795 1.00 0.16 C ATOM 245 N2 DG A 8 -4.088 5.617 -2.940 1.00 0.20 N ATOM 246 N3 DG A 8 -2.006 5.691 -3.903 1.00 0.17 N ATOM 247 C4 DG A 8 -0.677 5.558 -3.691 1.00 0.15 C ATOM 0 H5' DG A 8 0.467 9.784 -8.294 1.00 0.26 H new ATOM 0 H5'' DG A 8 -0.275 9.703 -6.709 1.00 0.26 H new ATOM 0 H4' DG A 8 1.184 7.579 -8.224 1.00 0.21 H new ATOM 0 H3' DG A 8 -1.628 8.011 -7.903 1.00 0.21 H new ATOM 0 H2' DG A 8 -1.831 6.791 -5.837 1.00 0.20 H new ATOM 0 H2'' DG A 8 -1.672 5.399 -6.889 1.00 0.20 H new ATOM 0 H1' DG A 8 0.603 5.214 -6.585 1.00 0.17 H new ATOM 0 H8 DG A 8 2.444 5.485 -4.453 1.00 0.16 H new ATOM 0 H1 DG A 8 -2.770 5.059 -0.732 1.00 0.14 H new ATOM 0 H21 DG A 8 -4.486 5.839 -3.853 1.00 0.20 H new ATOM 0 H22 DG A 8 -4.701 5.481 -2.136 1.00 0.20 H new ATOM 259 P DG A 9 0.393 5.399 -9.241 1.00 0.25 P ATOM 260 OP1 DG A 9 1.693 6.060 -8.989 1.00 0.33 O ATOM 261 OP2 DG A 9 0.138 4.767 -10.556 1.00 0.35 O ATOM 262 O5' DG A 9 0.165 4.283 -8.096 1.00 0.19 O ATOM 263 C5' DG A 9 0.962 3.084 -8.069 1.00 0.22 C ATOM 264 C4' DG A 9 2.442 3.365 -7.768 1.00 0.19 C ATOM 265 O4' DG A 9 2.600 3.727 -6.391 1.00 0.17 O ATOM 266 C3' DG A 9 3.356 2.162 -8.032 1.00 0.23 C ATOM 267 O3' DG A 9 4.427 2.550 -8.895 1.00 0.40 O ATOM 268 C2' DG A 9 3.916 1.775 -6.674 1.00 0.23 C ATOM 269 C1' DG A 9 3.717 3.019 -5.842 1.00 0.17 C ATOM 270 N9 DG A 9 3.423 2.737 -4.440 1.00 0.16 N ATOM 271 C8 DG A 9 4.295 2.627 -3.405 1.00 0.16 C ATOM 272 N7 DG A 9 3.720 2.492 -2.254 1.00 0.17 N ATOM 273 C5 DG A 9 2.372 2.500 -2.546 1.00 0.15 C ATOM 274 C6 DG A 9 1.270 2.386 -1.676 1.00 0.16 C ATOM 275 O6 DG A 9 1.293 2.319 -0.452 1.00 0.17 O ATOM 276 N1 DG A 9 0.061 2.425 -2.358 1.00 0.17 N ATOM 277 C2 DG A 9 -0.053 2.576 -3.777 1.00 0.18 C ATOM 278 N2 DG A 9 -1.257 2.654 -4.412 1.00 0.22 N ATOM 279 N3 DG A 9 1.015 2.686 -4.561 1.00 0.17 N ATOM 280 C4 DG A 9 2.177 2.640 -3.887 1.00 0.15 C ATOM 0 H5' DG A 9 0.881 2.576 -9.030 1.00 0.22 H new ATOM 0 H5'' DG A 9 0.564 2.405 -7.315 1.00 0.22 H new ATOM 0 H4' DG A 9 2.733 4.173 -8.439 1.00 0.19 H new ATOM 0 H3' DG A 9 2.820 1.340 -8.506 1.00 0.23 H new ATOM 0 H2' DG A 9 3.388 0.921 -6.251 1.00 0.23 H new ATOM 0 H2'' DG A 9 4.969 1.499 -6.738 1.00 0.23 H new ATOM 0 H1' DG A 9 4.645 3.590 -5.870 1.00 0.17 H new ATOM 0 H8 DG A 9 5.367 2.650 -3.531 1.00 0.16 H new ATOM 0 H1 DG A 9 -0.798 2.341 -1.815 1.00 0.17 H new ATOM 0 H21 DG A 9 -1.293 2.761 -5.426 1.00 0.22 H new ATOM 0 H22 DG A 9 -2.122 2.605 -3.873 1.00 0.22 H new ATOM 292 P DG A 10 5.209 1.443 -9.763 1.00 0.57 P ATOM 293 OP1 DG A 10 6.484 2.039 -10.226 1.00 0.76 O ATOM 294 OP2 DG A 10 4.263 0.874 -10.750 1.00 0.73 O ATOM 295 O5' DG A 10 5.547 0.307 -8.663 1.00 0.42 O ATOM 296 C5' DG A 10 6.829 0.262 -8.024 1.00 0.35 C ATOM 297 C4' DG A 10 6.835 -0.669 -6.811 1.00 0.24 C ATOM 298 O4' DG A 10 6.028 -0.126 -5.766 1.00 0.22 O ATOM 299 C3' DG A 10 6.293 -2.079 -7.090 1.00 0.24 C ATOM 300 O3' DG A 10 7.379 -3.016 -7.083 1.00 0.30 