USER MOD reduce.3.24.130724 H: found=0, std=0, add=280, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 279 hydrogens (9 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 NoAdj-H: A 25 GIQH101 : A 25 GIQ N10 : A 7 DG C8 :(H bumps) USER MOD Single : A 1 DC O5' : rot -100:sc= -0.182 USER MOD Single : A 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 11 DT C7 :methyl 150:sc= -1.8 (180deg=-1.8) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 180:sc= 0 USER MOD Single : B 15 DT C7 :methyl 150:sc= -0.337 (180deg=-0.337) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DC A 1 7.481 -6.988 -1.860 1.00 0.50 O ATOM 2 C5' DC A 1 7.914 -5.891 -2.671 1.00 0.49 C ATOM 3 C4' DC A 1 7.851 -4.543 -1.854 1.00 0.39 C ATOM 4 O4' DC A 1 6.479 -4.100 -1.722 1.00 0.30 O ATOM 5 C3' DC A 1 8.366 -4.765 -0.424 1.00 0.38 C ATOM 6 O3' DC A 1 9.569 -4.019 -0.183 1.00 0.41 O ATOM 7 C2' DC A 1 7.239 -4.294 0.471 1.00 0.30 C ATOM 8 C1' DC A 1 6.365 -3.473 -0.442 1.00 0.22 C ATOM 9 N1 DC A 1 4.974 -3.427 0.027 1.00 0.17 N ATOM 10 C2 DC A 1 4.341 -2.196 0.094 1.00 0.17 C ATOM 11 O2 DC A 1 4.936 -1.171 -0.233 1.00 0.21 O ATOM 12 N3 DC A 1 3.055 -2.164 0.536 1.00 0.21 N ATOM 13 C4 DC A 1 2.429 -3.292 0.895 1.00 0.26 C ATOM 14 N4 DC A 1 1.168 -3.233 1.322 1.00 0.34 N ATOM 15 C5 DC A 1 3.102 -4.552 0.817 1.00 0.24 C ATOM 16 C6 DC A 1 4.349 -4.558 0.384 1.00 0.19 C ATOM 0 H5' DC A 1 7.285 -5.816 -3.558 1.00 0.49 H new ATOM 0 H5'' DC A 1 8.933 -6.066 -3.017 1.00 0.49 H new ATOM 0 H4' DC A 1 8.456 -3.810 -2.387 1.00 0.39 H new ATOM 0 H3' DC A 1 8.625 -5.808 -0.240 1.00 0.38 H new ATOM 0 H2' DC A 1 6.691 -5.134 0.898 1.00 0.30 H new ATOM 0 H2'' DC A 1 7.613 -3.700 1.305 1.00 0.30 H new ATOM 0 HO5' DC A 1 8.262 -7.470 -1.518 1.00 0.50 H new ATOM 0 H1' DC A 1 6.680 -2.430 -0.475 1.00 0.22 H new ATOM 0 H41 DC A 1 0.682 -4.087 1.598 1.00 0.34 H new ATOM 0 H42 DC A 1 0.688 -2.334 1.373 1.00 0.34 H new ATOM 0 H5 DC A 1 2.606 -5.468 1.103 1.00 0.24 H new ATOM 0 H6 DC A 1 4.879 -5.497 0.316 1.00 0.19 H new ATOM 29 P DT A 2 10.155 -3.871 1.313 1.00 0.44 P ATOM 30 OP1 DT A 2 11.633 -3.864 1.230 1.00 0.54 O ATOM 31 OP2 DT A 2 9.473 -4.854 2.185 1.00 0.51 O ATOM 32 O5' DT A 2 9.664 -2.395 1.739 1.00 0.30 O ATOM 33 C5' DT A 2 10.492 -1.254 1.488 1.00 0.26 C ATOM 34 C4' DT A 2 9.826 0.045 2.001 1.00 0.21 C ATOM 35 O4' DT A 2 8.392 -0.058 1.839 1.00 0.21 O ATOM 36 C3' DT A 2 10.106 0.187 3.490 1.00 0.21 C ATOM 37 O3' DT A 2 10.708 1.458 3.774 1.00 0.21 O ATOM 38 C2' DT A 2 8.753 0.066 4.097 1.00 0.22 C ATOM 39 C1' DT A 2 7.795 0.507 3.007 1.00 0.21 C ATOM 40 N1 DT A 2 6.492 -0.085 3.245 1.00 0.23 N ATOM 41 C2 DT A 2 5.344 0.652 3.033 1.00 0.25 C ATOM 42 O2 DT A 2 5.367 1.819 2.647 1.00 0.25 O ATOM 43 N3 DT A 2 4.159 -0.013 3.285 1.00 0.29 N ATOM 44 C4 DT A 2 4.040 -1.326 3.717 1.00 0.31 C ATOM 45 O4 DT A 2 2.933 -1.822 3.913 1.00 0.37 O ATOM 46 C5 DT A 2 5.313 -1.998 3.906 1.00 0.30 C ATOM 47 C7 DT A 2 5.344 -3.446 4.388 1.00 0.36 C ATOM 48 C6 DT A 2 6.470 -1.350 3.664 1.00 0.27 C ATOM 0 H5' DT A 2 10.684 -1.169 0.418 1.00 0.26 H new ATOM 0 H5'' DT A 2 11.458 -1.388 1.976 1.00 0.26 H new ATOM 0 H4' DT A 2 10.218 0.896 1.444 1.00 0.21 H new ATOM 0 H3' DT A 2 10.807 -0.553 3.877 1.00 0.21 H new ATOM 0 H2' DT A 2 8.551 -0.958 4.410 1.00 0.22 H new ATOM 0 H2'' DT A 2 8.660 0.694 4.983 1.00 0.22 H new ATOM 0 H1' DT A 2 7.646 1.585 2.943 1.00 0.21 H new ATOM 0 H3 DT A 2 3.294 0.508 3.140 1.00 0.29 H new ATOM 0 H71 DT A 2 6.227 -3.944 3.988 1.00 0.36 H new ATOM 0 H72 DT A 2 5.378 -3.466 5.477 1.00 0.36 H new ATOM 0 H73 DT A 2 4.449 -3.963 4.043 1.00 0.36 H new ATOM 0 H6 DT A 2 7.405 -1.870 3.814 1.00 0.27 H new ATOM 61 P DC A 3 11.134 1.875 5.272 1.00 0.23 P ATOM 62 OP1 DC A 3 12.462 2.524 5.211 1.00 0.29 O ATOM 63 OP2 DC A 3 10.921 0.711 6.162 1.00 0.28 O ATOM 64 O5' DC A 3 10.041 2.998 5.642 1.00 0.24 O ATOM 65 C5' DC A 3 9.837 4.127 4.784 1.00 0.24 C ATOM 66 C4' DC A 3 8.439 4.711 4.957 1.00 0.21 C ATOM 67 O4' DC A 3 7.434 3.698 4.741 1.00 0.22 O ATOM 68 C3' DC A 3 8.231 5.230 6.385 1.00 0.21 C ATOM 69 O3' DC A 3 8.068 6.654 6.399 1.00 0.24 O ATOM 70 C2' DC A 3 6.982 4.526 6.868 1.00 0.22 C ATOM 71 C1' DC A 3 6.335 4.004 5.606 1.00 0.21 C ATOM 72 N1 DC A 3 5.532 2.793 5.880 1.00 0.21 N ATOM 73 C2 DC A 3 4.149 2.918 5.922 1.00 0.18 C ATOM 74 O2 DC A 3 3.615 4.010 5.735 1.00 0.18 O ATOM 75 N3 DC A 3 3.409 1.803 6.174 1.00 0.19 N ATOM 76 C4 DC A 3 3.998 0.616 6.375 1.00 0.22 C ATOM 77 N4 DC A 3 3.241 -0.454 6.619 1.00 0.24 N ATOM 78 C5 DC A 3 5.421 0.484 6.333 1.00 0.27 C ATOM 79 C6 DC A 3 6.143 1.590 6.084 1.00 0.26 C ATOM 0 H5' DC A 3 9.982 3.828 3.746 1.00 0.24 H new ATOM 0 H5'' DC A 3 10.582 4.892 5.003 1.00 0.24 H new ATOM 0 H4' DC A 3 8.347 5.520 4.233 1.00 0.21 H new ATOM 0 H3' DC A 3 9.088 5.028 7.027 1.00 0.21 H new ATOM 0 H2' DC A 3 7.223 3.716 7.556 1.00 0.22 H new ATOM 0 H2'' DC A 3 6.321 5.210 7.400 1.00 0.22 H new ATOM 0 H1' DC A 3 5.648 4.728 5.168 1.00 0.21 H new ATOM 0 H41 DC A 3 3.677 -1.363 6.774 1.00 0.24 H new ATOM 0 H42 DC A 3 2.226 -0.364 6.651 1.00 0.24 H new ATOM 0 H5 DC A 3 5.899 -0.471 6.496 1.00 0.27 H new ATOM 0 H6 DC A 3 7.220 1.526 6.045 1.00 0.26 H new ATOM 91 P DG A 4 8.047 7.470 7.790 1.00 0.25 P ATOM 92 OP1 DG A 4 8.660 8.797 7.557 1.00 0.36 O