USER MOD reduce.3.24.130724 H: found=0, std=0, add=135, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 135 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 25:sc= 0.129 USER MOD Single : A 9 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -5.794 -7.834 2.096 1.00 42.44 O ATOM 2 C5' DG A 1 -5.704 -8.889 3.054 1.00 60.22 C ATOM 3 C4' DG A 1 -4.632 -9.871 2.643 1.00 5.01 C ATOM 4 O4' DG A 1 -4.783 -10.190 1.281 1.00 10.51 O ATOM 5 C3' DG A 1 -3.211 -9.316 2.706 1.00 31.34 C ATOM 6 O3' DG A 1 -2.326 -10.326 3.186 1.00 11.21 O ATOM 7 C2' DG A 1 -2.879 -8.918 1.294 1.00 3.44 C ATOM 8 C1' DG A 1 -3.618 -10.001 0.512 1.00 65.05 C ATOM 9 N9 DG A 1 -3.948 -9.605 -0.873 1.00 5.43 N ATOM 10 C8 DG A 1 -5.140 -9.715 -1.494 1.00 2.53 C ATOM 11 N7 DG A 1 -5.111 -9.267 -2.745 1.00 13.14 N ATOM 12 C5 DG A 1 -3.817 -8.853 -2.915 1.00 32.51 C ATOM 13 C6 DG A 1 -3.158 -8.282 -4.023 1.00 3.41 C ATOM 14 O6 DG A 1 -3.673 -8.041 -5.113 1.00 3.00 O ATOM 15 N1 DG A 1 -1.840 -7.972 -3.875 1.00 71.44 N ATOM 16 C2 DG A 1 -1.247 -8.226 -2.688 1.00 23.33 C ATOM 17 N2 DG A 1 0.036 -7.869 -2.702 1.00 74.12 N ATOM 18 N3 DG A 1 -1.775 -8.763 -1.572 1.00 75.33 N ATOM 19 C4 DG A 1 -3.090 -9.049 -1.785 1.00 31.32 C ATOM 0 H5' DG A 1 -6.664 -9.399 3.136 1.00 60.22 H new ATOM 0 H5'' DG A 1 -5.475 -8.479 4.038 1.00 60.22 H new ATOM 0 H4' DG A 1 -4.752 -10.704 3.336 1.00 5.01 H new ATOM 0 H3' DG A 1 -3.117 -8.467 3.383 1.00 31.34 H new ATOM 0 H2' DG A 1 -3.236 -7.917 1.052 1.00 3.44 H new ATOM 0 H2'' DG A 1 -1.806 -8.929 1.103 1.00 3.44 H new ATOM 0 HO5' DG A 1 -5.466 -8.151 1.229 1.00 42.44 H new ATOM 0 H1' DG A 1 -3.015 -10.900 0.383 1.00 65.05 H new ATOM 0 H8 DG A 1 -6.023 -10.123 -1.025 1.00 2.53 H new ATOM 0 H1 DG A 1 -1.312 -7.557 -4.643 1.00 71.44 H new ATOM 0 H21 DG A 1 0.612 -8.003 -1.871 1.00 74.12 H new ATOM 0 H22 DG A 1 0.443 -7.462 -3.544 1.00 74.12 H new ATOM 32 P DG A 2 -1.030 -9.921 4.030 1.00 24.14 P ATOM 33 OP1 DG A 2 -0.620 -11.053 4.891 1.00 35.01 O ATOM 34 OP2 DG A 2 -1.250 -8.610 4.683 1.00 15.24 O ATOM 35 O5' DG A 2 0.088 -9.731 2.901 1.00 65.32 O ATOM 36 C5' DG A 2 1.376 -10.322 3.065 1.00 71.43 C ATOM 37 C4' DG A 2 2.455 -9.292 2.817 1.00 61.03 C ATOM 38 O4' DG A 2 2.114 -8.448 1.781 1.00 22.31 O ATOM 39 C3' DG A 2 2.640 -8.287 3.951 1.00 21.22 C ATOM 40 O3' DG A 2 4.002 -7.865 3.993 1.00 74.53 O ATOM 41 C2' DG A 2 1.719 -7.144 3.622 1.00 63.20 C ATOM 42 C1' DG A 2 1.851 -7.101 2.102 1.00 32.13 C ATOM 43 N9 DG A 2 0.633 -6.617 1.418 1.00 0.44 N ATOM 44 C8 DG A 2 -0.641 -6.703 