USER MOD reduce.3.24.130724 H: found=0, std=0, add=253, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 253 hydrogens (14 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 36:sc= 0.0134 USER MOD Single : A 5 DT C7 :methyl 150:sc= -1.3 (180deg=-1.3) USER MOD Single : A 7 DT C7 :methyl -30:sc= -0.622 (180deg=-1.04) USER MOD Single : A 11 DC O3' : rot 180:sc= 0 USER MOD Single : B 12 DG O5' : rot 40:sc= 0.0154 USER MOD Single : B 15 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 19 DT C7 :methyl 150:sc= -0.366 (180deg=-0.366) USER MOD Single : B 22 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 7.679 -14.148 0.256 1.00 0.00 O ATOM 2 C5' DC A 1 7.905 -15.092 -0.769 1.00 0.00 C ATOM 3 C4' DC A 1 6.943 -14.870 -1.942 1.00 0.00 C ATOM 4 O4' DC A 1 5.623 -15.016 -1.443 1.00 0.00 O ATOM 5 C3' DC A 1 7.058 -13.457 -2.534 1.00 0.00 C ATOM 6 O3' DC A 1 7.150 -13.568 -3.945 1.00 0.00 O ATOM 7 C2' DC A 1 5.748 -12.809 -2.089 1.00 0.00 C ATOM 8 C1' DC A 1 4.825 -14.023 -2.055 1.00 0.00 C ATOM 9 N1 DC A 1 3.608 -13.816 -1.220 1.00 0.00 N ATOM 10 C2 DC A 1 2.350 -13.895 -1.826 1.00 0.00 C ATOM 11 O2 DC A 1 2.235 -14.049 -3.039 1.00 0.00 O ATOM 12 N3 DC A 1 1.238 -13.796 -1.040 1.00 0.00 N ATOM 13 C4 DC A 1 1.339 -13.584 0.281 1.00 0.00 C ATOM 14 N4 DC A 1 0.220 -13.504 1.008 1.00 0.00 N ATOM 15 C5 DC A 1 2.619 -13.470 0.921 1.00 0.00 C ATOM 16 C6 DC A 1 3.713 -13.597 0.134 1.00 0.00 C ATOM 0 H5' DC A 1 7.777 -16.100 -0.375 1.00 0.00 H new ATOM 0 H5'' DC A 1 8.935 -15.015 -1.119 1.00 0.00 H new ATOM 0 H4' DC A 1 7.187 -15.589 -2.724 1.00 0.00 H new ATOM 0 H3' DC A 1 7.927 -12.882 -2.215 1.00 0.00 H new ATOM 0 H2' DC A 1 5.835 -12.329 -1.114 1.00 0.00 H new ATOM 0 H2'' DC A 1 5.404 -12.048 -2.790 1.00 0.00 H new ATOM 0 HO5' DC A 1 6.721 -13.951 0.314 1.00 0.00 H new ATOM 0 H1' DC A 1 4.462 -14.262 -3.054 1.00 0.00 H new ATOM 0 H41 DC A 1 0.276 -13.343 2.014 1.00 0.00 H new ATOM 0 H42 DC A 1 -0.689 -13.604 0.557 1.00 0.00 H new ATOM 0 H5 DC A 1 2.705 -13.291 1.983 1.00 0.00 H new ATOM 0 H6 DC A 1 4.694 -13.525 0.581 1.00 0.00 H new ATOM 29 P DG A 2 7.385 -12.285 -4.900 1.00 0.00 P ATOM 30 OP1 DG A 2 8.171 -12.727 -6.073 1.00 0.00 O ATOM 31 OP2 DG A 2 7.879 -11.166 -4.067 1.00 0.00 O ATOM 32 O5' DG A 2 5.895 -11.913 -5.398 1.00 0.00 O ATOM 33 C5' DG A 2 5.237 -12.668 -6.399 1.00 0.00 C ATOM 34 C4' DG A 2 3.904 -12.017 -6.787 1.00 0.00 C ATOM 35 O4' DG A 2 3.012 -12.137 -5.691 1.00 0.00 O ATOM 36 C3' DG A 2 4.059 -10.520 -7.103 1.00 0.00 C ATOM 37 O3' DG A 2 3.279 -10.269 -8.262 1.00 0.00 O ATOM 38 C2' DG A 2 3.482 -9.897 -5.833 1.00 0.00 C ATOM 39 C1' DG A 2 2.397 -10.880 -5.511 1.00 0.00 C ATOM 40 N9 DG A 2 1.831 -10.808 -4.151 1.00 0.00 N ATOM 41 C8 DG A 2 2.469 -10.558 -2.967 1.00 0.00 C ATOM 42 N7 DG A 2 1.707 -10.675 -1.916 1.00 0.00 N ATOM 43 C5 DG A 2 0.459 -10.994 -2.445 1.00 0.00 C ATOM 44 C6 DG A 2 -0.792 -11.211 -1.793 1.00 0.00 C ATOM 45 O6 DG A 2 -1.014 -11.275 -0.588 1.00 0.00 O ATOM 46 N1 DG A 2 -1.846 -11.361 -2.692 1.00 0.00 N ATOM 47 C2 DG A 2 -1.704 -11.347 -4.068 1.00 0.00 C ATOM 48 N2 DG A 2 -2.811 -11.492 -4.802 1.00 0.00 N ATOM 49 N3 DG A 2 -0.521 -11.198 -4.683 1.00 0.00 N ATOM 50 C4 DG A 2 0.516 -11.021 -3.818 1.00 0.00 C ATOM 0 H5' DG A 2 5.060 -13.681 -6.039 1.00 0.00 H new ATOM 0 H5'' DG A 2 5.876 -12.749 -7.278 1.00 0.00 H new ATOM 0 H4' DG A 2 3.533 -12.522 -7.679 1.00 0.00 H new ATOM 0 H3' DG A 2 5.059 -10.142 -7.317 1.00 0.00 H new ATOM 0 H2' DG A 2 4.222 -9.821 -5.036 1.00 0.00 H new ATOM 0 H2'' DG A 2 3.094 -8.893 -6.004 1.00 0.00 H new ATOM 0 H1' DG A 2 1.540 -10.674 -6.152 1.00 0.00 H new ATOM 0 H8 DG A 2 3.513 -10.287 -2.908 1.00 0.00 H new ATOM 0 H1 DG A 2 -2.783 -11.489 -2.311 1.00 0.00 H new ATOM 0 H21 DG A 2 -2.752 -11.488 -5.820 1.00 0.00 H new ATOM 0 H22 DG A 2 -3.715 -11.607 -4.344 1.00 0.00 H new ATOM 62 P DC A 3 3.038 -8.799 -8.887 1.00 0.00 P ATOM 63 OP1 DC A 3 3.256 -8.878 -10.348 1.00 0.00 O ATOM 64 OP2 DC A 3 3.777 -7.798 -8.086 1.00 0.00 O ATOM 65 O5' DC A 3 1.457 -8.600 -8.620 1.00 0.00 O ATOM 66 C5' DC A 3 0.505 -9.450 -9.237 1.00 0.00 C ATOM 67 C4' DC A 3 -0.934 -9.001 -8.957 1.00 0.00 C ATOM 68 O4' DC A 3 -1.177 -9.129 -7.565 1.00 0.00 O ATOM 69 C3' DC A 3 -1.160 -7.536 -9.340 1.00 0.00 C ATOM 70 O3' DC A 3 -2.447 -7.451 -9.935 1.00 0.00 O ATOM 71 C2' DC A 3 -1.086 -6.836 -7.985 1.00 0.00 C ATOM 72 C1' DC A 3 -1.678 -7.903 -7.061 1.00 0.00 C ATOM 73 N1 DC A 3 -1.221 -7.844 -5.644 1.00 0.00 N ATOM 74 C2 DC A 3 -2.139 -8.112 -4.623 1.00 0.00 C ATOM 75 O2 DC A 3 -3.324 -8.326 -4.870 1.00 0.00 O ATOM 76 N3 DC A 3 -1.699 -8.132 -3.331 1.00 0.00 N ATOM 77 C4 DC A 3 -0.408 -7.914 -3.040 1.00 0.00 C ATOM 78 N4 DC A 3 -0.019 -7.940 -1.762 1.00 0.00 N ATOM 79 C5 DC A 3 0.564 -7.709 -4.074 1.00 0.00 C ATOM 80 C6 DC A 3 0.111 -7.683 -5.349 1.00 0.00 C ATOM 0 H5' DC A 3 0.643 -10.470 -8.877 1.00 0.00 H new ATOM 0 H5'' DC A 3 0.677 -9.466 -10.313 1.00 0.00 H new ATOM 0 H4' DC A 3 -1.605 -9.622 -9.551 1.00 0.00 H new ATOM 0 H3' DC A 3 -0.457 -7.102 -10.051 1.00 0.00 H new ATOM 0 H2' DC A 3 -0.063 -6.578 -7.712 1.00 0.00 H new ATOM 0 H2'' DC A 3 -1.664 -5.912 -7.968 1.00 0.00 H new ATOM 0 H1' DC A 3 -2.760 -7.770 -7.052 1.00 0.00 H new ATOM 0 H41 DC A 3 0.959 -7.776 -1.523 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.700 -8.124 -1.025 1.00 0.00 H new ATOM 0 H5 DC A 3 1.612 -7.581 -3.845 1.00 0.00 H new ATOM 0 H6 DC A 3 0.814 -7.532 -6.155 1.00 0.00 H new ATOM 92 P DA A 4 -3.092 -6.058 -10.439 1.00 0.00 P ATOM 93 OP1 DA A 4 -4.044 -6.359 -11.531 1.00 0.00 O ATOM 94 OP2 DA A 4 -2.001 -5.084 -10.662 1.00 0.00 O ATOM 95 O5' DA A 4 -3.935 -5.587 -9.146 1.00 0.00 O ATOM 96 C5' DA A 4 -5.144 -6.228 -8.787 1.00 0.00 C ATOM 97 C4' DA A 4 -5.708 -5.619 -7.502 1.00 0.00 C ATOM 98 O4' DA A 4 -4.948 -5.999 -6.379 1.00 0.00 O ATOM 99 C3' DA A 4 -5.887 -4.100 -7.533 1.00 0.00 C ATOM 100 O3' DA A 4 -7.258 -3.751 -7.373 1.00 0.00 O ATOM 101 C2' DA A 4 -5.055 -3.792 -6.330 1.00 0.00 C ATOM 102 C1' DA A 4 -5.181 -4.987 -5.430 1.00 0.00 C ATOM 103 N9 DA A 4 -4.080 -5.051 -4.473 1.00 0.00 N ATOM 104 C8 DA A 4 -2.770 -4.975 -4.803 1.00 0.00 C ATOM 105 N7 DA A 4 -1.948 -5.040 -3.794 1.00 0.00 N ATOM 106 C5 DA A 4 -2.806 -5.189 -2.706 1.00 0.00 C ATOM 107 C6 DA A 4 -2.585 -5.334 -1.322 1.00 0.00 C ATOM 108 N6 DA A 4 -1.363 -5.377 -0.785 1.00 0.00 N ATOM 109 N1 DA A 4 -3.655 -5.440 -0.512 1.00 0.00 N ATOM 110 C2 DA A 4 -4.878 -5.414 -1.039 1.00 0.00 C ATOM 111 N3 DA A 4 -5.219 -5.298 -2.319 1.00 0.00 N ATOM 112 C4 DA A 4 -4.119 -5.192 -3.111 1.00 0.00 C ATOM 0 H5' DA A 4 -4.970 -7.295 -8.646 1.00 0.00 H new ATOM 0 H5'' DA A 4 -5.870 -6.128 -9.594 1.00 0.00 H new ATOM 0 H4' DA A 4 -6.714 -6.032 -7.422 1.00 0.00 H new ATOM 0 H3' DA A 4 -5.606 -3.573 -8.445 1.00 0.00 H new ATOM 0 H2' DA A 4 -4.015 -3.619 -6.607 1.00 0.00 H new ATOM 0 H2'' DA A 4 -5.407 -2.888 -5.832 1.00 0.00 H new ATOM 0 H1' DA A 4 -6.108 -5.017 -4.858 1.00 0.00 H new ATOM 0 H8 DA A 4 -2.432 -4.869 -5.823 1.00 0.00 H new ATOM 0 H61 DA A 4 -1.253 -5.483 0.223 1.00 0.00 H new ATOM 0 H62 DA A 4 -0.540 -5.304 -1.383 1.00 0.00 H new ATOM 0 H2 DA A 4 -5.696 -5.498 -0.338 1.00 0.00 H new ATOM 124 P DT A 5 -7.764 -2.221 -7.166 1.00 0.00 P ATOM 125 OP1 DT A 5 -9.147 -2.126 -7.686 1.00 0.00 O ATOM 126 OP2 DT A 5 -6.722 -1.310 -7.689 1.00 0.00 O ATOM 127 O5' DT A 5 -7.820 -2.045 -5.555 1.00 0.00 O ATOM 128 C5' DT A 5 -8.805 -2.706 -4.783 1.00 0.00 C ATOM 129 C4' DT A 5 -8.668 -2.428 -3.279 1.00 0.00 C ATOM 130 O4' DT A 5 -7.445 -2.922 -2.801 1.00 0.00 O ATOM 131 C3' DT A 5 -8.802 -0.958 -2.857 1.00 0.00 C ATOM 132 O3' DT A 5 -9.923 -0.863 -1.987 1.00 0.00 O ATOM 133 C2' DT A 5 -7.487 -0.686 -2.136 1.00 0.00 C ATOM 134 C1' DT A 5 -7.035 -2.086 -1.739 1.00 0.00 C ATOM 135 N1 DT A 5 -5.563 -2.139 -1.776 1.00 0.00 N ATOM 136 C2 DT A 5 -4.858 -2.284 -0.593 1.00 0.00 C ATOM 137 O2 DT A 5 -5.393 -2.566 0.475 1.00 0.00 O ATOM 138 N3 DT A 5 -3.491 -2.085 -0.685 1.00 0.00 N ATOM 139 C4 DT A 5 -2.763 -1.952 -1.857 1.00 0.00 C ATOM 140 O4 DT A 5 -1.534 -1.931 -1.809 1.00 0.00 O ATOM 141 C5 DT A 5 -3.579 -1.844 -3.060 1.00 0.00 C ATOM 142 C7 DT A 5 -2.895 -1.647 -4.401 1.00 0.00 C ATOM 143 C6 DT A 5 -4.936 -1.920 -2.975 1.00 0.00 C ATOM 0 H5' DT A 5 -8.736 -3.780 -4.957 1.00 0.00 H new ATOM 0 H5'' DT A 5 -9.794 -2.392 -5.117 1.00 0.00 H new ATOM 0 H4' DT A 5 -9.517 -2.947 -2.834 1.00 0.00 H new ATOM 0 H3' DT A 5 -8.964 -0.246 -3.666 1.00 0.00 H new ATOM 0 H2' DT A 5 -6.762 -0.194 -2.785 1.00 0.00 H new ATOM 0 H2'' DT A 5 -7.626 -0.042 -1.267 1.00 0.00 H new ATOM 0 H1' DT A 5 -7.424 -2.361 -0.759 1.00 0.00 H new ATOM 0 H3 DT A 5 -2.971 -2.031 0.191 1.00 0.00 H new ATOM 0 H71 DT A 5 -3.500 -2.098 -5.188 1.00 0.00 H new ATOM 0 H72 DT A 5 -2.780 -0.581 -4.598 1.00 0.00 H new ATOM 0 H73 DT A 5 -1.913 -2.120 -4.382 1.00 0.00 H new ATOM 0 H6 DT A 5 -5.530 -1.805 -3.870 1.00 0.00 H new ATOM 156 P DA A 6 -10.373 0.507 -1.252 1.00 0.00 P ATOM 157 OP1 DA A 6 -11.767 0.336 -0.787 1.00 0.00 O ATOM 158 OP2 DA A 6 -10.032 1.641 -2.140 1.00 0.00 O ATOM 159 O5' DA A 6 -9.417 0.586 0.052 1.00 0.00 O ATOM 160 C5' DA A 6 -9.481 -0.371 1.095 1.00 0.00 C ATOM 161 C4' DA A 6 -8.473 -0.051 2.212 1.00 0.00 C ATOM 162 O4' DA A 6 -7.194 -0.527 1.833 1.00 0.00 O ATOM 163 C3' DA A 6 -8.338 1.449 2.544 1.00 0.00 C ATOM 164 O3' DA A 6 -8.998 1.741 3.766 1.00 0.00 O ATOM 165 C2' DA A 6 -6.837 1.544 2.622 1.00 0.00 C ATOM 166 C1' DA A 6 -6.251 0.176 2.616 1.00 0.00 C ATOM 167 N9 DA A 6 -4.974 0.274 1.874 1.00 0.00 N ATOM 168 