USER MOD reduce.3.24.130724 H: found=0, std=0, add=321, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 346 hydrogens (96 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 102 PYB HN2 : A 102 PYB N : A 101 9TK C81 :(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 104 PYB HN2 : A 104 PYB N : A 103 PYB C :(H bumps) USER MOD NoAdj-H: A 106 IMT H : A 106 IMT N : A 105 ABU CD :(H bumps) USER MOD NoAdj-H: A 107 PYB HN2 : A 107 PYB N : A 106 IMT C :(H bumps) USER MOD NoAdj-H: A 108 PYB HN2 : A 108 PYB N : A 107 PYB C :(H bumps) USER MOD NoAdj-H: A 109 PYB HN2 : A 109 PYB N : A 108 PYB C :(H bumps) USER MOD Single : A 1 DCZ O5' : rot 180:sc= 0 USER MOD Single : A 4 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 6 DT C7 :methyl 150:sc= -0.579 (180deg=-0.579) USER MOD Single : A 10 DT C7 :methyl 150:sc= -0.0069 (180deg=-0.0069) 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 -30:sc= -0.0644 (180deg=-0.16) USER MOD Single : B 18 DT C7 :methyl -30:sc= -1.39 (180deg=-1.89!) USER MOD Single : B 22 DT C7 :methyl -30:sc= -0.265 (180deg=-0.939) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 DCZ A 1 31.312 12.881 27.905 1.00 0.00 N HETATM 2 C2 DCZ A 1 32.609 12.512 28.309 1.00 0.00 C HETATM 3 N3 DCZ A 1 33.360 13.337 29.085 1.00 0.00 N HETATM 4 C4 DCZ A 1 32.824 14.465 29.499 1.00 0.00 C HETATM 5 C5 DCZ A 1 31.492 14.856 29.208 1.00 0.00 C HETATM 6 C6 DCZ A 1 30.763 14.042 28.405 1.00 0.00 C HETATM 7 O2 DCZ A 1 33.114 11.428 27.996 1.00 0.00 O HETATM 8 N4 DCZ A 1 33.594 15.231 30.219 1.00 0.00 N HETATM 9 C1' DCZ A 1 30.615 12.031 26.884 1.00 0.00 C HETATM 10 C2' DCZ A 1 29.233 12.513 26.425 1.00 0.00 C HETATM 11 C3' DCZ A 1 29.022 11.691 25.159 1.00 0.00 C HETATM 12 C4' DCZ A 1 30.459 11.576 24.622 1.00 0.00 C HETATM 13 O4' DCZ A 1 31.325 12.043 25.655 1.00 0.00 O HETATM 14 O3' DCZ A 1 28.458 10.432 25.507 1.00 0.00 O HETATM 15 C5' DCZ A 1 30.709 12.364 23.320 1.00 0.00 C HETATM 16 O5' DCZ A 1 30.415 13.762 23.408 1.00 0.00 O HETATM 0 HO51 DCZ A 1 30.600 14.190 22.546 1.00 0.00 H new HETATM 0 HN42 DCZ A 1 33.242 16.120 30.573 1.00 0.00 H new HETATM 0 HN41 DCZ A 1 34.549 14.941 30.429 1.00 0.00 H new HETATM 0 H5'2 DCZ A 1 31.753 12.242 23.031 1.00 0.00 H new HETATM 0 H5'1 DCZ A 1 30.105 11.928 22.524 1.00 0.00 H new HETATM 0 H2'2 DCZ A 1 28.463 12.319 27.172 1.00 0.00 H new HETATM 0 H2'1 DCZ A 1 29.219 13.584 26.224 1.00 0.00 H new HETATM 0 H6 DCZ A 1 29.736 14.308 28.153 1.00 0.00 H new HETATM 0 H5 DCZ A 1 31.071 15.775 29.614 1.00 0.00 H new HETATM 0 H4' DCZ A 1 30.647 10.535 24.361 1.00 0.00 H new HETATM 0 H3' DCZ A 1 28.338 12.116 24.424 1.00 0.00 H new HETATM 0 H1' DCZ A 1 30.546 11.076 27.404 1.00 0.00 H new ATOM 29 P DG A 2 26.949 10.077 25.076 1.00 0.00 P ATOM 30 OP1 DG A 2 26.539 8.849 25.802 1.00 0.00 O ATOM 31 OP2 DG A 2 26.870 10.105 23.595 1.00 0.00 O ATOM 32 O5' DG A 2 26.122 11.329 25.663 1.00 0.00 O ATOM 33 C5' DG A 2 24.713 11.438 25.506 1.00 0.00 C ATOM 34 C4' DG A 2 24.177 12.790 26.005 1.00 0.00 C ATOM 35 O4' DG A 2 24.433 12.933 27.399 1.00 0.00 O ATOM 36 C3' DG A 2 24.820 14.004 25.305 1.00 0.00 C ATOM 37 O3' DG A 2 23.867 15.005 24.986 1.00 0.00 O ATOM 38 C2' DG A 2 25.744 14.539 26.391 1.00 0.00 C ATOM 39 C1' DG A 2 24.893 14.254 27.629 1.00 0.00 C ATOM 40 N9 DG A 2 25.638 14.341 28.911 1.00 0.00 N ATOM 41 C8 DG A 2 26.954 14.666 29.140 1.00 0.00 C ATOM 42 N7 DG A 2 27.325 14.583 30.392 1.00 0.00 N ATOM 43 C5 DG A 2 26.148 14.205 31.057 1.00 0.00 C ATOM 44 C6 DG A 2 25.859 13.982 32.452 1.00 0.00 C ATOM 45 O6 DG A 2 26.608 14.035 33.429 1.00 0.00 O ATOM 46 N1 DG A 2 24.537 13.673 32.699 1.00 0.00 N ATOM 47 C2 DG A 2 23.593 13.579 31.735 1.00 0.00 C ATOM 48 N2 DG A 2 22.374 13.306 32.111 1.00 0.00 N ATOM 49 N3 DG A 2 23.808 13.767 30.438 1.00 0.00 N ATOM 50 C4 DG A 2 25.110 14.079 30.156 1.00 0.00 C ATOM 0 H5' DG A 2 24.225 10.631 26.052 1.00 0.00 H new ATOM 0 H5'' DG A 2 24.455 11.312 24.454 1.00 0.00 H new ATOM 0 H4' DG A 2 23.111 12.780 25.779 1.00 0.00 H new