USER MOD reduce.3.24.130724 H: found=0, std=0, add=400, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 401 hydrogens (129 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: B 26 NBU H41 : B 26 NBU C4 : B 27 CCI CAN :(H bumps) USER MOD NoAdj-H: B 26 NBU H12 : B 26 NBU C1 : B 25 CCI O4D :(H bumps) USER MOD NoAdj-H: B 27 CCIHAN1 : B 27 CCI CAN : B 26 NBU C4 :(H bumps) USER MOD Single : A 1 DG O5' : rot 180:sc= 0 USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.107 (180deg=-0.107) USER MOD Single : A 7 DT C7 :methyl 150:sc= -0.587 (180deg=-0.587) USER MOD Single : A 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 12 DC O3' : rot 180:sc= 0 USER MOD Single : B 13 DG O5' : rot 24:sc= 0.166 USER MOD Single : B 22 DT C7 :methyl 150:sc= -0.326 (180deg=-0.326) USER MOD Single : B 24 DC O3' : rot 180:sc= 0 USER MOD Single : B 25 CCI O2D : rot 152:sc= 0.0617 USER MOD Single : B 25 CCI O3A : rot -41:sc= 0.018 USER MOD Single : B 25 CCI O3B : rot 98:sc= 1.14 USER MOD Single : B 27 CCI O2D : rot 137:sc= 1.18 USER MOD Single : B 27 CCI O3A : rot -28:sc=0.000964 USER MOD Single : B 27 CCI O3B : rot 60:sc= 1.02 USER MOD Single : B 27 CCI O4D : rot -30:sc=0.000227 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -7.011 16.248 -3.969 1.00 0.00 O ATOM 2 C5' DG A 1 -8.402 16.429 -3.851 1.00 0.00 C ATOM 3 C4' DG A 1 -9.102 15.072 -3.720 1.00 0.00 C ATOM 4 O4' DG A 1 -9.228 14.410 -4.966 1.00 0.00 O ATOM 5 C3' DG A 1 -8.378 14.077 -2.807 1.00 0.00 C ATOM 6 O3' DG A 1 -7.572 14.619 -1.779 1.00 0.00 O ATOM 7 C2' DG A 1 -7.700 13.131 -3.790 1.00 0.00 C ATOM 8 C1' DG A 1 -8.902 13.054 -4.724 1.00 0.00 C ATOM 9 N9 DG A 1 -8.843 12.216 -5.935 1.00 0.00 N ATOM 10 C8 DG A 1 -7.787 11.822 -6.709 1.00 0.00 C ATOM 11 N7 DG A 1 -8.129 11.110 -7.748 1.00 0.00 N ATOM 12 C5 DG A 1 -9.512 10.970 -7.619 1.00 0.00 C ATOM 13 C6 DG A 1 -10.465 10.244 -8.397 1.00 0.00 C ATOM 14 O6 DG A 1 -10.305 9.707 -9.489 1.00 0.00 O ATOM 15 N1 DG A 1 -11.712 10.171 -7.792 1.00 0.00 N ATOM 16 C2 DG A 1 -12.030 10.790 -6.607 1.00 0.00 C ATOM 17 N2 DG A 1 -13.242 10.619 -6.099 1.00 0.00 N ATOM 18 N3 DG A 1 -11.177 11.548 -5.921 1.00 0.00 N ATOM 19 C4 DG A 1 -9.935 11.583 -6.470 1.00 0.00 C ATOM 0 H5' DG A 1 -8.782 16.960 -4.723 1.00 0.00 H new ATOM 0 H5'' DG A 1 -8.623 17.046 -2.980 1.00 0.00 H new ATOM 0 H4' DG A 1 -10.070 15.338 -3.295 1.00 0.00 H new ATOM 0 H3' DG A 1 -9.071 13.551 -2.150 1.00 0.00 H new ATOM 0 H2' DG A 1 -6.806 13.546 -4.256 1.00 0.00 H new ATOM 0 H2'' DG A 1 -7.417 12.172 -3.355 1.00 0.00 H new ATOM 0 HO5' DG A 1 -6.574 17.121 -4.054 1.00 0.00 H new ATOM 0 H1' DG A 1 -9.684 12.479 -4.228 1.00 0.00 H new ATOM 0 H8 DG A 1 -6.763 12.077 -6.481 1.00 0.00 H new ATOM 0 H1 DG A 1 -12.437 9.624 -8.256 1.00 0.00 H new ATOM 0 H21 DG A 1 -13.495 11.071 -5.220 1.00 0.00 H new ATOM 0 H22 DG A 1 -13.922 10.035 -6.587 1.00 0.00 H new ATOM 32 P DC A 2 -7.226 13.745 -0.452 1.00 0.00 P ATOM 33 OP1 DC A 2 -7.045 14.681 0.677 1.00 0.00 O ATOM 34 OP2 DC A 2 -6.143 12.805 -0.811 1.00 0.00 O ATOM 35 O5' DC A 2 -8.559 12.863 -0.169 1.00 0.00 O ATOM 36 C5' DC A 2 -9.803 13.450 0.178 1.00 0.00 C ATOM 37 C4' DC A 2 -10.968 12.490 -0.141 1.00 0.00 C ATOM 38 O4' DC A 2 -10.856 11.983 -1.466 1.00 0.00 O ATOM 39 C3' DC A 2 -11.045 11.296 0.818 1.00 0.00 C ATOM 40 O3' DC A 2 -12.338 11.251 1.399 1.00 0.00 O ATOM 41 C2' DC A 2 -10.782 10.105 -0.102 1.00 0.00 C ATOM 42 C1' DC A 2 -11.151 10.598 -1.496 1.00 0.00 C ATOM 43 N1 DC A 2 -10.332 9.941 -2.556 1.00 0.00 N ATOM 44 C2 DC A 2 -10.933 9.175 -3.559 1.00 0.00 C ATOM 45 O2 DC A 2 -12.122 8.866 -3.505 1.00 0.00 O ATOM 46 N3 DC A 2 -10.180 8.748 -4.620 1.00 0.00 N ATOM 47 C4 DC A 2 -8.872 9.033 -4.665 1.00 0.00 C ATOM 48 N4 DC A 2 -8.171 8.737 -5.751 1.00 0.00 N ATOM 49 C5 DC A 2 -8.219 9.747 -3.619 1.00 0.00 C ATOM 50 C6 DC A 2 -8.985 10.175 -2.594 1.00 0.00 C ATOM 0 H5' DC A 2 -9.935 14.384 -0.368 1.00 0.00 H new ATOM 0 H5'' DC A 2 -9.810 13.698 1.239 1.00 0.00 H new ATOM 0 H4' DC A 2 -11.875 13.084 -0.027 1.00 0.00 H new ATOM 0 H3' DC A 2 -10.343 11.329 1.651 1.00 0.00 H new ATOM 0 H2' DC A 2 -9.738 9.793 -0.056 1.00 0.00 H new ATOM 0 H2'' DC A 2 -11.385 9.243 0.185 1.00 0.00 H new ATOM 0 H1' DC A 2 -12.192 10.375 -1.731 1.00 0.00 H new ATOM 0 H41 DC A 2 -7.175 8.952 -5.789 1.00 0.00 H new ATOM 0 H42 DC A 2 -8.628 8.294 -6.548 1.00 0.00 H new ATOM 0 H5 DC A 2 -7.156 9.937 -3.645 1.00 0.00 H new ATOM 0 H6 DC A 2 -8.522 10.717 -1.782 1.00 0.00 H new ATOM 62 P DA A 3 -12.690 10.303 2.659 1.00 0.00 P ATOM 63 OP1 DA A 3 -13.954 10.781 3.264 1.00 0.00 O ATOM 64 OP2 DA A 3 -11.479 10.166 3.497 1.00 0.00 O ATOM 65 O5' DA A 3 -12.977 8.875 1.972 1.00 0.00 O ATOM 66 C5' DA A 3 -14.180 8.628 1.273 1.00 0.00 C ATOM 67 C4' DA A 3 -14.139 7.243 0.617 1.00 0.00 C ATOM 68 O4' DA A 3 -13.223 7.240 -0.469 1.00 0.00 O ATOM 69 C3' DA A 3 -13.698 6.137 1.589 1.00 0.00 C ATOM 70 O3' DA A 3 -14.642 5.086 1.537 1.00 0.00 O ATOM 71 C2' DA A 3 -12.329 5.753 1.029 1.00 0.00 C ATOM 72 C1' DA A 3 -12.528 6.010 -0.459 1.00 0.00 C ATOM 73 N9 DA A 3 -11.245 6.153 -1.177 1.00 0.00 N ATOM 74 C8 DA A 3 -10.174 6.934 -0.829 1.00 0.00 C ATOM 75 N7 DA A 3 -9.201 6.947 -1.695 1.00 0.00 N ATOM 76 C5 DA A 3 -9.664 6.089 -2.684 1.00 0.00 C ATOM 77 C6 DA A 3 -9.097 5.648 -3.887 1.00 0.00 C ATOM 78 N6 DA A 3 -7.899 6.079 -4.250 1.00 0.00 N ATOM 79 N1 DA A 3 -9.752 4.746 -4.639 1.00 0.00 N ATOM 80 C2 DA A 3 -10.931 4.312 -4.202 1.00 0.00 C ATOM 81 N3 DA A 3 -11.586 4.653 -3.097 1.00 0.00 N ATOM 82 C4 DA A 3 -10.892 5.571 -2.375 1.00 0.00 C ATOM 0 H5' DA A 3 -14.330 9.394 0.512 1.00 0.00 H new ATOM 0 H5'' DA A 3 -15.026 8.689 1.958 1.00 0.00 H new ATOM 0 H4' DA A 3 -15.157 7.039 0.284 1.00 0.00 H new ATOM 0 H3' DA A 3 -13.638 6.416 2.641 1.00 0.00 H new ATOM 0 H2' DA A 3 -11.529 6.363 1.447 1.00 0.00 H new ATOM 0 H2'' DA A 3 -12.078 4.713 1.236 1.00 0.00 H new ATOM 0 H1' DA A 3 -13.048 5.191 -0.955 1.00 0.00 H new ATOM 0 H8 DA A 3 -10.139 7.496 0.093 1.00 0.00 H new ATOM 0 H61 DA A 3 -7.485 5.759 -5.126 1.00 0.00 H new ATOM 0 H62 DA A 3 -7.390 6.732 -3.654 1.00 0.00 H new ATOM 0 H2 DA A 3 -11.423 3.584 -4.830 1.00 0.00 H new ATOM 94 P DC A 4 -14.498 3.752 2.424 1.00 0.00 P ATOM 95 OP1 DC A 4 -15.856 3.260 2.752 1.00 0.00 O ATOM 96 OP2 DC A 4 -13.528 3.998 3.508 1.00 0.00 O ATOM 97 O5' DC A 4 -13.845 2.727 1.374 1.00 0.00 O ATOM 98 C5' DC A 4 -14.581 2.266 0.253 1.00 0.00 C ATOM 99 C4' DC A 4 -13.754 1.238 -0.516 1.00 0.00 C ATOM 100 O4' DC A 4 -12.616 1.864 -1.061 1.00 0.00 O ATOM 101 C3' DC A 4 -13.303 0.081 0.383 1.00 0.00 C ATOM 102 O3' DC A 4 -13.800 -1.131 -0.157 1.00 0.00 O ATOM 103 C2' DC A 4 -11.783 0.225 0.340 1.00 0.00 C ATOM 104 C1' DC A 4 -11.537 0.960 -0.980 1.00 0.00 C ATOM 105 N1 DC A 4 -10.300 1.782 -0.987 1.00 0.00 N ATOM 106 C2 DC A 4 -9.383 1.645 -2.025 1.00 0.00 C ATOM 107 O2 DC A 4 -9.480 0.736 -2.845 1.00 0.00 O ATOM 108 N3 DC A 4 -8.350 2.532 -2.124 1.00 0.00 N ATOM 109 C4 DC A 4 -8.216 3.510 -1.220 1.00 0.00 C ATOM 110 N4 DC A 4 -7.241 4.393 -1.373 1.00 0.00 N ATOM 111 C5 DC