O ATOM 301 C2' DG A 10 5.347 -2.362 -5.915 1.00 0.18 C ATOM 302 C1' DG A 10 5.636 -1.218 -4.959 1.00 0.15 C ATOM 303 N9 DG A 10 4.475 -0.839 -4.142 1.00 0.16 N ATOM 304 C8 DG A 10 3.154 -0.783 -4.509 1.00 0.16 C ATOM 305 N7 DG A 10 2.338 -0.591 -3.517 1.00 0.16 N ATOM 306 C5 DG A 10 3.173 -0.511 -2.411 1.00 0.14 C ATOM 307 C6 DG A 10 2.854 -0.320 -1.047 1.00 0.14 C ATOM 308 O6 DG A 10 1.748 -0.220 -0.535 1.00 0.17 O ATOM 309 N1 DG A 10 3.989 -0.302 -0.260 1.00 0.13 N ATOM 310 C2 DG A 10 5.254 -0.447 -0.708 1.00 0.15 C ATOM 311 N2 DG A 10 6.180 -0.413 0.228 1.00 0.17 N ATOM 312 N3 DG A 10 5.578 -0.627 -1.989 1.00 0.16 N ATOM 313 C4 DG A 10 4.483 -0.651 -2.784 1.00 0.15 C ATOM 0 H5' DG A 10 7.113 1.267 -7.711 1.00 0.35 H new ATOM 0 H5'' DG A 10 7.579 -0.072 -8.741 1.00 0.35 H new ATOM 0 H4' DG A 10 7.886 -0.750 -6.534 1.00 0.24 H new ATOM 0 H3' DG A 10 5.793 -2.160 -8.055 1.00 0.24 H new ATOM 0 H2' DG A 10 4.304 -2.370 -6.230 1.00 0.18 H new ATOM 0 H2'' DG A 10 5.550 -3.331 -5.458 1.00 0.18 H new ATOM 0 H1' DG A 10 6.408 -1.522 -4.252 1.00 0.15 H new ATOM 0 H8 DG A 10 2.822 -0.889 -5.531 1.00 0.16 H new ATOM 0 H1 DG A 10 3.861 -0.168 0.743 1.00 0.13 H new ATOM 0 H21 DG A 10 7.163 -0.515 -0.023 1.00 0.17 H new ATOM 0 H22 DG A 10 5.914 -0.285 1.204 1.00 0.17 H new ATOM 325 P DT A 11 7.274 -4.417 -7.874 1.00 0.40 P ATOM 326 OP1 DT A 11 8.634 -4.997 -7.965 1.00 0.52 O ATOM 327 OP2 DT A 11 6.481 -4.204 -9.106 1.00 0.57 O ATOM 328 O5' DT A 11 6.411 -5.334 -6.869 1.00 0.35 O ATOM 329 C5' DT A 11 6.711 -6.725 -6.726 1.00 0.35 C ATOM 330 C4' DT A 11 5.943 -7.356 -5.579 1.00 0.34 C ATOM 331 O4' DT A 11 6.402 -6.817 -4.339 1.00 0.33 O ATOM 332 C3' DT A 11 4.426 -7.126 -5.646 1.00 0.33 C ATOM 333 O3' DT A 11 3.754 -8.387 -5.615 1.00 0.38 O ATOM 334 C2' DT A 11 4.108 -6.355 -4.372 1.00 0.29 C ATOM 335 C1' DT A 11 5.277 -6.747 -3.477 1.00 0.29 C ATOM 336 N1 DT A 11 5.583 -5.803 -2.381 1.00 0.26 N ATOM 337 C2 DT A 11 5.119 -6.140 -1.124 1.00 0.30 C ATOM 338 O2 DT A 11 4.455 -7.154 -0.917 1.00 0.36 O ATOM 339 N3 DT A 11 5.437 -5.270 -0.103 1.00 0.32 N ATOM 340 C4 DT A 11 6.168 -4.105 -0.221 1.00 0.31 C ATOM 341 O4 DT A 11 6.396 -3.411 0.766 1.00 0.39 O ATOM 342 C5 DT A 11 6.613 -3.822 -1.572 1.00 0.25 C ATOM 343 C7 DT A 11 7.409 -2.548 -1.852 1.00 0.26 C ATOM 344 C6 DT A 11 6.317 -4.659 -2.591 1.00 0.24 C ATOM 0 H5' DT A 11 7.781 -6.850 -6.559 1.00 0.35 H new ATOM 0 H5'' DT A 11 6.471 -7.245 -7.653 1.00 0.35 H new ATOM 0 H4' DT A 11 6.125 -8.428 -5.658 1.00 0.34 H new ATOM 0 H3' DT A 11 4.117 -6.600 -6.549 1.00 0.33 H new ATOM 0 H2' DT A 11 4.066 -5.279 -4.544 1.00 0.29 H new ATOM 0 H2'' DT A 11 3.149 -6.647 -3.945 1.00 0.29 H new ATOM 0 H1' DT A 11 5.021 -7.681 -2.977 1.00 0.29 H new ATOM 0 H3 DT A 11 5.100 -5.510 0.829 1.00 0.32 H new ATOM 0 H71 DT A 11 8.087 -2.719 -2.688 1.00 0.26 H new ATOM 0 H72 DT A 11 6.723 -1.738 -2.101 1.00 0.26 H new ATOM 0 H73 DT A 11 7.985 -2.277 -0.967 1.00 0.26 