USER MOD reduce.3.24.130724 H: found=0, std=0, add=247, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 247 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 DC O5' : rot 180:sc= 0 USER MOD Single : A 12 DT C7 :methyl -30:sc= 0 (180deg=-0.168) USER MOD Single : A 13 DT C7 :methyl -30:sc= -3.06! (180deg=-4.61!) USER MOD Single : A 22 DT C7 :methyl -30:sc= 0 (180deg=-0.101) USER MOD Single : A 22 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 5.272 15.195 -3.080 1.00 0.30 O ATOM 2 C5' DC A 1 4.390 15.024 -1.968 1.00 0.35 C ATOM 3 C4' DC A 1 5.059 14.249 -0.835 1.00 0.24 C ATOM 4 O4' DC A 1 4.145 14.073 0.272 1.00 0.24 O ATOM 5 C3' DC A 1 5.508 12.867 -1.302 1.00 0.08 C ATOM 6 O3' DC A 1 6.934 12.749 -1.249 1.00 0.09 O ATOM 7 C2' DC A 1 4.856 11.890 -0.363 1.00 0.11 C ATOM 8 C1' DC A 1 4.152 12.698 0.707 1.00 0.11 C ATOM 9 N1 DC A 1 2.776 12.200 0.917 1.00 0.14 N ATOM 10 C2 DC A 1 2.498 11.565 2.118 1.00 0.17 C ATOM 11 O2 DC A 1 3.374 11.454 2.974 1.00 0.16 O ATOM 12 N3 DC A 1 1.244 11.078 2.316 1.00 0.24 N ATOM 13 C4 DC A 1 0.301 11.207 1.376 1.00 0.28 C ATOM 14 N4 DC A 1 -0.912 10.705 1.598 1.00 0.36 N ATOM 15 C5 DC A 1 0.580 11.864 0.137 1.00 0.25 C ATOM 16 C6 DC A 1 1.824 12.343 -0.051 1.00 0.17 C ATOM 0 H5' DC A 1 3.493 14.495 -2.292 1.00 0.35 H new ATOM 0 H5'' DC A 1 4.070 16.000 -1.603 1.00 0.35 H new ATOM 0 H4' DC A 1 5.926 14.830 -0.519 1.00 0.24 H new ATOM 0 H3' DC A 1 5.221 12.682 -2.337 1.00 0.08 H new ATOM 0 H2' DC A 1 4.146 11.258 -0.897 1.00 0.11 H new ATOM 0 H2'' DC A 1 5.600 11.229 0.081 1.00 0.11 H new ATOM 0 HO5' DC A 1 4.813 15.693 -3.788 1.00 0.30 H new ATOM 0 H1' DC A 1 4.671 12.607 1.661 1.00 0.11 H new ATOM 0 H41 DC A 1 -1.640 10.797 0.889 1.00 0.36 H new ATOM 0 H42 DC A 1 -1.114 10.228 2.477 1.00 0.36 H new ATOM 0 H5 DC A 1 -0.181 11.972 -0.622 1.00 0.25 H new ATOM 0 H6 DC A 1 2.071 12.844 -0.975 1.00 0.17 H new ATOM 29 P DG A 2 7.656 11.375 -1.675 1.00 0.12 P ATOM 30 OP1 DG A 2 9.116 11.615 -1.726 1.00 0.24 O ATOM 31 OP2 DG A 2 6.957 10.833 -2.862 1.00 0.26 O ATOM 32 O5' DG A 2 7.347 10.410 -0.424 1.00 0.09 O ATOM 33 C5' DG A 2 8.036 10.590 0.821 1.00 0.07 C ATOM 34 C4' DG A 2 7.656 9.537 1.853 1.00 0.09 C ATOM 35 O4' DG A 2 6.233 9.568 2.117 1.00 0.13 O ATOM 36 C3' DG A 2 8.013 8.129 1.364 1.00 0.09 C ATOM 37 O3' DG A 2 9.022 7.487 2.182 1.00 0.05 O ATOM 38 C2' DG A 2 6.724 7.353 1.395 1.00 0.14 C ATOM 39 C1' DG A 2 5.689 8.231 2.067 1.00 0.15 C ATOM 40 N9 DG A 2 4.414 8.204 1.322 1.00 0.19 N ATOM 41 C8 DG A 2 4.166 8.516 0.026 1.00 0.28 C ATOM 42 N7 DG A 2 2.951 8.408 -0.396 1.00 0.25 N ATOM 43 C5 DG A 2 2.286 7.970 0.754 1.00 0.14 C ATOM 44 C6 DG A 2 0.911 7.664 0.949 1.00 0.12 C ATOM 45 O6 DG A 2 -0.007 7.727 0.134 1.00 0.16 O ATOM 46 N1 DG A 2 0.657 7.258 2.252 1.00 0.18 N ATOM 47 C2 DG A 2 1.605 7.158 3.252 1.00 0.19 C ATOM 48 N2 DG A 2 1.161 6.760 4.442 1.00 0.34 N ATOM 49 N3 DG A 2 2.903 7.443 3.078 1.00 0.11 N ATOM 50 C4 DG A 2 3.175 7.841 1.812 1.00 0.11 C ATOM 0 H5' DG A 2 7.812 11.580 1.217 1.00 0.07 H new ATOM 0 H5'' DG A 2 9.111 10.552 0.647 1.00 0.07 H new ATOM 0 H4' DG A 2 8.214 9.766 2.761 1.00 0.09 H new ATOM 0 H3' DG A 2 8.447 8.173 0.365 1.00 0.09 H new ATOM 0 H2' DG A 2 6.409 7.090 0.385 1.00 0.14 H new ATOM 0 H2'' DG A 2 6.850 6.419 1.943 1.00 0.14 H new ATOM 0 H1' DG A 2 5.472 7.870 3.073 1.00 0.15 H new ATOM 0 H8 DG A 2 4.958 8.844 -0.631 1.00 0.28 H new ATOM 0 H1 DG A 2 -0.305 7.015 2.490 1.00 0.18 H new ATOM 0 H21 DG A 2 1.810 6.666 5.223 1.00 0.34 H new ATOM 0 H22 DG A 2 0.172 6.549 4.573 1.00 0.34 H new ATOM 62 P DG A 3 9.316 7.898 3.722 1.00 0.00 P ATOM 63 OP1 DG A 3 8.283 8.858 4.167 1.00 0.00 O ATOM 64 OP2 DG A 3 10.748 8.254 3.837 1.00 0.00 O ATOM 65 O5' DG A 3 9.080 6.517 4.518 1.00 0.00 O ATOM 66 C5' DG A 3 7.751 6.119 4.873 1.00 0.00 C ATOM 67 C4' DG A 3 7.711 4.975 5.876 1.00 0.00 C ATOM 68 O4' DG A 3 6.349 4.545 6.061 1.00 0.00 O ATOM 69 C3' DG A 3 8.518 3.770 5.395 1.00 0.00 C ATOM 70 O3' DG A 3 9.411 3.319 6.424 1.00 0.00 O ATOM 71 C2' DG A 3 7.497 2.711 5.065 1.00 0.00 C ATOM 72 C1' DG A 3 6.134 3.289 5.386 1.00 0.00 C ATOM 73 N9 DG A 3 5.335 3.478 4.157 1.00 0.00 N ATOM 74 C8 DG A 3 5.717 3.858 2.908 1.00 0.00 C ATOM 75 N7 DG A 3 4.806 3.913 1.996 1.00 0.00 N ATOM 76 C5 DG A 3 3.668 3.524 2.707 1.00 0.00 C ATOM 77 C6 DG A 3 2.326 3.381 2.267 1.00 0.00 C ATOM 78 O6 DG A 3 1.870 3.570 1.141 1.00 0.00 O ATOM 79 N1 DG A 3 1.493 2.971 3.302 1.00 0.00 N ATOM 80 C2 DG A 3 1.900 2.728 4.601 1.00 0.00 C ATOM 81 N2 DG A 3 0.956 2.349 5.459 1.00 0.00 N ATOM 82 N3 DG A 3 3.159 2.860 5.019 1.00 0.00 N ATOM 83 C4 DG A 3 3.986 3.258 4.030 1.00 0.00 C ATOM 0 H5' DG A 3 7.216 5.821 3.971 1.00 0.00 H new ATOM 0 H5'' DG A 3 7.222 6.976 5.289 1.00 0.00 H new ATOM 