USER MOD reduce.3.24.130724 H: found=0, std=0, add=127, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 127 hydrogens (12 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 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 1 DT O5' : rot 180:sc= -0.0538 USER MOD Single : A 3 DT C7 :methyl 150:sc= -2.01 (180deg=-2.01) USER MOD Single : A 10 DT C7 :methyl 150:sc= -2.03 (180deg=-2.03) USER MOD Single : A 11 DA O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DT A 1 -8.972 11.749 -4.263 1.00 0.00 O ATOM 2 C5' DT A 1 -7.668 11.899 -3.691 1.00 0.00 C ATOM 3 C4' DT A 1 -6.653 11.051 -4.420 1.00 0.00 C ATOM 4 O4' DT A 1 -5.449 10.981 -3.620 1.00 0.00 O ATOM 5 C3' DT A 1 -7.084 9.602 -4.675 1.00 0.00 C ATOM 6 O3' DT A 1 -6.839 9.249 -6.042 1.00 0.00 O ATOM 7 C2' DT A 1 -6.198 8.787 -3.748 1.00 0.00 C ATOM 8 C1' DT A 1 -4.966 9.656 -3.633 1.00 0.00 C ATOM 9 N1 DT A 1 -4.168 9.447 -2.409 1.00 0.00 N ATOM 10 C2 DT A 1 -2.862 9.033 -2.547 1.00 0.00 C ATOM 11 O2 DT A 1 -2.335 8.837 -3.629 1.00 0.00 O ATOM 12 N3 DT A 1 -2.191 8.855 -1.367 1.00 0.00 N ATOM 13 C4 DT A 1 -2.680 9.047 -0.093 1.00 0.00 C ATOM 14 O4 DT A 1 -1.954 8.838 0.875 1.00 0.00 O ATOM 15 C5 DT A 1 -4.055 9.486 -0.019 1.00 0.00 C ATOM 16 C7 DT A 1 -4.665 9.739 1.326 1.00 0.00 C ATOM 17 C6 DT A 1 -4.727 9.663 -1.166 1.00 0.00 C ATOM 0 H5' DT A 1 -7.694 11.616 -2.639 1.00 0.00 H new ATOM 0 H5'' DT A 1 -7.368 12.946 -3.732 1.00 0.00 H new ATOM 0 H4' DT A 1 -6.518 11.532 -5.389 1.00 0.00 H new ATOM 0 H3' DT A 1 -8.146 9.435 -4.493 1.00 0.00 H new ATOM 0 H2' DT A 1 -6.669 8.619 -2.779 1.00 0.00 H new ATOM 0 H2'' DT A 1 -5.967 7.807 -4.165 1.00 0.00 H new ATOM 0 HO5' DT A 1 -9.611 12.307 -3.772 1.00 0.00 H new ATOM 0 H1' DT A 1 -4.298 9.414 -4.459 1.00 0.00 H new ATOM 0 H3 DT A 1 -1.222 8.546 -1.439 1.00 0.00 H new ATOM 0 H71 DT A 1 -5.425 10.515 1.241 1.00 0.00 H new ATOM 0 H72 DT A 1 -5.123 8.822 1.696 1.00 0.00 H new ATOM 0 H73 DT A 1 -3.891 10.064 2.021 1.00 0.00 H new ATOM 0 H6 DT A 1 -5.755 9.990 -1.114 1.00 0.00 H new ATOM 31 P DA A 2 -7.235 7.784 -6.575 1.00 0.00 P ATOM 32 OP1 DA A 2 -7.806 7.928 -7.939 1.00 0.00 O ATOM 33 OP2 DA A 2 -8.030 7.110 -5.516 1.00 0.00 O ATOM 34 O5' DA A 2 -5.838 7.028 -6.696 1.00 0.00 O ATOM 35 C5' DA A 2 -4.813 7.515 -7.564 1.00 0.00 C ATOM 36 C4' DA A 2 -3.573 6.660 -7.446 1.00 0.00 C ATOM 37 