USER MOD reduce.3.24.130724 H: found=0, std=0, add=321, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 349 hydrogens (99 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 101 PYB HN2 : A 101 PYB N : A 100 9U2 C81 :(H bumps) USER MOD NoAdj-H: A 102 PYB HN2 : A 102 PYB N : A 101 PYB C :(H bumps) USER MOD NoAdj-H: A 103 PYB HN2 : A 103 PYB N : A 102 PYB C :(H bumps) USER MOD NoAdj-H: A 105 IMT H : A 105 IMT N : A 104 ABU CD :(H bumps) USER MOD NoAdj-H: A 106 PYB HN2 : A 106 PYB N : A 105 IMT C :(H bumps) USER MOD NoAdj-H: A 107 PYB HN2 : A 107 PYB N : A 106 PYB C :(H bumps) USER MOD NoAdj-H: A 108 PYB HN2 : A 108 PYB N : A 107 PYB C :(H bumps) USER MOD Single : A 1 DCZ O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl -30:sc= -0.0268 (180deg=-0.781) USER MOD Single : A 6 DT C7 :methyl -30:sc= -0.658 (180deg=-1.54!) USER MOD Single : A 10 DT C7 :methyl 150:sc= -0.181 (180deg=-0.181) USER MOD Single : A 12 DG O3' : rot 180:sc= 0 USER MOD Single : B 13 DCZ O5' : rot 180:sc= 0 USER MOD Single : B 16 DT C7 :methyl 150:sc= -0.224 (180deg=-0.224) USER MOD Single : B 18 DT C7 :methyl 150:sc= -0.778 (180deg=-0.778) USER MOD Single : B 22 DT C7 :methyl 150:sc= -0.0225 (180deg=-0.0225) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 DCZ A 1 26.931 8.396 28.567 1.00 0.00 N HETATM 2 C2 DCZ A 1 25.599 7.966 28.605 1.00 0.00 C HETATM 3 N3 DCZ A 1 24.794 8.270 29.648 1.00 0.00 N HETATM 4 C4 DCZ A 1 25.281 9.018 30.614 1.00 0.00 C HETATM 5 C5 DCZ A 1 26.618 9.506 30.635 1.00 0.00 C HETATM 6 C6 DCZ A 1 27.422 9.176 29.589 1.00 0.00 C HETATM 7 O2 DCZ A 1 25.096 7.310 27.690 1.00 0.00 O HETATM 8 N4 DCZ A 1 24.447 9.278 31.581 1.00 0.00 N HETATM 9 C1' DCZ A 1 27.731 8.114 27.340 1.00 0.00 C HETATM 10 C2' DCZ A 1 27.672 9.302 26.379 1.00 0.00 C HETATM 11 C3' DCZ A 1 29.085 9.869 26.370 1.00 0.00 C HETATM 12 C4' DCZ A 1 29.880 8.591 26.653 1.00 0.00 C HETATM 13 O4' DCZ A 1 29.106 7.898 27.628 1.00 0.00 O HETATM 14 O3' DCZ A 1 29.396 10.455 25.111 1.00 0.00 O HETATM 15 C5' DCZ A 1 31.323 8.816 27.145 1.00 0.00 C HETATM 16 O5' DCZ A 1 31.417 9.559 28.364 1.00 0.00 O HETATM 0 HO51 DCZ A 1 32.359 9.660 28.614 1.00 0.00 H new HETATM 0 HN42 DCZ A 1 24.744 9.852 32.370 1.00 0.00 H new HETATM 0 HN41 DCZ A 1 23.497 8.908 31.549 1.00 0.00 H new HETATM 0 H5'2 DCZ A 1 31.803 7.847 27.285 1.00 0.00 H new HETATM 0 H5'1 DCZ A 1 31.882 9.339 26.369 1.00 0.00 H new HETATM 0 H2'2 DCZ A 1 27.366 8.988 25.381 1.00 0.00 H new HETATM 0 H2'1 DCZ A 1 26.950 10.046 26.715 1.00 0.00 H new HETATM 0 H6 DCZ A 1 28.453 9.529 29.560 1.00 0.00 H new HETATM 0 H5 DCZ A 1 26.983 10.121 31.458 1.00 0.00 H new HETATM 0 H4' DCZ A 1 30.022 8.033 25.728 1.00 0.00 H new HETATM 0 H3' DCZ A 1 29.279 10.677 27.075 1.00 0.00 H new HETATM 0 H1' DCZ A 1 27.298 7.215 26.902 1.00 0.00 H new ATOM 29 P DG A 2 28.832 11.906 24.679 1.00 0.00 P ATOM 30 OP1 DG A 2 29.588 12.341 23.478 1.00 0.00 O ATOM 31 OP2 DG A 2 28.834 12.783 25.875 1.00 0.00 O ATOM 32 O5' DG A 2 27.291 11.666 24.249 1.00 0.00 O ATOM 33 C5' DG A 2 26.938 10.891 23.106 1.00 0.00 C ATOM 34 C4' DG A 2 25.458 11.025 22.693 1.00 0.00 C ATOM 35 O4' DG A 2 24.568 10.547 23.704 1.00 0.00 O ATOM 36 C3' DG A 2 25.069 12.477 22.378 1.00 0.00 C ATOM 37 O3' DG A 2 24.204 12.523 21.246 1.00 0.00 O ATOM 38 C2' DG A 2 24.384 12.898 23.674 1.00 0.00 C ATOM 39 C1' DG A 2 23.731 11.606 24.167 1.00 0.00 C ATOM 40 N9 DG A 2 23.655 11.554 25.648 1.00 0.00 N ATOM 41 C8 DG A 2 24.708 11.571 26.527 1.00 0.00 C ATOM 42 N7 DG A 2 24.378 11.439 27.782 1.00 0.00 N ATOM 43 C5 DG A 2 22.979 11.396 27.740 1.00 0.00 C ATOM 44 C6 DG A 2 22.006 11.322 28.798 1.00 0.00 C ATOM 45 O6 DG A 2 22.183 11.215 30.010 1.00 0.00 O ATOM 46 N1 DG A 2 20.702 11.400 28.357 1.00 0.00 N ATOM 47 C2 DG A 2 20.353 11.473 27.050 1.00 0.00 C ATOM 48 N2 DG A 2 19.077 11.574 26.793 1.00 0.00 N ATOM 49 N3 DG A 2 21.214 11.512 26.031 1.00 0.00 N ATOM 50 C4 DG A 2 22.523 11.483 26.439 1.00 0.00 C ATOM 0 H5' DG A 2 27.155 9.842 23.309 1.00 0.00 H new ATOM 0 H5'' DG A 2 27.567 11.190 22.268 1.00 0.00 H new ATOM 0 H4' DG A 2 25.361 10.414 21.795 1.00 0.00 H new ATOM 0 H3' DG A 2 25.896 13.134 22.109 1.00 0.00 H new ATOM 0 H2' DG A 2 25.099 13.288 24.398 1.00 0.00 H new ATOM 0 H2'' DG A 2 23.645 13.681 23.502 1.00 0.00 H new ATOM 0 H1' DG A 2 22.709 11.534 23.794 1.00 0.00 H new ATOM 0 H8 DG A 2 25.732 11.685 26.204 1.00 0.00 H new ATOM 0 H1 DG A 2 19.958 11.403 29.054 1.00 0.00 H new ATOM 0 H21 DG A 2 18.754 11.633 25.827 1.00 0.00 H new ATOM 0 H22 DG A 2 18.403 11.594 27.558 1.00 0.00 H new ATOM 62 P DA A 3 23.968 13.882 20.403 1.00 0.00 P ATOM 63 OP1 DA A 3 23.397 13.509 19.086 1.00 0.00 O ATOM 64 OP2 DA A 3 25.211 14.694 20.438 1.00 0.00 O ATOM 65 O5' DA A 3 22.841 14.651 21.258 1.00 0.00 O ATOM 66 C5' DA A 3 21.472 14.268 21.190 1.00 0.00 C ATOM 67 C4' DA A 3 20.646 14.812 22.365 1.00 0.00 C ATOM 68 O4' DA A 3 21.054 14.222 23.592 1.00 0.00 O ATOM 69 C3' DA A 3 20.756 16.330 22.571 1.00 0.00 C ATOM 70 O3' DA A 3 19.762 17.052 21.849 1.00 0.00 O ATOM 71 C2' DA A 3 20.583 16.455 24.084 1.00 0.00 C ATOM 72 C1' DA A 3 20.525 15.032 24.623 1.00 0.00 C ATOM 73 N9 DA A 3 21.286 14.912 25.883 1.00 0.00 N ATOM 74 C8 DA A 3 22.648 14.930 26.065 1.00 0.00 C ATOM 75 N7 DA A 3 23.026 14.811 27.311 1.00 0.00 N ATOM 76 C5 DA A 3 21.806 14.746 28.002 1.00 0.00 C ATOM 77 C6 DA A 3 21.431 14.625 29.362 1.00 0.00 C ATOM 78 N6 DA A 3 22.276 14.497 30.364 1.00 0.00 N ATOM 79 N1 DA A 3 20.150 14.625 29.728 1.00 0.00 N ATOM 80 C2 DA A 3 19.227 14.723 28.782 1.00 0.00 C ATOM 81 N3 DA A 3 19.418 14.843 27.472 1.00 0.00 N ATOM 82 C4 DA A 3 20.742 14.837 27.144 1.00 0.00 C ATOM 0 H5' DA A 3 21.403 13.180 21.176 1.00 0.00 H new ATOM 0 H5'' DA A 3 21.045 14.627 20.254 1.00 0.00 H new ATOM 0 H4' DA A 3 19.619 14.561 22.099 1.00 0.00 H new ATOM 0 H3' DA A 3 21.690 16.753 22.201 1.00 0.00 H new ATOM 0 H2' DA A 3 21.413 17.006 24.527 1.00 0.00 H new ATOM 0 H2'' DA A 3 19.672 17.001 24.328 1.00 0.00 H new ATOM 0 H1' DA A 3 19.510 14.725 24.875 1.00 0.00 H new ATOM 0 H8 DA A 3 23.347 15.034 25.248 1.00 0.00 H new ATOM 0 H61 DA A 3 21.926 14.415 31.319 1.00 0.00 H new ATOM 0 H62 DA A 3 23.280 14.480 30.185 1.00 0.00 H new ATOM 0 H2 DA A 3 18.200 14.703 29.114 1.00 0.00 H new ATOM 94 P DT A 4 19.690 18.672 21.860 1.00 0.00 P ATOM 95 OP1 DT A 4 18.825 19.093 20.729 