ATOM 0 H3' DG A 2 25.301 13.735 24.365 1.00 0.00 H new ATOM 0 H2' DG A 2 26.702 14.020 26.416 1.00 0.00 H new ATOM 0 H2'' DG A 2 25.960 15.600 26.269 1.00 0.00 H new ATOM 0 H1' DG A 2 24.102 14.995 27.746 1.00 0.00 H new ATOM 0 H8 DG A 2 27.627 14.966 28.350 1.00 0.00 H new ATOM 0 H1 DG A 2 24.255 13.506 33.665 1.00 0.00 H new ATOM 0 H21 DG A 2 21.632 13.226 31.416 1.00 0.00 H new ATOM 0 H22 DG A 2 22.163 13.172 33.100 1.00 0.00 H new ATOM 62 P DA A 3 23.061 14.969 23.597 1.00 0.00 P ATOM 63 OP1 DA A 3 22.514 13.605 23.391 1.00 0.00 O ATOM 64 OP2 DA A 3 23.930 15.559 22.550 1.00 0.00 O ATOM 65 O5' DA A 3 21.833 15.979 23.849 1.00 0.00 O ATOM 66 C5' DA A 3 20.783 15.692 24.771 1.00 0.00 C ATOM 67 C4' DA A 3 20.770 16.624 25.992 1.00 0.00 C ATOM 68 O4' DA A 3 21.827 16.375 26.907 1.00 0.00 O ATOM 69 C3' DA A 3 20.856 18.124 25.633 1.00 0.00 C ATOM 70 O3' DA A 3 19.618 18.839 25.498 1.00 0.00 O ATOM 71 C2' DA A 3 21.824 18.682 26.687 1.00 0.00 C ATOM 72 C1' DA A 3 21.924 17.539 27.704 1.00 0.00 C ATOM 73 N9 DA A 3 23.172 17.521 28.498 1.00 0.00 N ATOM 74 C8 DA A 3 24.473 17.650 28.068 1.00 0.00 C ATOM 75 N7 DA A 3 25.363 17.607 29.027 1.00 0.00 N ATOM 76 C5 DA A 3 24.579 17.437 30.181 1.00 0.00 C ATOM 77 C6 DA A 3 24.840 17.342 31.572 1.00 0.00 C ATOM 78 N6 DA A 3 26.028 17.419 32.139 1.00 0.00 N ATOM 79 N1 DA A 3 23.853 17.184 32.453 1.00 0.00 N ATOM 80 C2 DA A 3 22.611 17.106 31.992 1.00 0.00 C ATOM 81 N3 DA A 3 22.208 17.183 30.730 1.00 0.00 N ATOM 82 C4 DA A 3 23.248 17.360 29.865 1.00 0.00 C ATOM 0 H5' DA A 3 20.880 14.661 25.111 1.00 0.00 H new ATOM 0 H5'' DA A 3 19.826 15.768 24.255 1.00 0.00 H new ATOM 0 H4' DA A 3 19.806 16.399 26.448 1.00 0.00 H new ATOM 0 H3' DA A 3 21.212 18.260 24.612 1.00 0.00 H new ATOM 0 H2' DA A 3 22.795 18.924 26.255 1.00 0.00 H new ATOM 0 H2'' DA A 3 21.442 19.595 27.143 1.00 0.00 H new ATOM 0 H1' DA A 3 21.146 17.638 28.461 1.00 0.00 H new ATOM 0 H8 DA A 3 24.737 17.776 27.028 1.00 0.00 H new ATOM 0 H61 DA A 3 26.116 17.339 33.152 1.00 0.00 H new ATOM 0 H62 DA A 3 26.859 17.559 31.564 1.00 0.00 H new ATOM 0 H2 DA A 3 21.837 16.963 32.731 1.00 0.00 H new ATOM 94 P DT A 4 18.387 18.799 26.553 1.00 0.00 P ATOM 95 OP1 DT A 4 17.729 17.471 26.478 1.00 0.00 O ATOM 96 OP2 DT A 4 17.564 20.009 26.312 1.00 0.00 O ATOM 97 O5' DT A 4 19.133 18.929 27.971 1.00 0.00 O ATOM 98 C5' DT A 4 18.499 19.384 29.155 1.00 0.00 C ATOM 99 C4' DT A 4 19.383 20.408 29.882 1.00 0.00 C ATOM 100 O4' DT A 4 20.696 19.928 30.156 1.00 0.00 O ATOM 101 C3' DT A 4 19.666 21.668 29.066 1.00 0.00 C ATOM 102 O3' DT A 4 18.536 22.526 29.005 1.00 0.00 O ATOM 103 C2' DT A 4 20.824 22.261 29.875 1.00 0.00 C ATOM 104 C1' DT A 4 21.448 21.051 30.586 1.00 0.00 C ATOM 105 N1 DT A 4 22.921 20.891 30.389 1.00 0.00 N ATOM 106 C2 DT A 4 23.715 20.731 31.535 1.00 0.00 C ATOM 107 O2 DT A 4 23.266 20.655 32.675 1.00 0.00 O ATOM 108 N3 DT A 4 25.074 20.669 31.360 1.00 0.00 N ATOM 109 C4 DT A 4 25.731 20.703 30.153 1.00 0.00 C ATOM 110 O4 DT A 4 26.955 20.576 30.150 1.00 0.00 O ATOM 111 C5 DT A 4 24.857 20.877 28.989 1.00 0.00 C ATOM 112 C7 DT A 4 25.458 20.956 27.597 1.00 0.00 C ATOM 113 C6 DT A 4 23.505 20.961 29.138 1.00 0.00 C ATOM 0 H5' DT A 4 18.296 18.539 29.813 1.00 0.00 H new ATOM 0 H5'' DT A 4 17.538 19.835 28.909 1.00 0.00 H new ATOM 0 H4' DT A 4 18.798 20.605 30.780 1.00 0.00 H new ATOM 0 H3' DT A 4 19.898 21.496 28.015 1.00 0.00 H new ATOM 0 H2' DT A 4 21.547 22.759 29.229 1.00 0.00 H new ATOM 0 H2'' DT A 4 20.471 23.004 30.590 1.00 0.00 H new ATOM 0 H1' DT A 4 21.389 21.185 31.666 1.00 0.00 H new ATOM 0 H3 DT A 4 25.648 20.591 32.200 1.00 0.00 H new ATOM 0 H71 DT A 4 24.748 20.560 26.871 1.00 0.00 H new ATOM 0 H72 DT A 4 25.682 21.995 27.356 1.00 0.00 H new ATOM 0 H73 DT A 4 26.376 20.370 27.563 1.00 0.00 H new ATOM 0 H6 DT A 4 22.880 21.084 28.266 1.00 0.00 H new ATOM 126 P DG A 5 18.482 23.774 27.984 1.00 0.00 P ATOM 127 OP1 DG A 5 17.110 24.339 28.006 1.00 0.00 O ATOM 128 OP2 DG A 5 19.083 23.387 26.683 