0 H4' DG A 3 8.142 5.344 6.807 1.00 0.00 H new ATOM 0 H3' DG A 3 9.137 4.012 4.531 1.00 0.00 H new ATOM 0 H2' DG A 3 7.559 2.431 4.013 1.00 0.00 H new ATOM 0 H2'' DG A 3 7.678 1.807 5.646 1.00 0.00 H new ATOM 0 H1' DG A 3 5.572 2.606 6.023 1.00 0.00 H new ATOM 0 H8 DG A 3 6.745 4.105 2.688 1.00 0.00 H new ATOM 0 H1 DG A 3 0.505 2.839 3.086 1.00 0.00 H new ATOM 0 H21 DG A 3 1.198 2.156 6.431 1.00 0.00 H new ATOM 0 H22 DG A 3 -0.009 2.252 5.145 1.00 0.00 H new ATOM 95 P DG A 4 10.021 1.826 6.400 1.00 0.00 P ATOM 96 OP1 DG A 4 10.993 1.703 7.509 1.00 0.00 O ATOM 97 OP2 DG A 4 10.439 1.519 5.013 1.00 0.00 O ATOM 98 O5' DG A 4 8.734 0.917 6.752 1.00 0.00 O ATOM 99 C5' DG A 4 8.148 0.963 8.062 1.00 0.00 C ATOM 100 C4' DG A 4 6.863 0.147 8.166 1.00 0.00 C ATOM 101 O4' DG A 4 5.869 0.607 7.223 1.00 0.00 O ATOM 102 C3' DG A 4 7.112 -1.332 7.886 1.00 0.00 C ATOM 103 O3' DG A 4 7.094 -2.090 9.103 1.00 0.00 O ATOM 104 C2' DG A 4 6.000 -1.755 6.957 1.00 0.00 C ATOM 105 C1' DG A 4 5.159 -0.527 6.678 1.00 0.00 C ATOM 106 N9 DG A 4 4.928 -0.368 5.230 1.00 0.00 N ATOM 107 C8 DG A 4 5.809 -0.072 4.245 1.00 0.00 C ATOM 108 N7 DG A 4 5.356 0.010 3.041 1.00 0.00 N ATOM 109 C5 DG A 4 3.999 -0.264 3.226 1.00 0.00 C ATOM 110 C6 DG A 4 2.949 -0.327 2.272 1.00 0.00 C ATOM 111 O6 DG A 4 3.011 -0.146 1.058 1.00 0.00 O ATOM 112 N1 DG A 4 1.734 -0.633 2.871 1.00 0.00 N ATOM 113 C2 DG A 4 1.543 -0.853 4.220 1.00 0.00 C ATOM 114 N2 DG A 4 0.294 -1.140 4.597 1.00 0.00 N ATOM 115 N3 DG A 4 2.528 -0.795 5.127 1.00 0.00 N ATOM 116 C4 DG A 4 3.725 -0.498 4.565 1.00 0.00 C ATOM 0 H5' DG A 4 7.936 2.000 8.324 1.00 0.00 H new ATOM 0 H5'' DG A 4 8.869 0.591 8.790 1.00 0.00 H new ATOM 0 H4' DG A 4 6.504 0.278 9.187 1.00 0.00 H new ATOM 0 H3' DG A 4 8.091 -1.504 7.439 1.00 0.00 H new ATOM 0 H2' DG A 4 6.406 -2.162 6.031 1.00 0.00 H new ATOM 0 H2'' DG A 4 5.396 -2.540 7.412 1.00 0.00 H new ATOM 0 H1' DG A 4 4.177 -0.617 7.142 1.00 0.00 H new ATOM 0 H8 DG A 4 6.855 0.090 4.461 1.00 0.00 H new ATOM 0 H1 DG A 4 0.916 -0.701 2.265 1.00 0.00 H new ATOM 0 H21 DG A 4 0.085 -1.313 5.580 1.00 0.00 H new ATOM 0 H22 DG A 4 -0.451 -1.186 3.902 1.00 0.00 H new ATOM 128 P DG A 5 6.906 -3.689 9.074 1.00 0.00 P ATOM 129 OP1 DG A 5 6.971 -4.191 10.464 1.00 0.00 O ATOM 130 OP2 DG A 5 7.810 -4.245 8.043 1.00 0.00 O ATOM 131 O5' DG A 5 5.391 -3.839 8.551 1.00 0.00 O ATOM 132 C5' DG A 5 4.766 -5.126 8.474 1.00 0.00 C ATOM 133 C4' DG A 5 3.252 -5.040 8.615 1.00 0.00 C ATOM 134 O4' DG A 5 2.681 -4.201 7.582 1.00 0.00 O ATOM 135 C3' DG A 5 2.615 -6.420 8.503 1.00 0.00 C ATOM 136 O3' DG A 5 1.688 -6.656 9.579 1.00 0.00 O ATOM 137 C2' DG A 5 1.914 -6.427 7.174 1.00 0.00 C ATOM 138 C1' DG A 5 1.855 -4.992 6.697 1.00 0.00 C ATOM 139 N9 DG A 5 2.326 -4.867 5.304 1.00 0.00 N ATOM 140 C8 DG A 5 3.587 -4.693 4.841 1.00 0.00 C ATOM 141 N7 DG A 5 3.743 -4.522 3.573 1.00 0.00 N ATOM 142 C5 DG A 5 2.427 -4.589 3.111 1.00 0.00 C ATOM 143 C6 DG A 5 1.923 -4.474 1.788 1.00 0.00 C ATOM 144 O6 DG A 5 2.550 -4.275 0.749 1.00 0.00 O ATOM 145 N1 DG A 5 0.541 -4.605 1.756 1.00 0.00 N ATOM 146 C2 DG A 5 -0.263 -4.820 2.856 1.00 0.00 C ATOM 147 N2 DG A 5 -1.570 -4.937 2.613 1.00 0.00 N ATOM 148 N3 DG A 5 0.202 -4.926 4.108 1.00 0.00 N ATOM 149 C4 DG A 5 1.549 -4.802 4.165 1.00 0.00 C ATOM 0 H5' DG A 5 5.166 -5.770 9.257 1.00 0.00 H new ATOM 0 H5'' DG A 5 5.014 -5.592 7.521 1.00 0.00 H new ATOM 0 H4' DG A 5 3.049 -4.613 9.597 1.00 0.00 H new ATOM 0 H3' DG A 5 3.360 -7.213 8.571 1.00 0.00 H new ATOM 0 H2' DG A 5 2.451 -7.049 6.458 1.00 0.00 H new ATOM 0 H2'' DG A 5 0.911 -6.843 7.269 1.00 0.00 H new ATOM 0 H1' DG A 5 0.823 -4.641 6.716 1.00 0.00 H new ATOM 0 H8 DG A 5 4.433 -4.697 5.512 1.00 0.00 H new ATOM 0 H1 DG A 5 0.084 -4.537 0.847 1.00 0.00 H new ATOM 0 H21 DG A 5 -2.220 -5.097 3.383 1.00 0.00 H new ATOM 0 H22 DG A 5 -1.919 -4.866 1.657 1.00 0.00 H new ATOM 161 P DC A 6 0.719 -5.488 10.134 1.00 0.07 P ATOM 162 OP1 DC A 6 0.086 -5.976 11.383 1.00 0.20 O ATOM 163 OP2 DC A 6 -0.123 -5.008 9.016 1.00 0.12 O ATOM 164 O5' DC A 6 1.763 -4.319 10.522 1.00 0.12 O ATOM 165 C5' DC A 6 1.343 -2.973 10.804 1.00 0.11 C ATOM 166 C4' DC A 6 -0.177 -2.791 10.739 1.00 0.10 C ATOM 167 O4' DC A 6 -0.852 -3.822 11.491 1.00 0.13 O ATOM 168 C3' DC A 6 -0.589 -1.437 11.312 1.00 0.09 C ATOM 169 O3' DC A 6 -1.383 -0.706 10.368 1.00 0.05 O ATOM 170 C2' DC A 6 -1.387 -1.749 12.552 1.00 0.11 C ATOM 171 C1' DC A 6 -1.589 -3.254 12.592 1.00 0.12 C ATOM 172 N1 DC A 6 -1.126 -3.844 13.871 1.00 0.10 N ATOM 173 C2 DC A 6 -2.008 -4.675 14.549 1.00 0.16 C ATOM 174 O2 DC A 6 -3.143 -4.855 14.113 1.00 0.15 O ATOM 175 N3 DC A 6 -1.581 -5.277 15.693 1.00 0.25 N ATOM 176 C4 DC A 6 -0.342 -5.073 16.156 1.00 0.26 C ATOM 177 N4 DC A 6 0.052 -5.697 17.264 