1.00 0.00 O ATOM 96 OP2 DT A 4 21.072 19.209 21.939 1.00 0.00 O ATOM 97 O5' DT A 4 18.932 19.020 23.244 1.00 0.00 O ATOM 98 C5' DT A 4 17.559 18.689 23.425 1.00 0.00 C ATOM 99 C4' DT A 4 17.093 18.734 24.889 1.00 0.00 C ATOM 100 O4' DT A 4 17.779 17.790 25.704 1.00 0.00 O ATOM 101 C3' DT A 4 17.297 20.079 25.591 1.00 0.00 C ATOM 102 O3' DT A 4 16.452 21.120 25.084 1.00 0.00 O ATOM 103 C2' DT A 4 17.105 19.617 27.039 1.00 0.00 C ATOM 104 C1' DT A 4 17.792 18.250 27.051 1.00 0.00 C ATOM 105 N1 DT A 4 19.179 18.311 27.604 1.00 0.00 N ATOM 106 C2 DT A 4 19.334 18.052 28.971 1.00 0.00 C ATOM 107 O2 DT A 4 18.392 17.939 29.758 1.00 0.00 O ATOM 108 N3 DT A 4 20.620 17.924 29.434 1.00 0.00 N ATOM 109 C4 DT A 4 21.767 18.089 28.697 1.00 0.00 C ATOM 110 O4 DT A 4 22.851 17.886 29.246 1.00 0.00 O ATOM 111 C5 DT A 4 21.541 18.483 27.305 1.00 0.00 C ATOM 112 C7 DT A 4 22.727 18.769 26.399 1.00 0.00 C ATOM 113 C6 DT A 4 20.277 18.585 26.808 1.00 0.00 C ATOM 0 H5' DT A 4 17.382 17.689 23.028 1.00 0.00 H new ATOM 0 H5'' DT A 4 16.950 19.377 22.839 1.00 0.00 H new ATOM 0 H4' DT A 4 16.028 18.518 24.798 1.00 0.00 H new ATOM 0 H3' DT A 4 18.249 20.589 25.442 1.00 0.00 H new ATOM 0 H2' DT A 4 17.563 20.307 27.748 1.00 0.00 H new ATOM 0 H2'' DT A 4 16.050 19.542 27.304 1.00 0.00 H new ATOM 0 H1' DT A 4 17.262 17.561 27.709 1.00 0.00 H new ATOM 0 H3 DT A 4 20.734 17.684 30.419 1.00 0.00 H new ATOM 0 H71 DT A 4 23.556 19.151 26.995 1.00 0.00 H new ATOM 0 H72 DT A 4 23.033 17.850 25.899 1.00 0.00 H new ATOM 0 H73 DT A 4 22.444 19.511 25.653 1.00 0.00 H new ATOM 0 H6 DT A 4 20.130 18.883 25.780 1.00 0.00 H new ATOM 126 P DG A 5 14.900 21.333 25.475 1.00 0.00 P ATOM 127 OP1 DG A 5 14.231 20.010 25.489 1.00 0.00 O ATOM 128 OP2 DG A 5 14.356 22.402 24.605 1.00 0.00 O ATOM 129 O5' DG A 5 14.960 21.900 26.976 1.00 0.00 O ATOM 130 C5' DG A 5 13.983 21.568 27.953 1.00 0.00 C ATOM 131 C4' DG A 5 14.162 22.343 29.272 1.00 0.00 C ATOM 132 O4' DG A 5 15.425 22.030 29.844 1.00 0.00 O ATOM 133 C3' DG A 5 14.132 23.872 29.094 1.00 0.00 C ATOM 134 O3' DG A 5 13.712 24.561 30.264 1.00 0.00 O ATOM 135 C2' DG A 5 15.607 24.190 28.885 1.00 0.00 C ATOM 136 C1' DG A 5 16.229 23.199 29.871 1.00 0.00 C ATOM 137 N9 DG A 5 17.624 22.797 29.590 1.00 0.00 N ATOM 138 C8 DG A 5 18.294 22.659 28.397 1.00 0.00 C ATOM 139 N7 DG A 5 19.465 22.082 28.505 1.00 0.00 N ATOM 140 C5 DG A 5 19.600 21.870 29.885 1.00 0.00 C ATOM 141 C6 DG A 5 20.657 21.293 30.678 1.00 0.00 C ATOM 142 O6 DG A 5 21.727 20.803 30.319 1.00 0.00 O ATOM 143 N1 DG A 5 20.417 21.339 32.038 1.00 0.00 N ATOM 144 C2 DG A 5 19.319 21.903 32.584 1.00 0.00 C ATOM 145 N2 DG A 5 19.328 22.103 33.868 1.00 0.00 N ATOM 146 N3 DG A 5 18.287 22.380 31.902 1.00 0.00 N ATOM 147 C4 DG A 5 18.491 22.342 30.551 1.00 0.00 C ATOM 0 H5' DG A 5 14.031 20.498 28.157 1.00 0.00 H new ATOM 0 H5'' DG A 5 12.991 21.772 27.550 1.00 0.00 H new ATOM 0 H4' DG A 5 13.326 22.044 29.904 1.00 0.00 H new ATOM 0 H3' DG A 5 13.446 24.169 28.300 1.00 0.00 H new ATOM 0 H2' DG A 5 15.930 24.017 27.859 1.00 0.00 H new ATOM 0 H2'' DG A 5 15.849 25.225 29.125 1.00 0.00 H new ATOM 0 H1' DG A 5 16.263 23.705 30.836 1.00 0.00 H new ATOM 0 H8 DG A 5 17.890 22.997 27.454 1.00 0.00 H new ATOM 0 H1 DG A 5 21.107 20.924 32.664 1.00 0.00 H new ATOM 0 H21 DG A 5 18.520 22.527 34.324 1.00 0.00 H new ATOM 0 H22 DG A 5 20.143 21.836 34.420 1.00 0.00 H new ATOM 159 P DT A 6 12.164 24.834 30.583 1.00 0.00 P ATOM 160 OP1 DT A 6 11.462 23.535 30.737 1.00 0.00 O ATOM 161 OP2 DT A 6 11.653 25.812 29.591 1.00 0.00 O ATOM 162 O5' DT A 6 12.225 25.568 32.018 1.00 0.00 O ATOM 163 C5' DT A 6 12.622 24.889 33.207 1.00 0.00 C ATOM 164 C4' DT A 6 13.910 25.446 33.837 1.00 0.00 C ATOM 165 O4' DT A 6 15.087 25.084 33.137 1.00 0.00 O ATOM 166 C3' DT A 6 13.975 26.971 33.996 1.00 0.00 C ATOM 167 O3' DT A 6 13.402 27.374 35.235 1.00 0.00 O ATOM 168 C2' DT A 6 15.482 27.248 33.910 1.00 0.00 C ATOM 169 C1' DT A 6 16.116 25.880 33.695 1.00 0.00 C ATOM 170 N1 DT A 6 17.327 25.869 32.839 1.00 0.00 N ATOM 171 C2 DT A 6 18.528 25.390 33.385 1.00 0.00 C ATOM 172 O2 DT A 6 18.699 25.151 34.580 1.00 0.00 O ATOM 173 N3 DT A 6 19.567 25.187 32.509 1.00 0.00 N ATOM 174 C4 DT A 6 19.502 25.393 31.151 1.00 0.00 C ATOM 175 O4 DT A 6 20.420 24.982 30.451 1.00 0.00 O ATOM 176 C5 DT A 6 18.304 26.086 30.682 1.00 0.00 C ATOM 177 C7 DT A 6 18.217 26.582 29.248 1.00 0.00 C ATOM 178 C6 DT A 6 17.259 26.286 31.526 1.00 0.00 C ATOM 0 H5' DT A 6 12.766 23.833 32.980 1.00 0.00 H new ATOM 0 H5'' DT A 6 11.815 24.951 33.937 1.00 0.00 H new ATOM 0 H4' DT A 6 13.866 24.983 34.823 1.00 0.00 H new ATOM 0 H3' DT A 6 13.410 27.528 33.249 1.00 0.00 H new ATOM 0 H2' DT A 6 15.714 27.925 33.088 1.00 0.00 H new ATOM 0 H2'' DT A 6 15.851 27.716 34.822 1.00 0.00 H new ATOM 0 H1' DT A 6 16.490 25.503 34.647 1.00 0.00 H new ATOM 0 H3 DT A 6 20.452 24.859 32.895 1.00 0.00 H new ATOM 0 H71 DT A 6 19.215 26.831 28.888 1.00 0.00 H new ATOM 0 H72 DT A 6 17.788 25.802 28.619 1.00 0.00 H new ATOM 0 H73 DT A 6 17.585 27.469 29.208 1.00 0.00 H new ATOM 0 H6 DT A 6 16.367 26.776 31.166 1.00 0.00 H new ATOM 191 P DA A 7 13.222 28.927 35.648 1.00 0.00 P ATOM 192 OP1 DA A 7 12.205 28.997 36.727 1.00 0.00 O ATOM 193 OP2 DA A 7 13.012 29.729 34.418 1.00 0.00 O ATOM 194 O5' DA A 7 14.654 29.329 36.273 1.00 0.00 O ATOM 195 C5' DA A 7 15.122 28.716 37.469 1.00 0.00 C ATOM 196 C4' DA A 7 16.606 28.991 37.757 1.00 0.00 C ATOM 197 O4' DA A 7 17.422 28.460 36.717 1.00 0.00 O ATOM 198 C3' DA A 7 16.959 30.477 37.924 1.00 0.00 C ATOM 199 O3' DA A 7 17.628 30.657 39.168 1.00 0.00 O ATOM 200 C2' DA A 7 17.827 30.738 36.692 1.00 0.00 C ATOM 201 C1' DA A 7 18.462 29.373 36.421 1.00 0.00 C ATOM 202 N9 DA A 7 18.851 29.191 35.003 1.00 0.00 N ATOM 203 C8 DA A 7 18.083 29.452 33.891 1.00 0.00 C ATOM 204 N7 DA A 7 18.651 29.157 32.754 1.00 0.00 N ATOM 205 C5 DA A 7 19.902 28.665 33.155 1.00 0.00 C ATOM 206 C6 DA A 7 21.023 28.152 32.464 1.00 0.00 C ATOM 207 N6 DA A 7 21.080 28.031 31.156 1.00 0.00 N ATOM 208 N1 DA A 7 22.101 27.706 33.108 1.00 0.00 N ATOM 209 C2 DA A 7 22.090 27.781 34.431 1.00 0.00 C ATOM 210 N3 DA A 7 21.125 28.236 35.228 1.00 0.00 N ATOM 211 C4 DA A 7 20.037 28.669 34.520 1.00 0.00 C ATOM 0 H5' DA A 7 14.966 27.639 37.401 1.00 0.00 H new ATOM 0 H5'' DA A 7 14.525 29.072 38.308 1.00 0.00 H new