O4' DA A 2 -3.009 6.833 -6.122 1.00 0.00 O ATOM 38 C3' DA A 2 -3.798 5.153 -7.620 1.00 0.00 C ATOM 39 O3' DA A 2 -2.782 4.596 -8.462 1.00 0.00 O ATOM 40 C2' DA A 2 -3.682 4.603 -6.209 1.00 0.00 C ATOM 41 C1' DA A 2 -2.705 5.567 -5.571 1.00 0.00 C ATOM 42 N9 DA A 2 -2.805 5.673 -4.116 1.00 0.00 N ATOM 43 C8 DA A 2 -3.900 6.022 -3.367 1.00 0.00 C ATOM 44 N7 DA A 2 -3.674 6.037 -2.075 1.00 0.00 N ATOM 45 C5 DA A 2 -2.340 5.668 -1.967 1.00 0.00 C ATOM 46 C6 DA A 2 -1.492 5.495 -0.859 1.00 0.00 C ATOM 47 N6 DA A 2 -1.877 5.677 0.406 1.00 0.00 N ATOM 48 N1 DA A 2 -0.217 5.121 -1.097 1.00 0.00 N ATOM 49 C2 DA A 2 0.171 4.937 -2.366 1.00 0.00 C ATOM 50 N3 DA A 2 -0.532 5.068 -3.488 1.00 0.00 N ATOM 51 C4 DA A 2 -1.794 5.440 -3.216 1.00 0.00 C ATOM 0 H5' DA A 2 -4.575 8.549 -7.312 1.00 0.00 H new ATOM 0 H5'' DA A 2 -5.168 7.512 -8.594 1.00 0.00 H new ATOM 0 H4' DA A 2 -2.924 6.994 -8.256 1.00 0.00 H new ATOM 0 H3' DA A 2 -4.754 4.915 -8.086 1.00 0.00 H new ATOM 0 H2' DA A 2 -4.643 4.596 -5.694 1.00 0.00 H new ATOM 0 H2'' DA A 2 -3.309 3.579 -6.200 1.00 0.00 H new ATOM 0 H1' DA A 2 -1.696 5.207 -5.771 1.00 0.00 H new ATOM 0 H8 DA A 2 -4.859 6.262 -3.801 1.00 0.00 H new ATOM 0 H61 DA A 2 -1.213 5.535 1.167 1.00 0.00 H new ATOM 0 H62 DA A 2 -2.836 5.958 0.612 1.00 0.00 H new ATOM 0 H2 DA A 2 1.201 4.640 -2.497 1.00 0.00 H new ATOM 63 P DT A 3 -2.927 3.089 -9.004 1.00 0.00 P ATOM 64 OP1 DT A 3 -2.459 3.059 -10.413 1.00 0.00 O ATOM 65 OP2 DT A 3 -4.296 2.614 -8.677 1.00 0.00 O ATOM 66 O5' DT A 3 -1.893 2.260 -8.118 1.00 0.00 O ATOM 67 C5' DT A 3 -0.494 2.267 -8.415 1.00 0.00 C ATOM 68 C4' DT A 3 0.239 1.321 -7.495 1.00 0.00 C ATOM 69 O4' DT A 3 0.117 1.812 -6.140 1.00 0.00 O ATOM 70 C3' DT A 3 -0.300 -0.114 -7.485 1.00 0.00 C ATOM 71 O3' DT A 3 0.761 -1.049 -7.698 1.00 0.00 O ATOM 72 C2' DT A 3 -0.881 -0.291 -6.092 1.00 0.00 C ATOM 73 C1' DT A 3 -0.112 0.723 -5.274 1.00 0.00 C ATOM 74 N1 DT A 3 -0.827 1.229 -4.089 1.00 0.00 N ATOM 75 C2 DT A 3 -0.182 1.195 -2.876 1.00 0.00 C ATOM 76 O2 DT A 3 0.951 0.767 -2.734 1.00 0.00 O ATOM 77 N3 DT A 3 -0.912 1.681 -1.826 1.00 0.00 N ATOM 78 C4 DT A 3 -2.195 2.183 -1.863 1.00 0.00 C ATOM 79 O4 DT A 3 -2.722 2.580 -0.829 1.00 0.00 O ATOM 80 C5 DT A 3 -2.816 2.190 -3.168 1.00 0.00 C ATOM 81 C7 DT A 3 -4.220 2.693 -3.300 1.00 0.00 C ATOM 82 C6 DT A 3 -2.112 1.720 -4.207 1.00 