ATOM 93 OP2 DG A 4 8.578 6.591 8.856 1.00 0.30 O ATOM 94 O5' DG A 4 6.471 7.680 8.049 1.00 0.27 O ATOM 95 C5' DG A 4 5.736 8.659 7.308 1.00 0.27 C ATOM 96 C4' DG A 4 4.268 8.696 7.723 1.00 0.21 C ATOM 97 O4' DG A 4 3.625 7.412 7.483 1.00 0.22 O ATOM 98 C3' DG A 4 4.125 8.995 9.218 1.00 0.17 C ATOM 99 O3' DG A 4 3.127 10.003 9.443 1.00 0.15 O ATOM 100 C2' DG A 4 3.726 7.668 9.797 1.00 0.16 C ATOM 101 C1' DG A 4 2.956 7.016 8.695 1.00 0.17 C ATOM 102 N9 DG A 4 2.934 5.554 8.845 1.00 0.18 N ATOM 103 C8 DG A 4 3.963 4.687 8.898 1.00 0.21 C ATOM 104 N7 DG A 4 3.689 3.434 9.035 1.00 0.22 N ATOM 105 C5 DG A 4 2.292 3.457 9.081 1.00 0.19 C ATOM 106 C6 DG A 4 1.371 2.389 9.222 1.00 0.19 C ATOM 107 O6 DG A 4 1.607 1.190 9.336 1.00 0.22 O ATOM 108 N1 DG A 4 0.058 2.843 9.221 1.00 0.18 N ATOM 109 C2 DG A 4 -0.326 4.165 9.100 1.00 0.17 C ATOM 110 N2 DG A 4 -1.637 4.406 9.122 1.00 0.20 N ATOM 111 N3 DG A 4 0.537 5.176 8.966 1.00 0.16 N ATOM 112 C4 DG A 4 1.821 4.754 8.965 1.00 0.16 C ATOM 0 H5' DG A 4 5.808 8.439 6.243 1.00 0.27 H new ATOM 0 H5'' DG A 4 6.182 9.642 7.461 1.00 0.27 H new ATOM 0 H4' DG A 4 3.798 9.479 7.129 1.00 0.21 H new ATOM 0 H3' DG A 4 5.033 9.390 9.673 1.00 0.17 H new ATOM 0 H2' DG A 4 4.597 7.077 10.081 1.00 0.16 H new ATOM 0 H2'' DG A 4 3.117 7.789 10.693 1.00 0.16 H new ATOM 0 H1' DG A 4 1.910 7.323 8.697 1.00 0.17 H new ATOM 0 H8 DG A 4 4.985 5.030 8.828 1.00 0.21 H new ATOM 0 H1 DG A 4 -0.680 2.146 9.317 1.00 0.18 H new ATOM 0 H21 DG A 4 -1.981 5.362 9.037 1.00 0.20 H new ATOM 0 H22 DG A 4 -2.296 3.634 9.224 1.00 0.20 H new ATOM 124 P DG A 5 2.516 10.268 10.912 1.00 0.14 P ATOM 125 OP1 DG A 5 2.045 11.670 10.972 1.00 0.22 O ATOM 126 OP2 DG A 5 3.483 9.772 11.918 1.00 0.22 O ATOM 127 O5' DG A 5 1.228 9.300 10.931 1.00 0.14 O ATOM 128 C5' DG A 5 0.060 9.632 10.172 1.00 0.14 C ATOM 129 C4' DG A 5 -1.163 8.837 10.644 1.00 0.12 C ATOM 130 O4' DG A 5 -0.949 7.403 10.490 1.00 0.13 O ATOM 131 C3' DG A 5 -1.437 9.092 12.128 1.00 0.12 C ATOM 132 O3' DG A 5 -2.825 9.359 12.371 1.00 0.15 O ATOM 133 C2' DG A 5 -1.002 7.818 12.787 1.00 0.11 C ATOM 134 C1' DG A 5 -1.269 6.765 11.741 1.00 0.11 C ATOM 135 N9 DG A 5 -0.450 5.563 11.965 1.00 0.13 N ATOM 136 C8 DG A 5 0.888 5.447 11.990 1.00 0.14 C ATOM 137 N7 DG A 5 1.389 4.277 12.215 1.00 0.17 N ATOM 138 C5 DG A 5 0.236 3.499 12.361 1.00 0.17 C ATOM 139 C6 DG A 5 0.099 2.108 12.627 1.00 0.20 C ATOM 140 O6 DG A 5 0.982 1.268 12.788 1.00 0.24 O ATOM 141 N1 DG A 5 -1.236 1.733 12.695 1.00 0.20 N ATOM 142 C2 DG A 5 -2.312 2.583 12.528 1.00 0.18 C ATOM 143 N2 DG A 5 -3.522 2.033 12.632 1.00 0.19 N ATOM 144 N3 DG A 5 -2.192 3.891 12.278 1.00 0.15 N ATOM 145 C4 DG A 5 -0.899 4.282 12.208 1.00 0.14 C ATOM 0 H5' DG A 5 0.241 9.430 9.116 1.00 0.14 H new ATOM 0 H5'' DG A 5 -0.142 10.699 10.262 1.00 0.14 H new ATOM 0 H4' DG A 5 -2.004 9.165 10.033 1.00 0.12 H new ATOM 0 H3' DG A 5 -0.911 9.968 12.508 1.00 0.12 H new ATOM 0 H2' DG A 5 0.052 7.850 13.063 1.00 0.11 H new ATOM 0 H2'' DG A 5 -1.565 7.627 13.700 1.00 0.11 H new ATOM 0 H1' DG A 5 -2.301 6.415 11.766 1.00 0.11 H new ATOM 0 H8 DG A 5 1.525 6.304 11.827 1.00 0.14 H new ATOM 0 H1 DG A 5 -1.439 0.751 12.883 1.00 0.20 H new ATOM 0 H21 DG A 5 -4.356 2.610 12.519 1.00 0.19 H new ATOM 0 H22 DG A 5 -3.614 1.036 12.825 1.00 0.19 H new ATOM 157 P DC A 6 -3.322 9.876 13.817 1.00 0.17 P ATOM 158 OP1 DC A 6 -4.527 10.713 13.620 1.00 0.24 O ATOM 159 OP2 DC A 6 -2.154 10.427 14.542 1.00 0.21 O ATOM 160 O5' DC A 6 -3.769 8.511 14.549 1.00 0.17 O ATOM 161 C5' DC A 6 -4.962 7.833 14.145 1.00 0.16 C ATOM 162 C4' DC A 6 -5.018 6.403 14.715 1.00 0.13 C ATOM 163 O4' DC A 6 -3.830 5.690 14.352 1.00 0.12 O ATOM 164 C3' DC A 6 -5.053 6.424 16.252 1.00 0.14 C ATOM 165 O3' DC A 6 -6.275 5.852 16.745 1.00 0.16 O ATOM 166 C2' DC A 6 -3.872 5.591 16.675 1.00 0.15 C ATOM 167 C1' DC A 6 -3.518 4.821 15.437 1.00 0.12 C ATOM 168 N1 DC A 6 -2.102 4.479 15.435 1.00 0.13 N ATOM 169 C2 DC A 6 -1.781 3.163 15.623 1.00 0.15 C ATOM 170 O2 DC A 6 -2.670 2.343 15.780 1.00 0.16 O ATOM 171 N3 DC A 6 -0.481 2.803 15.624 1.00 0.18 N ATOM 172 C4 DC A 6 0.483 3.703 15.446 1.00 0.18 C ATOM 173 N4 DC A 6 1.748 3.285 15.457 1.00 0.22 N ATOM 174 C5 DC A 6 0.174 5.095 15.248 1.00 0.16 C ATOM 175 C6 DC A 6 -1.168 5.438 15.252 1.00 0.13 C ATOM 0 H5' DC A 6 -5.009 7.794 13.057 1.00 0.16 H new ATOM 0 H5'' DC A 6 -5.833 8.395 14.482 1.00 0.16 H new ATOM 0 H4' DC A 6 -5.915 5.930 14.315 1.00 0.13 H new ATOM 0 H3' DC A 6 -5.007 7.439 16.647 1.00 0.14 H new ATOM 0 H2' DC A 6 -3.042 6.214 17.010 1.00 0.15 H new ATOM 0 H2'' DC A 6 -4.126 4.927 17.501 1.00 0.15 H new ATOM 0 H1' DC A 6 -4.065 3.881 15.371 1.00 0.12 H new ATOM 0 H41 DC A 6 2.507 3.953 15.323 1.00 0.22 H new ATOM 0 H42 DC A 6 1.957 2.297 15.599 1.00 0.22 H new ATOM 0 H5 DC A 6 0.949 5.834 15.104 1.00 0.16 H new ATOM 0 H6 DC A 6 -1.466 6.466 15.110 1.00 0.13 H new ATOM 187 P DG A 7 -6.554 5.707 18.328 1.00 0.17 P ATOM 188 OP1 DG A 7 -7.964 6.078 18.579 1.00 0.22 O ATOM 189 OP2 DG A 7 -5.474 6.414 19.053 1.00 0.23 O ATOM 190 O5' DG A 7 -6.397 4.119 18.616 1.00 0.16 O ATOM 191 C5' DG A 7 -7.022 3.137 17.771 1.00 0.18 C ATOM 192 C4' DG A 7 -7.408 1.876 18.560 1.00 0.19 C ATOM 193 O4' DG A 7 -6.247 1.095 18.990 1.00 0.18 O ATOM 194 C3' DG A 7 -8.158 