USER MOD reduce.3.24.130724 H: found=0, std=0, add=184, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 264 hydrogens (80 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : X 1 DG O5' : rot 26:sc= 0.00242 USER MOD Single : X 3 DT C7 :methyl -30:sc= 0 (180deg=-0.5) USER MOD Single : X 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : X 8 DC O3' : rot 180:sc= 0 USER MOD Single : Y 9 DG O5' : rot -18:sc= 0.00605 USER MOD Single : Y 11 DT C7 :methyl -30:sc= -1.41! (180deg=-2.01!) USER MOD Single : Y 13 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : Y 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG X 1 37.101 28.677 15.117 1.00 0.00 O ATOM 2 C5' DG X 1 36.959 28.376 16.504 1.00 0.00 C ATOM 3 C4' DG X 1 35.569 28.810 17.057 1.00 0.00 C ATOM 4 O4' DG X 1 35.592 30.208 16.912 1.00 0.00 O ATOM 5 C3' DG X 1 34.311 28.259 16.263 1.00 0.00 C ATOM 6 O3' DG X 1 33.333 27.530 17.024 1.00 0.00 O ATOM 7 C2' DG X 1 33.709 29.611 15.695 1.00 0.00 C ATOM 8 C1' DG X 1 34.311 30.715 16.605 1.00 0.00 C ATOM 9 N9 DG X 1 34.364 32.085 16.063 1.00 0.00 N ATOM 10 C8 DG X 1 33.850 32.698 14.900 1.00 0.00 C ATOM 11 N7 DG X 1 34.048 33.971 14.932 1.00 0.00 N ATOM 12 C5 DG X 1 34.695 34.270 16.130 1.00 0.00 C ATOM 13 C6 DG X 1 35.069 35.550 16.701 1.00 0.00 C ATOM 14 O6 DG X 1 34.990 36.696 16.250 1.00 0.00 O ATOM 15 N1 DG X 1 35.481 35.437 18.016 1.00 0.00 N ATOM 16 C2 DG X 1 35.702 34.246 18.618 1.00 0.00 C ATOM 17 N2 DG X 1 36.106 34.385 19.829 1.00 0.00 N ATOM 18 N3 DG X 1 35.274 33.061 18.143 1.00 0.00 N ATOM 19 C4 DG X 1 34.810 33.126 16.869 1.00 0.00 C ATOM 0 H5' DG X 1 37.746 28.879 17.066 1.00 0.00 H new ATOM 0 H5'' DG X 1 37.092 27.305 16.658 1.00 0.00 H new ATOM 0 H4' DG X 1 35.447 28.421 18.068 1.00 0.00 H new ATOM 0 H3' DG X 1 34.602 27.504 15.532 1.00 0.00 H new ATOM 0 H2' DG X 1 33.986 29.762 14.652 1.00 0.00 H new ATOM 0 H2'' DG X 1 32.620 29.610 15.739 1.00 0.00 H new ATOM 0 HO5' DG X 1 36.518 29.430 14.884 1.00 0.00 H new ATOM 0 H1' DG X 1 33.662 30.880 17.465 1.00 0.00 H new ATOM 0 H8 DG X 1 33.359 32.173 14.094 1.00 0.00 H new ATOM 0 H1 DG X 1 35.625 36.290 18.556 1.00 0.00 H new ATOM 0 H21 DG X 1 36.309 33.562 20.396 1.00 0.00 H new ATOM 0 H22 DG X 1 36.223 35.318 20.223 1.00 0.00 H new ATOM 32 P DC X 2 33.524 25.963 17.443 1.00 0.00 P ATOM 33 OP1 DC X 2 34.762 25.425 16.848 1.00 0.00 O ATOM 34 OP2 DC X 2 32.266 25.253 17.225 1.00 0.00 O1- ATOM 35 O5' DC X 2 33.666 25.839 19.002 1.00 0.00 O ATOM 36 C5' DC X 2 34.935 25.871 19.511 1.00 0.00 C ATOM 37 C4' DC X 2 34.912 26.671 20.830 1.00 0.00 C ATOM 38 O4' DC X 2 34.792 28.036 20.416 1.00 0.00 O ATOM 39 C3' DC X 2 33.835 26.368 21.832 1.00 0.00 C ATOM 40 O3' DC X 2 34.275 26.523 23.184 1.00 0.00 O ATOM 41 C2' DC X 2 32.765 27.385 21.458 1.00 0.00 C ATOM 42 C1' DC X 2 33.639 28.566 21.075 1.00 0.00 C ATOM 43 N1 DC X 2 33.022 29.656 20.198 1.00 0.00 N ATOM 44 C2 DC X 2 33.151 30.934 20.647 1.00 0.00 C ATOM 45 O2 DC X 2 33.807 31.268 21.619 1.00 0.00 O ATOM 46 N3 DC X 2 32.536 31.959 19.998 1.00 0.00 N ATOM 47 C4 DC X 2 31.745 31.685 18.965 1.00 0.00 C ATOM 48 N4 DC X 2 30.906 32.623 18.597 1.00 0.00 N ATOM 49 C5 DC X 2 31.446 30.302 18.534 1.00 0.00 C ATOM 50 C6 DC X 2 32.084 29.290 19.204 1.00 0.00 C ATOM 0 H5' DC X 2 35.618 26.334 18.799 1.00 0.00 H new ATOM 0 H5'' DC X 2 35.298 24.859 19.688 1.00 0.00 H new ATOM 0 H4' DC X 2 35.815 26.403 21.378 1.00 0.00 H new ATOM 0 H3' DC X 2 33.494 25.333 21.798 1.00 0.00 H new ATOM 0 H2' DC X 2 32.139 27.046 20.633 1.00 0.00 H new ATOM 0 H2'' DC X 2 32.099 27.613 22.290 1.00 0.00 H new ATOM 0 H1' DC X 2 33.846 29.087 22.010 1.00 0.00 H new ATOM 0 H41 DC X 2 30.277 32.464 17.810 1.00 0.00 H new ATOM 0 H42 DC X 2 30.883 33.511 19.098 1.00 0.00 H new ATOM 0 H5 DC X 2 30.756 30.099 17.728 1.00 0.00 H new ATOM 0 H6 DC X 2 31.878 28.253 18.982 1.00 0.00 H new ATOM 62 P DT X 3 34.298 25.226 24.042 1.00 0.00 P ATOM 63 OP1 DT X 3 35.440 24.450 23.489 1.00 0.00 O ATOM 64 OP2 DT X 3 32.913 24.754 24.239 1.00 0.00 O1- ATOM 65 O5' DT X 3 34.720 25.809 25.506 1.00 0.00 O ATOM 66 C5' DT X 3 36.018 25.757 25.990 1.00 0.00 C ATOM 67 C4' DT X 3 36.159 26.445 27.322 1.00 0.00 C ATOM 68 O4' DT X 3 36.170 27.849 27.083 1.00 