1.856 1.00 2.42 C ATOM 45 N7 DG A 2 -1.511 -6.170 1.005 1.00 14.21 N ATOM 46 C5 DG A 2 -0.732 -5.725 -0.029 1.00 42.02 C ATOM 47 C6 DG A 2 -1.062 -5.070 -1.234 1.00 30.41 C ATOM 48 O6 DG A 2 -2.199 -4.763 -1.590 1.00 34.11 O ATOM 49 N1 DG A 2 -0.039 -4.750 -2.072 1.00 53.12 N ATOM 50 C2 DG A 2 1.221 -5.075 -1.707 1.00 71.30 C ATOM 51 N2 DG A 2 2.105 -4.697 -2.627 1.00 2.55 N ATOM 52 N3 DG A 2 1.648 -5.694 -0.590 1.00 1.43 N ATOM 53 C4 DG A 2 0.581 -5.987 0.203 1.00 54.51 C ATOM 0 H5' DG A 2 1.493 -11.156 2.373 1.00 71.43 H new ATOM 0 H5'' DG A 2 1.473 -10.727 4.072 1.00 71.43 H new ATOM 0 H4' DG A 2 3.337 -9.911 2.653 1.00 61.03 H new ATOM 0 H3' DG A 2 2.407 -8.705 4.931 1.00 21.22 H new ATOM 0 H2' DG A 2 0.695 -7.333 3.943 1.00 63.20 H new ATOM 0 H2'' DG A 2 2.033 -6.212 4.091 1.00 63.20 H new ATOM 0 H1' DG A 2 2.622 -6.402 1.777 1.00 32.13 H new ATOM 0 H8 DG A 2 -0.922 -7.156 2.795 1.00 2.42 H new ATOM 0 H1 DG A 2 -0.219 -4.275 -2.957 1.00 53.12 H new ATOM 0 H21 DG A 2 3.099 -4.878 -2.484 1.00 2.55 H new ATOM 0 H22 DG A 2 1.789 -4.226 -3.475 1.00 2.55 H new ATOM 65 P DC A 3 4.805 -7.891 5.376 1.00 53.12 P ATOM 66 OP1 DC A 3 5.717 -9.057 5.402 1.00 30.02 O ATOM 67 OP2 DC A 3 3.858 -7.741 6.505 1.00 21.02 O ATOM 68 O5' DC A 3 5.698 -6.566 5.300 1.00 13.33 O ATOM 69 C5' DC A 3 6.315 -6.193 4.070 1.00 22.32 C ATOM 70 C4' DC A 3 6.023 -4.742 3.763 1.00 31.04 C ATOM 71 O4' DC A 3 4.745 -4.621 3.201 1.00 52.52 O ATOM 72 C3' DC A 3 6.003 -3.829 4.984 1.00 41.15 C ATOM 73 O3' DC A 3 7.095 -2.916 4.911 1.00 61.24 O ATOM 74 C2' DC A 3 4.681 -3.115 4.925 1.00 54.54 C ATOM 75 C1' DC A 3 4.322 -3.301 3.453 1.00 4.23 C ATOM 76 N1 DC A 3 2.883 -3.138 3.173 1.00 71.00 N ATOM 77 C2 DC A 3 2.520 -2.418 2.034 1.00 22.54 C ATOM 78 O2 DC A 3 3.417 -1.954 1.319 1.00 54.02 O ATOM 79 N3 DC A 3 1.214 -2.256 1.757 1.00 22.13 N ATOM 80 C4 DC A 3 0.274 -2.758 2.530 1.00 42.31 C ATOM 81 N4 DC A 3 -1.009 -2.587 2.240 1.00 54.53 N ATOM 82 C5 DC A 3 0.620 -3.508 3.716 1.00 14.54 C ATOM 83 C6 DC A 3 1.927 -3.661 3.979 1.00 35.12 C ATOM 0 H5' DC A 3 5.946 -6.825 3.262 1.00 22.32 H new ATOM 0 H5'' DC A 3 7.392 -6.350 4.132 1.00 22.32 H new ATOM 0 H4' DC A 3 6.831 -4.439 3.097 1.00 31.04 H new ATOM 0 H3' DC A 3 6.108 -4.373 5.923 1.00 41.15 H new ATOM 0 H2' DC A 3 3.941 -3.560 5.590 1.00 54.54 H new ATOM 0 H2'' DC A 3 4.766 -2.064 5.200 1.00 54.54 H new ATOM 0 H1' DC A 3 4.791 -2.550 2.818 1.00 4.23 H new ATOM 0 H41 DC A 3 -1.726 -2.982 2.848 1.00 54.53 H new ATOM 0 H42 DC A 3 -1.278 -2.061 1.409 1.00 54.53 H new