USER MOD reduce.3.24.130724 H: found=0, std=0, add=195, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 196 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 1 PSO H3 : B 1 PSO C3 : B 12 DT C6 :(H bumps) USER MOD Single : A 1 DG O5' : rot 35:sc= 0.0652 USER MOD Single : A 4 DT C7 :methyl 150:sc= -1.97! (180deg=-1.97!) USER MOD Single : A 8 DC O3' : rot 180:sc= 0 USER MOD Single : B 1 PSO O14 : rot 180:sc= -0.43 USER MOD Single : B 9 DG O5' : rot -35:sc= 0.0317 USER MOD Single : B 12 DT C7 :methyl 150:sc= -1.49 (180deg=-1.49) USER MOD Single : B 16 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG A 1 -1.251 -10.663 9.240 1.00 0.00 O ATOM 2 C5' DG A 1 -0.112 -11.127 9.928 1.00 0.00 C ATOM 3 C4' DG A 1 1.149 -10.827 9.112 1.00 0.00 C ATOM 4 O4' DG A 1 0.983 -11.334 7.795 1.00 0.00 O ATOM 5 C3' DG A 1 1.436 -9.323 9.001 1.00 0.00 C ATOM 6 O3' DG A 1 2.828 -9.136 9.180 1.00 0.00 O ATOM 7 C2' DG A 1 0.965 -9.013 7.582 1.00 0.00 C ATOM 8 C1' DG A 1 1.277 -10.316 6.853 1.00 0.00 C ATOM 9 N9 DG A 1 0.450 -10.518 5.639 1.00 0.00 N ATOM 10 C8 DG A 1 -0.915 -10.452 5.521 1.00 0.00 C ATOM 11 N7 DG A 1 -1.370 -10.758 4.340 1.00 0.00 N ATOM 12 C5 DG A 1 -0.223 -11.065 3.614 1.00 0.00 C ATOM 13 C6 DG A 1 -0.074 -11.465 2.251 1.00 0.00 C ATOM 14 O6 DG A 1 -0.953 -11.647 1.412 1.00 0.00 O ATOM 15 N1 DG A 1 1.249 -11.658 1.890 1.00 0.00 N ATOM 16 C2 DG A 1 2.315 -11.471 2.738 1.00 0.00 C ATOM 17 N2 DG A 1 3.540 -11.671 2.265 1.00 0.00 N ATOM 18 N3 DG A 1 2.191 -11.092 4.015 1.00 0.00 N ATOM 19 C4 DG A 1 0.897 -10.911 4.395 1.00 0.00 C ATOM 0 H5' DG A 1 -0.195 -12.199 10.104 1.00 0.00 H new ATOM 0 H5'' DG A 1 -0.046 -10.648 10.905 1.00 0.00 H new ATOM 0 H4' DG A 1 1.984 -11.300 9.629 1.00 0.00 H new ATOM 0 H3' DG A 1 0.948 -8.678 9.732 1.00 0.00 H new ATOM 0 H2' DG A 1 -0.097 -8.771 7.548 1.00 0.00 H new ATOM 0 H2'' DG A 1 1.499 -8.166 7.151 1.00 0.00 H new ATOM 0 HO5' DG A 1 -1.121 -10.779 8.276 1.00 0.00 H new ATOM 0 H1' DG A 1 2.311 -10.316 6.508 1.00 0.00 H new ATOM 0 H8 DG A 1 -1.559 -10.169 6.340 1.00 0.00 H new ATOM 0 H1 DG A 1 1.445 -11.958 0.935 1.00 0.00 H new ATOM 0 H21 DG A 1 4.349 -11.539 2.872 1.00 0.00 H new ATOM 0 H22 DG A 1 3.672 -11.956 1.295 1.00 0.00 H new ATOM 32 P DC A 2 3.530 -7.685 9.169 1.00 0.00 P ATOM 33 OP1 DC A 2 4.481 -7.626 10.299 1.00 0.00 O ATOM 34 OP2 DC A 2 2.482 -6.651 9.033 1.00 0.00 O ATOM 35 O5' DC A 2 4.363 -7.742 7.793 1.00 0.00 O ATOM 36 C5' DC A 2 5.427 -8.661 7.643 1.00 0.00 C ATOM 37 C4' DC A 2 6.089 -8.516 6.272 1.00 0.00 C ATOM 38 O4' DC A 2 5.189 -8.879 5.246 1.00 0.00 O ATOM 39 C3' DC A 2 6.558 -7.084 5.997 1.00 0.00 C ATOM 40 O3' DC A 2 7.908 -7.205 5.593 1.00 0.00 O ATOM 41 C2' DC A 2 5.580 -6.583 4.920 1.00 0.00 C ATOM 42 C1' DC A 2 5.164 -7.883 4.239 1.00 0.00 C ATOM 43 N1 DC A 2 3.775 -7.862 3.705 1.00 0.00 N ATOM 44 C2 DC A 2 3.544 -8.289 2.402 1.00 0.00 C ATOM 45 O2 DC A 2 4.476 -8.557 1.649 1.00 0.00 O ATOM 46 N3 DC A 2 2.264 -8.415 1.949 1.00 0.00 N ATOM 47 C4 DC A 2 1.240 -8.095 2.751 1.00 0.00 C ATOM 48 N4 DC A 2 0.008 -8.301 2.307 1.00 0.00 N ATOM 49 C5 DC A 2 1.437 -7.710 4.112 1.00 0.00 C ATOM 50 C6 DC A 2 2.716 -7.618 4.541 1.00 0.00 C ATOM 0 H5' DC A 2 5.054 -9.678 7.764 1.00 0.00 H new ATOM 0 H5'' DC A 2 6.167 -8.497 8.427 1.00 0.00 H new ATOM 0 H4' DC A 2 6.955 -9.177 6.283 1.00 0.00 H new ATOM 0 H3' DC A 2 6.545 -6.372 6.823 1.00 0.00 H new ATOM 0 H2' DC A 2 4.728 -6.059 5.354 1.00 0.00 H new ATOM 0 H2'' DC A 2 6.058 -5.893 4.225 1.00 0.00 H new ATOM 0 H1' DC A 2 5.839 -8.054 3.401 1.00 0.00 H new ATOM 0 H41 DC A 2 -0.792 -8.067 2.895 1.00 0.00 H new ATOM 0 H42 DC A 2 -0.140 -8.693 1.377 1.00 0.00 H new ATOM 0 H5 DC A 2 0.604 -7.502 4.767 1.00 0.00 H new ATOM 0 H6 DC A 2 2.908 -7.345 5.568 1.00 0.00 H new ATOM 62 P DG A 3 8.877 -5.941 5.428 1.00 0.00 P ATOM 63 OP1 DG A 3 10.270 -6.430 5.345 1.00 0.00 O ATOM 64 OP2 DG A 3 8.505 -4.927 6.438 1.00 0.00 O ATOM 65 O5' DG A 3 8.415 -5.426 3.989 1.00 0.00 O ATOM 66 C5' DG A 3 8.676 -6.179 2.824 1.00 0.00 C ATOM 67 C4' DG A 3 8.027 -5.489 1.626 1.00 0.00 C ATOM 68 O4' DG A 3 6.689 -5.841 1.402 1.00 0.00 O ATOM 69 C3' DG A 3 8.051 -3.966 1.733 1.00 0.00 C ATOM 70 O3' DG A 3 8.431 -3.465 0.490 1.00 0.00 O ATOM 71 C2' DG A 3 6.600 -3.677 2.037 1.00 0.00 C ATOM 72 C1' DG A 3 6.002 -4.660 1.043 1.00 0.00 C ATOM 73 N9 DG A 3 4.595 -4.971 1.159 1.00 0.00 N ATOM 74 C8 DG A 3 3.856 -4.787 2.255 1.00 0.00 C ATOM 75 N7 DG A 3 2.616 -5.163 2.155 1.00 0.00 N ATOM 76 C5 DG A 3 2.540 -5.603 0.829 1.00 0.00 C ATOM 77 C6 DG A 3 1.426 -6.011 0.042 1.00 0.00 C ATOM 78 O6 DG A 3 0.269 -6.205 0.403 1.00 0.00 O ATOM 79 N1 DG A 3 1.757 -6.194 -1.290 1.00 0.00 N ATOM 80 C2 DG A 3 3.034 -6.140 -1.791 1.00 0.00 C ATOM 81 N2 DG A 3 3.227 -6.419 -3.074 1.00 0.00 N ATOM 82 N3 DG A 3 4.099 -5.826 -1.055 1.00 0.00 N ATOM 83 C4 DG A 3 3.771 -5.529 0.227 1.00 0.00 C ATOM 0 H5' DG A 3 8.283 -7.190 2.934 1.00 0.00 H new ATOM 0 H5'' DG A 3 9.751 -6.270 2.668 1.00 0.00 H new ATOM 0 H4' DG A 3 8.641 -5.841 0.797 1.00 0.00 H new ATOM 0 H3' DG A 3 8.731 -3.535 2.468 1.00 0.00 H new ATOM 0 H2' DG A 3 6.327 -3.891 3.070 1.00 0.00 H new ATOM 0 H2'' DG A 3 6.318 -2.643 1.841 1.00 0.00 H new ATOM 0 H1' DG A 3 6.097 -4.249 0.038 1.00 0.00 H new ATOM 0 H8 DG A 3 4.259 -4.357 3.160 1.00 0.00 H new ATOM 0 H1 DG A 3 0.998 -6.382 -1.945 1.00 0.00 H new ATOM 0 H21 DG A 3 4.167 -6.385 -3.467 1.00 0.00 H new ATOM 0 H22 DG A 3 2.435 -6.667 -3.667 1.00 0.00 H new ATOM 95 P DT A 4 9.944 -3.471 -0.019 1.00 0.00 P ATOM 96 OP1 DT A 4 10.122 -4.608 -0.945 1.00 0.00 O ATOM 97 OP2 DT A 4 10.828 -3.308 1.155 1.00 0.00 O ATOM 98 O5' DT A 4 9.872 -2.098 -0.826 1.00 0.00 O ATOM 99 C5' DT A 4 8.739 -1.784 -1.611 1.00 0.00 C ATOM 100 C4' DT A 4 7.558 -1.160 -0.825 1.00 0.00 C ATOM 101 O4' DT A 4 6.446 -2.052 -0.706 1.00 0.00 O ATOM 102 C3' DT A 4 7.774 -0.661 0.635 1.00 0.00 C ATOM 103 O3' DT A 4 9.018 0.037 0.831 1.00 0.00 O ATOM 104 C2' DT A 4 6.261 -0.349 0.678 1.00 0.00 C ATOM 105 C1' DT A 4 5.410 -1.256 -0.171 1.00 0.00 C ATOM 106 N1 DT A 4 4.212 -1.819 0.590 1.00 0.00 N ATOM 107 C2 DT A 4 3.219 -2.464 -0.140 1.00 0.00 C ATOM 108 O2 DT A 4 3.412 -2.844 -1.288 1.00 0.00 O ATOM 109 N3 DT A 4 1.989 -2.677 0.455 1.00 0.00 N ATOM 110 C4 DT A 4 1.581 -2.344 1.726 1.00 0.00 C ATOM 111 O4 DT A 4 0.512 -2.763 2.162 1.00 0.00 O ATOM 112 C5 DT A 4 2.476 -1.447 2.578 1.00 0.00 C ATOM 113 C7 DT A 4 2.685 -1.957 4.006 1.00 0.00 C ATOM 114 C6 DT A 4 3.802 -1.134 1.883 1.00 0.00 C ATOM 0 H5' DT A 4 8.391 -2.693 -2.102 1.00 0.00 H new ATOM 0 H5'' DT A 4 9.040 -1.092 -2.398 1.00 0.00 H new ATOM 0 H4' DT A 4 7.405 -0.287 -1.460 1.00 0.00 H new ATOM 0 H3' DT A 4 8.084 -1.108 1.579 1.00 0.00 H new ATOM 0 H2' DT A 4 5.919 -0.414 1.711 1.00 0.00 H new ATOM 0 H2'' DT A 4 6.106 0.680 0.355 1.00 0.00 H new ATOM 0 H1' DT A 4 4.798 -0.863 -0.983 1.00 0.00 H new ATOM 0 H3 DT A 4 1.292 -3.143 -0.126 1.00 0.00 H new ATOM 0 H71 DT A 4 3.664 -1.640 4.366 1.00 0.00 H new ATOM 0 H72 DT A 4 1.910 -1.549 4.655 1.00 0.00 H new ATOM 0 H73 DT A 4 2.630 -3.046 4.015 1.00 0.00 H new ATOM 0 H6 DT A 4 4.466 -0.405 2.324 1.00 0.00 H new ATOM 127 P DA A 5 9.800 1.108 -0.138 1.00 0.00 P ATOM 128 OP1 DA A 5 11.031 0.451 -0.624 1.00 0.00 O ATOM 129 OP2 DA A 5 9.907 2.374 0.618 