ATOM 0 H4' DA A 7 16.799 28.501 38.711 1.00 0.00 H new ATOM 0 H3' DA A 7 16.121 31.173 37.966 1.00 0.00 H new ATOM 0 H2' DA A 7 17.233 31.082 35.845 1.00 0.00 H new ATOM 0 H2'' DA A 7 18.580 31.502 36.884 1.00 0.00 H new ATOM 0 H1' DA A 7 19.372 29.245 37.007 1.00 0.00 H new ATOM 0 H8 DA A 7 17.088 29.868 33.955 1.00 0.00 H new ATOM 0 H61 DA A 7 21.918 27.653 30.715 1.00 0.00 H new ATOM 0 H62 DA A 7 20.286 28.315 30.582 1.00 0.00 H new ATOM 0 H2 DA A 7 22.981 27.427 34.928 1.00 0.00 H new ATOM 223 P DC A 8 18.141 32.093 39.698 1.00 0.00 P ATOM 224 OP1 DC A 8 18.126 32.064 41.182 1.00 0.00 O ATOM 225 OP2 DC A 8 17.401 33.170 38.995 1.00 0.00 O ATOM 226 O5' DC A 8 19.673 32.120 39.204 1.00 0.00 O ATOM 227 C5' DC A 8 20.595 31.158 39.702 1.00 0.00 C ATOM 228 C4' DC A 8 21.951 31.181 38.989 1.00 0.00 C ATOM 229 O4' DC A 8 21.781 30.892 37.606 1.00 0.00 O ATOM 230 C3' DC A 8 22.700 32.514 39.122 1.00 0.00 C ATOM 231 O3' DC A 8 23.962 32.295 39.750 1.00 0.00 O ATOM 232 C2' DC A 8 22.810 32.963 37.665 1.00 0.00 C ATOM 233 C1' DC A 8 22.704 31.665 36.864 1.00 0.00 C ATOM 234 N1 DC A 8 22.177 31.809 35.474 1.00 0.00 N ATOM 235 C2 DC A 8 22.883 31.261 34.390 1.00 0.00 C ATOM 236 O2 DC A 8 24.009 30.778 34.513 1.00 0.00 O ATOM 237 N3 DC A 8 22.342 31.238 33.144 1.00 0.00 N ATOM 238 C4 DC A 8 21.137 31.743 32.978 1.00 0.00 C ATOM 239 N4 DC A 8 20.644 31.675 31.777 1.00 0.00 N ATOM 240 C5 DC A 8 20.377 32.326 34.026 1.00 0.00 C ATOM 241 C6 DC A 8 20.931 32.346 35.263 1.00 0.00 C ATOM 0 H5' DC A 8 20.159 30.164 39.603 1.00 0.00 H new ATOM 0 H5'' DC A 8 20.751 31.333 40.766 1.00 0.00 H new ATOM 0 H4' DC A 8 22.556 30.419 39.481 1.00 0.00 H new ATOM 0 H3' DC A 8 22.215 33.268 39.742 1.00 0.00 H new ATOM 0 H2' DC A 8 22.014 33.660 37.402 1.00 0.00 H new ATOM 0 H2'' DC A 8 23.755 33.472 37.475 1.00 0.00 H new ATOM 0 H1' DC A 8 23.700 31.241 36.739 1.00 0.00 H new ATOM 0 H41 DC A 8 19.715 32.049 31.585 1.00 0.00 H new ATOM 0 H42 DC A 8 21.187 31.248 31.026 1.00 0.00 H new ATOM 0 H5 DC A 8 19.395 32.738 33.845 1.00 0.00 H new ATOM 0 H6 DC A 8 20.389 32.787 36.087 1.00 0.00 H new ATOM 253 P DA A 9 24.863 33.500 40.345 1.00 0.00 P ATOM 254 OP1 DA A 9 25.758 32.932 41.384 1.00 0.00 O ATOM 255 OP2 DA A 9 23.978 34.636 40.712 1.00 0.00 O ATOM 256 O5' DA A 9 25.765 33.956 39.091 1.00 0.00 O ATOM 257 C5' DA A 9 26.782 33.097 38.595 1.00 0.00 C ATOM 258 C4' DA A 9 27.208 33.422 37.159 1.00 0.00 C ATOM 259 O4' DA A 9 26.087 33.327 36.281 1.00 0.00 O ATOM 260 C3' DA A 9 27.835 34.813 36.972 1.00 0.00 C ATOM 261 O3' DA A 9 29.039 34.676 36.224 1.00 0.00 O ATOM 262 C2' DA A 9 26.715 35.548 36.234 1.00 0.00 C ATOM 263 C1' DA A 9 26.111 34.427 35.392 1.00 0.00 C ATOM 264 N9 DA A 9 24.734 34.724 34.926 1.00 0.00 N ATOM 265 C8 DA A 9 23.702 35.297 35.632 1.00 0.00 C ATOM 266 N7 DA A 9 22.586 35.420 34.965 1.00 0.00 N ATOM 267 C5 DA A 9 22.926 34.922 33.701 1.00 0.00 C ATOM 268 C6 DA A 9 22.243 34.791 32.468 1.00 0.00 C ATOM 269 N6 DA A 9 20.997 35.158 32.243 1.00 0.00 N ATOM 270 N1 DA A 9 22.841 34.266 31.403 1.00 0.00 N ATOM 271 C2 DA A 9 24.090 33.847 31.535 1.00 0.00 C ATOM 272 N3 DA A 9 24.865 33.900 32.612 1.00 0.00 N ATOM 273 C4 DA A 9 24.221 34.469 33.673 1.00 0.00 C ATOM 0 H5' DA A 9 26.429 32.067 38.637 1.00 0.00 H new ATOM 0 H5'' DA A 9 27.652 33.162 39.248 1.00 0.00 H new ATOM 0 H4' DA A 9 27.978 32.687 36.924 1.00 0.00 H new ATOM 0 H3' DA A 9 28.135 35.344 37.875 1.00 0.00 H new ATOM 0 H2' DA A 9 25.988 35.981 36.921 1.00 0.00 H new ATOM 0 H2'' DA A 9 27.096 36.362 35.618 1.00 0.00 H new ATOM 0 H1' DA A 9 26.688 34.262 34.482 1.00 0.00 H new ATOM 0 H8 DA A 9 23.806 35.620 36.657 1.00 0.00 H new ATOM 0 H61 DA A 9 20.585 35.025 31.319 1.00 0.00 H new ATOM 0 H62 DA A 9 20.445 35.575 32.993 1.00 0.00 H new ATOM 0 H2 DA A 9 24.535 33.406 30.655 1.00 0.00 H new ATOM 285 P DT A 10 29.977 35.929 35.839 1.00 0.00 P ATOM 286 OP1 DT A 10 31.352 35.417 35.608 1.00 0.00 O ATOM 287 OP2 DT A 10 29.775 37.010 36.837 1.00 0.00 O ATOM 288 O5' DT A 10 29.350 36.398 34.434 1.00 0.00 O ATOM 289 C5' DT A 10 29.519 35.598 33.274 1.00 0.00 C ATOM 290 C4' DT A 10 28.831 36.144 32.019 1.00 0.00 C ATOM 291 O4' DT A 10 27.424 35.994 32.046 1.00 0.00 O ATOM 292 C3' DT A 10 29.037 37.641 31.805 1.00 0.00 C ATOM 293 O3' DT A 10 30.363 37.931 31.387 1.00 0.00 O ATOM 294 C2' DT A 10 27.990 37.883 30.722 1.00 0.00 C ATOM 295 C1' DT A 10 26.900 36.849 31.038 1.00 0.00 C ATOM 296 N1 DT A 10 25.605 37.442 31.474 1.00 0.00 N ATOM 297 C2 DT A 10 24.631 37.640 30.492 1.00 0.00 C ATOM 298 O2 DT A 10 24.870 37.574 29.287 1.00 0.00 O ATOM 299 N3 DT A 10 23.362 37.935 30.927 1.00 0.00 N ATOM 300 C4 DT A 10 22.995 38.167 32.232 1.00 0.00 C ATOM 301 O4 DT A 10 21.808 38.377 32.480 1.00 0.00 O ATOM 302 C5 DT A 10 24.106 38.139 33.188 1.00 0.00 C ATOM 303 C7 DT A 10 23.873 38.507 34.644 1.00 0.00 C ATOM 304 C6 DT A 10 25.352 37.758 32.792 1.00 0.00 C ATOM 0 H5' DT A 10 29.134 34.599 33.478 1.00 0.00 H new ATOM 0 H5'' DT A 10 30.585 35.494 33.072 1.00 0.00 H new ATOM 0 H4' DT A 10 29.296 35.556 31.227 1.00 0.00 H new ATOM 0 H3' DT A 10 28.922 38.272 32.687 1.00 0.00 H new ATOM 0 H2' DT A 10 27.601 38.900 30.760 1.00 0.00 H new ATOM 0 H2'' DT A 10 28.404 37.737 29.724 1.00 0.00 H new ATOM 0 H1' DT A 10 26.660 36.308 30.123 1.00 0.00 H new ATOM 0 H3 DT A 10 22.628 37.986 30.221 1.00 0.00 H new ATOM 0 H71 DT A 10 24.573 37.958 35.274 1.00 0.00 H new ATOM 0 H72 DT A 10 24.027 39.578 34.778 1.00 0.00 H new ATOM 0 H73 DT A 10 22.852 38.249 34.926 1.00 0.00 H new ATOM 0 H6 DT A 10 26.150 37.703 33.518 1.00 0.00 H new ATOM 317 P DC A 11 31.090 39.320 31.766 1.00 0.00 P ATOM 318 OP1 DC A 11 32.532 39.190 31.434 1.00 0.00 O ATOM 319 OP2 DC A 11 30.707 39.722 33.142 1.00 0.00 O ATOM 320 O5' DC A 11 30.425 40.365 30.746 1.00 0.00 O ATOM 321 C5' DC A 11 30.696 40.312 29.352 1.00 0.00 C ATOM 322 C4' DC A 11 29.751 41.215 28.546 1.00 0.00 C ATOM 323 O4' DC A 11 28.407 40.780 28.759 1.00 0.00 O ATOM 324 C3' DC A 11 29.836 42.697 28.955 1.00 0.00 C ATOM 325 O3' DC A 11 29.691 43.560 27.838 1.00 0.00 O ATOM 326 C2' DC A 11 28.619 42.843 29.854 1.00 0.00 C ATOM 327 C1' DC A 11 27.634 41.903 29.146 1.00 0.00 C ATOM 328 N1 DC A 11 26.458 41.507 29.974 1.00 0.00 N ATOM 329 C2 DC A 11 25.202 41.427 29.354 1.00 0.00 C ATOM 330 O2 DC A 11 25.059 41.436 28.128 1.00 0.00 O ATOM 