ATOM 0 H5 DC A 3 -0.139 -3.926 4.361 1.00 14.54 H new ATOM 0 H6 DC A 3 2.225 -4.216 4.856 1.00 35.12 H new ATOM 95 P DC A 4 7.938 -2.569 6.226 1.00 11.24 P ATOM 96 OP1 DC A 4 9.156 -3.407 6.273 1.00 30.05 O ATOM 97 OP2 DC A 4 7.047 -2.592 7.409 1.00 42.40 O ATOM 98 O5' DC A 4 8.389 -1.054 5.977 1.00 21.32 O ATOM 99 C5' DC A 4 8.769 -0.631 4.669 1.00 72.45 C ATOM 100 C4' DC A 4 7.971 0.587 4.263 1.00 53.14 C ATOM 101 O4' DC A 4 6.594 0.234 4.186 1.00 71.00 O ATOM 102 C3' DC A 4 8.021 1.736 5.267 1.00 73.44 C ATOM 103 O3' DC A 4 8.457 2.923 4.607 1.00 25.50 O ATOM 104 C2' DC A 4 6.615 1.876 5.782 1.00 22.43 C ATOM 105 C1' DC A 4 5.822 1.342 4.592 1.00 13.31 C ATOM 106 N1 DC A 4 4.444 0.936 4.939 1.00 14.22 N ATOM 107 C2 DC A 4 3.444 1.170 3.996 1.00 34.32 C ATOM 108 O2 DC A 4 3.755 1.704 2.924 1.00 54.21 O ATOM 109 N3 DC A 4 2.182 0.810 4.287 1.00 75.02 N ATOM 110 C4 DC A 4 1.869 0.243 5.435 1.00 32.11 C ATOM 111 N4 DC A 4 0.617 -0.107 5.703 1.00 0.13 N ATOM 112 C5 DC A 4 2.887 -0.012 6.428 1.00 13.50 C ATOM 113 C6 DC A 4 4.139 0.352 6.124 1.00 32.14 C ATOM 0 H5' DC A 4 8.603 -1.438 3.955 1.00 72.45 H new ATOM 0 H5'' DC A 4 9.834 -0.401 4.648 1.00 72.45 H new ATOM 0 H4' DC A 4 8.411 0.912 3.320 1.00 53.14 H new ATOM 0 H3' DC A 4 8.718 1.554 6.085 1.00 73.44 H new ATOM 0 H2' DC A 4 6.446 1.292 6.687 1.00 22.43 H new ATOM 0 H2'' DC A 4 6.362 2.910 6.017 1.00 22.43 H new ATOM 0 H1' DC A 4 5.679 2.098 3.820 1.00 13.31 H new ATOM 0 H41 DC A 4 0.390 -0.545 6.596 1.00 0.13 H new ATOM 0 H42 DC A 4 -0.118 0.062 5.016 1.00 0.13 H new ATOM 0 H5 DC A 4 2.649 -0.476 7.374 1.00 13.50 H new ATOM 0 H6 DC A 4 4.927 0.176 6.842 1.00 32.14 H new ATOM 125 P DG A 5 9.870 3.575 4.981 1.00 3.12 P ATOM 126 OP1 DG A 5 10.947 2.894 4.230 1.00 1.24 O ATOM 127 OP2 DG A 5 10.008 3.653 6.453 1.00 13.23 O ATOM 128 O5' DG A 5 9.739 5.065 4.417 1.00 73.33 O ATOM 129 C5' DG A 5 9.111 5.300 3.160 1.00 1.23 C ATOM 130 C4' DG A 5 7.728 5.875 3.369 1.00 71.45 C ATOM 131 O4' DG A 5 7.140 5.133 4.327 1.00 12.32 O ATOM 132 C3' DG A 5 7.710 7.224 4.085 1.00 40.22 C ATOM 133 O3' DG A 5 7.750 8.274 3.121 1.00 73.14 O ATOM 134 C2' DG A 5 6.426 7.241 4.866 1.00 12.11 C ATOM 135 C1' DG A 5 5.947 5.808 4.657 1.00 21.04 C ATOM 136 N9 DG A 5 5.312 5.218 5.855 1.00 13.44 N ATOM 137 C8 DG A 5 5.813 5.168 7.107 1.00 2.04 C ATOM 138 N7 DG A 5 4.993 4.568 7.963 1.00 41.41 N ATOM 139 C5 DG A 5 3.913 4.221 7.196 1.00 44.41 C ATOM 140 C6 DG A 5 2.710 3.558 7.521 1.00 34.02 C ATOM 141 O6 DG A 5 2.402 3.146 8.638 1.00 2.20 O ATOM 142 N1 