2.281 19.816 1.00 0.17 C ATOM 195 O3' DG A 7 -9.255 1.384 20.046 1.00 0.21 O ATOM 196 C2' DG A 7 -7.104 2.179 20.880 1.00 0.16 C ATOM 197 C1' DG A 7 -6.263 0.983 20.440 1.00 0.16 C ATOM 198 N9 DG A 7 -4.862 1.041 20.959 1.00 0.15 N ATOM 199 C8 DG A 7 -3.927 0.036 21.217 1.00 0.15 C ATOM 200 N7 DG A 7 -2.763 0.455 21.599 1.00 0.16 N ATOM 201 C5 DG A 7 -2.902 1.839 21.614 1.00 0.17 C ATOM 202 C6 DG A 7 -1.953 2.839 21.962 1.00 0.19 C ATOM 203 O6 DG A 7 -0.792 2.689 22.335 1.00 0.21 O ATOM 204 N1 DG A 7 -2.484 4.115 21.843 1.00 0.21 N ATOM 205 C2 DG A 7 -3.769 4.405 21.438 1.00 0.21 C ATOM 206 N2 DG A 7 -4.089 5.712 21.384 1.00 0.25 N ATOM 207 N3 DG A 7 -4.672 3.459 21.109 1.00 0.18 N ATOM 208 C4 DG A 7 -4.172 2.207 21.222 1.00 0.16 C ATOM 0 H5' DG A 7 -6.343 2.867 16.962 1.00 0.18 H new ATOM 0 H5'' DG A 7 -7.912 3.566 17.311 1.00 0.18 H new ATOM 0 H4' DG A 7 -8.014 1.266 17.890 1.00 0.19 H new ATOM 0 H3' DG A 7 -8.605 3.274 19.773 1.00 0.17 H new ATOM 0 H2' DG A 7 -6.506 3.089 20.941 1.00 0.16 H new ATOM 0 H2'' DG A 7 -7.543 2.020 21.865 1.00 0.16 H new ATOM 0 H1' DG A 7 -6.676 0.047 20.816 1.00 0.16 H new ATOM 0 H8 DG A 7 -4.158 -1.013 21.106 1.00 0.15 H new ATOM 0 H1 DG A 7 -1.875 4.900 22.073 1.00 0.21 H new ATOM 0 H21 DG A 7 -5.024 5.996 21.092 1.00 0.25 H new ATOM 0 H22 DG A 7 -3.396 6.417 21.635 1.00 0.25 H new ATOM 219 P DC A 8 -10.177 1.483 21.362 1.00 0.22 P ATOM 220 OP1 DC A 8 -11.578 1.212 20.967 1.00 0.30 O ATOM 221 OP2 DC A 8 -9.841 2.733 22.079 1.00 0.24 O ATOM 222 O5' DC A 8 -9.654 0.241 22.242 1.00 0.22 O ATOM 223 C5' DC A 8 -9.190 -0.963 21.615 1.00 0.20 C ATOM 224 C4' DC A 8 -8.539 -1.886 22.594 1.00 0.19 C ATOM 225 O4' DC A 8 -7.191 -1.471 22.698 1.00 0.17 O ATOM 226 C3' DC A 8 -9.154 -1.763 23.990 1.00 0.20 C ATOM 227 O3' DC A 8 -9.657 -3.044 24.407 1.00 0.22 O ATOM 228 C2' DC A 8 -7.990 -1.281 24.847 1.00 0.19 C ATOM 229 C1' DC A 8 -6.796 -1.635 24.037 1.00 0.17 C ATOM 230 N1 DC A 8 -5.637 -0.758 24.284 1.00 0.16 N ATOM 231 C2 DC A 8 -4.423 -1.371 24.435 1.00 0.16 C ATOM 232 O2 DC A 8 -4.363 -2.582 24.412 1.00 0.18 O ATOM 233 N3 DC A 8 -3.320 -0.602 24.605 1.00 0.17 N ATOM 234 C4 DC A 8 -3.407 0.729 24.640 1.00 0.17 C ATOM 235 N4 DC A 8 -2.300 1.447 24.834 1.00 0.19 N ATOM 236 C5 DC A 8 -4.670 1.383 24.482 1.00 0.17 C ATOM 237 C6 DC A 8 -5.757 0.603 24.303 1.00 0.16 C ATOM 0 H5' DC A 8 -8.481 -0.712 20.826 1.00 0.20 H new ATOM 0 H5'' DC A 8 -10.029 -1.471 21.139 1.00 0.20 H new ATOM 0 H4' DC A 8 -8.659 -2.914 22.251 1.00 0.19 H new ATOM 0 H3' DC A 8 -10.003 -1.082 24.052 1.00 0.20 H new ATOM 0 H2' DC A 8 -8.045 -0.208 25.033 1.00 0.19 H new ATOM 0 H2'' DC A 8 -7.976 -1.773 25.819 1.00 0.19 H new ATOM 0 H1' DC A 8 -6.478 -2.646 24.292 1.00 0.17 H new ATOM 0 H41 DC A 8 -2.351 2.465 24.863 1.00 0.19 H new ATOM 0 H42 DC A 8 -1.402 0.978 24.953 1.00 0.19 H new ATOM 0 H5 DC A 8 -4.750 2.460 24.505 1.00 0.17 H new ATOM 0 H6 DC A 8 -6.728 1.058 24.174 1.00 0.16 H new ATOM 249 P DC A 9 -10.173 -3.318 25.906 1.00 0.24 P ATOM 250 OP1 DC A 9 -11.309 -4.264 25.839 1.00 0.28 O ATOM 251 OP2 DC A 9 -10.336 -2.016 26.592 1.00 0.27 O ATOM 252 O5' DC A 9 -8.916 -4.079 26.560 1.00 0.23 O ATOM 253 C5' DC A 9 -8.734 -5.497 26.417 1.00 0.23 C ATOM 254 C4' DC A 9 -7.413 -5.919 27.031 1.00 0.19 C ATOM 255 O4' DC A 9 -6.452 -4.893 26.735 1.00 0.17 O ATOM 256 C3' DC A 9 -7.597 -5.937 28.547 1.00 0.19 C ATOM 257 O3' DC A 9 -7.127 -7.191 29.071 1.00 0.19 O ATOM 258 C2' DC A 9 -6.745 -4.795 29.017 1.00 0.18 C ATOM 259 C1' DC A 9 -5.710 -4.655 27.931 1.00 0.15 C ATOM 260 N1 DC A 9 -5.107 -3.315 27.886 1.00 0.15 N ATOM 261 C2 DC A 9 -3.756 -3.213 28.172 1.00 0.15 C ATOM 262 O2 DC A 9 -3.108 -4.214 28.466 1.00 0.16 O ATOM 263 N3 DC A 9 -3.175 -1.988 28.114 1.00 0.17 N ATOM 264 C4 DC A 9 -3.883 -0.901 27.791 1.00 0.18 C ATOM 265 N4 DC A 9 -3.265 0.281 27.753 1.00 0.19 N ATOM 266 C5 DC A 9 -5.286 -0.993 27.490 1.00 0.18 C ATOM 267 C6 DC A 9 -5.857 -2.231 27.551 1.00 0.17 C ATOM 0 H5' DC A 9 -8.757 -5.770 25.362 1.00 0.23 H new ATOM 0 H5'' DC A 9 -9.554 -6.027 26.901 1.00 0.23 H new ATOM 0 H4' DC A 9 -7.094 -6.890 26.653 1.00 0.19 H new ATOM 0 H3' DC A 9 -8.634 -5.836 28.869 1.00 0.19 H new ATOM 0 H2' DC A 9 -7.328 -3.882 29.135 1.00 0.18 H new ATOM 0 H2'' DC A 9 -6.287 -5.008 29.983 1.00 0.18 H new ATOM 0 H1' DC A 9 -4.875 -5.338 28.086 1.00 0.15 H new ATOM 0 H41 DC A 9 -3.788 1.122 27.509 1.00 0.19 H new ATOM 0 H42 DC A 9 -2.270 0.343 27.968 1.00 0.19 H new ATOM 0 H5 DC A 9 -5.864 -0.119 27.227 1.00 0.18 H new ATOM 0 H6 DC A 9 -6.908 -2.350 27.333 1.00 0.17 H new ATOM 279 P DA A 10 -7.290 -7.592 30.623 1.00 0.20 P ATOM 280 OP1 DA A 10 -7.454 -9.061 30.703 1.00 0.23 O ATOM 281 OP2 DA A 10 -8.309 -6.705 31.228 1.00 0.28 O ATOM 282 O5' DA A 10 -5.854 -7.212 31.259 1.00 0.20 O ATOM 283 C5' DA A 10 -4.641 -7.264 30.486 1.00 0.18 C ATOM 284 C4' DA A 10 -3.398 -7.388 31.374 1.00 0.20 C ATOM 285 O4' DA A 10 -2.486 -6.328 31.030 1.00 0.19 O ATOM 286 C3' DA A 10 -3.789 -7.170 32.827 1.00 0.21 C ATOM 287 O3' DA A 10 -3.130 -8.154 33.644 1.00 0.26 O ATOM 288 C2' DA A 10 -3.343 -5.744 33.092 1.00 0.19 C ATOM 289 C1' DA A 10 -2.148 -5.594 32.223 1.00 0.19 C ATOM 290 N9 DA A 10 -2.012 -4.200 31.798 1.00 0.19 N ATOM 291 C8 DA A 10 -2.966 -3.439 31.236 1.00 0.19 C ATOM 292 