C8 DA A 6 -4.853 0.510 0.543 1.00 0.00 C ATOM 169 N7 DA A 6 -3.649 0.658 0.085 1.00 0.00 N ATOM 170 C5 DA A 6 -2.895 0.503 1.230 1.00 0.00 C ATOM 171 C6 DA A 6 -1.511 0.420 1.432 1.00 0.00 C ATOM 172 N6 DA A 6 -0.648 0.382 0.413 1.00 0.00 N ATOM 173 N1 DA A 6 -1.068 0.300 2.695 1.00 0.00 N ATOM 174 C2 DA A 6 -1.957 0.260 3.685 1.00 0.00 C ATOM 175 N3 DA A 6 -3.282 0.289 3.628 1.00 0.00 N ATOM 176 C4 DA A 6 -3.695 0.394 2.344 1.00 0.00 C ATOM 0 H5' DA A 6 -9.278 -1.364 0.693 1.00 0.00 H new ATOM 0 H5'' DA A 6 -10.489 -0.394 1.508 1.00 0.00 H new ATOM 0 H4' DA A 6 -8.858 -0.543 3.105 1.00 0.00 H new ATOM 0 H3' DA A 6 -8.784 2.155 1.844 1.00 0.00 H new ATOM 0 H2' DA A 6 -6.454 2.119 1.779 1.00 0.00 H new ATOM 0 H2'' DA A 6 -6.542 2.073 3.528 1.00 0.00 H new ATOM 0 H1' DA A 6 -6.067 -0.276 3.591 1.00 0.00 H new ATOM 0 H8 DA A 6 -5.717 0.571 -0.103 1.00 0.00 H new ATOM 0 H61 DA A 6 0.354 0.322 0.595 1.00 0.00 H new ATOM 0 H62 DA A 6 -0.991 0.413 -0.547 1.00 0.00 H new ATOM 0 H2 DA A 6 -1.539 0.194 4.679 1.00 0.00 H new ATOM 188 P DT A 7 -8.986 3.212 4.445 1.00 0.00 P ATOM 189 OP1 DT A 7 -9.991 3.218 5.532 1.00 0.00 O ATOM 190 OP2 DT A 7 -9.065 4.226 3.370 1.00 0.00 O ATOM 191 O5' DT A 7 -7.524 3.315 5.121 1.00 0.00 O ATOM 192 C5' DT A 7 -7.077 2.359 6.066 1.00 0.00 C ATOM 193 C4' DT A 7 -5.625 2.625 6.478 1.00 0.00 C ATOM 194 O4' DT A 7 -4.798 2.398 5.346 1.00 0.00 O ATOM 195 C3' DT A 7 -5.422 4.078 6.923 1.00 0.00 C ATOM 196 O3' DT A 7 -4.835 4.090 8.215 1.00 0.00 O ATOM 197 C2' DT A 7 -4.487 4.616 5.843 1.00 0.00 C ATOM 198 C1' DT A 7 -3.768 3.365 5.350 1.00 0.00 C ATOM 199 N1 DT A 7 -3.237 3.527 3.979 1.00 0.00 N ATOM 200 C2 DT A 7 -1.868 3.386 3.751 1.00 0.00 C ATOM 201 O2 DT A 7 -1.039 3.230 4.644 1.00 0.00 O ATOM 202 N3 DT A 7 -1.464 3.432 2.426 1.00 0.00 N ATOM 203 C4 DT A 7 -2.288 3.646 1.331 1.00 0.00 C ATOM 204 O4 DT A 7 -1.801 3.649 0.202 1.00 0.00 O ATOM 205 C5 DT A 7 -3.690 3.846 1.668 1.00 0.00 C ATOM 206 C7 DT A 7 -4.712 4.104 0.584 1.00 0.00 C ATOM 207 C6 DT A 7 -4.106 3.781 2.956 1.00 0.00 C ATOM 0 H5' DT A 7 -7.160 1.358 5.642 1.00 0.00 H new ATOM 0 H5'' DT A 7 -7.719 2.387 6.947 1.00 0.00 H new ATOM 0 H4' DT A 7 -5.375 1.966 7.310 1.00 0.00 H new ATOM 0 H3' DT A 7 -6.330 4.674 7.012 1.00 0.00 H new ATOM 0 H2' DT A 7 -5.038 5.106 5.041 1.00 0.00 H new ATOM 0 H2'' DT A 7 -3.788 5.350 6.244 1.00 0.00 H new ATOM 0 H1' DT A 7 -2.907 3.114 5.970 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.471 3.296 2.239 1.00 0.00 H new ATOM 0 H71 DT A 7 -4.236 4.619 -0.250 1.00 0.00 H new ATOM 0 H72 DT A 7 -5.123 3.155 0.238 1.00 0.00 H new ATOM 0 H73 DT A 7 -5.516 4.724 0.982 1.00 0.00 H new ATOM 0 H6 DT A 7 -5.151 3.934 3.180 1.00 0.00 H new ATOM 220 P DA A 8 -4.586 5.460 9.039 1.00 0.00 P ATOM 221 OP1 DA A 8 -4.577 5.133 10.483 1.00 0.00 O ATOM 222 OP2 DA A 8 -5.510 6.497 8.529 1.00 0.00 O ATOM 223 O5' DA A 8 -3.088 5.868 8.605 1.00 0.00 O ATOM 224 C5' DA A 8 -1.966 5.173 9.112 1.00 0.00 C ATOM 225 C4' DA A 8 -0.672 5.712 8.499 1.00 0.00 C ATOM 226 O4' DA A 8 -0.603 5.354 7.130 1.00 0.00 O ATOM 227 C3' DA A 8 -0.537 7.240 8.587 1.00 0.00 C ATOM 228 O3' DA A 8 0.660 7.559 9.279 1.00 0.00 O ATOM 229 C2' DA A 8 -0.514 7.602 7.128 1.00 0.00 C ATOM 230 C1' DA A 8 0.110 6.396 6.504 1.00 0.00 C ATOM 231 N9 DA A 8 -0.121 6.362 5.053 1.00 0.00 N ATOM 232 C8 DA A 8 -1.302 6.555 4.402 1.00 0.00 C ATOM 233 N7 DA A 8 -1.235 6.432 3.106 1.00 0.00 N ATOM 234 C5 DA A 8 0.112 6.157 2.885 1.00 0.00 C ATOM 235 C6 DA A 8 0.864 5.886 1.723 1.00 0.00 C ATOM 236 N6 DA A 8 0.317 5.755 0.508 1.00 0.00 N ATOM 237 N1 DA A 8 2.195 5.732 1.854 1.00 0.00 N ATOM 238 C2 DA A 8 2.749 5.804 3.062 1.00 0.00 C ATOM 239 N3 DA A 8 2.149 5.999 4.230 1.00 0.00 N ATOM 240 C4 DA A 8 0.810 6.167 4.068 1.00 0.00 C ATOM 0 H5' DA A 8 -2.062 4.109 8.894 1.00 0.00 H new ATOM 0 H5'' DA A 8 -1.930 5.274 10.197 1.00 0.00 H new ATOM 0 H4' DA A 8 0.137 5.268 9.079 1.00 0.00 H new ATOM 0 H3' DA A 8 -1.315 7.774 9.132 1.00 0.00 H new ATOM 0 H2' DA A 8 -1.516 7.787 6.740 1.00 0.00 H new ATOM 0 H2'' DA A 8 0.071 8.503 6.943 1.00 0.00 H new ATOM 0 H1' DA A 8 1.192 6.351 6.630 1.00 0.00 H new ATOM 0 H8 DA A 8 -2.221 6.791 4.919 1.00 0.00 H new ATOM 0 H61 DA A 8 0.909 5.559 -0.299 1.00 0.00 H new ATOM 0 H62 DA A 8 -0.692 5.851 0.390 1.00 0.00 H new ATOM 0 H2 DA A 8 3.822 5.689 3.096 1.00 0.00 H new ATOM 252 P DG A 9 1.114 9.079 9.598 1.00 0.00 P ATOM 253 OP1 DG A 9 1.519 9.151 11.019 1.00 0.00 O ATOM 254 OP2 DG A 9 0.088 10.011 9.079 1.00 0.00 O ATOM 255 O5' DG A 9 2.434 9.241 8.685 1.00 0.00 O ATOM 256 C5' DG A 9 3.596 8.477 8.942 1.00 0.00 C ATOM 257 C4' DG A 9 4.803 8.960 8.127 1.00 0.00 C ATOM 258 O4' DG A 9 4.563 8.726 6.748 1.00 0.00 O ATOM 259 C3' DG A 9 5.071 10.456 8.293 1.00 