331 N3 DC A 11 24.074 41.338 30.094 1.00 0.00 N ATOM 332 C4 DC A 11 24.184 41.298 31.403 1.00 0.00 C ATOM 333 N4 DC A 11 23.066 41.278 32.063 1.00 0.00 N ATOM 334 C5 DC A 11 25.427 41.214 32.084 1.00 0.00 C ATOM 335 C6 DC A 11 26.551 41.309 31.333 1.00 0.00 C ATOM 0 H5' DC A 11 30.600 39.284 29.003 1.00 0.00 H new ATOM 0 H5'' DC A 11 31.728 40.615 29.172 1.00 0.00 H new ATOM 0 H4' DC A 11 30.051 41.137 27.501 1.00 0.00 H new ATOM 0 H3' DC A 11 30.790 42.954 29.415 1.00 0.00 H new ATOM 0 H2' DC A 11 28.822 42.535 30.880 1.00 0.00 H new ATOM 0 H2'' DC A 11 28.255 43.870 29.896 1.00 0.00 H new ATOM 0 H1' DC A 11 27.178 42.412 28.297 1.00 0.00 H new ATOM 0 H41 DC A 11 23.076 41.247 33.082 1.00 0.00 H new ATOM 0 H42 DC A 11 22.178 41.293 31.562 1.00 0.00 H new ATOM 0 H5 DC A 11 25.475 41.080 33.155 1.00 0.00 H new ATOM 0 H6 DC A 11 27.521 41.229 31.801 1.00 0.00 H new ATOM 347 P DG A 12 30.615 44.862 27.666 1.00 0.00 P ATOM 348 OP1 DG A 12 32.033 44.435 27.576 1.00 0.00 O ATOM 349 OP2 DG A 12 30.218 45.858 28.691 1.00 0.00 O ATOM 350 O5' DG A 12 30.147 45.413 26.230 1.00 0.00 O ATOM 351 C5' DG A 12 30.264 44.621 25.054 1.00 0.00 C ATOM 352 C4' DG A 12 28.950 44.567 24.255 1.00 0.00 C ATOM 353 O4' DG A 12 27.918 43.954 25.037 1.00 0.00 O ATOM 354 C3' DG A 12 28.439 45.957 23.833 1.00 0.00 C ATOM 355 O3' DG A 12 27.844 45.923 22.536 1.00 0.00 O ATOM 356 C2' DG A 12 27.382 46.238 24.894 1.00 0.00 C ATOM 357 C1' DG A 12 26.807 44.839 25.116 1.00 0.00 C ATOM 358 N9 DG A 12 26.099 44.721 26.416 1.00 0.00 N ATOM 359 C8 DG A 12 26.573 44.982 27.680 1.00 0.00 C ATOM 360 N7 DG A 12 25.676 44.873 28.627 1.00 0.00 N ATOM 361 C5 DG A 12 24.505 44.522 27.936 1.00 0.00 C ATOM 362 C6 DG A 12 23.153 44.286 28.389 1.00 0.00 C ATOM 363 O6 DG A 12 22.686 44.335 29.530 1.00 0.00 O ATOM 364 N1 DG A 12 22.275 43.985 27.367 1.00 0.00 N ATOM 365 C2 DG A 12 22.640 43.903 26.063 1.00 0.00 C ATOM 366 N2 DG A 12 21.700 43.654 25.193 1.00 0.00 N ATOM 367 N3 DG A 12 23.866 44.114 25.595 1.00 0.00 N ATOM 368 C4 DG A 12 24.763 44.419 26.582 1.00 0.00 C ATOM 0 H5' DG A 12 30.562 43.609 25.328 1.00 0.00 H new ATOM 0 H5'' DG A 12 31.055 45.026 24.422 1.00 0.00 H new ATOM 0 H4' DG A 12 29.175 43.989 23.358 1.00 0.00 H new ATOM 0 H3' DG A 12 29.227 46.708 23.771 1.00 0.00 H new ATOM 0 H2' DG A 12 27.813 46.655 25.804 1.00 0.00 H new ATOM 0 H2'' DG A 12 26.627 46.943 24.546 1.00 0.00 H new ATOM 0 HO3' DG A 12 27.528 46.819 22.297 1.00 0.00 H new ATOM 0 H1' DG A 12 26.052 44.602 24.367 1.00 0.00 H new ATOM 0 H8 DG A 12 27.600 45.254 27.875 1.00 0.00 H new ATOM 0 H1 DG A 12 21.298 43.815 27.606 1.00 0.00 H new ATOM 0 H21 DG A 12 21.928 43.584 24.201 1.00 0.00 H new ATOM 0 H22 DG A 12 20.737 43.530 25.505 1.00 0.00 H new TER 381 DG A 12 HETATM 382 N1 DCZ B 13 17.281 43.959 27.698 1.00 0.00 N HETATM 383 C2 DCZ B 13 18.666 43.869 27.514 1.00 0.00 C HETATM 384 N3 DCZ B 13 19.510 43.803 28.570 1.00 0.00 N HETATM 385 C4 DCZ B 13 18.987 43.781 29.779 1.00 0.00 C HETATM 386 C5 DCZ B 13 17.587 43.800 30.037 1.00 0.00 C HETATM 387 C6 DCZ B 13 16.757 43.884 28.965 1.00 0.00 C HETATM 388 O2 DCZ B 13 19.175 43.855 26.393 1.00 0.00 O HETATM 389 N4 DCZ B 13 19.850 43.779 30.753 1.00 0.00 N HETATM 390 C1' DCZ B 13 16.411 44.145 26.506 1.00 0.00 C HETATM 391 C2' DCZ B 13 15.851 42.819 26.004 1.00 0.00 C HETATM 392 C3' DCZ B 13 14.688 43.322 25.156 1.00 0.00 C HETATM 393 C4' DCZ B 13 14.179 44.504 25.995 1.00 0.00 C HETATM 394 O4' DCZ B 13 15.278 44.957 26.787 1.00 0.00 O HETATM 395 O3' DCZ B 13 15.169 43.764 23.887 1.00 0.00 O HETATM 396 C5' DCZ B 13 12.972 44.150 26.891 1.00 0.00 C HETATM 397 O5' DCZ B 13 13.217 43.083 27.809 1.00 0.00 O HETATM 0 HO51 DCZ B 13 12.411 42.918 28.341 1.00 0.00 H new HETATM 0 HN42 DCZ B 13 19.527 43.763 31.720 1.00 0.00 H new HETATM 0 HN41 DCZ B 13 20.849 43.794 30.549 1.00 0.00 H new HETATM 0 H5'2 DCZ B 13 12.678 45.037 27.452 1.00 0.00 H new HETATM 0 H5'1 DCZ B 13 12.128 43.881 26.255 1.00 0.00 H new HETATM 0 H2'2 DCZ B 13 16.578 42.255 25.420 1.00 0.00 H new HETATM 0 H2'1 DCZ B 13 15.523 42.171 26.817 1.00 0.00 H new HETATM 0 H6 DCZ B 13 15.677 43.892 29.110 1.00 0.00 H new HETATM 0 H5 DCZ B 13 17.197 43.749 31.054 1.00 0.00 H new HETATM 0 H4' DCZ B 13 13.815 45.282 25.324 1.00 0.00 H new HETATM 0 H3' DCZ B 13 13.922 42.576 24.944 1.00 0.00 H new HETATM 0 H1' DCZ B 13 17.054 44.616 25.762 1.00 0.00 H new ATOM 410 P DG B 14 14.956 42.867 22.571 1.00 0.00 P ATOM 411 OP1 DG B 14 15.724 43.491 21.463 1.00 0.00 O ATOM 412 OP2 DG B 14 13.501 42.628 22.398 1.00 0.00 O ATOM 413 O5' DG B 14 15.653 41.486 23.015 1.00 0.00 O ATOM 414 C5' DG B 14 16.740 40.898 22.312 1.00 0.00 C ATOM 415 C4' DG B 14 17.337 39.727 23.108 1.00 0.00 C ATOM 416 O4' DG B 14 18.084 40.205 24.230 1.00 0.00 O ATOM 417 C3' DG B 14 16.272 38.750 23.650 1.00 0.00 C ATOM 418 O3' DG B 14 16.542 37.405 23.298 1.00 0.00 O ATOM 419 C2' DG B 14 16.432 38.928 25.153 1.00 0.00 C ATOM 420 C1' DG B 14 17.924 39.252 25.264 1.00 0.00 C ATOM 421 N9 DG B 14 18.318 39.751 26.611 1.00 0.00 N ATOM 422 C8 DG B 14 17.518 39.956 27.713 1.00 0.00 C ATOM 423 N7 DG B 14 18.160 40.309 28.792 1.00 0.00 N ATOM 424 C5 DG B 14 19.497 40.354 28.379 1.00 0.00 C ATOM 425 C6 DG B 14 20.703 40.648 29.107 1.00 0.00 C ATOM 426 O6 DG B 14 20.847 40.900 30.304 1.00 0.00 O ATOM 427 N1 DG B 14 21.837 40.631 28.327 1.00 0.00 N ATOM 428 C2 DG B 14 21.842 40.308 27.013 1.00 0.00 C ATOM 429 N2 DG B 14 23.002 40.345 26.413 1.00 0.00 N ATOM 430 N3 DG B 14 20.762 39.974 26.306 1.00 0.00 N ATOM 431 C4 DG B 14 19.604 40.030 27.041 1.00 0.00 C ATOM 0 H5' DG B 14 17.509 41.649 22.129 1.00 0.00 H new ATOM 0 H5'' DG B 14 16.401 40.546 21.338 1.00 0.00 H new ATOM 0 H4' DG B 14 17.974 39.196 22.400 1.00 0.00 H new ATOM 0 H3' DG B 14 15.275 38.952 23.258 1.00 0.00 H new ATOM 0 H2' DG B 14 15.807 39.733 25.540 1.00 0.00 H new ATOM 0 H2'' DG B 14 16.166 38.026 25.704 1.00 0.00 H new ATOM 0 H1' DG B 14 18.574 38.384 25.154 1.00 0.00 H new ATOM 0 H8 DG B 14 16.445 39.834 27.686 1.00 0.00 H new ATOM 0 H1 DG B 14 22.725 40.876 28.765 1.00 0.00 H new ATOM 0 H21 DG B 14 23.071 40.112 25.422 1.00 0.00 H new ATOM 0 H22 DG B 14 23.838 40.607 26.935 1.00 0.00 H new ATOM 443 P DA B 15 15.872 36.741 21.996 1.00 0.00 P ATOM 444 OP1 DA B 15 15.801 37.756 20.915 1.00 0.00 O ATOM 445 OP2 DA B 15 14.624 36.063 22.424 