1.00 0.00 O ATOM 129 O5' DG A 5 19.478 24.815 28.687 1.00 0.00 O ATOM 130 C5' DG A 5 19.145 25.441 29.917 1.00 0.00 C ATOM 131 C4' DG A 5 20.324 26.236 30.489 1.00 0.00 C ATOM 132 O4' DG A 5 21.418 25.400 30.842 1.00 0.00 O ATOM 133 C3' DG A 5 20.915 27.218 29.470 1.00 0.00 C ATOM 134 O3' DG A 5 20.211 28.439 29.197 1.00 0.00 O ATOM 135 C2' DG A 5 22.342 27.398 29.982 1.00 0.00 C ATOM 136 C1' DG A 5 22.564 26.228 30.954 1.00 0.00 C ATOM 137 N9 DG A 5 23.806 25.440 30.711 1.00 0.00 N ATOM 138 C8 DG A 5 24.181 24.710 29.608 1.00 0.00 C ATOM 139 N7 DG A 5 25.336 24.100 29.732 1.00 0.00 N ATOM 140 C5 DG A 5 25.773 24.457 31.019 1.00 0.00 C ATOM 141 C6 DG A 5 26.961 24.133 31.781 1.00 0.00 C ATOM 142 O6 DG A 5 27.938 23.446 31.478 1.00 0.00 O ATOM 143 N1 DG A 5 26.980 24.696 33.044 1.00 0.00 N ATOM 144 C2 DG A 5 26.003 25.493 33.520 1.00 0.00 C ATOM 145 N2 DG A 5 26.143 25.968 34.722 1.00 0.00 N ATOM 146 N3 DG A 5 24.909 25.831 32.851 1.00 0.00 N ATOM 147 C4 DG A 5 24.837 25.279 31.609 1.00 0.00 C ATOM 0 H5' DG A 5 18.833 24.684 30.637 1.00 0.00 H new ATOM 0 H5'' DG A 5 18.296 26.108 29.767 1.00 0.00 H new ATOM 0 H4' DG A 5 19.901 26.747 31.354 1.00 0.00 H new ATOM 0 H3' DG A 5 20.842 26.810 28.462 1.00 0.00 H new ATOM 0 H2' DG A 5 23.061 27.374 29.164 1.00 0.00 H new ATOM 0 H2'' DG A 5 22.463 28.358 30.485 1.00 0.00 H new ATOM 0 H1' DG A 5 22.701 26.631 31.957 1.00 0.00 H new ATOM 0 H8 DG A 5 23.576 24.644 28.716 1.00 0.00 H new ATOM 0 H1 DG A 5 27.777 24.497 33.648 1.00 0.00 H new ATOM 0 H21 DG A 5 25.425 26.575 35.117 1.00 0.00 H new ATOM 0 H22 DG A 5 26.971 25.734 35.270 1.00 0.00 H new ATOM 159 P DT A 6 19.381 29.323 30.277 1.00 0.00 P ATOM 160 OP1 DT A 6 18.281 28.501 30.837 1.00 0.00 O ATOM 161 OP2 DT A 6 19.035 30.605 29.615 1.00 0.00 O ATOM 162 O5' DT A 6 20.440 29.659 31.437 1.00 0.00 O ATOM 163 C5' DT A 6 20.242 29.290 32.797 1.00 0.00 C ATOM 164 C4' DT A 6 21.434 29.743 33.642 1.00 0.00 C ATOM 165 O4' DT A 6 22.620 29.118 33.187 1.00 0.00 O ATOM 166 C3' DT A 6 21.667 31.259 33.583 1.00 0.00 C ATOM 167 O3' DT A 6 21.270 31.853 34.813 1.00 0.00 O ATOM 168 C2' DT A 6 23.166 31.376 33.299 1.00 0.00 C ATOM 169 C1' DT A 6 23.703 29.965 33.514 1.00 0.00 C ATOM 170 N1 DT A 6 24.869 29.574 32.677 1.00 0.00 N ATOM 171 C2 DT A 6 26.011 29.081 33.324 1.00 0.00 C ATOM 172 O2 DT A 6 26.261 29.254 34.515 1.00 0.00 O ATOM 173 N3 DT A 6 26.907 28.385 32.546 1.00 0.00 N ATOM 174 C4 DT A 6 26.760 28.120 31.206 1.00 0.00 C ATOM 175 O4 DT A 6 27.529 27.324 30.673 1.00 0.00 O ATOM 176 C5 DT A 6 25.664 28.837 30.557 1.00 0.00 C ATOM 177 C7 DT A 6 25.508 28.769 29.049 1.00 0.00 C ATOM 178 C6 DT A 6 24.766 29.536 31.299 1.00 0.00 C ATOM 0 H5' DT A 6 20.120 28.210 32.875 1.00 0.00 H new ATOM 0 H5'' DT A 6 19.325 29.742 33.175 1.00 0.00 H new ATOM 0 H4' DT A 6 21.197 29.462 34.668 1.00 0.00 H new ATOM 0 H3' DT A 6 21.086 31.782 32.823 1.00 0.00 H new ATOM 0 H2' DT A 6 23.352 31.722 32.282 1.00 0.00 H new ATOM 0 H2'' DT A 6 23.643 32.090 33.971 1.00 0.00 H new ATOM 0 H1' DT A 6 24.070 29.896 34.538 1.00 0.00 H new ATOM 0 H3 DT A 6 27.750 28.037 33.002 1.00 0.00 H new ATOM 0 H71 DT A 6 24.454 28.864 28.788 1.00 0.00 H new ATOM 0 H72 DT A 6 26.071 29.580 28.588 1.00 0.00 H new ATOM 0 H73 DT A 6 25.887 27.813 28.687 1.00 0.00 H new ATOM 0 H6 DT A 6 23.964 30.067 30.808 1.00 0.00 H new ATOM 191 P DA A 7 21.094 33.450 34.982 1.00 0.00 P ATOM 192 OP1 DA A 7 20.145 33.687 36.098 1.00 0.00 O ATOM 193 OP2 DA A 7 20.802 34.052 33.657 1.00 0.00 O ATOM 194 O5' DA A 7 22.557 33.939 35.441 1.00 0.00 O ATOM 195 C5' DA A 7 23.067 33.599 36.724 1.00 0.00 C ATOM 196 C4' DA A 7 24.583 33.793 36.821 1.00 0.00 C ATOM 197 O4' DA A 7 25.235 32.946 35.886 1.00 0.00 O ATOM 198 C3' DA A 7 25.054 35.233 36.568 1.00 0.00 C ATOM 199 O3' DA A 7 25.647 35.760 37.752 1.00 0.00 O ATOM 200 C2' DA A 7 26.037 35.064 35.408 1.00 0.00 C ATOM 201 C1' DA A 7 26.402 33.583 35.416 1.00 0.00 C ATOM 202 N9 DA A 7 26.695 33.046 34.068 1.00 0.00 N ATOM 203 C8 DA A 