1.00 0.40 N ATOM 178 C5 DC A 6 0.569 -4.214 15.467 1.00 0.18 C ATOM 179 C6 DC A 6 0.139 -3.623 14.337 1.00 0.11 C ATOM 0 H5' DC A 6 1.815 -2.295 10.093 1.00 0.11 H new ATOM 0 H5'' DC A 6 1.695 -2.689 11.796 1.00 0.11 H new ATOM 0 H4' DC A 6 -0.462 -2.851 9.689 1.00 0.10 H new ATOM 0 H3' DC A 6 0.277 -0.815 11.537 1.00 0.09 H new ATOM 0 H2' DC A 6 -0.861 -1.408 13.444 1.00 0.11 H new ATOM 0 H2'' DC A 6 -2.347 -1.233 12.531 1.00 0.11 H new ATOM 0 H1' DC A 6 -2.653 -3.475 12.511 1.00 0.12 H new ATOM 0 H41 DC A 6 0.994 -5.549 17.625 1.00 0.40 H new ATOM 0 H42 DC A 6 -0.588 -6.324 17.752 1.00 0.40 H new ATOM 0 H5 DC A 6 1.568 -4.045 15.840 1.00 0.18 H new ATOM 0 H6 DC A 6 0.801 -2.967 13.792 1.00 0.11 H new ATOM 191 P DG A 7 -1.104 0.858 10.092 1.00 0.00 P ATOM 192 OP1 DG A 7 0.156 0.975 9.323 1.00 0.00 O ATOM 193 OP2 DG A 7 -1.258 1.590 11.369 1.00 0.00 O ATOM 194 O5' DG A 7 -2.325 1.273 9.126 1.00 0.00 O ATOM 195 C5' DG A 7 -3.626 1.538 9.669 1.00 0.00 C ATOM 196 C4' DG A 7 -4.743 1.182 8.697 1.00 0.00 C ATOM 197 O4' DG A 7 -4.676 2.007 7.510 1.00 0.00 O ATOM 198 C3' DG A 7 -4.646 -0.278 8.269 1.00 0.00 C ATOM 199 O3' DG A 7 -5.830 -0.994 8.636 1.00 0.00 O ATOM 200 C2' DG A 7 -4.472 -0.251 6.774 1.00 0.00 C ATOM 201 C1' DG A 7 -4.659 1.182 6.326 1.00 0.00 C ATOM 202 N9 DG A 7 -3.572 1.590 5.419 1.00 0.00 N ATOM 203 C8 DG A 7 -2.263 1.804 5.688 1.00 0.00 C ATOM 204 N7 DG A 7 -1.501 2.153 4.709 1.00 0.00 N ATOM 205 C5 DG A 7 -2.399 2.181 3.641 1.00 0.00 C ATOM 206 C6 DG A 7 -2.172 2.496 2.277 1.00 0.00 C ATOM 207 O6 DG A 7 -1.117 2.817 1.735 1.00 0.00 O ATOM 208 N1 DG A 7 -3.341 2.405 1.532 1.00 0.00 N ATOM 209 C2 DG A 7 -4.578 2.053 2.035 1.00 0.00 C ATOM 210 N2 DG A 7 -5.583 2.022 1.161 1.00 0.00 N ATOM 211 N3 DG A 7 -4.799 1.754 3.321 1.00 0.00 N ATOM 212 C4 DG A 7 -3.673 1.837 4.066 1.00 0.00 C ATOM 0 H5' DG A 7 -3.699 2.593 9.932 1.00 0.00 H new ATOM 0 H5'' DG A 7 -3.755 0.970 10.590 1.00 0.00 H new ATOM 0 H4' DG A 7 -5.687 1.354 9.215 1.00 0.00 H new ATOM 0 H3' DG A 7 -3.815 -0.787 8.758 1.00 0.00 H new ATOM 0 H2' DG A 7 -3.483 -0.615 6.495 1.00 0.00 H new ATOM 0 H2'' DG A 7 -5.199 -0.903 6.290 1.00 0.00 H new ATOM 0 H1' DG A 7 -5.593 1.290 5.775 1.00 0.00 H new ATOM 0 H8 DG A 7 -1.871 1.686 6.687 1.00 0.00 H new ATOM 0 H1 DG A 7 -3.281 2.615 0.536 1.00 0.00 H new ATOM 0 H21 DG A 7 -6.521 1.769 1.471 1.00 0.00 H new ATOM 0 H22 DG A 7 -5.414 2.251 0.181 1.00 0.00 H new ATOM 224 P DG A 8 -6.021 -2.533 8.206 1.00 0.00 P ATOM 225 OP1 DG A 8 -7.234 -3.054 8.874 1.00 0.00 O ATOM 226 OP2 DG A 8 -4.726 -3.228 8.380 1.00 0.00 O ATOM 227 O5' DG A 8 -6.324 -2.416 6.630 1.00 0.00 O ATOM 228 C5' DG A 8 -7.560 -1.852 6.171 1.00 0.00 C ATOM 229 C4' DG A 8 -7.720 -1.956 4.661 1.00 0.00 C ATOM 230 O4' DG A 8 -6.698 -1.201 3.969 1.00 0.00 O ATOM 231 C3' DG A 8 -7.624 -3.406 4.201 1.00 0.00 C ATOM 232 O3' DG A 8 -8.875 -3.834 3.655 1.00 0.00 O ATOM 233 C2' DG A 8 -6.532 -3.428 3.161 1.00 0.00 C ATOM 234 C1' DG A 8 -6.167 -1.987 2.882 1.00 0.00 C ATOM 235 N9 DG A 8 -4.705 -1.807 2.763 1.00 0.00 N ATOM 236 C8 DG A 8 -3.742 -1.852 3.719 1.00 0.00 C ATOM 237 N7 DG A 8 -2.523 -1.618 3.355 1.00 0.00 N ATOM 238 C5 DG A 8 -2.678 -1.387 1.982 1.00 0.00 C ATOM 239 C6 DG A 8 -1.703 -1.072 0.997 1.00 0.00 C ATOM 240 O6 DG A 8 -0.493 -0.930 1.141 1.00 0.00 O ATOM 241 N1 DG A 8 -2.276 -0.920 -0.259 1.00 0.00 N ATOM 242 C2 DG A 8 -3.620 -1.054 -0.541 1.00 0.00 C ATOM 243 N2 DG A 8 -3.974 -0.876 -1.815 1.00 0.00 N ATOM 244 N3 DG A 8 -4.545 -1.349 0.379 1.00 0.00 N ATOM 245 C4 DG A 8 -4.010 -1.502 1.613 1.00 0.00 C ATOM 0 H5' DG A 8 -7.610 -0.804 6.468 1.00 0.00 H new ATOM 0 H5'' DG A 8 -8.392 -2.362 6.658 1.00 0.00 H new ATOM 0 H4' DG A 8 -8.703 -1.550 4.423 1.00 0.00 H new ATOM 0 H3' DG A 8 -7.396 -4.086 5.022 1.00 0.00 H new ATOM 0 H2' DG A 8 -5.666 -3.984 3.521 1.00 0.00 H new ATOM 0 H2'' DG A 8 -6.873 -3.924 2.252 1.00 0.00 H new ATOM 0 H1' DG A 8 -6.589 -1.669 1.929 1.00 0.00 H new ATOM 0 H8 DG A 8 -3.985 -2.075 4.747 1.00 0.00 H new ATOM 0 H1 DG A 8 -1.654 -0.691 -1.034 1.00 0.00 H new ATOM 0 H21 DG A 8 -4.953 -0.961 -2.089 1.00 0.00 H new ATOM 0 H22 DG A 8 -3.266 -0.655 -2.515 1.00 0.00 H new ATOM 257 P DG A 9 -9.039 -5.308 3.038 1.00 0.00 P ATOM 258 OP1 DG A 9 -10.480 -5.642 3.011 1.00 0.00 O ATOM 259 OP2 DG A 9 -8.084 -6.207 3.723 1.00 0.00 O ATOM 260 O5' DG A 9 -8.540 -5.103 1.524 1.00 0.00 O ATOM 261 C5' DG A 9 -8.054 -6.218 0.773 1.00 0.00 C ATOM 262 C4' DG A 9 -8.049 -5.957 -0.725 1.00 0.00 C ATOM 263 O4' DG A 9 -7.209 -4.824 -1.059 1.00 0.00 O ATOM 264 C3' DG A 9 -7.525 -7.177 -1.478 1.00 0.00 C ATOM 265 O3' DG A 9 -8.580 -7.865 -2.168 1.00 0.00 O ATOM 266 C2' DG A 9 -6.498 -6.648 -2.435 1.00 0.00 C ATOM 267 C1' DG A 9 -6.228 -5.208 -2.046 