0.00 O ATOM 69 C3' DT X 3 35.139 25.993 28.319 1.00 0.00 C ATOM 70 O3' DT X 3 35.914 25.786 29.577 1.00 0.00 O ATOM 71 C2' DT X 3 34.332 27.259 28.546 1.00 0.00 C ATOM 72 C1' DT X 3 35.224 28.358 27.929 1.00 0.00 C ATOM 73 N1 DT X 3 34.432 29.455 27.215 1.00 0.00 N ATOM 74 C2 DT X 3 34.774 30.703 27.563 1.00 0.00 C ATOM 75 O2 DT X 3 35.741 30.981 28.268 1.00 0.00 O ATOM 76 N3 DT X 3 33.943 31.691 27.178 1.00 0.00 N ATOM 77 C4 DT X 3 32.816 31.521 26.371 1.00 0.00 C ATOM 78 O4 DT X 3 32.178 32.473 25.968 1.00 0.00 O ATOM 79 C5 DT X 3 32.604 30.161 25.938 1.00 0.00 C ATOM 80 C7 DT X 3 31.647 29.834 24.843 1.00 0.00 C ATOM 81 C6 DT X 3 33.384 29.163 26.433 1.00 0.00 C ATOM 0 H5' DT X 3 36.691 26.223 25.270 1.00 0.00 H new ATOM 0 H5'' DT X 3 36.326 24.716 26.087 1.00 0.00 H new ATOM 0 H4' DT X 3 37.101 26.167 27.796 1.00 0.00 H new ATOM 0 H3' DT X 3 34.553 25.120 28.033 1.00 0.00 H new ATOM 0 H2' DT X 3 33.358 27.209 28.059 1.00 0.00 H new ATOM 0 H2'' DT X 3 34.149 27.436 29.606 1.00 0.00 H new ATOM 0 H1' DT X 3 35.726 28.814 28.782 1.00 0.00 H new ATOM 0 H3 DT X 3 34.153 32.636 27.501 1.00 0.00 H new ATOM 0 H71 DT X 3 30.840 30.567 24.834 1.00 0.00 H new ATOM 0 H72 DT X 3 32.168 29.856 23.886 1.00 0.00 H new ATOM 0 H73 DT X 3 31.232 28.840 25.007 1.00 0.00 H new ATOM 0 H6 DT X 3 33.158 28.134 26.195 1.00 0.00 H new ATOM 94 P DA X 4 35.744 24.475 30.433 1.00 0.00 P ATOM 95 OP1 DA X 4 36.503 24.691 31.718 1.00 0.00 O ATOM 96 OP2 DA X 4 35.888 23.282 29.612 1.00 0.00 O1- ATOM 97 O5' DA X 4 34.182 24.722 30.773 1.00 0.00 O ATOM 98 C5' DA X 4 33.826 25.417 31.993 1.00 0.00 C ATOM 99 C4' DA X 4 32.387 25.888 32.023 1.00 0.00 C ATOM 100 O4' DA X 4 32.214 27.105 31.312 1.00 0.00 O ATOM 101 C3' DA X 4 31.355 24.899 31.517 1.00 0.00 C ATOM 102 O3' DA X 4 30.336 24.911 32.491 1.00 0.00 O ATOM 103 C2' DA X 4 30.899 25.604 30.221 1.00 0.00 C ATOM 104 C1' DA X 4 30.930 27.054 30.741 1.00 0.00 C ATOM 105 N9 DA X 4 30.468 28.077 29.712 1.00 0.00 N ATOM 106 C8 DA X 4 29.611 27.875 28.697 1.00 0.00 C ATOM 107 N7 DA X 4 29.491 28.924 27.898 1.00 0.00 N ATOM 108 C5 DA X 4 30.234 29.911 28.534 1.00 0.00 C ATOM 109 C6 DA X 4 30.436 31.280 28.297 1.00 0.00 C ATOM 110 N6 DA X 4 29.711 32.039 27.489 1.00 0.00 N ATOM 111 N1 DA X 4 31.299 31.952 28.994 1.00 0.00 N ATOM 112 C2 DA X 4 31.971 31.249 29.956 1.00 0.00 C ATOM 113 N3 DA X 4 31.751 30.062 30.435 1.00 0.00 N ATOM 114 C4 DA X 4 30.925 29.375 29.607 1.00 0.00 C ATOM 0 H5' DA X 4 34.484 26.277 32.117 1.00 0.00 H new ATOM 0 H5'' DA X 4 34.001 24.757 32.842 1.00 0.00 H new ATOM 0 H4' DA X 4 32.203 26.021 33.089 1.00 0.00 H new ATOM 0 H3' DA X 4 31.666 23.868 31.346 1.00 0.00 H new ATOM 0 H2' DA X 4 31.578 25.438 29.385 1.00 0.00 H new ATOM 0 H2'' DA X 4 29.908 25.291 29.893 1.00 0.00 H new ATOM 0 H1' DA X 4 30.198 27.343 31.495 1.00 0.00 H new ATOM 0 H8 DA X 4 29.074 26.950 28.548 1.00 0.00 H new ATOM 0 H61 DA X 4 29.935 33.028 27.381 1.00 0.00 H new ATOM 0 H62 DA X 4 28.929 31.634 26.975 1.00 0.00 H new ATOM 0 H2 DA X 4 32.819 31.762 30.385 1.00 0.00 H new ATOM 126 P DT X 5 30.047 23.626 33.397 1.00 0.00 P ATOM 127 OP1 DT X 5 29.095 23.932 34.439 1.00 0.00 O ATOM 128 OP2 DT X 5 31.302 23.004 33.807 1.00 0.00 O1- ATOM 129 O5' DT X 5 29.386 22.551 32.434 1.00 0.00 O ATOM 130 C5' DT X 5 27.970 22.570 32.252 1.00 0.00 C ATOM 131 C4' DT X 5 27.500 23.525 31.172 1.00 0.00 C ATOM 132 O4' DT X 5 28.262 23.197 29.983 1.00 0.00 O ATOM 133 C3' DT X 5 26.104 23.323 30.736 1.00 0.00 C ATOM 134 O3' DT X 5 25.270 24.482 31.120 1.00 0.00 O ATOM 135 C2' DT X 5 26.102 23.186 29.212 1.00 0.00 C ATOM 136 C1' DT X 5 27.543 23.509 28.797 1.00 0.00 C ATOM 137 N1 DT X 5 28.153 22.720 27.720 1.00 0.00 N ATOM 138 C2 DT X 5 29.106 23.420 26.980 1.00 0.00 C ATOM 139 O2 DT X 5 29.591 24.558 27.265 1.00 0.00 O ATOM 140 N3 DT X 5 29.526 22.875 25.808 1.00 0.00 N ATOM 141 C4 DT X 5 29.358 21.565 25.443 1.00 0.00 C ATOM 142 O4 DT X 5 29.983 21.243 24.447 1.00 0.00 O ATOM 143 C5 DT X 5 28.614 20.722 26.348 1.00 0.00 C ATOM 144 C7 DT X 5 28.455 19.252 26.063 1.00 0.00 C ATOM 145 C6 DT X 5 28.041 21.317 27.445 1.00 0.00 C ATOM 0 H5' DT X 5 27.496 22.843 33.195 1.00 0.00 H new ATOM 0 H5'' DT X 5 27.632 21.564 32.005 1.00 