H new ATOM 0 H6 DT A 11 6.663 -4.426 -3.587 1.00 0.24 H new ATOM 357 P DT A 12 3.836 -9.404 -6.862 1.00 0.51 P ATOM 358 OP1 DT A 12 5.261 -9.614 -7.204 1.00 0.87 O ATOM 359 OP2 DT A 12 2.888 -8.939 -7.898 1.00 0.80 O ATOM 360 O5' DT A 12 3.265 -10.773 -6.231 1.00 0.33 O ATOM 361 C5' DT A 12 2.628 -10.785 -4.943 1.00 0.28 C ATOM 362 C4' DT A 12 1.104 -10.753 -5.058 1.00 0.28 C ATOM 363 O4' DT A 12 0.526 -10.801 -3.750 1.00 0.32 O ATOM 364 C3' DT A 12 0.551 -9.505 -5.729 1.00 0.28 C ATOM 365 O3' DT A 12 -0.703 -9.817 -6.354 1.00 0.37 O ATOM 366 C2' DT A 12 0.331 -8.557 -4.561 1.00 0.26 C ATOM 367 C1' DT A 12 -0.016 -9.512 -3.413 1.00 0.26 C ATOM 368 N1 DT A 12 0.526 -9.128 -2.082 1.00 0.25 N ATOM 369 C2 DT A 12 0.592 -10.113 -1.101 1.00 0.34 C ATOM 370 O2 DT A 12 0.278 -11.285 -1.307 1.00 0.40 O ATOM 371 N3 DT A 12 1.024 -9.701 0.143 1.00 0.38 N ATOM 372 C4 DT A 12 1.388 -8.419 0.500 1.00 0.34 C ATOM 373 O4 DT A 12 1.744 -8.167 1.649 1.00 0.43 O ATOM 374 C5 DT A 12 1.290 -7.463 -0.579 1.00 0.25 C ATOM 375 C7 DT A 12 1.601 -5.995 -0.320 1.00 0.24 C ATOM 376 C6 DT A 12 0.880 -7.832 -1.804 1.00 0.22 C ATOM 0 H5' DT A 12 2.966 -9.926 -4.363 1.00 0.28 H new ATOM 0 H5'' DT A 12 2.932 -11.678 -4.397 1.00 0.28 H new ATOM 0 H4' DT A 12 0.846 -11.614 -5.674 1.00 0.28 H new ATOM 0 H3' DT A 12 1.203 -9.093 -6.499 1.00 0.28 H new ATOM 0 H2' DT A 12 1.223 -7.969 -4.343 1.00 0.26 H new ATOM 0 H2'' DT A 12 -0.476 -7.851 -4.759 1.00 0.26 H new ATOM 0 H1' DT A 12 -1.101 -9.495 -3.314 1.00 0.26 H new ATOM 0 H3 DT A 12 1.080 -10.414 0.870 1.00 0.38 H new ATOM 0 H71 DT A 12 1.356 -5.748 0.713 1.00 0.24 H new ATOM 0 H72 DT A 12 2.661 -5.811 -0.496 1.00 0.24 H new ATOM 0 H73 DT A 12 1.009 -5.374 -0.992 1.00 0.24 H new ATOM 0 H6 DT A 12 0.828 -7.091 -2.588 1.00 0.22 H new ATOM 389 P DG A 13 -1.359 -8.817 -7.435 1.00 0.45 P ATOM 390 OP1 DG A 13 -2.579 -9.461 -7.974 1.00 0.61 O ATOM 391 OP2 DG A 13 -0.295 -8.366 -8.360 1.00 0.54 O ATOM 392 O5' DG A 13 -1.810 -7.563 -6.535 1.00 0.37 O ATOM 393 C5' DG A 13 -3.001 -7.614 -5.746 1.00 0.35 C ATOM 394 C4' DG A 13 -3.223 -6.300 -5.012 1.00 0.27 C ATOM 395 O4' DG A 13 -2.154 -6.083 -4.103 1.00 0.26 O ATOM 396 C3' DG A 13 -3.270 -5.092 -5.934 1.00 0.25 C ATOM 397 O3' DG A 13 -4.633 -4.811 -6.255 1.00 0.32 O ATOM 398 C2' DG A 13 -2.697 -3.949 -5.081 1.00 0.22 C ATOM 399 C1' DG A 13 -1.915 -4.680 -3.977 1.00 0.20 C ATOM 400 N9 DG A 13 -0.462 -4.485 -4.046 1.00 0.18 N ATOM 401 C8 DG A 13 0.408 -4.787 -5.059 1.00 0.21 C ATOM 402 N7 DG A 13 1.652 -4.530 -4.775 1.00 0.22 N ATOM 403 C5 DG A 13 1.597 -4.020 -3.482 1.00 0.18 C ATOM 404 C6 DG A 13 2.638 -3.567 -2.639 1.00 0.20 C ATOM 405 O6 DG A 13 3.838 -3.517 -2.876 1.00 0.23 O ATOM 406 N1 DG A 13 2.164 -3.137 -1.409 1.00 0.19 N ATOM 407 C2 DG A 13 0.800 -3.139 -1.030 1.00 0.17 C ATOM 408 N2 DG A 13 0.405 -2.708 0.202 1.00 0.20 N ATOM 409 N3 DG A 13 -0.159 -3.570 -1.847 1.00 0.16 N ATOM 410 C4 DG A 13 0.307 -3.990 -3.036 