DG A 5 1.815 3.357 6.515 1.00 53.34 N ATOM 143 C2 DG A 5 2.127 3.799 5.276 1.00 43.23 C ATOM 144 N2 DG A 5 1.155 3.529 4.407 1.00 20.20 N ATOM 145 N3 DG A 5 3.234 4.437 4.856 1.00 32.31 N ATOM 146 C4 DG A 5 4.086 4.608 5.906 1.00 23.24 C ATOM 0 H5' DG A 5 9.045 4.368 2.598 1.00 1.23 H new ATOM 0 H5'' DG A 5 9.713 5.988 2.567 1.00 1.23 H new ATOM 0 H4' DG A 5 7.283 5.921 2.375 1.00 71.45 H new ATOM 0 H3' DG A 5 8.567 7.367 4.743 1.00 40.22 H new ATOM 0 H2' DG A 5 6.585 7.474 5.919 1.00 12.11 H new ATOM 0 H2'' DG A 5 5.717 7.974 4.481 1.00 12.11 H new ATOM 0 H1' DG A 5 5.168 5.742 3.897 1.00 21.04 H new ATOM 0 H8 DG A 5 6.776 5.572 7.383 1.00 2.04 H new ATOM 0 H1 DG A 5 0.929 2.884 6.692 1.00 53.34 H new ATOM 0 H21 DG A 5 1.253 3.805 3.430 1.00 20.20 H new ATOM 0 H22 DG A 5 0.312 3.046 4.718 1.00 20.20 H new ATOM 158 P DC A 6 7.526 9.790 3.580 1.00 32.21 P ATOM 159 OP1 DC A 6 8.399 10.685 2.788 1.00 64.11 O ATOM 160 OP2 DC A 6 7.610 9.883 5.055 1.00 22.00 O ATOM 161 O5' DC A 6 6.011 10.075 3.152 1.00 12.21 O ATOM 162 C5' DC A 6 5.367 9.227 2.201 1.00 70.32 C ATOM 163 C4' DC A 6 3.897 9.569 2.113 1.00 73.44 C ATOM 164 O4' DC A 6 2.966 8.807 2.881 1.00 43.34 O ATOM 165 C3' DC A 6 3.550 10.987 2.561 1.00 30.14 C ATOM 166 O3' DC A 6 2.604 11.553 1.657 1.00 63.13 O ATOM 167 C2' DC A 6 2.975 10.838 3.942 1.00 11.34 C ATOM 168 C1' DC A 6 2.170 9.552 3.777 1.00 3.24 C ATOM 169 N1 DC A 6 1.963 8.819 5.043 1.00 62.12 N ATOM 170 C2 DC A 6 0.724 8.946 5.670 1.00 43.11 C ATOM 171 O2 DC A 6 -0.136 9.660 5.141 1.00 3.43 O ATOM 172 N3 DC A 6 0.510 8.289 6.823 1.00 53.14 N ATOM 173 C4 DC A 6 1.439 7.532 7.373 1.00 32.31 C ATOM 174 N4 DC A 6 1.209 6.892 8.513 1.00 73.32 N ATOM 175 C5 DC A 6 2.732 7.384 6.745 1.00 10.22 C ATOM 176 C6 DC A 6 2.929 8.046 5.595 1.00 41.11 C ATOM 0 H5' DC A 6 5.489 8.183 2.491 1.00 70.32 H new ATOM 0 H5'' DC A 6 5.835 9.343 1.223 1.00 70.32 H new ATOM 0 H4' DC A 6 3.786 9.367 1.048 1.00 73.44 H new ATOM 0 H3' DC A 6 4.413 11.652 2.570 1.00 30.14 H new ATOM 0 H2' DC A 6 3.749 10.747 4.704 1.00 11.34 H new ATOM 0 H2'' DC A 6 2.349 11.685 4.223 1.00 11.34 H new ATOM 0 H1' DC A 6 1.157 9.745 3.425 1.00 3.24 H new ATOM 0 H41 DC A 6 1.937 6.310 8.927 1.00 73.32 H new ATOM 0 H42 DC A 6 0.304 6.982 8.975 1.00 73.32 H new ATOM 0 H5 DC A 6 3.505 6.768 7.182 1.00 10.22 H new ATOM 0 H6 DC A 6 3.883 7.960 5.096 1.00 41.11 H new ATOM 188 P DA A 7 3.062 11.997 0.191 1.00 12.42 P ATOM 189 OP1 DA A 7 4.355 11.358 -0.142 1.00 43.23 O ATOM 190 OP2 DA A 7 2.977 13.469 0.067 1.00 12.11 