7 25.886 33.102 32.959 1.00 0.00 C ATOM 204 N7 DA A 7 26.324 32.430 31.931 1.00 0.00 N ATOM 205 C5 DA A 7 27.552 31.932 32.393 1.00 0.00 C ATOM 206 C6 DA A 7 28.574 31.141 31.819 1.00 0.00 C ATOM 207 N6 DA A 7 28.524 30.649 30.598 1.00 0.00 N ATOM 208 N1 DA A 7 29.669 30.812 32.504 1.00 0.00 N ATOM 209 C2 DA A 7 29.771 31.261 33.748 1.00 0.00 C ATOM 210 N3 DA A 7 28.902 32.000 34.432 1.00 0.00 N ATOM 211 C4 DA A 7 27.797 32.307 33.688 1.00 0.00 C ATOM 0 H5' DA A 7 22.822 32.560 36.946 1.00 0.00 H new ATOM 0 H5'' DA A 7 22.576 34.211 37.481 1.00 0.00 H new ATOM 0 H4' DA A 7 24.843 33.544 37.850 1.00 0.00 H new ATOM 0 H3' DA A 7 24.266 35.944 36.319 1.00 0.00 H new ATOM 0 H2' DA A 7 25.583 35.354 34.460 1.00 0.00 H new ATOM 0 H2'' DA A 7 26.920 35.689 35.544 1.00 0.00 H new ATOM 0 H1' DA A 7 27.297 33.422 36.016 1.00 0.00 H new ATOM 0 H8 DA A 7 24.961 33.659 32.940 1.00 0.00 H new ATOM 0 H61 DA A 7 29.296 30.085 30.243 1.00 0.00 H new ATOM 0 H62 DA A 7 27.713 30.832 30.007 1.00 0.00 H new ATOM 0 H2 DA A 7 30.676 30.992 34.273 1.00 0.00 H new ATOM 223 P DC A 8 26.159 37.290 37.870 1.00 0.00 P ATOM 224 OP1 DC A 8 26.155 37.663 39.306 1.00 0.00 O ATOM 225 OP2 DC A 8 25.400 38.131 36.910 1.00 0.00 O ATOM 226 O5' DC A 8 27.686 37.210 37.368 1.00 0.00 O ATOM 227 C5' DC A 8 28.638 36.424 38.076 1.00 0.00 C ATOM 228 C4' DC A 8 29.953 36.232 37.309 1.00 0.00 C ATOM 229 O4' DC A 8 29.712 35.522 36.096 1.00 0.00 O ATOM 230 C3' DC A 8 30.657 37.551 36.951 1.00 0.00 C ATOM 231 O3' DC A 8 32.017 37.513 37.378 1.00 0.00 O ATOM 232 C2' DC A 8 30.499 37.588 35.430 1.00 0.00 C ATOM 233 C1' DC A 8 30.495 36.099 35.068 1.00 0.00 C ATOM 234 N1 DC A 8 29.873 35.752 33.756 1.00 0.00 N ATOM 235 C2 DC A 8 30.541 34.892 32.866 1.00 0.00 C ATOM 236 O2 DC A 8 31.694 34.500 33.058 1.00 0.00 O ATOM 237 N3 DC A 8 29.936 34.457 31.731 1.00 0.00 N ATOM 238 C4 DC A 8 28.704 34.858 31.490 1.00 0.00 C ATOM 239 N4 DC A 8 28.153 34.407 30.404 1.00 0.00 N ATOM 240 C5 DC A 8 27.974 35.726 32.340 1.00 0.00 C ATOM 241 C6 DC A 8 28.597 36.168 33.460 1.00 0.00 C ATOM 0 H5' DC A 8 28.205 35.447 38.292 1.00 0.00 H new ATOM 0 H5'' DC A 8 28.850 36.898 39.035 1.00 0.00 H new ATOM 0 H4' DC A 8 30.606 35.674 37.980 1.00 0.00 H new ATOM 0 H3' DC A 8 30.251 38.442 37.429 1.00 0.00 H new ATOM 0 H2' DC A 8 29.576 38.083 35.129 1.00 0.00 H new ATOM 0 H2'' DC A 8 31.318 38.122 34.949 1.00 0.00 H new ATOM 0 H1' DC A 8 31.523 35.747 34.979 1.00 0.00 H new ATOM 0 H41 DC A 8 27.201 34.682 30.163 1.00 0.00 H new ATOM 0 H42 DC A 8 28.673 33.778 29.792 1.00 0.00 H new ATOM 0 H5 DC A 8 26.963 36.023 32.105 1.00 0.00 H new ATOM 0 H6 DC A 8 28.088 36.851 34.124 1.00 0.00 H new ATOM 253 P DA A 9 32.926 38.847 37.482 1.00 0.00 P ATOM 254 OP1 DA A 9 34.046 38.565 38.416 1.00 0.00 O ATOM 255 OP2 DA A 9 32.050 40.013 37.759 1.00 0.00 O ATOM 256 O5' DA A 9 33.527 39.012 35.994 1.00 0.00 O ATOM 257 C5' DA A 9 34.557 38.145 35.535 1.00 0.00 C ATOM 258 C4' DA A 9 34.613 38.011 34.008 1.00 0.00 C ATOM 259 O4' DA A 9 33.399 37.503 33.476 1.00 0.00 O ATOM 260 C3' DA A 9 34.938 39.295 33.233 1.00 0.00 C ATOM 261 O3' DA A 9 36.331 39.340 32.940 1.00 0.00 O ATOM 262 C2' DA A 9 34.059 39.154 31.982 1.00 0.00 C ATOM 263 C1' DA A 9 33.453 37.757 32.090 1.00 0.00 C ATOM 264 N9 DA A 9 32.116 37.672 31.468 1.00 0.00 N ATOM 265 C8 DA A 9 30.956 38.305 31.848 1.00 0.00 C ATOM 266 N7 DA A 9 29.938 38.085 31.056 1.00 0.00 N ATOM 267 C5 DA A 9 30.485 37.245 30.069 1.00 0.00 C ATOM 268 C6 DA A 9 29.987 36.620 28.899 1.00 0.00 C ATOM 269 N6 DA A 9 28.754 36.737 28.443 1.00 0.00 N ATOM 270 N1 DA A 9 30.763 35.840 28.145 1.00 0.00 N ATOM 271 C2 DA A 9 32.023 35.674 28.524 1.00 0.00 C ATOM 272 N3 DA A 9 32.640 36.193 29.580 1.00 0.00 N ATOM 273 C4 DA A 9 31.804 36.978 30.321 1.00 0.00 C ATOM 0 H5' DA A 9 34.411 37.158 35.973 1.00 0.00 H new ATOM 0 H5'' DA A 9 35.518 38.514 35.894 1.00 0.00 H new ATOM 0 H4' DA A 9 35.444 37.319 33.867 1.00 0.00 H new ATOM 0 H3' DA A 9 34.737 40.224 33.767 1.00 0.00 