0.00 C ATOM 0 H5' DT A 3 -0.096 3.276 -8.303 1.00 0.00 H new ATOM 0 H5'' DT A 3 -0.334 1.974 -9.453 1.00 0.00 H new ATOM 0 H4' DT A 3 1.263 1.288 -7.866 1.00 0.00 H new ATOM 0 H3' DT A 3 -1.035 -0.285 -8.272 1.00 0.00 H new ATOM 0 H2' DT A 3 -1.953 -0.096 -6.074 1.00 0.00 H new ATOM 0 H2'' DT A 3 -0.735 -1.305 -5.719 1.00 0.00 H new ATOM 0 H1' DT A 3 0.788 0.240 -4.894 1.00 0.00 H new ATOM 0 H3 DT A 3 -0.456 1.671 -0.914 1.00 0.00 H new ATOM 0 H71 DT A 3 -4.359 3.130 -4.289 1.00 0.00 H new ATOM 0 H72 DT A 3 -4.917 1.865 -3.168 1.00 0.00 H new ATOM 0 H73 DT A 3 -4.408 3.451 -2.539 1.00 0.00 H new ATOM 0 H6 DT A 3 -2.572 1.726 -5.184 1.00 0.00 H new ATOM 95 P DC A 4 0.460 -2.432 -8.461 1.00 0.00 P ATOM 96 OP1 DC A 4 1.744 -3.160 -8.629 1.00 0.00 O ATOM 97 OP2 DC A 4 -0.360 -2.110 -9.657 1.00 0.00 O ATOM 98 O5' DC A 4 -0.459 -3.246 -7.444 1.00 0.00 O ATOM 99 C5' DC A 4 0.018 -4.426 -6.791 1.00 0.00 C ATOM 100 C4' DC A 4 1.112 -4.083 -5.807 1.00 0.00 C ATOM 101 O4' DC A 4 0.691 -2.956 -4.998 1.00 0.00 O ATOM 102 C3' DC A 4 1.443 -5.203 -4.818 1.00 0.00 C ATOM 103 O3' DC A 4 2.839 -5.200 -4.500 1.00 0.00 O ATOM 104 C2' DC A 4 0.612 -4.840 -3.603 1.00 0.00 C ATOM 105 C1' DC A 4 0.664 -3.327 -3.628 1.00 0.00 C ATOM 106 N1 DC A 4 -0.493 -2.670 -2.999 1.00 0.00 N ATOM 107 C2 DC A 4 -0.369 -2.196 -1.689 1.00 0.00 C ATOM 108 O2 DC A 4 0.713 -2.332 -1.100 1.00 0.00 O ATOM 109 N3 DC A 4 -1.431 -1.602 -1.099 1.00 0.00 N ATOM 110 C4 DC A 4 -2.577 -1.470 -1.767 1.00 0.00 C ATOM 111 N4 DC A 4 -3.595 -0.876 -1.145 1.00 0.00 N ATOM 112 C5 DC A 4 -2.731 -1.940 -3.104 1.00 0.00 C ATOM 113 C6 DC A 4 -1.673 -2.529 -3.674 1.00 0.00 C ATOM 0 H5' DC A 4 0.395 -5.131 -7.532 1.00 0.00 H new ATOM 0 H5'' DC A 4 -0.804 -4.919 -6.272 1.00 0.00 H new ATOM 0 H4' DC A 4 1.993 -3.883 -6.417 1.00 0.00 H new ATOM 0 H3' DC A 4 1.227 -6.199 -5.204 1.00 0.00 H new ATOM 0 H2' DC A 4 -0.409 -5.215 -3.680 1.00 0.00 H new ATOM 0 H2'' DC A 4 1.033 -5.248 -2.684 1.00 0.00 H new ATOM 0 H1' DC A 4 1.538 -3.009 -3.060 1.00 0.00 H new ATOM 0 H41 DC A 4 -4.487 -0.758 -1.625 1.00 0.00 H new ATOM 0 H42 DC A 4 -3.482 -0.540 -0.189 1.00 0.00 H new ATOM 0 H5 DC A 4 -3.664 -1.825 -3.636 1.00 0.00 H new ATOM 0 H6 DC A 4 -1.753 -2.899 -4.685 1.00 0.00 H new ATOM 125 P DA A 5 3.565 -6.572 -4.075 1.00 0.00 P ATOM 126 OP1 DA A 5 4.974 -6.247 -3.737 1.00 0.00 