A 4 -9.151 3.685 -0.153 1.00 0.00 C ATOM 112 C6 DC A 4 -10.171 2.801 -0.084 1.00 0.00 C ATOM 0 H5' DC A 4 -14.835 3.103 -0.397 1.00 0.00 H new ATOM 0 H5'' DC A 4 -15.520 1.820 0.580 1.00 0.00 H new ATOM 0 H4' DC A 4 -14.384 0.830 -1.306 1.00 0.00 H new ATOM 0 H3' DC A 4 -13.665 0.088 1.411 1.00 0.00 H new ATOM 0 H2' DC A 4 -11.408 0.792 1.192 1.00 0.00 H new ATOM 0 H2'' DC A 4 -11.286 -0.745 0.359 1.00 0.00 H new ATOM 0 H1' DC A 4 -11.443 0.237 -1.790 1.00 0.00 H new ATOM 0 H41 DC A 4 -7.123 5.145 -0.694 1.00 0.00 H new ATOM 0 H42 DC A 4 -6.608 4.321 -2.169 1.00 0.00 H new ATOM 0 H5 DC A 4 -9.047 4.486 0.564 1.00 0.00 H new ATOM 0 H6 DC A 4 -10.903 2.902 0.704 1.00 0.00 H new ATOM 124 P DC A 5 -13.568 -2.558 0.566 1.00 0.00 P ATOM 125 OP1 DC A 5 -14.712 -3.432 0.221 1.00 0.00 O ATOM 126 OP2 DC A 5 -13.237 -2.314 1.987 1.00 0.00 O ATOM 127 O5' DC A 5 -12.253 -3.108 -0.181 1.00 0.00 O ATOM 128 C5' DC A 5 -12.301 -3.480 -1.544 1.00 0.00 C ATOM 129 C4' DC A 5 -10.909 -3.845 -2.062 1.00 0.00 C ATOM 130 O4' DC A 5 -10.097 -2.690 -2.018 1.00 0.00 O ATOM 131 C3' DC A 5 -10.213 -4.950 -1.254 1.00 0.00 C ATOM 132 O3' DC A 5 -10.065 -6.085 -2.090 1.00 0.00 O ATOM 133 C2' DC A 5 -8.892 -4.290 -0.856 1.00 0.00 C ATOM 134 C1' DC A 5 -8.762 -3.087 -1.795 1.00 0.00 C ATOM 135 N1 DC A 5 -8.059 -1.940 -1.164 1.00 0.00 N ATOM 136 C2 DC A 5 -6.948 -1.358 -1.775 1.00 0.00 C ATOM 137 O2 DC A 5 -6.413 -1.854 -2.764 1.00 0.00 O ATOM 138 N3 DC A 5 -6.418 -0.219 -1.239 1.00 0.00 N ATOM 139 C4 DC A 5 -6.959 0.323 -0.139 1.00 0.00 C ATOM 140 N4 DC A 5 -6.425 1.425 0.367 1.00 0.00 N ATOM 141 C5 DC A 5 -8.105 -0.246 0.498 1.00 0.00 C ATOM 142 C6 DC A 5 -8.605 -1.372 -0.049 1.00 0.00 C ATOM 0 H5' DC A 5 -12.709 -2.660 -2.134 1.00 0.00 H new ATOM 0 H5'' DC A 5 -12.974 -4.328 -1.670 1.00 0.00 H new ATOM 0 H4' DC A 5 -11.042 -4.226 -3.075 1.00 0.00 H new ATOM 0 H3' DC A 5 -10.743 -5.311 -0.373 1.00 0.00 H new ATOM 0 H2' DC A 5 -8.904 -3.978 0.188 1.00 0.00 H new ATOM 0 H2'' DC A 5 -8.054 -4.977 -0.974 1.00 0.00 H new ATOM 0 H1' DC A 5 -8.196 -3.358 -2.686 1.00 0.00 H new ATOM 0 H41 DC A 5 -6.826 1.848 1.204 1.00 0.00 H new ATOM 0 H42 DC A 5 -5.613 1.850 -0.080 1.00 0.00 H new ATOM 0 H5 DC A 5 -8.548 0.204 1.374 1.00 0.00 H new ATOM 0 H6 DC A 5 -9.464 -1.839 0.409 1.00 0.00 H new ATOM 154 P DT A 6 -9.381 -7.460 -1.593 1.00 0.00 P ATOM 155 OP1 DT A 6 -9.865 -8.561 -2.453 1.00 0.00 O ATOM 156 OP2 DT A 6 -9.509 -7.550 -0.121 1.00 0.00 O ATOM 157 O5' DT A 6 -7.839 -7.187 -1.955 1.00 0.00 O ATOM 158 C5' DT A 6 -7.441 -6.996 -3.298 1.00 0.00 C ATOM 159 C4' DT A 6 -6.037 -6.402 -3.352 1.00 0.00 C ATOM 160 O4' DT A 6 -5.982 -5.162 -2.669 1.00 0.00 O ATOM 161 C3' DT A 6 -4.952 -7.314 -2.765 1.00 0.00 C ATOM 162 O3' DT A 6 -4.074 -7.691 -3.812 1.00 0.00 O ATOM 163 C2' DT A 6 -4.304 -6.410 -1.722 1.00 0.00 C ATOM 164 C1' DT A 6 -4.668 -5.002 -2.181 1.00 0.00 C ATOM 165 N1 DT A 6 -4.654 -4.009 -1.075 1.00 0.00 N ATOM 166 C2 DT A 6 -3.831 -2.889 -1.165 1.00 0.00 C ATOM 167 O2 DT A 6 -3.017 -2.714 -2.066 1.00 0.00 O ATOM 168 N3 DT A 6 -3.952 -1.964 -0.149 1.00 0.00 N ATOM 169 C4 DT A 6 -4.807 -2.035 0.925 1.00 0.00 C ATOM 170 C5 DT A 6 -5.605 -3.246 0.974 1.00 0.00 C ATOM 171 C6 DT A 6 -5.502 -4.172 -0.010 1.00 0.00 C ATOM 172 O4 DT A 6 -4.867 -1.108 1.729 1.00 0.00 O ATOM 185 C7 DT A 6 -6.535 -3.479 2.148 1.00 0.00 C ATOM 0 H5' DT A 6 -8.144 -6.333 -3.802 1.00 0.00 H new ATOM 0 H5'' DT A 6 -7.462 -7.947 -3.830 1.00 0.00 H new ATOM 0 H4' DT A 6 -5.831 -6.274 -4.415 1.00 0.00 H new ATOM 0 H3' DT A 6 -5.294 -8.249 -2.321 1.00 0.00 H new ATOM 0 H2' DT A 6 -4.686 -6.616 -0.722 1.00 0.00 H new ATOM 0 H2'' DT A 6 -3.224 -6.552 -1.686 1.00 0.00 H new ATOM 0 H1' DT A 6 -3.955 -4.617 -2.910 1.00 0.00 H new ATOM 0 H3 DT A 6 -3.346 -1.145 -0.200 1.00 0.00 H new ATOM 0 H71 DT A 6 -7.390 -4.071 1.823 1.00 0.00 H new ATOM 0 H72 DT A 6 -6.002 -4.013 2.934 1.00 0.00 H new ATOM 0 H73 DT A 6 -6.883 -2.520 2.532 1.00 0.00 H new ATOM 0 H6 DT A 6 -6.106 -5.065 0.046 1.00 0.00 H new ATOM 186 P DT A 7 -2.814 -8.675 -3.594 1.00 0.00 P ATOM 187 OP1 DT A 7 -2.569 -9.396 -4.861 1.00 0.00 O ATOM 188 OP2 DT A 7 -3.011 -9.429 -2.337 1.00 0.00 O ATOM 189 O5' DT A 7 -1.613 -7.626 -3.372 1.00 0.00 O ATOM 190 C5' DT A 7 -1.175 -6.784 -4.421 1.00 0.00 C ATOM 191 C4' DT A 7 -0.089 -5.830 -3.920 1.00 0.00 C ATOM 192 O4' DT A 7 -0.641 -5.017 -2.900 1.00 0.00 O ATOM 193 C3' DT A 7 1.117 -6.578 -3.335 1.00 0.00 C ATOM 194 O3' DT A 7 2.318 -6.058 -3.888 1.00 0.00 O ATOM 195 C2' DT A 7 0.980 -6.290 -1.848 1.00 0.00 C ATOM 196 C1' DT A 7 0.301 -4.920 -1.859 1.00 0.00 C ATOM 197 N1 DT A 7 -0.407 -4.586 -0.593 1.00 0.00 N ATOM 198 C2 DT A 7 -0.209 -3.329 -0.031 1.00 0.00 C ATOM 199 O2 DT A 7 0.618 -2.518 -0.439 1.00 0.00 O ATOM 200 N3 DT A 7 -0.999 -3.021 1.056 1.00 0.00 N ATOM 201 C4 DT A 7 -1.953 -3.823 1.636 1.00 0.00 C ATOM 202 C5 DT A 7 -2.064 -5.140 1.039 1.00 0.00 C ATOM 203 C6 DT A 7 -1.308 -5.466 -0.040 1.00 0.00 C ATOM 204 O4 DT A 7 -2.644 -3.394 2.555 1.00 0.00 O ATOM 217 C7 DT A 7 -3.005 -6.161 1.653 1.00 0.00 C ATOM 0 H5' DT A 7 -2.017 -6.213 -4.813 1.00 0.00 H new ATOM 0 H5'' DT A 7 -0.788 -7.387 -5.242 1.00 0.00 H new ATOM 0 H4' DT A 7 0.256 -5.241 -4.770 1.00 0.00 H new ATOM 0 H3' DT A 7 1.148 -7.647 -3.548 1.00 0.00 H new ATOM 0 H2' DT A 7 0.377 -7.042 -1.339 1.00 0.00 H new ATOM 0 H2'' DT A 7 1.947 -6.264 -1.345 1.00 0.00 H new ATOM 0 H1' DT A 7 1.045 -4.134 -1.984 1.00 0.00 H new ATOM 0 H3 DT A 7 -0.861 -2.101 1.474 1.00 0.00 H new ATOM 0 H71 DT A 7 -3.377 -6.827 0.875 1.00 0.00 H new ATOM 0 H72 DT A 7 -2.471 -6.743 2.404 1.00 0.00 H new ATOM 0 H73 DT A 7 -3.844 -5.647 2.122 1.00 0.00 H new ATOM 0 H6 DT A 7 -1.417 -6.447 -0.478 1.00 0.00 H new ATOM 218 P DC A 8 3.756 -6.745 -3.619 1.00 0.00 P ATOM 219 OP1 DC A 8 4.568 -6.569 -4.848 1.00 0.00 O ATOM 220 OP2 DC A 8 3.537 -8.105 -3.080 1.00 0.00 O ATOM 221 O5' DC A 8 4.401 -5.842 -2.447 1.00 0.00 O ATOM 222 C5' DC A 8 4.924 -4.553 -2.713 1.00 0.00 C ATOM 223 C4' DC A 8 5.391 -3.877 -1.419 1.00 0.00 C ATOM 224 O4' DC A 8 4.277 -3.681 -0.567 1.00 0.00 O ATOM 225 C3' DC A 8 6.444 -4.688 -0.651 1.00 0.00 C ATOM 226 O3' DC A 8 7.580 -3.866 -0.440 1.00 0.00 O ATOM 227 C2' DC A 8 5.707 -5.041 0.637 1.00 0.00 C ATOM 228 C1' DC A 8 4.690 -3.903 0.764 1.00 0.00 C ATOM 229 N1 DC A 8 3.492 -4.265 1.567 1.00 0.00 N ATOM 230 C2 DC A 8 3.066 -3.440 2.607 1.00 0.00 C ATOM 231 O2 DC A 8 3.710 -2.456 2.957 1.00 0.00 O ATOM 232 N3 DC A 8 1.912 -3.747 3.269 1.00 0.00 N ATOM 233 C4 DC A 8 1.202 -4.825 2.922 1.00 0.00 C ATOM 234 N4 DC A 8 0.101 -5.127 3.594 1.00 0.00 N ATOM 235 C5 DC A 8 1.603 -5.677 1.848 1.00 0.00 C ATOM 236 C6 DC A 8 2.747 -5.354 1.208 1.00 0.00 C ATOM 0 H5' DC A 8 4.163 -3.939 -3.195 1.00 0.00 H new ATOM 0 H5'' DC A 8 5.759 -4.631 -3.410 1.00 0.00 H new ATOM 0 H4' DC A 8 5.851 -2.933 -1.712 1.00 0.00 H new ATOM 0 H3' DC A 8 6.819 -5.580 -1.153 1.00 0.00 H new ATOM 0 H2' DC A 8 5.220 -6.014 0.572 1.00 0.00 H new ATOM 0 H2'' DC A 8 6.382 -5.079 1.492 1.00 0.00 H new ATOM 0 H1' DC A 8 