1.00 0.00 C ATOM 268 N9 DG A 9 -4.861 -5.044 -1.509 1.00 0.00 N ATOM 269 C8 DG A 9 -4.411 -5.187 -0.237 1.00 0.00 C ATOM 270 N7 DG A 9 -3.165 -4.934 -0.010 1.00 0.00 N ATOM 271 C5 DG A 9 -2.712 -4.571 -1.281 1.00 0.00 C ATOM 272 C6 DG A 9 -1.414 -4.177 -1.705 1.00 0.00 C ATOM 273 O6 DG A 9 -0.393 -4.069 -1.031 1.00 0.00 O ATOM 274 N1 DG A 9 -1.384 -3.901 -3.066 1.00 0.00 N ATOM 275 C2 DG A 9 -2.466 -3.989 -3.920 1.00 0.00 C ATOM 276 N2 DG A 9 -2.235 -3.686 -5.197 1.00 0.00 N ATOM 277 N3 DG A 9 -3.691 -4.358 -3.529 1.00 0.00 N ATOM 278 C4 DG A 9 -3.745 -4.634 -2.206 1.00 0.00 C ATOM 0 H5' DG A 9 -8.672 -7.091 0.984 1.00 0.00 H new ATOM 0 H5'' DG A 9 -7.042 -6.458 1.100 1.00 0.00 H new ATOM 0 H4' DG A 9 -9.078 -5.745 -1.017 1.00 0.00 H new ATOM 0 H3' DG A 9 -7.096 -7.911 -0.796 1.00 0.00 H new ATOM 0 H2' DG A 9 -5.583 -7.239 -2.384 1.00 0.00 H new ATOM 0 H2'' DG A 9 -6.860 -6.709 -3.461 1.00 0.00 H new ATOM 0 H1' DG A 9 -6.303 -4.570 -2.926 1.00 0.00 H new ATOM 0 H8 DG A 9 -5.071 -5.501 0.558 1.00 0.00 H new ATOM 0 H1 DG A 9 -0.492 -3.610 -3.467 1.00 0.00 H new ATOM 0 H21 DG A 9 -2.994 -3.732 -5.877 1.00 0.00 H new ATOM 0 H22 DG A 9 -1.300 -3.408 -5.494 1.00 0.00 H new ATOM 290 P DC A 10 -9.551 -7.098 -3.200 1.00 0.00 P ATOM 291 OP1 DC A 10 -9.293 -7.627 -4.558 1.00 0.00 O ATOM 292 OP2 DC A 10 -9.452 -5.643 -2.946 1.00 0.00 O ATOM 293 O5' DC A 10 -11.014 -7.595 -2.735 1.00 0.00 O ATOM 294 C5' DC A 10 -11.468 -7.369 -1.396 1.00 0.00 C ATOM 295 C4' DC A 10 -12.040 -5.951 -1.229 1.00 0.00 C ATOM 296 O4' DC A 10 -11.784 -5.166 -2.416 1.00 0.00 O ATOM 297 C3' DC A 10 -13.554 -5.959 -0.984 1.00 0.00 C ATOM 298 O3' DC A 10 -13.870 -5.369 0.284 1.00 0.00 O ATOM 299 C2' DC A 10 -14.156 -5.159 -2.105 1.00 0.00 C ATOM 300 C1' DC A 10 -13.025 -4.737 -3.021 1.00 0.00 C ATOM 301 N1 DC A 10 -13.189 -5.336 -4.363 1.00 0.00 N ATOM 302 C2 DC A 10 -13.910 -4.617 -5.305 1.00 0.00 C ATOM 303 O2 DC A 10 -14.384 -3.521 -5.013 1.00 0.00 O ATOM 304 N3 DC A 10 -14.073 -5.158 -6.544 1.00 0.00 N ATOM 305 C4 DC A 10 -13.548 -6.353 -6.847 1.00 0.00 C ATOM 306 N4 DC A 10 -13.736 -6.860 -8.067 1.00 0.00 N ATOM 307 C5 DC A 10 -12.801 -7.095 -5.879 1.00 0.00 C ATOM 308 C6 DC A 10 -12.649 -6.553 -4.657 1.00 0.00 C ATOM 0 H5' DC A 10 -10.641 -7.514 -0.701 1.00 0.00 H new ATOM 0 H5'' DC A 10 -12.232 -8.103 -1.140 1.00 0.00 H new ATOM 0 H4' DC A 10 -11.545 -5.517 -0.360 1.00 0.00 H new ATOM 0 H3' DC A 10 -13.946 -6.976 -0.961 1.00 0.00 H new ATOM 0 H2' DC A 10 -14.889 -5.754 -2.650 1.00 0.00 H new ATOM 0 H2'' DC A 10 -14.680 -4.286 -1.715 1.00 0.00 H new ATOM 0 H1' DC A 10 -13.026 -3.654 -3.148 1.00 0.00 H new ATOM 0 H41 DC A 10 -13.341 -7.769 -8.308 1.00 0.00 H new ATOM 0 H42 DC A 10 -14.275 -6.339 -8.758 1.00 0.00 H new ATOM 0 H5 DC A 10 -12.374 -8.057 -6.121 1.00 0.00 H new ATOM 0 H6 DC A 10 -12.093 -7.088 -3.901 1.00 0.00 H new ATOM 320 P DC A 11 -13.370 -3.881 0.648 1.00 0.00 P ATOM 321 OP1 DC A 11 -13.310 -3.092 -0.603 1.00 0.00 O ATOM 322 OP2 DC A 11 -12.170 -3.994 1.506 1.00 0.00 O ATOM 323 O5' DC A 11 -14.579 -3.308 1.547 1.00 0.00 O ATOM 324 C5' DC A 11 -15.374 -2.210 1.086 1.00 0.00 C ATOM 325 C4' DC A 11 -15.490 -1.116 2.147 1.00 0.00 C ATOM 326 O4' DC A 11 -16.172 -1.614 3.320 1.00 0.00 O ATOM 327 C3' DC A 11 -14.112 -0.615 2.571 1.00 0.00 C ATOM 328 O3' DC A 11 -13.950 0.773 2.248 1.00 0.00 O ATOM 329 C2' DC A 11 -14.034 -0.836 4.057 1.00 0.00 C ATOM 330 C1' DC A 11 -15.340 -1.474 4.491 1.00 0.00 C ATOM 331 N1 DC A 11 -15.100 -2.792 5.116 1.00 0.00 N ATOM 332 C2 DC A 11 -14.903 -2.827 6.489 1.00 0.00 C ATOM 333 O2 DC A 11 -14.928 -1.786 7.141 1.00 0.00 O ATOM 334 N3 DC A 11 -14.687 -4.035 7.079 1.00 0.00 N ATOM 335 C4 DC A 11 -14.663 -5.161 6.353 1.00 0.00 C ATOM 336 N4 DC A 11 -14.448 -6.327 6.962 1.00 0.00 N ATOM 337 C5 DC A 11 -14.865 -5.129 4.937 1.00 0.00 C ATOM 338 C6 DC A 11 -15.079 -3.929 4.363 1.00 0.00 C ATOM 0 H5' DC A 11 -16.369 -2.567 0.820 1.00 0.00 H new ATOM 0 H5'' DC A 11 -14.932 -1.794 0.181 1.00 0.00 H new ATOM 0 H4' DC A 11 -16.057 -0.297 1.705 1.00 0.00 H new ATOM 0 H3' DC A 11 -13.316 -1.146 2.048 1.00 0.00 H new ATOM 0 H2' DC A 11 -13.191 -1.481 4.305 1.00 0.00 H new ATOM 0 H2'' DC A 11 -13.877 0.109 4.578 1.00 0.00 H new ATOM 0 H1' DC A 11 -15.833 -0.848 5.235 1.00 0.00 H new ATOM 0 H41 DC A 11 -14.428 -7.190 6.419 1.00 0.00 H new ATOM 0 H42 DC A 11 -14.304 -6.356 7.971 1.00 0.00 H new ATOM 0 H5 DC A 11 -14.847 -6.035 4.349 1.00 0.00 H new ATOM 0 H6 DC A 11 -15.235 -3.867 3.296 1.00 0.00 H new ATOM 350 P DT A 12 -14.954 1.885 2.842 1.00 0.00 P ATOM 351 OP1 DT A 12 -16.042 1.188 3.564 1.00 0.00 O ATOM 352 OP2 DT A 12 -15.281 2.839 1.759 1.00 0.00 O ATOM 353 O5' DT A 12 -14.037 2.647 3.925 1.00 0.00 O ATOM 354 C5' DT A 12 -12.678 