H new ATOM 0 H2' DA A 9 33.285 39.921 31.954 1.00 0.00 H new ATOM 0 H2'' DA A 9 34.647 39.261 31.071 1.00 0.00 H new ATOM 0 H1' DA A 9 34.049 37.018 31.554 1.00 0.00 H new ATOM 0 H8 DA A 9 30.891 38.931 32.726 1.00 0.00 H new ATOM 0 H61 DA A 9 28.478 36.251 27.590 1.00 0.00 H new ATOM 0 H62 DA A 9 28.078 37.313 28.944 1.00 0.00 H new ATOM 0 H2 DA A 9 32.624 35.035 27.894 1.00 0.00 H new ATOM 285 P DT A 10 37.030 40.604 32.215 1.00 0.00 P ATOM 286 OP1 DT A 10 38.480 40.562 32.533 1.00 0.00 O ATOM 287 OP2 DT A 10 36.262 41.830 32.549 1.00 0.00 O ATOM 288 O5' DT A 10 36.837 40.297 30.643 1.00 0.00 O ATOM 289 C5' DT A 10 37.600 39.286 29.995 1.00 0.00 C ATOM 290 C4' DT A 10 37.164 39.021 28.546 1.00 0.00 C ATOM 291 O4' DT A 10 35.865 38.452 28.480 1.00 0.00 O ATOM 292 C3' DT A 10 37.067 40.277 27.677 1.00 0.00 C ATOM 293 O3' DT A 10 38.327 40.718 27.192 1.00 0.00 O ATOM 294 C2' DT A 10 36.197 39.766 26.531 1.00 0.00 C ATOM 295 C1' DT A 10 35.385 38.626 27.154 1.00 0.00 C ATOM 296 N1 DT A 10 33.924 38.894 27.149 1.00 0.00 N ATOM 297 C2 DT A 10 33.168 38.340 26.108 1.00 0.00 C ATOM 298 O2 DT A 10 33.654 37.726 25.159 1.00 0.00 O ATOM 299 N3 DT A 10 31.810 38.527 26.168 1.00 0.00 N ATOM 300 C4 DT A 10 31.136 39.243 27.126 1.00 0.00 C ATOM 301 O4 DT A 10 29.909 39.283 27.064 1.00 0.00 O ATOM 302 C5 DT A 10 31.991 39.880 28.131 1.00 0.00 C ATOM 303 C7 DT A 10 31.384 40.749 29.219 1.00 0.00 C ATOM 304 C6 DT A 10 33.337 39.687 28.113 1.00 0.00 C ATOM 0 H5' DT A 10 37.520 38.360 30.565 1.00 0.00 H new ATOM 0 H5'' DT A 10 38.651 39.575 30.002 1.00 0.00 H new ATOM 0 H4' DT A 10 37.944 38.356 28.177 1.00 0.00 H new ATOM 0 H3' DT A 10 36.677 41.142 28.214 1.00 0.00 H new ATOM 0 H2' DT A 10 35.548 40.551 26.143 1.00 0.00 H new ATOM 0 H2'' DT A 10 36.804 39.413 25.697 1.00 0.00 H new ATOM 0 H1' DT A 10 35.516 37.720 26.563 1.00 0.00 H new ATOM 0 H3 DT A 10 31.250 38.094 25.433 1.00 0.00 H new ATOM 0 H71 DT A 10 32.002 40.694 30.115 1.00 0.00 H new ATOM 0 H72 DT A 10 31.335 41.782 28.875 1.00 0.00 H new ATOM 0 H73 DT A 10 30.379 40.395 29.449 1.00 0.00 H new ATOM 0 H6 DT A 10 33.954 40.160 28.863 1.00 0.00 H new ATOM 317 P DC A 11 38.623 42.286 26.970 1.00 0.00 P ATOM 318 OP1 DC A 11 40.008 42.421 26.453 1.00 0.00 O ATOM 319 OP2 DC A 11 38.248 43.019 28.205 1.00 0.00 O ATOM 320 O5' DC A 11 37.586 42.705 25.808 1.00 0.00 O ATOM 321 C5' DC A 11 37.868 42.488 24.429 1.00 0.00 C ATOM 322 C4' DC A 11 36.691 42.878 23.522 1.00 0.00 C ATOM 323 O4' DC A 11 35.571 42.028 23.734 1.00 0.00 O ATOM 324 C3' DC A 11 36.152 44.292 23.789 1.00 0.00 C ATOM 325 O3' DC A 11 36.866 45.417 23.262 1.00 0.00 O ATOM 326 C2' DC A 11 34.700 44.195 23.331 1.00 0.00 C ATOM 327 C1' DC A 11 34.423 42.686 23.225 1.00 0.00 C ATOM 328 N1 DC A 11 33.212 42.306 24.002 1.00 0.00 N ATOM 329 C2 DC A 11 32.071 41.849 23.326 1.00 0.00 C ATOM 330 O2 DC A 11 32.094 41.497 22.145 1.00 0.00 O ATOM 331 N3 DC A 11 30.877 41.775 23.959 1.00 0.00 N ATOM 332 C4 DC A 11 30.823 42.123 25.228 1.00 0.00 C ATOM 333 N4 DC A 11 29.654 42.040 25.784 1.00 0.00 N ATOM 334 C5 DC A 11 31.957 42.515 25.990 1.00 0.00 C ATOM 335 C6 DC A 11 33.147 42.580 25.346 1.00 0.00 C ATOM 0 H5' DC A 11 38.112 41.437 24.272 1.00 0.00 H new ATOM 0 H5'' DC A 11 38.748 43.065 24.146 1.00 0.00 H new ATOM 0 H4' DC A 11 37.101 42.802 22.515 1.00 0.00 H new ATOM 0 H3' DC A 11 36.281 44.541 24.842 1.00 0.00 H new ATOM 0 H2' DC A 11 34.027 44.672 24.044 1.00 0.00 H new ATOM 0 H2'' DC A 11 34.553 44.693 22.372 1.00 0.00 H new ATOM 0 H1' DC A 11 34.231 42.401 22.191 1.00 0.00 H new ATOM 0 H41 DC A 11 29.537 42.293 26.765 1.00 0.00 H new ATOM 0 H42 DC A 11 28.852 41.721 25.240 1.00 0.00 H new ATOM 0 H5 DC A 11 31.873 42.752 27.040 1.00 0.00 H new ATOM 0 H6 DC A 11 34.042 42.847 25.888 1.00 0.00 H new ATOM 347 P DG A 12 37.427 45.579 21.746 1.00 0.00 P ATOM 348 OP1 DG A 12 38.432 44.517 21.500 1.00 0.00 O ATOM 349 OP2 DG A 12 37.854 46.993 21.609 1.00 0.00 O ATOM 350 O5' DG A 12 36.178 45.369 20.744 1.00 