O ATOM 127 OP2 DA A 5 3.277 -7.593 -5.115 1.00 0.00 O ATOM 128 O5' DA A 5 2.818 -7.005 -2.735 1.00 0.00 O ATOM 129 C5' DA A 5 3.117 -6.376 -1.487 1.00 0.00 C ATOM 130 C4' DA A 5 2.208 -6.906 -0.403 1.00 0.00 C ATOM 131 O4' DA A 5 0.891 -6.322 -0.569 1.00 0.00 O ATOM 132 C3' DA A 5 1.999 -8.423 -0.414 1.00 0.00 C ATOM 133 O3' DA A 5 1.995 -8.922 0.926 1.00 0.00 O ATOM 134 C2' DA A 5 0.632 -8.587 -1.052 1.00 0.00 C ATOM 135 C1' DA A 5 -0.083 -7.349 -0.558 1.00 0.00 C ATOM 136 N9 DA A 5 -1.211 -6.914 -1.381 1.00 0.00 N ATOM 137 C8 DA A 5 -1.373 -7.038 -2.739 1.00 0.00 C ATOM 138 N7 DA A 5 -2.510 -6.556 -3.182 1.00 0.00 N ATOM 139 C5 DA A 5 -3.136 -6.079 -2.038 1.00 0.00 C ATOM 140 C6 DA A 5 -4.376 -5.449 -1.830 1.00 0.00 C ATOM 141 N6 DA A 5 -5.247 -5.182 -2.805 1.00 0.00 N ATOM 142 N1 DA A 5 -4.698 -5.099 -0.566 1.00 0.00 N ATOM 143 C2 DA A 5 -3.827 -5.372 0.416 1.00 0.00 C ATOM 144 N3 DA A 5 -2.636 -5.959 0.345 1.00 0.00 N ATOM 145 C4 DA A 5 -2.347 -6.292 -0.924 1.00 0.00 C ATOM 0 H5' DA A 5 2.996 -5.297 -1.578 1.00 0.00 H new ATOM 0 H5'' DA A 5 4.158 -6.558 -1.220 1.00 0.00 H new ATOM 0 H4' DA A 5 2.702 -6.642 0.532 1.00 0.00 H new ATOM 0 H3' DA A 5 2.780 -8.966 -0.947 1.00 0.00 H new ATOM 0 H2' DA A 5 0.689 -8.621 -2.140 1.00 0.00 H new ATOM 0 H2'' DA A 5 0.136 -9.503 -0.730 1.00 0.00 H new ATOM 0 H1' DA A 5 -0.508 -7.572 0.421 1.00 0.00 H new ATOM 0 H8 DA A 5 -0.633 -7.490 -3.383 1.00 0.00 H new ATOM 0 H61 DA A 5 -6.131 -4.722 -2.587 1.00 0.00 H new ATOM 0 H62 DA A 5 -5.029 -5.438 -3.768 1.00 0.00 H new ATOM 0 H2 DA A 5 -4.137 -5.072 1.406 1.00 0.00 H new HETATM 157 P 0DT A 6 2.178 -10.496 1.194 1.00 0.00 P HETATM 158 OP1 0DT A 6 3.484 -10.701 1.868 1.00 0.00 O HETATM 159 OP2 0DT A 6 1.885 -11.217 -0.072 1.00 0.00 O HETATM 160 O5' 0DT A 6 1.021 -10.836 2.235 1.00 0.00 O HETATM 161 C5' 0DT A 6 0.394 -9.803 2.998 1.00 0.00 C HETATM 162 C4' 0DT A 6 -0.173 -10.371 4.280 1.00 0.00 C HETATM 163 O4' 0DT A 6 -0.428 -11.781 4.096 1.00 0.00 O HETATM 164 C3' 0DT A 6 -1.506 -9.784 4.732 1.00 0.00 C HETATM 165 O3' 0DT A 6 -1.644 -9.895 6.155 1.00 0.00 O HETATM 166 C2' 0DT A 6 -2.524 -10.660 4.021 1.00 0.00 C HETATM 167 C1' 0DT A 6 -1.814 -12.002 3.863 1.00 0.00 C HETATM 168 N1 0DT A 6 -1.957 -12.615 2.526 1.00 0.00 N HETATM 169 C2 0DT A 6 -2.456 -13.897 2.451 1.00 0.00 C HETATM 170 O2 0DT A 6 -2.763 -14.550 