2.975 3.622 1.00 0.00 C ATOM 355 C4' DT A 12 -12.167 4.126 4.490 1.00 0.00 C ATOM 356 O4' DT A 12 -12.410 3.868 5.893 1.00 0.00 O ATOM 357 C3' DT A 12 -10.664 4.334 4.302 1.00 0.00 C ATOM 358 O3' DT A 12 -10.399 5.667 3.847 1.00 0.00 O ATOM 359 C2' DT A 12 -10.055 4.099 5.658 1.00 0.00 C ATOM 360 C1' DT A 12 -11.200 4.080 6.648 1.00 0.00 C ATOM 361 N1 DT A 12 -11.031 3.029 7.680 1.00 0.00 N ATOM 362 C2 DT A 12 -10.958 3.439 9.001 1.00 0.00 C ATOM 363 O2 DT A 12 -10.994 4.626 9.319 1.00 0.00 O ATOM 364 N3 DT A 12 -10.842 2.436 9.945 1.00 0.00 N ATOM 365 C4 DT A 12 -10.794 1.077 9.689 1.00 0.00 C ATOM 366 O4 DT A 12 -10.691 0.269 10.609 1.00 0.00 O ATOM 367 C5 DT A 12 -10.877 0.741 8.285 1.00 0.00 C ATOM 368 C7 DT A 12 -10.848 -0.723 7.859 1.00 0.00 C ATOM 369 C6 DT A 12 -10.989 1.700 7.344 1.00 0.00 C ATOM 0 H5' DT A 12 -12.595 3.248 2.570 1.00 0.00 H new ATOM 0 H5'' DT A 12 -12.049 2.098 3.774 1.00 0.00 H new ATOM 0 H4' DT A 12 -12.708 5.019 4.176 1.00 0.00 H new ATOM 0 H3' DT A 12 -10.248 3.659 3.554 1.00 0.00 H new ATOM 0 H2' DT A 12 -9.509 3.156 5.679 1.00 0.00 H new ATOM 0 H2'' DT A 12 -9.342 4.886 5.905 1.00 0.00 H new ATOM 0 H1' DT A 12 -11.235 5.026 7.188 1.00 0.00 H new ATOM 0 H3 DT A 12 -10.787 2.725 10.922 1.00 0.00 H new ATOM 0 H71 DT A 12 -10.261 -1.299 8.574 1.00 0.00 H new ATOM 0 H72 DT A 12 -11.865 -1.113 7.828 1.00 0.00 H new ATOM 0 H73 DT A 12 -10.397 -0.805 6.870 1.00 0.00 H new ATOM 0 H6 DT A 12 -11.047 1.416 6.304 1.00 0.00 H new ATOM 382 P DT A 13 -8.889 6.175 3.608 1.00 0.00 P ATOM 383 OP1 DT A 13 -7.971 5.240 4.295 1.00 0.00 O ATOM 384 OP2 DT A 13 -8.834 7.622 3.914 1.00 0.00 O ATOM 385 O5' DT A 13 -8.703 5.989 2.020 1.00 0.00 O ATOM 386 C5' DT A 13 -9.552 6.683 1.101 1.00 0.00 C ATOM 387 C4' DT A 13 -9.048 6.546 -0.333 1.00 0.00 C ATOM 388 O4' DT A 13 -7.792 7.241 -0.499 1.00 0.00 O ATOM 389 C3' DT A 13 -8.838 5.080 -0.698 1.00 0.00 C ATOM 390 O3' DT A 13 -9.686 4.700 -1.786 1.00 0.00 O ATOM 391 C2' DT A 13 -7.388 4.957 -1.079 1.00 0.00 C ATOM 392 C1' DT A 13 -6.758 6.328 -0.925 1.00 0.00 C ATOM 393 N1 DT A 13 -5.659 6.295 0.064 1.00 0.00 N ATOM 394 C2 DT A 13 -4.387 6.615 -0.376 1.00 0.00 C ATOM 395 O2 DT A 13 -4.157 6.915 -1.546 1.00 0.00 O ATOM 396 N3 DT A 13 -3.388 6.582 0.578 1.00 0.00 N ATOM 397 C4 DT A 13 -3.546 6.263 1.916 1.00 0.00 C ATOM 398 O4 DT A 13 -2.581 6.272 2.680 1.00 0.00 O ATOM 399 C5 DT A 13 -4.910 5.942 2.285 1.00 0.00 C ATOM 400 C7 DT A 13 -5.240 5.575 3.731 1.00 0.00 C ATOM 401 C6 DT A 13 -5.901 5.966 1.371 1.00 0.00 C ATOM 0 H5' DT A 13 -9.600 7.738 1.372 1.00 0.00 H new ATOM 0 H5'' DT A 13 -10.566 6.289 1.171 1.00 0.00 H new ATOM 0 H4' DT A 13 -9.803 6.982 -0.987 1.00 0.00 H new ATOM 0 H3' DT A 13 -9.089 4.421 0.133 1.00 0.00 H new ATOM 0 H2' DT A 13 -6.885 4.230 -0.442 1.00 0.00 H new ATOM 0 H2'' DT A 13 -7.290 4.603 -2.105 1.00 0.00 H new ATOM 0 H1' DT A 13 -6.330 6.651 -1.874 1.00 0.00 H new ATOM 0 H3 DT A 13 -2.445 6.815 0.267 1.00 0.00 H new ATOM 0 H71 DT A 13 -4.375 5.097 4.192 1.00 0.00 H new ATOM 0 H72 DT A 13 -5.495 6.478 4.286 1.00 0.00 H new ATOM 0 H73 DT A 13 -6.086 4.888 3.748 1.00 0.00 H new ATOM 0 H6 DT A 13 -6.907 5.720 1.676 1.00 0.00 H new ATOM 414 P DG A 14 -9.722 3.174 -2.297 1.00 0.00 P ATOM 415 OP1 DG A 14 -11.020 2.940 -2.968 1.00 0.00 O ATOM 416 OP2 DG A 14 -9.302 2.301 -1.178 1.00 0.00 O ATOM 417 O5' DG A 14 -8.565 3.151 -3.416 1.00 0.00 O ATOM 418 C5' DG A 14 -8.795 3.728 -4.708 1.00 0.00 C ATOM 419 C4' DG A 14 -7.608 3.548 -5.644 1.00 0.00 C ATOM 420 O4' DG A 14 -6.432 4.195 -5.109 1.00 0.00 O ATOM 421 C3' DG A 14 -7.284 2.071 -5.845 1.00 0.00 C ATOM 422 O3' DG A 14 -7.617 1.648 -7.170 1.00 0.00 O ATOM 423 C2' DG A 14 -5.806 1.942 -5.599 1.00 0.00 C ATOM 424 C1' DG A 14 -5.297 3.308 -5.184 1.00 0.00 C ATOM 425 N9 DG A 14 -4.602 3.229 -3.887 1.00 0.00 N ATOM 426 C8 DG A 14 -5.087 2.899 -2.665 1.00 0.00 C ATOM 427 N7 DG A 14 -4.258 2.886 -1.676 1.00 0.00 N ATOM 428 C5 DG A 14 -3.063 3.253 -2.303 1.00 0.00 C ATOM 429 C6 DG A 14 -1.763 3.420 -1.756 1.00 0.00 C ATOM 430 O6 DG A 14 -1.404 3.273 -0.591 1.00 0.00 O ATOM 431 N1 DG A 14 -0.845 3.794 -2.729 1.00 0.00 N ATOM 432 C2 DG A 14 -1.135 3.986 -4.065 1.00 0.00 C ATOM 433 N2 DG A 14 -0.117 4.346 -4.845 1.00 0.00 N ATOM 434 N3 DG A 14 -2.356 3.830 -4.587 1.00 0.00 N ATOM 435 C4 DG A 14 -3.267 3.465 -3.657 1.00 0.00 C ATOM 0 H5' DG A 14 -9.007 4.791 -4.595 1.00 0.00 H new ATOM 0 H5'' DG A 14 -9.679 3.272 -5.154 1.00 0.00 H new ATOM 0 H4' DG A 14 -7.884 3.998 -6.598 1.00 0.00 H new ATOM 0 H3' DG A 14 -7.861 1.441 -5.168 1.00 0.00 H new ATOM 0 H2' DG A 14 -5.609 1.206 -4.820 1.00 0.00 H new ATOM 0 H2'' DG A 14 -5.295 1.599 -6.499 1.00 0.00 H new ATOM 0 H1' DG A 14 -4.578 3.684 -5.912 1.00 0.00 H new ATOM 