USER MOD reduce.3.24.130724 H: found=0, std=0, add=241, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 241 hydrogens (36 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 -30:sc=0.000608 USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 9 DG O5' : rot 17:sc= 0.645 USER MOD Single : B 13 DT C7 :methyl -30:sc= -1.14 (180deg=-3.07!) USER MOD Single : B 14 DT C7 :methyl -30:sc= -6.45! (180deg=-6.71!) USER MOD Single : B 18 DG O3' : rot 180:sc= 0 USER MOD Single : B 21 NCS O3' : rot -108:sc= 0.568 USER MOD Single : B 21 NCS O4' : rot -34:sc= 0.0469 USER MOD Single : B 21 NCS O9 : rot 145:sc= -0.0376 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 -8.668 -1.227 6.252 1.00 0.00 O ATOM 2 C5' DC A 1 -7.915 -2.165 5.480 1.00 0.00 C ATOM 3 C4' DC A 1 -7.845 -1.752 4.013 1.00 0.00 C ATOM 4 O4' DC A 1 -7.254 -0.457 3.882 1.00 0.00 O ATOM 5 C3' DC A 1 -7.008 -2.738 3.204 1.00 0.00 C ATOM 6 O3' DC A 1 -7.766 -3.283 2.120 1.00 0.00 O ATOM 7 C2' DC A 1 -5.835 -1.912 2.688 1.00 0.00 C ATOM 8 C1' DC A 1 -6.290 -0.464 2.826 1.00 0.00 C ATOM 9 N1 DC A 1 -5.182 0.472 3.095 1.00 0.00 N ATOM 10 C2 DC A 1 -5.520 1.802 3.266 1.00 0.00 C ATOM 11 O2 DC A 1 -6.698 2.154 3.250 1.00 0.00 O ATOM 12 N3 DC A 1 -4.526 2.707 3.460 1.00 0.00 N ATOM 13 C4 DC A 1 -3.241 2.332 3.489 1.00 0.00 C ATOM 14 N4 DC A 1 -2.299 3.257 3.674 1.00 0.00 N ATOM 15 C5 DC A 1 -2.881 0.955 3.319 1.00 0.00 C ATOM 16 C6 DC A 1 -3.879 0.067 3.125 1.00 0.00 C ATOM 0 H5' DC A 1 -8.370 -3.152 5.560 1.00 0.00 H new ATOM 0 H5'' DC A 1 -6.906 -2.245 5.885 1.00 0.00 H new ATOM 0 H4' DC A 1 -8.867 -1.740 3.634 1.00 0.00 H new ATOM 0 H3' DC A 1 -6.682 -3.590 3.801 1.00 0.00 H new ATOM 0 H2' DC A 1 -4.932 -2.100 3.269 1.00 0.00 H new ATOM 0 H2'' DC A 1 -5.604 -2.157 1.651 1.00 0.00 H new ATOM 0 HO5' DC A 1 -8.580 -0.334 5.858 1.00 0.00 H new ATOM 0 H1' DC A 1 -6.715 -0.112 1.886 1.00 0.00 H new ATOM 0 H41 DC A 1 -1.316 2.986 3.698 1.00 0.00 H new ATOM 0 H42 DC A 1 -2.561 4.236 3.791 1.00 0.00 H new ATOM 0 H5 DC A 1 -1.848 0.639 3.345 1.00 0.00 H new ATOM 0 H6 DC A 1 -3.643 -0.978 2.992 1.00 0.00 H new ATOM 29 P DC A 2 -7.101 -4.282 1.046 1.00 0.00 P ATOM 30 OP1 DC A 2 -8.003 -5.442 0.871 1.00 0.00 O ATOM 31 OP2 DC A 2 -5.685 -4.499 1.421 1.00 0.00 O ATOM 32 O5' DC A 2 -7.127 -3.410 -0.307 1.00 0.00 O ATOM 33 C5' DC A 2 -8.369 -2.999 -0.885 1.00 0.00 C ATOM 34 C4' DC A 2 -8.168 -2.258 -2.203 1.00 0.00 C ATOM 35 O4' DC A 2 -7.449 -1.040 -1.995 1.00 0.00 O ATOM 36 C3' DC A 2 -7.396 -3.116 -3.199 1.00 0.00 C ATOM 37 O3' DC A 2 -8.199 -3.413 -4.345 1.00 0.00 O ATOM 38 C2' DC A 2 -6.170 -2.293 -3.580 1.00 0.00 C ATOM 39 C1' DC A 2 -6.275 -0.981 -2.809 1.00 0.00 C ATOM 40 N1 DC A 2 -5.084 -0.770 -1.965 1.00 0.00 N ATOM 41 C2 DC A 2 -4.466 0.466 -2.020 1.00 0.00 C ATOM 42 O2 DC A 2 -4.862 1.333 -2.797 1.00 0.00 O ATOM 43 N3 DC A 2 -3.405 0.691 -1.202 1.00 0.00 N ATOM 44 C4 DC A 2 -2.964 -0.254 -0.362 1.00 0.00 C ATOM 45 N4 DC A 2 -1.936 0.027 0.438 1.00 0.00 N ATOM 46 C5 DC A 2 -3.593 -1.541 -0.305 1.00 0.00 C ATOM 47 C6 DC A 2 -4.646 -1.752 -1.124 1.00 0.00 C ATOM 0 H5' DC A 2 -8.900 -2.355 -0.184 1.00 0.00 H new ATOM 0 H5'' DC A 2 -8.998 -3.873 -1.053 1.00 0.00 H new ATOM 0 H4' DC A 2 -9.157 -2.036 -2.604 1.00 0.00 H new ATOM 0 H3' DC A 2 -7.112 -4.078 -2.772 1.00 0.00 H new ATOM 0 H2' DC A 2 -5.252 -2.822 -3.323 1.00 0.00 H new ATOM 0 H2'' DC A 2 -6.143 -2.111 -4.654 1.00 0.00 H new ATOM 0 H1' DC A 2 -6.336 -0.147 -3.508 1.00 0.00 H new ATOM 0 H41 DC A 2 -1.585 -0.679 1.085 1.00 0.00 H new ATOM 0 H42 DC A 2 -1.500 0.948 0.403 1.00 0.00 H new ATOM 0 H5 DC A 2 -3.239 -2.310 0.365 1.00 0.00 H new ATOM 0 H6 DC A 2 -5.147 -2.709 -1.113 1.00 0.00 H new ATOM 59 P DC A 3 -7.574 -4.147 -5.635 1.00 0.00 P ATOM 60 OP1 DC A 3 -8.687 -4.672 -6.457 1.00 0.00 O ATOM 61 OP2 DC A 3 -6.502 -5.059 -5.179 1.00 0.00 O ATOM 62 O5' DC A 3 -6.886 -2.928 -6.430 1.00 0.00 O ATOM 63 C5' DC A 3 -7.672 -1.824 -6.887 1.00 0.00 C ATOM 64 C4' DC A 3 -6.809 -0.733 -7.513 1.00 0.00 C ATOM 65 O4' DC A 3 -5.930 -0.161 -6.542 1.00 0.00 O ATOM 66 C3' DC A 3 -5.967 -1.291 -8.656 1.00 0.00 C ATOM 67 O3' DC A 3 -6.414 -0.775 -9.913 1.00 0.00 O ATOM 68 C2' DC A 3 -4.538 -0.852 -8.356 1.00 0.00 C ATOM 69 C1' DC A 3 -4.599 -0.059 -7.055 1.00 0.00 C ATOM 70 N1 DC A 3 -3.629 -0.569 -6.067 1.00 0.00 N ATOM 71 C2 DC A 3 -2.825 0.356 -5.426 1.00 0.00 C ATOM 72 O2 DC A 3 -2.898 1.551 -5.704 1.00 0.00 O ATOM 73 N3 DC A 3 -1.951 -0.091 -4.487 1.00 0.00 N ATOM 74 C4 DC A 3 -1.861 -1.392 -4.183 1.00 