3.434 1.00 0.00 O HETATM 171 N3 0DT A 6 -2.582 -14.391 1.183 1.00 0.00 N HETATM 172 C4 0DT A 6 -2.269 -13.753 0.003 1.00 0.00 C HETATM 173 O4 0DT A 6 -2.454 -14.324 -1.067 1.00 0.00 O HETATM 174 C5 0DT A 6 -1.743 -12.413 0.147 1.00 0.00 C HETATM 175 C5M 0DT A 6 -1.414 -11.628 -1.085 1.00 0.00 C HETATM 176 C6 0DT A 6 -1.608 -11.914 1.385 1.00 0.00 C HETATM 0 H5'' 0DT A 6 1.117 -9.020 3.227 1.00 0.00 H new HETATM 0 H2'' 0DT A 6 -3.440 -10.760 4.603 1.00 0.00 H new HETATM 0 H73 0DT A 6 -0.657 -12.158 -1.663 1.00 0.00 H new HETATM 0 H72 0DT A 6 -2.313 -11.506 -1.689 1.00 0.00 H new HETATM 0 H71 0DT A 6 -1.032 -10.648 -0.801 1.00 0.00 H new HETATM 0 H6 0DT A 6 -1.204 -10.908 1.498 1.00 0.00 H new HETATM 0 H5' 0DT A 6 -0.401 -9.341 2.413 1.00 0.00 H new HETATM 0 H4' 0DT A 6 0.577 -10.132 5.034 1.00 0.00 H new HETATM 0 H3' 0DT A 6 -1.616 -8.725 4.499 1.00 0.00 H new HETATM 0 H3 0DT A 6 -2.949 -15.339 1.101 1.00 0.00 H new HETATM 0 H2' 0DT A 6 -2.805 -10.241 3.055 1.00 0.00 H new HETATM 0 H1' 0DT A 6 -2.273 -12.691 4.572 1.00 0.00 H new ATOM 189 P DC A 7 -2.788 -9.059 6.918 1.00 0.00 P ATOM 190 OP1 DC A 7 -3.326 -9.929 7.997 1.00 0.00 O ATOM 191 OP2 DC A 7 -3.715 -8.489 5.906 1.00 0.00 O ATOM 192 O5' DC A 7 -1.999 -7.852 7.599 1.00 0.00 O ATOM 193 C5' DC A 7 -1.631 -7.898 8.979 1.00 0.00 C ATOM 194 C4' DC A 7 -1.040 -6.575 9.411 1.00 0.00 C ATOM 195 O4' DC A 7 0.006 -6.197 8.485 1.00 0.00 O ATOM 196 C3' DC A 7 -2.016 -5.400 9.431 1.00 0.00 C ATOM 197 O3' DC A 7 -1.649 -4.476 10.464 1.00 0.00 O ATOM 198 C2' DC A 7 -1.838 -4.781 8.057 1.00 0.00 C ATOM 199 C1' DC A 7 -0.369 -5.036 7.753 1.00 0.00 C ATOM 200 N1 DC A 7 -0.064 -5.288 6.334 1.00 0.00 N ATOM 201 C2 DC A 7 1.133 -4.795 5.801 1.00 0.00 C ATOM 202 O2 DC A 7 1.888 -4.136 6.530 1.00 0.00 O ATOM 203 N3 DC A 7 1.433 -5.048 4.507 1.00 0.00 N ATOM 204 C4 DC A 7 0.593 -5.759 3.753 1.00 0.00 C ATOM 205 N4 DC A 7 0.935 -5.989 2.485 1.00 0.00 N ATOM 206 C5 DC A 7 -0.635 -6.267 4.267 1.00 0.00 C ATOM 207 C6 DC A 7 -0.925 -6.003 5.548 1.00 0.00 C ATOM 0 H5' DC A 7 -0.908 -8.697 9.143 1.00 0.00 H new ATOM 0 H5'' DC A 7 -2.505 -8.129 9.588 1.00 0.00 H new ATOM 0 H4' DC A 7 -0.697 -6.749 10.431 1.00 0.00 H new ATOM 0 H3' DC A 7 -3.048 -5.689 9.633 1.00 0.00 H new ATOM 0 H2' DC A 7 -2.490 -5.246 7.317 1.00 0.00 H new ATOM 0 H2'' DC A 7 -2.070 -3.716 8.061 1.00 