0 H8 DG A 14 -6.130 2.656 -2.524 1.00 0.00 H new ATOM 0 H1 DG A 14 0.120 3.938 -2.433 1.00 0.00 H new ATOM 0 H21 DG A 14 -0.269 4.503 -5.841 1.00 0.00 H new ATOM 0 H22 DG A 14 0.814 4.465 -4.446 1.00 0.00 H new ATOM 447 P DG A 15 -7.220 0.171 -7.671 1.00 0.00 P ATOM 448 OP1 DG A 15 -7.897 -0.079 -8.963 1.00 0.00 O ATOM 449 OP2 DG A 15 -7.411 -0.766 -6.542 1.00 0.00 O ATOM 450 O5' DG A 15 -5.640 0.307 -7.947 1.00 0.00 O ATOM 451 C5' DG A 15 -5.163 1.012 -9.100 1.00 0.00 C ATOM 452 C4' DG A 15 -3.671 0.817 -9.324 1.00 0.00 C ATOM 453 O4' DG A 15 -2.904 1.354 -8.224 1.00 0.00 O ATOM 454 C3' DG A 15 -3.320 -0.660 -9.454 1.00 0.00 C ATOM 455 O3' DG A 15 -3.076 -1.015 -10.819 1.00 0.00 O ATOM 456 C2' DG A 15 -2.084 -0.851 -8.618 1.00 0.00 C ATOM 457 C1' DG A 15 -1.817 0.460 -7.905 1.00 0.00 C ATOM 458 N9 DG A 15 -1.709 0.253 -6.447 1.00 0.00 N ATOM 459 C8 DG A 15 -2.668 -0.070 -5.544 1.00 0.00 C ATOM 460 N7 DG A 15 -2.309 -0.202 -4.310 1.00 0.00 N ATOM 461 C5 DG A 15 -0.937 0.063 -4.383 1.00 0.00 C ATOM 462 C6 DG A 15 0.044 0.077 -3.354 1.00 0.00 C ATOM 463 O6 DG A 15 -0.106 -0.144 -2.154 1.00 0.00 O ATOM 464 N1 DG A 15 1.303 0.390 -3.854 1.00 0.00 N ATOM 465 C2 DG A 15 1.589 0.656 -5.178 1.00 0.00 C ATOM 466 N2 DG A 15 2.861 0.934 -5.462 1.00 0.00 N ATOM 467 N3 DG A 15 0.672 0.644 -6.151 1.00 0.00 N ATOM 468 C4 DG A 15 -0.563 0.342 -5.689 1.00 0.00 C ATOM 0 H5' DG A 15 -5.374 2.075 -8.985 1.00 0.00 H new ATOM 0 H5'' DG A 15 -5.707 0.672 -9.981 1.00 0.00 H new ATOM 0 H4' DG A 15 -3.425 1.343 -10.247 1.00 0.00 H new ATOM 0 H3' DG A 15 -4.138 -1.298 -9.118 1.00 0.00 H new ATOM 0 H2' DG A 15 -2.227 -1.658 -7.899 1.00 0.00 H new ATOM 0 H2'' DG A 15 -1.236 -1.128 -9.244 1.00 0.00 H new ATOM 0 H1' DG A 15 -0.869 0.887 -8.233 1.00 0.00 H new ATOM 0 H8 DG A 15 -3.695 -0.212 -5.846 1.00 0.00 H new ATOM 0 H1 DG A 15 2.076 0.426 -3.190 1.00 0.00 H new ATOM 0 H21 DG A 15 3.136 1.139 -6.423 1.00 0.00 H new ATOM 0 H22 DG A 15 3.560 0.941 -4.719 1.00 0.00 H new ATOM 480 P DG A 16 -2.503 -2.472 -11.195 1.00 0.00 P ATOM 481 OP1 DG A 16 -2.715 -2.695 -12.642 1.00 0.00 O ATOM 482 OP2 DG A 16 -3.030 -3.445 -10.213 1.00 0.00 O ATOM 483 O5' DG A 16 -0.923 -2.303 -10.937 1.00 0.00 O ATOM 484 C5' DG A 16 -0.172 -1.332 -11.678 1.00 0.00 C ATOM 485 C4' DG A 16 1.304 -1.321 -11.303 1.00 0.00 C ATOM 486 O4' DG A 16 1.478 -1.046 -9.893 1.00 0.00 O ATOM 487 C3' DG A 16 1.966 -2.663 -11.606 1.00 0.00 C ATOM 488 O3' DG A 16 3.050 -2.490 -12.529 1.00 0.00 O ATOM 489 C2' DG A 16 2.463 -3.173 -10.281 1.00 0.00 C ATOM 490 C1' DG A 16 2.369 -2.018 -9.309 1.00 0.00 C ATOM 491 N9 DG A 16 1.876 -2.463 -7.992 1.00 0.00 N ATOM 492 C8 DG A 16 0.627 -2.829 -7.611 1.00 0.00 C ATOM 493 N7 DG A 16 0.447 -3.145 -6.373 1.00 0.00 N ATOM 494 C5 DG A 16 1.731 -2.975 -5.845 1.00 0.00 C ATOM 495 C6 DG A 16 2.202 -3.165 -4.518 1.00 0.00 C ATOM 496 O6 DG A 16 1.567 -3.522 -3.528 1.00 0.00 O ATOM 497 N1 DG A 16 3.560 -2.887 -4.415 1.00 0.00 N ATOM 498 C2 DG A 16 4.368 -2.476 -5.456 1.00 0.00 C ATOM 499 N2 DG A 16 5.651 -2.269 -5.160 1.00 0.00 N ATOM 500 N3 DG A 16 3.932 -2.294 -6.706 1.00 0.00 N ATOM 501 C4 DG A 16 2.612 -2.559 -6.832 1.00 0.00 C ATOM 0 H5' DG A 16 -0.594 -0.342 -11.505 1.00 0.00 H new ATOM 0 H5'' DG A 16 -0.271 -1.538 -12.744 1.00 0.00 H new ATOM 0 H4' DG A 16 1.772 -0.537 -11.899 1.00 0.00 H new ATOM 0 H3' DG A 16 1.272 -3.365 -12.069 1.00 0.00 H new ATOM 0 H2' DG A 16 1.862 -4.016 -9.940 1.00 0.00 H new ATOM 0 H2'' DG A 16 3.491 -3.527 -10.363 1.00 0.00 H new ATOM 0 H1' DG A 16 3.354 -1.585 -9.138 1.00 0.00 H new ATOM 0 H8 DG A 16 -0.188 -2.855 -8.319 1.00 0.00 H new ATOM 0 H1 DG A 16 3.994 -2.995 -3.498 1.00 0.00 H new ATOM 0 H21 DG A 16 6.299 -1.964 -5.886 1.00 0.00 H new ATOM 0 H22 DG A 16 5.985 -2.415 -4.207 1.00 0.00 H new ATOM 513 P DC A 17 4.390 -1.709 -12.089 1.00 0.03 P ATOM 514 OP1 DC A 17 5.040 -1.181 -13.310 1.00 0.06 O ATOM 515 OP2 DC A 17 5.151 -2.580 -11.166 1.00 0.07 O ATOM 516 O5' DC A 17 3.816 -0.462 -11.245 1.00 0.04 O ATOM 517 C5' DC A 17 3.957 0.878 -11.727 1.00 0.07 C ATOM 518 C4' DC A 17 5.235 1.530 -11.204 1.00 0.06 C ATOM 519 O4' DC A 17 6.400 0.833 -11.697 1.00 0.10 O ATOM 520 C3' DC A 17 5.329 2.988 -11.642 1.00 0.05 C ATOM 521 O3' DC A 17 5.233 3.868 -10.516 1.00 0.04 O ATOM 522 C2' DC A 17 6.666 3.127 -12.316 1.00 0.08 C ATOM 523 C1' DC A 17 7.318 1.757 -12.320 1.00 0.07 C ATOM 524 N1 DC A 17 7.636 1.327 -13.700 1.00 0.06 N ATOM 525 C2 DC A 17 8.964 1.060 -14.003 1.00 0.05 C ATOM 526 O2 DC A 17 9.830 1.186 -13.139 1.00 0.15 O ATOM 527 N3 DC A 17 9.271 0.660 -15.267 1.00 0.15 N ATOM 528 C4 DC A 17 8.317 0.527 -16.198 1.00 0.28 C ATOM 529 N4 DC A 17 8.651 0.132 -17.426 1.00 0.42 N ATOM 530 C5 DC A 17 6.947 0.801 -15.891 1.00 0.29 C ATOM 