O ATOM 191 O5' DA A 7 1.939 11.355 -0.749 1.00 74.21 O ATOM 192 C5' DA A 7 2.158 10.086 -1.360 1.00 14.32 C ATOM 193 C4' DA A 7 0.838 9.388 -1.599 1.00 63.40 C ATOM 194 O4' DA A 7 0.967 8.021 -1.259 1.00 61.42 O ATOM 195 C3' DA A 7 -0.267 9.777 -0.620 1.00 24.14 C ATOM 196 O3' DA A 7 -1.538 9.528 -1.217 1.00 61.52 O ATOM 197 C2' DA A 7 -0.047 8.915 0.591 1.00 3.01 C ATOM 198 C1' DA A 7 0.344 7.594 -0.068 1.00 71.42 C ATOM 199 N9 DA A 7 1.264 6.778 0.751 1.00 41.33 N ATOM 200 C8 DA A 7 1.170 6.513 2.072 1.00 65.02 C ATOM 201 N7 DA A 7 2.159 5.743 2.512 1.00 61.20 N ATOM 202 C5 DA A 7 2.919 5.513 1.396 1.00 52.10 C ATOM 203 C6 DA A 7 4.103 4.769 1.208 1.00 73.43 C ATOM 204 N6 DA A 7 4.750 4.093 2.190 1.00 25.10 N ATOM 205 N1 DA A 7 4.627 4.731 -0.050 1.00 71.45 N ATOM 206 C2 DA A 7 3.988 5.402 -1.034 1.00 11.11 C ATOM 207 N3 DA A 7 2.862 6.137 -0.968 1.00 50.43 N ATOM 208 C4 DA A 7 2.390 6.136 0.310 1.00 10.43 C ATOM 0 H5' DA A 7 2.793 9.471 -0.722 1.00 14.32 H new ATOM 0 H5'' DA A 7 2.686 10.215 -2.305 1.00 14.32 H new ATOM 0 H4' DA A 7 0.599 9.637 -2.633 1.00 63.40 H new ATOM 0 H3' DA A 7 -0.245 10.833 -0.353 1.00 24.14 H new ATOM 0 H2' DA A 7 0.740 9.303 1.238 1.00 3.01 H new ATOM 0 H2'' DA A 7 -0.945 8.823 1.202 1.00 3.01 H new ATOM 0 H1' DA A 7 -0.515 6.940 -0.218 1.00 71.42 H new ATOM 0 H8 DA A 7 0.377 6.887 2.702 1.00 65.02 H new ATOM 0 H61 DA A 7 5.603 3.576 1.977 1.00 25.10 H new ATOM 0 H62 DA A 7 4.383 4.101 3.142 1.00 25.10 H new ATOM 0 H2 DA A 7 4.445 5.340 -2.011 1.00 11.11 H new ATOM 220 P DG A 8 -2.867 10.104 -0.537 1.00 22.54 P ATOM 221 OP1 DG A 8 -3.464 11.141 -1.410 1.00 1.33 O ATOM 222 OP2 DG A 8 -2.590 10.472 0.869 1.00 3.10 O ATOM 223 O5' DG A 8 -3.846 8.839 -0.533 1.00 2.33 O ATOM 224 C5' DG A 8 -3.357 7.560 -0.129 1.00 54.22 C ATOM 225 C4' DG A 8 -3.328 6.618 -1.311 1.00 42.22 C ATOM 226 O4' DG A 8 -2.285 5.781 -1.047 1.00 43.24 O ATOM 227 C3' DG A 8 -4.474 5.612 -1.344 1.00 13.53 C ATOM 228 O3' DG A 8 -5.499 6.089 -2.215 1.00 14.31 O ATOM 229 C2' DG A 8 -3.868 4.336 -1.852 1.00 0.14 C ATOM 230 C1' DG A 8 -2.489 4.394 -1.201 1.00 71.35 C ATOM 231 N9 DG A 8 -2.423 3.698 0.100 1.00 44.31 N ATOM 232 C8 DG A 8 -3.430 3.500 0.977 1.00 21.05 C ATOM 233 N7 DG A 8 -3.043 2.833 2.059 1.00 52.23 N ATOM 234 C5 DG A 8 -1.711 2.602 1.846 1.00 24.02 C ATOM 235 C6 DG A 8 -0.740 1.941 2.628 1.00 72.44 C ATOM 236 O6 DG A 8 -0.941 1.421 3.724 1.00 43.13 O ATOM 237 N1 DG A 8 0.526 1.876 2.130 1.00 51.14 N ATOM 238 C2 DG A 8 0.776 2.440 0.928 1.00 32.44 C ATOM 239 N2 DG A 8 