N7 DA A 10 -2.662 -2.234 30.907 1.00 0.21 N ATOM 293 C5 DA A 10 -1.321 -2.174 31.292 1.00 0.21 C ATOM 294 C6 DA A 10 -0.374 -1.156 31.224 1.00 0.23 C ATOM 295 N6 DA A 10 -0.647 0.047 30.726 1.00 0.25 N ATOM 296 N1 DA A 10 0.858 -1.423 31.688 1.00 0.24 N ATOM 297 C2 DA A 10 1.140 -2.630 32.190 1.00 0.23 C ATOM 298 N3 DA A 10 0.315 -3.670 32.305 1.00 0.22 N ATOM 299 C4 DA A 10 -0.910 -3.373 31.835 1.00 0.20 C ATOM 0 H5' DA A 10 -4.562 -6.365 29.875 1.00 0.18 H new ATOM 0 H5'' DA A 10 -4.683 -8.111 29.802 1.00 0.18 H new ATOM 0 H4' DA A 10 -2.952 -8.373 31.233 1.00 0.20 H new ATOM 0 H3' DA A 10 -4.849 -7.288 33.051 1.00 0.21 H new ATOM 0 H2' DA A 10 -4.121 -5.025 32.835 1.00 0.19 H new ATOM 0 H2'' DA A 10 -3.099 -5.587 34.143 1.00 0.19 H new ATOM 0 H1' DA A 10 -1.242 -5.921 32.733 1.00 0.19 H new ATOM 0 H8 DA A 10 -3.959 -3.828 31.066 1.00 0.19 H new ATOM 0 H61 DA A 10 0.079 0.763 30.696 1.00 0.25 H new ATOM 0 H62 DA A 10 -1.582 0.253 30.374 1.00 0.25 H new ATOM 0 H2 DA A 10 2.150 -2.779 32.542 1.00 0.23 H new ATOM 311 P DT A 11 -2.543 -7.816 35.095 1.00 0.27 P ATOM 312 OP1 DT A 11 -2.192 -9.092 35.760 1.00 0.34 O ATOM 313 OP2 DT A 11 -3.463 -6.868 35.763 1.00 0.28 O ATOM 314 O5' DT A 11 -1.180 -7.034 34.747 1.00 0.26 O ATOM 315 C5' DT A 11 0.066 -7.729 34.588 1.00 0.30 C ATOM 316 C4' DT A 11 1.190 -6.827 35.026 1.00 0.29 C ATOM 317 O4' DT A 11 1.001 -5.554 34.381 1.00 0.25 O ATOM 318 C3' DT A 11 0.985 -6.611 36.520 1.00 0.28 C ATOM 319 O3' DT A 11 2.207 -6.870 37.235 1.00 0.33 O ATOM 320 C2' DT A 11 0.588 -5.174 36.595 1.00 0.22 C ATOM 321 C1' DT A 11 1.189 -4.550 35.381 1.00 0.22 C ATOM 322 N1 DT A 11 0.437 -3.344 35.053 1.00 0.17 N ATOM 323 C2 DT A 11 1.111 -2.150 34.876 1.00 0.17 C ATOM 324 O2 DT A 11 2.332 -2.058 34.976 1.00 0.20 O ATOM 325 N3 DT A 11 0.318 -1.057 34.575 1.00 0.16 N ATOM 326 C4 DT A 11 -1.062 -1.064 34.442 1.00 0.16 C ATOM 327 O4 DT A 11 -1.664 -0.028 34.168 1.00 0.19 O ATOM 328 C5 DT A 11 -1.670 -2.364 34.649 1.00 0.15 C ATOM 329 C7 DT A 11 -3.186 -2.515 34.535 1.00 0.17 C ATOM 330 C6 DT A 11 -0.910 -3.440 34.942 1.00 0.16 C ATOM 0 H5' DT A 11 0.203 -8.023 33.547 1.00 0.30 H new ATOM 0 H5'' DT A 11 0.065 -8.644 35.180 1.00 0.30 H new ATOM 0 H4' DT A 11 2.171 -7.241 34.792 1.00 0.29 H new ATOM 0 H3' DT A 11 0.244 -7.273 36.968 1.00 0.28 H new ATOM 0 H2' DT A 11 -0.496 -5.063 36.602 1.00 0.22 H new ATOM 0 H2'' DT A 11 0.962 -4.707 37.506 1.00 0.22 H new ATOM 0 H1' DT A 11 2.233 -4.258 35.491 1.00 0.22 H new ATOM 0 H3 DT A 11 0.792 -0.164 34.438 1.00 0.16 H new ATOM 0 H71 DT A 11 -3.427 -3.521 34.191 1.00 0.17 H new ATOM 0 H72 DT A 11 -3.643 -2.346 35.510 1.00 0.17 H new ATOM 0 H73 DT A 11 -3.572 -1.786 33.823 1.00 0.17 H new ATOM 0 H6 DT A 11 -1.386 -4.398 35.091 1.00 0.16 H new ATOM 343 P DC A 12 2.386 -6.480 38.791 1.00 0.33 P ATOM 344 OP1 DC A 12 3.251 -7.499 39.426 1.00 0.47 O ATOM 345 OP2 DC A 12 1.050 -6.190 39.359 1.00 0.32 O ATOM 346 O5' DC A 12 3.211 -5.096 38.717 1.00 0.30 O ATOM 347 C5' DC A 12 4.444 -5.012 37.989 1.00 0.35 C ATOM 348 C4' DC A 12 4.958 -3.570 37.930 1.00 0.36 C ATOM 349 O4' DC A 12 4.001 -2.735 37.252 1.00 0.31 O ATOM 350 C3' DC A 12 5.109 -2.997 39.344 1.00 0.35 C ATOM 351 O3' DC A 12 6.467 -2.630 39.606 1.00 0.46 O ATOM 352 C2' DC A 12 4.206 -1.786 39.359 1.00 0.33 C ATOM 353 C1' DC A 12 4.010 -1.456 37.894 1.00 0.32 C ATOM 354 N1 DC A 12 2.722 -0.765 37.682 1.00 0.26 N ATOM 355 C2 DC A 12 2.734 0.593 37.392 1.00 0.30 C ATOM 356 O2 DC A 12 3.797 1.205 37.313 1.00 0.39 O ATOM 357 N3 DC A 12 1.539 1.217 37.202 1.00 0.29 N ATOM 358 C4 DC A 12 0.385 0.540 37.292 1.00 0.24 C ATOM 359 N4 DC A 12 -0.769 1.178 37.100 1.00 0.28 N ATOM 360 C5 DC A 12 0.375 -0.856 37.591 1.00 0.20 C ATOM 361 C6 DC A 12 1.558 -1.461 37.776 1.00 0.20 C ATOM 0 H5' DC A 12 4.298 -5.390 36.977 1.00 0.35 H new ATOM 0 H5'' DC A 12 5.192 -5.648 38.462 1.00 0.35 H new ATOM 0 H4' DC A 12 5.916 -3.583 37.410 1.00 0.36 H new ATOM 0 H3' DC A 12 4.842 -3.720 40.115 1.00 0.35 H new ATOM 0 H2' DC A 12 3.257 -2.002 39.850 1.00 0.33 H new ATOM 0 H2'' DC A 12 4.662 -0.955 39.898 1.00 0.33 H new ATOM 0 HO3' DC A 12 6.538 -2.266 40.513 1.00 0.46 H new ATOM 0 H1' DC A 12 4.783 -0.792 37.507 1.00 0.32 H new ATOM 0 H41 DC A 12 -1.650 0.669 37.167 1.00 0.28 H new ATOM 0 H42 DC A 12 -0.771 2.175 36.886 1.00 0.28 H new ATOM 0 H5 DC A 12 -0.552 -1.405 37.666 1.00 0.20 H new ATOM 0 H6 DC A 12 1.586 -2.517 38.003 1.00 0.20 H new TER 374 DC A 12 ATOM 375 O5' DG B 13 0.564 11.754 36.105 1.00 0.38 O ATOM 376 C5' DG B 13 1.917 12.070 36.442 1.00 0.30 C ATOM 377 C4' DG B 13 2.899 11.080 35.817 1.00 0.22 C ATOM 378 O4' DG B 13 2.619 9.722 36.261 1.00 0.20 O ATOM 379 C3' DG B 13 2.792 11.088 34.290 1.00 0.19 C ATOM 380 O3' DG B 13 4.101 11.179 33.692 1.00 0.19 O ATOM 381 C2' DG B 13 2.086 9.800 33.990 1.00 0.19 C ATOM 382 C1' DG B 13 2.526 8.879 35.097 1.00 0.18 C ATOM 383 N9 DG B 13 1.530 7.822 35.310 1.00 0.19 N ATOM 384 C8 DG B 13 0.187 7.879 35.167 1.00 0.25 C ATOM 385 N7 DG B 13 -0.487 6.809 35.421 1.00 0.28 N ATOM 386 C5 DG B 13 0.527 5.916 35.782 1.00 0.25 C ATOM 387 C6 DG B 13 0.442 4.557 36.178 1.00 0.29 C ATOM 388 O6 DG B 13 -0.560 3.858 36.289 1.00 0.33 O ATOM 389 N1 DG B 13 1.696 4.026 36.454 1.00 0.32 N ATOM 390 C2 DG B 13 2.890 4.715 36.363 