0.00 C ATOM 75 N4 DC A 3 -0.993 -1.775 -3.248 1.00 0.00 N ATOM 76 C5 DC A 3 -2.689 -2.357 -4.846 1.00 0.00 C ATOM 77 C6 DC A 3 -3.555 -1.901 -5.776 1.00 0.00 C ATOM 0 H5' DC A 3 -8.234 -1.408 -6.051 1.00 0.00 H new ATOM 0 H5'' DC A 3 -8.401 -2.175 -7.618 1.00 0.00 H new ATOM 0 H4' DC A 3 -7.485 0.032 -7.896 1.00 0.00 H new ATOM 0 H3' DC A 3 -6.045 -2.376 -8.728 1.00 0.00 H new ATOM 0 H2' DC A 3 -3.879 -1.715 -8.255 1.00 0.00 H new ATOM 0 H2'' DC A 3 -4.141 -0.240 -9.166 1.00 0.00 H new ATOM 0 H1' DC A 3 -4.340 0.982 -7.250 1.00 0.00 H new ATOM 0 H41 DC A 3 -0.910 -2.762 -3.003 1.00 0.00 H new ATOM 0 H42 DC A 3 -0.411 -1.082 -2.777 1.00 0.00 H new ATOM 0 H5 DC A 3 -2.622 -3.409 -4.610 1.00 0.00 H new ATOM 0 H6 DC A 3 -4.196 -2.598 -6.296 1.00 0.00 H new ATOM 89 P DG A 4 -5.794 -1.320 -11.295 1.00 0.00 P ATOM 90 OP1 DG A 4 -6.692 -0.912 -12.398 1.00 0.00 O ATOM 91 OP2 DG A 4 -5.448 -2.748 -11.118 1.00 0.00 O ATOM 92 O5' DG A 4 -4.422 -0.486 -11.420 1.00 0.00 O ATOM 93 C5' DG A 4 -4.428 0.924 -11.656 1.00 0.00 C ATOM 94 C4' DG A 4 -3.010 1.459 -11.835 1.00 0.00 C ATOM 95 O4' DG A 4 -2.310 1.498 -10.589 1.00 0.00 O ATOM 96 C3' DG A 4 -2.238 0.561 -12.796 1.00 0.00 C ATOM 97 O3' DG A 4 -2.007 1.221 -14.043 1.00 0.00 O ATOM 98 C2' DG A 4 -0.927 0.254 -12.080 1.00 0.00 C ATOM 99 C1' DG A 4 -0.974 1.017 -10.761 1.00 0.00 C ATOM 100 N9 DG A 4 -0.574 0.164 -9.625 1.00 0.00 N ATOM 101 C8 DG A 4 -0.841 -1.156 -9.372 1.00 0.00 C ATOM 102 N7 DG A 4 -0.357 -1.650 -8.267 1.00 0.00 N ATOM 103 C5 DG A 4 0.296 -0.546 -7.728 1.00 0.00 C ATOM 104 C6 DG A 4 1.027 -0.443 -6.516 1.00 0.00 C ATOM 105 O6 DG A 4 1.255 -1.315 -5.680 1.00 0.00 O ATOM 106 N1 DG A 4 1.531 0.837 -6.330 1.00 0.00 N ATOM 107 C2 DG A 4 1.357 1.894 -7.202 1.00 0.00 C ATOM 108 N2 DG A 4 1.914 3.053 -6.851 1.00 0.00 N ATOM 109 N3 DG A 4 0.667 1.797 -8.346 1.00 0.00 N ATOM 110 C4 DG A 4 0.170 0.552 -8.538 1.00 0.00 C ATOM 0 H5' DG A 4 -4.909 1.433 -10.821 1.00 0.00 H new ATOM 0 H5'' DG A 4 -5.018 1.144 -12.546 1.00 0.00 H new ATOM 0 H4' DG A 4 -3.084 2.471 -12.233 1.00 0.00 H new ATOM 0 H3' DG A 4 -2.789 -0.347 -13.039 1.00 0.00 H new ATOM 0 H2' DG A 4 -0.820 -0.817 -11.907 1.00 0.00 H new ATOM 0 H2'' DG A 4 -0.073 0.567 -12.681 1.00 0.00 H new ATOM 0 H1' DG A 4 -0.267 1.847 -10.789 1.00 0.00 H new ATOM 0 H8 DG A 4 -1.424 -1.757 -10.054 1.00 0.00 H new ATOM 0 H1 DG A 4 2.072 1.011 -5.483 1.00 0.00 H new ATOM 0 H21 DG A 4 1.819 3.869 -7.456 1.00 0.00 H new ATOM 0 H22 DG A 4 2.436 3.124 -5.977 1.00 0.00 H new ATOM 122 P DA A 5 -0.899 0.680 -15.079 1.00 0.00 P ATOM 123 OP1 DA A 5 -1.244 1.194 -16.423 1.00 0.00 O ATOM 124 OP2 DA A 5 -0.736 -0.777 -14.874 1.00 0.00 O ATOM 125 O5' DA A 5 0.464 1.398 -14.612 1.00 0.00 O ATOM 126 C5' DA A 5 0.536 2.808 -14.383 1.00 0.00 C ATOM 127 C4' DA A 5 1.988 3.251 -14.229 1.00 0.00 C ATOM 128 O4' DA A 5 2.562 2.742 -13.022 1.00 0.00 O ATOM 129 C3' DA A 5 2.784 2.733 -15.423 1.00 0.00 C ATOM 130 O3' DA A 5 3.532 3.791 -16.026 1.00 0.00 O ATOM 131 C2' DA A 5 3.711 1.675 -14.832 1.00 0.00 C ATOM 132 C1' DA A 5 3.596 1.800 -13.316 1.00 0.00 C ATOM 133 N9 DA A 5 3.322 0.528 -12.620 1.00 0.00 N ATOM 134 C8 DA A 5 2.742 -0.632 -13.065 1.00 0.00 C ATOM 135 N7 DA A 5 2.497 -1.553 -12.175 1.00 0.00 N ATOM 136 C5 DA A 5 2.966 -0.945 -11.015 1.00 0.00 C ATOM 137 C6 DA A 5 3.019 -1.374 -9.679 1.00 0.00 C ATOM 138 N6 DA A 5 2.647 -2.588 -9.271 1.00 0.00 N ATOM 139 N1 DA A 5 3.543 -0.527 -8.785 1.00 0.00 N ATOM 140 C2 DA A 5 4.008 0.657 -9.150 1.00 0.00 C ATOM 141 N3 DA A 5 4.004 1.164 -10.374 1.00 0.00 N ATOM 142 C4 DA A 5 3.463 0.306 -11.271 1.00 0.00 C ATOM 0 H5' DA A 5 -0.026 3.066 -13.485 1.00 0.00 H new ATOM 0 H5'' DA A 5 0.073 3.341 -15.213 1.00 0.00 H new ATOM 0 H4' DA A 5 2.019 4.340 -14.185 1.00 0.00 H new ATOM 0 H3' DA A 5 2.145 2.328 -16.208 1.00 0.00 H new ATOM 0 H2' DA A 5 3.422 0.677 -15.162 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.739 1.834 -15.158 1.00 0.00 H new ATOM 0 H1' DA A 5 4.567 2.132 -12.948 1.00 0.00 H new ATOM 0 H8 DA A 5 2.499 -0.777 -14.107 1.00 0.00 H new ATOM 0 H61 DA A 5 2.711 -2.836 -8.284 1.00 0.00 H new ATOM 0 H62 DA A 5 2.299 -3.268 -9.946 1.00 0.00 H new ATOM 0 H2 DA A 5 4.434 1.272 -8.371 1.00 0.00 H new ATOM 154 P DT A 6 3.901 3.805 -17.593 1.00 0.00 P ATOM 155 OP1 DT A 6 4.903 4.874 -17.804 1.00 0.00 O ATOM 156 OP2 DT A 6 2.631 3.849 -18.351 1.00 0.00 O ATOM 157 O5' DT A 6 4.610 2.396 -17.918 1.00 0.00 O ATOM 158 C5' DT A 6 6.026 2.233 -17.797 1.00 0.00 C ATOM 159 C4' DT A 6 