0.00 H new ATOM 0 H4' DT X 5 27.611 24.530 31.580 1.00 0.00 H new ATOM 0 H3' DT X 5 25.696 22.430 31.210 1.00 0.00 H new ATOM 0 H2' DT X 5 25.816 22.180 28.904 1.00 0.00 H new ATOM 0 H2'' DT X 5 25.393 23.874 28.752 1.00 0.00 H new ATOM 0 H1' DT X 5 27.562 24.527 28.407 1.00 0.00 H new ATOM 0 H3 DT X 5 30.004 23.489 25.148 1.00 0.00 H new ATOM 0 H71 DT X 5 28.370 18.706 27.003 1.00 0.00 H new ATOM 0 H72 DT X 5 27.556 19.092 25.468 1.00 0.00 H new ATOM 0 H73 DT X 5 29.324 18.892 25.512 1.00 0.00 H new ATOM 0 H6 DT X 5 27.480 20.700 28.132 1.00 0.00 H new ATOM 158 P DA X 6 24.719 24.640 32.548 1.00 0.00 P ATOM 159 OP1 DA X 6 25.783 25.169 33.421 1.00 0.00 O ATOM 160 OP2 DA X 6 23.984 23.398 32.973 1.00 0.00 O1- ATOM 161 O5' DA X 6 23.668 25.786 32.228 1.00 0.00 O ATOM 162 C5' DA X 6 23.867 27.191 32.421 1.00 0.00 C ATOM 163 C4' DA X 6 22.736 27.950 31.638 1.00 0.00 C ATOM 164 O4' DA X 6 22.745 27.698 30.201 1.00 0.00 O ATOM 165 C3' DA X 6 21.320 27.560 32.131 1.00 0.00 C ATOM 166 O3' DA X 6 20.474 28.650 32.370 1.00 0.00 O ATOM 167 C2' DA X 6 20.756 26.631 31.065 1.00 0.00 C ATOM 168 C1' DA X 6 21.473 27.238 29.795 1.00 0.00 C ATOM 169 N9 DA X 6 21.788 26.186 28.829 1.00 0.00 N ATOM 170 C8 DA X 6 22.921 25.330 28.759 1.00 0.00 C ATOM 171 N7 DA X 6 22.884 24.449 27.813 1.00 0.00 N ATOM 172 C5 DA X 6 21.672 24.857 27.110 1.00 0.00 C ATOM 173 C6 DA X 6 21.138 24.408 25.898 1.00 0.00 C ATOM 174 N6 DA X 6 21.666 23.499 25.082 1.00 0.00 N ATOM 175 N1 DA X 6 19.988 24.978 25.500 1.00 0.00 N ATOM 176 C2 DA X 6 19.355 25.888 26.246 1.00 0.00 C ATOM 177 N3 DA X 6 19.836 26.422 27.405 1.00 0.00 N ATOM 178 C4 DA X 6 20.956 25.808 27.819 1.00 0.00 C ATOM 0 H5' DA X 6 24.850 27.491 32.058 1.00 0.00 H new ATOM 0 H5'' DA X 6 23.830 27.440 33.482 1.00 0.00 H new ATOM 0 H4' DA X 6 22.953 29.000 31.833 1.00 0.00 H new ATOM 0 H3' DA X 6 21.390 27.077 33.106 1.00 0.00 H new ATOM 0 H2' DA X 6 21.018 25.587 31.236 1.00 0.00 H new ATOM 0 H2'' DA X 6 19.669 26.680 30.997 1.00 0.00 H new ATOM 0 H1' DA X 6 20.822 28.003 29.371 1.00 0.00 H new ATOM 0 H8 DA X 6 23.751 25.410 29.445 1.00 0.00 H new ATOM 0 H61 DA X 6 21.185 23.248 24.218 1.00 0.00 H new ATOM 0 H62 DA X 6 22.552 23.053 25.320 1.00 0.00 H new ATOM 0 H2 DA X 6 18.388 26.227 25.905 1.00 0.00 H new ATOM 190 P DG X 7 19.064 28.563 33.133 1.00 0.00 P ATOM 191 OP1 DG X 7 18.756 29.920 33.558 1.00 0.00 O ATOM 192 OP2 DG X 7 19.278 27.505 34.092 1.00 0.00 O1- ATOM 193 O5' DG X 7 17.946 27.986 32.094 1.00 0.00 O ATOM 194 C5' DG X 7 17.277 28.704 31.117 1.00 0.00 C ATOM 195 C4' DG X 7 16.129 27.931 30.540 1.00 0.00 C ATOM 196 O4' DG X 7 16.586 27.085 29.465 1.00 0.00 O ATOM 197 C3' DG X 7 15.352 27.160 31.562 1.00 0.00 C ATOM 198 O3' DG X 7 13.937 27.287 31.353 1.00 0.00 O ATOM 199 C2' DG X 7 15.982 25.782 31.324 1.00 0.00 C ATOM 200 C1' DG X 7 16.241 25.796 29.808 1.00 0.00 C ATOM 201 N9 DG X 7 17.271 24.792 29.350 1.00 0.00 N ATOM 202 C8 DG X 7 18.258 24.145 30.034 1.00 0.00 C ATOM 203 N7 DG X 7 18.915 23.192 29.405 1.00 0.00 N ATOM 204 C5 DG X 7 18.287 23.216 28.128 1.00 0.00 C ATOM 205 C6 DG X 7 18.476 22.455 26.921 1.00 0.00 C ATOM 206 O6 DG X 7 19.226 21.499 26.709 1.00 0.00 O ATOM 207 N1 DG X 7 17.724 22.910 25.843 1.00 0.00 N ATOM 208 C2 DG X 7 16.768 23.859 25.989 1.00 0.00 C ATOM 209 N2 DG X 7 16.227 24.183 24.896 1.00 0.00 N ATOM 210 N3 DG X 7 16.475 24.559 27.087 1.00 0.00 N ATOM 211 C4 DG X 7 17.300 24.221 28.109 1.00 0.00 C ATOM 0 H5' DG X 7 17.973 28.968 30.321 1.00 0.00 H new ATOM 0 H5'' DG X 7 16.909 29.638 31.542 1.00 0.00 H new ATOM 0 H4' DG X 7 15.426 28.661 30.139 1.00 0.00 H new ATOM 0 H3' DG X 7 15.411 27.473 32.604 1.00 0.00 H new ATOM 0 H2' DG X 7 16.903 25.652 31.892 1.00 0.00 H new ATOM 0 H2'' DG X 7 15.312 24.973 31.614 1.00 0.00 H new ATOM 0 H1' DG X 7 15.332 25.485 29.293 1.00 0.00 H new ATOM 0 H8 DG X 7 18.493 24.405 31.056 1.00 0.00 H new ATOM 0 H1 DG X 7 17.897 22.519 24.917 1.00 0.00 H new ATOM 0 H21 DG X 7 15.492 24.890 24.881 1.00 0.00 H new ATOM 0 H22 DG X 7 16.525 23.738 24.028 1.00 0.00 H new ATOM 223 P DC X 8 12.995 27.019 32.604 1.00 0.00 P ATOM 224 OP1 DC X 8 11.658 27.401 32.099 1.00 0.00 O ATOM 225 OP2 DC X 8 13.623 27.771 33.693 1.00 0.00 O ATOM 