1.00 0.33 C ATOM 391 N2 DG B 13 3.994 4.033 36.669 1.00 0.42 N ATOM 392 N3 DG B 13 2.977 5.995 35.991 1.00 0.28 N ATOM 393 C4 DG B 13 1.767 6.532 35.717 1.00 0.22 C ATOM 0 H5' DG B 13 2.033 12.064 37.526 1.00 0.30 H new ATOM 0 H5'' DG B 13 2.151 13.079 36.102 1.00 0.30 H new ATOM 0 H4' DG B 13 3.897 11.388 36.130 1.00 0.22 H new ATOM 0 H3' DG B 13 2.252 11.942 33.882 1.00 0.19 H new ATOM 0 H2' DG B 13 1.004 9.930 33.985 1.00 0.19 H new ATOM 0 H2'' DG B 13 2.365 9.410 33.011 1.00 0.19 H new ATOM 0 HO5' DG B 13 -0.038 12.405 36.522 1.00 0.38 H new ATOM 0 H1' DG B 13 3.469 8.383 34.870 1.00 0.18 H new ATOM 0 H8 DG B 13 -0.304 8.788 34.851 1.00 0.25 H new ATOM 0 H1 DG B 13 1.738 3.050 36.747 1.00 0.32 H new ATOM 0 H21 DG B 13 4.905 4.489 36.620 1.00 0.42 H new ATOM 0 H22 DG B 13 3.927 3.055 36.952 1.00 0.42 H new ATOM 406 P DA B 14 4.482 10.430 32.314 1.00 0.19 P ATOM 407 OP1 DA B 14 5.762 10.988 31.823 1.00 0.24 O ATOM 408 OP2 DA B 14 3.291 10.431 31.435 1.00 0.26 O ATOM 409 O5' DA B 14 4.746 8.920 32.808 1.00 0.19 O ATOM 410 C5' DA B 14 5.756 8.641 33.785 1.00 0.16 C ATOM 411 C4' DA B 14 6.189 7.186 33.741 1.00 0.15 C ATOM 412 O4' DA B 14 5.117 6.305 34.177 1.00 0.15 O ATOM 413 C3' DA B 14 6.527 6.819 32.309 1.00 0.16 C ATOM 414 O3' DA B 14 7.804 6.175 32.234 1.00 0.21 O ATOM 415 C2' DA B 14 5.397 5.921 31.904 1.00 0.15 C ATOM 416 C1' DA B 14 4.976 5.268 33.193 1.00 0.15 C ATOM 417 N9 DA B 14 3.570 4.859 33.121 1.00 0.16 N ATOM 418 C8 DA B 14 2.515 5.583 32.703 1.00 0.17 C ATOM 419 N7 DA B 14 1.351 5.022 32.739 1.00 0.19 N ATOM 420 C5 DA B 14 1.668 3.756 33.249 1.00 0.19 C ATOM 421 C6 DA B 14 0.890 2.630 33.549 1.00 0.22 C ATOM 422 N6 DA B 14 -0.430 2.586 33.368 1.00 0.25 N ATOM 423 N1 DA B 14 1.527 1.549 34.039 1.00 0.23 N ATOM 424 C2 DA B 14 2.850 1.572 34.223 1.00 0.22 C ATOM 425 N3 DA B 14 3.680 2.581 33.974 1.00 0.20 N ATOM 426 C4 DA B 14 3.020 3.650 33.485 1.00 0.18 C ATOM 0 H5' DA B 14 5.377 8.879 34.779 1.00 0.16 H new ATOM 0 H5'' DA B 14 6.619 9.284 33.611 1.00 0.16 H new ATOM 0 H4' DA B 14 7.047 7.068 34.402 1.00 0.15 H new ATOM 0 H3' DA B 14 6.618 7.679 31.646 1.00 0.16 H new ATOM 0 H2' DA B 14 4.579 6.485 31.456 1.00 0.15 H new ATOM 0 H2'' DA B 14 5.717 5.183 31.168 1.00 0.15 H new ATOM 0 H1' DA B 14 5.565 4.379 33.417 1.00 0.15 H new ATOM 0 H8 DA B 14 2.637 6.596 32.350 1.00 0.17 H new ATOM 0 H61 DA B 14 -0.949 1.740 33.603 1.00 0.25 H new ATOM 0 H62 DA B 14 -0.921 3.398 32.994 1.00 0.25 H new ATOM 0 H2 DA B 14 3.295 0.671 34.618 1.00 0.22 H new ATOM 438 P DT B 15 8.479 5.805 30.821 1.00 0.23 P ATOM 439 OP1 DT B 15 9.920 6.135 30.894 1.00 0.34 O ATOM 440 OP2 DT B 15 7.645 6.372 29.737 1.00 0.27 O ATOM 441 O5' DT B 15 8.330 4.205 30.787 1.00 0.22 O ATOM 442 C5' DT B 15 8.862 3.394 31.843 1.00 0.19 C ATOM 443 C4' DT B 15 8.194 2.025 31.864 1.00 0.17 C ATOM 444 O4' DT B 15 6.784 2.147 32.150 1.00 0.17 O ATOM 445 C3' DT B 15 8.294 1.371 30.483 1.00 0.18 C ATOM 446 O3' DT B 15 9.049 0.153 30.545 1.00 0.20 O ATOM 447 C2' DT B 15 6.856 1.119 30.091 1.00 0.18 C ATOM 448 C1' DT B 15 6.109 1.155 31.364 1.00 0.18 C ATOM 449 N1 DT B 15 4.709 1.508 31.107 1.00 0.18 N ATOM 450 C2 DT B 15 3.724 0.597 31.440 1.00 0.20 C ATOM 451 O2 DT B 15 3.977 -0.489 31.957 1.00 0.22 O ATOM 452 N3 DT B 15 2.430 0.982 31.149 1.00 0.20 N ATOM 453 C4 DT B 15 2.048 2.181 30.564 1.00 0.20 C ATOM 454 O4 DT B 15 0.864 2.430 30.354 1.00 0.21 O ATOM 455 C5 DT B 15 3.153 3.060 30.254 1.00 0.18 C ATOM 456 C7 DT B 15 2.880 4.416 29.607 1.00 0.18 C ATOM 457 C6 DT B 15 4.420 2.699 30.531 1.00 0.16 C ATOM 0 H5' DT B 15 8.711 3.892 32.801 1.00 0.19 H new ATOM 0 H5'' DT B 15 9.938 3.277 31.711 1.00 0.19 H new ATOM 0 H4' DT B 15 8.697 1.433 32.628 1.00 0.17 H new ATOM 0 H3' DT B 15 8.814 1.995 29.756 1.00 0.18 H new ATOM 0 H2' DT B 15 6.495 1.879 29.398 1.00 0.18 H new ATOM 0 H2'' DT B 15 6.744 0.156 29.593 1.00 0.18 H new ATOM 0 H1' DT B 15 6.086 0.196 31.881 1.00 0.18 H new ATOM 0 H3 DT B 15 1.687 0.325 31.386 1.00 0.20 H new ATOM 0 H71 DT B 15 3.648 5.126 29.913 1.00 0.18 H new ATOM 0 H72 DT B 15 2.894 4.311 28.522 1.00 0.18 H new ATOM 0 H73 DT B 15 1.902 4.780 29.923 1.00 0.18 H new ATOM 0 H6 DT B 15 5.226 3.376 30.288 1.00 0.16 H new ATOM 470 P DG B 16 9.080 -0.869 29.299 1.00 0.23 P ATOM 471 OP1 DG B 16 10.244 -1.769 29.467 1.00 0.27 O ATOM 472 OP2 DG B 16 8.928 -0.088 28.051 1.00 0.27 O ATOM 473 O5' DG B 16 7.736 -1.729 29.523 1.00 0.24 O ATOM 474 C5' DG B 16 7.734 -2.863 30.397 1.00 0.23 C ATOM 475 C4' DG B 16 6.723 -3.913 29.949 1.00 0.22 C ATOM 476 O4' DG B 16 5.353 -3.435 30.083 1.00 0.22 O ATOM 477 C3' DG B 16 6.931 -4.266 28.478 1.00 0.21 C ATOM 478 O3' DG B 16 6.952 -5.687 28.291 1.00 0.23 O ATOM 479 C2' DG B 16 5.764 -3.620 27.793 1.00 0.21 C ATOM 480 C1' DG B 16 4.674 -3.662 28.831 1.00 0.21 C ATOM 481 N9 DG B 16 3.657 -2.622 28.582 1.00 0.22 N ATOM 482 C8 DG B 16 3.822 -1.313 28.284 1.00 0.24 C ATOM 483 N7 DG B 16 2.757 -0.600 28.102 1.00 0.24 N ATOM 484 C5 DG B 16 1.744 -1.546 28.302 1.00 0.23 C ATOM 485 C6 DG B 16 0.328 -1.400 28.242 1.00 0.24 C ATOM 486 O6 DG B 16 -0.334 -0.389 27.998 1.00 0.25 O ATOM 487 N1 DG B 16 -0.316 -2.602 28.506 1.00 0.24 N ATOM 488 C2 DG B 16 0.313 -3.798 28.794 1.00 0.24 C ATOM 489 N2 DG B 16 -0.480 -4.845 29.020 1.00 0.27 N