0.00 H new ATOM 0 H1' DC A 7 0.176 -4.133 8.027 1.00 0.00 H new ATOM 0 H41 DC A 7 0.316 -6.529 1.880 1.00 0.00 H new ATOM 0 H42 DC A 7 1.815 -5.625 2.120 1.00 0.00 H new ATOM 0 H5 DC A 7 -1.306 -6.843 3.647 1.00 0.00 H new ATOM 0 H6 DC A 7 -1.854 -6.361 5.967 1.00 0.00 H new ATOM 219 P DG A 8 -2.629 -3.255 10.832 1.00 0.00 P ATOM 220 OP1 DG A 8 -1.991 -2.461 11.913 1.00 0.00 O ATOM 221 OP2 DG A 8 -3.990 -3.816 11.043 1.00 0.00 O ATOM 222 O5' DG A 8 -2.657 -2.374 9.503 1.00 0.00 O ATOM 223 C5' DG A 8 -1.867 -1.191 9.384 1.00 0.00 C ATOM 224 C4' DG A 8 -0.481 -1.534 8.888 1.00 0.00 C ATOM 225 O4' DG A 8 -0.578 -2.109 7.563 1.00 0.00 O ATOM 226 C3' DG A 8 0.458 -0.339 8.748 1.00 0.00 C ATOM 227 O3' DG A 8 1.816 -0.734 8.971 1.00 0.00 O ATOM 228 C2' DG A 8 0.253 0.093 7.308 1.00 0.00 C ATOM 229 C1' DG A 8 -0.076 -1.204 6.585 1.00 0.00 C ATOM 230 N9 DG A 8 -1.095 -1.050 5.553 1.00 0.00 N ATOM 231 C8 DG A 8 -2.398 -0.674 5.752 1.00 0.00 C ATOM 232 N7 DG A 8 -3.090 -0.602 4.650 1.00 0.00 N ATOM 233 C5 DG A 8 -2.187 -0.957 3.656 1.00 0.00 C ATOM 234 C6 DG A 8 -2.361 -1.059 2.253 1.00 0.00 C ATOM 235 O6 DG A 8 -3.380 -0.848 1.588 1.00 0.00 O ATOM 236 N1 DG A 8 -1.188 -1.452 1.618 1.00 0.00 N ATOM 237 C2 DG A 8 0.002 -1.711 2.254 1.00 0.00 C ATOM 238 N2 DG A 8 1.021 -2.079 1.469 1.00 0.00 N ATOM 239 N3 DG A 8 0.179 -1.618 3.562 1.00 0.00 N ATOM 240 C4 DG A 8 -0.950 -1.239 4.197 1.00 0.00 C ATOM 0 H5' DG A 8 -1.801 -0.690 10.350 1.00 0.00 H new ATOM 0 H5'' DG A 8 -2.345 -0.494 8.696 1.00 0.00 H new ATOM 0 H4' DG A 8 -0.073 -2.211 9.638 1.00 0.00 H new ATOM 0 H3' DG A 8 0.255 0.455 9.467 1.00 0.00 H new ATOM 0 H2' DG A 8 -0.557 0.817 7.219 1.00 0.00 H new ATOM 0 H2'' DG A 8 1.148 0.563 6.900 1.00 0.00 H new ATOM 0 H1' DG A 8 0.830 -1.554 6.091 1.00 0.00 H new ATOM 0 H8 DG A 8 -2.811 -0.459 6.726 1.00 0.00 H new ATOM 0 H1 DG A 8 -1.213 -1.556 0.604 1.00 0.00 H new ATOM 0 H21 DG A 8 1.932 -2.286 1.879 1.00 0.00 H new ATOM 0 H22 DG A 8 0.887 -2.153 0.461 1.00 0.00 H new ATOM 252 P DA A 9 2.961 0.389 9.112 1.00 0.00 P ATOM 253 OP1 DA A 9 3.975 -0.097 10.082 1.00 0.00 O ATOM 254 OP2 DA A 9 2.292 1.694 9.344 1.00 0.00 O ATOM 255 O5' DA A 9 3.634 0.441 7.667 1.00 0.00 O ATOM 256 C5' DA A 9 4.390 -0.665 7.168 1.00 0.00 C ATOM 257 C4' DA A 9 4.866 -0.382 5.761 1.00 0.00 C ATOM 258 O4' DA A 9 3.715 -0.301 4.884 1.00 