226 O5' DC X 8 13.106 25.445 32.844 1.00 0.00 O ATOM 227 C5' DC X 8 12.106 24.560 32.294 1.00 0.00 C ATOM 228 C4' DC X 8 12.159 24.455 30.787 1.00 0.00 C ATOM 229 O4' DC X 8 13.453 24.062 30.344 1.00 0.00 O ATOM 230 C3' DC X 8 11.125 23.458 30.228 1.00 0.00 C ATOM 231 O3' DC X 8 10.636 23.905 28.960 1.00 0.00 O ATOM 232 C2' DC X 8 12.018 22.260 29.960 1.00 0.00 C ATOM 233 C1' DC X 8 13.217 23.001 29.433 1.00 0.00 C ATOM 234 N1 DC X 8 14.436 22.146 29.328 1.00 0.00 N ATOM 235 C2 DC X 8 14.781 21.563 28.109 1.00 0.00 C ATOM 236 O2 DC X 8 14.021 21.732 27.162 1.00 0.00 O ATOM 237 N3 DC X 8 15.915 20.805 27.971 1.00 0.00 N ATOM 238 C4 DC X 8 16.532 20.471 29.084 1.00 0.00 C ATOM 239 N4 DC X 8 17.357 19.452 28.985 1.00 0.00 N ATOM 240 C5 DC X 8 16.239 20.998 30.324 1.00 0.00 C ATOM 241 C6 DC X 8 15.229 21.859 30.418 1.00 0.00 C ATOM 0 H5' DC X 8 11.118 24.911 32.592 1.00 0.00 H new ATOM 0 H5'' DC X 8 12.234 23.567 32.725 1.00 0.00 H new ATOM 0 H4' DC X 8 11.922 25.450 30.410 1.00 0.00 H new ATOM 0 H3' DC X 8 10.268 23.299 30.882 1.00 0.00 H new ATOM 0 H2' DC X 8 12.236 21.684 30.859 1.00 0.00 H new ATOM 0 H2'' DC X 8 11.593 21.568 29.233 1.00 0.00 H new ATOM 0 HO3' DC X 8 9.982 23.261 28.616 1.00 0.00 H new ATOM 0 H1' DC X 8 13.012 23.349 28.421 1.00 0.00 H new ATOM 0 H41 DC X 8 17.873 19.132 29.805 1.00 0.00 H new ATOM 0 H42 DC X 8 17.481 18.981 28.089 1.00 0.00 H new ATOM 0 H5 DC X 8 16.814 20.720 31.195 1.00 0.00 H new ATOM 0 H6 DC X 8 15.027 22.341 31.363 1.00 0.00 H new TER 254 DC X 8 ATOM 255 O5' DG Y 9 12.963 16.381 20.792 1.00 0.00 O ATOM 256 C5' DG Y 9 13.982 15.678 20.067 1.00 0.00 C ATOM 257 C4' DG Y 9 15.212 16.468 19.956 1.00 0.00 C ATOM 258 O4' DG Y 9 15.704 17.218 21.080 1.00 0.00 O ATOM 259 C3' DG Y 9 16.385 15.631 19.451 1.00 0.00 C ATOM 260 O3' DG Y 9 17.236 16.299 18.477 1.00 0.00 O ATOM 261 C2' DG Y 9 17.180 15.527 20.760 1.00 0.00 C ATOM 262 C1' DG Y 9 17.109 17.045 21.176 1.00 0.00 C ATOM 263 N9 DG Y 9 17.782 17.259 22.483 1.00 0.00 N ATOM 264 C8 DG Y 9 18.942 16.656 22.859 1.00 0.00 C ATOM 265 N7 DG Y 9 19.261 17.060 24.093 1.00 0.00 N ATOM 266 C5 DG Y 9 18.170 17.877 24.495 1.00 0.00 C ATOM 267 C6 DG Y 9 17.940 18.502 25.741 1.00 0.00 C ATOM 268 O6 DG Y 9 18.612 18.478 26.771 1.00 0.00 O ATOM 269 N1 DG Y 9 16.717 19.248 25.655 1.00 0.00 N ATOM 270 C2 DG Y 9 15.815 19.173 24.685 1.00 0.00 C ATOM 271 N2 DG Y 9 14.937 20.029 24.698 1.00 0.00 N ATOM 272 N3 DG Y 9 15.998 18.501 23.512 1.00 0.00 N ATOM 273 C4 DG Y 9 17.206 17.866 23.511 1.00 0.00 C ATOM 0 H5' DG Y 9 13.616 15.433 19.070 1.00 0.00 H new ATOM 0 H5'' DG Y 9 14.199 14.734 20.568 1.00 0.00 H new ATOM 0 H4' DG Y 9 14.851 17.221 19.255 1.00 0.00 H new ATOM 0 H3' DG Y 9 16.060 14.718 18.951 1.00 0.00 H new ATOM 0 H2' DG Y 9 16.715 14.863 21.489 1.00 0.00 H new ATOM 0 H2'' DG Y 9 18.200 15.173 20.612 1.00 0.00 H new ATOM 0 HO5' DG Y 9 13.371 17.107 21.309 1.00 0.00 H new ATOM 0 H1' DG Y 9 17.638 17.794 20.587 1.00 0.00 H new ATOM 0 H8 DG Y 9 19.513 15.963 22.258 1.00 0.00 H new ATOM 0 H1 DG Y 9 16.522 19.900 26.415 1.00 0.00 H new ATOM 0 H21 DG Y 9 14.213 20.028 23.980 1.00 0.00 H new ATOM 0 H22 DG Y 9 14.931 20.742 25.427 1.00 0.00 H new ATOM 286 P DC Y 10 16.777 16.637 16.982 1.00 0.00 P ATOM 287 OP1 DC Y 10 15.977 15.474 16.543 1.00 0.00 O ATOM 288 OP2 DC Y 10 17.951 16.874 16.115 1.00 0.00 O1- ATOM 289 O5' DC Y 10 15.873 17.930 16.976 1.00 0.00 O ATOM 290 C5' DC Y 10 16.294 19.256 16.763 1.00 0.00 C ATOM 291 C4' DC Y 10 15.824 20.197 17.893 1.00 0.00 C ATOM 292 O4' DC Y 10 16.397 19.863 19.137 1.00 0.00 O ATOM 293 C3' DC Y 10 16.205 21.624 17.692 1.00 0.00 C ATOM 294 O3' DC Y 10 15.020 22.366 17.545 1.00 0.00 O ATOM 295 C2' DC Y 10 16.831 22.104 19.008 1.00 0.00 C ATOM 296 C1' DC Y 10 16.487 21.034 19.949 1.00 0.00 C ATOM 297 N1 DC Y 10 17.485 20.885 21.051 1.00 0.00 N ATOM 298 C2 DC Y 10 17.335 21.681 22.235 1.00 0.00 C ATOM 299 O2 DC Y 10 16.496 22.578 22.325 1.00 0.00 O ATOM 300 N3 DC Y 10 18.272 21.611 23.202 1.00 0.00 N ATOM 301 C4 DC Y 10 19.363 20.848 23.039 1.00 0.00 C ATOM 302 N4 DC Y 10 20.242 20.844 24.005 1.00 0.00 N ATOM 303 C5 DC Y 10 19.608 20.159 21.803 1.00 0.00 C ATOM 304 C6 DC Y 10 18.605 20.179 20.839 1.00 0.00 C ATOM 