5.139 -3.046 1.266 1.00 0.00 H new ATOM 0 H41 DC A 8 -0.446 -5.948 3.335 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.200 -4.538 4.371 1.00 0.00 H new ATOM 0 H5 DC A 8 1.019 -6.539 1.561 1.00 0.00 H new ATOM 0 H6 DC A 8 3.083 -5.973 0.389 1.00 0.00 H new ATOM 248 P DC A 9 8.898 -4.378 0.342 1.00 0.00 P ATOM 249 OP1 DC A 9 10.082 -3.741 -0.275 1.00 0.00 O ATOM 250 OP2 DC A 9 8.835 -5.852 0.461 1.00 0.00 O ATOM 251 O5' DC A 9 8.675 -3.737 1.803 1.00 0.00 O ATOM 252 C5' DC A 9 8.771 -2.338 1.988 1.00 0.00 C ATOM 253 C4' DC A 9 8.399 -1.930 3.415 1.00 0.00 C ATOM 254 O4' DC A 9 7.075 -2.349 3.683 1.00 0.00 O ATOM 255 C3' DC A 9 9.322 -2.539 4.476 1.00 0.00 C ATOM 256 O3' DC A 9 9.933 -1.487 5.204 1.00 0.00 O ATOM 257 C2' DC A 9 8.364 -3.392 5.306 1.00 0.00 C ATOM 258 C1' DC A 9 6.993 -2.773 5.029 1.00 0.00 C ATOM 259 N1 DC A 9 5.902 -3.776 5.131 1.00 0.00 N ATOM 260 C2 DC A 9 4.830 -3.566 5.996 1.00 0.00 C ATOM 261 O2 DC A 9 4.801 -2.627 6.786 1.00 0.00 O ATOM 262 N3 DC A 9 3.795 -4.455 5.993 1.00 0.00 N ATOM 263 C4 DC A 9 3.812 -5.512 5.174 1.00 0.00 C ATOM 264 N4 DC A 9 2.786 -6.354 5.200 1.00 0.00 N ATOM 265 C5 DC A 9 4.898 -5.754 4.277 1.00 0.00 C ATOM 266 C6 DC A 9 5.911 -4.859 4.296 1.00 0.00 C ATOM 0 H5' DC A 9 8.114 -1.831 1.281 1.00 0.00 H new ATOM 0 H5'' DC A 9 9.787 -2.011 1.769 1.00 0.00 H new ATOM 0 H4' DC A 9 8.501 -0.846 3.472 1.00 0.00 H new ATOM 0 H3' DC A 9 10.149 -3.141 4.099 1.00 0.00 H new ATOM 0 H2' DC A 9 8.398 -4.439 5.006 1.00 0.00 H new ATOM 0 H2'' DC A 9 8.613 -3.356 6.367 1.00 0.00 H new ATOM 0 H1' DC A 9 6.769 -1.980 5.743 1.00 0.00 H new ATOM 0 H41 DC A 9 2.778 -7.167 4.584 1.00 0.00 H new ATOM 0 H42 DC A 9 2.006 -6.188 5.836 1.00 0.00 H new ATOM 0 H5 DC A 9 4.909 -6.609 3.617 1.00 0.00 H new ATOM 0 H6 DC A 9 6.751 -5.003 3.633 1.00 0.00 H new ATOM 278 P DT A 10 11.022 -1.750 6.367 1.00 0.00 P ATOM 279 OP1 DT A 10 11.837 -0.526 6.529 1.00 0.00 O ATOM 280 OP2 DT A 10 11.680 -3.052 6.119 1.00 0.00 O ATOM 281 O5' DT A 10 10.077 -1.898 7.661 1.00 0.00 O ATOM 282 C5' DT A 10 9.333 -0.791 8.126 1.00 0.00 C ATOM 283 C4' DT A 10 8.306 -1.226 9.171 1.00 0.00 C ATOM 284 O4' DT A 10 7.369 -2.141 8.627 1.00 0.00 O ATOM 285 C3' DT A 10 8.911 -1.865 10.431 1.00 0.00 C ATOM 286 O3' DT A 10 8.555 -1.079 11.555 1.00 0.00 O ATOM 287 C2' DT A 10 8.242 -3.237 10.440 1.00 0.00 C ATOM 288 C1' DT A 10 6.946 -2.977 9.681 1.00 0.00 C ATOM 289 N1 DT A 10 6.325 -4.221 9.158 1.00 0.00 N ATOM 290 C2 DT A 10 5.010 -4.521 9.508 1.00 0.00 C ATOM 291 O2 DT A 10 4.347 -3.853 10.295 1.00 0.00 O ATOM 292 N3 DT A 10 4.462 -5.645 8.926 1.00 0.00 N ATOM 293 C4 DT A 10 5.107 -6.505 8.065 1.00 0.00 C ATOM 294 C5 DT A 10 6.482 -6.148 7.766 1.00 0.00 C ATOM 295 C6 DT A 10 7.034 -5.039 8.315 1.00 0.00 C ATOM 296 O4 DT A 10 4.502 -7.458 7.586 1.00 0.00 O ATOM 309 C7 DT A 10 7.302 -7.029 6.844 1.00 0.00 C ATOM 0 H5' DT A 10 8.826 -0.311 7.289 1.00 0.00 H new ATOM 0 H5'' DT A 10 10.006 -0.050 8.558 1.00 0.00 H new ATOM 0 H4' DT A 10 7.821 -0.296 9.467 1.00 0.00 H new ATOM 0 H3' DT A 10 9.998 -1.937 10.452 1.00 0.00 H new ATOM 0 H2' DT A 10 8.856 -3.991 9.948 1.00 0.00 H new ATOM 0 H2'' DT A 10 8.055 -3.590 11.454 1.00 0.00 H new ATOM 0 H1' DT A 10 6.175 -2.540 10.315 1.00 0.00 H new ATOM 0 H3 DT A 10 3.491 -5.859 9.154 1.00 0.00 H new ATOM 0 H71 DT A 10 8.035 -6.420 6.316 1.00 0.00 H new ATOM 0 H72 DT A 10 7.817 -7.790 7.431 1.00 0.00 H new ATOM 0 H73 DT A 10 6.644 -7.512 6.122 1.00 0.00 H new ATOM 0 H6 DT A 10 8.060 -4.792 8.083 1.00 0.00 H new ATOM 310 P DG A 11 9.034 -1.441 13.052 1.00 0.00 P ATOM 311 OP1 DG A 11 9.123 -0.182 13.822 1.00 0.00 O ATOM 312 OP2 DG A 11 10.206 -2.341 12.968 1.00 0.00 O ATOM 313 O5' DG A 11 7.787 -2.293 13.622 1.00 0.00 O ATOM 314 C5' DG A 11 6.553 -1.666 13.932 1.00 0.00 C ATOM 315 C4' DG A 11 5.568 -2.664 14.550 1.00 0.00 C ATOM 316 O4' DG A 11 5.153 -3.605 13.571 1.00 0.00 O ATOM 317 C3' DG A 11 6.196 -3.444 15.713 1.00 0.00 C ATOM 318 O3' DG A 11 5.285 -3.471 16.798 1.00 0.00 O ATOM 319 C2' DG A 11 6.398 -4.815 15.074 1.00 0.00 C ATOM 320 C1' DG A 11 5.191 -4.895 14.147 1.00 0.00 C ATOM 321 N9 DG A 11 5.345 -5.909 13.080 1.00 0.00 N ATOM 322 C8 DG A 11 6.411 -6.082 12.242 1.00 0.00 C ATOM 323 N7 DG A 11 6.241 -6.991 11.326 1.00 0.00 N ATOM 324 C5 DG A 11 4.963 -7.481 11.590 1.00 0.00 C ATOM 325 C6 DG A 11 4.223 -8.523 10.954 1.00 0.00 C ATOM 326 O6 DG A 11 4.545 -9.194 9.978 1.00 0.00 O ATOM 327 N1 DG A 11 3.009 -8.779 11.568 1.00 0.00 N ATOM 328 C2 DG A 11 2.551 -8.113 12.677 1.00 0.00 C ATOM 329 N2 DG A 11 1.366 -8.459 13.165 1.00 0.00 N ATOM 330 N3 DG A 11 3.228 -7.129 13.279 1.00 0.00 N ATOM 331 C4 DG A 11 4.422 -6.854 12.686 1.00 0.00 C ATOM 0 H5' DG A 11 6.122 -1.237 13.027 1.00 0.00 H new ATOM 0 H5'' DG A 11 6.724 -0.842 14.625 1.00 0.00 H new ATOM 0 H4' DG A 11 4.723 -2.086 14.923 1.00 0.00 H new ATOM 0 H3' DG A 11 7.118 -3.034 16.125 1.00 0.00 H new ATOM 0 H2' DG A 11 7.340 -4.879 14.529 1.00 0.00 H new ATOM 0 H2'' DG A 11 6.402 -5.616 15.813 1.00 0.00 H new ATOM 0 H1' DG A 11 4.290 -5.186 14.687 1.00 0.00 H new ATOM 0 H8 DG A 11 7.322 -5.510 12.333 1.00 0.00 H new ATOM 0 H1 DG A 11 2.417 -9.509 11.171 1.00 0.00 H new ATOM 0 H21 DG A 11 0.995 -7.985 13.988 1.00 0.00 H new ATOM 0 H22 DG A 11 0.826 -9.199 12.717 1.00 0.00 H new ATOM 343 P DC A 12 5.688 -4.065 18.245 1.00 0.00 P ATOM 344 OP1 DC A 12 5.028 -3.247 19.286 1.00 0.00 O ATOM 345 OP2 DC A 12 7.152 -4.269 18.288 1.00 0.00 O ATOM 346 O5' DC A 12 4.986 -5.513 18.224 1.00 0.00 O ATOM 347 C5' DC A 12 3.586 -5.647 18.389 1.00 0.00 C ATOM 348 C4' DC A 12 3.171 -7.108 18.204 1.00 0.00 C ATOM 349 O4' DC A 12 3.523 -7.531 16.904 1.00 0.00 O ATOM 350 C3' DC A 12 3.849 -8.070 19.191 1.00 0.00 C ATOM 351 O3' DC A 12 2.902 -8.663 20.052 1.00 0.00 O ATOM 352 C2' DC A 12 4.486 -9.138 18.308 1.00 0.00 C ATOM 353 C1' DC A 12 3.819 -8.907 16.951 1.00 0.00 C ATOM 354 N1 DC A 12 4.739 -9.216 15.829 1.00 0.00 N ATOM 355 C2 DC A 12 4.410 -10.221 14.929 1.00 0.00 C ATOM 356 O2 DC A 12 3.438 -10.947 15.121 1.00 0.00 O ATOM 357 N3 DC A 12 5.179 -10.404 13.817 1.00 0.00 N ATOM 358 C4 DC A 12 6.260 -9.641 13.620 1.00 0.00 C ATOM 359 N4 DC A 12 6.935 -9.795 12.487 1.00 0.00 N ATOM 360 C5 DC A 12 6.642 -8.618 14.546 1.00 0.00 C ATOM 361 C6 DC A 12 5.851 -8.447 15.629 1.00 0.00 C ATOM 0 H5' DC A 12 3.065 -5.019 17.666 1.00 0.00 H new ATOM 0 H5'' DC A 12 3.294 -5.301 19.381 1.00 0.00 H new ATOM 0 H4' DC A 12 2.096 -7.140 18.380 1.00 0.00 H new ATOM 0 H3' DC A 12 4.571 -7.556 19.826 1.00 0.00 H new ATOM 0 H2' DC A 12 5.568 -9.021 18.251 1.00 0.00 H new ATOM 0 H2'' DC A 12 4.293 -10.142 18.686 1.00 0.00 H new ATOM 0 HO3' DC A 12 3.358 -9.272 20.670 1.00 0.00 H new ATOM 0 H1' DC A 12 2.942 -9.547 16.850 1.00 0.00 H new ATOM 0 H41 DC A 12 7.764 -9.229 12.306 1.00 0.00 H new ATOM 0 H42 DC A 12 6.625 -10.480 11.798 1.00 0.00 H new ATOM 0 H5 DC A 12 7.521 -8.011 14.387 1.00 0.00 H new ATOM 0 H6 DC A 12 6.103 -7.686 16.352 1.00 0.00 H new TER 374 DC A 12 ATOM 375 O5' DG B 13 0.791 -17.765 6.985 1.00 0.00 O ATOM 