0.00 O ATOM 351 C5' DG A 12 36.028 44.206 19.937 1.00 0.00 C ATOM 352 C4' DG A 12 34.670 44.152 19.217 1.00 0.00 C ATOM 353 O4' DG A 12 33.617 43.869 20.139 1.00 0.00 O ATOM 354 C3' DG A 12 34.302 45.458 18.488 1.00 0.00 C ATOM 355 O3' DG A 12 33.742 45.175 17.208 1.00 0.00 O ATOM 356 C2' DG A 12 33.244 46.050 19.416 1.00 0.00 C ATOM 357 C1' DG A 12 32.551 44.772 19.889 1.00 0.00 C ATOM 358 N9 DG A 12 31.688 44.944 21.086 1.00 0.00 N ATOM 359 C8 DG A 12 31.895 45.697 22.218 1.00 0.00 C ATOM 360 N7 DG A 12 30.927 45.631 23.096 1.00 0.00 N ATOM 361 C5 DG A 12 29.982 44.792 22.485 1.00 0.00 C ATOM 362 C6 DG A 12 28.669 44.354 22.901 1.00 0.00 C ATOM 363 O6 DG A 12 28.054 44.608 23.938 1.00 0.00 O ATOM 364 N1 DG A 12 28.030 43.560 21.966 1.00 0.00 N ATOM 365 C2 DG A 12 28.581 43.222 20.772 1.00 0.00 C ATOM 366 N2 DG A 12 27.847 42.535 19.945 1.00 0.00 N ATOM 367 N3 DG A 12 29.783 43.593 20.348 1.00 0.00 N ATOM 368 C4 DG A 12 30.442 44.379 21.251 1.00 0.00 C ATOM 0 H5' DG A 12 36.139 43.319 20.561 1.00 0.00 H new ATOM 0 H5'' DG A 12 36.828 44.177 19.197 1.00 0.00 H new ATOM 0 H4' DG A 12 34.778 43.360 18.476 1.00 0.00 H new ATOM 0 H3' DG A 12 35.150 46.118 18.305 1.00 0.00 H new ATOM 0 H2' DG A 12 33.682 46.614 20.239 1.00 0.00 H new ATOM 0 H2'' DG A 12 32.564 46.723 18.895 1.00 0.00 H new ATOM 0 HO3' DG A 12 33.512 46.015 16.759 1.00 0.00 H new ATOM 0 H1' DG A 12 31.850 44.417 19.133 1.00 0.00 H new ATOM 0 H8 DG A 12 32.783 46.293 22.370 1.00 0.00 H new ATOM 0 H1 DG A 12 27.097 43.210 22.185 1.00 0.00 H new ATOM 0 H21 DG A 12 28.222 42.260 19.037 1.00 0.00 H new ATOM 0 H22 DG A 12 26.897 42.271 20.205 1.00 0.00 H new TER 381 DG A 12 HETATM 382 N1 DCZ B 13 23.314 41.448 21.297 1.00 0.00 N HETATM 383 C2 DCZ B 13 24.536 42.065 21.595 1.00 0.00 C HETATM 384 N3 DCZ B 13 25.054 42.026 22.844 1.00 0.00 N HETATM 385 C4 DCZ B 13 24.365 41.400 23.777 1.00 0.00 C HETATM 386 C5 DCZ B 13 23.105 40.780 23.556 1.00 0.00 C HETATM 387 C6 DCZ B 13 22.609 40.817 22.294 1.00 0.00 C HETATM 388 O2 DCZ B 13 25.193 42.644 20.731 1.00 0.00 O HETATM 389 N4 DCZ B 13 24.938 41.321 24.941 1.00 0.00 N HETATM 390 C1' DCZ B 13 22.862 41.387 19.880 1.00 0.00 C HETATM 391 C2' DCZ B 13 23.138 40.003 19.288 1.00 0.00 C HETATM 392 C3' DCZ B 13 21.888 39.668 18.480 1.00 0.00 C HETATM 393 C4' DCZ B 13 20.854 40.722 18.893 1.00 0.00 C HETATM 394 O4' DCZ B 13 21.464 41.619 19.813 1.00 0.00 O HETATM 395 O3' DCZ B 13 22.163 39.716 17.087 1.00 0.00 O HETATM 396 C5' DCZ B 13 19.619 40.072 19.539 1.00 0.00 C HETATM 397 O5' DCZ B 13 18.658 41.049 19.931 1.00 0.00 O HETATM 0 HO51 DCZ B 13 17.885 40.603 20.336 1.00 0.00 H new HETATM 0 HN42 DCZ B 13 24.464 40.850 25.712 1.00 0.00 H new HETATM 0 HN41 DCZ B 13 25.862 41.730 25.084 1.00 0.00 H new HETATM 0 H5'2 DCZ B 13 19.164 39.375 18.836 1.00 0.00 H new HETATM 0 H5'1 DCZ B 13 19.925 39.492 20.410 1.00 0.00 H new HETATM 0 H2'2 DCZ B 13 24.026 40.013 18.656 1.00 0.00 H new HETATM 0 H2'1 DCZ B 13 23.312 39.265 20.071 1.00 0.00 H new HETATM 0 H6 DCZ B 13 21.652 40.346 22.071 1.00 0.00 H new HETATM 0 H5 DCZ B 13 22.560 40.295 24.366 1.00 0.00 H new HETATM 0 H4' DCZ B 13 20.519 41.257 18.004 1.00 0.00 H new HETATM 0 H3' DCZ B 13 21.525 38.659 18.675 1.00 0.00 H new HETATM 0 H1' DCZ B 13 23.406 42.146 19.318 1.00 0.00 H new ATOM 410 P DG B 14 21.975 38.394 16.195 1.00 0.00 P ATOM 411 OP1 DG B 14 22.397 38.695 14.804 1.00 0.00 O ATOM 412 OP2 DG B 14 20.614 37.855 16.439 1.00 0.00 O ATOM 413 O5' DG B 14 23.045 37.410 16.886 1.00 0.00 O ATOM 414 C5' DG B 14 24.411 37.387 16.494 1.00 0.00 C ATOM 415 C4' DG B 14 25.325 36.767 17.563 1.00 0.00 C ATOM 416 O4' DG B 14 25.669 37.716 18.572 1.00 0.00 O ATOM 417 C3' DG B 14 24.741 35.533 18.284 1.00 0.00 C ATOM 418 O3' DG B 14 25.585 34.400 18.192 1.00 0.00 O ATOM 419 C2' DG B 14 24.715 36.014 19.732 1.00 0.00 C ATOM 420 C1' DG B 14 25.918 36.959 19.741 1.00 0.00 C ATOM 421 N9 DG B 14 26.039 37.786 20.973 1.00 0.00 N ATOM 422 C8 DG B 14 25.182 37.854 22.048 1.00 0.00 C