0 H5' DC Y 10 15.905 19.612 15.809 1.00 0.00 H new ATOM 0 H5'' DC Y 10 17.381 19.285 16.695 1.00 0.00 H new ATOM 0 H4' DC Y 10 14.741 20.073 17.876 1.00 0.00 H new ATOM 0 H3' DC Y 10 16.871 21.736 16.836 1.00 0.00 H new ATOM 0 H2' DC Y 10 17.910 22.231 18.919 1.00 0.00 H new ATOM 0 H2'' DC Y 10 16.422 23.064 19.322 1.00 0.00 H new ATOM 0 H1' DC Y 10 15.555 21.245 20.474 1.00 0.00 H new ATOM 0 H41 DC Y 10 21.087 20.278 23.924 1.00 0.00 H new ATOM 0 H42 DC Y 10 20.084 21.407 24.841 1.00 0.00 H new ATOM 0 H5 DC Y 10 20.540 19.642 21.628 1.00 0.00 H new ATOM 0 H6 DC Y 10 18.729 19.626 19.920 1.00 0.00 H new ATOM 316 P DT Y 11 15.035 23.848 16.876 1.00 0.00 P ATOM 317 OP1 DT Y 11 13.753 24.005 16.173 1.00 0.00 O ATOM 318 OP2 DT Y 11 16.256 23.977 16.096 1.00 0.00 O1- ATOM 319 O5' DT Y 11 15.233 24.975 17.955 1.00 0.00 O ATOM 320 C5' DT Y 11 14.233 25.390 18.845 1.00 0.00 C ATOM 321 C4' DT Y 11 14.729 26.334 19.917 1.00 0.00 C ATOM 322 O4' DT Y 11 15.788 25.709 20.628 1.00 0.00 O ATOM 323 C3' DT Y 11 15.334 27.660 19.362 1.00 0.00 C ATOM 324 O3' DT Y 11 14.762 28.839 20.009 1.00 0.00 O ATOM 325 C2' DT Y 11 16.799 27.634 19.835 1.00 0.00 C ATOM 326 C1' DT Y 11 16.718 26.659 21.006 1.00 0.00 C ATOM 327 N1 DT Y 11 17.958 25.897 21.293 1.00 0.00 N ATOM 328 C2 DT Y 11 18.555 25.985 22.516 1.00 0.00 C ATOM 329 O2 DT Y 11 18.124 26.716 23.410 1.00 0.00 O ATOM 330 N3 DT Y 11 19.724 25.275 22.738 1.00 0.00 N ATOM 331 C4 DT Y 11 20.261 24.361 21.881 1.00 0.00 C ATOM 332 O4 DT Y 11 21.223 23.650 22.276 1.00 0.00 O ATOM 333 C5 DT Y 11 19.677 24.349 20.539 1.00 0.00 C ATOM 334 C7 DT Y 11 20.212 23.563 19.399 1.00 0.00 C ATOM 335 C6 DT Y 11 18.524 25.059 20.290 1.00 0.00 C ATOM 0 H5' DT Y 11 13.794 24.512 19.320 1.00 0.00 H new ATOM 0 H5'' DT Y 11 13.438 25.879 18.282 1.00 0.00 H new ATOM 0 H4' DT Y 11 13.857 26.566 20.528 1.00 0.00 H new ATOM 0 H3' DT Y 11 15.167 27.719 18.287 1.00 0.00 H new ATOM 0 H2' DT Y 11 17.476 27.285 19.056 1.00 0.00 H new ATOM 0 H2'' DT Y 11 17.149 28.619 20.144 1.00 0.00 H new ATOM 0 H1' DT Y 11 16.491 27.248 21.895 1.00 0.00 H new ATOM 0 H3 DT Y 11 20.222 25.450 23.611 1.00 0.00 H new ATOM 0 H71 DT Y 11 21.291 23.453 19.507 1.00 0.00 H new ATOM 0 H72 DT Y 11 19.746 22.578 19.386 1.00 0.00 H new ATOM 0 H73 DT Y 11 19.992 24.080 18.465 1.00 0.00 H new ATOM 0 H6 DT Y 11 18.044 24.980 19.326 1.00 0.00 H new ATOM 348 P DA Y 12 14.710 30.297 19.289 1.00 0.00 P ATOM 349 OP1 DA Y 12 13.545 31.083 19.798 1.00 0.00 O ATOM 350 OP2 DA Y 12 14.761 30.074 17.871 1.00 0.00 O1- ATOM 351 O5' DA Y 12 16.050 30.951 19.778 1.00 0.00 O ATOM 352 C5' DA Y 12 16.185 31.463 21.064 1.00 0.00 C ATOM 353 C4' DA Y 12 17.634 31.724 21.422 1.00 0.00 C ATOM 354 O4' DA Y 12 18.339 30.488 21.641 1.00 0.00 O ATOM 355 C3' DA Y 12 18.619 32.457 20.423 1.00 0.00 C ATOM 356 O3' DA Y 12 18.473 33.879 20.465 1.00 0.00 O ATOM 357 C2' DA Y 12 20.069 31.999 20.857 1.00 0.00 C ATOM 358 C1' DA Y 12 19.678 30.879 21.855 1.00 0.00 C ATOM 359 N9 DA Y 12 20.489 29.614 21.784 1.00 0.00 N ATOM 360 C8 DA Y 12 21.018 28.904 20.747 1.00 0.00 C ATOM 361 N7 DA Y 12 21.786 27.897 21.089 1.00 0.00 N ATOM 362 C5 DA Y 12 21.776 27.952 22.475 1.00 0.00 C ATOM 363 C6 DA Y 12 22.274 27.154 23.536 1.00 0.00 C ATOM 364 N6 DA Y 12 22.870 25.986 23.365 1.00 0.00 N ATOM 365 N1 DA Y 12 22.047 27.490 24.833 1.00 0.00 N ATOM 366 C2 DA Y 12 21.390 28.649 25.129 1.00 0.00 C ATOM 367 N3 DA Y 12 20.785 29.394 24.227 1.00 0.00 N ATOM 368 C4 DA Y 12 21.027 29.035 22.928 1.00 0.00 C ATOM 0 H5' DA Y 12 15.755 30.763 21.780 1.00 0.00 H new ATOM 0 H5'' DA Y 12 15.619 32.391 21.146 1.00 0.00 H new ATOM 0 H4' DA Y 12 17.451 32.392 22.264 1.00 0.00 H new ATOM 0 H3' DA Y 12 18.406 32.190 19.388 1.00 0.00 H new ATOM 0 H2' DA Y 12 20.662 31.630 20.021 1.00 0.00 H new ATOM 0 H2'' DA Y 12 20.641 32.800 21.325 1.00 0.00 H new ATOM 0 H1' DA Y 12 19.860 31.336 22.828 1.00 0.00 H new ATOM 0 H8 DA Y 12 20.818 29.153 19.715 1.00 0.00 H new ATOM 0 H61 DA Y 12 23.206 25.462 24.173 1.00 0.00 H new ATOM 0 H62 DA Y 12 22.994 25.609 22.425 1.00 0.00 H new ATOM 0 H2 DA Y 12 21.365 28.973 26.159 1.00 0.00 H new ATOM 380 P DT Y 13 18.678 34.793 19.157 1.00 0.00 P ATOM 381 OP1 DT Y 13 17.719 35.940 19.204 