6.516 0.920 -18.400 1.00 0.00 C ATOM 160 O4' DT A 6 5.705 -0.194 -18.018 1.00 0.00 O ATOM 161 C3' DT A 6 6.511 1.007 -19.922 1.00 0.00 C ATOM 162 O3' DT A 6 7.820 0.763 -20.443 1.00 0.00 O ATOM 163 C2' DT A 6 5.528 -0.071 -20.368 1.00 0.00 C ATOM 164 C1' DT A 6 5.425 -1.002 -19.164 1.00 0.00 C ATOM 165 N1 DT A 6 4.089 -1.621 -19.078 1.00 0.00 N ATOM 166 C2 DT A 6 4.015 -3.002 -19.119 1.00 0.00 C ATOM 167 O2 DT A 6 4.995 -3.725 -19.283 1.00 0.00 O ATOM 168 N3 DT A 6 2.743 -3.535 -18.956 1.00 0.00 N ATOM 169 C4 DT A 6 1.569 -2.823 -18.756 1.00 0.00 C ATOM 170 O4 DT A 6 0.516 -3.427 -18.561 1.00 0.00 O ATOM 171 C5 DT A 6 1.757 -1.391 -18.744 1.00 0.00 C ATOM 172 C7 DT A 6 0.554 -0.474 -18.550 1.00 0.00 C ATOM 173 C6 DT A 6 2.976 -0.851 -18.904 1.00 0.00 C ATOM 0 H5' DT A 6 6.304 2.272 -16.744 1.00 0.00 H new ATOM 0 H5'' DT A 6 6.528 3.065 -18.290 1.00 0.00 H new ATOM 0 H4' DT A 6 7.525 0.763 -18.020 1.00 0.00 H new ATOM 0 H3' DT A 6 6.221 1.994 -20.283 1.00 0.00 H new ATOM 0 H2' DT A 6 4.559 0.356 -20.626 1.00 0.00 H new ATOM 0 H2'' DT A 6 5.889 -0.599 -21.251 1.00 0.00 H new ATOM 0 H1' DT A 6 6.129 -1.830 -19.241 1.00 0.00 H new ATOM 0 H3 DT A 6 2.664 -4.551 -18.986 1.00 0.00 H new ATOM 0 H71 DT A 6 0.871 0.442 -18.051 1.00 0.00 H new ATOM 0 H72 DT A 6 0.124 -0.228 -19.521 1.00 0.00 H new ATOM 0 H73 DT A 6 -0.194 -0.979 -17.939 1.00 0.00 H new ATOM 0 H6 DT A 6 3.078 0.224 -18.895 1.00 0.00 H new ATOM 186 P DG A 7 8.089 0.573 -22.019 1.00 0.00 P ATOM 187 OP1 DG A 7 9.509 0.895 -22.285 1.00 0.00 O ATOM 188 OP2 DG A 7 7.024 1.279 -22.765 1.00 0.00 O ATOM 189 O5' DG A 7 7.883 -1.010 -22.230 1.00 0.00 O ATOM 190 C5' DG A 7 8.867 -1.946 -21.782 1.00 0.00 C ATOM 191 C4' DG A 7 8.540 -3.371 -22.215 1.00 0.00 C ATOM 192 O4' DG A 7 7.312 -3.811 -21.629 1.00 0.00 O ATOM 193 C3' DG A 7 8.408 -3.471 -23.731 1.00 0.00 C ATOM 194 O3' DG A 7 9.327 -4.436 -24.250 1.00 0.00 O ATOM 195 C2' DG A 7 6.970 -3.922 -23.966 1.00 0.00 C ATOM 196 C1' DG A 7 6.529 -4.485 -22.619 1.00 0.00 C ATOM 197 N9 DG A 7 5.080 -4.321 -22.394 1.00 0.00 N ATOM 198 C8 DG A 7 4.298 -3.195 -22.375 1.00 0.00 C ATOM 199 N7 DG A 7 3.036 -3.364 -22.092 1.00 0.00 N ATOM 200 C5 DG A 7 2.968 -4.741 -21.907 1.00 0.00 C ATOM 201 C6 DG A 7 1.850 -5.549 -21.575 1.00 0.00 C ATOM 202 O6 DG A 7 0.690 -5.211 -21.348 1.00 0.00 O ATOM 203 N1 DG A 7 2.198 -6.890 -21.484 1.00 0.00 N ATOM 204 C2 DG A 7 3.465 -7.399 -21.688 1.00 0.00 C ATOM 205 N2 DG A 7 3.604 -8.719 -21.570 1.00 0.00 N ATOM 206 N3 DG A 7 4.521 -6.636 -21.998 1.00 0.00 N ATOM 207 C4 DG A 7 4.194 -5.325 -22.089 1.00 0.00 C ATOM 0 H5' DG A 7 8.938 -1.905 -20.695 1.00 0.00 H new ATOM 0 H5'' DG A 7 9.843 -1.662 -22.176 1.00 0.00 H new ATOM 0 H4' DG A 7 9.362 -4.002 -21.877 1.00 0.00 H new ATOM 0 H3' DG A 7 8.631 -2.527 -24.229 1.00 0.00 H new ATOM 0 H2' DG A 7 6.338 -3.090 -24.276 1.00 0.00 H new ATOM 0 H2'' DG A 7 6.912 -4.676 -24.751 1.00 0.00 H new ATOM 0 H1' DG A 7 6.694 -5.562 -22.575 1.00 0.00 H new ATOM 0 H8 DG A 7 4.706 -2.217 -22.584 1.00 0.00 H new ATOM 0 H1 DG A 7 1.459 -7.552 -21.248 1.00 0.00 H new ATOM 0 H21 DG A 7 4.518 -9.150 -21.710 1.00 0.00 H new ATOM 0 H22 DG A 7 2.797 -9.298 -21.340 1.00 0.00 H new ATOM 219 P DC A 8 9.292 -4.875 -25.798 1.00 0.00 P ATOM 220 OP1 DC A 8 10.629 -5.395 -26.163 1.00 0.00 O ATOM 221 OP2 DC A 8 8.692 -3.774 -26.585 1.00 0.00 O ATOM 222 O5' DC A 8 8.257 -6.109 -25.791 1.00 0.00 O ATOM 223 C5' DC A 8 8.643 -7.378 -25.256 1.00 0.00 C ATOM 224 C4' DC A 8 7.832 -8.520 -25.859 1.00 0.00 C ATOM 225 O4' DC A 8 6.493 -8.508 -25.355 1.00 0.00 O ATOM 226 C3' DC A 8 7.773 -8.414 -27.379 1.00 0.00 C ATOM 227 O3' DC A 8 8.309 -9.589 -27.993 1.00 0.00 O ATOM 228 C2' DC A 8 6.292 -8.268 -27.713 1.00 0.00 C ATOM 229 C1' DC A 8 5.546 -8.593 -26.423 1.00 0.00 C ATOM 230 N1 DC A 8 4.419 -7.670 -26.192 1.00 0.00 N ATOM 231 C2 DC A 8 3.208 -8.223 -25.819 1.00 0.00 C ATOM 232 O2 DC A 8 3.073 -9.442 -25.744 1.00 0.00 O ATOM 233 N3 DC A 8 2.172 -7.388 -25.545 1.00 0.00 N ATOM 234 C4 DC A 8 2.312 -6.059 -25.632 1.00 0.00 C ATOM 235 N4 DC A 8 1.272 -5.279 -25.333 1.00 0.00 N ATOM 236 C5 DC A 8 3.561 -5.477 -26.024 1.00 0.00 C ATOM 237 C6 DC A 8 4.582 -6.319 -26.295 1.00 0.00 C ATOM 0 H5' DC A 8 8.511 -7.371 -24.174 1.00 0.00 H new ATOM 0 H5'' DC A 8 9.703 -7.545 -25.447 1.00 0.00 H new ATOM 0 H4' DC A 8 8.329 -9.449 -25.579 1.00 0.00 H new ATOM 0 H3' DC A 8 8.362 -7.574 -27.747 1.00 0.00 H new ATOM 0 H2' DC A 8 6.065 -7.258 -28.053 1.00 0.00 H new ATOM 0 H2'' DC A 8 6.002 -8.947 -28.515 1.00 0.00 H new ATOM 0 HO3' DC A 8 8.260 -9.500 -28.968 1.00 0.00 H new ATOM 0 H1' DC A 8 5.115 -9.592 -26.487 1.00 0.00 H new ATOM 0 H41 DC A 8 1.361 -4.265 -25.394 1.00 0.00 H new ATOM 0 H42 DC A 8 0.388 -5.697 -25.044 1.00 0.00 H new ATOM 0 H5 DC A 8 3.682 -4.406 -26.100 1.00 0.00 H new ATOM 0 H6 DC A 8 5.538 -5.918 -26.597 1.00 0.00 H new TER 250 DC A 8 ATOM 251 O5' DG B 9 -6.020 -10.458 -21.475 1.00 0.00 O ATOM 252 C5' DG B 9 -6.112 -11.880 -21.353 1.00 0.00 C ATOM 253 C4' DG B 9 -4.856 -12.472 -20.723 1.00 0.00 C ATOM 254 O4' DG B 9 -3.710 -12.135 -21.509 1.00 0.00 O ATOM 255 C3' DG B 9 -4.647 -11.949 -19.305 1.00 0.00 C ATOM 256 O3' DG B 9 -4.610 -13.027 -18.365 1.00 0.00 O ATOM 257 C2' DG B 9 -3.313 -11.211 -19.337 1.00 0.00 C ATOM 258 C1' DG B 9 -2.773 -11.361 -20.755 1.00 0.00 C ATOM 259 N9 DG B 9 -2.536 -10.049 -21.387 1.00 0.00 N ATOM 260 C8 DG B 9 -3.178 -8.851 -21.213 1.00 0.00 C ATOM 261 N7 DG B 9 -2.748 -7.845 -21.924 1.00 0.00 N ATOM 262 C5 DG B 9 -1.715 -8.434 -22.645 1.00 0.00 C ATOM 263 C6 DG B 9 -0.846 -7.846 -23.601 1.00 0.00 C ATOM 264 O6 DG B 9 -0.819 -6.684 -24.001 1.00 0.00 O ATOM 265 N1 DG B 9 0.066 -8.766 -24.100 1.00 0.00 N ATOM 266 C2 DG B 9 0.134 -10.094 -23.728 1.00 0.00 C ATOM 267 N2 DG B 9 1.085 -10.826 -24.309 1.00 0.00 N ATOM 268 N3 DG B 9 -0.688 -10.650 -22.829 1.00 0.00 N ATOM 269 C4 DG B 9 -1.581 -9.761 -22.332 1.00 0.00 C ATOM 0 H5' DG B 9 -6.268 -12.321 -22.338 1.00 0.00 H new ATOM 0 H5'' DG B 9 -6.980 -12.138 -20.747 1.00 0.00 H new ATOM 0 H4' DG B 9 -4.984 -13.554 -20.686 1.00 0.00 H new ATOM 0 H3' DG B 9 -5.462 -11.296 -18.992 1.00 0.00 H new ATOM 0 H2' DG B 9 -3.444 -10.160 -19.080 1.00 0.00 H new ATOM 0 H2'' DG B 9 -2.618 -11.632 -18.610 1.00 0.00 H new ATOM 0 HO5' DG B 9 -5.085 -10.181 -21.379 1.00 0.00 H new ATOM 0 H1' DG B 9 -1.809 -11.868 -20.726 1.00 0.00 H new ATOM 0 H8 DG B 9 -4.000 -8.745 -20.521 1.00 0.00 H new ATOM 0 H1 DG B 9 0.737 -8.436 -24.794 1.00 0.00 H new ATOM 0 H21 DG B 9 1.184 -11.814 -24.074 1.00 0.00 H new ATOM 0 H22 DG B 9 1.714 -10.398 -24.989 1.00 0.00 H new ATOM 282 P DC B 10 -4.041 -12.827 -16.872 1.00 0.00 P ATOM 283 OP1 DC B 10 -4.379 -14.032 -16.082 1.00 0.00 O ATOM 284 OP2 DC B 10 -4.462 -11.492 -16.393 1.00 0.00 O ATOM 285 O5' DC B 10 -2.447 -12.800 -17.098 1.00 0.00 O ATOM 286 C5' DC B 10 -1.751 -13.981 -17.506 1.00 0.00 C ATOM 287 C4' DC B 10 -0.293 -13.702 -17.855 1.00 0.00 C ATOM 288 O4' DC B 10 -0.218 -12.667 -18.838 1.00 0.00 O ATOM 289 C3' DC B 10 0.495 -13.268 -16.623 1.00 0.00 C ATOM 290 O3' DC B 10 1.598 -14.144 -16.374 1.00 0.00 O ATOM 291 C2' DC B 10 1.014 -11.873 -16.953 1.00 0.00 C ATOM 292 C1' DC B 10 0.698 -11.648 -18.428 1.00 0.00 C ATOM 293 N1 DC B 10 0.148 -10.304 -18.690 1.00 0.00 N ATOM 294 C2 DC B 10 0.620 -9.658 -19.819 1.00 0.00 C ATOM 295 O2 DC B 10 1.432 -10.209 -20.558 1.00 0.00 O ATOM 296 N3 DC B 10 0.173 -8.404 -20.083 1.00 0.00 N ATOM 297 C4 DC B 10 -0.706 -7.797 -19.276 1.00 0.00 C ATOM 298 N4 DC B 10 -1.071 -6.545 -19.550 1.00 0.00 N ATOM 299 C5 DC B 10 -1.211 -8.464 -18.112 1.00 0.00 C ATOM 300 C6 DC B 10 -0.756 -9.710 -17.858 1.00 0.00 C ATOM 0 H5' DC B 10 -2.253 -14.415 -18.371 1.00 0.00 H new ATOM 0 H5'' DC B 10 -1.796 -14.721 -16.707 1.00 0.00 H new ATOM 0 H4' DC B 10 0.139 -14.624 -18.244 1.00 0.00 H new ATOM 0 H3' DC B 10 -0.130 -13.287 -15.730 1.00 0.00 H new ATOM 0 H2' DC B 10 0.531 -11.119 -16.331 1.00 0.00 H new ATOM 0 H2'' DC B 10 2.086 -11.801 -16.768 1.00 0.00 H new ATOM 0 H1' DC B 10 1.621 -11.706 -19.004 1.00 0.00 H new ATOM 0 H41 DC B 10 -1.740 -6.065 -18.947 1.00 0.00 H new ATOM 0 H42 DC B 10 -0.682 -6.067 -20.362 1.00 0.00 H new ATOM 0 H5 DC B 10 -1.929 -7.987 -17.462 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.111 -10.242 -16.988 1.00 0.00 H new ATOM 312 P DA B 11 2.311 -14.176 -14.931 1.00 0.00 P ATOM 313 OP1 DA B 11 2.867 -15.533 -14.734 1.00 0.00 O ATOM 314 OP2 DA B 11 1.357 -13.633 -13.937 1.00 0.00 O ATOM 315 O5' DA B 11 3.542 -13.145 -15.043 1.00 0.00 O ATOM 316 C5' DA B 11 4.835 -13.581 -15.473 1.00 0.00 C ATOM 317 C4' DA B 11 5.771 -12.421 -15.796 1.00 0.00 C ATOM 318 O4' DA B 11 5.131 -11.407 -16.576 1.00 0.00 O ATOM 319 C3' DA B 11 6.292 -11.793 -14.508 1.00 0.00 C ATOM 320 O3' DA B 11 7.712 -11.943 -14.435 1.00 0.00 O ATOM 321 C2' DA B 11 5.886 -10.326 -14.601 1.00 0.00 C ATOM 322 C1' DA B 11 5.446 -10.116 -16.046 1.00 0.00 C ATOM 323 N9 DA B 11 4.279 -9.219 -16.134 1.00 0.00 N ATOM 324 C8 DA B 11 3.090 -9.269 -15.454 1.00 0.00 C ATOM 