ATOM 423 N7 DG B 14 25.599 38.616 23.021 1.00 0.00 N ATOM 424 C5 DG B 14 26.827 39.106 22.561 1.00 0.00 C ATOM 425 C6 DG B 14 27.784 39.998 23.168 1.00 0.00 C ATOM 426 O6 DG B 14 27.731 40.589 24.249 1.00 0.00 O ATOM 427 N1 DG B 14 28.914 40.195 22.404 1.00 0.00 N ATOM 428 C2 DG B 14 29.114 39.623 21.193 1.00 0.00 C ATOM 429 N2 DG B 14 30.248 39.887 20.604 1.00 0.00 N ATOM 430 N3 DG B 14 28.254 38.806 20.583 1.00 0.00 N ATOM 431 C4 DG B 14 27.115 38.585 21.316 1.00 0.00 C ATOM 0 H5' DG B 14 24.742 38.404 16.285 1.00 0.00 H new ATOM 0 H5'' DG B 14 24.509 36.823 15.567 1.00 0.00 H new ATOM 0 H4' DG B 14 26.197 36.446 16.993 1.00 0.00 H new ATOM 0 H3' DG B 14 23.784 35.219 17.867 1.00 0.00 H new ATOM 0 H2' DG B 14 23.785 36.526 19.981 1.00 0.00 H new ATOM 0 H2'' DG B 14 24.828 35.195 20.442 1.00 0.00 H new ATOM 0 H1' DG B 14 26.878 36.444 19.746 1.00 0.00 H new ATOM 0 H8 DG B 14 24.243 37.321 22.083 1.00 0.00 H new ATOM 0 H1 DG B 14 29.642 40.807 22.772 1.00 0.00 H new ATOM 0 H21 DG B 14 30.454 39.484 19.690 1.00 0.00 H new ATOM 0 H22 DG B 14 30.929 40.496 21.058 1.00 0.00 H new ATOM 443 P DA B 15 25.451 33.371 16.967 1.00 0.00 P ATOM 444 OP1 DA B 15 25.396 34.134 15.696 1.00 0.00 O ATOM 445 OP2 DA B 15 24.354 32.424 17.284 1.00 0.00 O ATOM 446 O5' DA B 15 26.836 32.550 17.002 1.00 0.00 O ATOM 447 C5' DA B 15 28.086 33.159 16.687 1.00 0.00 C ATOM 448 C4' DA B 15 28.950 33.493 17.915 1.00 0.00 C ATOM 449 O4' DA B 15 28.449 34.536 18.749 1.00 0.00 O ATOM 450 C3' DA B 15 29.134 32.306 18.862 1.00 0.00 C ATOM 451 O3' DA B 15 30.096 31.373 18.381 1.00 0.00 O ATOM 452 C2' DA B 15 29.604 33.034 20.120 1.00 0.00 C ATOM 453 C1' DA B 15 29.260 34.503 19.910 1.00 0.00 C ATOM 454 N9 DA B 15 28.659 35.066 21.138 1.00 0.00 N ATOM 455 C8 DA B 15 27.462 34.757 21.735 1.00 0.00 C ATOM 456 N7 DA B 15 27.271 35.342 22.891 1.00 0.00 N ATOM 457 C5 DA B 15 28.464 36.060 23.086 1.00 0.00 C ATOM 458 C6 DA B 15 28.991 36.894 24.107 1.00 0.00 C ATOM 459 N6 DA B 15 28.373 37.241 25.220 1.00 0.00 N ATOM 460 N1 DA B 15 30.210 37.421 24.006 1.00 0.00 N ATOM 461 C2 DA B 15 30.929 37.141 22.928 1.00 0.00 C ATOM 462 N3 DA B 15 30.579 36.386 21.894 1.00 0.00 N ATOM 463 C4 DA B 15 29.319 35.880 22.031 1.00 0.00 C ATOM 0 H5' DA B 15 27.900 34.075 16.127 1.00 0.00 H new ATOM 0 H5'' DA B 15 28.647 32.493 16.032 1.00 0.00 H new ATOM 0 H4' DA B 15 29.881 33.801 17.439 1.00 0.00 H new ATOM 0 H3' DA B 15 28.245 31.691 18.999 1.00 0.00 H new ATOM 0 H2' DA B 15 29.107 32.640 21.007 1.00 0.00 H new ATOM 0 H2'' DA B 15 30.676 32.902 20.270 1.00 0.00 H new ATOM 0 H1' DA B 15 30.124 35.146 19.739 1.00 0.00 H new ATOM 0 H8 DA B 15 26.740 34.089 21.290 1.00 0.00 H new ATOM 0 H61 DA B 15 28.839 37.848 25.894 1.00 0.00 H new ATOM 0 H62 DA B 15 27.429 36.903 25.406 1.00 0.00 H new ATOM 0 H2 DA B 15 31.915 37.579 22.886 1.00 0.00 H new ATOM 475 P DT B 16 30.518 30.059 19.221 1.00 0.00 P ATOM 476 OP1 DT B 16 31.307 29.181 18.322 1.00 0.00 O ATOM 477 OP2 DT B 16 29.307 29.507 19.882 1.00 0.00 O ATOM 478 O5' DT B 16 31.494 30.646 20.363 1.00 0.00 O ATOM 479 C5' DT B 16 32.729 31.278 20.032 1.00 0.00 C ATOM 480 C4' DT B 16 33.379 31.977 21.238 1.00 0.00 C ATOM 481 O4' DT B 16 32.598 33.040 21.768 1.00 0.00 O ATOM 482 C3' DT B 16 33.611 31.015 22.396 1.00 0.00 C ATOM 483 O3' DT B 16 34.780 30.258 22.131 1.00 0.00 O ATOM 484 C2' DT B 16 33.781 32.000 23.548 1.00 0.00 C ATOM 485 C1' DT B 16 32.857 33.164 23.161 1.00 0.00 C ATOM 486 N1 DT B 16 31.570 33.179 23.918 1.00 0.00 N ATOM 487 C2 DT B 16 31.477 34.034 25.024 1.00 0.00 C ATOM 488 O2 DT B 16 32.431 34.664 25.472 1.00 0.00 O ATOM 489 N3 DT B 16 30.248 34.154 25.629 1.00 0.00 N ATOM 490 C4 DT B 16 29.107 33.473 25.259 1.00 0.00 C ATOM 491 O4 DT B 16 28.054 33.720 25.848 1.00 0.00 O ATOM 492 C5 DT B 16 29.292 32.521 24.159 1.00 0.00 C ATOM 493 C7 DT B 16 28.131 31.657 23.698 1.00 0.00 C ATOM 494 C6 DT B 16 30.496 32.402 23.535 1.00 0.00 C ATOM 0 H5' DT B 16 32.558 32.009 19.242 1.00 0.00 H new ATOM 0 H5'' DT B 