0.00 C ATOM 260 O3' DG A 9 6.483 10.584 8.224 1.00 0.00 O ATOM 261 C2' DG A 9 4.305 11.053 7.114 1.00 0.00 C ATOM 262 C1' DG A 9 4.430 9.959 6.057 1.00 0.00 C ATOM 263 N9 DG A 9 3.283 9.764 5.141 1.00 0.00 N ATOM 264 C8 DG A 9 1.944 9.990 5.337 1.00 0.00 C ATOM 265 N7 DG A 9 1.207 9.752 4.285 1.00 0.00 N ATOM 266 C5 DG A 9 2.119 9.337 3.319 1.00 0.00 C ATOM 267 C6 DG A 9 1.927 9.006 1.941 1.00 0.00 C ATOM 268 O6 DG A 9 0.873 8.959 1.313 1.00 0.00 O ATOM 269 N1 DG A 9 3.124 8.710 1.288 1.00 0.00 N ATOM 270 C2 DG A 9 4.360 8.688 1.903 1.00 0.00 C ATOM 271 N2 DG A 9 5.419 8.403 1.139 1.00 0.00 N ATOM 272 N3 DG A 9 4.540 8.983 3.198 1.00 0.00 N ATOM 273 C4 DG A 9 3.387 9.307 3.847 1.00 0.00 C ATOM 0 H5' DG A 9 3.399 7.431 8.709 1.00 0.00 H new ATOM 0 H5'' DG A 9 3.834 8.528 10.004 1.00 0.00 H new ATOM 0 H4' DG A 9 5.668 8.407 8.495 1.00 0.00 H new ATOM 0 H3' DG A 9 4.756 10.949 9.213 1.00 0.00 H new ATOM 0 H2' DG A 9 3.265 11.257 7.367 1.00 0.00 H new ATOM 0 H2'' DG A 9 4.742 11.994 6.779 1.00 0.00 H new ATOM 0 H1' DG A 9 5.271 10.272 5.439 1.00 0.00 H new ATOM 0 H8 DG A 9 1.536 10.334 6.276 1.00 0.00 H new ATOM 0 H1 DG A 9 3.083 8.496 0.292 1.00 0.00 H new ATOM 0 H21 DG A 9 6.352 8.376 1.550 1.00 0.00 H new ATOM 0 H22 DG A 9 5.294 8.213 0.145 1.00 0.00 H new ATOM 285 P DC A 10 7.278 11.979 8.056 1.00 0.00 P ATOM 286 OP1 DC A 10 8.544 11.881 8.816 1.00 0.00 O ATOM 287 OP2 DC A 10 6.354 13.107 8.310 1.00 0.00 O ATOM 288 O5' DC A 10 7.630 11.933 6.479 1.00 0.00 O ATOM 289 C5' DC A 10 8.422 10.882 5.949 1.00 0.00 C ATOM 290 C4' DC A 10 8.745 11.057 4.457 1.00 0.00 C ATOM 291 O4' DC A 10 7.555 10.716 3.782 1.00 0.00 O ATOM 292 C3' DC A 10 9.121 12.486 4.039 1.00 0.00 C ATOM 293 O3' DC A 10 10.521 12.651 3.864 1.00 0.00 O ATOM 294 C2' DC A 10 8.393 12.635 2.711 1.00 0.00 C ATOM 295 C1' DC A 10 7.474 11.443 2.577 1.00 0.00 C ATOM 296 N1 DC A 10 6.062 11.858 2.395 1.00 0.00 N ATOM 297 C2 DC A 10 5.519 11.831 1.112 1.00 0.00 C ATOM 298 O2 DC A 10 6.239 11.655 0.132 1.00 0.00 O ATOM 299 N3 DC A 10 4.172 12.003 0.967 1.00 0.00 N ATOM 300 C4 DC A 10 3.387 12.212 2.036 1.00 0.00 C ATOM 301 N4 DC A 10 2.067 12.328 1.858 1.00 0.00 N ATOM 302 C5 DC A 10 3.941 12.285 3.359 1.00 0.00 C ATOM 303 C6 DC A 10 5.272 12.122 3.484 1.00 0.00 C ATOM 0 H5' DC A 10 7.900 9.936 6.092 1.00 0.00 H new ATOM 0 H5'' DC A 10 9.354 10.820 6.511 1.00 0.00 H new ATOM 0 H4' DC A 10 9.613 10.441 4.221 1.00 0.00 H new ATOM 0 H3' DC A 10 8.849 13.229 4.789 1.00 0.00 H new ATOM 0 H2' DC A 10 7.825 13.565 2.684 1.00 0.00 H new ATOM 0 H2'' DC A 10 9.102 12.671 1.884 1.00 0.00 H new ATOM 0 H1' DC A 10 7.777 10.858 1.709 1.00 0.00 H new ATOM 0 H41 DC A 10 1.456 12.487 2.659 1.00 0.00 H new ATOM 0 H42 DC A 10 1.671 12.258 0.921 1.00 0.00 H new ATOM 0 H5 DC A 10 3.314 12.464 4.220 1.00 0.00 H new ATOM 0 H6 DC A 10 5.726 12.201 4.461 1.00 0.00 H new ATOM 315 P DC A 11 11.178 14.074 3.433 1.00 0.00 P ATOM 316 OP1 DC A 11 12.646 13.956 3.574 1.00 0.00 O ATOM 317 OP2 DC A 11 10.461 15.149 4.156 1.00 0.00 O ATOM 318 O5' DC A 11 10.845 14.240 1.855 1.00 0.00 O ATOM 319 C5' DC A 11 11.514 13.474 0.869 1.00 0.00 C ATOM 320 C4' DC A 11 10.897 13.668 -0.525 1.00 0.00 C ATOM 321 O4' DC A 11 9.549 13.258 -0.531 1.00 0.00 O ATOM 322 C3' DC A 11 10.954 15.090 -1.078 1.00 0.00 C ATOM 323 O3' DC A 11 12.161 15.321 -1.774 1.00 0.00 O ATOM 324 C2' DC A 11 9.762 15.090 -2.035 1.00 0.00 C ATOM 325 C1' DC A 11 8.860 13.934 -1.572 1.00 0.00 C ATOM 326 N1 DC A 11 7.606 14.429 -0.946 1.00 0.00 N ATOM 327 C2 DC A 11 6.384 14.280 -1.607 1.00 0.00 C ATOM 328 O2 DC A 11 6.325 13.835 -2.751 1.00 0.00 O ATOM 329 N3 DC A 11 5.245 14.645 -0.948 1.00 0.00 N ATOM 330 C4 DC A 11 5.291 15.155 0.294 1.00 0.00 C ATOM 331 N4 DC A 11 4.146 15.455 0.912 1.00 0.00 N ATOM 332 C5 DC A 11 6.542 15.363 0.968 1.00 0.00 C ATOM 333 C6 DC A 11 7.659 14.984 0.306 1.00 0.00 C ATOM 0 H5' DC A 11 11.474 12.419 1.140 1.00 0.00 H new ATOM 0 H5'' DC A 11 12.566 13.756 0.842 1.00 0.00 H new ATOM 0 H4' DC A 11 11.519 13.051 -1.174 1.00 0.00 H new ATOM 0 H3' DC A 11 10.916 15.866 -0.313 1.00 0.00 H new ATOM 0 H2' DC A 11 9.230 16.041 -1.999 1.00 0.00 H new ATOM 0 H2'' DC A 11 10.087 14.945 -3.065 1.00 0.00 H new ATOM 0 HO3' DC A 11 12.170 16.238 -2.119 1.00 0.00 H new ATOM 0 H1' DC A 11 8.628 13.316 -2.439 1.00 0.00 H new ATOM 0 H41 DC A 11 4.162 15.843 1.855 1.00 0.00 H new ATOM 0 H42 DC A 11 3.255 15.296 0.441 1.00 0.00 H new ATOM 0 H5 DC A 11 6.589 15.800 1.954 1.00 0.00 H new ATOM 0 H6 DC A 11 8.621 15.123 0.778 1.00 0.00 H new TER 346 DC A 11 ATOM 347 O5' DG B 12 -5.017 14.760 -5.222 1.00 0.00 O ATOM 348 C5' DG B 12 -4.520 15.369 -6.397 1.00 0.00 C ATOM 349 C4' DG B 12 -3.130 14.827 -6.745 1.00 0.00 C ATOM 350 O4' DG B 12 -2.276 15.122 -5.655 1.00 0.00 O ATOM 351 C3' DG B 12 -3.128 13.304 -6.942 1.00 0.00 C ATOM 352 O3' DG B 12 -2.602 13.014 -8.227 1.00 0.00 O ATOM 353 C2' DG B 12 -2.224 12.819 -5.810 1.00 0.00 C ATOM 354 C1' DG B 12 -1.380 14.043 -5.508 1.00 0.00 C ATOM 355 N9 DG B 12 -0.886 14.061 -4.112 1.00 0.00 N ATOM 356 C8 DG B 12 -1.622 14.126 -2.955 1.00 0.00 C ATOM 357 N7 DG B 12 -0.907 14.208 -1.869 1.00 0.00 N ATOM 358 C5 DG B 12 0.403 14.190 -2.334 1.00 0.00 C ATOM 359 C6 DG B 12 1.628 14.257 -1.607 1.00 0.00 C ATOM 360 O6 DG B 12 1.783 14.350 -0.393 1.00 0.00 O ATOM 361 N1 DG B 12 2.743 14.204 -2.439 1.00 0.00 N ATOM 362 C2 DG B 12 2.686 14.077 -3.815 1.00 0.00 C ATOM 363 N2 DG B 12 3.852 13.988 -4.462 1.00 0.00 N ATOM 364 N3 DG B 12 1.532 14.016 -4.501 1.00 0.00 N ATOM 365 C4 DG B 12 0.429 14.080 -3.705 1.00 0.00 C ATOM 0 H5' DG B 12 -4.470 16.449 -6.259 1.00 0.00 H new ATOM 0 H5'' DG B 12 -5.205 15.185 -7.225 1.00 0.00 H new ATOM 0 H4' DG B 12 -2.805 15.288 -7.678 1.00 0.00 H new ATOM 0 H3' DG B 12 -4.107 12.826 -6.905 1.00 0.00 H new ATOM 0 H2' DG B 12 -2.799 12.500 -4.941 1.00 0.00 H new ATOM 0 H2'' DG B 12 -1.612 11.971 -6.116 1.00 0.00 H new ATOM 0 HO5' DG B 12 -4.289 14.656 -4.574 1.00 0.00 H new ATOM 0 H1' DG B 12 -0.506 14.073 -6.159 1.00 0.00 H new ATOM 0 H8 DG B 12 -2.702 14.110 -2.946 1.00 0.00 H new ATOM 0 H1 DG B 12 3.664 14.263 -2.004 1.00 0.00 H new ATOM 0 H21 DG B 12 3.866 13.893 -5.477 1.00 0.00 H new ATOM 0 H22 DG B 12 4.728 14.015 -3.940 1.00 0.00 H new ATOM 378 P DG B 13 -2.509 11.508 -8.812 1.00 0.00 P ATOM 379 OP1 DG B 13 -2.538 11.589 -10.289 1.00 0.00 O ATOM 380 OP2 DG B 13 -3.498 10.666 -8.104 1.00 0.00 O ATOM 381 O5' DG B 13 -1.035 11.035 -8.362 1.00 0.00 O ATOM 382 C5' DG B 13 0.123 11.649 -8.892 1.00 0.00 C ATOM 383 C4' DG B 13 1.404 11.020 -8.331 1.00 0.00 C ATOM 384 O4' DG B 13 1.455 11.276 -6.936 1.00 0.00 O ATOM 385 C3' DG B 13 1.449 9.501 -8.519 1.00 0.00 C ATOM 386 O3' DG B 13 2.815 9.197 -8.755 1.00 0.00 O ATOM 387 C2' DG B 13 0.954 8.997 -7.162 1.00 0.00 C ATOM 388 C1' DG B 13 1.546 10.044 -6.239 1.00 0.00 C ATOM 389 N9 DG B 13 0.928 10.258 -4.911 1.00 0.00 N ATOM 390 C8 DG B 13 -0.377 10.160 -4.498 1.00 0.00 C ATOM 391 N7 DG B 13 -0.557 10.446 -3.237 1.00 0.00 N ATOM 392 C5 DG B 13 0.720 10.743 -2.770 1.00 0.00 C ATOM 393 C6 DG B 13 1.180 11.082 -1.459 1.00 0.00 C ATOM 394 O6 DG B 13 0.516 11.266 -0.443 1.00 0.00 O ATOM 395 N1 DG B 13 2.568 11.206 -1.397 1.00 0.00 N ATOM 396 C2 DG B 13 3.410 11.081 -2.486 1.00 0.00 C ATOM 397 N2 DG B 13 4.716 11.259 -2.283 1.00 0.00 N ATOM 398 N3 DG B 13 2.977 10.806 -3.721 1.00 0.00 N ATOM 399 C4 DG B 13 1.629 10.637 -3.794 1.00 0.00 C ATOM 0 H5' DG B 13 0.109 12.714 -8.661 1.00 0.00 H new ATOM 0 H5'' DG B 13 0.118 11.559 -9.978 1.00 0.00 H new ATOM 0 H4' DG B 13 2.244 11.458 -8.870 1.00 0.00 H new ATOM 0 H3' DG B 13 0.863 9.070 -9.330 1.00 0.00 H new ATOM 0 H2' DG B 13 -0.134 8.963 -7.105 1.00 0.00 H new ATOM 0 H2'' DG B 13 1.316 7.994 -6.936 1.00 0.00 H new ATOM 0 H1' DG B 13 2.545 9.675 -6.006 1.00 0.00 H new ATOM 0 H8 DG B 13 -1.183 9.872 -5.157 1.00 0.00 H new ATOM 0 H1 DG B 13 2.989 11.402 -0.489 1.00 0.00 H new ATOM 0 H21 DG B 13 5.369 11.175 -3.062 1.00 0.00 H new ATOM 0 H22 DG B 13 5.062 11.479 -1.349 1.00 0.00 H new ATOM 411 P DC B 14 3.383 7.713 -9.044 1.00 0.00 P ATOM 412 OP1 DC B 14 4.078 7.728 -10.350 1.00 0.00 O ATOM 413 OP2 DC B 14 2.321 6.715 -8.785 1.00 0.00 O ATOM 414 O5' DC B 14 4.489 7.597 -7.876 1.00 0.00 O ATOM 415 C5' DC B 14 5.634 8.434 -7.877 1.00 0.00 C ATOM 416 C4' DC B 14 6.505 8.205 -6.638 1.00 0.00 C ATOM 417 O4' DC B 14 5.745 8.576 -5.499 1.00 0.00 O ATOM 418 C3' DC B 14 6.906 6.734 -6.479 1.00 0.00 C ATOM 419 O3' DC B 14 8.280 6.701 -6.133 1.00 0.00 O ATOM 420 C2' DC B 14 5.990 6.275 -5.345 1.00 0.00 C ATOM 421 C1' DC B 14 5.865 7.557 -4.523 1.00 0.00 C ATOM 422 N1 DC B 14 4.627 7.603 -3.692 1.00 0.00 N ATOM 423 C2 DC B 14 4.732 7.800 -2.309 1.00 0.00 C ATOM 424 O2 DC B 14 5.824 7.893 -1.754 1.00 0.00 O ATOM 425 N3 DC B 14 3.587 7.889 -1.567 1.00 0.00 N ATOM 426 C4 DC B 14 2.382 7.795 -2.147 1.00 0.00 C ATOM 427 N4 DC B 14 1.283 7.899 -1.396 1.00 0.00 N ATOM 428 C5 DC B 14 2.252 7.633 -3.564 1.00 0.00 C ATOM 429 C6 DC B 14 3.389 7.550 -4.290 1.00 0.00 C ATOM 0 H5' DC B 14 5.322 9.478 -7.914 1.00 0.00 H new ATOM 0 H5'' DC B 14 6.222 8.245 -8.775 1.00 0.00 H new ATOM 0 H4' DC B 14 7.414 8.797 -6.743 1.00 0.00 H new ATOM 0 H3' DC B 14 6.798 6.100 -7.359 1.00 0.00 H new ATOM 0 H2' DC B 14 5.025 5.926 -5.712 1.00 0.00 H new ATOM 0 H2'' DC B 14 6.426 5.459 -4.769 1.00 0.00 H new ATOM 0 H1' DC B 14 6.711 7.647 -3.842 1.00 0.00 H new ATOM 0 H41 DC B 14 0.362 7.829 -1.828 1.00 0.00 H new ATOM 0 H42 DC B 14 1.365 8.049 -0.390 1.00 0.00 H new ATOM 0 H5 DC