376 C5' DG B 13 -0.188 -17.725 7.998 1.00 0.00 C ATOM 377 C4' DG B 13 -0.212 -16.307 8.574 1.00 0.00 C ATOM 378 O4' DG B 13 1.113 -15.886 8.837 1.00 0.00 O ATOM 379 C3' DG B 13 -0.842 -15.225 7.693 1.00 0.00 C ATOM 380 O3' DG B 13 -1.824 -15.629 6.760 1.00 0.00 O ATOM 381 C2' DG B 13 0.366 -14.458 7.179 1.00 0.00 C ATOM 382 C1' DG B 13 1.135 -14.519 8.498 1.00 0.00 C ATOM 383 N9 DG B 13 2.451 -13.860 8.631 1.00 0.00 N ATOM 384 C8 DG B 13 3.407 -13.545 7.704 1.00 0.00 C ATOM 385 N7 DG B 13 4.460 -12.957 8.205 1.00 0.00 N ATOM 386 C5 DG B 13 4.156 -12.820 9.559 1.00 0.00 C ATOM 387 C6 DG B 13 4.864 -12.184 10.626 1.00 0.00 C ATOM 388 O6 DG B 13 6.014 -11.754 10.632 1.00 0.00 O ATOM 389 N1 DG B 13 4.100 -12.068 11.782 1.00 0.00 N ATOM 390 C2 DG B 13 2.831 -12.575 11.920 1.00 0.00 C ATOM 391 N2 DG B 13 2.185 -12.394 13.061 1.00 0.00 N ATOM 392 N3 DG B 13 2.194 -13.245 10.960 1.00 0.00 N ATOM 393 C4 DG B 13 2.903 -13.319 9.806 1.00 0.00 C ATOM 0 H5' DG B 13 0.041 -18.450 8.779 1.00 0.00 H new ATOM 0 H5'' DG B 13 -1.165 -17.989 7.595 1.00 0.00 H new ATOM 0 H4' DG B 13 -0.838 -16.397 9.461 1.00 0.00 H new ATOM 0 H3' DG B 13 -1.519 -14.579 8.252 1.00 0.00 H new ATOM 0 H2' DG B 13 0.877 -14.950 6.351 1.00 0.00 H new ATOM 0 H2'' DG B 13 0.135 -13.444 6.854 1.00 0.00 H new ATOM 0 HO5' DG B 13 1.453 -17.060 7.142 1.00 0.00 H new ATOM 0 H1' DG B 13 0.635 -13.867 9.214 1.00 0.00 H new ATOM 0 H8 DG B 13 3.300 -13.763 6.652 1.00 0.00 H new ATOM 0 H1 DG B 13 4.507 -11.576 12.577 1.00 0.00 H new ATOM 0 H21 DG B 13 1.242 -12.765 13.178 1.00 0.00 H new ATOM 0 H22 DG B 13 2.630 -11.884 13.824 1.00 0.00 H new ATOM 406 P DC B 14 -2.915 -14.571 6.188 1.00 0.00 P ATOM 407 OP1 DC B 14 -4.102 -15.333 5.738 1.00 0.00 O ATOM 408 OP2 DC B 14 -2.221 -13.663 5.250 1.00 0.00 O ATOM 409 O5' DC B 14 -3.342 -13.691 7.487 1.00 0.00 O ATOM 410 C5' DC B 14 -3.970 -14.271 8.619 1.00 0.00 C ATOM 411 C4' DC B 14 -3.762 -13.389 9.864 1.00 0.00 C ATOM 412 O4' DC B 14 -2.385 -13.075 10.012 1.00 0.00 O ATOM 413 C3' DC B 14 -4.546 -12.069 9.825 1.00 0.00 C ATOM 414 O3' DC B 14 -5.305 -11.951 11.019 1.00 0.00 O ATOM 415 C2' DC B 14 -3.450 -11.012 9.743 1.00 0.00 C ATOM 416 C1' DC B 14 -2.223 -11.704 10.331 1.00 0.00 C ATOM 417 N1 DC B 14 -0.954 -11.206 9.729 1.00 0.00 N ATOM 418 C2 DC B 14 0.035 -10.633 10.533 1.00 0.00 C ATOM 419 O2 DC B 14 -0.165 -10.390 11.721 1.00 0.00 O ATOM 420 N3 DC B 14 1.256 -10.343 9.991 1.00 0.00 N ATOM 421 C4 DC B 14 1.483 -10.581 8.695 1.00 0.00 C ATOM 422 N4 DC B 14 2.708 -10.430 8.208 1.00 0.00 N ATOM 423 C5 DC B 14 0.471 -11.104 7.836 1.00 0.00 C ATOM 424 C6 DC B 14 -0.725 -11.394 8.393 1.00 0.00 C ATOM 0 H5' DC B 14 -3.562 -15.266 8.799 1.00 0.00 H new ATOM 0 H5'' DC B 14 -5.036 -14.394 8.427 1.00 0.00 H new ATOM 0 H4' DC B 14 -4.135 -13.974 10.705 1.00 0.00 H new ATOM 0 H3' DC B 14 -5.252 -11.984 8.999 1.00 0.00 H new ATOM 0 H2' DC B 14 -3.276 -10.697 8.714 1.00 0.00 H new ATOM 0 H2'' DC B 14 -3.714 -10.119 10.309 1.00 0.00 H new ATOM 0 H1' DC B 14 -2.153 -11.514 11.402 1.00 0.00 H new ATOM 0 H41 DC B 14 2.890 -10.609 7.221 1.00 0.00 H new ATOM 0 H42 DC B 14 3.468 -10.134 8.821 1.00 0.00 H new ATOM 0 H5 DC B 14 0.654 -11.262 6.783 1.00 0.00 H new ATOM 0 H6 DC B 14 -1.517 -11.783 7.771 1.00 0.00 H new ATOM 436 P DA B 15 -6.463 -10.838 11.212 1.00 0.00 P ATOM 437 OP1 DA B 15 -7.310 -11.252 12.352 1.00 0.00 O ATOM 438 OP2 DA B 15 -7.085 -10.579 9.894 1.00 0.00 O ATOM 439 O5' DA B 15 -5.645 -9.516 11.645 1.00 0.00 O ATOM 440 C5' DA B 15 -5.151 -9.351 12.962 1.00 0.00 C ATOM 441 C4' DA B 15 -4.349 -8.048 13.088 1.00 0.00 C ATOM 442 O4' DA B 15 -3.144 -8.147 12.347 1.00 0.00 O ATOM 443 C3' DA B 15 -5.116 -6.827 12.558 1.00 0.00 C ATOM 444 O3' DA B 15 -5.155 -5.833 13.568 1.00 0.00 O ATOM 445 C2' DA B 15 -4.280 -6.404 11.353 1.00 0.00 C ATOM 446 C1' DA B 15 -2.890 -6.894 11.743 1.00 0.00 C ATOM 447 N9 DA B 15 -2.000 -7.109 10.584 1.00 0.00 N ATOM 448 C8 DA B 15 -2.247 -7.873 9.474 1.00 0.00 C ATOM 449 N7 DA B 15 -1.212 -8.077 8.707 1.00 0.00 N ATOM 450 C5 DA B 15 -0.218 -7.337 9.335 1.00 0.00 C ATOM 451 C6 DA B 15 1.124 -7.091 9.016 1.00 0.00 C ATOM 452 N6 DA B 15 1.676 -7.599 7.920 1.00 0.00 N ATOM 453 N1 DA B 15 1.848 -6.274 9.797 1.00 0.00 N ATOM 454 C2 DA B 15 1.264 -5.733 10.864 1.00 0.00 C ATOM 455 N3 DA B 15 0.017 -5.899 11.289 1.00 0.00 N ATOM 456 C4 DA B 15 -0.687 -6.718 10.462 1.00 0.00 C ATOM 0 H5' DA B 15 -4.519 -10.199 13.226 1.00 0.00 H new ATOM 0 H5'' DA B 15 -5.982 -9.341 13.668 1.00 0.00 H new ATOM 0 H4' DA B 15 -4.156 -7.909 14.152 1.00 0.00 H new ATOM 0 H3' DA B 15 -6.155 -7.014 12.285 1.00 0.00 H new ATOM 0 H2' DA B 15 -4.631 -6.866 10.430 1.00 0.00 H new ATOM 0 H2'' DA B 15 -4.304 -5.325 11.198 1.00 0.00 H new ATOM 0 H1' DA B 15 -2.386 -6.162 12.375 1.00 0.00 H new ATOM 0 H8 DA B 15 -3.224 -8.276 9.251 1.00 0.00 H new ATOM 0 H61 DA B 15 2.655 -7.408 7.706 1.00 0.00 H new ATOM 0 H62 DA B 15 1.121 -8.181 7.292 1.00 0.00 H new ATOM 0 H2 DA B 15 1.882 -5.077 11.459 1.00 0.00 H new ATOM 468 P DG B 16 -6.032 -4.484 13.421 1.00 0.00 P ATOM 469 OP1 DG B 16 -6.432 -4.044 14.775 1.00 0.00 O ATOM 470 OP2 DG B 16 -7.066 -4.701 12.385 1.00 0.00 O ATOM 471 O5' DG B 16 -4.958 -3.431 12.844 1.00 0.00 O ATOM 472 C5' DG B 16 -4.004 -2.822 13.694 1.00 0.00 C ATOM 473 C4' DG B 16 -3.060 -1.927 12.886 1.00 0.00 C ATOM 474 O4' DG B 16 -2.262 -2.724 12.027 1.00 0.00 O ATOM 475 C3' DG B 16 -3.805 -0.902 12.016 1.00 0.00 C ATOM 476 O3' DG B 16 -3.344 0.401 12.326 1.00 0.00 O ATOM 477 C2' DG B 16 -3.423 -1.336 10.605 1.00 0.00 C ATOM 478 C1' DG B 16 -2.072 -2.007 10.827 1.00 0.00 C ATOM 479 N9 DG B 16 -1.712 -2.937 9.734 1.00 0.00 N ATOM 480 C8 DG B 16 -2.474 -3.946 9.207 1.00 0.00 C ATOM 481 N7 DG B 16 -1.870 -4.666 8.307 1.00 0.00 N ATOM 482 C5 DG B 16 -0.614 -4.078 8.210 1.00 0.00 C ATOM 483 C6 DG B 16 0.491 -4.407 7.373 1.00 0.00 C ATOM 484 O6 DG B 16 0.544 -5.270 6.503 1.00 0.00 O ATOM 485 N1 DG B 16 1.601 -3.614 7.607 1.00 0.00 N ATOM 486 C2 DG B 16 1.630 -2.574 8.504 1.00 0.00 C ATOM 487 N2 DG B 16 2.726 -1.829 8.566 1.00 0.00 N ATOM 488 N3 DG B 16 0.585 -2.226 9.263 1.00 0.00 N ATOM 489 C4 DG B 16 -0.502 -3.023 9.082 1.00 0.00 C ATOM 0 H5' DG B 16 -3.431 -3.589 14.215 1.00 0.00 H new ATOM 0 H5'' DG B 16 -4.512 -2.231 14.456 1.00 0.00 H new ATOM 0 H4' DG B 16 -2.453 -1.386 13.612 1.00 0.00 H new ATOM 0 H3' DG B 16 -4.885 -0.870 12.159 1.00 0.00 H new ATOM 0 H2' DG B 16 -4.154 -2.024 10.179 1.00 0.00 H new ATOM 0 H2'' DG B 16 -3.349 -0.488 9.924 1.00 0.00 H new ATOM 0 H1' DG B 16 -1.261 -1.280 10.862 1.00 0.00 H new ATOM 0 H8 DG B 16 -3.493 -4.129 9.514 1.00 0.00 H new ATOM 0 H1 DG B 16 2.451 -3.814 7.080 1.00 0.00 H new ATOM 0 H21 DG B 16 2.777 -1.050 9.222 1.00 0.00 H new ATOM 0 H22 DG B 16 3.518 -2.035 7.957 1.00 0.00 H new ATOM 501 P DG B 17 -4.015 1.728 11.693 1.00 0.00 P ATOM 502 OP1 DG B 17 -4.217 2.711 12.779 1.00 0.00 O ATOM 503 OP2 DG B 17 -5.158 1.329 10.842 1.00 0.00 O ATOM 504 O5' DG B 17 -2.843 2.269 10.731 1.00 0.00 O ATOM 505 C5' DG B 17 -1.665 2.829 11.280 1.00 