ATOM 490 N3 DG B 16 1.638 -3.943 28.852 1.00 0.22 N ATOM 491 C4 DG B 16 2.291 -2.787 28.598 1.00 0.22 C ATOM 0 H5' DG B 16 7.500 -2.541 31.412 1.00 0.23 H new ATOM 0 H5'' DG B 16 8.730 -3.304 30.424 1.00 0.23 H new ATOM 0 H4' DG B 16 6.879 -4.782 30.588 1.00 0.22 H new ATOM 0 H3' DG B 16 7.884 -3.917 28.080 1.00 0.21 H new ATOM 0 H2' DG B 16 5.992 -2.597 27.493 1.00 0.21 H new ATOM 0 H2'' DG B 16 5.479 -4.161 26.891 1.00 0.21 H new ATOM 0 H1' DG B 16 4.136 -4.610 28.820 1.00 0.21 H new ATOM 0 H8 DG B 16 4.807 -0.878 28.201 1.00 0.24 H new ATOM 0 H1 DG B 16 -1.336 -2.602 28.486 1.00 0.24 H new ATOM 0 H21 DG B 16 -0.074 -5.755 29.238 1.00 0.27 H new ATOM 0 H22 DG B 16 -1.493 -4.736 28.975 1.00 0.27 H new ATOM 503 P DG B 17 7.105 -6.330 26.823 1.00 0.25 P ATOM 504 OP1 DG B 17 7.805 -7.628 26.957 1.00 0.31 O ATOM 505 OP2 DG B 17 7.639 -5.294 25.912 1.00 0.29 O ATOM 506 O5' DG B 17 5.575 -6.619 26.417 1.00 0.22 O ATOM 507 C5' DG B 17 4.875 -7.745 26.958 1.00 0.18 C ATOM 508 C4' DG B 17 3.510 -7.912 26.307 1.00 0.15 C ATOM 509 O4' DG B 17 2.604 -6.839 26.708 1.00 0.16 O ATOM 510 C3' DG B 17 3.623 -7.865 24.784 1.00 0.13 C ATOM 511 O3' DG B 17 2.947 -8.952 24.129 1.00 0.13 O ATOM 512 C2' DG B 17 3.024 -6.542 24.448 1.00 0.14 C ATOM 513 C1' DG B 17 2.011 -6.307 25.513 1.00 0.13 C ATOM 514 N9 DG B 17 1.728 -4.875 25.551 1.00 0.14 N ATOM 515 C8 DG B 17 2.523 -3.838 25.872 1.00 0.16 C ATOM 516 N7 DG B 17 2.043 -2.648 25.733 1.00 0.17 N ATOM 517 C5 DG B 17 0.761 -2.925 25.258 1.00 0.15 C ATOM 518 C6 DG B 17 -0.293 -2.050 24.901 1.00 0.16 C ATOM 519 O6 DG B 17 -0.319 -0.820 24.943 1.00 0.18 O ATOM 520 N1 DG B 17 -1.404 -2.758 24.468 1.00 0.15 N ATOM 521 C2 DG B 17 -1.494 -4.138 24.390 1.00 0.16 C ATOM 522 N2 DG B 17 -2.636 -4.653 23.945 1.00 0.17 N ATOM 523 N3 DG B 17 -0.511 -4.952 24.726 1.00 0.14 N ATOM 524 C4 DG B 17 0.574 -4.290 25.146 1.00 0.14 C ATOM 0 H5' DG B 17 4.754 -7.618 28.034 1.00 0.18 H new ATOM 0 H5'' DG B 17 5.465 -8.649 26.808 1.00 0.18 H new ATOM 0 H4' DG B 17 3.123 -8.878 26.632 1.00 0.15 H new ATOM 0 H3' DG B 17 4.652 -7.975 24.441 1.00 0.13 H new ATOM 0 H2' DG B 17 3.779 -5.756 24.439 1.00 0.14 H new ATOM 0 H2'' DG B 17 2.565 -6.554 23.460 1.00 0.14 H new ATOM 0 H1' DG B 17 1.047 -6.792 25.360 1.00 0.13 H new ATOM 0 H8 DG B 17 3.528 -3.996 26.234 1.00 0.16 H new ATOM 0 H1 DG B 17 -2.222 -2.218 24.184 1.00 0.15 H new ATOM 0 H21 DG B 17 -2.745 -5.665 23.872 1.00 0.17 H new ATOM 0 H22 DG B 17 -3.403 -4.037 23.677 1.00 0.17 H new ATOM 536 P DC B 18 3.718 -9.811 22.989 1.00 0.17 P ATOM 537 OP1 DC B 18 3.762 -11.224 23.430 1.00 0.23 O ATOM 538 OP2 DC B 18 4.978 -9.110 22.653 1.00 0.21 O ATOM 539 O5' DC B 18 2.737 -9.714 21.709 1.00 0.16 O ATOM 540 C5' DC B 18 1.484 -10.394 21.728 1.00 0.16 C ATOM 541 C4' DC B 18 0.416 -9.742 20.885 1.00 0.15 C ATOM 542 O4' DC B 18 0.420 -10.264 19.538 1.00 0.18 O ATOM 543 C3' DC B 18 -0.949 -10.070 21.502 1.00 0.17 C ATOM 544 O3' DC B 18 -1.511 -8.911 22.147 1.00 0.19 O ATOM 545 C2' DC B 18 -1.793 -10.626 20.379 1.00 0.17 C ATOM 546 C1' DC B 18 -0.928 -10.593 19.134 1.00 0.17 C ATOM 547 N1 DC B 18 -0.962 -11.878 18.419 1.00 0.19 N ATOM 548 C2 DC B 18 -1.201 -11.872 17.051 1.00 0.24 C ATOM 549 O2 DC B 18 -1.381 -10.810 16.456 1.00 0.28 O ATOM 550 N3 DC B 18 -1.229 -13.068 16.400 1.00 0.28 N ATOM 551 C4 DC B 18 -1.030 -14.215 17.065 1.00 0.27 C ATOM 552 N4 DC B 18 -1.063 -15.371 16.402 1.00 0.32 N ATOM 553 C5 DC B 18 -0.784 -14.212 18.475 1.00 0.25 C ATOM 554 C6 DC B 18 -0.761 -13.018 19.097 1.00 0.21 C ATOM 0 H5' DC B 18 1.132 -10.455 22.758 1.00 0.16 H new ATOM 0 H5'' DC B 18 1.632 -11.416 21.380 1.00 0.16 H new ATOM 0 H4' DC B 18 0.607 -8.669 20.854 1.00 0.15 H new ATOM 0 H3' DC B 18 -0.882 -10.812 22.298 1.00 0.17 H new ATOM 0 H2' DC B 18 -2.114 -11.644 20.602 1.00 0.17 H new ATOM 0 H2'' DC B 18 -2.695 -10.031 20.240 1.00 0.17 H new ATOM 0 H1' DC B 18 -1.310 -9.842 18.443 1.00 0.17 H new ATOM 0 H41 DC B 18 -0.913 -16.249 16.899 1.00 0.32 H new ATOM 0 H42 DC B 18 -1.239 -15.378 15.397 1.00 0.32 H new ATOM 0 H5 DC B 18 -0.623 -15.131 19.019 1.00 0.25 H new ATOM 0 H6 DC B 18 -0.577 -12.977 20.161 1.00 0.21 H new ATOM 566 P DG B 19 -3.048 -8.462 22.030 1.00 0.17 P ATOM 567 OP1 DG B 19 -3.320 -7.455 23.079 1.00 0.20 O ATOM 568 OP2 DG B 19 -3.890 -9.676 21.937 1.00 0.20 O ATOM 569 O5' DG B 19 -3.054 -7.730 20.605 1.00 0.18 O ATOM 570 C5' DG B 19 -2.525 -6.406 20.405 1.00 0.16 C ATOM 571 C4' DG B 19 -2.941 -5.932 19.076 1.00 0.13 C ATOM 572 O4' DG B 19 -2.402 -4.627 18.736 1.00 0.14 O ATOM 573 C3' DG B 19 -2.412 -6.918 18.063 1.00 0.12 C ATOM 574 O3' DG B 19 -3.470 -7.323 17.172 1.00 0.12 O ATOM 575 C2' DG B 19 -1.340 -6.160 17.373 1.00 0.12 C ATOM 576 C1' DG B 19 -1.817 -4.753 17.433 1.00 0.12 C ATOM 577 N9 DG B 19 -0.818 -3.689 17.137 1.00 0.14 N ATOM 578 C8 DG B 19 0.552 -3.643 17.143 1.00 0.15 C ATOM 579 N7 DG B 19 1.108 -2.519 16.819 1.00 0.17 N ATOM 580 C5 DG B 19 -0.004 -1.714 16.563 1.00 0.17 C ATOM 581 C6 DG B 19 -0.082 -0.352 16.159 1.00 0.21 C ATOM 582 O6 DG B 19 0.838 0.445 15.938 1.00 0.23 O ATOM 583 N1 DG B 19 -1.405 0.052 16.016 1.00 0.24 N ATOM 584 C2 DG B 19 -2.515 -0.746 16.231 1.00 0.23 C ATOM 585 N2 DG B 19 -3.709 -0.187 16.045 1.00 0.27 N ATOM 586 N3 DG B 19 -2.443 -2.010 16.607 1.00 0.19 