B 14 1.282 7.579 -4.035 1.00 0.00 H new ATOM 0 H6 DC B 14 3.324 7.440 -5.362 1.00 0.00 H new ATOM 441 P DT B 15 9.098 5.322 -5.942 1.00 0.00 P ATOM 442 OP1 DT B 15 10.538 5.613 -6.118 1.00 0.00 O ATOM 443 OP2 DT B 15 8.454 4.272 -6.762 1.00 0.00 O ATOM 444 O5' DT B 15 8.837 4.982 -4.391 1.00 0.00 O ATOM 445 C5' DT B 15 9.407 5.764 -3.359 1.00 0.00 C ATOM 446 C4' DT B 15 8.967 5.252 -1.984 1.00 0.00 C ATOM 447 O4' DT B 15 7.595 5.527 -1.856 1.00 0.00 O ATOM 448 C3' DT B 15 9.120 3.736 -1.792 1.00 0.00 C ATOM 449 O3' DT B 15 10.264 3.509 -0.980 1.00 0.00 O ATOM 450 C2' DT B 15 7.803 3.315 -1.145 1.00 0.00 C ATOM 451 C1' DT B 15 7.087 4.633 -0.893 1.00 0.00 C ATOM 452 N1 DT B 15 5.643 4.538 -1.185 1.00 0.00 N ATOM 453 C2 DT B 15 4.740 4.980 -0.229 1.00 0.00 C ATOM 454 O2 DT B 15 5.076 5.363 0.888 1.00 0.00 O ATOM 455 N3 DT B 15 3.410 4.966 -0.606 1.00 0.00 N ATOM 456 C4 DT B 15 2.908 4.554 -1.828 1.00 0.00 C ATOM 457 O4 DT B 15 1.696 4.607 -2.029 1.00 0.00 O ATOM 458 C5 DT B 15 3.918 4.089 -2.766 1.00 0.00 C ATOM 459 C7 DT B 15 3.495 3.610 -4.140 1.00 0.00 C ATOM 460 C6 DT B 15 5.231 4.093 -2.417 1.00 0.00 C ATOM 0 H5' DT B 15 9.107 6.805 -3.478 1.00 0.00 H new ATOM 0 H5'' DT B 15 10.494 5.735 -3.432 1.00 0.00 H new ATOM 0 H4' DT B 15 9.603 5.745 -1.249 1.00 0.00 H new ATOM 0 H3' DT B 15 9.285 3.159 -2.702 1.00 0.00 H new ATOM 0 H2' DT B 15 7.225 2.664 -1.801 1.00 0.00 H new ATOM 0 H2'' DT B 15 7.970 2.766 -0.218 1.00 0.00 H new ATOM 0 H1' DT B 15 7.233 4.927 0.146 1.00 0.00 H new ATOM 0 H3 DT B 15 2.733 5.291 0.084 1.00 0.00 H new ATOM 0 H71 DT B 15 4.294 3.805 -4.855 1.00 0.00 H new ATOM 0 H72 DT B 15 3.292 2.540 -4.106 1.00 0.00 H new ATOM 0 H73 DT B 15 2.594 4.140 -4.449 1.00 0.00 H new ATOM 0 H6 DT B 15 5.967 3.739 -3.124 1.00 0.00 H new ATOM 473 P DA B 16 10.733 2.040 -0.492 1.00 0.00 P ATOM 474 OP1 DA B 16 12.130 2.141 -0.012 1.00 0.00 O ATOM 475 OP2 DA B 16 10.390 1.066 -1.551 1.00 0.00 O ATOM 476 O5' DA B 16 9.786 1.749 0.784 1.00 0.00 O ATOM 477 C5' DA B 16 9.927 2.448 2.010 1.00 0.00 C ATOM 478 C4' DA B 16 8.745 2.165 2.955 1.00 0.00 C ATOM 479 O4' DA B 16 7.556 2.637 2.366 1.00 0.00 O ATOM 480 C3' DA B 16 8.473 0.697 3.223 1.00 0.00 C ATOM 481 O3' DA B 16 9.026 0.243 4.450 1.00 0.00 O ATOM 482 C2' DA B 16 7.006 0.439 2.994 1.00 0.00 C ATOM 483 C1' DA B 16 6.531 1.854 2.937 1.00 0.00 C ATOM 484 N9 DA B 16 5.333 1.959 2.100 1.00 0.00 N ATOM 485 C8 DA B 16 5.306 1.649 0.781 1.00 0.00 C ATOM 486 N7 DA B 16 4.150 1.836 0.205 1.00 0.00 N ATOM 487 C5 DA B 16 3.331 2.239 1.262 1.00 0.00 C ATOM 488 C6 DA B 16 1.959 2.563 1.353 1.00 0.00 C ATOM 489 N6 DA B 16 1.161 2.681 0.284 1.00 0.00 N ATOM 490 N1 DA B 16 1.428 2.762 2.576 1.00 0.00 N ATOM 491 C2 DA B 16 2.221 2.690 3.645 1.00 0.00 C ATOM 492 N3 DA B 16 3.531 2.461 3.688 1.00 0.00 N ATOM 493 C4 DA B 16 4.034 2.241 2.444 1.00 0.00 C ATOM 0 H5' DA B 16 9.991 3.519 1.815 1.00 0.00 H new ATOM 0 H5'' DA B 16 10.859 2.155 2.493 1.00 0.00 H new ATOM 0 H4' DA B 16 9.024 2.655 3.888 1.00 0.00 H new ATOM 0 H3' DA B 16 9.009 0.066 2.514 1.00 0.00 H new ATOM 0 H2' DA B 16 6.813 -0.108 2.071 1.00 0.00 H new ATOM 0 H2'' DA B 16 6.546 -0.128 3.803 1.00 0.00 H new ATOM 0 H1' DA B 16 6.288 2.198 3.942 1.00 0.00 H new ATOM 0 H8 DA B 16 6.170 1.278 0.250 1.00 0.00 H new ATOM 0 H61 DA B 16 0.176 2.917 0.406 1.00 0.00 H new ATOM 0 H62 DA B 16 1.538 2.535 -0.652 1.00 0.00 H new ATOM 0 H2 DA B 16 1.738 2.836 4.600 1.00 0.00 H new HETATM 505 N1 T41 B 17 3.320 -0.986 4.180 1.00 0.00 N HETATM 506 C2 T41 B 17 2.016 -0.581 3.901 1.00 0.00 C HETATM 507 N3 T41 B 17 1.654 -0.567 2.563 1.00 0.00 N HETATM 508 C4 T41 B 17 2.455 -0.916 1.488 1.00 0.00 C HETATM 509 C5 T41 B 17 3.784 -1.348 1.867 1.00 0.00 C HETATM 510 C5M T41 B 17 4.766 -1.807 0.818 1.00 0.00 C HETATM 511 C6 T41 B 17 4.160 -1.363 3.163 1.00 0.00 C HETATM 512 O2 T41 B 17 1.209 -0.249 4.765 1.00 0.00 O HETATM 513 O4 T41 B 17 2.021 -0.844 0.342 1.00 0.00 O HETATM 514 C1' T41 B 17 3.782 -0.965 5.594 1.00 0.00 C HETATM 515 C2' T41 B 17 4.251 -2.251 6.196 1.00 0.00 C HETATM 516 O2' T41 B 17 5.117 -2.963 5.364 1.00 0.00 O HETATM 517 C3' T41 B 17 5.034 -1.789 7.416 1.00 0.00 C HETATM 518 C4' T41 B 17 5.532 -0.405 6.971 1.00 0.00 C HETATM 519 O3' T41 B 17 4.223 -1.600 8.568 1.00 0.00 O HETATM 520 O4' T41 B 17 4.836 -0.044 5.784 1.00 0.00 O HETATM 521 C5' T41 B 17 7.034 -0.361 6.662 1.00 0.00 C HETATM 522 O5' T41 B 17 7.395 -1.289 5.656 1.00 0.00 O HETATM 523 C6' T41 B 17 4.712 -4.288 5.417 1.00 0.00 C HETATM 524 P T41 B 17 8.868 -1.277 4.990 1.00 0.00 P HETATM 525 O1P T41 B 17 9.858 -1.482 6.071 1.00 0.00 O HETATM 526 O2P T41 B 17 8.851 -2.189 3.825 1.00 0.00 O HETATM 0 H5M3 T41 B 17 4.356 -2.666 0.287 1.00 0.00 H new HETATM 0 H5M2 T41 B 17 4.949 -0.997 