0.00 C ATOM 506 C4' DG B 17 -0.650 3.163 10.184 1.00 0.00 C ATOM 507 O4' DG B 17 -0.287 1.974 9.500 1.00 0.00 O ATOM 508 C3' DG B 17 -1.157 4.183 9.162 1.00 0.00 C ATOM 509 O3' DG B 17 -0.118 5.123 8.926 1.00 0.00 O ATOM 510 C2' DG B 17 -1.454 3.286 7.968 1.00 0.00 C ATOM 511 C1' DG B 17 -0.404 2.181 8.107 1.00 0.00 C ATOM 512 N9 DG B 17 -0.828 0.920 7.450 1.00 0.00 N ATOM 513 C8 DG B 17 -2.042 0.293 7.557 1.00 0.00 C ATOM 514 N7 DG B 17 -2.127 -0.842 6.925 1.00 0.00 N ATOM 515 C5 DG B 17 -0.874 -0.981 6.342 1.00 0.00 C ATOM 516 C6 DG B 17 -0.367 -2.017 5.503 1.00 0.00 C ATOM 517 O6 DG B 17 -0.945 -3.028 5.118 1.00 0.00 O ATOM 518 N1 DG B 17 0.942 -1.800 5.114 1.00 0.00 N ATOM 519 C2 DG B 17 1.685 -0.706 5.475 1.00 0.00 C ATOM 520 N2 DG B 17 2.918 -0.633 4.988 1.00 0.00 N ATOM 521 N3 DG B 17 1.221 0.285 6.247 1.00 0.00 N ATOM 522 C4 DG B 17 -0.065 0.088 6.656 1.00 0.00 C ATOM 0 H5' DG B 17 -1.222 2.129 11.989 1.00 0.00 H new ATOM 0 H5'' DG B 17 -1.914 3.732 11.837 1.00 0.00 H new ATOM 0 H4' DG B 17 0.205 3.614 10.687 1.00 0.00 H new ATOM 0 H3' DG B 17 -2.026 4.778 9.445 1.00 0.00 H new ATOM 0 H2' DG B 17 -2.468 2.888 8.003 1.00 0.00 H new ATOM 0 H2'' DG B 17 -1.355 3.822 7.024 1.00 0.00 H new ATOM 0 H1' DG B 17 0.533 2.470 7.631 1.00 0.00 H new ATOM 0 H8 DG B 17 -2.864 0.708 8.121 1.00 0.00 H new ATOM 0 H1 DG B 17 1.384 -2.501 4.519 1.00 0.00 H new ATOM 0 H21 DG B 17 3.514 0.160 5.225 1.00 0.00 H new ATOM 0 H22 DG B 17 3.269 -1.370 4.377 1.00 0.00 H new ATOM 534 P DA B 18 -0.247 6.312 7.839 1.00 0.00 P ATOM 535 OP1 DA B 18 0.446 7.508 8.362 1.00 0.00 O ATOM 536 OP2 DA B 18 -1.656 6.409 7.399 1.00 0.00 O ATOM 537 O5' DA B 18 0.622 5.715 6.625 1.00 0.00 O ATOM 538 C5' DA B 18 1.997 5.416 6.780 1.00 0.00 C ATOM 539 C4' DA B 18 2.600 5.001 5.436 1.00 0.00 C ATOM 540 O4' DA B 18 2.017 3.772 5.061 1.00 0.00 O ATOM 541 C3' DA B 18 2.338 6.009 4.309 1.00 0.00 C ATOM 542 O3' DA B 18 3.489 6.061 3.482 1.00 0.00 O ATOM 543 C2' DA B 18 1.151 5.383 3.591 1.00 0.00 C ATOM 544 C1' DA B 18 1.463 3.902 3.774 1.00 0.00 C ATOM 545 N9 DA B 18 0.269 3.040 3.717 1.00 0.00 N ATOM 546 C8 DA B 18 -0.937 3.239 4.339 1.00 0.00 C ATOM 547 N7 DA B 18 -1.744 2.213 4.301 1.00 0.00 N ATOM 548 C5 DA B 18 -1.015 1.271 3.582 1.00 0.00 C ATOM 549 C6 DA B 18 -1.293 -0.048 3.193 1.00 0.00 C ATOM 550 N6 DA B 18 -2.405 -0.688 3.540 1.00 0.00 N ATOM 551 N1 DA B 18 -0.371 -0.717 2.490 1.00 0.00 N ATOM 552 C2 DA B 18 0.775 -0.122 2.191 1.00 0.00 C ATOM 553 N3 DA B 18 1.169 1.109 2.499 1.00 0.00 N ATOM 554 C4 DA B 18 0.208 1.766 3.208 1.00 0.00 C ATOM 0 H5' DA B 18 2.123 4.614 7.507 1.00 0.00 H new ATOM 0 H5'' DA B 18 2.524 6.286 7.171 1.00 0.00 H new ATOM 0 H4' DA B 18 3.680 4.938 5.571 1.00 0.00 H new ATOM 0 H3' DA B 18 2.137 7.032 4.627 1.00 0.00 H new ATOM 0 H2' DA B 18 0.199 5.665 4.041 1.00 0.00 H new ATOM 0 H2'' DA B 18 1.104 5.670 2.540 1.00 0.00 H new ATOM 0 H1' DA B 18 2.126 3.588 2.968 1.00 0.00 H new ATOM 0 H8 DA B 18 -1.198 4.169 4.821 1.00 0.00 H new ATOM 0 H61 DA B 18 -2.559 -1.648 3.230 1.00 0.00 H new ATOM 0 H62 DA B 18 -3.104 -0.219 4.116 1.00 0.00 H new ATOM 0 H2 DA B 18 1.479 -0.714 1.624 1.00 0.00 H new ATOM 566 P DA B 19 3.609 7.043 2.211 1.00 0.00 P ATOM 567 OP1 DA B 19 5.034 7.392 2.032 1.00 0.00 O ATOM 568 OP2 DA B 19 2.599 8.115 2.346 1.00 0.00 O ATOM 569 O5' DA B 19 3.168 6.085 0.990 1.00 0.00 O ATOM 570 C5' DA B 19 4.063 5.140 0.425 1.00 0.00 C ATOM 571 C4' DA B 19 3.427 4.470 -0.791 1.00 0.00 C ATOM 572 O4' DA B 19 2.353 3.654 -0.358 1.00 0.00 O ATOM 573 C3' DA B 19 2.886 5.476 -1.813 1.00 0.00 C ATOM 574 O3' DA B 19 3.400 5.122 -3.084 1.00 0.00 O ATOM 575 C2' DA B 19 1.375 5.291 -1.693 1.00 0.00 C ATOM 576 C1' DA B 19 1.254 3.844 -1.223 1.00 0.00 C ATOM 577 N9 DA B 19 0.011 3.578 -0.469 1.00 0.00 N ATOM 578 C8 DA B 19 -0.567 4.340 0.516 1.00 0.00 C ATOM 579 N7 DA B 19 -1.580 3.776 1.117 1.00 0.00 N ATOM 580 C5 DA B 19 -1.691 2.553 0.464 1.00 0.00 C ATOM 581 C6 DA B 19 -2.558 1.458 0.617 1.00 0.00 C ATOM 582 N6 DA B 19 -3.519 1.436 1.537 1.00 0.00 N ATOM 583 N1 DA B 19 -2.363 0.361 -0.129 1.00 0.00 N ATOM 584 C2 DA B 19 -1.371 0.357 -1.011 1.00 0.00 C ATOM 585 N3 DA B 19 -0.511 1.329 -1.279 1.00 0.00 N ATOM 586 C4 DA B 19 -0.724 2.417 -0.496 1.00 0.00 C ATOM 0 H5' DA B 19 4.325 4.387 1.168 1.00 0.00 H new ATOM 0 H5'' DA B 19 4.989 5.635 0.133 1.00 0.00 H new ATOM 0 H4' DA B 19 4.207 3.887 -1.280 1.00 0.00 H new ATOM 0 H3' DA B 19 3.164 6.519 -1.659 1.00 0.00 H new ATOM 0 H2' DA B 19 0.937 5.988 -0.978 1.00 0.00 H new ATOM 0 H2'' DA B 19 0.870 5.452 -2.645 1.00 0.00 H new ATOM 0 H1' DA B 19 1.236 3.175 -2.084 1.00 0.00 H new ATOM 0 H8 DA B 19 -0.212 5.327 0.773 1.00 0.00 H new ATOM 0 H61 DA B 19 -4.129 0.623 1.618 1.00 0.00 H new ATOM 0 H62 DA B 19 -3.645 2.233 2.161 1.00 0.00 H new ATOM 0 H2 DA B 19 -1.250 -0.552 -1.581 1.00 0.00 H new ATOM 598 P DG B 20 3.141 6.007 -4.408 1.00 0.00 P ATOM 599 OP1 DG B 20 4.421 6.143 -5.137 1.00 0.00 O ATOM 600 OP2 DG B 20 2.364 7.210 -4.041 1.00 0.00 O ATOM 601 O5' DG B 20 2.187 5.014 -5.238 1.00 0.00 O ATOM 602 C5' DG B 20 2.697 3.804 -5.771 1.00 0.00 C ATOM 603 C4' DG B 20 1.564 2.990 -6.397 1.00 0.00 C ATOM 604 O4' DG B 20 0.618 2.660 -5.395 1.00 0.00 O ATOM 605 C3' DG B 20 0.838 3.778 -7.493 1.00 0.00 C ATOM 606 O3' DG B 20 0.724 2.949 -8.636 1.00 0.00 O ATOM 607 C2' DG B 20 -0.505 4.072 -6.828 1.00 0.00 C ATOM 608 C1' DG B 20 -0.683 2.881 -5.887 1.00 0.00 C ATOM 609 N9 DG B 20 -1.574 3.159 -4.734 1.00 0.00 N ATOM 610 C8 DG B 20 -1.529 4.232 -3.882 1.00 0.00 C ATOM 611 N7 DG B 20 -2.331 4.147 -2.859 1.00 0.00 N ATOM 612 C5 DG B 20 -2.981 2.935 -3.059 1.00 0.00 C ATOM 613 C6 DG B 20 -4.000 2.304 -2.285 1.00 0.00 C ATOM 614 O6 DG B 20 -4.537 2.725 -1.268 1.00 0.00 O ATOM 615 N1 DG B 20 -4.379 1.073 -2.790 1.00 0.00 N ATOM 616 C2 DG B 20 -3.850 0.511 -3.925 1.00 0.00 C ATOM 617 N2 DG B 20 -4.325 -0.667 -4.312 1.00 0.00 N ATOM 618 N3 DG B 20 -2.918 1.105 -4.682 1.00 0.00 N ATOM 619 C4 DG B 20 -2.519 2.314 -4.196 1.00 0.00 C ATOM 0 H5' DG B 20 3.180 3.225 -4.984 1.00 0.00 H new ATOM 0 H5'' DG B 20 3.458 4.020 -6.521 1.00 0.00 H new ATOM 0 H4' DG B 20 2.004 2.096 -6.838 1.00 0.00 H new ATOM 0 H3' DG B 20 1.327 4.689 -7.838 1.00 0.00 H new ATOM 0 H2' DG B 20 -0.490 5.017 -6.286 1.00 0.00 H new ATOM 0 H2'' DG B 20 -1.312 4.136 -7.557 1.00 0.00 H new ATOM 0 H1' DG B 20 -1.138 2.043 -6.416 1.00 0.00 H new ATOM 0 H8 DG B 20 -0.881 5.080 -4.046 1.00 0.00 H new ATOM 0 H1 DG B 20 -5.096 0.550 -2.287 1.00 0.00 H new ATOM 0 H21 DG B 20 -3.956 -1.115 -5.151 1.00 0.00 H new ATOM 0 H22 DG B 20 -5.059 -1.124 -3.771 1.00 0.00 H new ATOM 631 P DG B 21 0.146 3.490 -10.042 1.00 0.00 P ATOM 632 OP1 DG B 21 1.030 3.015 -11.129 1.00 0.00 O ATOM 633 OP2 DG B 21 -0.164 4.930 -9.915 1.00 0.00 O ATOM 634 O5' DG B 21 -1.240 2.685 -10.126 1.00 0.00 O ATOM 635 C5' DG B 21 -1.243 1.281 -10.318 1.00 0.00 C ATOM 636 C4' DG B 21 -2.671 0.745 -10.243 1.00 0.00 C ATOM 637 O4' DG B 21 -3.171 0.991 -8.938 1.00 0.00 O ATOM 638 C3' DG B 21 -3.595 1.430 -11.257 1.00 0.00 C ATOM 