325 N7 DA B 11 2.180 -8.399 -15.792 1.00 0.00 N ATOM 326 C5 DA B 11 2.833 -7.690 -16.796 1.00 0.00 C ATOM 327 C6 DA B 11 2.440 -6.608 -17.599 1.00 0.00 C ATOM 328 N6 DA B 11 1.252 -6.010 -17.513 1.00 0.00 N ATOM 329 N1 DA B 11 3.331 -6.151 -18.488 1.00 0.00 N ATOM 330 C2 DA B 11 4.532 -6.697 -18.595 1.00 0.00 C ATOM 331 N3 DA B 11 5.008 -7.719 -17.901 1.00 0.00 N ATOM 332 C4 DA B 11 4.097 -8.174 -17.008 1.00 0.00 C ATOM 0 H5' DA B 11 4.726 -14.211 -16.356 1.00 0.00 H new ATOM 0 H5'' DA B 11 5.283 -14.198 -14.694 1.00 0.00 H new ATOM 0 H4' DA B 11 6.594 -12.833 -16.381 1.00 0.00 H new ATOM 0 H3' DA B 11 5.887 -12.261 -13.610 1.00 0.00 H new ATOM 0 H2' DA B 11 5.077 -10.098 -13.907 1.00 0.00 H new ATOM 0 H2'' DA B 11 6.719 -9.671 -14.345 1.00 0.00 H new ATOM 0 H1' DA B 11 6.243 -9.640 -16.617 1.00 0.00 H new ATOM 0 H8 DA B 11 2.915 -9.996 -14.674 1.00 0.00 H new ATOM 0 H61 DA B 11 1.029 -5.227 -18.128 1.00 0.00 H new ATOM 0 H62 DA B 11 0.565 -6.335 -16.832 1.00 0.00 H new ATOM 0 H2 DA B 11 5.195 -6.262 -19.328 1.00 0.00 H new ATOM 344 P DA B 12 8.532 -11.803 -13.057 1.00 0.00 P ATOM 345 OP1 DA B 12 9.970 -11.722 -13.398 1.00 0.00 O ATOM 346 OP2 DA B 12 8.062 -12.858 -12.131 1.00 0.00 O ATOM 347 O5' DA B 12 8.080 -10.378 -12.459 1.00 0.00 O ATOM 348 C5' DA B 12 9.054 -9.365 -12.195 1.00 0.00 C ATOM 349 C4' DA B 12 8.632 -8.397 -11.094 1.00 0.00 C ATOM 350 O4' DA B 12 7.236 -8.107 -11.204 1.00 0.00 O ATOM 351 C3' DA B 12 8.894 -8.974 -9.707 1.00 0.00 C ATOM 352 O3' DA B 12 10.001 -8.329 -9.072 1.00 0.00 O ATOM 353 C2' DA B 12 7.604 -8.714 -8.935 1.00 0.00 C ATOM 354 C1' DA B 12 6.545 -8.455 -10.001 1.00 0.00 C ATOM 355 N9 DA B 12 5.711 -9.658 -10.185 1.00 0.00 N ATOM 356 C8 DA B 12 5.927 -10.759 -10.972 1.00 0.00 C ATOM 357 N7 DA B 12 5.016 -11.692 -10.952 1.00 0.00 N ATOM 358 C5 DA B 12 4.097 -11.155 -10.056 1.00 0.00 C ATOM 359 C6 DA B 12 2.873 -11.633 -9.560 1.00 0.00 C ATOM 360 N6 DA B 12 2.353 -12.808 -9.917 1.00 0.00 N ATOM 361 N1 DA B 12 2.215 -10.863 -8.684 1.00 0.00 N ATOM 362 C2 DA B 12 2.716 -9.696 -8.308 1.00 0.00 C ATOM 363 N3 DA B 12 3.852 -9.143 -8.703 1.00 0.00 N ATOM 364 C4 DA B 12 4.503 -9.933 -9.590 1.00 0.00 C ATOM 0 H5' DA B 12 9.242 -8.804 -13.110 1.00 0.00 H new ATOM 0 H5'' DA B 12 9.994 -9.839 -11.912 1.00 0.00 H new ATOM 0 H4' DA B 12 9.223 -7.490 -11.218 1.00 0.00 H new ATOM 0 H3' DA B 12 9.151 -10.032 -9.750 1.00 0.00 H new ATOM 0 H2' DA B 12 7.337 -9.570 -8.315 1.00 0.00 H new ATOM 0 H2'' DA B 12 7.710 -7.858 -8.269 1.00 0.00 H new ATOM 0 H1' DA B 12 5.876 -7.645 -9.710 1.00 0.00 H new ATOM 0 H8 DA B 12 6.813 -10.850 -11.582 1.00 0.00 H new ATOM 0 H61 DA B 12 1.460 -13.110 -9.528 1.00 0.00 H new ATOM 0 H62 DA B 12 2.848 -13.405 -10.579 1.00 0.00 H new ATOM 0 H2 DA B 12 2.131 -9.131 -7.598 1.00 0.00 H new ATOM 376 P DT B 13 9.933 -6.805 -8.555 1.00 0.00 P ATOM 377 OP1 DT B 13 8.857 -6.118 -9.305 1.00 0.00 O ATOM 378 OP2 DT B 13 11.305 -6.250 -8.560 1.00 0.00 O ATOM 379 O5' DT B 13 9.457 -6.964 -7.025 1.00 0.00 O ATOM 380 C5' DT B 13 9.301 -5.817 -6.185 1.00 0.00 C ATOM 381 C4' DT B 13 8.615 -6.146 -4.863 1.00 0.00 C ATOM 382 O4' DT B 13 7.701 -7.236 -5.006 1.00 0.00 O ATOM 383 C3' DT B 13 9.647 -6.512 -3.801 1.00 0.00 C ATOM 384 O3' DT B 13 9.383 -5.914 -2.529 1.00 0.00 O ATOM 385 C2' DT B 13 9.433 -8.012 -3.629 1.00 0.00 C ATOM 386 C1' DT B 13 7.958 -8.190 -3.973 1.00 0.00 C ATOM 387 N1 DT B 13 7.625 -9.566 -4.389 1.00 0.00 N ATOM 388 C2 DT B 13 6.816 -10.295 -3.537 1.00 0.00 C ATOM 389 O2 DT B 13 6.419 -9.849 -2.462 1.00 0.00 O ATOM 390 N3 DT B 13 6.473 -11.569 -3.966 1.00 0.00 N ATOM 391 C4 DT B 13 6.870 -12.157 -5.159 1.00 0.00 C ATOM 392 O4 DT B 13 6.500 -13.293 -5.449 1.00 0.00 O ATOM 393 C5 DT B 13 7.714 -11.316 -5.975 1.00 0.00 C ATOM 394 C7 DT B 13 8.193 -11.834 -7.327 1.00 0.00 C ATOM 395 C6 DT B 13 8.063 -10.082 -5.574 1.00 0.00 C ATOM 0 H5' DT B 13 8.720 -5.061 -6.713 1.00 0.00 H new ATOM 0 H5'' DT B 13 10.280 -5.383 -5.984 1.00 0.00 H new ATOM 0 H4' DT B 13 8.064 -5.256 -4.557 1.00 0.00 H new ATOM 0 H3' DT B 13 10.642 -6.188 -4.105 1.00 0.00 H new ATOM 0 H2' DT B 13 10.075 -8.590 -4.294 1.00 0.00 H new ATOM 0 H2'' DT B 13 9.652 -8.337 -2.612 1.00 0.00 H new ATOM 0 H1' DT B 13 7.328 -8.024 -3.099 1.00 0.00 H new ATOM 0 H3 DT B 13 5.877 -12.122 -3.351 1.00 0.00 H new ATOM 0 H71 DT B 13 8.284 -12.920 -7.289 1.00 0.00 H new ATOM 0 H72 DT B 13 7.474 -11.557 -8.098 1.00 0.00 H new ATOM 0 H73 DT B 13 9.163 -11.396 -7.561 1.00 0.00 H new ATOM 0 H6 DT B 13 8.705 -9.485 -6.204 1.00 0.00 H new ATOM 408 P DT B 14 8.629 -4.518 -2.259 1.00 -1.00 P ATOM 409 OP1 DT B 14 9.194 -3.949 -1.014 1.00 -1.00 O ATOM 410 OP2 DT B 14 7.176 -4.790 -2.320 1.00 -1.00 O ATOM 411 O5' DT B 14 8.962 -3.481 -3.445 1.00 0.00 O ATOM 412 C5' DT B 14 10.272 -3.155 -3.915 1.00 0.00 C ATOM 413 C4' DT B 14 10.266 -1.702 -4.380 1.00 0.00 C ATOM 414 O4' DT B 14 9.467 -1.485 -5.547 1.00 0.00 O ATOM 415 C3' DT B 14 9.703 -0.871 -3.233 1.00 0.00 C ATOM 416 O3' DT B 14 10.674 0.051 -2.732 1.00 0.00 O ATOM 417 C2' DT B 14 8.466 -0.186 -3.804 1.00 0.00 C ATOM 418 C1' DT B 14 8.385 -0.591 -5.272 1.00 0.00 C ATOM 419 N1 DT B 14 7.116 -1.271 -5.593 1.00 0.00 N ATOM 420 C2 DT B 14 6.393 -0.838 -6.690 1.00 0.00 C ATOM 421 O2 DT B 14 6.564 0.246 -7.244 1.00 0.00 O ATOM 422 N3 DT B 14 5.334 -1.654 -7.064 1.00 0.00 N ATOM 423 C4 DT B 14 4.921 -2.822 -6.438 1.00 0.00 C ATOM 424 O4 DT B 14 3.936 -3.427 -6.856 1.00 0.00 O ATOM 425 C5 DT B 14 5.729 -3.174 -5.295 1.00 0.00 C ATOM 426 C7 DT B 14 5.418 -4.442 -4.507 1.00 0.00 C ATOM 427 C6 DT B 14 6.769 -2.409 -4.923 1.00 0.00 C ATOM 0 H5' DT B 14 10.556 -3.815 -4.735 1.00 0.00 H new ATOM 0 H5'' DT B 14 11.006 -3.297 -3.122 1.00 0.00 H new ATOM 0 H4' DT B 14 11.285 -1.420 -4.647 1.00 0.00 H new ATOM 0 H3' DT B 14 9.439 -1.481 -2.369 1.00 0.00 H new ATOM 0 H2' DT B 14 7.569 -0.494 -3.267 1.00 0.00 H new ATOM 0 H2'' DT B 14 8.541 0.897 -3.704 1.00 0.00 H new ATOM 0 H1' DT B 14 8.441 0.312 -5.880 1.00 0.00 H new ATOM 0 H3 DT B 14 4.803 -1.365 -7.886 1.00 0.00 H new ATOM 0 H71 DT B 14 4.350 -4.652 -4.562 1.00 0.00 H new ATOM 0 H72 DT B 14 5.975 -5.279 -4.929 1.00 0.00 H new ATOM 0 H73 DT B 14 5.707 -4.303 -3.465 1.00 0.00 H new ATOM 0 H6 DT B 14 7.352 -2.705 -4.063 1.00 0.00 H new ATOM 440 P DC B 15 10.275 1.265 -1.753 1.00 0.00 P ATOM 441 OP1 DC B 15 11.423 2.198 -1.698 1.00 0.00 O ATOM 442 OP2 DC B 15 9.748 0.683 -0.499 1.00 0.00 O ATOM 443 O5' DC B 15 9.059 2.008 -2.503 1.00 0.00 O ATOM 444 C5' DC B 15 9.195 3.332 -3.026 1.00 0.00 C ATOM 445 C4' DC B 15 7.864 4.077 -2.991 1.00 0.00 C ATOM 446 O4' DC B 15 6.860 3.363 -3.717 1.00 0.00 O ATOM 447 C3' DC B 15 7.388 4.241 -1.551 1.00 0.00 C ATOM 448 O3' DC B 15 7.493 5.605 -1.135 1.00 0.00 O ATOM 449 C2' DC B 15 5.945 3.748 -1.549 1.00 0.00 C ATOM 450 C1' DC B 15 5.630 3.358 -2.989 1.00 0.00 C ATOM 451 N1 DC B 15 4.986 2.033 -3.074 1.00 0.00 N ATOM 452 C2 DC B 15 3.874 1.925 -3.889 1.00 0.00 C ATOM 453 O2 DC B 15 3.434 2.911 -4.477 1.00 0.00 O ATOM 454 N3 DC B 15 3.290 0.707 -4.027 1.00 0.00 N ATOM 455 C4 DC B 15 3.772 -0.369 -3.392 1.00 0.00 C ATOM 456 N4 DC B 15 3.178 -1.546 -3.584 1.00 0.00 N ATOM 457 C5 DC B 15 4.919 -0.263 -2.540 1.00 0.00 C ATOM 458 C6 DC B 15 5.493 0.952 -2.412 1.00 0.00 C ATOM 0 H5' DC B 15 9.562 3.285 -4.051 1.00 0.00 H new ATOM 0 H5'' DC B 15 9.937 3.881 -2.446 1.00 0.00 H new ATOM 0 H4' DC B 15 8.021 5.053 -3.450 1.00 0.00 H new ATOM 0 H3' DC B 15 7.995 3.674 -0.845 1.00 0.00 H new ATOM 0 H2' DC B 15 5.825 2.896 -0.879 1.00 0.00 H new ATOM 0 H2'' DC B 15 5.267 4.527 -1.199 1.00 0.00 H new ATOM 0 H1' DC B 15 4.924 4.073 -3.412 1.00 0.00 H new ATOM 0 H41 DC B 15 3.529 -2.378 -3.110 1.00 0.00 H new ATOM 0 H42 DC B 15 2.372 -1.615 -4.205 1.00 0.00 H new ATOM 0 H5 DC B 15 5.310 -1.124 -2.019 1.00 0.00 H new ATOM 0 H6 DC B 15 6.361 1.070 -1.780 1.00 0.00 H new ATOM 470 P DG B 16 6.664 6.179 0.120 1.00 0.00 P ATOM 471 OP1 DG B 16 7.227 7.502 0.471 1.00 0.00 O ATOM 472 OP2 DG B 16 6.585 5.119 1.151 1.00 0.00 O ATOM 473 O5' DG B 16 5.187 6.400 -0.483 1.00 0.00 O ATOM 474 C5' DG B 16 4.884 7.557 -1.267 1.00 0.00 C ATOM 475 C4' DG B 16 3.381 7.803 -1.355 1.00 0.00 C ATOM 476 O4' DG B 16 2.719 6.710 -1.997 1.00 0.00 O ATOM 477 C3' DG B 16 2.780 7.981 0.035 1.00 0.00 C ATOM 478 O3' DG B 16 2.344 9.329 0.227 1.00 0.00 O ATOM 479 C2' DG B 16 1.611 7.003 0.098 1.00 0.00 C ATOM 480 C1' DG B 16 1.532 6.357 -1.281 1.00 0.00 C ATOM 481 N9 DG B 16 1.381 4.893 -1.190 1.00 0.00 N ATOM 482 C8 DG B 16 1.962 3.991 -0.336 1.00 0.00 C ATOM 483 N7 DG B 16 1.659 2.735 -0.517 1.00 0.00 N ATOM 484 C5 DG B 16 0.789 2.808 -1.600 1.00 0.00 C ATOM 485 C6 DG B 16 0.110 1.759 -2.273 1.00 0.00 C ATOM 486 O6 DG B 16 0.148 0.551 -2.049 1.00 0.00 O ATOM 487 N1 DG B 16 -0.675 2.241 -3.311 1.00 0.00 N ATOM 488 C2 DG B 16 -0.797 3.571 -3.663 1.00 0.00 C ATOM 489 N2 DG B 16 -1.602 3.844 -4.690 1.00 0.00 N ATOM 490 N3 DG B 16 -0.155 4.560 -3.029 1.00 0.00 N ATOM 491 C4 DG B 16 0.615 4.103 -2.013 1.00 0.00 C ATOM 0 H5' DG B 16 5.292 7.433 -2.270 1.00 0.00 H new ATOM 0 H5'' DG B 16 5.370 8.429 -0.831 1.00 0.00 H new ATOM 0 H4' DG B 16 3.237 8.712 -1.940 1.00 0.00 H new ATOM 0 H3' DG B 16 3.506 7.783 0.824 1.00 0.00 H new ATOM 0 H2' DG B 16 1.771 6.253 0.872 1.00 0.00 H new ATOM 0 H2'' DG B 16 0.682 7.519 0.341 1.00 0.00 H new ATOM 0 H1' DG B 16 0.650 6.722 -1.808 1.00 0.00 H new ATOM 0 H8 DG B 16 2.636 4.305 0.447 1.00 0.00 H new ATOM 0 H1 DG B 16 -1.203 1.560 -3.857 1.00 0.00 H new ATOM 0 H21 DG B 16 -1.731 4.809 -4.995 1.00 0.00 H new ATOM 0 H22 DG B 16 -2.089 3.088 -5.171 1.00 0.00 H new ATOM 503 P DG B 17 1.484 9.761 1.517 1.00 0.00 P ATOM 504 OP1 DG B 17 1.844 11.153 1.870 1.00 0.00 O ATOM 505 OP2 DG B 17 1.597 8.694 2.536 1.00 0.00 O ATOM 506 O5' DG B 17 -0.023 9.761 0.951 1.00 0.00 O ATOM 507 C5' DG B 17 -0.431 10.718 -0.030 1.00 0.00 C ATOM 508 C4' DG B 17 -1.903 10.570 -0.397 1.00 0.00 C ATOM 509 O4' DG B 17 -2.164 9.260 -0.910 1.00 0.00 O ATOM 510 C3' DG B 17 -2.794 10.802 0.819 1.00 0.00 C ATOM 511 O3' DG B 17 -3.745 11.838 0.557 1.00 0.00 O ATOM 512 C2' DG B 17 -3.491 9.469 1.069 1.00 0.00 C ATOM 513 C1' DG B 17 -3.127 8.571 -0.109 1.00 0.00 C ATOM 514 N9 DG B 17 -2.583 7.281 0.355 1.00 0.00 N ATOM 515 C8 DG B 17 -1.715 7.010 1.382 1.00 0.00 C ATOM 516 N7 DG B 17 -1.365 5.764 1.539 1.00 0.00 N ATOM 517 C5 DG B 17 -2.073 5.141 0.515 1.00 0.00 C ATOM 518 C6 DG B 17 -2.110 3.768 0.161 1.00 0.00 C ATOM 519 O6 DG B 17 -1.514 2.824 0.676 1.00 0.00 O ATOM 520 N1 DG B 17 -2.944 3.541 -0.925 1.00 0.00 N ATOM 521 C2 DG B 17 -3.659 4.516 -1.593 1.00 0.00 C ATOM 522 N2 DG B 17 -4.425 4.105 -2.603 1.00 0.00 N ATOM 523 N3 DG B 17 -3.621 5.813 -1.262 1.00 0.00 N ATOM 524 C4 DG B 17 -2.811 6.046 -0.202 1.00 0.00 C ATOM 0 H5' DG B 17 0.179 10.601 -0.926 1.00 0.00 H new ATOM 0 H5'' DG B 17 -0.252 11.724 0.349 1.00 0.00 H new ATOM 0 H4' DG B 17 -2.126 11.317 -1.159 1.00 0.00 H new ATOM 0 H3' DG B 17 -2.221 11.124 1.689 1.00 0.00 H new ATOM 0 H2' DG B 17 -3.162 9.028 2.010 1.00 0.00 H new ATOM 0 H2'' DG B 17 -4.571 9.601 1.139 1.00 0.00 H new ATOM 0 H1' DG B 17 -4.020 8.353 -0.694 1.00 0.00 H new ATOM 0 H8 DG B 17 -1.340 7.790 2.028 1.00 0.00 H new ATOM 0 H1 DG B 17 -3.036 2.580 -1.255 1.00 0.00 H new ATOM 0 H21 DG B 17 -4.976 4.780 -3.133 1.00 0.00 H new ATOM 0 H22 DG B 17 -4.460 3.115 -2.846 1.00 0.00 H new ATOM 536 P DG B 18 -4.653 12.450 1.737 1.00 0.00 P ATOM 537 OP1 DG B 18 -5.130 13.783 1.306 1.00 0.00 O ATOM 538 OP2 DG B 18 -3.918 12.313 3.015 1.00 0.00 O ATOM 539 O5' DG B 18 -5.913 11.450 1.773 1.00 0.00 O ATOM 540 C5' DG B 18 -7.208 11.877 1.339 1.00 0.00 C ATOM 541 C4' DG B 18 -8.271 11.598 2.396 1.00 0.00 C ATOM 542 O4' DG B 18 -8.375 10.195 2.652 1.00 0.00 O ATOM 543 C3' DG B 18 -7.928 12.303 3.704 1.00 0.00 C ATOM 544 O3' DG B 18 -8.898 13.304 4.023 1.00 0.00 O ATOM 545 C2' DG B 18 -7.903 11.205 4.762 1.00 0.00 C ATOM 546 C1' DG B 18 -7.998 9.889 3.997 1.00 0.00 C ATOM 547 N9 DG B 18 -6.718 9.156 4.015 1.00 0.00 N ATOM 548 C8 DG B 18 -5.430 9.619 4.099 1.00 0.00 C ATOM 549 N7 DG B 18 -4.482 8.724 4.071 1.00 0.00 N ATOM 550 C5 DG B 18 -5.212 7.546 3.955 1.00 0.00 C ATOM 551 C6 DG B 18 -4.743 6.209 3.874 1.00 0.00 C ATOM 552 O6 DG B 18 -3.585 5.797 3.893 1.00 0.00 O ATOM 553 N1 DG B 18 -5.791 5.306 3.764 1.00 0.00 N ATOM 554 C2 DG B 18 -7.130 5.642 3.737 1.00 0.00 C ATOM 555 N2 DG B 18 -7.992 4.631 3.624 1.00 0.00 N ATOM 556 N3 DG B 18 -7.573 6.903 3.814 1.00 0.00 N ATOM 557 C4 DG B 18 -6.559 7.794 3.920 1.00 0.00 C ATOM 0 H5' DG B 18 -7.470 11.364 0.413 1.00 0.00 H new ATOM 0 H5'' DG B 18 -7.185 12.944 1.117 1.00 0.00 H new ATOM 0 H4' DG B 18 -9.220 11.973 2.012 1.00 0.00 H new ATOM 0 H3' DG B 18 -6.972 12.823 3.640 1.00 0.00 H new ATOM 0 H2' DG B 18 -6.987 11.250 5.351 1.00 0.00 H new ATOM 0 H2'' DG B 18 -8.735 11.314 5.458 1.00 0.00 H new ATOM 0 HO3' DG B 18 -8.654 13.739 4.867 1.00 0.00 H new ATOM 0 H1' DG B 18 -8.738 9.245 4.471 1.00 0.00 H new ATOM 0 H8 DG B 18 -5.211 10.673 4.184 1.00 0.00 H new ATOM 0 H1 DG B 18 -5.553 4.316 3.698 1.00 0.00 H new ATOM 0 H21 DG B 18 -8.995 4.816 3.599 1.00 0.00 H new ATOM 0 H22 DG B 18 -7.649 3.672 3.563 1.00 0.00 H new TER 570 DG B 18 HETATM 571 C1 NCS B 21 4.267 -5.340 -9.460 1.00 0.00 C HETATM 572 C2 NCS B 21 5.398 -5.081 -8.750 1.00 0.00 C HETATM 573 C3 NCS B 21 6.368 -4.330 -9.337 1.00 0.00 C HETATM 574 C4 NCS B 21 6.185 -3.851 -10.650 1.00 0.00 C HETATM 575 C5 NCS B 21 5.063 -4.113 -11.372 1.00 0.00 C HETATM 576 C6 NCS B 21 4.093 -4.855 -10.773 1.00 0.00 C HETATM 577 C7 NCS B 