531 C6 DC A 17 6.653 1.197 -14.638 1.00 0.16 C ATOM 0 H5' DC A 17 3.094 1.469 -11.420 1.00 0.07 H new ATOM 0 H5'' DC A 17 3.969 0.874 -12.817 1.00 0.07 H new ATOM 0 H4' DC A 17 5.200 1.478 -10.116 1.00 0.06 H new ATOM 0 H3' DC A 17 4.513 3.255 -12.313 1.00 0.05 H new ATOM 0 H2' DC A 17 6.546 3.498 -13.334 1.00 0.08 H new ATOM 0 H2'' DC A 17 7.290 3.847 -11.786 1.00 0.08 H new ATOM 0 H1' DC A 17 8.258 1.787 -11.769 1.00 0.07 H new ATOM 0 H41 DC A 17 7.932 0.028 -18.142 1.00 0.42 H new ATOM 0 H42 DC A 17 9.626 -0.066 -17.650 1.00 0.42 H new ATOM 0 H5 DC A 17 6.175 0.694 -16.639 1.00 0.29 H new ATOM 0 H6 DC A 17 5.629 1.414 -14.373 1.00 0.16 H new ATOM 543 P DG A 18 3.796 4.367 -9.986 1.00 0.00 P ATOM 544 OP1 DG A 18 3.069 3.197 -9.445 1.00 0.00 O ATOM 545 OP2 DG A 18 3.175 5.196 -11.043 1.00 0.00 O ATOM 546 O5' DG A 18 4.188 5.330 -8.754 1.00 0.00 O ATOM 547 C5' DG A 18 4.953 6.525 -8.975 1.00 0.00 C ATOM 548 C4' DG A 18 6.013 6.741 -7.903 1.00 0.00 C ATOM 549 O4' DG A 18 5.402 6.981 -6.615 1.00 0.00 O ATOM 550 C3' DG A 18 6.914 5.519 -7.777 1.00 0.00 C ATOM 551 O3' DG A 18 8.290 5.904 -7.863 1.00 0.00 O ATOM 552 C2' DG A 18 6.601 4.928 -6.429 1.00 0.00 C ATOM 553 C1' DG A 18 5.809 5.970 -5.667 1.00 0.00 C ATOM 554 N9 DG A 18 4.627 5.382 -5.006 1.00 0.00 N ATOM 555 C8 DG A 18 3.395 5.126 -5.511 1.00 0.00 C ATOM 556 N7 DG A 18 2.499 4.671 -4.702 1.00 0.00 N ATOM 557 C5 DG A 18 3.205 4.607 -3.498 1.00 0.00 C ATOM 558 C6 DG A 18 2.773 4.183 -2.212 1.00 0.00 C ATOM 559 O6 DG A 18 1.661 3.782 -1.876 1.00 0.00 O ATOM 560 N1 DG A 18 3.794 4.273 -1.275 1.00 0.00 N ATOM 561 C2 DG A 18 5.077 4.714 -1.538 1.00 0.00 C ATOM 562 N2 DG A 18 5.922 4.717 -0.507 1.00 0.00 N ATOM 563 N3 DG A 18 5.491 5.116 -2.745 1.00 0.00 N ATOM 564 C4 DG A 18 4.512 5.038 -3.675 1.00 0.00 C ATOM 0 H5' DG A 18 4.282 7.384 -8.997 1.00 0.00 H new ATOM 0 H5'' DG A 18 5.434 6.470 -9.952 1.00 0.00 H new ATOM 0 H4' DG A 18 6.601 7.608 -8.204 1.00 0.00 H new ATOM 0 H3' DG A 18 6.742 4.799 -8.577 1.00 0.00 H new ATOM 0 H2' DG A 18 6.027 4.007 -6.534 1.00 0.00 H new ATOM 0 H2'' DG A 18 7.517 4.673 -5.896 1.00 0.00 H new ATOM 0 H1' DG A 18 6.428 6.398 -4.879 1.00 0.00 H new ATOM 0 H8 DG A 18 3.172 5.297 -6.554 1.00 0.00 H new ATOM 0 H1 DG A 18 3.580 3.992 -0.318 1.00 0.00 H new ATOM 0 H21 DG A 18 6.884 5.031 -0.637 1.00 0.00 H new ATOM 0 H22 DG A 18 5.607 4.405 0.412 1.00 0.00 H new ATOM 576 P DG A 19 9.389 4.888 -8.452 1.00 0.00 P ATOM 577 OP1 DG A 19 10.475 5.685 -9.066 1.00 0.00 O ATOM 578 OP2 DG A 19 8.688 3.857 -9.249 1.00 0.00 O ATOM 579 O5' DG A 19 9.966 4.192 -7.122 1.00 0.00 O ATOM 580 C5' DG A 19 10.073 2.765 -7.037 1.00 0.00 C ATOM 581 C4' DG A 19 10.497 2.304 -5.652 1.00 0.00 C ATOM 582 O4' DG A 19 9.527 2.707 -4.660 1.00 0.00 O ATOM 583 C3' DG A 19 10.630 0.786 -5.594 1.00 0.00 C ATOM 584 O3' DG A 19 12.000 0.399 -5.452 1.00 0.00 O ATOM 585 C2' DG A 19 9.824 0.353 -4.401 1.00 0.00 C ATOM 586 C1' DG A 19 9.221 1.602 -3.787 1.00 0.00 C ATOM 587 N9 DG A 19 7.764 1.445 -3.617 1.00 0.00 N ATOM 588 C8 DG A 19 6.772 1.490 -4.540 1.00 0.00 C ATOM 589 N7 DG A 19 5.565 1.280 -4.132 1.00 0.00 N ATOM 590 C5 DG A 19 5.760 1.068 -2.764 1.00 0.00 C ATOM 591 C6 DG A 19 4.815 0.783 -1.742 1.00 0.00 C ATOM 592 O6 DG A 19 3.597 0.652 -1.845 1.00 0.00 O ATOM 593 N1 DG A 19 5.431 0.644 -0.503 1.00 0.00 N ATOM 594 C2 DG A 19 6.787 0.764 -0.272 1.00 0.00 C ATOM 595 N2 DG A 19 7.190 0.606 0.988 1.00 0.00 N ATOM 596 N3 DG A 19 7.681 1.031 -1.228 1.00 0.00 N ATOM 597 C4 DG A 19 7.105 1.170 -2.442 1.00 0.00 C ATOM 0 H5' DG A 19 10.795 2.412 -7.773 1.00 0.00 H new ATOM 0 H5'' DG A 19 9.113 2.314 -7.290 1.00 0.00 H new ATOM 0 H4' DG A 19 11.462 2.766 -5.443 1.00 0.00 H new ATOM 0 H3' DG A 19 10.272 0.317 -6.511 1.00 0.00 H new ATOM 0 H2' DG A 19 9.042 -0.345 -4.699 1.00 0.00 H new ATOM 0 H2'' DG A 19 10.455 -0.164 -3.678 1.00 0.00 H new ATOM 0 H1' DG A 19 9.639 1.782 -2.797 1.00 0.00 H new ATOM 0 H8 DG A 19 6.984 1.694 -5.579 1.00 0.00 H new ATOM 0 H1 DG A 19 4.834 0.437 0.298 1.00 0.00 H new ATOM 0 H21 DG A 19 8.180 0.683 1.220 1.00 0.00 H new ATOM 0 H22 DG A 19 6.508 0.408 1.720 1.00 0.00 H new ATOM 609 P DG A 20 12.403 -1.156 -5.346 1.00 0.00 P ATOM 610 OP1 DG A 20 13.874 -1.263 -5.473 1.00 0.00 O ATOM 611 OP2 DG A 20 11.526 -1.925 -6.257 1.00 0.00 O ATOM 612 O5' DG A 20 12.001 -1.521 -3.831 1.00 0.00 O ATOM 613 C5' DG A 20 12.819 -1.083 -2.737 1.00 0.00 C ATOM 614 C4' DG A 20 12.429 -1.740 -1.420 1.00 0.00 C ATOM 615 O4' DG A 20 11.078 -1.385 -1.048 1.00 0.00 O ATOM 616 C3' DG A 20 12.506 -3.261 -1.518 1.00 0.00 C ATOM 617 O3' DG A 20 13.554 -3.775 -0.689 1.00 0.00 O ATOM 618 C2' DG A 20 11.166 -3.765 -1.058 1.00 0.00 C ATOM 619 C1' DG A 20 10.364 -2.560 -0.614 1.00 0.00 C ATOM 620 