639 O3' DG B 21 -4.339 0.447 -11.952 1.00 0.00 O ATOM 640 C2' DG B 21 -4.459 2.310 -10.364 1.00 0.00 C ATOM 641 C1' DG B 21 -4.456 1.571 -9.026 1.00 0.00 C ATOM 642 N9 DG B 21 -4.650 2.481 -7.874 1.00 0.00 N ATOM 643 C8 DG B 21 -4.024 3.678 -7.643 1.00 0.00 C ATOM 644 N7 DG B 21 -4.332 4.244 -6.513 1.00 0.00 N ATOM 645 C5 DG B 21 -5.237 3.359 -5.944 1.00 0.00 C ATOM 646 C6 DG B 21 -5.928 3.434 -4.700 1.00 0.00 C ATOM 647 O6 DG B 21 -5.804 4.271 -3.812 1.00 0.00 O ATOM 648 N1 DG B 21 -6.807 2.383 -4.514 1.00 0.00 N ATOM 649 C2 DG B 21 -6.894 1.299 -5.347 1.00 0.00 C ATOM 650 N2 DG B 21 -7.624 0.278 -4.924 1.00 0.00 N ATOM 651 N3 DG B 21 -6.226 1.190 -6.504 1.00 0.00 N ATOM 652 C4 DG B 21 -5.433 2.267 -6.759 1.00 0.00 C ATOM 0 H5' DG B 21 -0.626 0.801 -9.559 1.00 0.00 H new ATOM 0 H5'' DG B 21 -0.805 1.037 -11.286 1.00 0.00 H new ATOM 0 H4' DG B 21 -2.649 -0.320 -10.473 1.00 0.00 H new ATOM 0 H3' DG B 21 -3.092 2.008 -12.033 1.00 0.00 H new ATOM 0 H2' DG B 21 -4.046 3.314 -10.269 1.00 0.00 H new ATOM 0 H2'' DG B 21 -5.468 2.417 -10.761 1.00 0.00 H new ATOM 0 H1' DG B 21 -5.272 0.849 -8.989 1.00 0.00 H new ATOM 0 H8 DG B 21 -3.330 4.117 -8.344 1.00 0.00 H new ATOM 0 H1 DG B 21 -7.429 2.417 -3.706 1.00 0.00 H new ATOM 0 H21 DG B 21 -7.722 -0.554 -5.505 1.00 0.00 H new ATOM 0 H22 DG B 21 -8.088 0.324 -4.017 1.00 0.00 H new ATOM 664 P DT B 22 -5.354 0.828 -13.154 1.00 0.00 P ATOM 665 OP1 DT B 22 -5.321 -0.258 -14.155 1.00 0.00 O ATOM 666 OP2 DT B 22 -5.106 2.229 -13.565 1.00 0.00 O ATOM 667 O5' DT B 22 -6.770 0.778 -12.389 1.00 0.00 O ATOM 668 C5' DT B 22 -7.219 -0.438 -11.827 1.00 0.00 C ATOM 669 C4' DT B 22 -8.532 -0.319 -11.088 1.00 0.00 C ATOM 670 O4' DT B 22 -8.353 0.567 -9.998 1.00 0.00 O ATOM 671 C3' DT B 22 -9.644 0.243 -11.986 1.00 0.00 C ATOM 672 O3' DT B 22 -10.839 -0.491 -11.801 1.00 0.00 O ATOM 673 C2' DT B 22 -9.763 1.672 -11.469 1.00 0.00 C ATOM 674 C1' DT B 22 -9.423 1.480 -9.996 1.00 0.00 C ATOM 675 N1 DT B 22 -8.996 2.724 -9.309 1.00 0.00 N ATOM 676 C2 DT B 22 -9.652 3.111 -8.147 1.00 0.00 C ATOM 677 O2 DT B 22 -10.796 2.778 -7.875 1.00 0.00 O ATOM 678 N3 DT B 22 -8.984 3.967 -7.309 1.00 0.00 N ATOM 679 C4 DT B 22 -7.879 4.709 -7.683 1.00 0.00 C ATOM 680 C5 DT B 22 -7.389 4.447 -9.025 1.00 0.00 C ATOM 681 C6 DT B 22 -7.940 3.460 -9.774 1.00 0.00 C ATOM 682 O4 DT B 22 -7.362 5.494 -6.900 1.00 0.00 O ATOM 695 C7 DT B 22 -6.307 5.336 -9.610 1.00 0.00 C ATOM 0 H5' DT B 22 -6.459 -0.813 -11.141 1.00 0.00 H new ATOM 0 H5'' DT B 22 -7.325 -1.177 -12.621 1.00 0.00 H new ATOM 0 H4' DT B 22 -8.828 -1.314 -10.757 1.00 0.00 H new ATOM 0 H3' DT B 22 -9.442 0.190 -13.056 1.00 0.00 H new ATOM 0 H2' DT B 22 -9.069 2.349 -11.967 1.00 0.00 H new ATOM 0 H2'' DT B 22 -10.764 2.080 -11.611 1.00 0.00 H new ATOM 0 H1' DT B 22 -10.307 1.142 -9.455 1.00 0.00 H new ATOM 0 H3 DT B 22 -9.323 4.062 -6.352 1.00 0.00 H new ATOM 0 H71 DT B 22 -5.700 4.759 -10.308 1.00 0.00 H new ATOM 0 H72 DT B 22 -6.768 6.173 -10.135 1.00 0.00 H new ATOM 0 H73 DT B 22 -5.674 5.715 -8.807 1.00 0.00 H new ATOM 0 H6 DT B 22 -7.539 3.251 -10.755 1.00 0.00 H new ATOM 696 P DG B 23 -12.170 -0.216 -12.671 1.00 0.00 P ATOM 697 OP1 DG B 23 -12.927 -1.481 -12.761 1.00 0.00 O ATOM 698 OP2 DG B 23 -11.786 0.498 -13.909 1.00 0.00 O ATOM 699 O5' DG B 23 -13.009 0.802 -11.742 1.00 0.00 O ATOM 700 C5' DG B 23 -13.725 0.336 -10.614 1.00 0.00 C ATOM 701 C4' DG B 23 -14.446 1.478 -9.894 1.00 0.00 C ATOM 702 O4' DG B 23 -13.498 2.365 -9.318 1.00 0.00 O ATOM 703 C3' DG B 23 -15.343 2.298 -10.836 1.00 0.00 C ATOM 704 O3' DG B 23 -16.618 2.437 -10.234 1.00 0.00 O ATOM 705 C2' DG B 23 -14.583 3.621 -10.899 1.00 0.00 C ATOM 706 C1' DG B 23 -13.952 3.688 -9.509 1.00 0.00 C ATOM 707 N9 DG B 23 -12.791 4.606 -9.424 1.00 0.00 N ATOM 708 C8 DG B 23 -11.730 4.682 -10.290 1.00 0.00 C ATOM 709 N7 DG B 23 -10.771 5.473 -9.902 1.00 0.00 N ATOM 710 C5 DG B 23 -11.230 5.970 -8.686 1.00 0.00 C ATOM 711 C6 DG B 23 -10.609 6.867 -7.767 1.00 0.00 C ATOM 712 O6 DG B 23 -9.503 7.390 -7.855 1.00 0.00 O ATOM 713 N1 DG B 23 -11.390 7.142 -6.660 1.00 0.00 N ATOM 714 C2 DG B 23 -12.626 6.591 -6.439 1.00 0.00 C ATOM 715 N2 DG B 23 -13.263 6.944 -5.326 1.00 0.00 N ATOM 716 N3 DG B 23 -13.214 5.724 -7.274 1.00 0.00 N ATOM 717 C4 DG B 23 -12.465 5.450 -8.379 1.00 0.00 C ATOM 0 H5' DG B 23 -13.039 -0.154 -9.924 1.00 0.00 H new ATOM 0 H5'' DG B 23 -14.452 -0.414 -10.928 1.00 0.00 H new ATOM 0 H4' DG B 23 -15.071 1.014 -9.131 1.00 0.00 H new ATOM 0 H3' DG B 23 -15.522 1.871 -11.823 1.00 0.00 H new ATOM 0 H2' DG B 23 -13.832 3.623 -11.689 1.00 0.00 H new ATOM 0 H2'' DG B 23 -15.247 4.465 -11.087 1.00 0.00 H new ATOM 0 H1' DG B 23 -14.663 4.060 -8.772 1.00 0.00 H new ATOM 0 H8 DG B 23 -11.693 4.131 -11.218 1.00 0.00 H new ATOM 0 H1 DG B 23 -11.025 7.794 -5.966 1.00 0.00 H new ATOM 0 H21 DG B 23 -14.185 6.558 -5.122 1.00 0.00 H new ATOM 0 H22 DG B 23 -12.830 7.601 -4.677 1.00 0.00 H new ATOM 729 P DC B 24 -17.881 3.090 -11.001 1.00 0.00 P ATOM 730 OP1 DC B 24 -19.017 2.148 -10.921 1.00 0.00 O ATOM 731 OP2 DC B 24 -17.437 3.609 -12.314 1.00 0.00 O ATOM 732 O5' DC B 24 -18.198 4.347 -10.050 1.00 0.00 O ATOM 733 C5' DC B 24 -18.679 4.145 -8.734 1.00 0.00 C ATOM 734 C4' DC B 24 -18.521 5.428 -7.915 1.00 0.00 C ATOM 735 O4' DC B 24 -17.165 5.825 -7.991 1.00 0.00 O ATOM 736 C3' DC B 24 -19.383 6.584 -8.439 1.00 0.00 C ATOM 737 O3' DC B 24 -20.073 7.203 -7.372 1.00 0.00 O ATOM 738 C2' DC B 24 -18.371 7.559 -9.014 1.00 0.00 C ATOM 739 C1' DC B 24 -17.110 7.215 -8.219 1.00 0.00 C ATOM 740 N1 DC B 24 -15.860 7.525 -8.963 1.00 0.00 N ATOM 741 C2 DC B 24 -14.891 8.324 -8.363 1.00 0.00 C ATOM 742 O2 DC B 24 -15.082 8.834 -7.262 1.00 0.00 O ATOM 743 N3 DC B 24 -13.709 8.546 -9.010 1.00 0.00 N ATOM 744 C4 DC B 24 -13.495 8.007 -10.215 1.00 0.00 C ATOM 745 N4 DC B 24 -12.304 8.176 -10.775 1.00 0.00 N ATOM 746 C5 DC B 24 -14.472 7.188 -10.860 1.00 0.00 C ATOM 747 C6 DC B 24 -15.629 6.972 -10.193 1.00 0.00 C ATOM 0 H5' DC B 24 -18.131 3.331 -8.259 1.00 0.00 H new ATOM 0 H5'' DC B 24 -19.728 3.849 -8.763 1.00 0.00 H new ATOM 0 H4' DC B 24 -18.842 5.214 -6.896 1.00 0.00 H new ATOM 0 H3' DC B 24 -20.129 6.255 -9.162 1.00 0.00 H new ATOM 0 H2' DC B 24 -18.230 7.416 -10.085 1.00 0.00 H new ATOM 0 H2'' DC B 24 -18.675 8.596 -8.868 1.00 0.00 H new ATOM 0 HO3' DC B 24 -20.618 7.940 -7.719 1.00 0.00 H new ATOM 0 H1' DC B 24 -17.086 7.805 -7.303 1.00 0.00 H new ATOM 0 H41 DC B 24 -12.111 7.777 -11.693 1.00 0.00 H new ATOM 0 H42 DC B 24 -11.581 8.705 -10.287 1.00 0.00 H new ATOM 0 H5 DC B 24 -14.295 6.761 -11.836 1.00 0.00 H new ATOM 0 H6 DC B 24 -16.388 6.348 -10.642 1.00 0.00 H new TER 760 DC B 24 HETATM 761 C1D CCI B 25 -6.022 -4.161 -11.134 1.00 0.00 C HETATM 762 C2D CCI B 25 -5.183 -3.017 -10.577 1.00 0.00 C HETATM 763 C3D CCI B 25 -3.958 -3.598 -9.866 1.00 0.00 C HETATM 764 C4D CCI B 25 -3.163 -4.495 -10.837 1.00 0.00 C HETATM 765 C5D CCI B 25 -4.127 -5.497 -11.510 1.00 0.00 C HETATM 766 C6D CCI B 25 -3.507 -6.323 -12.629 1.00 0.00 C HETATM 767 OCD CCI B 25 -6.407 -5.090 -10.136 1.00 0.00 O HETATM 768 O2D CCI B 25 -4.741 -2.228 -11.660 1.00 0.00 O HETATM 769 O3D CCI B 25 -3.116 -2.577 -9.351 1.00 0.00 O HETATM 770 O4D CCI B 25 -2.208 -5.212 -10.064 1.00 0.00 O HETATM 771 OD CCI B 25 -5.253 -4.856 -12.089 1.00 0.00 O HETATM 772 C7D CCI B 25 -3.591 -2.021 -8.133 1.00 0.00 C HETATM 773 C4C CCI B 25 -7.229 -4.693 -9.036 1.00 0.00 C HETATM 774 C5C CCI B 25 -8.533 -4.270 -9.279 1.00 0.00 C HETATM 775 C6C CCI B 25 -9.206 -3.528 -8.294 1.00 0.00 C HETATM 776 C1C CCI B 25 -8.579 -3.239 -7.055 1.00 0.00 C HETATM 777 C2C CCI B 25 -7.328 -3.853 -6.763 1.00 0.00 C HETATM 778 I CCI B 25 -4.310 -6.443 -7.105 1.00 0.00 I HETATM 779 O5C CCI B 25 -9.119 -4.498 -10.590 1.00 0.00 O HETATM 780 C8C CCI B 25 -9.100 -5.772 -11.218 1.00 0.00 C HETATM 781 O6C CCI B 25 -10.599 -3.233 -8.515 1.00 0.00 O HETATM 782 C9C CCI B 25 -11.000 -2.314 -9.502 1.00 0.00 C HETATM 783 C7C CCI B 25 -6.562 -3.557 -5.487 1.00 0.00 C HETATM 784 CBC CCI B 25 -9.137 -2.284 -6.169 1.00 0.00 C HETATM 785 OBC CCI B 25 -8.947 -2.301 -4.955 1.00 0.00 O HETATM 786 SBC CCI B 25 -10.072 -0.863 -6.706 1.00 0.00 S HETATM 787 C1B CCI B 25 -14.423 -0.049 -5.829 1.00 0.00 C HETATM 788 C2B CCI B 25 -13.428 1.083 -5.458 1.00 0.00 C HETATM 789 C3B CCI B 25 -12.089 0.785 -6.144 1.00 0.00 C HETATM 790 C4B CCI B 25 -11.608 -0.620 -5.760 1.00 0.00 C HETATM 791 C5B CCI B 25 -12.695 -1.648 -6.136 1.00 0.00 C HETATM 792 C6B CCI B 25 -12.349 -3.075 -5.731 1.00 0.00 C HETATM 793 OAB CCI B 25 -15.857 0.075 -5.771 1.00 0.00 O HETATM 794 O3B CCI B 25 -12.306 0.741 -7.541 1.00 0.00 O HETATM 795 OB CCI B 25 -13.925 -1.346 -5.496 1.00 0.00 O HETATM 796 C1A CCI B 25 -19.052 1.320 -2.202 1.00 0.00 C HETATM 797 C2A CCI B 25 -18.210 0.140 -1.678 1.00 0.00 C HETATM 798 C3A CCI B 25 -16.820 0.179 -2.309 1.00 0.00 C HETATM 799 C4A CCI B 25 -16.954 0.219 -3.826 1.00 0.00 C HETATM 800 C5A CCI B 25 -17.722 1.515 -4.179 1.00 0.00 C HETATM 801 C6A CCI B 25 -17.877 1.796 -5.684 1.00 0.00 C HETATM 802 ORA CCI B 25 -20.397 1.138 -1.799 1.00 0.00 O HETATM 803 OEA CCI B 25 -17.989 0.187 -0.271 1.00 0.00 O HETATM 804 O3A CCI B 25 -16.088 -0.975 -1.941 1.00 0.00 O HETATM 805 NAB CCI B 25 -15.640 0.168 -4.436 1.00 0.00 N HETATM 806 OA CCI B 25 -19.020 1.409 -3.621 1.00 0.00 O HETATM 807 CAN CCI B 25 -21.191 2.271 -2.085 1.00 0.00 C HETATM 808 C1E CCI B 25 -19.112 -0.160 0.532 1.00 0.00 C HETATM 809 C2E CCI B 25 -18.598 -0.942 1.750 1.00 0.00 C HETATM 810 C3E CCI B 25 -17.782 -0.023 2.663 1.00 0.00 C HETATM 811 C4E CCI B 25 -18.669 1.159 3.051 1.00 0.00 C HETATM 812 C5E CCI B 25 -19.086 1.880 1.763 1.00 0.00 C HETATM 813 O3E CCI B 25 -17.381 -0.649 3.872 1.00 0.00 O HETATM 814 C6E CCI B 25 -16.366 -1.624 3.700 1.00 0.00 C HETATM 815 N4E CCI B 25 -17.944 2.025 4.005 1.00 0.00 N HETATM 816 C7E CCI B 25 -18.738 3.081 4.677 1.00 0.00 C HETATM 817 C8E CCI B 25 -17.896 3.834 5.717 1.00 0.00 C HETATM 818 OE CCI B 25 -19.834 0.991 0.954 1.00 0.00 O HETATM 819 C3C CCI B 25 -6.677 -4.614 -7.755 1.00 0.00 C HETATM 0 HOD2 CCI B 25 -4.614 -1.303 -11.361 1.00 0.00 H new HETATM 0 HOB3 CCI B 25 -12.062 1.604 -7.937 1.00 0.00 H new HETATM 0 HOA3 CCI B 25 -16.253 -1.180 -0.997 1.00 0.00 H new HETATM 0 HNE2 CCI B 25 -16.949 1.902 4.191 1.00 0.00 H new HETATM 0 HAN3 CCI B 25 -20.792 3.138 -1.558 1.00 0.00 H new HETATM 0 HAN2 CCI B 25 -21.180 2.462 -3.158 1.00 0.00 H new HETATM 0 HAN1 CCI B 25 -22.215 2.089 -1.760 1.00 0.00 H new HETATM 0 H9C3 CCI B 25 -10.567 -1.337 -9.287 1.00 0.00 H new HETATM 0 H9C2 CCI B 25 -10.657 -2.656 -10.478 1.00 0.00 H new HETATM 0 H9C1 CCI B 25 -12.087 -2.236 -9.506 1.00 0.00 H new HETATM 0 H8E3 CCI B 25 -17.540 3.134 6.473 1.00 0.00 H new HETATM 0 H8E2 CCI B 25 -17.043 4.302 5.225 1.00 0.00 H new HETATM 0 H8E1 CCI B 25 -18.506 4.602 6.192 1.00 0.00 H new HETATM 0 H8C3 CCI B 25 -8.068 -6.094 -11.357 1.00 0.00 H new HETATM 0 H8C2 CCI B 25 -9.624 -6.494 -10.592 1.00 0.00 H new HETATM 0 H8C1 CCI B 25 -9.594 -5.707 -12.188 1.00 0.00 H new HETATM 0 H7E2 CCI B 25 -19.116 3.783 3.934 1.00 0.00 H new HETATM 0 H7E1 CCI B 25 -19.605 2.634 5.163 1.00 0.00 H new HETATM 0 H7D3 CCI B 25 -4.577 -1.585 -8.292 1.00 0.00 H new HETATM 0 H7D2 CCI B 25 -3.658 -2.804 -7.378 1.00 0.00 H new HETATM 0 H7D1 CCI B 25 -2.902 -1.247 -7.793 1.00 0.00 H new HETATM 0 H7C3 CCI B 25 -6.293 -4.494 -4.999 1.00 0.00 H new HETATM 0 H7C2 CCI B 25 -5.657 -3.000 -5.727 1.00 0.00 H new HETATM 0 H7C1 CCI B 25 -7.186 -2.965 -4.817 1.00 0.00 H new HETATM 0 H6E3 CCI B 25 -16.724 -2.408 3.032 1.00 0.00 H new HETATM 0 H6E2 CCI B 25 -15.481 -1.156 3.269 1.00 0.00 H new HETATM 0 H6E1 CCI B 25 -16.112 -2.059 4.667 1.00 0.00 H new HETATM 0 H6D3 CCI B 25 -3.145 -5.659 -13.414 1.00 0.00 H new HETATM 0 H6D2 CCI B 25 -2.674 -6.905 -12.233 1.00 0.00 H new HETATM 0 H6D1 CCI B 25 -4.257 -6.998 -13.042 1.00 0.00 H new HETATM 0 H6B3 CCI B 25 -11.427 -3.380 -6.226 1.00 0.00 H new HETATM 0 H6B2 CCI B 25 -12.214 -3.124 -4.650 1.00 0.00 H new HETATM 0 H6B1 CCI B 25 -13.158 -3.743 -6.026 1.00 0.00 H new HETATM 0 H6A3 CCI B 25 -16.891 1.886 -6.141 1.00 0.00 H new HETATM 0 H6A2 CCI B 25 -18.421 0.976 -6.153 1.00 0.00 H new HETATM 0 H6A1 CCI B 25 -18.429 2.725 -5.826 1.00 0.00 H new HETATM 0 H5E2 CCI B 25 -19.681 2.762 2.002 1.00 0.00 H new HETATM 0 H5E1 CCI B 25 -18.204 2.227 1.224 1.00 0.00 H new HETATM 0 H2E2 CCI B 25 -19.438 -1.362 2.302 1.00 0.00 H new HETATM 0 H2E1 CCI B 25 -17.982 -1.779 1.421 1.00 0.00 H new HETATM 0 H2B2 CCI B 25 -13.814 2.050 -5.781 1.00 0.00 H new HETATM 0 H2B1 CCI B 25 -13.298 1.136 -4.377 1.00 0.00 H new HETATM 0 HAB CCI B 25 -14.739 0.196 -3.959 1.00 0.00 H new HETATM 0 H5D CCI B 25 -4.405 -6.150 -10.683 1.00 0.00 H new HETATM 0 H5B CCI B 25 -12.768 -1.583 -7.222 1.00 0.00 H new HETATM 0 H5A CCI B 25 -17.134 2.340 -3.777 1.00 0.00 H new HETATM 0 H4E CCI B 25 -19.577 0.838 3.561 1.00 0.00 H new HETATM 0 H4D CCI B 25 -2.674 -3.898 -11.607 1.00 0.00 H new HETATM 0 H4B CCI B 25 -11.424 -0.742 -4.693 1.00 0.00 H new HETATM 0 H4A CCI B 25 -17.505 -0.640 -4.210 1.00 0.00 H new HETATM 0 H3E CCI B 25 -16.886 0.266 2.114 1.00 0.00 H new HETATM 0 H3D CCI B 25 -4.313 -4.193 -9.024 1.00 0.00 H new HETATM 0 H3B CCI B 25 -11.367 1.547 -5.850 1.00 0.00 H new HETATM 0 H3A CCI B 25 -16.295 1.067 -1.957 1.00 0.00 H new HETATM 0 H2D CCI B 25 -5.771 -2.421 -9.879 1.00 0.00 H new HETATM 0 H2A CCI B 25 -18.775 -0.757 -1.933 1.00 0.00 H new HETATM 0 H1E CCI B 25 -19.801 -0.768 -0.055 1.00 0.00 H new HETATM 0 H1D CCI B 25 -6.924 -3.725 -11.563 1.00 0.00 H new HETATM 0 H1B CCI B 25 -14.411 0.145 -6.902 1.00 0.00 H new HETATM 0 H1A CCI B 25 -18.631 2.237 -1.790 1.00 0.00 H new HETATM 881 C1 NBU B 26 -0.911 -5.283 -10.633 1.00 0.00 C HETATM 882 C2 NBU B 26 -0.061 -4.051 -10.288 1.00 0.00 C HETATM 883 C3 NBU B 26 0.196 -3.914 -8.779 1.00 0.00 C HETATM 884 C4 NBU B 26 1.357 -2.940 -8.526 1.00 0.00 C HETATM 0 H43 NBU B 26 2.259 -3.316 -9.009 1.00 0.00 H new HETATM 0 H42 NBU B 26 1.107 -1.961 -8.936 1.00 0.00 H new HETATM 0 H32 NBU B 26 -0.704 -3.556 -8.280 1.00 0.00 H new HETATM 0 H31 