1.00 0.16 C ATOM 0 H5' DG A 13 -2.931 -8.430 -5.026 1.00 0.35 H new ATOM 0 H5'' DG A 13 -3.857 -7.827 -6.386 1.00 0.35 H new ATOM 0 H4' DG A 13 -4.188 -6.393 -4.513 1.00 0.27 H new ATOM 0 H3' DG A 13 -2.723 -5.237 -6.865 1.00 0.25 H new ATOM 0 H2' DG A 13 -2.049 -3.297 -5.667 1.00 0.22 H new ATOM 0 H2'' DG A 13 -3.487 -3.323 -4.666 1.00 0.22 H new ATOM 0 H1' DG A 13 -2.263 -4.266 -3.031 1.00 0.20 H new ATOM 0 H8 DG A 13 0.092 -5.200 -6.005 1.00 0.21 H new ATOM 0 H1 DG A 13 2.845 -2.796 -0.731 1.00 0.19 H new ATOM 0 H21 DG A 13 -0.584 -2.718 0.453 1.00 0.20 H new ATOM 0 H22 DG A 13 1.098 -2.375 0.872 1.00 0.20 H new ATOM 422 P DG A 14 -5.009 -3.849 -7.488 1.00 0.30 P ATOM 423 OP1 DG A 14 -5.036 -4.672 -8.719 1.00 0.43 O ATOM 424 OP2 DG A 14 -4.149 -2.646 -7.427 1.00 0.34 O ATOM 425 O5' DG A 14 -6.522 -3.412 -7.142 1.00 0.30 O ATOM 426 C5' DG A 14 -6.983 -3.374 -5.784 1.00 0.27 C ATOM 427 C4' DG A 14 -6.852 -1.988 -5.161 1.00 0.19 C ATOM 428 O4' DG A 14 -6.007 -2.047 -4.025 1.00 0.18 O ATOM 429 C3' DG A 14 -6.259 -0.891 -6.078 1.00 0.20 C ATOM 430 O3' DG A 14 -7.237 0.161 -6.200 1.00 0.29 O ATOM 431 C2' DG A 14 -5.031 -0.408 -5.290 1.00 0.18 C ATOM 432 C1' DG A 14 -5.506 -0.743 -3.906 1.00 0.14 C ATOM 433 N9 DG A 14 -4.550 -0.709 -2.808 1.00 0.14 N ATOM 434 C8 DG A 14 -4.867 -0.723 -1.494 1.00 0.15 C ATOM 435 N7 DG A 14 -3.847 -0.642 -0.706 1.00 0.16 N ATOM 436 C5 DG A 14 -2.765 -0.565 -1.562 1.00 0.14 C ATOM 437 C6 DG A 14 -1.399 -0.455 -1.251 1.00 0.14 C ATOM 438 O6 DG A 14 -0.888 -0.429 -0.131 1.00 0.16 O ATOM 439 N1 DG A 14 -0.610 -0.394 -2.390 1.00 0.14 N ATOM 440 C2 DG A 14 -1.113 -0.450 -3.720 1.00 0.14 C ATOM 441 N2 DG A 14 -0.274 -0.422 -4.798 1.00 0.17 N ATOM 442 N3 DG A 14 -2.420 -0.556 -3.981 1.00 0.14 N ATOM 443 C4 DG A 14 -3.179 -0.606 -2.866 1.00 0.13 C ATOM 0 H5' DG A 14 -6.415 -4.091 -5.191 1.00 0.27 H new ATOM 0 H5'' DG A 14 -8.026 -3.687 -5.749 1.00 0.27 H new ATOM 0 H4' DG A 14 -7.881 -1.710 -4.932 1.00 0.19 H new ATOM 0 H3' DG A 14 -6.000 -1.222 -7.084 1.00 0.20 H new ATOM 0 H2' DG A 14 -4.118 -0.937 -5.563 1.00 0.18 H new ATOM 0 H2'' DG A 14 -4.835 0.656 -5.424 1.00 0.18 H new ATOM 0 H1' DG A 14 -6.209 0.038 -3.617 1.00 0.14 H new ATOM 0 H8 DG A 14 -5.883 -0.795 -1.135 1.00 0.15 H new ATOM 0 H1 DG A 14 0.398 -0.303 -2.266 1.00 0.14 H new ATOM 0 H21 DG A 14 -0.656 -0.463 -5.743 1.00 0.17 H new ATOM 0 H22 DG A 14 0.734 -0.360 -4.658 1.00 0.17 H new ATOM 455 P DG A 15 -6.840 1.659 -6.650 1.00 0.29 P ATOM 456 OP1 DG A 15 -8.069 2.350 -7.105 1.00 0.41 O ATOM 457 OP2 DG A 15 -5.671 1.580 -7.552 1.00 0.40 O ATOM 458 O5' DG A 15 -6.360 2.333 -5.265 1.00 0.37 O ATOM 459 C5' DG A 15 -6.980 3.530 -4.783 1.00 0.27 C ATOM 460 C4' DG A 15 -7.960 3.252 -3.643 1.00 0.20 C ATOM 461 O4' DG A 15 -7.359 2.400 -2.660 1.00 0.21 O ATOM 462 C3' DG A 15 -8.383 4.495 -2.893 1.00 0.18 C ATOM 463 O3' DG A 15 -9.618 4.237 -2.187 1.00 0.24 O ATOM 464 C2' DG A 15 -7.222 4.671 -1.917 