1.00 0.00 O ATOM 446 O5' DA B 15 16.923 35.605 21.547 1.00 0.00 O ATOM 447 C5' DA B 15 18.234 35.930 21.087 1.00 0.00 C ATOM 448 C4' DA B 15 19.331 35.597 22.109 1.00 0.00 C ATOM 449 O4' DA B 15 19.218 36.359 23.300 1.00 0.00 O ATOM 450 C3' DA B 15 19.309 34.130 22.552 1.00 0.00 C ATOM 451 O3' DA B 15 20.026 33.318 21.628 1.00 0.00 O ATOM 452 C2' DA B 15 19.948 34.207 23.940 1.00 0.00 C ATOM 453 C1' DA B 15 19.967 35.692 24.293 1.00 0.00 C ATOM 454 N9 DA B 15 19.428 35.960 25.644 1.00 0.00 N ATOM 455 C8 DA B 15 18.130 35.924 26.099 1.00 0.00 C ATOM 456 N7 DA B 15 17.995 36.275 27.358 1.00 0.00 N ATOM 457 C5 DA B 15 19.320 36.527 27.762 1.00 0.00 C ATOM 458 C6 DA B 15 19.961 36.945 28.958 1.00 0.00 C ATOM 459 N6 DA B 15 19.370 37.236 30.101 1.00 0.00 N ATOM 460 N1 DA B 15 21.285 37.107 29.012 1.00 0.00 N ATOM 461 C2 DA B 15 21.987 36.848 27.917 1.00 0.00 C ATOM 462 N3 DA B 15 21.542 36.450 26.736 1.00 0.00 N ATOM 463 C4 DA B 15 20.189 36.319 26.725 1.00 0.00 C ATOM 0 H5' DA B 15 18.276 36.993 20.851 1.00 0.00 H new ATOM 0 H5'' DA B 15 18.432 35.390 20.161 1.00 0.00 H new ATOM 0 H4' DA B 15 20.255 35.829 21.579 1.00 0.00 H new ATOM 0 H3' DA B 15 18.322 33.669 22.585 1.00 0.00 H new ATOM 0 H2' DA B 15 19.373 33.637 24.670 1.00 0.00 H new ATOM 0 H2'' DA B 15 20.956 33.792 23.933 1.00 0.00 H new ATOM 0 H1' DA B 15 20.995 36.053 24.317 1.00 0.00 H new ATOM 0 H8 DA B 15 17.296 35.633 25.477 1.00 0.00 H new ATOM 0 H61 DA B 15 19.928 37.528 30.904 1.00 0.00 H new ATOM 0 H62 DA B 15 18.355 37.169 30.182 1.00 0.00 H new ATOM 0 H2 DA B 15 23.056 36.978 27.999 1.00 0.00 H new ATOM 475 P DT B 16 20.246 31.732 21.839 1.00 0.00 P ATOM 476 OP1 DT B 16 20.590 31.143 20.520 1.00 0.00 O ATOM 477 OP2 DT B 16 19.091 31.181 22.591 1.00 0.00 O ATOM 478 O5' DT B 16 21.550 31.671 22.786 1.00 0.00 O ATOM 479 C5' DT B 16 22.811 32.145 22.322 1.00 0.00 C ATOM 480 C4' DT B 16 23.844 32.296 23.446 1.00 0.00 C ATOM 481 O4' DT B 16 23.406 33.230 24.422 1.00 0.00 O ATOM 482 C3' DT B 16 24.150 30.984 24.172 1.00 0.00 C ATOM 483 O3' DT B 16 25.180 30.310 23.454 1.00 0.00 O ATOM 484 C2' DT B 16 24.623 31.511 25.525 1.00 0.00 C ATOM 485 C1' DT B 16 23.914 32.861 25.694 1.00 0.00 C ATOM 486 N1 DT B 16 22.792 32.859 26.683 1.00 0.00 N ATOM 487 C2 DT B 16 22.990 33.544 27.889 1.00 0.00 C ATOM 488 O2 DT B 16 24.058 34.050 28.224 1.00 0.00 O ATOM 489 N3 DT B 16 21.913 33.649 28.733 1.00 0.00 N ATOM 490 C4 DT B 16 20.649 33.173 28.491 1.00 0.00 C ATOM 491 O4 DT B 16 19.764 33.416 29.313 1.00 0.00 O ATOM 492 C5 DT B 16 20.508 32.429 27.238 1.00 0.00 C ATOM 493 C7 DT B 16 19.165 31.824 26.868 1.00 0.00 C ATOM 494 C6 DT B 16 21.567 32.286 26.392 1.00 0.00 C ATOM 0 H5' DT B 16 22.673 33.108 21.831 1.00 0.00 H new ATOM 0 H5'' DT B 16 23.198 31.457 21.570 1.00 0.00 H new ATOM 0 H4' DT B 16 24.750 32.642 22.949 1.00 0.00 H new ATOM 0 H3' DT B 16 23.333 30.268 24.263 1.00 0.00 H new ATOM 0 H2' DT B 16 24.361 30.824 26.330 1.00 0.00 H new ATOM 0 H2'' DT B 16 25.706 31.629 25.546 1.00 0.00 H new ATOM 0 H1' DT B 16 24.647 33.566 26.086 1.00 0.00 H new ATOM 0 H3 DT B 16 22.066 34.125 29.622 1.00 0.00 H new ATOM 0 H71 DT B 16 19.066 31.795 25.783 1.00 0.00 H new ATOM 0 H72 DT B 16 19.100 30.811 27.266 1.00 0.00 H new ATOM 0 H73 DT B 16 18.364 32.431 27.289 1.00 0.00 H new ATOM 0 H6 DT B 16 21.448 31.717 25.482 1.00 0.00 H new ATOM 507 P DG B 17 25.272 28.706 23.318 1.00 0.00 P ATOM 508 OP1 DG B 17 26.077 28.406 22.108 1.00 0.00 O ATOM 509 OP2 DG B 17 23.914 28.121 23.430 1.00 0.00 O ATOM 510 O5' DG B 17 26.116 28.241 24.606 1.00 0.00 O ATOM 511 C5' DG B 17 27.460 28.648 24.801 1.00 0.00 C ATOM 512 C4' DG B 17 28.178 27.919 25.950 1.00 0.00 C ATOM 513 O4' DG B 17 27.686 28.284 27.233 1.00 0.00 O ATOM 514 C3' DG B 17 28.116 26.388 25.898 1.00 0.00 C ATOM 515 O3' DG B 17 29.397 25.913 26.318 1.00 0.00 O ATOM 516 C2' DG B 17 26.903 26.107 26.798 1.00 0.00 C ATOM 517 C1' DG B 17 26.770 27.322 27.727 1.00 0.00 C ATOM 518 N9 DG B 17 25.402 27.927 27.841 1.00 0.00 N ATOM 519 C8 DG B 17 24.344 27.934 26.956 1.00 0.00 C ATOM 520 N7 DG B 17 23.310 28.639 27.339 1.00 0.00 N ATOM 521 C5 DG B 17 23.685 29.110 28.603 1.00 0.00 C ATOM 522 C6 DG B 17 22.993 29.926 29.572 1.00 0.00 C ATOM 523 O6 DG B 17 21.905 30.492 29.487 1.00 0.00 O ATOM 524 N1 DG B 17 23.668 30.059 30.769 1.00 0.00 N ATOM 525 C2 DG B 17 24.874 29.504 31.005 1.00 0.00 C ATOM 526 N2 DG B 17 25.372 29.630 32.200 1.00 0.00 N ATOM 527 N3 DG B 17 25.590 28.832 30.111 1.00 0.00 N ATOM 528 C4 DG B 17 24.941 28.644 28.926 1.00 0.00 C ATOM 0 H5' DG B 17 27.479 29.720 24.998 1.00 0.00 H new ATOM 0 H5'' DG B 17 28.015 28.484 23.878 1.00 0.00 H new ATOM 0 H4' DG B 17 29.208 28.243 25.803 1.00 0.00 H new ATOM 0 H3' DG B 17 27.962 25.883 24.944 1.00 0.00 H new ATOM 0 H2' DG B 17 26.000 25.971 26.203 1.00 0.00 H new ATOM 0 H2'' DG B 17 27.048 25.192 27.372 1.00 0.00 H new ATOM 0 H1' DG B 17 26.977 26.986 28.743 1.00 0.00 H new ATOM 0 H8 DG B 17 24.367 27.398 26.018 1.00 0.00 H new ATOM 0 H1 DG B 17 23.232 30.605 31.512 1.00 0.00 H new ATOM 0 H21 DG B 17 26.282 29.224 32.419 1.00 0.00 H new ATOM 0 H22 DG B 17 24.853 30.134 32.918 1.00 0.00 H new ATOM 540 P DT B 18 29.723 24.420 26.835 1.00 0.00 P ATOM 541 OP1 DT B 18 31.149 24.137 26.531 1.00 0.00 O ATOM 542 OP2 DT B 18 28.687 23.477 26.345 1.00 0.00 O ATOM 543 O5' DT B 18 29.570 24.595 28.429 1.00 0.00 O ATOM 544 C5' DT B 18 30.410 25.515 29.124 1.00 0.00 C ATOM 545 C4' DT B 18 30.047 25.681 30.602 1.00 0.00 C ATOM 546 O4' DT B 18 28.710 26.144 30.705 1.00 0.00 O ATOM 547 C3' DT B 18 30.177 24.391 31.422 1.00 0.00 C ATOM 548 O3' DT B 18 30.947 24.639 32.595 1.00 0.00 O ATOM 549 C2' DT B 18 28.722 24.037 31.724 1.00 0.00 C ATOM 550 C1' DT B 18 28.021 25.396 31.687 1.00 0.00 C ATOM 551 N1 DT B 18 26.580 25.387 31.300 1.00 0.00 N ATOM 552 C2 DT B 18 25.680 26.136 32.076 1.00 0.00 C ATOM 553 O2 DT B 18 25.936 26.597 33.184 1.00 0.00 O ATOM 554 N3 DT B 18 24.428 26.345 31.553 1.00 0.00 N ATOM 555 C4 DT B 18 24.008 25.916 30.318 1.00 0.00 C ATOM 556 O4 DT B 18 22.937 26.330 29.889 1.00 0.00 O ATOM 557 C5 DT B 18 24.917 24.997 29.638 1.00 0.00 C ATOM 558 C7 DT B 18 24.473 24.290 28.368 1.00 0.00 C ATOM 559 C6 DT B 18 26.163 24.777 30.133 1.00 0.00 C ATOM 0 H5' DT B 18 30.354 26.487 28.634 1.00 0.00 H new ATOM 0 H5'' DT B 18 31.444 25.179 29.048 1.00 