1.00 0.00 O ATOM 130 O5' DA A 5 8.870 1.397 -1.414 1.00 0.00 O ATOM 131 C5' DA A 5 7.716 2.176 -1.253 1.00 0.00 C ATOM 132 C4' DA A 5 6.682 1.893 -2.359 1.00 0.00 C ATOM 133 O4' DA A 5 5.385 1.631 -1.836 1.00 0.00 O ATOM 134 C3' DA A 5 6.608 3.050 -3.321 1.00 0.00 C ATOM 135 O3' DA A 5 6.392 2.679 -4.672 1.00 0.00 O ATOM 136 C2' DA A 5 5.439 3.731 -2.711 1.00 0.00 C ATOM 137 C1' DA A 5 4.518 2.701 -2.150 1.00 0.00 C ATOM 138 N9 DA A 5 3.907 3.237 -0.914 1.00 0.00 N ATOM 139 C8 DA A 5 4.546 3.822 0.145 1.00 0.00 C ATOM 140 N7 DA A 5 3.780 4.219 1.115 1.00 0.00 N ATOM 141 C5 DA A 5 2.517 3.900 0.635 1.00 0.00 C ATOM 142 C6 DA A 5 1.228 4.090 1.149 1.00 0.00 C ATOM 143 N6 DA A 5 1.018 4.489 2.397 1.00 0.00 N ATOM 144 N1 DA A 5 0.186 3.923 0.328 1.00 0.00 N ATOM 145 C2 DA A 5 0.426 3.487 -0.899 1.00 0.00 C ATOM 146 N3 DA A 5 1.564 3.184 -1.486 1.00 0.00 N ATOM 147 C4 DA A 5 2.586 3.411 -0.643 1.00 0.00 C ATOM 0 H5' DA A 5 7.985 3.232 -1.267 1.00 0.00 H new ATOM 0 H5'' DA A 5 7.272 1.973 -0.278 1.00 0.00 H new ATOM 0 H4' DA A 5 7.020 0.997 -2.881 1.00 0.00 H new ATOM 0 H3' DA A 5 7.522 3.636 -3.420 1.00 0.00 H new ATOM 0 H2' DA A 5 5.767 4.411 -1.925 1.00 0.00 H new ATOM 0 H2'' DA A 5 4.921 4.333 -3.458 1.00 0.00 H new ATOM 0 H1' DA A 5 3.711 2.410 -2.822 1.00 0.00 H new ATOM 0 H8 DA A 5 5.619 3.946 0.172 1.00 0.00 H new ATOM 0 H61 DA A 5 0.065 4.617 2.738 1.00 0.00 H new ATOM 0 H62 DA A 5 1.809 4.668 3.015 1.00 0.00 H new ATOM 0 H2 DA A 5 -0.451 3.360 -1.516 1.00 0.00 H new ATOM 159 P DC A 6 6.408 3.773 -5.867 1.00 0.00 P ATOM 160 OP1 DC A 6 6.307 3.044 -7.149 1.00 0.00 O ATOM 161 OP2 DC A 6 7.557 4.672 -5.626 1.00 0.00 O ATOM 162 O5' DC A 6 5.052 4.633 -5.663 1.00 0.00 O ATOM 163 C5' DC A 6 3.789 4.109 -6.024 1.00 0.00 C ATOM 164 C4' DC A 6 2.629 4.975 -5.510 1.00 0.00 C ATOM 165 O4' DC A 6 2.481 4.903 -4.096 1.00 0.00 O ATOM 166 C3' DC A 6 2.719 6.478 -5.853 1.00 0.00 C ATOM 167 O3' DC A 6 1.662 6.796 -6.747 1.00 0.00 O ATOM 168 C2' DC A 6 2.553 7.113 -4.469 1.00 0.00 C ATOM 169 C1' DC A 6 1.741 6.058 -3.745 1.00 0.00 C ATOM 170 N1 DC A 6 1.683 6.367 -2.294 1.00 0.00 N ATOM 171 C2 DC A 6 0.454 6.708 -1.716 1.00 0.00 C ATOM 172 O2 DC A 6 -0.596 6.687 -2.354 1.00 0.00 O ATOM 173 N3 DC A 6 0.408 7.076 -0.407 1.00 0.00 N ATOM 174 C4 DC A 6 1.536 7.165 0.299 1.00 0.00 C ATOM 175 N4 DC A 6 1.463 7.448 1.590 1.00 0.00 N ATOM 176 C5 DC A 6 2.794 6.791 -0.256 1.00 0.00 C ATOM 177 C6 DC A 6 2.827 6.392 -1.540 1.00 0.00 C ATOM 0 H5' DC A 6 3.690 3.099 -5.625 1.00 0.00 H new ATOM 0 H5'' DC A 6 3.728 4.031 -7.109 1.00 0.00 H new ATOM 0 H4' DC A 6 1.776 4.544 -6.035 1.00 0.00 H new ATOM 0 H3' DC A 6 3.630 6.813 -6.349 1.00 0.00 H new ATOM 0 H2' DC A 6 3.512 7.296 -3.984 1.00 0.00 H new ATOM 0 H2'' DC A 6 2.032 8.069 -4.517 1.00 0.00 H new ATOM 0 H1' DC A 6 0.687 5.966 -4.005 1.00 0.00 H new ATOM 0 H41 DC A 6 2.316 7.520 2.145 1.00 0.00 H new ATOM 0 H42 DC A 6 0.554 7.594 2.029 1.00 0.00 H new ATOM 0 H5 DC A 6 3.696 6.827 0.338 1.00 0.00 H new ATOM 0 H6 DC A 6 3.765 6.088 -1.981 1.00 0.00 H new ATOM 189 P DG A 7 1.292 8.308 -7.196 1.00 0.00 P ATOM 190 OP1 DG A 7 0.946 8.278 -8.633 1.00 0.00 O ATOM 191 OP2 DG A 7 2.361 9.214 -6.722 1.00 0.00 O ATOM 192 O5' DG A 7 -0.054 8.616 -6.348 1.00 0.00 O ATOM 193 C5' DG A 7 -1.245 7.911 -6.644 1.00 0.00 C ATOM 194 C4' DG A 7 -2.481 8.371 -5.860 1.00 0.00 C ATOM 195 O4' DG A 7 -2.215 8.306 -4.470 1.00 0.00 O ATOM 196 C3' DG A 7 -2.918 9.808 -6.175 1.00 0.00 C ATOM 197 O3' DG A 7 -4.336 9.868 -6.119 1.00 0.00 O ATOM 198 C2' DG A 7 -2.228 10.560 -5.056 1.00 0.00 C ATOM 199 C1' DG A 7 -2.426 9.584 -3.898 1.00 0.00 C ATOM 