1.00 0.00 O ATOM 382 OP2 DT Y 13 18.667 33.960 18.001 1.00 0.00 O1- ATOM 383 O5' DT Y 13 20.144 35.401 19.339 1.00 0.00 O ATOM 384 C5' DT Y 13 21.341 34.603 18.983 1.00 0.00 C ATOM 385 C4' DT Y 13 22.572 35.447 19.045 1.00 0.00 C ATOM 386 O4' DT Y 13 23.767 34.682 18.983 1.00 0.00 O ATOM 387 C3' DT Y 13 22.587 36.451 17.885 1.00 0.00 C ATOM 388 O3' DT Y 13 22.899 37.797 18.249 1.00 0.00 O ATOM 389 C2' DT Y 13 23.571 35.680 16.982 1.00 0.00 C ATOM 390 C1' DT Y 13 24.601 35.272 17.978 1.00 0.00 C ATOM 391 N1 DT Y 13 25.625 34.189 17.434 1.00 0.00 N ATOM 392 C2 DT Y 13 26.733 34.715 16.871 1.00 0.00 C ATOM 393 O2 DT Y 13 26.932 35.922 16.717 1.00 0.00 O ATOM 394 N3 DT Y 13 27.726 33.852 16.648 1.00 0.00 N ATOM 395 C4 DT Y 13 27.632 32.502 16.760 1.00 0.00 C ATOM 396 O4 DT Y 13 28.676 31.837 16.506 1.00 0.00 O ATOM 397 C5 DT Y 13 26.346 31.953 17.188 1.00 0.00 C ATOM 398 C7 DT Y 13 26.097 30.476 17.002 1.00 0.00 C ATOM 399 C6 DT Y 13 25.335 32.829 17.552 1.00 0.00 C ATOM 0 H5' DT Y 13 21.226 34.192 17.980 1.00 0.00 H new ATOM 0 H5'' DT Y 13 21.438 33.758 19.665 1.00 0.00 H new ATOM 0 H4' DT Y 13 22.541 35.960 20.006 1.00 0.00 H new ATOM 0 H3' DT Y 13 21.637 36.689 17.408 1.00 0.00 H new ATOM 0 H2' DT Y 13 23.103 34.823 16.497 1.00 0.00 H new ATOM 0 H2'' DT Y 13 23.985 36.307 16.192 1.00 0.00 H new ATOM 0 H1' DT Y 13 25.236 36.101 18.291 1.00 0.00 H new ATOM 0 H3 DT Y 13 28.629 34.238 16.371 1.00 0.00 H new ATOM 0 H71 DT Y 13 25.421 30.120 17.779 1.00 0.00 H new ATOM 0 H72 DT Y 13 25.648 30.303 16.024 1.00 0.00 H new ATOM 0 H73 DT Y 13 27.042 29.937 17.068 1.00 0.00 H new ATOM 0 H6 DT Y 13 24.377 32.479 17.907 1.00 0.00 H new ATOM 412 P DA Y 14 23.483 38.852 17.172 1.00 0.00 P ATOM 413 OP1 DA Y 14 23.455 40.165 17.708 1.00 0.00 O ATOM 414 OP2 DA Y 14 22.779 38.579 15.900 1.00 0.00 O1- ATOM 415 O5' DA Y 14 25.023 38.301 16.979 1.00 0.00 O ATOM 416 C5' DA Y 14 26.004 38.951 17.713 1.00 0.00 C ATOM 417 C4' DA Y 14 25.944 38.965 19.289 1.00 0.00 C ATOM 418 O4' DA Y 14 26.158 37.582 19.704 1.00 0.00 O ATOM 419 C3' DA Y 14 26.996 39.959 19.901 1.00 0.00 C ATOM 420 O3' DA Y 14 26.419 40.600 21.022 1.00 0.00 O ATOM 421 C2' DA Y 14 28.037 38.938 20.353 1.00 0.00 C ATOM 422 C1' DA Y 14 27.208 37.624 20.693 1.00 0.00 C ATOM 423 N9 DA Y 14 28.011 36.435 20.862 1.00 0.00 N ATOM 424 C8 DA Y 14 28.574 35.652 19.931 1.00 0.00 C ATOM 425 N7 DA Y 14 29.403 34.745 20.308 1.00 0.00 N ATOM 426 C5 DA Y 14 29.446 34.932 21.734 1.00 0.00 C ATOM 427 C6 DA Y 14 30.120 34.385 22.821 1.00 0.00 C ATOM 428 N6 DA Y 14 30.979 33.358 22.807 1.00 0.00 N ATOM 429 N1 DA Y 14 29.798 34.746 24.036 1.00 0.00 N ATOM 430 C2 DA Y 14 28.986 35.823 24.214 1.00 0.00 C ATOM 431 N3 DA Y 14 28.408 36.513 23.253 1.00 0.00 N ATOM 432 C4 DA Y 14 28.588 35.956 22.051 1.00 0.00 C ATOM 0 H5' DA Y 14 26.019 39.989 17.382 1.00 0.00 H new ATOM 0 H5'' DA Y 14 26.961 38.512 17.431 1.00 0.00 H new ATOM 0 H4' DA Y 14 24.984 39.329 19.655 1.00 0.00 H new ATOM 0 H3' DA Y 14 27.365 40.750 19.249 1.00 0.00 H new ATOM 0 H2' DA Y 14 28.771 38.750 19.569 1.00 0.00 H new ATOM 0 H2'' DA Y 14 28.586 39.294 21.225 1.00 0.00 H new ATOM 0 H1' DA Y 14 26.764 37.657 21.688 1.00 0.00 H new ATOM 0 H8 DA Y 14 28.336 35.781 18.885 1.00 0.00 H new ATOM 0 H61 DA Y 14 31.414 33.045 23.675 1.00 0.00 H new ATOM 0 H62 DA Y 14 31.199 32.889 21.928 1.00 0.00 H new ATOM 0 H2 DA Y 14 28.800 36.139 25.230 1.00 0.00 H new ATOM 444 P DG Y 15 27.166 41.904 21.733 1.00 0.00 P ATOM 445 OP1 DG Y 15 26.337 42.486 22.823 1.00 0.00 O ATOM 446 OP2 DG Y 15 27.575 42.871 20.688 1.00 0.00 O1- ATOM 447 O5' DG Y 15 28.521 41.363 22.366 1.00 0.00 O ATOM 448 C5' DG Y 15 28.698 40.875 23.714 1.00 0.00 C ATOM 449 C4' DG Y 15 30.174 40.540 24.041 1.00 0.00 C ATOM 450 O4' DG Y 15 30.632 39.336 23.361 1.00 0.00 O ATOM 451 C3' DG Y 15 31.232 41.569 23.895 1.00 0.00 C ATOM 452 O3' DG Y 15 32.232 41.451 24.969 1.00 0.00 O ATOM 453 C2' DG Y 15 31.826 41.159 22.528 1.00 0.00 C ATOM 454 C1' DG Y 15 31.779 39.631 22.557 1.00 0.00 C ATOM 455 N9 DG Y 15 31.822 39.010 21.281 1.00 0.00 N ATOM 456 C8 DG Y 15 31.430 39.522 20.055 1.00 0.00 C ATOM 457 N7 DG Y 15 31.378 38.620 19.105 1.00 0.00 N ATOM 458 C5 DG Y 15 31.948 37.476 19.700 1.00 