0.00 H new ATOM 0 H4' DT B 18 30.759 26.396 31.013 1.00 0.00 H new ATOM 0 H3' DT B 18 30.694 23.576 30.916 1.00 0.00 H new ATOM 0 H2' DT B 18 28.312 23.351 30.983 1.00 0.00 H new ATOM 0 H2'' DT B 18 28.617 23.556 32.696 1.00 0.00 H new ATOM 0 H1' DT B 18 28.043 25.795 32.701 1.00 0.00 H new ATOM 0 H3 DT B 18 23.758 26.858 32.126 1.00 0.00 H new ATOM 0 H71 DT B 18 25.340 24.102 27.734 1.00 0.00 H new ATOM 0 H72 DT B 18 24.000 23.342 28.626 1.00 0.00 H new ATOM 0 H73 DT B 18 23.761 24.917 27.832 1.00 0.00 H new ATOM 0 H6 DT B 18 26.836 24.116 29.607 1.00 0.00 H new ATOM 572 P DA B 19 31.701 23.453 33.402 1.00 0.00 P ATOM 573 OP1 DA B 19 32.837 24.059 34.140 1.00 0.00 O ATOM 574 OP2 DA B 19 31.980 22.332 32.470 1.00 0.00 O ATOM 575 O5' DA B 19 30.601 22.953 34.470 1.00 0.00 O ATOM 576 C5' DA B 19 30.342 23.714 35.642 1.00 0.00 C ATOM 577 C4' DA B 19 28.981 23.418 36.279 1.00 0.00 C ATOM 578 O4' DA B 19 27.935 23.721 35.368 1.00 0.00 O ATOM 579 C3' DA B 19 28.756 21.991 36.802 1.00 0.00 C ATOM 580 O3' DA B 19 28.626 22.046 38.222 1.00 0.00 O ATOM 581 C2' DA B 19 27.472 21.581 36.072 1.00 0.00 C ATOM 582 C1' DA B 19 26.827 22.912 35.687 1.00 0.00 C ATOM 583 N9 DA B 19 25.968 22.833 34.483 1.00 0.00 N ATOM 584 C8 DA B 19 26.295 22.283 33.267 1.00 0.00 C ATOM 585 N7 DA B 19 25.397 22.448 32.336 1.00 0.00 N ATOM 586 C5 DA B 19 24.378 23.135 33.012 1.00 0.00 C ATOM 587 C6 DA B 19 23.107 23.626 32.640 1.00 0.00 C ATOM 588 N6 DA B 19 22.607 23.512 31.431 1.00 0.00 N ATOM 589 N1 DA B 19 22.328 24.285 33.496 1.00 0.00 N ATOM 590 C2 DA B 19 22.787 24.449 34.728 1.00 0.00 C ATOM 591 N3 DA B 19 23.950 24.045 35.236 1.00 0.00 N ATOM 592 C4 DA B 19 24.714 23.386 34.315 1.00 0.00 C ATOM 0 H5' DA B 19 30.395 24.774 35.395 1.00 0.00 H new ATOM 0 H5'' DA B 19 31.126 23.517 36.373 1.00 0.00 H new ATOM 0 H4' DA B 19 28.974 24.060 37.160 1.00 0.00 H new ATOM 0 H3' DA B 19 29.557 21.275 36.619 1.00 0.00 H new ATOM 0 H2' DA B 19 27.689 20.973 35.194 1.00 0.00 H new ATOM 0 H2'' DA B 19 26.818 20.991 36.714 1.00 0.00 H new ATOM 0 H1' DA B 19 26.185 23.270 36.492 1.00 0.00 H new ATOM 0 H8 DA B 19 27.222 21.756 33.096 1.00 0.00 H new ATOM 0 H61 DA B 19 21.682 23.888 31.224 1.00 0.00 H new ATOM 0 H62 DA B 19 23.144 23.047 30.699 1.00 0.00 H new ATOM 0 H2 DA B 19 22.135 24.978 35.407 1.00 0.00 H new ATOM 604 P DC B 20 28.385 20.742 39.149 1.00 0.00 P ATOM 605 OP1 DC B 20 28.892 21.054 40.509 1.00 0.00 O ATOM 606 OP2 DC B 20 28.909 19.545 38.446 1.00 0.00 O ATOM 607 O5' DC B 20 26.778 20.628 39.219 1.00 0.00 O ATOM 608 C5' DC B 20 26.005 21.659 39.823 1.00 0.00 C ATOM 609 C4' DC B 20 24.509 21.577 39.483 1.00 0.00 C ATOM 610 O4' DC B 20 24.326 21.663 38.071 1.00 0.00 O ATOM 611 C3' DC B 20 23.820 20.288 39.968 1.00 0.00 C ATOM 612 O3' DC B 20 22.657 20.590 40.741 1.00 0.00 O ATOM 613 C2' DC B 20 23.475 19.596 38.652 1.00 0.00 C ATOM 614 C1' DC B 20 23.277 20.785 37.710 1.00 0.00 C ATOM 615 N1 DC B 20 23.366 20.452 36.257 1.00 0.00 N ATOM 616 C2 DC B 20 22.350 20.871 35.385 1.00 0.00 C ATOM 617 O2 DC B 20 21.340 21.449 35.787 1.00 0.00 O ATOM 618 N3 DC B 20 22.444 20.653 34.048 1.00 0.00 N ATOM 619 C4 DC B 20 23.519 20.049 33.588 1.00 0.00 C ATOM 620 N4 DC B 20 23.594 19.889 32.298 1.00 0.00 N ATOM 621 C5 DC B 20 24.574 19.585 34.416 1.00 0.00 C ATOM 622 C6 DC B 20 24.461 19.797 35.751 1.00 0.00 C ATOM 0 H5' DC B 20 26.390 22.627 39.503 1.00 0.00 H new ATOM 0 H5'' DC B 20 26.128 21.609 40.905 1.00 0.00 H new ATOM 0 H4' DC B 20 24.048 22.414 40.008 1.00 0.00 H new ATOM 0 H3' DC B 20 24.433 19.672 40.626 1.00 0.00 H new ATOM 0 H2' DC B 20 24.276 18.937 38.315 1.00 0.00 H new ATOM 0 H2'' DC B 20 22.575 18.987 38.735 1.00 0.00 H new ATOM 0 H1' DC B 20 22.273 21.195 37.820 1.00 0.00 H new ATOM 0 H41 DC B 20 24.406 19.427 31.888 1.00 0.00 H new ATOM 0 H42 DC B 20 22.841 20.226 31.698 1.00 0.00 H new ATOM 0 H5 DC B 20 25.434 19.082 33.999 1.00 0.00 H new ATOM 0 H6 DC B 20 25.236 19.449 36.418 1.00 0.00 H new ATOM 634 P DA B 21 22.002 19.525 41.776 1.00 0.00 P ATOM 635 OP1 DA B 21 21.188 20.289 42.753 1.00 0.00 O ATOM 636 OP2 DA B 21 23.076 18.642 42.296 1.00 0.00 O ATOM 637 O5' DA B 21 21.005 18.621 40.878 1.00 0.00 O ATOM 638 C5' DA B 21 19.732 19.121 40.485 1.00 0.00 C ATOM 639 C4' DA B 21 19.163 18.489 39.207 1.00 0.00 C ATOM 640 O4' DA B 21 20.113 18.530 38.159 1.00 0.00 O ATOM 641 C3' DA B 21 18.638 17.048 39.285 1.00 0.00 C ATOM 642 O3' DA B 21 17.216 17.081 39.438 1.00 0.00 O ATOM 643 C2' DA B 21 19.076 16.457 37.938 1.00 0.00 C ATOM 644 C1' DA B 21 19.648 17.647 37.169 1.00 0.00 C ATOM 645 N9 DA B 21 20.759 17.312 36.252 1.00 0.00 N ATOM 646 C8 DA B 21 21.992 16.779 36.542 1.00 0.00 C ATOM 647 N7 DA B 21 22.756 16.588 35.495 1.00 0.00 N ATOM 648 C5 DA B 21 21.953 17.041 34.434 1.00 0.00 C ATOM 649 C6 DA B 21 22.096 17.139 33.026 1.00 0.00 C ATOM 650 N6 DA B 21 23.157 16.781 32.328 1.00 0.00 N ATOM 651 N1 DA B 21 21.124 17.646 32.268 1.00 0.00 N ATOM 652 C2 DA B 21 20.022 18.068 32.863 1.00 0.00 C ATOM 653 N3 DA B 21 19.733 18.040 34.157 1.00 0.00 N ATOM 654 C4 DA B 21 20.748 17.505 34.893 1.00 0.00 C ATOM 0 H5' DA B 21 19.809 20.198 40.338 1.00 0.00 H new ATOM 0 H5'' DA B 21 19.026 18.960 41.300 1.00 0.00 H new ATOM 0 H4' DA B 21 18.287 19.112 39.028 1.00 0.00 H new ATOM 0 H3' DA B 21 19.012 16.460 40.123 1.00 0.00 H new ATOM 0 H2' DA B 21 19.823 15.674 38.071 1.00 0.00 H new ATOM 0 H2'' DA B 21 18.235 16.009 37.409 1.00 0.00 H new ATOM 0 H1' DA B 21 18.872 18.061 36.525 1.00 0.00 H new ATOM 0 H8 DA B 21 22.305 16.538 37.547 1.00 0.00 H new ATOM 0 H61 DA B 21 23.162 16.892 31.314 1.00 0.00 H new ATOM 0 H62 DA B 21 23.972 16.393 32.802 1.00 0.00 H new ATOM 0 H2 DA B 21 19.265 18.487 32.217 1.00 0.00 H new ATOM 666 P DT B 22 16.324 15.775 39.786 1.00 0.00 P ATOM 667 OP1 DT B 22 15.123 16.244 40.522 1.00 0.00 O ATOM 668 OP2 DT B 22 17.196 14.761 40.429 1.00 0.00 O ATOM 669 O5' DT B 22 15.849 15.188 38.353 1.00 0.00 O ATOM 670 C5' DT B 22 14.688 15.693 37.691 1.00 0.00 C ATOM 671 C4' DT B 22 14.707 15.485 36.171 1.00 0.00 C ATOM 672 O4' DT B 22 15.972 15.835 35.625 1.00 0.00 O ATOM 673 C3' DT B 22 14.469 14.031 35.758 1.00 0.00 C ATOM 674 O3' DT B 22 13.080 13.750 35.604 1.00 0.00 O ATOM 675 C2' DT B 22 15.196 13.970 34.416 1.00 0.00 C ATOM 676 C1' DT B 22 16.087 15.206 34.364 1.00 0.00 C ATOM 677 N1 DT B 22 17.497 