N9 DG A 20 9.004 -2.595 -1.184 1.00 0.00 N ATOM 621 C8 DG A 20 8.589 -2.376 -2.456 1.00 0.00 C ATOM 622 N7 DG A 20 7.326 -2.483 -2.700 1.00 0.00 N ATOM 623 C5 DG A 20 6.819 -2.815 -1.440 1.00 0.00 C ATOM 624 C6 DG A 20 5.482 -3.071 -1.034 1.00 0.00 C ATOM 625 O6 DG A 20 4.461 -3.051 -1.718 1.00 0.00 O ATOM 626 N1 DG A 20 5.408 -3.370 0.321 1.00 0.00 N ATOM 627 C2 DG A 20 6.486 -3.417 1.184 1.00 0.00 C ATOM 628 N2 DG A 20 6.213 -3.718 2.453 1.00 0.00 N ATOM 629 N3 DG A 20 7.746 -3.178 0.810 1.00 0.00 N ATOM 630 C4 DG A 20 7.842 -2.885 -0.506 1.00 0.00 C ATOM 0 H5' DG A 20 12.738 -0.001 -2.638 1.00 0.00 H new ATOM 0 H5'' DG A 20 13.863 -1.306 -2.956 1.00 0.00 H new ATOM 0 H4' DG A 20 13.132 -1.382 -0.668 1.00 0.00 H new ATOM 0 H3' DG A 20 12.730 -3.585 -2.534 1.00 0.00 H new ATOM 0 H2' DG A 20 10.655 -4.291 -1.864 1.00 0.00 H new ATOM 0 H2'' DG A 20 11.282 -4.474 -0.238 1.00 0.00 H new ATOM 0 H1' DG A 20 10.250 -2.555 0.470 1.00 0.00 H new ATOM 0 H8 DG A 20 9.290 -2.121 -3.237 1.00 0.00 H new ATOM 0 H1 DG A 20 4.486 -3.570 0.709 1.00 0.00 H new ATOM 0 H21 DG A 20 6.966 -3.768 3.139 1.00 0.00 H new ATOM 0 H22 DG A 20 5.251 -3.898 2.739 1.00 0.00 H new ATOM 642 P DG A 21 13.829 -5.359 -0.612 1.00 0.00 P ATOM 643 OP1 DG A 21 15.101 -5.574 0.114 1.00 0.00 O ATOM 644 OP2 DG A 21 13.649 -5.926 -1.967 1.00 0.00 O ATOM 645 O5' DG A 21 12.623 -5.883 0.318 1.00 0.00 O ATOM 646 C5' DG A 21 12.635 -5.635 1.730 1.00 0.00 C ATOM 647 C4' DG A 21 11.597 -6.464 2.475 1.00 0.00 C ATOM 648 O4' DG A 21 10.261 -6.146 2.018 1.00 0.00 O ATOM 649 C3' DG A 21 11.823 -7.961 2.254 1.00 0.00 C ATOM 650 O3' DG A 21 12.163 -8.624 3.481 1.00 0.00 O ATOM 651 C2' DG A 21 10.527 -8.484 1.704 1.00 0.00 C ATOM 652 C1' DG A 21 9.519 -7.362 1.804 1.00 0.00 C ATOM 653 N9 DG A 21 8.699 -7.288 0.580 1.00 0.00 N ATOM 654 C8 DG A 21 9.057 -6.958 -0.685 1.00 0.00 C ATOM 655 N7 DG A 21 8.144 -7.008 -1.597 1.00 0.00 N ATOM 656 C5 DG A 21 7.028 -7.421 -0.862 1.00 0.00 C ATOM 657 C6 DG A 21 5.696 -7.667 -1.289 1.00 0.00 C ATOM 658 O6 DG A 21 5.230 -7.581 -2.423 1.00 0.00 O ATOM 659 N1 DG A 21 4.886 -8.064 -0.232 1.00 0.00 N ATOM 660 C2 DG A 21 5.301 -8.210 1.076 1.00 0.00 C ATOM 661 N2 DG A 21 4.373 -8.600 1.949 1.00 0.00 N ATOM 662 N3 DG A 21 6.553 -7.982 1.486 1.00 0.00 N ATOM 663 C4 DG A 21 7.361 -7.593 0.473 1.00 0.00 C ATOM 0 H5' DG A 21 12.449 -4.576 1.912 1.00 0.00 H new ATOM 0 H5'' DG A 21 13.626 -5.857 2.127 1.00 0.00 H new ATOM 0 H4' DG A 21 11.702 -6.225 3.533 1.00 0.00 H new ATOM 0 H3' DG A 21 12.655 -8.142 1.573 1.00 0.00 H new ATOM 0 H2' DG A 21 10.648 -8.802 0.669 1.00 0.00 H new ATOM 0 H2'' DG A 21 10.192 -9.355 2.268 1.00 0.00 H new ATOM 0 H1' DG A 21 8.827 -7.530 2.630 1.00 0.00 H new ATOM 0 H8 DG A 21 10.069 -6.664 -0.922 1.00 0.00 H new ATOM 0 H1 DG A 21 3.907 -8.263 -0.439 1.00 0.00 H new ATOM 0 H21 DG A 21 4.618 -8.726 2.931 1.00 0.00 H new ATOM 0 H22 DG A 21 3.418 -8.773 1.635 1.00 0.00 H new ATOM 675 P DT A 22 11.206 -8.521 4.775 1.00 0.04 P ATOM 676 OP1 DT A 22 10.884 -7.095 4.999 1.00 0.09 O ATOM 677 OP2 DT A 22 11.816 -9.318 5.863 1.00 0.09 O ATOM 678 O5' DT A 22 9.864 -9.271 4.295 1.00 0.07 O ATOM 679 C5' DT A 22 9.718 -10.687 4.449 1.00 0.11 C ATOM 680 C4' DT A 22 8.246 -11.094 4.486 1.00 0.12 C ATOM 681 O4' DT A 22 7.537 -10.565 3.345 1.00 0.15 O ATOM 682 C3' DT A 22 8.086 -12.611 4.477 1.00 0.10 C ATOM 683 O3' DT A 22 7.599 -13.080 5.739 1.00 0.11 O ATOM 684 C2' DT A 22 7.103 -12.908 3.377 1.00 0.11 C ATOM 685 C1' DT A 22 6.678 -11.578 2.784 1.00 0.10 C ATOM 686 N1 DT A 22 6.780 -11.595 1.309 1.00 0.10 N ATOM 687 C2 DT A 22 5.622 -11.827 0.588 1.00 0.11 C ATOM 688 O2 DT A 22 4.539 -12.023 1.135 1.00 0.17 O ATOM 689 N3 DT A 22 5.753 -11.825 -0.789 1.00 0.14 N ATOM 690 C4 DT A 22 6.924 -11.614 -1.495 1.00 0.15 C ATOM 691 O4 DT A 22 6.927 -11.634 -2.724 1.00 0.21 O ATOM 692 C5 DT A 22 8.081 -11.381 -0.659 1.00 0.17 C ATOM 693 C7 DT A 22 9.439 -11.127 -1.308 1.00 0.27 C ATOM 694 C6 DT A 22 7.979 -11.378 0.685 1.00 0.17 C ATOM 0 H5' DT A 22 10.209 -11.007 5.368 1.00 0.11 H new ATOM 0 H5'' DT A 22 10.218 -11.198 3.626 1.00 0.11 H new ATOM 0 H4' DT A 22 7.833 -10.687 5.409 1.00 0.12 H new ATOM 0 H3' DT A 22 9.038 -13.114 4.309 1.00 0.10 H new ATOM 0 H2' DT A 22 7.558 -13.541 2.615 1.00 0.11 H new ATOM 0 H2'' DT A 22 6.241 -13.448 3.767 1.00 0.11 H new ATOM 0 HO3' DT A 22 7.502 -14.055 5.710 1.00 0.11 H new ATOM 0 H1' DT A 22 5.635 -11.373 3.024 1.00 0.10 H new ATOM 0 H3 DT A 22 4.908 -11.995 -1.334 1.00 0.14 H new ATOM 0 H71 DT A 22 9.490 -11.652 -2.262 1.00 0.27 H new ATOM 0 H72 DT A 22 9.568 -10.058 -1.475 1.00 0.27 H new ATOM 0 H73 DT A 22 10.230 -11.490 -0.651 1.00 0.27 H new ATOM 0 H6 DT A 22 8.861 -11.201 1.282 1.00 0.17 H new TER 708 DT A 22