N ATOM 587 C4 DG B 19 -1.173 -2.429 16.755 1.00 0.17 C ATOM 0 H5' DG B 19 -1.438 -6.417 20.480 1.00 0.16 H new ATOM 0 H5'' DG B 19 -2.891 -5.731 21.179 1.00 0.16 H new ATOM 0 H4' DG B 19 -4.028 -5.849 19.078 1.00 0.13 H new ATOM 0 H3' DG B 19 -2.033 -7.844 18.495 1.00 0.12 H new ATOM 0 H2' DG B 19 -0.379 -6.280 17.872 1.00 0.12 H new ATOM 0 H2'' DG B 19 -1.209 -6.496 16.344 1.00 0.12 H new ATOM 0 H1' DG B 19 -2.524 -4.579 16.622 1.00 0.12 H new ATOM 0 H8 DG B 19 1.143 -4.508 17.407 1.00 0.15 H new ATOM 0 H1 DG B 19 -1.571 1.017 15.729 1.00 0.24 H new ATOM 0 H21 DG B 19 -4.557 -0.735 16.191 1.00 0.27 H new ATOM 0 H22 DG B 19 -3.776 0.789 15.756 1.00 0.27 H new ATOM 599 P DC B 20 -3.205 -7.995 15.723 1.00 0.15 P ATOM 600 OP1 DC B 20 -3.859 -9.322 15.703 1.00 0.22 O ATOM 601 OP2 DC B 20 -1.767 -7.877 15.392 1.00 0.21 O ATOM 602 O5' DC B 20 -4.030 -7.013 14.743 1.00 0.14 O ATOM 603 C5' DC B 20 -5.199 -6.340 15.225 1.00 0.13 C ATOM 604 C4' DC B 20 -5.446 -5.031 14.508 1.00 0.14 C ATOM 605 O4' DC B 20 -4.343 -4.161 14.753 1.00 0.13 O ATOM 606 C3' DC B 20 -5.526 -5.245 12.992 1.00 0.16 C ATOM 607 O3' DC B 20 -6.815 -4.840 12.498 1.00 0.20 O ATOM 608 C2' DC B 20 -4.404 -4.362 12.439 1.00 0.14 C ATOM 609 C1' DC B 20 -4.121 -3.404 13.574 1.00 0.13 C ATOM 610 N1 DC B 20 -2.727 -2.958 13.548 1.00 0.13 N ATOM 611 C2 DC B 20 -2.456 -1.634 13.242 1.00 0.14 C ATOM 612 O2 DC B 20 -3.371 -0.848 13.004 1.00 0.15 O ATOM 613 N3 DC B 20 -1.157 -1.237 13.216 1.00 0.15 N ATOM 614 C4 DC B 20 -0.167 -2.102 13.477 1.00 0.17 C ATOM 615 N4 DC B 20 1.095 -1.670 13.441 1.00 0.20 N ATOM 616 C5 DC B 20 -0.447 -3.472 13.797 1.00 0.17 C ATOM 617 C6 DC B 20 -1.741 -3.852 13.822 1.00 0.14 C ATOM 0 H5' DC B 20 -5.092 -6.152 16.293 1.00 0.13 H new ATOM 0 H5'' DC B 20 -6.066 -6.989 15.101 1.00 0.13 H new ATOM 0 H4' DC B 20 -6.384 -4.612 14.872 1.00 0.14 H new ATOM 0 H3' DC B 20 -5.410 -6.287 12.695 1.00 0.16 H new ATOM 0 H2' DC B 20 -3.523 -4.948 12.179 1.00 0.14 H new ATOM 0 H2'' DC B 20 -4.715 -3.835 11.537 1.00 0.14 H new ATOM 0 H1' DC B 20 -4.748 -2.515 13.509 1.00 0.13 H new ATOM 0 H41 DC B 20 1.861 -2.315 13.637 1.00 0.20 H new ATOM 0 H42 DC B 20 1.294 -0.695 13.217 1.00 0.20 H new ATOM 0 H5 DC B 20 0.347 -4.172 14.010 1.00 0.17 H new ATOM 0 H6 DC B 20 -1.995 -4.874 14.061 1.00 0.14 H new ATOM 629 P DC B 21 -7.128 -4.728 10.918 1.00 0.23 P ATOM 630 OP1 DC B 21 -8.546 -5.093 10.702 1.00 0.35 O ATOM 631 OP2 DC B 21 -6.063 -5.442 10.178 1.00 0.25 O ATOM 632 O5' DC B 21 -6.967 -3.147 10.632 1.00 0.19 O ATOM 633 C5' DC B 21 -7.350 -2.180 11.620 1.00 0.20 C ATOM 634 C4' DC B 21 -7.160 -0.760 11.130 1.00 0.19 C ATOM 635 O4' DC B 21 -5.789 -0.444 11.347 1.00 0.18 O ATOM 636 C3' DC B 21 -7.389 -0.734 9.625 1.00 0.16 C ATOM 637 O3' DC B 21 -8.310 0.308 9.268 1.00 0.19 O ATOM 638 C2' DC B 21 -6.013 -0.463 9.074 1.00 0.14 C ATOM 639 C1' DC B 21 -5.300 0.229 10.193 1.00 0.17 C ATOM 640 N1 DC B 21 -3.884 -0.083 10.094 1.00 0.16 N ATOM 641 C2 DC B 21 -2.956 0.911 9.836 1.00 0.19 C ATOM 642 O2 DC B 21 -3.310 2.078 9.685 1.00 0.23 O ATOM 643 N3 DC B 21 -1.646 0.544 9.754 1.00 0.21 N ATOM 644 C4 DC B 21 -1.276 -0.739 9.919 1.00 0.20 C ATOM 645 N4 DC B 21 0.013 -1.066 9.834 1.00 0.24 N ATOM 646 C5 DC B 21 -2.247 -1.758 10.186 1.00 0.18 C ATOM 647 C6 DC B 21 -3.533 -1.378 10.264 1.00 0.15 C ATOM 0 H5' DC B 21 -6.761 -2.333 12.524 1.00 0.20 H new ATOM 0 H5'' DC B 21 -8.395 -2.333 11.891 1.00 0.20 H new ATOM 0 H4' DC B 21 -7.837 -0.071 11.635 1.00 0.19 H new ATOM 0 H3' DC B 21 -7.826 -1.654 9.237 1.00 0.16 H new ATOM 0 H2' DC B 21 -5.508 -1.387 8.791 1.00 0.14 H new ATOM 0 H2'' DC B 21 -6.057 0.162 8.182 1.00 0.14 H new ATOM 0 H1' DC B 21 -5.445 1.309 10.197 1.00 0.17 H new ATOM 0 H41 DC B 21 0.302 -2.036 9.958 1.00 0.24 H new ATOM 0 H42 DC B 21 0.710 -0.346 9.645 1.00 0.24 H new ATOM 0 H5 DC B 21 -1.957 -2.790 10.319 1.00 0.18 H new ATOM 0 H6 DC B 21 -4.296 -2.116 10.465 1.00 0.15 H new ATOM 659 P DG B 22 -8.602 0.672 7.724 1.00 0.19 P ATOM 660 OP1 DG B 22 -9.928 1.325 7.645 1.00 0.26 O ATOM 661 OP2 DG B 22 -8.320 -0.525 6.900 1.00 0.25 O ATOM 662 O5' DG B 22 -7.475 1.778 7.408 1.00 0.21 O ATOM 663 C5' DG B 22 -7.410 2.982 8.181 1.00 0.20 C ATOM 664 C4' DG B 22 -6.489 4.018 7.548 1.00 0.20 C ATOM 665 O4' DG B 22 -5.101 3.688 7.806 1.00 0.20 O ATOM 666 C3' DG B 22 -6.681 4.046 6.036 1.00 0.21 C ATOM 667 O3' DG B 22 -6.747 5.392 5.546 1.00 0.25 O ATOM 668 C2' DG B 22 -5.474 3.316 5.535 1.00 0.18 C ATOM 669 C1' DG B 22 -4.411 3.642 6.548 1.00 0.17 C ATOM 670 N9 DG B 22 -3.405 2.579 6.597 1.00 0.14 N ATOM 671 C8 DG B 22 -3.592 1.270 6.857 1.00 0.15 C ATOM 672 N7 DG B 22 -2.551 0.506 6.871 1.00 0.15 N ATOM 673 C5 DG B 22 -1.529 1.419 6.583 1.00 0.13 C ATOM 674 C6 DG B 22 -0.132 1.210 6.453 1.00 0.15 C ATOM 675 O6 DG B 22 0.496 0.160 6.566 1.00 0.18 O ATOM 676 N1 DG B 22 0.536 2.391 6.160 1.00 0.16 N ATOM 677 C2 DG B 22 -0.061 3.627 6.007 1.00 0.17 C ATOM 678 N2 DG B 22 0.752 4.646 5.727 1.00 0.22 N ATOM 679 N3 DG B 22 -1.376 3.834 6.127 1.00 0.16 N ATOM 680 C4 DG B 22 -2.047 2.695 6.414 1.00 0.13 C ATOM 0 H5' DG B 22 -7.057 2.749 9.186 1.00 0.20 H new ATOM 0 H5'' DG B 22 -8.411 3.401 8.284 1.00 0.20 H new ATOM 0 H4' DG B 22 -6.736 4.987 7.982 1.00 0.20 H new ATOM 0 H3' DG B 22 -7.614 3.591 5.704 