1.00 0.19 C ATOM 465 C1' DG A 15 -6.817 3.227 -1.620 1.00 0.18 C ATOM 466 N9 DG A 15 -5.387 2.984 -1.573 1.00 0.16 N ATOM 467 C8 DG A 15 -4.483 2.900 -2.579 1.00 0.15 C ATOM 468 N7 DG A 15 -3.262 2.680 -2.166 1.00 0.15 N ATOM 469 C5 DG A 15 -3.401 2.615 -0.777 1.00 0.15 C ATOM 470 C6 DG A 15 -2.437 2.404 0.237 1.00 0.15 C ATOM 471 O6 DG A 15 -1.237 2.246 0.116 1.00 0.16 O ATOM 472 N1 DG A 15 -2.997 2.409 1.502 1.00 0.15 N ATOM 473 C2 DG A 15 -4.376 2.601 1.763 1.00 0.15 C ATOM 474 N2 DG A 15 -4.878 2.561 3.019 1.00 0.18 N ATOM 475 N3 DG A 15 -5.252 2.801 0.795 1.00 0.16 N ATOM 476 C4 DG A 15 -4.699 2.796 -0.427 1.00 0.15 C ATOM 0 H5' DG A 15 -7.507 4.020 -5.602 1.00 0.27 H new ATOM 0 H5'' DG A 15 -6.212 4.222 -4.439 1.00 0.27 H new ATOM 0 H4' DG A 15 -8.825 2.798 -4.127 1.00 0.20 H new ATOM 0 H3' DG A 15 -8.567 5.370 -3.517 1.00 0.18 H new ATOM 0 H2' DG A 15 -6.403 5.239 -2.359 1.00 0.19 H new ATOM 0 H2'' DG A 15 -7.527 5.201 -1.015 1.00 0.19 H new ATOM 0 H1' DG A 15 -7.202 3.002 -0.625 1.00 0.18 H new ATOM 0 H8 DG A 15 -4.746 3.005 -3.621 1.00 0.15 H new ATOM 0 H1 DG A 15 -2.377 2.265 2.299 1.00 0.15 H new ATOM 0 H21 DG A 15 -5.876 2.703 3.174 1.00 0.18 H new ATOM 0 H22 DG A 15 -4.258 2.389 3.811 1.00 0.18 H new ATOM 488 P DT A 16 -11.049 4.325 -2.946 1.00 0.28 P ATOM 489 OP1 DT A 16 -10.829 4.075 -4.388 1.00 0.34 O ATOM 490 OP2 DT A 16 -11.729 5.568 -2.512 1.00 0.39 O ATOM 491 O5' DT A 16 -11.875 3.070 -2.348 1.00 0.26 O ATOM 492 C5' DT A 16 -11.559 1.742 -2.773 1.00 0.23 C ATOM 493 C4' DT A 16 -12.693 0.754 -2.560 1.00 0.22 C ATOM 494 O4' DT A 16 -13.826 1.155 -3.337 1.00 0.22 O ATOM 495 C3' DT A 16 -12.310 -0.671 -2.971 1.00 0.24 C ATOM 496 O3' DT A 16 -12.192 -1.501 -1.805 1.00 0.29 O ATOM 497 C2' DT A 16 -13.465 -1.149 -3.839 1.00 0.28 C ATOM 498 C1' DT A 16 -14.157 0.135 -4.279 1.00 0.24 C ATOM 499 N1 DT A 16 -13.768 0.616 -5.626 1.00 0.28 N ATOM 500 C2 DT A 16 -14.780 1.055 -6.459 1.00 0.39 C ATOM 501 O2 DT A 16 -15.958 1.062 -6.116 1.00 0.46 O ATOM 502 N3 DT A 16 -14.389 1.489 -7.709 1.00 0.49 N ATOM 503 C4 DT A 16 -13.100 1.522 -8.197 1.00 0.49 C ATOM 504 O4 DT A 16 -12.875 1.922 -9.337 1.00 0.60 O ATOM 505 C5 DT A 16 -12.107 1.046 -7.260 1.00 0.39 C ATOM 506 C7 DT A 16 -10.635 1.025 -7.664 1.00 0.46 C ATOM 507 C6 DT A 16 -12.461 0.619 -6.033 1.00 0.30 C ATOM 0 H5' DT A 16 -10.679 1.395 -2.232 1.00 0.23 H new ATOM 0 H5'' DT A 16 -11.297 1.760 -3.831 1.00 0.23 H new ATOM 0 H4' DT A 16 -12.922 0.754 -1.494 1.00 0.22 H new ATOM 0 H3' DT A 16 -11.356 -0.710 -3.496 1.00 0.24 H new ATOM 0 H2' DT A 16 -13.109 -1.723 -4.695 1.00 0.28 H new ATOM 0 H2'' DT A 16 -14.142 -1.795 -3.281 1.00 0.28 H new ATOM 0 H1' DT A 16 -15.223 -0.086 -4.324 1.00 0.24 H new ATOM 0 H3 DT A 16 -15.126 1.818 -8.333 1.00 0.49 H new ATOM 0 H71 DT A 16 -10.013 1.167 -6.780 1.00 0.46 H new ATOM 0 H72 DT A 16 -10.398 0.066 -8.125 1.00 0.46 H new ATOM 0 H73 DT A 16 -10.442 1.827 -8.376 1.00 0.46 H new ATOM 