0.00 O ATOM 259 C3' DA A 9 5.626 0.937 5.583 1.00 0.00 C ATOM 260 O3' DA A 9 6.760 0.733 4.729 1.00 0.00 O ATOM 261 C2' DA A 9 4.606 1.851 4.927 1.00 0.00 C ATOM 262 C1' DA A 9 3.799 0.874 4.102 1.00 0.00 C ATOM 263 N9 DA A 9 2.439 1.308 3.788 1.00 0.00 N ATOM 264 C8 DA A 9 1.504 1.855 4.633 1.00 0.00 C ATOM 265 N7 DA A 9 0.368 2.145 4.048 1.00 0.00 N ATOM 266 C5 DA A 9 0.567 1.765 2.727 1.00 0.00 C ATOM 267 C6 DA A 9 -0.259 1.814 1.593 1.00 0.00 C ATOM 268 N6 DA A 9 -1.507 2.286 1.604 1.00 0.00 N ATOM 269 N1 DA A 9 0.247 1.355 0.428 1.00 0.00 N ATOM 270 C2 DA A 9 1.500 0.879 0.416 1.00 0.00 C ATOM 271 N3 DA A 9 2.372 0.783 1.413 1.00 0.00 N ATOM 272 C4 DA A 9 1.839 1.248 2.555 1.00 0.00 C ATOM 0 H5' DA A 9 3.778 -1.567 7.178 1.00 0.00 H new ATOM 0 H5'' DA A 9 5.245 -0.853 7.818 1.00 0.00 H new ATOM 0 H4' DA A 9 5.551 -1.197 5.527 1.00 0.00 H new ATOM 0 H3' DA A 9 6.012 1.348 6.516 1.00 0.00 H new ATOM 0 H2' DA A 9 3.991 2.371 5.662 1.00 0.00 H new ATOM 0 H2'' DA A 9 5.079 2.614 4.309 1.00 0.00 H new ATOM 0 H1' DA A 9 4.296 0.752 3.139 1.00 0.00 H new ATOM 0 H8 DA A 9 1.688 2.030 5.683 1.00 0.00 H new ATOM 0 H61 DA A 9 -2.057 2.294 0.745 1.00 0.00 H new ATOM 0 H62 DA A 9 -1.911 2.638 2.472 1.00 0.00 H new ATOM 0 H2 DA A 9 1.851 0.523 -0.541 1.00 0.00 H new ATOM 284 P DT A 10 7.636 1.992 4.241 1.00 0.00 P ATOM 285 OP1 DT A 10 9.053 1.560 4.159 1.00 0.00 O ATOM 286 OP2 DT A 10 7.274 3.162 5.086 1.00 0.00 O ATOM 287 O5' DT A 10 7.114 2.272 2.762 1.00 0.00 O ATOM 288 C5' DT A 10 7.149 1.249 1.764 1.00 0.00 C ATOM 289 C4' DT A 10 6.782 1.820 0.414 1.00 0.00 C ATOM 290 O4' DT A 10 5.362 2.108 0.398 1.00 0.00 O ATOM 291 C3' DT A 10 7.487 3.129 0.046 1.00 0.00 C ATOM 292 O3' DT A 10 7.895 3.100 -1.327 1.00 0.00 O ATOM 293 C2' DT A 10 6.420 4.188 0.266 1.00 0.00 C ATOM 294 C1' DT A 10 5.147 3.433 -0.051 1.00 0.00 C ATOM 295 N1 DT A 10 3.939 3.951 0.619 1.00 0.00 N ATOM 296 C2 DT A 10 2.841 4.246 -0.158 1.00 0.00 C ATOM 297 O2 DT A 10 2.819 4.096 -1.368 1.00 0.00 O ATOM 298 N3 DT A 10 1.763 4.724 0.537 1.00 0.00 N ATOM 299 C4 DT A 10 1.670 4.932 1.895 1.00 0.00 C ATOM 300 O4 DT A 10 0.626 5.364 2.376 1.00 0.00 O ATOM 301 C5 DT A 10 2.857 4.603 2.651 1.00 0.00 C ATOM 302 C7 DT A 10 2.852 4.811 4.134 1.00 0.00 C ATOM 303 C6 DT A 10 3.923 4.134 1.986 1.00 0.00 C ATOM 0 H5' DT A 10 6.457 0.450 2.029 1.00 0.00 