14.861 34.056 1.00 0.00 N ATOM 678 C2 DT B 22 17.946 15.027 32.740 1.00 0.00 C ATOM 679 O2 DT B 22 17.229 15.408 31.814 1.00 0.00 O ATOM 680 N3 DT B 22 19.261 14.728 32.498 1.00 0.00 N ATOM 681 C4 DT B 22 20.163 14.249 33.420 1.00 0.00 C ATOM 682 O4 DT B 22 21.323 14.063 33.065 1.00 0.00 O ATOM 683 C5 DT B 22 19.609 14.012 34.753 1.00 0.00 C ATOM 684 C7 DT B 22 20.476 13.418 35.848 1.00 0.00 C ATOM 685 C6 DT B 22 18.313 14.313 35.025 1.00 0.00 C ATOM 0 H5' DT B 22 14.594 16.758 37.902 1.00 0.00 H new ATOM 0 H5'' DT B 22 13.804 15.207 38.105 1.00 0.00 H new ATOM 0 H4' DT B 22 13.903 16.118 35.796 1.00 0.00 H new ATOM 0 H3' DT B 22 14.819 13.303 36.490 1.00 0.00 H new ATOM 0 H2' DT B 22 15.788 13.059 34.334 1.00 0.00 H new ATOM 0 H2'' DT B 22 14.487 13.965 33.588 1.00 0.00 H new ATOM 0 H1' DT B 22 15.770 15.873 33.563 1.00 0.00 H new ATOM 0 H3 DT B 22 19.602 14.874 31.548 1.00 0.00 H new ATOM 0 H71 DT B 22 20.139 13.784 36.818 1.00 0.00 H new ATOM 0 H72 DT B 22 20.399 12.331 35.824 1.00 0.00 H new ATOM 0 H73 DT B 22 21.514 13.711 35.690 1.00 0.00 H new ATOM 0 H6 DT B 22 17.916 14.121 36.011 1.00 0.00 H new ATOM 698 P DC B 23 12.521 12.249 35.386 1.00 0.00 P ATOM 699 OP1 DC B 23 11.040 12.310 35.455 1.00 0.00 O ATOM 700 OP2 DC B 23 13.239 11.341 36.313 1.00 0.00 O ATOM 701 O5' DC B 23 12.943 11.865 33.874 1.00 0.00 O ATOM 702 C5' DC B 23 12.361 12.526 32.754 1.00 0.00 C ATOM 703 C4' DC B 23 13.070 12.216 31.424 1.00 0.00 C ATOM 704 O4' DC B 23 14.458 12.562 31.468 1.00 0.00 O ATOM 705 C3' DC B 23 12.973 10.739 31.005 1.00 0.00 C ATOM 706 O3' DC B 23 12.512 10.678 29.659 1.00 0.00 O ATOM 707 C2' DC B 23 14.414 10.269 31.191 1.00 0.00 C ATOM 708 C1' DC B 23 15.198 11.531 30.832 1.00 0.00 C ATOM 709 N1 DC B 23 16.619 11.497 31.298 1.00 0.00 N ATOM 710 C2 DC B 23 17.656 11.685 30.370 1.00 0.00 C ATOM 711 O2 DC B 23 17.449 11.977 29.192 1.00 0.00 O ATOM 712 N3 DC B 23 18.951 11.536 30.736 1.00 0.00 N ATOM 713 C4 DC B 23 19.217 11.230 31.987 1.00 0.00 C ATOM 714 N4 DC B 23 20.474 11.080 32.278 1.00 0.00 N ATOM 715 C5 DC B 23 18.223 11.083 32.992 1.00 0.00 C ATOM 716 C6 DC B 23 16.928 11.216 32.608 1.00 0.00 C ATOM 0 H5' DC B 23 12.382 13.602 32.926 1.00 0.00 H new ATOM 0 H5'' DC B 23 11.313 12.236 32.675 1.00 0.00 H new ATOM 0 H4' DC B 23 12.544 12.826 30.689 1.00 0.00 H new ATOM 0 H3' DC B 23 12.276 10.117 31.567 1.00 0.00 H new ATOM 0 H2' DC B 23 14.610 9.942 32.212 1.00 0.00 H new ATOM 0 H2'' DC B 23 14.660 9.433 30.536 1.00 0.00 H new ATOM 0 H1' DC B 23 15.289 11.663 29.754 1.00 0.00 H new ATOM 0 H41 DC B 23 20.752 10.842 33.230 1.00 0.00 H new ATOM 0 H42 DC B 23 21.183 11.200 31.554 1.00 0.00 H new ATOM 0 H5 DC B 23 18.487 10.874 34.018 1.00 0.00 H new ATOM 0 H6 DC B 23 16.137 11.101 33.334 1.00 0.00 H new ATOM 728 P DG B 24 12.308 9.295 28.856 1.00 0.00 P ATOM 729 OP1 DG B 24 11.228 9.498 27.858 1.00 0.00 O ATOM 730 OP2 DG B 24 12.186 8.177 29.825 1.00 0.00 O ATOM 731 O5' DG B 24 13.706 9.137 28.073 1.00 0.00 O ATOM 732 C5' DG B 24 14.083 10.062 27.058 1.00 0.00 C ATOM 733 C4' DG B 24 15.408 9.703 26.371 1.00 0.00 C ATOM 734 O4' DG B 24 16.491 9.816 27.290 1.00 0.00 O ATOM 735 C3' DG B 24 15.434 8.267 25.809 1.00 0.00 C ATOM 736 O3' DG B 24 16.060 8.223 24.527 1.00 0.00 O ATOM 737 C2' DG B 24 16.293 7.547 26.844 1.00 0.00 C ATOM 738 C1' DG B 24 17.291 8.654 27.170 1.00 0.00 C ATOM 739 N9 DG B 24 18.067 8.411 28.406 1.00 0.00 N ATOM 740 C8 DG B 24 17.627 8.328 29.703 1.00 0.00 C ATOM 741 N7 DG B 24 18.580 8.175 30.587 1.00 0.00 N ATOM 742 C5 DG B 24 19.748 8.127 29.806 1.00 0.00 C ATOM 743 C6 DG B 24 21.142 7.985 30.155 1.00 0.00 C ATOM 744 O6 DG B 24 21.678 7.914 31.263 1.00 0.00 O ATOM 745 N1 DG B 24 21.976 7.920 29.056 1.00 0.00 N ATOM 746 C2 DG B 24 21.553 8.013 27.775 1.00 0.00 C ATOM 747 N2 DG B 24 22.456 7.943 26.838 1.00 0.00 N ATOM 748 N3 DG B 24 20.288 8.182 27.404 1.00 0.00 N ATOM 749 C4 DG B 24 19.429 8.230 28.468 1.00 0.00 C ATOM 0 H5' DG B 24 14.167 11.057 27.496 1.00 0.00 H new ATOM 0 H5'' DG B 24 13.294 10.109 26.308 1.00 0.00 H new ATOM 0 H4' DG B 24 15.506 10.405 25.543 1.00 0.00 H new ATOM 0 H3' DG B 24 14.443 7.836 25.663 1.00 0.00 H new ATOM 0 H2' DG B 24 15.720 7.232 27.716 1.00 0.00 H new ATOM 0 H2'' DG B 24 16.775 6.656 26.440 1.00 0.00 H new ATOM 0 HO3' DG B 24 16.064 7.301 24.196 1.00 0.00 H new ATOM 0 H1' DG B 24 18.053 8.730 26.395 1.00 0.00 H new ATOM 0 H8 DG B 24 16.582 8.384 29.972 1.00 0.00 H new ATOM 0 H1 DG B 24 22.975 7.794 29.221 1.00 0.00 H new ATOM 0 H21 DG B 24 22.180 8.009 25.858 1.00 0.00 H new ATOM 0 H22 DG B 24 23.438 7.823 27.085 1.00 0.00 H new TER 762 DG B 24 HETATM 763 O81 9U2 A 100 15.659 25.018 38.614 1.00 0.00 O HETATM 764 C81 9U2 A 100 16.267 24.624 37.630 1.00 0.00 C HETATM 765 C82 9U2 A 100 15.710 23.669 36.609 1.00 0.00 C HETATM 766 C84 9U2 A 100 14.425 23.121 36.607 1.00 0.00 C HETATM 767 C85 9U2 A 100 13.260 23.365 37.561 1.00 0.00 C HETATM 768 S81 9U2 A 100 14.159 22.100 35.213 1.00 0.00 S HETATM 769 C83 9U2 A 100 15.789 22.454 34.714 1.00 0.00 C HETATM 770 N81 9U2 A 100 16.466 23.256 35.515 1.00 0.00 N HETATM 771 CM8 9U2 A 100 12.669 24.790 37.474 1.00 0.00 C HETATM 772 CM9 9U2 A 100 13.466 22.898 39.024 1.00 0.00 C HETATM 781 N PYB A 101 17.563 25.063 37.360 1.00 0.00 N HETATM 782 CA PYB A 101 18.366 25.863 38.172 1.00 0.00 C HETATM 783 CB1 PYB A 101 19.640 26.386 37.821 1.00 0.00 C HETATM 784 CB PYB A 101 18.080 26.240 39.458 1.00 0.00 C HETATM 785 CG1 PYB A 101 20.121 27.067 38.918 1.00 0.00 C HETATM 786 NG2 PYB A 101 19.132 27.017 39.910 1.00 0.00 N HETATM 787 CD PYB A 101 19.114 27.679 41.223 1.00 0.00 C HETATM 788 C PYB A 101 21.448 27.694 39.188 1.00 0.00 C HETATM 789 O PYB A 101 21.762 28.068 40.311 1.00 0.00 O HETATM 0 HD3 PYB A 101 18.270 28.367 41.272 1.00 0.00 H new HETATM 0 HD2 PYB A 101 19.016 26.929 42.008 1.00 0.00 H new HETATM 0 HD1 PYB A 101 20.042 28.233 41.364 1.00 0.00 H new HETATM 0 HB1 PYB A 101 20.144 26.270 36.861 1.00 0.00 H new HETATM 0 HB PYB A 101 17.186 25.976 40.023 1.00 0.00 H new HETATM 0 H PYB A 101 17.879 24.806 36.425 1.00 0.00 H new HETATM 796 N PYB A 102 22.317 27.843 38.113 1.00 0.00 N HETATM 797 CA PYB A 102 23.645 28.276 38.211 1.00 0.00 C HETATM 798 CB1 PYB A 102 24.432 28.811 37.161 1.00 0.00 C HETATM 799 CB PYB A 102 24.402 28.276 39.355 1.00 0.00 C HETATM 800 CG1 PYB A 102 25.652 