0.112 1.00 0.00 H new HETATM 0 H5M1 T41 B 17 5.704 -2.090 1.296 1.00 0.00 H new HETATM 0 H5'2 T41 B 17 7.309 0.644 6.344 1.00 0.00 H new HETATM 0 H5'1 T41 B 17 7.598 -0.573 7.570 1.00 0.00 H new HETATM 0 H2'1 T41 B 17 3.413 -2.918 6.397 1.00 0.00 H new HETATM 0 H6 T41 B 17 5.171 -1.687 3.411 1.00 0.00 H new HETATM 0 H4' T41 B 17 5.348 0.280 7.798 1.00 0.00 H new HETATM 0 H3' T41 B 17 5.794 -2.518 7.697 1.00 0.00 H new HETATM 0 H3 T41 B 17 0.702 -0.270 2.348 1.00 0.00 H new HETATM 0 H13 T41 B 17 4.776 -4.647 6.444 1.00 0.00 H new HETATM 0 H12 T41 B 17 3.683 -4.368 5.068 1.00 0.00 H new HETATM 0 H11 T41 B 17 5.359 -4.892 4.781 1.00 0.00 H new HETATM 0 H1' T41 B 17 2.858 -0.691 6.104 1.00 0.00 H new ATOM 541 P DA B 18 3.560 -2.820 9.394 1.00 0.00 P ATOM 542 OP1 DA B 18 3.500 -2.425 10.819 1.00 0.00 O ATOM 543 OP2 DA B 18 4.241 -4.076 9.012 1.00 0.00 O ATOM 544 O5' DA B 18 2.051 -2.874 8.823 1.00 0.00 O ATOM 545 C5' DA B 18 1.065 -1.936 9.224 1.00 0.00 C ATOM 546 C4' DA B 18 -0.283 -2.305 8.595 1.00 0.00 C ATOM 547 O4' DA B 18 -0.148 -2.187 7.199 1.00 0.00 O ATOM 548 C3' DA B 18 -0.697 -3.748 8.913 1.00 0.00 C ATOM 549 O3' DA B 18 -1.922 -3.705 9.628 1.00 0.00 O ATOM 550 C2' DA B 18 -0.821 -4.354 7.515 1.00 0.00 C ATOM 551 C1' DA B 18 -1.013 -3.142 6.639 1.00 0.00 C ATOM 552 N9 DA B 18 -0.553 -3.331 5.248 1.00 0.00 N ATOM 553 C8 DA B 18 0.728 -3.617 4.846 1.00 0.00 C ATOM 554 N7 DA B 18 0.908 -3.595 3.557 1.00 0.00 N ATOM 555 C5 DA B 18 -0.347 -3.260 3.067 1.00 0.00 C ATOM 556 C6 DA B 18 -0.822 -3.028 1.764 1.00 0.00 C ATOM 557 N6 DA B 18 -0.054 -3.059 0.670 1.00 0.00 N ATOM 558 N1 DA B 18 -2.109 -2.691 1.616 1.00 0.00 N ATOM 559 C2 DA B 18 -2.909 -2.584 2.668 1.00 0.00 C ATOM 560 N3 DA B 18 -2.579 -2.768 3.950 1.00 0.00 N ATOM 561 C4 DA B 18 -1.261 -3.110 4.086 1.00 0.00 C ATOM 0 H5' DA B 18 1.358 -0.932 8.917 1.00 0.00 H new ATOM 0 H5'' DA B 18 0.980 -1.925 10.311 1.00 0.00 H new ATOM 0 H4' DA B 18 -1.046 -1.640 8.999 1.00 0.00 H new ATOM 0 H3' DA B 18 -0.016 -4.328 9.537 1.00 0.00 H new ATOM 0 H2' DA B 18 0.071 -4.916 7.238 1.00 0.00 H new ATOM 0 H2'' DA B 18 -1.665 -5.041 7.446 1.00 0.00 H new ATOM 0 H1' DA B 18 -2.072 -2.889 6.601 1.00 0.00 H new ATOM 0 H8 DA B 18 1.522 -3.842 5.543 1.00 0.00 H new ATOM 0 H61 DA B 18 -0.465 -2.881 -0.247 1.00 0.00 H new ATOM 0 H62 DA B 18 0.943 -3.261 0.752 1.00 0.00 H new ATOM 0 H2 DA B 18 -3.937 -2.320 2.468 1.00 0.00 H new ATOM 573 P DT B 19 -2.753 -5.031 10.030 1.00 0.00 P ATOM 574 OP1 DT B 19 -3.555 -4.728 11.236 1.00 0.00 O ATOM 575 OP2 DT B 19 -1.833 -6.191 10.027 1.00 0.00 O ATOM 576 O5' DT B 19 -3.759 -5.179 8.778 1.00 0.00 O ATOM 577 C5' DT B 19 -4.721 -4.180 8.492 1.00 0.00 C ATOM 578 C4' DT B 19 -5.540 -4.550 7.252 1.00 0.00 C ATOM 579 O4' DT B 19 -4.668 -4.475 6.136 1.00 0.00 O ATOM 580 C3' DT B 19 -6.098 -5.981 7.322 1.00 0.00 C ATOM 581 O3' DT B 19 -7.491 -5.947 7.049 1.00 0.00 O ATOM 582 C2' DT B 19 -5.313 -6.700 6.225 1.00 0.00 C ATOM 583 C1' DT B 19 -4.969 -5.564 5.292 1.00 0.00 C ATOM 584 N1 DT B 19 -3.854 -5.817 4.360 1.00 0.00 N ATOM 585 C2 DT B 19 -4.017 -5.680 2.984 1.00 0.00 C ATOM 586 O2 DT B 19 -5.081 -5.376 2.451 1.00 0.00 O ATOM 587 N3 DT B 19 -2.879 -5.912 2.223 1.00 0.00 N ATOM 588 C4 DT B 19 -1.628 -6.276 2.703 1.00 0.00 C ATOM 589 O4 DT B 19 -0.692 -6.431 1.923 1.00 0.00 O ATOM 590 C5 DT B 19 -1.567 -6.435 4.145 1.00 0.00 C ATOM 591 C7 DT B 19 -0.280 -6.897 4.798 1.00 0.00 C ATOM 592 C6 DT B 19 -2.669 -6.189 4.897 1.00 0.00 C ATOM 0 H5' DT B 19 -4.222 -3.224 8.332 1.00 0.00 H new ATOM 0 H5'' DT B 19 -5.385 -4.053 9.347 1.00 0.00 H new ATOM 0 H4' DT B 19 -6.386 -3.866 7.179 1.00 0.00 H new ATOM 0 H3' DT B 19 -5.992 -6.471 8.290 1.00 0.00 H new ATOM 0 H2' DT B 19 -4.422 -7.192 6.616 1.00 0.00 H new ATOM 0 H2'' DT B 19 -5.910 -7.467 5.732 1.00 0.00 H new ATOM 0 H1' DT B 19 -5.814 -5.391 4.626 1.00 0.00 H new ATOM 0 H3 DT B 19 -2.971 -5.805 1.213 1.00 0.00 H new ATOM 0 H71 DT B 19 -0.209 -6.476 5.801 1.00 0.00 H new ATOM 0 H72 DT B 19 -0.274 -7.985 4.860 1.00 0.00 H new ATOM 0 H73 DT B 19 0.570 -6.562 4.204 1.00 0.00 H new ATOM 0 H6 DT B 19 -2.597 -6.295 5.969 1.00 0.00 H new ATOM 605 P DG B 20 -8.408 -7.281 7.051 1.00 0.00 P ATOM 606 OP1 DG B 20 -9.768 -6.902 7.494 1.00 0.00 O ATOM 607 OP2 DG B 20 -7.680 -8.356 7.761 1.00 0.00 O ATOM 608 O5' DG B 20 -8.478 -7.676 5.485 1.00 0.00 O ATOM 609 C5' DG B 20 -9.210 -6.890 4.564 1.00 0.00 C ATOM 610 C4' DG B 20 -9.248 -7.533 3.172 1.00 0.00 C ATOM 611 O4' DG B 20 -7.955 -7.466 2.593 1.00 0.00 O ATOM 612 C3' DG B 20 -9.644 -9.015 3.217 1.00 0.00 C ATOM 613 O3' DG B 20 -10.569 -9.199 2.156 1.00 0.00 O ATOM 614 C2' DG B 20 -8.299 -9.711 3.008 1.00 0.00 C ATOM 615 C1' DG B 20 -7.650 -8.734 2.042 1.00 0.00 C ATOM 616 N9 DG B 20 -6.181 -8.813 1.945 1.00 0.00 N ATOM 617 C8 DG B 20 -5.278 -9.011 2.949 1.00 0.00 C ATOM 618 N7 DG B 20 -4.031 -8.975 2.569 1.00 0.00 N ATOM 619 C5 DG B 20 -4.113 -8.756 1.196 1.00 0.00 C ATOM 620 C6 DG B 20 -3.082 -8.676 0.212 1.00 0.00 C ATOM 621 O6 DG B 20 -1.868 -8.676 0.391 1.00 0.00 O ATOM 622 N1 DG B 20 -3.584 -8.591 -1.085 1.00 0.00 N ATOM 623 C2 DG B 20 -4.931 -8.542 -1.395 1.00 0.00 C ATOM 624 N2 DG B 20 -5.267 -8.483 -2.687 1.00 0.00 N ATOM 625 N3 DG B 20 -5.901 -8.562 -0.468 1.00 0.00 N ATOM 626 C4 DG B 20 -5.428 -8.679 0.802 1.00 0.00 C ATOM 0 H5' DG B 20 -8.762 -5.899 4.495 1.00 0.00 H new ATOM 0 H5'' DG B 20 -10.228 -6.754 4.930 1.00 0.00 H new ATOM 0 H4' DG B 20 -9.992 -6.986 2.593 1.00 0.00 H new ATOM 0 H3' DG B 20 -10.125 -9.391 4.120 1.00 0.00 H new ATOM 0 H2' DG B 20 -7.736 -9.818 3.935 1.00 0.00 H new ATOM 0 H2'' DG B 20 -8.407 -10.709 2.583 1.00 0.00 H new ATOM 0 H1' DG B 20 -8.020 -8.942 1.038 1.00 0.00 H new ATOM 0 H8 DG B 20 -5.572 -9.183 3.974 1.00 0.00 H new ATOM 0 H1 DG B 20 -2.916 -8.563 -1.855 1.00 0.00 H new ATOM 0 H21 DG B 20 -6.250 -8.446 -2.957 1.00 0.00 H new ATOM 0 H22 DG B 20 -4.541 -8.475 -3.403 1.00 0.00 H new ATOM 638 P DC B 21 -11.147 -10.632 1.689 1.00 0.00 P ATOM 639 OP1 DC B 21 -12.587 -10.472 1.386 1.00 0.00 O ATOM 640 OP2 DC B 21 -10.707 -11.676 2.641 1.00 0.00 O ATOM 641 O5' DC B 21 -10.357 -10.834 0.296 1.00 0.00 O ATOM 642 C5' DC B 21 -10.512 -9.904 -0.762 1.00 0.00 C ATOM 643 C4' DC B 21 -9.806 -10.362 -2.044 1.00 0.00 C ATOM 644 O4' DC B 21 -8.411 -10.292 -1.802 1.00 0.00 O ATOM 645 C3' DC B 21 -10.152 -11.810 -2.415 1.00 0.00 C ATOM 646 O3' DC B 21 -10.335 -11.879 -3.820 1.00 0.00 O ATOM 647 C2' DC B 21 -8.906 -12.557 -1.944 1.00 0.00 C ATOM 648 C1' DC B 21 -7.820 -11.515 -2.197 1.00 0.00 C ATOM 649 N1 DC B 21 -6.629 -11.708 -1.328 1.00 0.00 N ATOM 650 C2 DC B 21 -5.355 -11.747 -1.900 1.00 0.00 C ATOM 651 O2 DC B 21 -5.196 -11.707 -3.117 1.00 0.00 O ATOM 652 N3 DC B 21 -4.272 -11.832 -1.074 1.00 0.00 N ATOM 653 C4 DC B 21 -4.418 -11.883 0.258 1.00 0.00 C ATOM 654 N4 DC B 21 -3.324 -11.937 1.023 1.00 0.00 N ATOM 655 C5 DC B 21 -5.715 -11.812 0.866 1.00 0.00 C ATOM 656 C6 DC B 21 -6.778 -11.725 0.037 1.00 0.00 C ATOM 0 H5' DC B 21 -10.113 -8.937 -0.455 1.00 0.00 H new ATOM 0 H5'' DC B 21 -11.573 -9.761 -0.965 1.00 0.00 H new ATOM 0 H4' DC B 21 -10.126 -9.722 -2.866 1.00 0.00 H new ATOM 0 H3' DC B 21 -11.063 -12.215 -1.975 1.00 0.00 H new ATOM 0 H2' DC B 21 -8.968 -12.839 -0.893 1.00 0.00 H new ATOM 0 H2'' DC B 21 -8.737 -13.473 -2.510 1.00 0.00 H new ATOM 0 H1' DC B 21 -7.489 -11.567 -3.234 1.00 0.00 H new ATOM 0 H41 DC B 21 -3.413 -11.976 2.038 1.00 0.00 H new ATOM 0 H42 DC B 21 -2.400 -11.939 0.592 1.00 0.00 H new ATOM 0 H5 DC B 21 -5.836 -11.827 1.939 1.00 0.00 H new ATOM 0 H6 DC B 21 -7.771 -11.667 0.459 1.00 0.00 H new ATOM 668 P DG B 22 -10.713 -13.253 -4.584 1.00 0.00 P ATOM 669 OP1 DG B 22 -11.491 -12.909 -5.795 1.00 0.00 O ATOM 670 OP2 DG B 22 -11.269 -14.208 -3.599 1.00 0.00 O ATOM 671 O5' DG B 22 -9.269 -13.797 -5.051 1.00 0.00 O ATOM 672 C5' DG B 22 -8.556 -13.167 -6.098 1.00 0.00 C ATOM 673 C4' DG B 22 -7.204 -13.851 -6.316 1.00 0.00 C ATOM 674 O4' DG B 22 -6.435 -13.681 -5.140 1.00 0.00 O ATOM 675 C3' DG B 22 -7.331 -15.364 -6.552 1.00 0.00 C ATOM 676 O3' DG B 22 -6.730 -15.716 -7.781 1.00 0.00 O ATOM 677 C2' DG B 22 -6.543 -15.969 -5.397 1.00 0.00 C ATOM 678 C1' DG B 22 -5.619 -14.825 -5.026 1.00 0.00 C ATOM 679 N9 DG B 22 -5.087 -14.895 -3.646 1.00 0.00 N ATOM 680 C8 DG B 22 -5.765 -15.025 -2.460 1.00 0.00 C ATOM 681 N7 DG B 22 -5.003 -14.983 -1.402 1.00 0.00 N ATOM 682 C5 DG B 22 -3.722 -14.815 -1.919 1.00 0.00 C ATOM 683 C6 DG B 22 -2.469 -14.667 -1.251 1.00 0.00 C ATOM 684 O6 DG B 22 -2.252 -14.648 -0.042 1.00 0.00 O ATOM 685 N1 DG B 22 -1.404 -14.530 -2.139 1.00 0.00 N ATOM 686 C2 DG B 22 -1.531 -14.534 -3.515 1.00 0.00 C ATOM 687 N2 DG B 22 -0.416 -14.386 -4.237 1.00 0.00 N ATOM 688 N3 DG B 22 -2.711 -14.645 -4.144 1.00 0.00 N ATOM 689 C4 DG B 22 -3.764 -14.778 -3.293 1.00 0.00 C ATOM 0 H5' DG B 22 -8.403 -12.115 -5.859 1.00 0.00 H new ATOM 0 H5'' DG B 22 -9.141 -13.204 -7.017 1.00 0.00 H new ATOM 0 H4' DG B 22 -6.749 -13.401 -7.199 1.00 0.00 H new ATOM 0 H3' DG B 22 -8.365 -15.705 -6.594 1.00 0.00 H new ATOM 0 H2' DG B 22 -7.189 -16.260 -4.568 1.00 0.00 H new ATOM 0 H2'' DG B 22 -5.992 -16.860 -5.699 1.00 0.00 H new ATOM 0 HO3' DG B 22 -6.815 -16.682 -7.922 1.00 0.00 H new ATOM 0 H1' DG B 22 -4.739 -14.835 -5.670 1.00 0.00 H new ATOM 0 H8 DG B 22 -6.836 -15.151 -2.407 1.00 0.00 H new ATOM 0 H1 DG B 22 -0.469 -14.419 -1.747 1.00 0.00 H new ATOM 0 H21 DG B 22 -0.465 -14.383 -5.256 1.00 0.00 H new ATOM 0 H22 DG B 22 0.484 -14.276 -3.769 1.00 0.00 H new TER 702 DG B 22