H new ATOM 0 H5'' DT A 10 8.145 0.807 1.721 1.00 0.00 H new ATOM 0 H4' DT A 10 7.092 1.063 -0.306 1.00 0.00 H new ATOM 0 H3' DT A 10 8.387 3.311 0.634 1.00 0.00 H new ATOM 0 H2' DT A 10 6.426 4.565 1.289 1.00 0.00 H new ATOM 0 H2'' DT A 10 6.558 5.047 -0.391 1.00 0.00 H new ATOM 0 H1' DT A 10 4.957 3.527 -1.120 1.00 0.00 H new ATOM 0 H3 DT A 10 0.935 4.952 -0.013 1.00 0.00 H new ATOM 0 H71 DT A 10 3.512 4.083 4.606 1.00 0.00 H new ATOM 0 H72 DT A 10 3.201 5.818 4.361 1.00 0.00 H new ATOM 0 H73 DT A 10 1.839 4.683 4.516 1.00 0.00 H new ATOM 0 H6 DT A 10 4.812 3.888 2.548 1.00 0.00 H new ATOM 316 P DA A 11 8.742 4.325 -1.936 1.00 0.00 P ATOM 317 OP1 DA A 11 9.734 3.751 -2.880 1.00 0.00 O ATOM 318 OP2 DA A 11 9.206 5.186 -0.817 1.00 0.00 O ATOM 319 O5' DA A 11 7.670 5.145 -2.784 1.00 0.00 O ATOM 320 C5' DA A 11 6.960 4.533 -3.862 1.00 0.00 C ATOM 321 C4' DA A 11 6.266 5.584 -4.696 1.00 0.00 C ATOM 322 O4' DA A 11 4.971 5.865 -4.108 1.00 0.00 O ATOM 323 C3' DA A 11 6.987 6.932 -4.774 1.00 0.00 C ATOM 324 O3' DA A 11 6.793 7.543 -6.051 1.00 0.00 O ATOM 325 C2' DA A 11 6.311 7.747 -3.688 1.00 0.00 C ATOM 326 C1' DA A 11 4.884 7.236 -3.754 1.00 0.00 C ATOM 327 N9 DA A 11 4.139 7.328 -2.498 1.00 0.00 N ATOM 328 C8 DA A 11 4.611 7.161 -1.219 1.00 0.00 C ATOM 329 N7 DA A 11 3.695 7.312 -0.293 1.00 0.00 N ATOM 330 C5 DA A 11 2.541 7.598 -1.010 1.00 0.00 C ATOM 331 C6 DA A 11 1.220 7.866 -0.611 1.00 0.00 C ATOM 332 N6 DA A 11 0.820 7.893 0.662 1.00 0.00 N ATOM 333 N1 DA A 11 0.309 8.110 -1.578 1.00 0.00 N ATOM 334 C2 DA A 11 0.709 8.085 -2.856 1.00 0.00 C ATOM 335 N3 DA A 11 1.919 7.849 -3.356 1.00 0.00 N ATOM 336 C4 DA A 11 2.800 7.610 -2.370 1.00 0.00 C ATOM 0 H5' DA A 11 6.227 3.828 -3.470 1.00 0.00 H new ATOM 0 H5'' DA A 11 7.650 3.963 -4.484 1.00 0.00 H new ATOM 0 H4' DA A 11 6.225 5.164 -5.701 1.00 0.00 H new ATOM 0 H3' DA A 11 8.066 6.846 -4.644 1.00 0.00 H new ATOM 0 H2' DA A 11 6.761 7.576 -2.710 1.00 0.00 H new ATOM 0 H2'' DA A 11 6.371 8.818 -3.884 1.00 0.00 H new ATOM 0 HO3' DA A 11 7.261 8.403 -6.076 1.00 0.00 H new ATOM 0 H1' DA A 11 4.344 7.857 -4.469 1.00 0.00 H new ATOM 0 H8 DA A 11 5.642 6.927 -0.997 1.00 0.00 H new ATOM 0 H61 DA A 11 -0.155 8.094 0.886 1.00 0.00 H new ATOM 0 H62 DA A 11 1.489 7.713 1.411 1.00 0.00 H new ATOM 0 H2 DA A 11 -0.062 8.285 -3.586 1.00 0.00 H new TER 349 DA A 11