2.052 2.291 0.580 1.00 54.02 N ATOM 240 N3 DG A 8 -0.066 3.088 0.103 1.00 51.43 N ATOM 241 C4 DG A 8 -1.312 3.120 0.657 1.00 32.44 C ATOM 0 H5' DG A 8 -3.992 7.151 0.657 1.00 54.22 H new ATOM 0 H5'' DG A 8 -2.356 7.661 0.290 1.00 54.22 H new ATOM 0 H4' DG A 8 -3.323 7.232 -2.212 1.00 42.22 H new ATOM 0 H3' DG A 8 -4.934 5.461 -0.368 1.00 13.53 H new ATOM 0 H2' DG A 8 -4.434 3.458 -1.542 1.00 0.14 H new ATOM 0 H2'' DG A 8 -3.810 4.311 -2.940 1.00 0.14 H new ATOM 0 H1' DG A 8 -1.730 3.890 -1.800 1.00 71.35 H new ATOM 0 H8 DG A 8 -4.440 3.846 0.817 1.00 21.05 H new ATOM 0 H1 DG A 8 1.269 1.412 2.653 1.00 51.14 H new ATOM 0 H21 DG A 8 2.386 2.668 -0.307 1.00 54.02 H new ATOM 0 H22 DG A 8 2.696 1.800 1.200 1.00 54.02 H new ATOM 253 P DT A 9 -7.019 5.653 -1.976 1.00 42.24 P ATOM 254 OP1 DT A 9 -7.736 5.615 -3.270 1.00 2.24 O ATOM 255 OP2 DT A 9 -7.608 6.472 -0.892 1.00 13.41 O ATOM 256 O5' DT A 9 -6.883 4.152 -1.442 1.00 65.34 O ATOM 257 C5' DT A 9 -7.379 3.068 -2.224 1.00 13.40 C ATOM 258 C4' DT A 9 -6.256 2.448 -3.023 1.00 22.44 C ATOM 259 O4' DT A 9 -5.474 1.576 -2.235 1.00 12.30 O ATOM 260 C3' DT A 9 -6.710 1.434 -4.069 1.00 74.12 C ATOM 261 O3' DT A 9 -5.711 1.312 -5.078 1.00 64.30 O ATOM 262 C2' DT A 9 -6.898 0.145 -3.318 1.00 73.34 C ATOM 263 C1' DT A 9 -5.701 0.191 -2.373 1.00 1.04 C ATOM 264 N1 DT A 9 -5.959 -0.441 -1.062 1.00 31.15 N ATOM 265 C2 DT A 9 -4.997 -1.283 -0.598 1.00 3.14 C ATOM 266 O2 DT A 9 -3.963 -1.529 -1.201 1.00 32.54 O ATOM 267 N3 DT A 9 -5.235 -1.874 0.622 1.00 72.11 N ATOM 268 C4 DT A 9 -6.367 -1.653 1.363 1.00 51.22 C ATOM 269 O4 DT A 9 -6.476 -2.235 2.442 1.00 2.15 O ATOM 270 C5 DT A 9 -7.342 -0.766 0.833 1.00 72.42 C ATOM 271 C7 DT A 9 -8.608 -0.486 1.605 1.00 60.34 C ATOM 272 C6 DT A 9 -7.090 -0.204 -0.353 1.00 62.24 C ATOM 0 H5' DT A 9 -8.161 3.422 -2.895 1.00 13.40 H new ATOM 0 H5'' DT A 9 -7.831 2.318 -1.575 1.00 13.40 H new ATOM 0 H4' DT A 9 -5.763 3.331 -3.430 1.00 22.44 H new ATOM 0 H3' DT A 9 -7.631 1.728 -4.572 1.00 74.12 H new ATOM 0 H2' DT A 9 -7.847 0.113 -2.783 1.00 73.34 H new ATOM 0 H2'' DT A 9 -6.873 -0.724 -3.975 1.00 73.34 H new ATOM 0 H1' DT A 9 -4.850 -0.368 -2.763 1.00 1.04 H new ATOM 0 H3 DT A 9 -4.531 -2.511 0.995 1.00 72.11 H new ATOM 0 H71 DT A 9 -8.956 0.522 1.380 1.00 60.34 H new ATOM 0 H72 DT A 9 -9.375 -1.207 1.321 1.00 60.34 H new ATOM 0 H73 DT A 9 -8.409 -0.571 2.673 1.00 60.34 H new ATOM 0 H6 DT A 9 -7.823 0.472 -0.767 1.00 62.24 H new ATOM 285 P DG A 10 -5.637 2.379 -6.266 1.00 61.10 P ATOM 286 OP1 DG A 10 -6.047 3.710 -5.767 1.00 43.02 O ATOM 287 OP2 DG A 10 -6.340 1.851 -7.457 1.00 42.52 O ATOM 288 O5' DG A 10 -4.074 2.436 -6.603 1.00 21.00 O ATOM 289 C5' DG A 10 -3.192 3.185 -5.767 1.00 51.53 C ATOM 290 C4' DG A 10 -1.765 3.019 -6.238 1.00 23.41 C ATOM 291 O4' DG A 10 -0.906 2.985 -5.163 1.00 62.03 O ATOM 292 C3' DG A 10 -1.484 1.698 -6.947 1.00 23.23 C ATOM 293 O3' DG A 10 -1.497 1.905 -8.357 1.00 32.44 O ATOM 294 C2' DG A 10 -0.125 1.270 -6.465 1.00 73.43 C ATOM 295 C1' DG A 10 -0.150 1.802 -5.035 1.00 54.22 C ATOM 296 N9 DG A 10 -0.775 0.872 -4.071 1.00 2.13 N ATOM 297 C8 DG A 10 -2.039 0.402 -4.088 1.00 4.12 C ATOM 298 N7 DG A 10 -2.294 -0.424 -3.078 1.00 42.25 N ATOM 299 C5 DG A 10 -1.112 -0.470 -2.387 1.00 53.43 C ATOM 300 C6 DG A 10 -0.739 -1.168 -1.219 1.00 10.11 C ATOM 301 O6 DG A 10 -1.472 -1.914 -0.570 1.00 70.21 O ATOM 302 N1 DG A 10 0.536 -1.005 -0.771 1.00 53.20 N ATOM 303 C2 DG A 10 1.363 -0.190 -1.464 1.00 51.30 C ATOM 304 N2 DG A 10 2.568 -0.135 -0.904 1.00 65.20 N ATOM 305 N3 DG A 10 1.117 0.518 -2.580 1.00 31.44 N ATOM 306 C4 DG A 10 -0.171 0.312 -2.977 1.00 62.42 C ATOM 0 H5' DG A 10 -3.284 2.849 -4.734 1.00 51.53 H new ATOM 0 H5'' DG A 10 -3.469 4.239 -5.785 1.00 51.53 H new ATOM 0 H4' DG A 10 -1.619 3.861 -6.915 1.00 23.41 H new ATOM 0 H3' DG A 10 -2.231 0.934 -6.732 1.00 23.23 H new ATOM 0 H2' DG A 10 0.005 0.188 -6.502 1.00 73.43 H new ATOM 0 H2'' DG A 10 0.680 1.708 -7.055 1.00 73.43 H new ATOM 0 H1' DG A 10 0.853 1.950 -4.635 1.00 54.22 H new ATOM 0 H8 DG A 10 -2.766 0.668 -4.841 1.00 4.12 H new ATOM 0 H1 DG A 10 0.860 -1.486 0.068 1.00 53.20 H new ATOM 0 H21 DG A 10 3.298 0.443 -1.320 1.00 65.20 H new ATOM 0 H22 DG A 10 2.762 -0.671 -0.058 1.00 65.20 H new ATOM 318 P DC A 11 -2.062 0.765 -9.329 1.00 15.22 P ATOM 319 OP1 DC A 11 -2.335 1.340 -10.664 1.00 11.33 O ATOM 320 OP2 DC A 11 -3.166 0.042 -8.657 1.00 2.34 O ATOM 321 O5' DC A 11 -0.823 -0.237 -9.464 1.00 72.32 O ATOM 322 C5' DC A 11 0.497 0.277 -9.625 1.00 41.24 C ATOM 323 C4' DC A 11 1.512 -0.741 -9.156 1.00 24.53 C ATOM 324 O4' DC A 11 1.248 -1.132 -7.828 1.00 3.31 O ATOM 325 C3' DC A 11 1.436 -2.084 -9.877 1.00 13.05 C ATOM 326 O3' DC A 11 2.740 -2.652 -9.958 1.00 23.03 O ATOM 327 C2' DC A 11 0.516 -2.930 -9.042 1.00 31.33 C ATOM 328 C1' DC A 11 0.919 -2.489 -7.638 1.00 1.11 C ATOM 329 N1 DC A 11 -0.160 -2.644 -6.638 1.00 0.32 N ATOM 330 C2 DC A 11 0.116 -3.402 -5.501 1.00 11.35 C ATOM 331 O2 DC A 11 1.239 -3.905 -5.383 1.00 41.14 O ATOM 332 N3 DC A 11 -0.849 -3.557 -4.578 1.00 73.12 N ATOM 333 C4 DC A 