200 N9 DG A 7 -1.464 9.799 -2.804 1.00 0.00 N ATOM 201 C8 DG A 7 -0.107 9.942 -2.897 1.00 0.00 C ATOM 202 N7 DG A 7 0.494 10.083 -1.748 1.00 0.00 N ATOM 203 C5 DG A 7 -0.543 9.985 -0.818 1.00 0.00 C ATOM 204 C6 DG A 7 -0.525 10.012 0.610 1.00 0.00 C ATOM 205 O6 DG A 7 0.420 10.247 1.357 1.00 0.00 O ATOM 206 N1 DG A 7 -1.763 9.731 1.171 1.00 0.00 N ATOM 207 C2 DG A 7 -2.915 9.573 0.448 1.00 0.00 C ATOM 208 N2 DG A 7 -4.049 9.362 1.108 1.00 0.00 N ATOM 209 N3 DG A 7 -2.962 9.620 -0.885 1.00 0.00 N ATOM 210 C4 DG A 7 -1.740 9.786 -1.458 1.00 0.00 C ATOM 0 H5' DG A 7 -1.081 6.852 -6.447 1.00 0.00 H new ATOM 0 H5'' DG A 7 -1.452 8.008 -7.710 1.00 0.00 H new ATOM 0 H4' DG A 7 -3.286 7.700 -6.161 1.00 0.00 H new ATOM 0 H3' DG A 7 -2.660 10.205 -7.157 1.00 0.00 H new ATOM 0 H2' DG A 7 -1.175 10.743 -5.268 1.00 0.00 H new ATOM 0 H2'' DG A 7 -2.687 11.530 -4.864 1.00 0.00 H new ATOM 0 H1' DG A 7 -3.414 9.709 -3.454 1.00 0.00 H new ATOM 0 H8 DG A 7 0.421 9.938 -3.839 1.00 0.00 H new ATOM 0 H1 DG A 7 -1.818 9.636 2.185 1.00 0.00 H new ATOM 0 H21 DG A 7 -4.922 9.241 0.595 1.00 0.00 H new ATOM 0 H22 DG A 7 -4.046 9.321 2.127 1.00 0.00 H new ATOM 222 P DC A 8 -5.170 11.204 -6.479 1.00 0.00 P ATOM 223 OP1 DC A 8 -6.319 10.811 -7.322 1.00 0.00 O ATOM 224 OP2 DC A 8 -4.218 12.225 -6.967 1.00 0.00 O ATOM 225 O5' DC A 8 -5.722 11.681 -5.043 1.00 0.00 O ATOM 226 C5' DC A 8 -6.872 11.084 -4.473 1.00 0.00 C ATOM 227 C4' DC A 8 -7.050 11.552 -3.026 1.00 0.00 C ATOM 228 O4' DC A 8 -5.923 11.199 -2.254 1.00 0.00 O ATOM 229 C3' DC A 8 -7.161 13.065 -2.864 1.00 0.00 C ATOM 230 O3' DC A 8 -8.458 13.539 -3.155 1.00 0.00 O ATOM 231 C2' DC A 8 -6.811 13.224 -1.389 1.00 0.00 C ATOM 232 C1' DC A 8 -5.897 12.024 -1.099 1.00 0.00 C ATOM 233 N1 DC A 8 -4.502 12.456 -0.811 1.00 0.00 N ATOM 234 C2 DC A 8 -4.115 12.612 0.517 1.00 0.00 C ATOM 235 O2 DC A 8 -4.929 12.512 1.432 1.00 0.00 O ATOM 236 N3 DC A 8 -2.811 12.880 0.806 1.00 0.00 N ATOM 237 C4 DC A 8 -1.925 13.042 -0.181 1.00 0.00 C ATOM 238 N4 DC A 8 -0.651 13.218 0.143 1.00 0.00 N ATOM 239 C5 DC A 8 -2.301 12.942 -1.559 1.00 0.00 C ATOM 240 C6 DC A 8 -3.595 12.644 -1.821 1.00 0.00 C ATOM 0 H5' DC A 8 -6.779 9.998 -4.503 1.00 0.00 H new ATOM 0 H5'' DC A 8 -7.754 11.345 -5.058 1.00 0.00 H new ATOM 0 H4' DC A 8 -7.975 11.073 -2.706 1.00 0.00 H new ATOM 0 H3' DC A 8 -6.524 13.635 -3.541 1.00 0.00 H new ATOM 0 H2' DC A 8 -6.303 14.169 -1.198 1.00 0.00 H new ATOM 0 H2'' DC A 8 -7.703 13.209 -0.762 1.00 0.00 H new ATOM 0 HO3' DC A 8 -8.485 14.511 -3.037 1.00 0.00 H new ATOM 0 H1' DC A 8 -6.250 11.489 -0.217 1.00 0.00 H new ATOM 0 H41 DC A 8 0.049 13.344 -0.589 1.00 0.00 H new ATOM 0 H42 DC A 8 -0.371 13.227 1.124 1.00 0.00 H new ATOM 0 H5 DC A 8 -1.585 13.097 -2.353 1.00 0.00 H new ATOM 0 H6 DC A 8 -3.919 12.552 -2.847 1.00 0.00 H new TER 253 DC A 8 ATOM 254 O5' DG B 9 0.036 13.316 10.059 1.00 0.00 O ATOM 255 C5' DG B 9 0.246 11.950 10.338 1.00 0.00 C ATOM 256 C4' DG B 9 -1.108 11.234 10.322 1.00 0.00 C ATOM 257 O4' DG B 9 -1.758 11.419 9.074 1.00 0.00 O ATOM 258 C3' DG B 9 -0.980 9.721 10.476 1.00 0.00 C ATOM 259 O3' DG B 9 -2.230 9.286 10.978 1.00 0.00 O ATOM 260 C2' DG B 9 -0.672 9.311 9.032 1.00 0.00 C ATOM 261 C1' DG B 9 -1.474 10.326 8.210 1.00 0.00 C ATOM 262 N9 DG B 9 -0.802 10.859 6.998 1.00 0.00 N ATOM 263 C8 DG B 9 0.531 11.096 6.758 1.00 0.00 C ATOM 264 N7 DG B 9 0.779 11.662 5.611 1.00 0.00 N ATOM 265 C5 DG B 9 -0.478 11.823 5.039 1.00 0.00 C ATOM 266 C6 DG B 9 -0.857 12.360 3.771 1.00 0.00 C ATOM 267 O6 DG B 9 -0.140 12.867 2.913 1.00 0.00 O ATOM 268 N1 DG B 9 -2.219 12.269 3.534 1.00 0.00 N ATOM 269 C2 DG B 9 -3.127 