21 7.663 -3.870 -8.880 1.00 0.00 C HETATM 578 C8 NCS B 21 8.205 -3.135 -9.941 1.00 0.00 C HETATM 579 C9 NCS B 21 7.320 -3.069 -11.162 1.00 0.00 C HETATM 580 O9 NCS B 21 7.941 -3.727 -12.238 1.00 0.00 O HETATM 581 C10 NCS B 21 2.808 -5.302 -11.328 1.00 0.00 C HETATM 582 C11 NCS B 21 2.359 -6.389 -10.350 1.00 0.00 C HETATM 583 C12 NCS B 21 3.102 -6.130 -9.039 1.00 0.00 C HETATM 584 C13 NCS B 21 6.939 -1.637 -11.539 1.00 0.00 C HETATM 585 O14 NCS B 21 7.959 -1.086 -12.337 1.00 0.00 O HETATM 586 C15 NCS B 21 8.472 0.016 -11.739 1.00 0.00 C HETATM 587 O15 NCS B 21 9.382 0.690 -12.204 1.00 0.00 O HETATM 588 O16 NCS B 21 7.853 0.273 -10.562 1.00 0.00 O HETATM 589 C17 NCS B 21 6.878 -0.713 -10.322 1.00 0.00 C HETATM 590 O18 NCS B 21 2.736 -7.609 -10.941 1.00 0.00 O HETATM 591 C19 NCS B 21 3.009 -7.475 -12.260 1.00 0.00 C HETATM 592 O19 NCS B 21 3.330 -8.393 -13.005 1.00 0.00 O HETATM 593 C20 NCS B 21 2.939 -6.005 -12.680 1.00 0.00 C HETATM 594 C21 NCS B 21 1.657 -5.713 -13.463 1.00 0.00 C HETATM 595 O21 NCS B 21 0.632 -6.314 -13.162 1.00 0.00 O HETATM 596 C22 NCS B 21 1.689 -4.610 -14.418 1.00 0.00 C HETATM 597 C23 NCS B 21 2.860 -3.947 -14.739 1.00 0.00 C HETATM 598 C24 NCS B 21 4.081 -4.540 -14.384 1.00 0.00 C HETATM 599 C25 NCS B 21 4.180 -5.591 -13.434 1.00 0.00 C HETATM 600 C26 NCS B 21 5.425 -6.185 -13.183 1.00 0.00 C HETATM 601 C27 NCS B 21 6.532 -5.737 -13.881 1.00 0.00 C HETATM 602 O27 NCS B 21 7.762 -6.323 -13.658 1.00 0.00 O HETATM 603 C28 NCS B 21 6.431 -4.711 -14.802 1.00 0.00 C HETATM 604 C29 NCS B 21 5.222 -4.094 -15.069 1.00 0.00 C HETATM 605 C30 NCS B 21 5.170 -2.976 -16.082 1.00 0.00 C HETATM 606 C31 NCS B 21 8.210 -6.906 -14.858 1.00 0.00 C HETATM 607 O1' NCS B 21 2.251 -5.363 -8.221 1.00 0.00 O HETATM 608 C1' NCS B 21 1.288 -6.153 -7.567 1.00 0.00 C HETATM 609 C2' NCS B 21 0.394 -5.262 -6.704 1.00 0.00 C HETATM 610 N2' NCS B 21 -0.289 -4.227 -7.471 1.00 0.00 N HETATM 611 C2M NCS B 21 -1.096 -4.813 -8.535 1.00 0.00 C HETATM 612 C3' NCS B 21 1.253 -4.632 -5.608 1.00 0.00 C HETATM 613 O3' NCS B 21 0.413 -3.931 -4.726 1.00 0.00 O HETATM 614 C4' NCS B 21 2.020 -5.716 -4.849 1.00 0.00 C HETATM 615 O4' NCS B 21 1.108 -6.542 -4.171 1.00 0.00 O HETATM 616 C5' NCS B 21 2.843 -6.535 -5.843 1.00 0.00 C HETATM 617 C5M NCS B 21 3.592 -7.652 -5.115 1.00 0.00 C HETATM 618 O5' NCS B 21 1.956 -7.104 -6.775 1.00 0.00 O HETATM 0 HO4' NCS B 21 0.340 -6.009 -3.876 1.00 0.00 H new HETATM 0 HO3' NCS B 21 0.537 -2.967 -4.853 1.00 0.00 H new HETATM 0 HN22 NCS B 21 -0.884 -3.676 -6.852 1.00 0.00 H new HETATM 0 HN21 NCS B 21 0.397 -3.587 -7.872 1.00 0.00 H new HETATM 0 HM53 NCS B 21 4.260 -7.217 -4.372 1.00 0.00 H new HETATM 0 HM52 NCS B 21 2.876 -8.308 -4.620 1.00 0.00 H new HETATM 0 HM51 NCS B 21 4.174 -8.228 -5.834 1.00 0.00 H new HETATM 0 HM23 NCS B 21 -0.454 -5.381 -9.208 1.00 0.00 H new HETATM 0 HM22 NCS B 21 -1.843 -5.477 -8.101 1.00 0.00 H new HETATM 0 HM21 NCS B 21 -1.595 -4.020 -9.092 1.00 0.00 H new HETATM 0 H313 NCS B 21 7.495 -7.661 -15.185 1.00 0.00 H new HETATM 0 H312 NCS B 21 8.301 -6.136 -15.625 1.00 0.00 H new HETATM 0 H311 NCS B 21 9.182 -7.373 -14.695 1.00 0.00 H new HETATM 0 H303 NCS B 21 4.496 -3.251 -16.893 1.00 0.00 H new HETATM 0 H302 NCS B 21 4.808 -2.067 -15.602 1.00 0.00 H new HETATM 0 H301 NCS B 21 6.168 -2.802 -16.483 1.00 0.00 H new HETATM 0 H172 NCS B 21 5.888 -0.270 -10.212 1.00 0.00 H new HETATM 0 H171 NCS B 21 7.087 -1.259 -9.402 1.00 0.00 H new HETATM 0 HO9 NCS B 21 8.261 -3.065 -12.886 1.00 0.00 H new HETATM 0 H8 NCS B 21 9.181 -2.652 -9.890 1.00 0.00 H new HETATM 0 H7 NCS B 21 8.122 -4.058 -7.909 1.00 0.00 H new HETATM 0 H5' NCS B 21 3.571 -5.893 -6.340 1.00 0.00 H new HETATM 0 H5 NCS B 21 4.945 -3.743 -12.391 1.00 0.00 H new HETATM 0 H4' NCS B 21 2.691 -5.261 -4.121 1.00 0.00 H new HETATM 0 H3' NCS B 21 1.976 -3.949 -6.055 1.00 0.00 H new HETATM 0 H28 NCS B 21 7.325 -4.380 -15.330 1.00 0.00 H new HETATM 0 H26 NCS B 21 5.519 -6.986 -12.450 1.00 0.00 H new HETATM 0 H23 NCS B 21 2.835 -2.987 -15.255 1.00 0.00 H new HETATM 0 H22 NCS B 21 0.759 -4.298 -14.894 1.00 0.00 H new HETATM 0 H2' NCS B 21 -0.390 -5.885 -6.273 1.00 0.00 H new HETATM 0 H2 NCS B 21 5.523 -5.465 -7.738 1.00 0.00 H new HETATM 0 H13 NCS B 21 5.969 -1.698 -12.033 1.00 0.00 H new HETATM 0 H12 NCS B 21 3.393 -7.024 -8.488 1.00 0.00 H new HETATM 0 H11 NCS B 21 1.289 -6.402 -10.144 1.00 0.00 H new HETATM 0 H10 NCS B 21 2.148 -4.445 -11.460 1.00 0.00 H new HETATM 0 H1' NCS B 21 0.658 -6.666 -8.293 1.00 0.00 H new