0 H6 DT A 16 -11.696 0.271 -5.354 1.00 0.30 H new ATOM 520 P DT A 17 -11.763 -3.059 -1.922 1.00 0.29 P ATOM 521 OP1 DT A 17 -12.584 -3.690 -2.979 1.00 0.37 O ATOM 522 OP2 DT A 17 -11.764 -3.631 -0.558 1.00 0.39 O ATOM 523 O5' DT A 17 -10.233 -3.009 -2.443 1.00 0.23 O ATOM 524 C5' DT A 17 -9.530 -4.217 -2.808 1.00 0.22 C ATOM 525 C4' DT A 17 -8.605 -4.722 -1.701 1.00 0.21 C ATOM 526 O4' DT A 17 -7.453 -3.873 -1.615 1.00 0.18 O ATOM 527 C3' DT A 17 -9.241 -4.778 -0.312 1.00 0.23 C ATOM 528 O3' DT A 17 -9.446 -6.154 0.063 1.00 0.27 O ATOM 529 C2' DT A 17 -8.197 -4.148 0.588 1.00 0.21 C ATOM 530 C1' DT A 17 -7.438 -3.237 -0.340 1.00 0.18 C ATOM 531 N1 DT A 17 -7.997 -1.892 -0.510 1.00 0.17 N ATOM 532 C2 DT A 17 -8.230 -1.116 0.611 1.00 0.19 C ATOM 533 O2 DT A 17 -7.988 -1.507 1.749 1.00 0.24 O ATOM 534 N3 DT A 17 -8.723 0.148 0.370 1.00 0.21 N ATOM 535 C4 DT A 17 -8.994 0.691 -0.874 1.00 0.19 C ATOM 536 O4 DT A 17 -9.435 1.832 -0.971 1.00 0.23 O ATOM 537 C5 DT A 17 -8.712 -0.204 -1.981 1.00 0.18 C ATOM 538 C7 DT A 17 -8.943 0.250 -3.426 1.00 0.21 C ATOM 539 C6 DT A 17 -8.237 -1.433 -1.755 1.00 0.16 C ATOM 0 H5' DT A 17 -8.944 -4.033 -3.709 1.00 0.22 H new ATOM 0 H5'' DT A 17 -10.255 -4.994 -3.052 1.00 0.22 H new ATOM 0 H4' DT A 17 -8.354 -5.744 -1.983 1.00 0.21 H new ATOM 0 H3' DT A 17 -10.206 -4.274 -0.257 1.00 0.23 H new ATOM 0 H2' DT A 17 -8.655 -3.595 1.408 1.00 0.21 H new ATOM 0 H2'' DT A 17 -7.546 -4.899 1.035 1.00 0.21 H new ATOM 0 H1' DT A 17 -6.450 -3.089 0.095 1.00 0.18 H new ATOM 0 H3 DT A 17 -8.905 0.737 1.182 1.00 0.21 H new ATOM 0 H71 DT A 17 -9.759 0.972 -3.454 1.00 0.21 H new ATOM 0 H72 DT A 17 -8.035 0.713 -3.811 1.00 0.21 H new ATOM 0 H73 DT A 17 -9.200 -0.612 -4.042 1.00 0.21 H new ATOM 0 H6 DT A 17 -8.039 -2.079 -2.597 1.00 0.16 H new ATOM 552 P DT A 18 -10.117 -6.560 1.481 1.00 0.30 P ATOM 553 OP1 DT A 18 -10.376 -8.017 1.466 1.00 0.38 O ATOM 554 OP2 DT A 18 -11.225 -5.617 1.755 1.00 0.41 O ATOM 555 O5' DT A 18 -8.939 -6.271 2.542 1.00 0.28 O ATOM 556 C5' DT A 18 -7.661 -6.903 2.406 1.00 0.22 C ATOM 557 C4' DT A 18 -6.607 -6.241 3.295 1.00 0.18 C ATOM 558 O4' DT A 18 -5.295 -6.641 2.904 1.00 0.18 O ATOM 559 C3' DT A 18 -6.640 -4.717 3.264 1.00 0.17 C ATOM 560 O3' DT A 18 -6.638 -4.224 4.604 1.00 0.20 O ATOM 561 C2' DT A 18 -5.354 -4.304 2.546 1.00 0.15 C ATOM 562 C1' DT A 18 -4.761 -5.639 2.051 1.00 0.16 C ATOM 563 N1 DT A 18 -5.053 -6.020 0.626 1.00 0.17 N ATOM 564 C2 DT A 18 -5.472 -7.326 0.336 1.00 0.20 C ATOM 565 O2 DT A 18 -5.571 -8.208 1.185 1.00 0.23 O ATOM 566 N3 DT A 18 -5.732 -7.600 -0.990 1.00 0.24 N ATOM 567 C4 DT A 18 -5.612 -6.723 -2.047 1.00 0.25 C ATOM 568 O4 DT A 18 -5.881 -7.081 -3.190 1.00 0.31 O ATOM 569 C5 DT A 18 -5.164 -5.405 -1.663 1.00 0.21 C ATOM 570 C7 DT A 18 -5.000 -4.322 -2.726 1.00 0.23 C ATOM 571 C6 DT A 18 -4.904 -5.105 -0.378 1.00 0.18 C ATOM 0 H5' DT A 18 -7.341 -6.857 1.365 1.00 0.22 H new ATOM 0 H5'' DT A 18 -7.747 -7.958 