1.00 0.21 H new ATOM 0 H2' DG B 22 -5.653 2.242 5.474 1.00 0.18 H new ATOM 0 H2'' DG B 22 -5.191 3.649 4.537 1.00 0.18 H new ATOM 0 H1' DG B 22 -3.899 4.573 6.306 1.00 0.17 H new ATOM 0 H8 DG B 22 -4.578 0.874 7.047 1.00 0.15 H new ATOM 0 H1 DG B 22 1.549 2.342 6.049 1.00 0.16 H new ATOM 0 H21 DG B 22 0.370 5.584 5.603 1.00 0.22 H new ATOM 0 H22 DG B 22 1.756 4.488 5.637 1.00 0.22 H new ATOM 692 P DA B 23 -6.885 5.698 3.972 1.00 0.31 P ATOM 693 OP1 DA B 23 -7.373 7.087 3.811 1.00 0.44 O ATOM 694 OP2 DA B 23 -7.624 4.580 3.343 1.00 0.33 O ATOM 695 O5' DA B 23 -5.356 5.636 3.473 1.00 0.37 O ATOM 696 C5' DA B 23 -4.473 6.746 3.674 1.00 0.39 C ATOM 697 C4' DA B 23 -3.292 6.692 2.723 1.00 0.32 C ATOM 698 O4' DA B 23 -2.349 5.684 3.158 1.00 0.32 O ATOM 699 C3' DA B 23 -3.776 6.249 1.347 1.00 0.30 C ATOM 700 O3' DA B 23 -3.324 7.150 0.326 1.00 0.27 O ATOM 701 C2' DA B 23 -3.214 4.875 1.191 1.00 0.28 C ATOM 702 C1' DA B 23 -2.013 4.879 2.012 1.00 0.27 C ATOM 703 N9 DA B 23 -1.671 3.517 2.407 1.00 0.27 N ATOM 704 C8 DA B 23 -2.508 2.501 2.594 1.00 0.28 C ATOM 705 N7 DA B 23 -2.012 1.363 2.954 1.00 0.28 N ATOM 706 C5 DA B 23 -0.647 1.669 3.013 1.00 0.27 C ATOM 707 C6 DA B 23 0.484 0.911 3.336 1.00 0.29 C ATOM 708 N6 DA B 23 0.424 -0.377 3.675 1.00 0.32 N ATOM 709 N1 DA B 23 1.679 1.532 3.293 1.00 0.30 N ATOM 710 C2 DA B 23 1.756 2.820 2.949 1.00 0.30 C ATOM 711 N3 DA B 23 0.751 3.630 2.625 1.00 0.27 N ATOM 712 C4 DA B 23 -0.431 2.986 2.679 1.00 0.26 C ATOM 0 H5' DA B 23 -4.114 6.746 4.703 1.00 0.39 H new ATOM 0 H5'' DA B 23 -5.018 7.678 3.527 1.00 0.39 H new ATOM 0 H4' DA B 23 -2.831 7.679 2.697 1.00 0.32 H new ATOM 0 H3' DA B 23 -4.862 6.251 1.254 1.00 0.30 H new ATOM 0 H2' DA B 23 -3.921 4.116 1.526 1.00 0.28 H new ATOM 0 H2'' DA B 23 -2.982 4.657 0.149 1.00 0.28 H new ATOM 0 H1' DA B 23 -1.146 5.276 1.484 1.00 0.27 H new ATOM 0 H8 DA B 23 -3.571 2.623 2.449 1.00 0.28 H new ATOM 0 H61 DA B 23 1.279 -0.885 3.902 1.00 0.32 H new ATOM 0 H62 DA B 23 -0.477 -0.854 3.708 1.00 0.32 H new ATOM 0 H2 DA B 23 2.745 3.253 2.932 1.00 0.30 H new ATOM 724 P DG B 24 -3.793 6.999 -1.210 1.00 0.29 P ATOM 725 OP1 DG B 24 -4.472 8.251 -1.613 1.00 0.34 O ATOM 726 OP2 DG B 24 -4.483 5.699 -1.369 1.00 0.34 O ATOM 727 O5' DG B 24 -2.383 6.919 -1.982 1.00 0.24 O ATOM 728 C5' DG B 24 -1.335 7.844 -1.668 1.00 0.20 C ATOM 729 C4' DG B 24 0.027 7.222 -1.883 1.00 0.18 C ATOM 730 O4' DG B 24 0.169 6.118 -0.974 1.00 0.17 O ATOM 731 C3' DG B 24 0.108 6.657 -3.293 1.00 0.24 C ATOM 732 O3' DG B 24 1.100 7.343 -4.066 1.00 0.33 O ATOM 733 C2' DG B 24 0.477 5.213 -3.095 1.00 0.23 C ATOM 734 C1' DG B 24 0.918 5.102 -1.630 1.00 0.19 C ATOM 735 N9 DG B 24 0.542 3.789 -1.091 1.00 0.21 N ATOM 736 C8 DG B 24 -0.696 3.279 -0.894 1.00 0.27 C ATOM 737 N7 DG B 24 -0.783 2.088 -0.409 1.00 0.32 N ATOM 738 C5 DG B 24 0.565 1.746 -0.256 1.00 0.28 C ATOM 739 C6 DG B 24 1.147 0.552 0.236 1.00 0.34 C ATOM 740 O6 DG B 24 0.583 -0.460 0.646 1.00 0.40 O ATOM 741 N1 DG B 24 2.533 0.619 0.222 1.00 0.35 N ATOM 742 C2 DG B 24 3.276 1.700 -0.211 1.00 0.32 C ATOM 743 N2 DG B 24 4.601 1.573 -0.148 1.00 0.40 N ATOM 744 N3 DG B 24 2.735 2.830 -0.677 1.00 0.25 N ATOM 745 C4 DG B 24 1.383 2.786 -0.673 1.00 0.23 C ATOM 0 H5' DG B 24 -1.430 8.167 -0.631 1.00 0.20 H new ATOM 0 H5'' DG B 24 -1.433 8.734 -2.290 1.00 0.20 H new ATOM 0 H4' DG B 24 0.800 7.974 -1.726 1.00 0.18 H new ATOM 0 H3' DG B 24 -0.827 6.773 -3.841 1.00 0.24 H new ATOM 0 H2' DG B 24 -0.371 4.559 -3.301 1.00 0.23 H new ATOM 0 H2'' DG B 24 1.280 4.916 -3.770 1.00 0.23 H new ATOM 0 HO3' DG B 24 1.134 6.961 -4.968 1.00 0.33 H new ATOM 0 H1' DG B 24 1.995 5.210 -1.502 1.00 0.19 H new ATOM 0 H8 DG B 24 -1.580 3.850 -1.135 1.00 0.27 H new ATOM 0 H1 DG B 24 3.045 -0.196 0.559 1.00 0.35 H new ATOM 0 H21 DG B 24 5.202 2.338 -0.454 1.00 0.40 H new ATOM 0 H22 DG B 24 5.014 0.710 0.206 1.00 0.40 H new TER 758 DG B 24 HETATM 759 N3A GIQ A 25 -1.610 -1.795 20.446 1.00 0.15 N HETATM 760 C3A GIQ A 25 -0.652 -2.792 20.514 1.00 0.14 C HETATM 761 C1A GIQ A 25 -1.162 -3.795 21.322 1.00 0.13 C HETATM 762 N1A GIQ A 25 -2.445 -3.438 21.765 1.00 0.14 N HETATM 763 C GIQ A 25 -1.490 -0.563 19.672 1.00 0.17 C HETATM 764 C4A GIQ A 25 0.609 -2.887 19.933 1.00 0.15 C HETATM 765 C5A GIQ A 25 1.340 -4.026 20.188 1.00 0.15 C HETATM 766 C6A GIQ A 25 0.898 -5.035 20.980 1.00 0.14 C HETATM 767 C10 GIQ A 25 -0.361 -4.975 21.585 1.00 0.14 C HETATM 768 N6A GIQ A 25 1.762 -6.060 21.131 1.00 0.15 N HETATM 769 C7A GIQ A 25 1.402 -7.036 21.882 1.00 0.16 C HETATM 770 C8A GIQ A 25 0.174 -7.101 22.527 1.00 0.15 C HETATM 771 C9A GIQ A 25 -0.704 -6.065 22.369 1.00 0.14 C HETATM 772 N10 GIQ A 25 -3.818 -1.385 21.350 1.00 0.16 N HETATM 773 C2A GIQ A 25 -2.681 -2.245 21.215 1.00 0.15 C HETATM 0 H102 GIQ A 25 -4.620 -1.683 21.906 1.00 0.16 H new HETATM 0 H9A GIQ A 25 -1.676 -6.096 22.861 1.00 0.14 H new HETATM 0 H8A GIQ A 25 -0.084 -7.960 23.146 1.00 0.15 H new HETATM 0 H7A GIQ A 25 2.100 -7.861 22.022 1.00 0.16 H new HETATM 0 H5A GIQ A 25 2.324 -4.122 19.730 1.00 0.15 H new HETATM 0 H4A GIQ A 25 1.003 -2.091 19.301 1.00 0.15 H new HETATM 0 H3 GIQ A 25 -0.624 0.001 20.018 1.00 0.17 H new HETATM 0 H2 GIQ A 25 -1.366 -0.807 18.617 1.00 0.17 H new HETATM 0 H1 GIQ A 25 -2.390 0.038 19.802 1.00 0.17 H new