0.00 C ATOM 459 C6 DG Y 15 32.302 36.257 19.051 1.00 0.00 C ATOM 460 O6 DG Y 15 32.227 35.889 17.906 1.00 0.00 O ATOM 461 N1 DG Y 15 32.949 35.431 19.968 1.00 0.00 N ATOM 462 C2 DG Y 15 33.214 35.735 21.281 1.00 0.00 C ATOM 463 N2 DG Y 15 33.728 34.798 22.079 1.00 0.00 N ATOM 464 N3 DG Y 15 32.943 36.891 21.842 1.00 0.00 N ATOM 465 C4 DG Y 15 32.260 37.743 21.037 1.00 0.00 C ATOM 0 H5' DG Y 15 28.088 39.983 23.856 1.00 0.00 H new ATOM 0 H5'' DG Y 15 28.336 41.625 24.418 1.00 0.00 H new ATOM 0 H4' DG Y 15 30.070 40.424 25.120 1.00 0.00 H new ATOM 0 H3' DG Y 15 30.884 42.601 23.951 1.00 0.00 H new ATOM 0 H2' DG Y 15 31.242 41.562 21.700 1.00 0.00 H new ATOM 0 H2'' DG Y 15 32.845 41.526 22.408 1.00 0.00 H new ATOM 0 H1' DG Y 15 32.680 39.198 22.991 1.00 0.00 H new ATOM 0 H8 DG Y 15 31.190 40.563 19.897 1.00 0.00 H new ATOM 0 H1 DG Y 15 33.254 34.517 19.634 1.00 0.00 H new ATOM 0 H21 DG Y 15 33.928 35.014 23.056 1.00 0.00 H new ATOM 0 H22 DG Y 15 33.921 33.866 21.713 1.00 0.00 H new ATOM 477 P DC Y 16 33.095 42.637 25.472 1.00 0.00 P ATOM 478 OP1 DC Y 16 33.675 42.210 26.721 1.00 0.00 O ATOM 479 OP2 DC Y 16 32.278 43.835 25.477 1.00 0.00 O ATOM 480 O5' DC Y 16 34.234 42.807 24.344 1.00 0.00 O ATOM 481 C5' DC Y 16 35.572 42.277 24.445 1.00 0.00 C ATOM 482 C4' DC Y 16 35.675 40.716 24.641 1.00 0.00 C ATOM 483 O4' DC Y 16 35.008 40.157 23.536 1.00 0.00 O ATOM 484 C3' DC Y 16 37.098 40.108 24.556 1.00 0.00 C ATOM 485 O3' DC Y 16 37.368 39.053 25.466 1.00 0.00 O ATOM 486 C2' DC Y 16 37.286 39.747 23.089 1.00 0.00 C ATOM 487 C1' DC Y 16 35.855 39.265 22.832 1.00 0.00 C ATOM 488 N1 DC Y 16 35.542 39.361 21.335 1.00 0.00 N ATOM 489 C2 DC Y 16 35.741 38.192 20.568 1.00 0.00 C ATOM 490 O2 DC Y 16 36.182 37.096 21.018 1.00 0.00 O ATOM 491 N3 DC Y 16 35.273 38.131 19.316 1.00 0.00 N ATOM 492 C4 DC Y 16 34.777 39.272 18.696 1.00 0.00 C ATOM 493 N4 DC Y 16 34.293 39.176 17.481 1.00 0.00 N ATOM 494 C5 DC Y 16 34.782 40.537 19.403 1.00 0.00 C ATOM 495 C6 DC Y 16 35.180 40.520 20.719 1.00 0.00 C ATOM 0 H5' DC Y 16 36.074 42.764 25.281 1.00 0.00 H new ATOM 0 H5'' DC Y 16 36.120 42.549 23.543 1.00 0.00 H new ATOM 0 H4' DC Y 16 35.284 40.509 25.637 1.00 0.00 H new ATOM 0 H3' DC Y 16 37.843 40.833 24.886 1.00 0.00 H new ATOM 0 H2' DC Y 16 37.571 40.598 22.470 1.00 0.00 H new ATOM 0 H2'' DC Y 16 38.036 38.972 22.930 1.00 0.00 H new ATOM 0 HO3' DC Y 16 38.286 38.735 25.335 1.00 0.00 H new ATOM 0 H1' DC Y 16 35.719 38.232 23.153 1.00 0.00 H new ATOM 0 H41 DC Y 16 33.925 40.004 17.012 1.00 0.00 H new ATOM 0 H42 DC Y 16 34.284 38.274 17.005 1.00 0.00 H new ATOM 0 H5 DC Y 16 34.486 41.455 18.917 1.00 0.00 H new ATOM 0 H6 DC Y 16 35.206 41.445 21.276 1.00 0.00 H new TER 508 DC Y 16 HETATM 509 C1 4JF Y 101 26.462 26.387 22.913 1.00 0.00 C HETATM 510 C2 4JF Y 101 26.277 26.475 24.267 1.00 0.00 C HETATM 511 C3 4JF Y 101 25.689 27.590 24.856 1.00 0.00 C HETATM 512 C4 4JF Y 101 25.178 28.606 24.065 1.00 0.00 C HETATM 513 C5 4JF Y 101 25.403 28.594 22.685 1.00 0.00 C HETATM 514 C6 4JF Y 101 26.112 27.511 22.148 1.00 0.00 C HETATM 515 C9 4JF Y 101 24.361 29.733 24.627 1.00 0.00 C HETATM 516 C10 4JF Y 101 25.452 27.655 26.301 1.00 0.00 C HETATM 517 C11 4JF Y 101 24.265 29.784 26.010 1.00 0.00 C HETATM 518 C12 4JF Y 101 24.860 28.808 26.824 1.00 0.00 C HETATM 519 O13 4JF Y 101 23.925 30.685 23.945 1.00 0.00 O HETATM 520 O14 4JF Y 101 25.751 26.696 27.035 1.00 0.00 O HETATM 521 O15 4JF Y 101 24.915 29.563 21.797 1.00 0.00 O HETATM 522 O17 4JF Y 101 26.688 25.412 25.006 1.00 0.00 O HETATM 523 C19 4JF Y 101 23.721 30.786 26.910 1.00 0.00 C HETATM 524 C20 4JF Y 101 24.074 30.438 28.214 1.00 0.00 C HETATM 525 C21 4JF Y 101 24.837 29.278 28.126 1.00 0.00 C HETATM 526 C22 4JF Y 101 23.126 32.064 26.629 1.00 0.00 C HETATM 527 N23 4JF Y 101 25.436 28.779 29.146 1.00 0.00 N HETATM 528 N24 4JF Y 101 25.954 28.364 30.081 1.00 0.00 N HETATM 529 O25 4JF Y 101 25.323 31.917 29.499 1.00 0.00 O HETATM 530 C26 4JF Y 101 23.323 33.137 27.651 1.00 0.00 C HETATM 531 C28 4JF Y 101 23.014 32.528 29.103 1.00 0.00 C HETATM 532 C29 4JF Y 101 23.950 31.349 29.395 1.00 0.00 C HETATM 533 C31 4JF Y 101 21.455 32.239 29.146 1.00 0.00 C HETATM 534 C34 4JF Y 101 21.027 30.910 29.893 