11 -2.041 -3.013 -4.721 1.00 42.31 C ATOM 334 N4 DC A 11 -2.981 -3.178 -3.798 1.00 4.13 N ATOM 335 C5 DC A 11 -2.352 -2.223 -5.890 1.00 24.12 C ATOM 336 C6 DC A 11 -1.378 -2.079 -6.803 1.00 73.52 C ATOM 0 H5' DC A 11 0.608 1.201 -9.057 1.00 41.24 H new ATOM 0 H5'' DC A 11 0.675 0.523 -10.672 1.00 41.24 H new ATOM 0 H4' DC A 11 2.463 -0.234 -9.323 1.00 24.53 H new ATOM 0 H3' DC A 11 1.065 -1.998 -10.898 1.00 13.05 H new ATOM 0 H2' DC A 11 -0.535 -2.730 -9.253 1.00 31.33 H new ATOM 0 H2'' DC A 11 0.676 -3.996 -9.202 1.00 31.33 H new ATOM 0 H1' DC A 11 1.729 -3.096 -7.234 1.00 1.11 H new ATOM 0 H41 DC A 11 -3.899 -2.751 -3.923 1.00 4.13 H new ATOM 0 H42 DC A 11 -2.785 -3.732 -2.964 1.00 4.13 H new ATOM 0 H5 DC A 11 -3.323 -1.769 -6.023 1.00 24.12 H new ATOM 0 H6 DC A 11 -1.572 -1.497 -7.692 1.00 73.52 H new ATOM 348 P DC A 12 3.100 -3.665 -11.145 1.00 65.13 P ATOM 349 OP1 DC A 12 4.164 -3.079 -11.992 1.00 5.33 O ATOM 350 OP2 DC A 12 1.858 -4.105 -11.817 1.00 2.50 O ATOM 351 O5' DC A 12 3.718 -4.921 -10.371 1.00 51.11 O ATOM 352 C5' DC A 12 4.754 -4.728 -9.409 1.00 32.23 C ATOM 353 C4' DC A 12 4.649 -5.768 -8.317 1.00 24.55 C ATOM 354 O4' DC A 12 3.384 -5.686 -7.699 1.00 54.00 O ATOM 355 C3' DC A 12 4.713 -7.210 -8.813 1.00 52.55 C ATOM 356 O3' DC A 12 5.563 -7.973 -7.941 1.00 13.32 O ATOM 357 C2' DC A 12 3.294 -7.707 -8.774 1.00 5.14 C ATOM 358 C1' DC A 12 2.758 -6.944 -7.567 1.00 64.44 C ATOM 359 N1 DC A 12 1.286 -6.811 -7.559 1.00 64.05 N ATOM 360 C2 DC A 12 0.624 -7.012 -6.348 1.00 31.33 C ATOM 361 O2 DC A 12 1.293 -7.289 -5.347 1.00 3.32 O ATOM 362 N3 DC A 12 -0.715 -6.897 -6.316 1.00 35.01 N ATOM 363 C4 DC A 12 -1.412 -6.599 -7.393 1.00 35.13 C ATOM 364 N4 DC A 12 -2.735 -6.490 -7.341 1.00 4.10 N ATOM 365 C5 DC A 12 -0.751 -6.386 -8.660 1.00 53.14 C ATOM 366 C6 DC A 12 0.585 -6.505 -8.676 1.00 71.01 C ATOM 0 H5' DC A 12 4.680 -3.729 -8.979 1.00 32.23 H new ATOM 0 H5'' DC A 12 5.728 -4.795 -9.894 1.00 32.23 H new ATOM 0 H4' DC A 12 5.494 -5.554 -7.662 1.00 24.55 H new ATOM 0 H3' DC A 12 5.126 -7.297 -9.818 1.00 52.55 H new ATOM 0 H2' DC A 12 2.748 -7.471 -9.688 1.00 5.14 H new ATOM 0 H2'' DC A 12 3.238 -8.787 -8.639 1.00 5.14 H new ATOM 0 HO3' DC A 12 5.606 -8.900 -8.255 1.00 13.32 H new ATOM 0 H1' DC A 12 2.972 -7.457 -6.629 1.00 64.44 H new ATOM 0 H41 DC A 12 -3.261 -6.259 -8.184 1.00 4.10 H new ATOM 0 H42 DC A 12 -3.225 -6.638 -6.458 1.00 4.10 H new ATOM 0 H5 DC A 12 -1.307 -6.142 -9.553 1.00 53.14 H new ATOM 0 H6 DC A 12 1.115 -6.353 -9.604 1.00 71.01 H new TER 379 DC A 12