2.667 1.00 0.22 H new ATOM 0 H4' DT A 18 -6.848 -6.571 4.305 1.00 0.18 H new ATOM 0 H3' DT A 18 -7.524 -4.324 2.763 1.00 0.17 H new ATOM 0 H2' DT A 18 -5.559 -3.626 1.717 1.00 0.15 H new ATOM 0 H2'' DT A 18 -4.669 -3.787 3.218 1.00 0.15 H new ATOM 0 H1' DT A 18 -3.677 -5.533 2.081 1.00 0.16 H new ATOM 0 H3 DT A 18 -6.044 -8.546 -1.211 1.00 0.24 H new ATOM 0 H71 DT A 18 -4.737 -4.783 -3.678 1.00 0.23 H new ATOM 0 H72 DT A 18 -5.936 -3.774 -2.835 1.00 0.23 H new ATOM 0 H73 DT A 18 -4.210 -3.634 -2.425 1.00 0.23 H new ATOM 0 H6 DT A 18 -4.567 -4.109 -0.132 1.00 0.18 H new ATOM 584 P DG A 19 -7.813 -4.649 5.626 1.00 0.20 P ATOM 585 OP1 DG A 19 -7.531 -6.018 6.107 1.00 0.39 O ATOM 586 OP2 DG A 19 -9.116 -4.337 4.997 1.00 0.42 O ATOM 587 O5' DG A 19 -7.591 -3.641 6.854 1.00 0.32 O ATOM 588 C5' DG A 19 -6.271 -3.324 7.300 1.00 0.28 C ATOM 589 C4' DG A 19 -6.220 -1.934 7.916 1.00 0.24 C ATOM 590 O4' DG A 19 -4.853 -1.488 7.987 1.00 0.22 O ATOM 591 C3' DG A 19 -6.994 -0.885 7.120 1.00 0.25 C ATOM 592 O3' DG A 19 -7.601 0.039 8.056 1.00 0.33 O ATOM 593 C2' DG A 19 -5.911 -0.276 6.253 1.00 0.21 C ATOM 594 C1' DG A 19 -4.699 -0.324 7.168 1.00 0.19 C ATOM 595 N9 DG A 19 -3.397 -0.411 6.499 1.00 0.16 N ATOM 596 C8 DG A 19 -2.177 -0.438 7.084 1.00 0.16 C ATOM 597 N7 DG A 19 -1.176 -0.520 6.243 1.00 0.16 N ATOM 598 C5 DG A 19 -1.816 -0.543 4.997 1.00 0.15 C ATOM 599 C6 DG A 19 -1.276 -0.622 3.688 1.00 0.15 C ATOM 600 O6 DG A 19 -0.104 -0.697 3.357 1.00 0.19 O ATOM 601 N1 DG A 19 -2.262 -0.618 2.712 1.00 0.15 N ATOM 602 C2 DG A 19 -3.657 -0.542 2.991 1.00 0.16 C ATOM 603 N2 DG A 19 -4.599 -0.512 2.018 1.00 0.16 N ATOM 604 N3 DG A 19 -4.121 -0.466 4.221 1.00 0.16 N ATOM 605 C4 DG A 19 -3.171 -0.473 5.159 1.00 0.15 C ATOM 0 H5' DG A 19 -5.577 -3.379 6.461 1.00 0.28 H new ATOM 0 H5'' DG A 19 -5.944 -4.062 8.033 1.00 0.28 H new ATOM 0 H4' DG A 19 -6.679 -2.027 8.900 1.00 0.24 H new ATOM 0 H3' DG A 19 -7.820 -1.248 6.508 1.00 0.25 H new ATOM 0 H2' DG A 19 -5.753 -0.847 5.338 1.00 0.21 H new ATOM 0 H2'' DG A 19 -6.155 0.743 5.954 1.00 0.21 H new ATOM 0 H1' DG A 19 -4.679 0.619 7.714 1.00 0.19 H new ATOM 0 H8 DG A 19 -2.040 -0.396 8.154 1.00 0.16 H new ATOM 0 H1 DG A 19 -1.971 -0.673 1.736 1.00 0.15 H new ATOM 0 H21 DG A 19 -5.587 -0.457 2.266 1.00 0.16 H new ATOM 0 H22 DG A 19 -4.320 -0.544 1.037 1.00 0.16 H new ATOM 617 P DG A 20 -7.706 1.639 7.851 1.00 0.29 P ATOM 618 OP1 DG A 20 -8.814 2.133 8.695 1.00 0.42 O ATOM 619 OP2 DG A 20 -7.690 1.962 6.408 1.00 0.34 O ATOM 620 O5' DG A 20 -6.335 2.124 8.525 1.00 0.30 O ATOM 621 C5' DG A 20 -5.957 1.568 9.787 1.00 0.35 C ATOM 622 C4' DG A 20 -4.519 1.891 10.150 1.00 0.26 C ATOM 623 O4' DG A 20 -3.646 1.531 9.069 1.00 0.26 O ATOM 624 C3' DG A 20 -4.274 3.357 10.469 1.00 0.25 C ATOM 625 O3' DG A 20 -3.385 3.416 11.596 1.00 0.29 O ATOM 626 C2' DG A 20 -3.632 3.878 9.196 1.00 0.20 C ATOM 627 C1' DG A 20 -2.849 2.661 8.726 1.00 0.19 C ATOM 628 N9 DG A 20 -2.602 2.606 7.274 1.00 0.16 N ATOM 629 C8 DG A 20 -3.517 2.564 6.258 1.00 0.16 C ATOM 630 N7 DG A 20 -2.986 2.534 5.078 1.00 0.16 N ATOM 631 C5 DG A 20 -1.626 2.549 5.313 1.00 0.14 C ATOM 632 C6 DG A 20 -0.564 2.522 4.384 1.00 0.15 C ATOM 633 O6 DG A 20 -0.633 2.485 3.161 1.00 0.18 O ATOM 634 N1 DG A 20 0.669 2.542 5.003 1.00 0.15 N ATOM 635 C2 DG A 20 0.865 2.589 6.407 1.00 0.14 C ATOM 636 N2 DG A 20 2.122 2.602 6.938 1.00 0.18 N ATOM 637 N3 DG A 20 -0.166 2.612 7.270 1.00 0.15 N ATOM 638 C4 DG A 20 -1.370 2.590 6.655 1.00 0.15 C ATOM 0 H5' DG A 20 -6.088 0.486 9.759 1.00 0.35 H new ATOM 0 H5'' DG A 20 -6.620 1.950 10.563 1.00 0.35 H new ATOM 0 H4' DG A 20 -4.314 1.314 11.052 1.00 0.26 H new ATOM 0 H3' DG A 20 -5.157 3.939 10.734 1.00 0.25 H new ATOM 0 H2' DG A 20 -4.374 4.195 8.463 1.00 0.20 H new ATOM 0 H2'' DG A 20 -2.984 4.734 9.385 1.00 0.20 H new ATOM 0 H1' DG A 20 -1.867 2.694 9.198 1.00 0.19 H new ATOM 0 H8 DG A 20 -4.584 2.557 6.425 1.00 0.16 H new ATOM 0 H1 DG A 20 1.498 2.522 4.409 1.00 0.15 H new ATOM 0 H21 DG A 20 2.248 2.636 7.950 1.00 0.18 H new ATOM 0 H22 DG A 20 2.936 2.578 6.323 1.00 0.18 H new ATOM 650 P DG A 21 -2.311 4.593 11.776 1.00 0.32 P ATOM 651 OP1 DG A 21 -1.581 4.364 13.043 1.00 0.43 O ATOM 652 OP2 DG A 21 -2.998 5.883 11.544 1.00 0.37 O ATOM 653 O5' DG A 21 -1.296 4.309 10.553 1.00 0.29 O ATOM 654 C5' DG A 21 -0.281 5.246 10.185 1.00 0.28 C ATOM 655 C4' DG A 21 -0.748 6.231 9.105 1.00 0.25 C ATOM 656 O4' DG A 21 -1.156 5.555 7.914 1.00 0.21 O ATOM 657 C3' DG A 21 -1.939 7.121 9.493 1.00 0.28 C ATOM 658 O3' DG A 21 -1.501 8.398 9.976 1.00 0.35 O ATOM 659 C2' DG A 21 -2.728 7.258 8.180 1.00 0.27 C ATOM 660 C1' DG A 21 -1.823 6.561 7.176 1.00 0.20 C ATOM 661 N9 DG A 21 -2.514 5.993 5.996 1.00 0.17 N ATOM 662 C8 DG A 21 -3.859 5.871 5.754 1.00 0.18 C ATOM 663 N7 DG A 21 -4.152 5.599 4.501 1.00 0.18 N ATOM 664 C5 DG A 21 -2.905 5.522 3.874 1.00 0.15 C ATOM 665 C6 DG A 21 -2.548 5.255 2.506 1.00 0.14 C ATOM 666 O6 DG A 21 -3.256 5.134 1.477 1.00 0.16 O ATOM 667 N1 DG A 21 -1.192 5.247 2.345 1.00 0.14 N ATOM 668 C2 DG A 21 -0.231 5.488 3.355 1.00 0.15 C ATOM 669 N2 DG A 21 1.106 5.437 3.089 1.00 0.17 N ATOM 670 N3 DG A 21 -0.576 5.750 4.604 1.00 0.15 N ATOM 671 C4 DG A 21 -1.907 5.748 4.795 1.00 0.15 C ATOM 0 H5' DG A 21 0.594 4.705 9.824 1.00 0.28 H new ATOM 0 H5'' DG A 21 0.031 5.803 11.068 1.00 0.28 H new ATOM 0 H4' DG A 21 0.134 6.856 8.962 1.00 0.25 H new ATOM 0 H3' DG A 21 -2.536 6.700 10.302 1.00 0.28 H new ATOM 0 H2' DG A 21 -3.706 6.782 8.243 1.00 0.27 H new ATOM 0 H2'' DG A 21 -2.898 8.302 7.916 1.00 0.27 H new ATOM 0 HO3' DG A 21 -2.280 8.943 10.214 1.00 0.35 H new ATOM 0 H1' DG A 21 -1.145 7.292 6.734 1.00 0.20 H new ATOM 0 H8 DG A 21 -4.609 5.988 6.522 1.00 0.18 H new ATOM 0 H1 DG A 21 -0.839 5.049 1.409 1.00 0.14 H new ATOM 0 H21 DG A 21 1.781 5.614 3.833 1.00 0.17 H new ATOM 0 H22 DG A 21 1.431 5.222 2.146 1.00 0.17 H new TER 684 DG A 21