1.00 0.00 C HETATM 535 O38 4JF Y 101 22.393 32.304 25.669 1.00 0.00 O HETATM 536 C39 4JF Y 101 24.689 33.870 27.461 1.00 0.00 C HETATM 537 C41 4JF Y 101 25.774 33.019 26.720 1.00 0.00 C HETATM 538 C42 4JF Y 101 24.588 35.341 26.837 1.00 0.00 C HETATM 539 O43 4JF Y 101 26.490 32.252 27.324 1.00 0.00 O HETATM 540 C44 4JF Y 101 25.828 33.201 25.384 1.00 0.00 C HETATM 541 C45 4JF Y 101 25.117 34.189 24.633 1.00 0.00 C HETATM 542 C46 4JF Y 101 24.263 35.265 25.316 1.00 0.00 C HETATM 543 C48 4JF Y 101 26.019 36.023 27.071 1.00 0.00 C HETATM 544 C51 4JF Y 101 26.471 37.099 26.133 1.00 0.00 C HETATM 545 O55 4JF Y 101 22.890 34.856 25.031 1.00 0.00 O HETATM 546 C56 4JF Y 101 25.532 34.163 23.326 1.00 0.00 C HETATM 547 C57 4JF Y 101 26.408 33.103 23.208 1.00 0.00 C HETATM 548 C58 4JF Y 101 26.650 32.503 24.412 1.00 0.00 C HETATM 549 C59 4JF Y 101 26.952 32.524 21.979 1.00 0.00 C HETATM 550 C60 4JF Y 101 27.538 31.361 24.614 1.00 0.00 C HETATM 551 O61 4JF Y 101 26.595 33.045 20.968 1.00 0.00 O HETATM 552 O62 4JF Y 101 27.906 30.842 25.686 1.00 0.00 O HETATM 553 C63 4JF Y 101 28.893 29.410 20.975 1.00 0.00 C HETATM 554 C64 4JF Y 101 29.011 28.819 22.229 1.00 0.00 C HETATM 555 C65 4JF Y 101 28.547 29.360 23.410 1.00 0.00 C HETATM 556 C66 4JF Y 101 28.018 30.650 23.343 1.00 0.00 C HETATM 557 C67 4JF Y 101 27.861 31.315 22.116 1.00 0.00 C HETATM 558 C68 4JF Y 101 28.309 30.677 20.914 1.00 0.00 C HETATM 559 O71 4JF Y 101 28.658 28.646 24.601 1.00 0.00 O HETATM 560 O73 4JF Y 101 27.949 31.205 19.707 1.00 0.00 O HETATM 561 N75 4JF Y 101 25.180 34.981 22.357 1.00 0.00 N HETATM 562 N76 4JF Y 101 24.808 35.760 21.660 1.00 0.00 N HETATM 563 C77 4JF Y 101 25.837 31.515 33.129 1.00 0.00 C HETATM 564 C78 4JF Y 101 25.905 32.144 30.830 1.00 0.00 C HETATM 565 C79 4JF Y 101 27.345 31.661 30.634 1.00 0.00 C HETATM 566 C80 4JF Y 101 28.120 31.910 31.942 1.00 0.00 C HETATM 567 C81 4JF Y 101 27.401 31.314 33.129 1.00 0.00 C HETATM 568 O88 4JF Y 101 25.308 31.291 31.842 1.00 0.00 O HETATM 569 C89 4JF Y 101 25.157 30.563 34.159 1.00 0.00 C HETATM 570 N93 4JF Y 101 27.894 31.785 34.496 1.00 0.00 N HETATM 571 O94 4JF Y 101 29.436 31.434 31.934 1.00 0.00 O HETATM 572 C96 4JF Y 101 27.657 33.223 34.809 1.00 0.00 C HETATM 573 C0A 4JF Y 101 29.127 31.090 35.005 1.00 0.00 C HETATM 574 C4A 4JF Y 101 21.968 35.813 24.558 1.00 0.00 C HETATM 575 C5A 4JF Y 101 20.827 35.100 23.847 1.00 0.00 C HETATM 576 C6A 4JF Y 101 19.700 36.036 23.508 1.00 0.00 C HETATM 577 C7A 4JF Y 101 20.318 37.053 22.453 1.00 0.00 C HETATM 578 C8A 4JF Y 101 21.584 37.718 23.062 1.00 0.00 C HETATM 579 O5B 4JF Y 101 22.459 36.656 23.561 1.00 0.00 O HETATM 580 O6B 4JF Y 101 18.597 35.314 22.988 1.00 0.00 O HETATM 581 N8B 4JF Y 101 19.215 37.986 22.020 1.00 0.00 N HETATM 582 C9B 4JF Y 101 18.949 39.181 22.928 1.00 0.00 C HETATM 583 C3C 4JF Y 101 19.486 38.595 20.620 1.00 0.00 C HETATM 584 C7C 4JF Y 101 22.392 38.600 22.027 1.00 0.00 C HETATM 585 O1D 4JF Y 101 23.598 36.037 27.622 1.00 0.00 O HETATM 586 O2D 4JF Y 101 23.215 33.699 30.057 1.00 0.00 O HETATM 587 C3D 4JF Y 101 23.053 33.453 31.464 1.00 0.00 C HETATM 588 C4D 4JF Y 101 23.699 34.484 32.442 1.00 0.00 C HETATM 589 C6D 4JF Y 101 22.938 35.834 32.636 1.00 0.00 C HETATM 590 C9D 4JF Y 101 20.922 34.667 31.611 1.00 0.00 C HETATM 591 C0E 4JF Y 101 21.383 35.635 32.690 1.00 0.00 C HETATM 592 O4E 4JF Y 101 21.642 33.493 31.791 1.00 0.00 O HETATM 593 C5E 4JF Y 101 19.422 34.239 31.766 1.00 0.00 C HETATM 594 O9E 4JF Y 101 20.869 36.950 32.447 1.00 0.00 O HETATM 595 O1F 4JF Y 101 23.425 36.423 33.862 1.00 0.00 O HETATM 596 C2F 4JF Y 101 24.766 37.094 33.703 1.00 0.00 C HETATM 597 C6F 4JF Y 101 23.264 37.445 27.305 1.00 0.00 C HETATM 598 C7F 4JF Y 101 21.789 37.738 27.673 1.00 0.00 C HETATM 599 C9F 4JF Y 101 21.611 37.870 29.179 1.00 0.00 C HETATM 600 C2G 4JF Y 101 24.084 38.391 29.399 1.00 0.00 C HETATM 601 C3G 4JF Y 101 22.686 38.824 29.720 1.00 0.00 C HETATM 602 O7G 4JF Y 101 24.112 38.425 27.950 1.00 0.00 O HETATM 603 O8G 4JF Y 101 22.534 38.893 31.089 1.00 0.00 O HETATM 604 O0H 4JF Y 101 20.242 38.365 29.513 1.00 0.00 O HETATM 605 C1H 4JF Y 101 19.254 37.279 29.499 1.00 0.00 C HETATM 606 C5H 4JF Y 101 25.149 39.406 29.799 1.00 0.00 C