29.175 37.693 1.00 0.00 C HETATM 801 NG2 PYB A 102 25.644 28.808 39.043 1.00 0.00 N HETATM 802 CD PYB A 102 26.721 28.942 40.033 1.00 0.00 C HETATM 803 C PYB A 102 26.842 29.819 37.063 1.00 0.00 C HETATM 804 O PYB A 102 27.908 29.986 37.642 1.00 0.00 O HETATM 0 HD3 PYB A 102 26.388 29.584 40.849 1.00 0.00 H new HETATM 0 HD2 PYB A 102 26.978 27.959 40.427 1.00 0.00 H new HETATM 0 HD1 PYB A 102 27.598 29.383 39.559 1.00 0.00 H new HETATM 0 HB1 PYB A 102 24.128 28.916 36.120 1.00 0.00 H new HETATM 0 HB PYB A 102 24.084 27.921 40.335 1.00 0.00 H new HETATM 0 H PYB A 102 21.827 27.898 37.220 1.00 0.00 H new HETATM 811 N PYB A 103 26.647 30.275 35.772 1.00 0.00 N HETATM 812 CA PYB A 103 27.586 30.895 34.953 1.00 0.00 C HETATM 813 CB1 PYB A 103 27.246 31.582 33.772 1.00 0.00 C HETATM 814 CB PYB A 103 28.947 30.970 35.125 1.00 0.00 C HETATM 815 CG1 PYB A 103 28.410 32.013 33.187 1.00 0.00 C HETATM 816 NG2 PYB A 103 29.462 31.681 34.042 1.00 0.00 N HETATM 817 CD PYB A 103 30.882 32.017 33.880 1.00 0.00 C HETATM 818 C PYB A 103 28.606 32.643 31.859 1.00 0.00 C HETATM 819 O PYB A 103 29.680 32.920 31.350 1.00 0.00 O HETATM 0 HD3 PYB A 103 31.210 32.626 34.722 1.00 0.00 H new HETATM 0 HD2 PYB A 103 31.471 31.101 33.844 1.00 0.00 H new HETATM 0 HD1 PYB A 103 31.021 32.574 32.953 1.00 0.00 H new HETATM 0 HB1 PYB A 103 26.238 31.743 33.390 1.00 0.00 H new HETATM 0 HB PYB A 103 29.518 30.552 35.954 1.00 0.00 H new HETATM 0 H PYB A 103 25.657 30.305 35.527 1.00 0.00 H new HETATM 826 N ABU A 104 27.419 32.880 31.212 1.00 0.00 N HETATM 827 CA ABU A 104 27.281 33.319 29.820 1.00 0.00 C HETATM 828 CB ABU A 104 26.731 32.189 28.930 1.00 0.00 C HETATM 829 CG ABU A 104 27.802 31.278 28.288 1.00 0.00 C HETATM 830 CD ABU A 104 28.799 30.576 29.224 1.00 0.00 C HETATM 831 OE1 ABU A 104 29.998 30.680 29.020 1.00 0.00 O HETATM 0 H ABU A 104 26.518 32.761 31.676 1.00 0.00 H new HETATM 0 HB1 ABU A 104 26.061 31.570 29.528 1.00 0.00 H new HETATM 0 HB2 ABU A 104 26.131 32.633 28.136 1.00 0.00 H new HETATM 0 HG1 ABU A 104 27.314 30.515 27.681 1.00 0.00 H new HETATM 0 HG2 ABU A 104 28.459 31.877 27.658 1.00 0.00 H new HETATM 0 HE2 ABU A 104 28.389 30.798 29.071 1.00 0.00 H new HETATM 839 N IMT A 105 28.273 29.850 30.273 1.00 0.00 N HETATM 840 CA IMT A 105 28.922 29.270 31.340 1.00 0.00 C HETATM 841 NB1 IMT A 105 28.300 28.670 32.409 1.00 0.00 N HETATM 842 CB IMT A 105 30.281 29.266 31.507 1.00 0.00 C HETATM 843 CG1 IMT A 105 29.286 28.319 33.240 1.00 0.00 C HETATM 844 NG2 IMT A 105 30.530 28.655 32.712 1.00 0.00 N HETATM 845 CD IMT A 105 31.877 28.427 33.259 1.00 0.00 C HETATM 846 C IMT A 105 29.199 27.683 34.610 1.00 0.00 C HETATM 847 O IMT A 105 30.170 27.519 35.343 1.00 0.00 O HETATM 0 HN2 IMT A 105 27.254 29.855 30.237 1.00 0.00 H new HETATM 0 HD3 IMT A 105 32.448 27.802 32.572 1.00 0.00 H new HETATM 0 HD2 IMT A 105 32.384 29.383 33.387 1.00 0.00 H new HETATM 0 HD1 IMT A 105 31.798 27.927 34.224 1.00 0.00 H new HETATM 0 HB IMT A 105 31.022 29.670 30.817 1.00 0.00 H new HETATM 853 N PYB A 106 27.930 27.276 35.014 1.00 0.00 N HETATM 854 CA PYB A 106 27.568 26.713 36.239 1.00 0.00 C HETATM 855 CB1 PYB A 106 26.287 26.184 36.544 1.00 0.00 C HETATM 856 CB PYB A 106 28.361 26.600 37.352 1.00 0.00 C HETATM 857 CG1 PYB A 106 26.316 25.751 37.852 1.00 0.00 C HETATM 858 NG2 PYB A 106 27.613 25.962 38.332 1.00 0.00 N HETATM 859 CD PYB A 106 28.193 25.505 39.604 1.00 0.00 C HETATM 860 C PYB A 106 25.235 25.228 38.737 1.00 0.00 C HETATM 861 O PYB A 106 25.387 25.084 39.943 1.00 0.00 O HETATM 0 HD3 PYB A 106 28.984 24.783 39.404 1.00 0.00 H new HETATM 0 HD2 PYB A 106 28.607 26.358 40.142 1.00 0.00 H new HETATM 0 HD1 PYB A 106 27.418 25.036 40.210 1.00 0.00 H new HETATM 0 HB1 PYB A 106 25.435 26.130 35.867 1.00 0.00 H new HETATM 0 HB PYB A 106 29.390 26.947 37.449 1.00 0.00 H new HETATM 0 H PYB A 106 27.249 27.329 34.256 1.00 0.00 H new HETATM 868 N PYB A 107 24.039 24.904 38.116 1.00 0.00 N HETATM 869 CA PYB A 107 22.864 24.522 38.762 1.00 0.00 C HETATM 870 CB1 PYB A 107 21.797 23.809 38.165 1.00 0.00 C HETATM 871 CB PYB A 107 22.557 24.739 40.081 1.00 0.00 C HETATM 872 CG1 PYB A 107 20.866 23.553 39.146 1.00 0.00 C HETATM 873 NG2 PYB A 107 21.321 24.154 40.324 1.00 0.00 N HETATM 874 CD PYB A 107 20.678 24.165 41.646 1.00 0.00 C HETATM 875 C PYB A 107 19.587 22.792 39.093 1.00 0.00 C HETATM 876 O PYB A 107 18.803 22.728 40.030 1.00 0.00 O HETATM 0 HD3 PYB A 107 21.321 23.661 42.368 1.00 0.00 H new HETATM 0 HD2 PYB A 107 20.515 25.195 41.963 1.00 0.00 H new HETATM 0 HD1 PYB A 107 19.721 23.647 41.589 1.00 0.00 H new HETATM 0 HB1 PYB A 107 21.725 23.516 37.118 1.00 0.00 H new HETATM 0 HB PYB A 107 23.171 25.273 40.806 1.00 0.00 H new HETATM 0 H PYB A 107 24.180 24.670 37.133 1.00 0.00 H new HETATM 883 N PYB A 108 19.355 22.117 37.905 1.00 0.00 N HETATM 884 CA PYB A 108 18.243 21.343 37.587 1.00 0.00 C HETATM 885 CB1 PYB A 108 18.130 20.560 36.415 1.00 0.00 C HETATM 886 CB PYB A 108 17.093 21.191 38.322 1.00 0.00 C HETATM 887 CG1 PYB A 108 16.888 19.975 36.418 1.00 0.00 C HETATM 888 NG2 PYB A 108 16.291 20.284 37.641 1.00 0.00 N HETATM 889 CD PYB A 108 15.089 19.675 38.214 1.00 0.00 C HETATM 890 C PYB A 108 16.180 19.225 35.346 1.00 0.00 C HETATM 891 O PYB A 108 15.038 18.800 35.429 1.00 0.00 O HETATM 0 HD3 PYB A 108 15.357 19.113 39.109 1.00 0.00 H new HETATM 0 HD2 PYB A 108 14.375 20.456 38.476 1.00 0.00 H new HETATM 0 HD1 PYB A 108 14.639 19.002 37.484 1.00 0.00 H new HETATM 0 HB1 PYB A 108 18.893 20.442 35.646 1.00 0.00 H new HETATM 0 HB PYB A 108 16.855 21.688 39.262 1.00 0.00 H new HETATM 0 H PYB A 108 20.156 22.143 37.274 1.00 0.00 H new HETATM 898 C01 9T8 A 109 11.195 19.116 26.699 1.00 0.00 C HETATM 899 N02 9T8 A 109 15.478 17.966 30.065 1.00 0.00 N HETATM 900 C03 9T8 A 109 12.889 17.896 28.076 1.00 0.00 C HETATM 901 C05 9T8 A 109 14.672 16.826 29.598 1.00 0.00 C HETATM 902 C06 9T8 A 109 14.979 18.943 30.893 1.00 0.00 C HETATM 903 C07 9T8 A 109 15.975 19.543 31.877 1.00 0.00 C HETATM 904 C04 9T8 A 109 14.139 16.994 28.159 1.00 0.00 C HETATM 905 N01 9T8 A 109 12.471 18.278 26.657 1.00 0.00 N HETATM 906 C02 9T8 A 109 12.230 17.049 25.780 1.00 0.00 C HETATM 907 N03 9T8 A 109 16.898 19.113 34.178 1.00 0.00 N HETATM 908 C08 9T8 A 109 16.371 18.507 32.947 1.00 0.00 C HETATM 909 O01 9T8 A 109 13.789 19.213 30.914 1.00 0.00 O