NBU B 26 0.430 -4.889 -8.352 1.00 0.00 H new HETATM 0 H22 NBU B 26 0.893 -4.115 -10.811 1.00 0.00 H new HETATM 0 H21 NBU B 26 -0.564 -3.154 -10.650 1.00 0.00 H new HETATM 0 H13 NBU B 26 -0.398 -6.184 -10.298 1.00 0.00 H new HETATM 0 H11 NBU B 26 -1.062 -5.331 -11.711 1.00 0.00 H new HETATM 893 C1D CCI B 27 4.535 5.823 9.667 1.00 0.00 C HETATM 894 C2D CCI B 27 3.282 5.090 10.154 1.00 0.00 C HETATM 895 C3D CCI B 27 3.509 4.561 11.575 1.00 0.00 C HETATM 896 C4D CCI B 27 3.910 5.728 12.478 1.00 0.00 C HETATM 897 C5D CCI B 27 5.148 6.413 11.882 1.00 0.00 C HETATM 898 C6D CCI B 27 5.565 7.626 12.713 1.00 0.00 C HETATM 899 OCD CCI B 27 5.620 4.929 9.496 1.00 0.00 O HETATM 900 O2D CCI B 27 2.193 5.987 10.149 1.00 0.00 O HETATM 901 O3D CCI B 27 2.348 3.907 12.070 1.00 0.00 O HETATM 902 O4D CCI B 27 4.236 5.238 13.765 1.00 0.00 O HETATM 903 OD CCI B 27 4.891 6.864 10.563 1.00 0.00 O HETATM 904 C7D CCI B 27 2.322 2.518 11.773 1.00 0.00 C HETATM 905 C4C CCI B 27 5.663 4.034 8.362 1.00 0.00 C HETATM 906 C5C CCI B 27 6.022 4.537 7.107 1.00 0.00 C HETATM 907 C6C CCI B 27 6.236 3.661 6.029 1.00 0.00 C HETATM 908 C1C CCI B 27 5.931 2.276 6.149 1.00 0.00 C HETATM 909 C2C CCI B 27 5.588 1.782 7.446 1.00 0.00 C HETATM 910 I CCI B 27 6.176 1.547 11.342 1.00 0.00 I HETATM 911 O5C CCI B 27 6.244 5.961 6.946 1.00 0.00 O HETATM 912 C8C CCI B 27 7.408 6.578 7.456 1.00 0.00 C HETATM 913 O6C CCI B 27 6.966 4.199 4.897 1.00 0.00 O HETATM 914 C9C CCI B 27 6.318 4.916 3.864 1.00 0.00 C HETATM 915 C7C CCI B 27 5.322 0.314 7.719 1.00 0.00 C HETATM 916 CBC CCI B 27 6.021 1.395 5.030 1.00 0.00 C HETATM 917 OBC CCI B 27 5.563 0.256 5.038 1.00 0.00 O HETATM 918 SBC CCI B 27 6.834 1.775 3.481 1.00 0.00 S HETATM 919 C1B CCI B 27 4.695 0.753 -0.502 1.00 0.00 C HETATM 920 C2B CCI B 27 4.151 0.113 0.779 1.00 0.00 C HETATM 921 C3B CCI B 27 4.603 0.775 2.080 1.00 0.00 C HETATM 922 C4B CCI B 27 6.124 0.926 2.034 1.00 0.00 C HETATM 923 C5B CCI B 27 6.494 1.679 0.751 1.00 0.00 C HETATM 924 C6B CCI B 27 7.995 1.961 0.645 1.00 0.00 C HETATM 925 OAB CCI B 27 4.357 -0.288 -1.475 1.00 0.00 O HETATM 926 O3B CCI B 27 3.945 2.009 2.245 1.00 0.00 O HETATM 927 OB CCI B 27 6.113 0.895 -0.367 1.00 0.00 O HETATM 928 C1A CCI B 27 3.284 -1.840 -5.551 1.00 0.00 C HETATM 929 C2A CCI B 27 4.770 -1.431 -5.516 1.00 0.00 C HETATM 930 C3A CCI B 27 5.165 -0.878 -4.142 1.00 0.00 C HETATM 931 C4A CCI B 27 4.177 0.203 -3.701 1.00 0.00 C HETATM 932 C5A CCI B 27 2.774 -0.423 -3.725 1.00 0.00 C HETATM 933 C6A CCI B 27 1.736 0.570 -3.212 1.00 0.00 C HETATM 934 ORA CCI B 27 2.920 -2.119 -6.893 1.00 0.00 O HETATM 935 OEA CCI B 27 5.606 -2.567 -5.712 1.00 0.00 O HETATM 936 O3A CCI B 27 6.473 -0.346 -4.202 1.00 0.00 O HETATM 937 NAB CCI B 27 4.508 0.721 -2.383 1.00 0.00 N HETATM 938 OA CCI B 27 2.459 -0.793 -5.057 1.00 0.00 O HETATM 939 CAN CCI B 27 1.648 -2.740 -7.032 1.00 0.00 C HETATM 940 C1E CCI B 27 6.350 -2.563 -6.921 1.00 0.00 C HETATM 941 C2E CCI B 27 7.530 -3.527 -6.778 1.00 0.00 C HETATM 942 C3E CCI B 27 7.006 -4.950 -6.560 1.00 0.00 C HETATM 943 C4E CCI B 27 6.059 -5.326 -7.699 1.00 0.00 C HETATM 944 C5E CCI B 27 4.976 -4.251 -7.850 1.00 0.00 C HETATM 945 O3E CCI B 27 8.030 -5.935 -6.539 1.00 0.00 O HETATM 946 C6E CCI B 27 8.937 -5.806 -5.458 1.00 0.00 C HETATM 947 N4E CCI B 27 5.519 -6.678 -7.428 1.00 0.00 N HETATM 948 C7E CCI B 27 4.579 -7.255 -8.416 1.00 0.00 C HETATM 949 C8E CCI B 27 3.106 -7.010 -8.050 1.00 0.00 C HETATM 950 OE CCI B 27 5.551 -2.965 -8.017 1.00 0.00 O HETATM 951 C3C CCI B 27 5.578 2.652 8.558 1.00 0.00 C HETATM 0 HOD4 CCI B 27 3.714 4.429 13.949 1.00 0.00 H new HETATM 0 HOD2 CCI B 27 1.404 5.542 9.775 1.00 0.00 H new HETATM 0 HOB3 CCI B 27 2.977 1.861 2.279 1.00 0.00 H new HETATM 0 HOA3 CCI B 27 6.985 -0.814 -4.894 1.00 0.00 H new HETATM 0 HNE2 CCI B 27 5.785 -7.194 -6.590 1.00 0.00 H new HETATM 0 HAN3 CCI B 27 1.646 -3.689 -6.495 1.00 0.00 H new HETATM 0 HAN2 CCI B 27 0.878 -2.088 -6.620 1.00 0.00 H new HETATM 0 H9C3 CCI B 27 5.570 4.278 3.392 1.00 0.00 H new HETATM 0 H9C2 CCI B 27 5.832 5.797 4.282 1.00 0.00 H new HETATM 0 H9C1 CCI B 27 7.052 5.226 3.120 1.00 0.00 H new HETATM 0 H8E3 CCI B 27 2.891 -7.463 -7.082 1.00 0.00 H new HETATM 0 H8E2 CCI B 27 2.917 -5.938 -7.998 1.00 0.00 H new HETATM 0 H8E1 CCI B 27 2.463 -7.455 -8.810 1.00 0.00 H new HETATM 0 H8C3 CCI B 27 7.452 6.435 8.536 1.00 0.00 H new HETATM 0 H8C2 CCI B 27 8.289 6.131 6.995 1.00 0.00 H new HETATM 0 H8C1 CCI B 27 7.383 7.644 7.231 1.00 0.00 H new HETATM 0 H7E2 CCI B 27 4.781 -6.825 -9.397 1.00 0.00 H new HETATM 0 H7E1 CCI B 27 4.755 -8.328 -8.495 1.00 0.00 H new HETATM 0 H7D3 CCI B 27 2.345 2.376 10.692 1.00 0.00 H new HETATM 0 H7D2 CCI B 27 3.190 2.034 12.221 1.00 0.00 H new HETATM 0 H7D1 CCI B 27 1.411 2.076 12.177 1.00 0.00 H new HETATM 0 H7C3 CCI B 27 6.080 -0.073 8.400 1.00 0.00 H new HETATM 0 H7C2 CCI B 27 4.337 0.201 8.171 1.00 0.00 H new HETATM 0 H7C1 CCI B 27 5.358 -0.243 6.783 1.00 0.00 H new HETATM 0 H6E3 CCI B 27 9.429 -4.835 -5.510 1.00 0.00 H new HETATM 0 H6E2 CCI B 27 8.395 -5.889 -4.516 1.00 0.00 H new HETATM 0 H6E1 CCI B 27 9.686 -6.596 -5.516 1.00 0.00 H new HETATM 0 H6D3 CCI B 27 4.748 8.347 12.739 1.00 0.00 H new HETATM 0 H6D2 CCI B 27 5.800 7.308 13.729 1.00 0.00 H new HETATM 0 H6D1 CCI B 27 6.444 8.089 12.265 1.00 0.00 H new HETATM 0 H6B3 CCI B 27 8.312 2.569 1.492 1.00 0.00 H new HETATM 0 H6B2 CCI B 27 8.543 1.019 0.649 1.00 0.00 H new HETATM 0 H6B1 CCI B 27 8.200 2.496 -0.282 1.00 0.00 H new HETATM 0 H6A3 CCI B 27 1.979 0.854 -2.188 1.00 0.00 H new HETATM 0 H6A2 CCI B 27 1.738 1.458 -3.845 1.00 0.00 H new HETATM 0 H6A1 CCI B 27 0.748 0.109 -3.236 1.00 0.00 H new HETATM 0 H5E2 CCI B 27 4.345 -4.484 -8.708 1.00 0.00 H new HETATM 0 H5E1 CCI B 27 4.332 -4.253 -6.970 1.00 0.00 H new HETATM 0 H2E2 CCI B 27 8.153 -3.491 -7.672 1.00 0.00 H new HETATM 0 H2E1 CCI B 27 8.158 -3.227 -5.939 1.00 0.00 H new HETATM 0 H2B2 CCI B 27 3.062 0.130 0.741 1.00 0.00 H new HETATM 0 H2B1 CCI B 27 4.452 -0.934 0.799 1.00 0.00 H new HETATM 0 HAB CCI B 27 4.803 1.675 -2.173 1.00 0.00 H new HETATM 0 H5D CCI B 27 5.946 5.670 11.880 1.00 0.00 H new HETATM 0 H5B CCI B 27 5.971 2.635 0.774 1.00 0.00 H new HETATM 0 H5A CCI B 27 2.763 -1.301 -3.079 1.00 0.00 H new HETATM 0 H4E CCI B 27 6.579 -5.365 -8.656 1.00 0.00 H new HETATM 0 H4D CCI B 27 3.084 6.435 12.552 1.00 0.00 H new HETATM 0 H4B CCI B 27 6.549 -0.078 2.049 1.00 0.00 H new HETATM 0 H4A CCI B 27 4.221 1.056 -4.379 1.00 0.00 H new HETATM 0 H3E CCI B 27 6.513 -4.938 -5.588 1.00 0.00 H new HETATM 0 H3D CCI B 27 4.310 3.822 11.561 1.00 0.00 H new HETATM 0 H3B CCI B 27 4.341 0.163 2.943 1.00 0.00 H new HETATM 0 H3A CCI B 27 5.141 -1.688 -3.413 1.00 0.00 H new HETATM 0 H2D CCI B 27 3.070 4.250 9.493 1.00 0.00 H new HETATM 0 H2A CCI B 27 4.897 -0.684 -6.299 1.00 0.00 H new HETATM 0 H1E CCI B 27 6.702 -1.549 -7.109 1.00 0.00 H new HETATM 0 H1D CCI B 27 4.303 6.263 8.697 1.00 0.00 H new HETATM 0 H1B CCI B 27 4.307 1.739 -0.757 1.00 0.00 H new HETATM 0 H1A CCI B 27 3.145 -2.719 -4.922 1.00 0.00 H new