11.788 4.447 1.00 0.00 C ATOM 270 N2 DG B 9 -4.411 11.766 4.107 1.00 0.00 N ATOM 271 N3 DG B 9 -2.789 11.308 5.649 1.00 0.00 N ATOM 272 C4 DG B 9 -1.450 11.342 5.881 1.00 0.00 C ATOM 0 H5' DG B 9 0.725 11.832 11.310 1.00 0.00 H new ATOM 0 H5'' DG B 9 0.915 11.511 9.598 1.00 0.00 H new ATOM 0 H4' DG B 9 -1.662 11.662 11.157 1.00 0.00 H new ATOM 0 H3' DG B 9 -0.229 9.312 11.152 1.00 0.00 H new ATOM 0 H2' DG B 9 0.395 9.368 8.815 1.00 0.00 H new ATOM 0 H2'' DG B 9 -0.985 8.287 8.827 1.00 0.00 H new ATOM 0 HO5' DG B 9 -0.695 13.409 9.412 1.00 0.00 H new ATOM 0 H1' DG B 9 -2.353 9.799 7.839 1.00 0.00 H new ATOM 0 H8 DG B 9 1.308 10.835 7.462 1.00 0.00 H new ATOM 0 H1 DG B 9 -2.569 12.578 2.627 1.00 0.00 H new ATOM 0 H21 DG B 9 -5.107 11.414 4.765 1.00 0.00 H new ATOM 0 H22 DG B 9 -4.701 12.101 3.188 1.00 0.00 H new ATOM 285 P DC B 10 -2.620 7.741 11.171 1.00 0.00 P ATOM 286 OP1 DC B 10 -3.456 7.621 12.384 1.00 0.00 O ATOM 287 OP2 DC B 10 -1.394 6.926 11.034 1.00 0.00 O ATOM 288 O5' DC B 10 -3.541 7.499 9.877 1.00 0.00 O ATOM 289 C5' DC B 10 -4.819 8.096 9.769 1.00 0.00 C ATOM 290 C4' DC B 10 -5.464 7.758 8.420 1.00 0.00 C ATOM 291 O4' DC B 10 -4.757 8.410 7.368 1.00 0.00 O ATOM 292 C3' DC B 10 -5.439 6.246 8.141 1.00 0.00 C ATOM 293 O3' DC B 10 -6.663 5.900 7.543 1.00 0.00 O ATOM 294 C2' DC B 10 -4.233 6.183 7.208 1.00 0.00 C ATOM 295 C1' DC B 10 -4.388 7.457 6.388 1.00 0.00 C ATOM 296 N1 DC B 10 -3.138 7.842 5.680 1.00 0.00 N ATOM 297 C2 DC B 10 -3.177 8.476 4.440 1.00 0.00 C ATOM 298 O2 DC B 10 -4.243 8.700 3.870 1.00 0.00 O ATOM 299 N3 DC B 10 -2.001 8.857 3.845 1.00 0.00 N ATOM 300 C4 DC B 10 -0.830 8.561 4.431 1.00 0.00 C ATOM 301 N4 DC B 10 0.296 9.007 3.890 1.00 0.00 N ATOM 302 C5 DC B 10 -0.771 7.855 5.670 1.00 0.00 C ATOM 303 C6 DC B 10 -1.939 7.525 6.231 1.00 0.00 C ATOM 0 H5' DC B 10 -4.731 9.177 9.874 1.00 0.00 H new ATOM 0 H5'' DC B 10 -5.458 7.748 10.580 1.00 0.00 H new ATOM 0 H4' DC B 10 -6.499 8.097 8.464 1.00 0.00 H new ATOM 0 H3' DC B 10 -5.344 5.561 8.983 1.00 0.00 H new ATOM 0 H2' DC B 10 -3.293 6.167 7.760 1.00 0.00 H new ATOM 0 H2'' DC B 10 -4.250 5.292 6.581 1.00 0.00 H new ATOM 0 H1' DC B 10 -5.115 7.355 5.583 1.00 0.00 H new ATOM 0 H41 DC B 10 1.192 8.789 4.325 1.00 0.00 H new ATOM 0 H42 DC B 10 0.266 9.568 3.039 1.00 0.00 H new ATOM 0 H5 DC B 10 0.171 7.600 6.132 1.00 0.00 H new ATOM 0 H6 DC B 10 -1.928 6.982 7.164 1.00 0.00 H new ATOM 315 P DG B 11 -7.092 4.378 7.285 1.00 0.00 P ATOM 316 OP1 DG B 11 -8.324 4.106 8.055 1.00 0.00 O ATOM 317 OP2 DG B 11 -5.905 3.511 7.446 1.00 0.00 O ATOM 318 O5' DG B 11 -7.446 4.466 5.728 1.00 0.00 O ATOM 319 C5' DG B 11 -8.413 5.381 5.260 1.00 0.00 C ATOM 320 C4' DG B 11 -8.533 5.268 3.742 1.00 0.00 C ATOM 321 O4' DG B 11 -7.375 5.816 3.142 1.00 0.00 O ATOM 322 C3' DG B 11 -8.654 3.810 3.293 1.00 0.00 C ATOM 323 O3' DG B 11 -9.638 3.775 2.278 1.00 0.00 O ATOM 324 C2' DG B 11 -7.228 3.471 2.850 1.00 0.00 C ATOM 325 C1' DG B 11 -6.675 4.829 2.408 1.00 0.00 C ATOM 326 N9 DG B 11 -5.238 4.998 2.703 1.00 0.00 N ATOM 327 C8 DG B 11 -4.599 4.792 3.899 1.00 0.00 C ATOM 328 N7 DG B 11 -3.369 5.210 3.931 1.00 0.00 N ATOM 329 C5 DG B 11 -3.158 5.688 2.643 1.00 0.00 C ATOM 330 C6 DG B 11 -1.974 6.201 2.048 1.00 0.00 C ATOM 331 O6 DG B 11 -0.892 6.399 2.586 1.00 0.00 O ATOM 332 N1 DG B 11 -2.120 6.488 0.706 1.00 0.00 N ATOM 333 C2 DG B 11 -3.296 6.358 0.012 1.00 0.00 C ATOM 334 N2 DG B 11 -3.263 6.613 -1.290 1.00 0.00 N ATOM 335 N3 DG B 11 -4.426 5.885 0.560 1.00 0.00 N ATOM 336 C4 DG B 11 -4.288 5.559 1.876 1.00 0.00 C ATOM 0 H5' DG B 11 -8.132 6.397 5.538 1.00 0.00 H new ATOM 0 H5'' DG B 11 -9.377 5.178 5.727 1.00 0.00 H new ATOM 0 H4' DG B 11 -9.430 5.807 3.439 1.00 0.00 H new ATOM 0 H3' DG B 11 -8.980 3.078 4.032 1.00 0.00 H new ATOM 0 H2' DG B 11 -6.643 3.042 3.664 1.00 0.00 H new ATOM 0 H2'' DG B 11 -7.219 2.747 2.035 1.00 0.00 H new ATOM 0 H1' DG B 11 -6.801 4.909 1.328 1.00 0.00 H new ATOM 0 H8 DG B 11 -5.079 4.321 4.744 1.00 0.00 H new ATOM 0 H1 DG B 11 -1.300 6.818 0.197 1.00 0.00 H new ATOM 0 H21 DG B 11 -4.113 6.530 -1.848 1.00 0.00 H new ATOM 0 H22 DG B 11 -2.388 6.892 -1.733 1.00 0.00 H new ATOM 348 P DT B 12 -10.219 2.398 1.692 1.00 0.00 P ATOM 349 OP1 DT B 12 -11.534 2.677 1.076 1.00 0.00 O ATOM 350 OP2 DT B 12 -10.096 1.357 2.735 1.00 0.00 O ATOM 351 O5' DT B 12 -9.158 2.095 0.535 1.00 0.00 O ATOM 352 C5' DT B 12 -9.126 2.878 -0.640 1.00 0.00 C ATOM 353 C4' DT B 12 -7.896 2.504 -1.464 1.00 0.00 C ATOM 354 O4' DT B 12 -6.699 2.861 -0.811 1.00 0.00 O ATOM 355 C3' DT B 12 -7.778 0.999 -1.704 1.00 0.00 C ATOM 356 O3' DT B 12 -8.530 0.676 -2.856 1.00 0.00 O ATOM 357 C2' DT B 12 -6.259 0.800 -1.805 1.00 0.00 C ATOM 358 C1' DT B 12 -5.671 2.186 -1.508 1.00 0.00 C ATOM 359 N1 DT B 12 -4.431 2.209 -0.695 1.00 0.00 N ATOM 360 C2 DT B 12 -3.450 3.176 -0.864 1.00 0.00 C ATOM 361 O2 DT B 12 -3.387 3.878 -1.867 1.00 0.00 O ATOM 362 N3 DT B 12 -2.533 3.316 0.161 1.00 0.00 N ATOM 363 C4 DT B 12 -2.494 2.599 1.330 1.00 0.00 C ATOM 364 O4 DT B 12 -1.804 2.976 2.271 1.00 0.00 O ATOM 365 C5 DT B 12 -3.321 1.324 1.442 1.00 0.00 C ATOM 366 C7 DT B 12 -4.250 1.312 2.661 1.00 0.00 C ATOM 367 C6 DT B 12 -4.231 1.102 0.253 1.00 0.00 C ATOM 0 H5' DT B 12 -9.098 3.937 -0.384 1.00 0.00 H new ATOM 0 H5'' DT B 12 -10.032 2.715 -1.224 1.00 0.00 H new ATOM 0 H4' DT B 12 -8.030 3.043 -2.402 1.00 0.00 H new ATOM 0 H3' DT B 12 -8.180 0.336 -0.938 1.00 0.00 H new ATOM 0 H2' DT B 12 -5.907 0.057 -1.089 1.00 0.00 H new ATOM 0 H2'' DT B 12 -5.969 0.450 -2.796 1.00 0.00 H new ATOM 0 H1' DT B 12 -5.366 2.642 -2.450 1.00 0.00 H new ATOM 0 H3 DT B 12 -1.811 4.025 0.035 1.00 0.00 H new ATOM 0 H71 DT B 12 -5.136 0.718 2.437 1.00 0.00 H new ATOM 0 H72 DT B 12 -3.727 0.877 3.513 1.00 0.00 H new ATOM 0 H73 DT B 12 -4.548 2.333 2.901 1.00 0.00 H new ATOM 0 H6 DT B 12 -4.723 0.152 0.104 1.00 0.00 H new ATOM 380 P DA B 13 -8.859 -0.843 -3.271 1.00 0.00 P ATOM 381 OP1 DA B 13 -9.927 -0.815 -4.293 1.00 0.00 O ATOM 382 OP2 DA B 13 -9.043 -1.634 -2.035 1.00 0.00 O ATOM 383 O5' DA B 13 -7.496 -1.305 -3.971 1.00 0.00 O ATOM 384 C5' DA B 13 -7.007 -0.629 -5.111 1.00 0.00 C ATOM 385 C4' DA B 13 -5.696 -1.283 -5.529 1.00 0.00 C ATOM 386 O4' DA B 13 -4.771 -1.270 -4.459 1.00 0.00 O ATOM 387 C3' DA B 13 -5.926 -2.735 -5.953 1.00 0.00 C ATOM 388 O3' DA B 13 -5.484 -2.857 -7.290 1.00 0.00 O ATOM 389 C2' DA B 13 -5.113 -3.498 -4.908 1.00 0.00 C ATOM 390 C1' DA B 13 -4.072 -2.497 -4.411 1.00 0.00 C ATOM 391 N9 DA B 13 -3.699 -2.782 -3.005 1.00 0.00 N ATOM 392 C8 DA B 13 -4.551 -2.808 -1.930 1.00 0.00 C ATOM 393 N7 DA B 13 -4.021 -3.283 -0.838 1.00 0.00 N ATOM 394 C5 DA B 13 -2.678 -3.409 -1.173 1.00 0.00 C ATOM 395 C6 DA B 13 -1.538 -3.689 -0.400 1.00 0.00 C ATOM 396 N6 DA B 13 -1.612 -4.063 0.873 1.00 0.00 N ATOM 397 N1 DA B 13 -0.329 -3.443 -0.917 1.00 0.00 N ATOM 398 C2 DA B 13 -0.243 -3.047 -2.176 1.00 0.00 C ATOM 399 N3 DA B 13 -1.228 -2.835 -3.049 1.00 0.00 N ATOM 400 C4 DA B 13 -2.448 -3.017 -2.468 1.00 0.00 C ATOM 0 H5' DA B 13 -6.851 0.427 -4.889 1.00 0.00 H new ATOM 0 H5'' DA B 13 -7.733 -0.680 -5.923 1.00 0.00 H new ATOM 0 H4' DA B 13 -5.298 -0.714 -6.369 1.00 0.00 H new ATOM 0 H3' DA B 13 -6.950 -3.109 -5.968 1.00 0.00 H new ATOM 0 H2' DA B 13 -5.746 -3.847 -4.092 1.00 0.00 H new ATOM 0 H2'' DA B 13 -4.639 -4.378 -5.342 1.00 0.00 H new ATOM 0 H1' DA B 13 -3.153 -2.518 -4.997 1.00 0.00 H new ATOM 0 H8 DA B 13 -5.573 -2.464 -1.984 1.00 0.00 H new ATOM 0 H61 DA B 13 -0.759 -4.257 1.398 1.00 0.00 H new ATOM 0 H62 DA B 13 -2.522 -4.156 1.325 1.00 0.00 H new ATOM 0 H2 DA B 13 0.757 -2.872 -2.545 1.00 0.00 H new ATOM 412 P DC B 14 -5.606 -4.221 -8.137 1.00 0.00 P ATOM 413 OP1 DC B 14 -5.969 -3.869 -9.526 1.00 0.00 O ATOM 414 OP2 DC B 14 -6.436 -5.177 -7.372 1.00 0.00 O ATOM 415 O5' DC B 14 -4.086 -4.726 -8.106 1.00 0.00 O ATOM 416 C5' DC B 14 -3.058 -3.933 -8.666 1.00 0.00 C ATOM 417 C4' DC B 14 -1.711 -4.444 -8.165 1.00 0.00 C ATOM 418 O4' DC B 14 -1.733 -4.478 -6.743 1.00 0.00 O ATOM 419 C3' DC B 14 -1.406 -5.866 -8.661 1.00 0.00 C ATOM 420 O3' DC B 14 -0.066 -5.878 -9.128 1.00 0.00 O ATOM 421 C2' DC B 14 -1.602 -6.668 -7.376 1.00 0.00 C ATOM 422 C1' DC B 14 -1.088 -5.669 -6.346 1.00 0.00 C ATOM 423 N1 DC B 14 -1.411 -6.040 -4.940 1.00 0.00 N ATOM 424 C2 DC B 14 -0.367 -6.145 -4.026 1.00 0.00 C ATOM 425 O2 DC B 14 0.805 -6.052 -4.380 1.00 0.00 O ATOM 426 N3 DC B 14 -0.646 -6.357 -2.714 1.00 0.00 N ATOM 427 C4 DC B 14 -1.900 -6.559 -2.312 1.00 0.00 C ATOM 428 N4 DC B 14 -2.116 -6.738 -1.017 1.00 0.00 N ATOM 429 C5 DC B 14 -2.999 -6.490 -3.226 1.00 0.00 C ATOM 430 C6 DC B 14 -2.702 -6.235 -4.521 1.00 0.00 C ATOM 0 H5' DC B 14 -3.193 -2.888 -8.386 1.00 0.00 H new ATOM 0 H5'' DC B 14 -3.097 -3.979 -9.754 1.00 0.00 H new ATOM 0 H4' DC B 14 -0.944 -3.771 -8.547 1.00 0.00 H new ATOM 0 H3' DC B 14 -2.012 -6.251 -9.481 1.00 0.00 H new ATOM 0 H2' DC B 14 -2.645 -6.936 -7.209 1.00 0.00 H new ATOM 0 H2'' DC B 14 -1.030 -7.596 -7.375 1.00 0.00 H new ATOM 0 H1' DC B 14 -0.000 -5.604 -6.332 1.00 0.00 H new ATOM 0 H41 DC B 14 -3.064 -6.895 -0.675 1.00 0.00 H new ATOM 0 H42 DC B 14 -1.334 -6.719 -0.362 1.00 0.00 H new ATOM 0 H5 DC B 14 -4.018 -6.635 -2.897 1.00 0.00 H new ATOM 0 H6 DC B 14 -3.503 -6.184 -5.244 1.00 0.00 H new ATOM 442 P DG B 15 0.517 -6.985 -10.154 1.00 0.00 P ATOM 443 OP1 DG B 15 1.659 -6.368 -10.860 1.00 0.00 O ATOM 444 OP2 DG B 15 -0.612 -7.533 -10.936 1.00 0.00 O ATOM 445 O5' DG B 15 1.096 -8.163 -9.217 1.00 0.00 O ATOM 446 C5' DG B 15 1.861 -7.875 -8.064 1.00 0.00 C ATOM 447 C4' DG B 15 2.880 -8.982 -7.742 1.00 0.00 C ATOM 448 O4' DG B 15 3.046 -8.971 -6.335 1.00 0.00 O ATOM 449 C3' DG B 15 2.480 -10.419 -8.119 1.00 0.00 C ATOM 450 O3' DG B 15 3.613 -11.267 -8.066 1.00 0.00 O ATOM 451 C2' DG B 15 1.496 -10.600 -6.988 1.00 0.00 C ATOM 452 C1' DG B 15 2.313 -10.059 -5.811 1.00 0.00 C ATOM 453 N9 DG B 15 1.460 -9.689 -4.668 1.00 0.00 N ATOM 454 C8 DG B 15 0.107 -9.539 -4.669 1.00 0.00 C ATOM 455 N7 DG B 15 -0.422 -9.330 -3.500 1.00 0.00 N ATOM 456 C5 DG B 15 0.680 -9.327 -2.646 1.00 0.00 C ATOM 457 C6 DG B 15 0.755 -9.176 -1.229 1.00 0.00 C ATOM 458 O6 DG B 15 -0.165 -8.999 -0.435 1.00 0.00 O ATOM 459 N1 DG B 15 2.055 -9.248 -0.751 1.00 0.00 N ATOM 460 C2 DG B 15 3.153 -9.505 -1.535 1.00 0.00 C ATOM 461 N2 DG B 15 4.342 -9.603 -0.956 1.00 0.00 N ATOM 462 N3 DG B 15 3.090 -9.702 -2.855 1.00 0.00 N ATOM 463 C4 DG B 15 1.834 -9.569 -3.352 1.00 0.00 C ATOM 0 H5' DG B 15 1.193 -7.741 -7.213 1.00 0.00 H new ATOM 0 H5'' DG B 15 2.387 -6.931 -8.207 1.00 0.00 H new ATOM 0 H4' DG B 15 3.766 -8.754 -8.335 1.00 0.00 H new ATOM 0 H3' DG B 15 2.086 -10.627 -9.114 1.00 0.00 H new ATOM 0 H2' DG B 15 0.576 -10.037 -7.146 1.00 0.00 H new ATOM 0 H2'' DG B 15 1.212 -11.643 -6.850 1.00 0.00 H new ATOM 0 H1' DG B 15 2.984 -10.814 -5.400 1.00 0.00 H new ATOM 0 H8 DG B 15 -0.482 -9.590 -5.573 1.00 0.00 H new ATOM 0 H1 DG B 15 2.205 -9.101 0.247 1.00 0.00 H new ATOM 0 H21 DG B 15 5.170 -9.793 -1.520 1.00 0.00 H new ATOM 0 H22 DG B 15 4.429 -9.488 0.054 1.00 0.00 H new ATOM 475 P DC B 16 3.520 -12.865 -8.284 1.00 0.00 P ATOM 476 OP1 DC B 16 4.550 -13.253 -9.271 1.00 0.00 O ATOM 477 OP2 DC B 16 2.105 -13.223 -8.519 1.00 0.00 O ATOM 478 O5' DC B 16 3.950 -13.428 -6.836 1.00 0.00 O ATOM 479 C5' DC B 16 5.280 -13.271 -6.384 1.00 0.00 C ATOM 480 C4' DC B 16 5.414 -13.594 -4.898 1.00 0.00 C ATOM 481 O4' DC B 16 4.636 -12.677 -4.165 1.00 0.00 O ATOM 482 C3' DC B 16 4.911 -14.972 -4.481 1.00 0.00 C ATOM 483 O3' DC B 16 5.877 -15.977 -4.698 1.00 0.00 O ATOM 484 C2' DC B 16 4.649 -14.742 -2.997 1.00 0.00 C ATOM 485 C1' DC B 16 4.364 -13.235 -2.893 1.00 0.00 C ATOM 486 N1 DC B 16 2.947 -12.968 -2.533 1.00 0.00 N ATOM 487 C2 DC B 16 2.637 -12.751 -1.194 1.00 0.00 C ATOM 488 O2 DC B 16 3.501 -12.798 -0.322 1.00 0.00 O ATOM 489 N3 DC B 16 1.351 -12.481 -0.843 1.00 0.00 N ATOM 490 C4 DC B 16 0.390 -12.459 -1.771 1.00 0.00 C ATOM 491 N4 DC B 16 -0.833 -12.118 -1.389 1.00 0.00 N ATOM 492 C5 DC B 16 0.674 -12.683 -3.157 1.00 0.00 C ATOM 493 C6 DC B 16 1.965 -12.925 -3.490 1.00 0.00 C ATOM 0 H5' DC B 16 5.607 -12.247 -6.565 1.00 0.00 H new ATOM 0 H5'' DC B 16 5.939 -13.922 -6.959 1.00 0.00 H new ATOM 0 H4' DC B 16 6.485 -13.549 -4.700 1.00 0.00 H new ATOM 0 H3' DC B 16 4.045 -15.323 -5.042 1.00 0.00 H new ATOM 0 H2' DC B 16 3.803 -15.332 -2.646 1.00 0.00 H new ATOM 0 H2'' DC B 16 5.510 -15.027 -2.392 1.00 0.00 H new ATOM 0 HO3' DC B 16 5.516 -16.844 -4.417 1.00 0.00 H new ATOM 0 H1' DC B 16 4.985 -12.797 -2.112 1.00 0.00 H new ATOM 0 H41 DC B 16 -1.591 -12.091 -2.071 1.00 0.00 H new ATOM 0 H42 DC B 16 -1.016 -11.883 -0.413 1.00 0.00 H new ATOM 0 H5 DC B 16 -0.106 -12.660 -3.903 1.00 0.00 H new ATOM 0 H6 DC B 16 2.225 -13.087 -4.526 1.00 0.00 H new TER 506 DC B 16 HETATM 507 O1 PSO B 1 -1.407 0.227 -1.615 1.00 0.00 O HETATM 508 C2 PSO B 1 -2.659 0.139 -1.546 1.00 0.00 C HETATM 509 C3 PSO B 1 -3.422 -0.073 -0.250 1.00 0.00 C HETATM 510 C4 PSO B 1 -2.607 0.026 1.002 1.00 0.00 C HETATM 511 C5 PSO B 1 -0.382 0.283 1.853 1.00 0.00 C HETATM 512 C6 PSO B 1 1.006 0.433 1.660 1.00 0.00 C HETATM 513 C7 PSO B 1 1.519 0.462 0.413 1.00 0.00 C HETATM 514 C8 PSO B 1 0.680 0.215 -0.678 1.00 0.00 C HETATM 515 C9 PSO B 1 -0.725 0.246 -0.538 1.00 0.00 C HETATM 516 C10 PSO B 1 -1.243 0.207 0.751 1.00 0.00 C HETATM 517 C4' PSO B 1 2.101 0.054 2.604 1.00 0.00 C HETATM 518 C5' PSO B 1 3.289 0.303 1.686 1.00 0.00 C HETATM 519 O6' PSO B 1 2.781 0.475 0.352 1.00 0.00 O HETATM 520 O11 PSO B 1 -3.295 0.227 -2.590 1.00 0.00 O HETATM 521 C12 PSO B 1 -2.893 -1.069 2.043 1.00 0.00 C HETATM 522 C13 PSO B 1 2.070 0.787 3.957 1.00 0.00 C HETATM 523 O14 PSO B 1 1.697 2.146 3.906 1.00 0.00 O HETATM 524 C15 PSO B 1 4.069 1.466 2.278 1.00 0.00 C HETATM 525 C16 PSO B 1 1.321 -0.097 -2.001 1.00 0.00 C HETATM 0 H163 PSO B 1 1.947 0.740 -2.308 1.00 0.00 H new HETATM 0 H162 PSO B 1 1.934 -0.993 -1.906 1.00 0.00 H new HETATM 0 H161 PSO B 1 0.547 -0.265 -2.750 1.00 0.00 H new HETATM 0 H153 PSO B 1 3.428 2.346 2.327 1.00 0.00 H new HETATM 0 H152 PSO B 1 4.405 1.205 3.282 1.00 0.00 H new HETATM 0 H151 PSO B 1 4.934 1.681 1.650 1.00 0.00 H new HETATM 0 H132 PSO B 1 1.379 0.264 4.618 1.00 0.00 H new HETATM 0 H131 PSO B 1 3.059 0.717 4.410 1.00 0.00 H new HETATM 0 H123 PSO B 1 -3.940 -1.020 2.344 1.00 0.00 H new HETATM 0 H122 PSO B 1 -2.685 -2.047 1.609 1.00 0.00 H new HETATM 0 H121 PSO B 1 -2.257 -0.917 2.915 1.00 0.00 H new HETATM 0 H5 PSO B 1 -0.787 0.226 2.863 1.00 0.00 H new HETATM 0 H14 PSO B 1 1.706 2.522 4.811 1.00 0.00 H new