16 33.418 30.534 19.634 1.00 0.00 H new ATOM 0 H4' DT B 16 34.317 32.364 20.839 1.00 0.00 H new ATOM 0 H3' DT B 16 32.832 30.276 22.587 1.00 0.00 H new ATOM 0 H2' DT B 16 33.492 31.557 24.501 1.00 0.00 H new ATOM 0 H2'' DT B 16 34.816 32.325 23.649 1.00 0.00 H new ATOM 0 H1' DT B 16 33.354 34.102 23.409 1.00 0.00 H new ATOM 0 H3 DT B 16 30.174 34.799 26.416 1.00 0.00 H new ATOM 0 H71 DT B 16 27.466 31.462 24.539 1.00 0.00 H new ATOM 0 H72 DT B 16 27.580 32.176 22.913 1.00 0.00 H new ATOM 0 H73 DT B 16 28.512 30.712 23.310 1.00 0.00 H new ATOM 0 H6 DT B 16 30.612 31.691 22.730 1.00 0.00 H new ATOM 507 P DG B 17 34.857 28.686 22.447 1.00 0.00 P ATOM 508 OP1 DG B 17 36.106 28.151 21.847 1.00 0.00 O ATOM 509 OP2 DG B 17 33.564 28.042 22.112 1.00 0.00 O ATOM 510 O5' DG B 17 35.011 28.699 24.037 1.00 0.00 O ATOM 511 C5' DG B 17 36.187 29.187 24.666 1.00 0.00 C ATOM 512 C4' DG B 17 36.096 29.049 26.189 1.00 0.00 C ATOM 513 O4' DG B 17 35.113 29.939 26.704 1.00 0.00 O ATOM 514 C3' DG B 17 35.694 27.621 26.597 1.00 0.00 C ATOM 515 O3' DG B 17 36.371 27.180 27.761 1.00 0.00 O ATOM 516 C2' DG B 17 34.209 27.798 26.889 1.00 0.00 C ATOM 517 C1' DG B 17 34.176 29.213 27.474 1.00 0.00 C ATOM 518 N9 DG B 17 32.863 29.905 27.403 1.00 0.00 N ATOM 519 C8 DG B 17 31.892 29.849 26.429 1.00 0.00 C ATOM 520 N7 DG B 17 30.870 30.641 26.638 1.00 0.00 N ATOM 521 C5 DG B 17 31.182 31.271 27.851 1.00 0.00 C ATOM 522 C6 DG B 17 30.480 32.254 28.641 1.00 0.00 C ATOM 523 O6 DG B 17 29.391 32.783 28.443 1.00 0.00 O ATOM 524 N1 DG B 17 31.152 32.635 29.785 1.00 0.00 N ATOM 525 C2 DG B 17 32.340 32.122 30.158 1.00 0.00 C ATOM 526 N2 DG B 17 32.864 32.560 31.266 1.00 0.00 N ATOM 527 N3 DG B 17 33.029 31.226 29.461 1.00 0.00 N ATOM 528 C4 DG B 17 32.400 30.828 28.316 1.00 0.00 C ATOM 0 H5' DG B 17 36.337 30.234 24.401 1.00 0.00 H new ATOM 0 H5'' DG B 17 37.054 28.638 24.299 1.00 0.00 H new ATOM 0 H4' DG B 17 37.081 29.283 26.594 1.00 0.00 H new ATOM 0 H3' DG B 17 35.933 26.877 25.838 1.00 0.00 H new ATOM 0 H2' DG B 17 33.601 27.713 25.988 1.00 0.00 H new ATOM 0 H2'' DG B 17 33.839 27.054 27.595 1.00 0.00 H new ATOM 0 H1' DG B 17 34.394 29.152 28.540 1.00 0.00 H new ATOM 0 H8 DG B 17 31.967 29.206 25.565 1.00 0.00 H new ATOM 0 H1 DG B 17 30.725 33.344 30.381 1.00 0.00 H new ATOM 0 H21 DG B 17 33.763 32.197 31.584 1.00 0.00 H new ATOM 0 H22 DG B 17 32.376 33.266 31.817 1.00 0.00 H new ATOM 540 P DT B 18 37.846 26.548 27.671 1.00 0.00 P ATOM 541 OP1 DT B 18 38.648 27.291 26.666 1.00 0.00 O ATOM 542 OP2 DT B 18 37.713 25.077 27.536 1.00 0.00 O ATOM 543 O5' DT B 18 38.458 26.856 29.123 1.00 0.00 O ATOM 544 C5' DT B 18 38.526 28.180 29.649 1.00 0.00 C ATOM 545 C4' DT B 18 37.545 28.405 30.812 1.00 0.00 C ATOM 546 O4' DT B 18 36.191 28.571 30.418 1.00 0.00 O ATOM 547 C3' DT B 18 37.565 27.289 31.866 1.00 0.00 C ATOM 548 O3' DT B 18 38.384 27.684 32.959 1.00 0.00 O ATOM 549 C2' DT B 18 36.084 27.120 32.221 1.00 0.00 C ATOM 550 C1' DT B 18 35.419 28.335 31.580 1.00 0.00 C ATOM 551 N1 DT B 18 33.974 28.178 31.247 1.00 0.00 N ATOM 552 C2 DT B 18 33.064 29.066 31.839 1.00 0.00 C ATOM 553 O2 DT B 18 33.337 29.819 32.770 1.00 0.00 O ATOM 554 N3 DT B 18 31.786 29.072 31.338 1.00 0.00 N ATOM 555 C4 DT B 18 31.340 28.296 30.297 1.00 0.00 C ATOM 556 O4 DT B 18 30.241 28.541 29.811 1.00 0.00 O ATOM 557 C5 DT B 18 32.262 27.242 29.879 1.00 0.00 C ATOM 558 C7 DT B 18 31.787 26.170 28.909 1.00 0.00 C ATOM 559 C6 DT B 18 33.539 27.222 30.348 1.00 0.00 C ATOM 0 H5' DT B 18 38.311 28.894 28.854 1.00 0.00 H new ATOM 0 H5'' DT B 18 39.541 28.379 29.991 1.00 0.00 H new ATOM 0 H4' DT B 18 37.918 29.336 31.239 1.00 0.00 H new ATOM 0 H3' DT B 18 37.992 26.343 31.534 1.00 0.00 H new ATOM 0 H2' DT B 18 35.681 26.188 31.826 1.00 0.00 H new ATOM 0 H2'' DT B 18 35.930 27.102 33.300 1.00 0.00 H new ATOM 0 H1' DT B 18 35.405 29.165 32.286 1.00 0.00 H new ATOM 0 H3 DT B 18 31.114 29.703 31.774 1.00 0.00 H new ATOM 0 H71 DT B 18 30.718 26.006 29.043 1.00 0.00 H new ATOM 0 H72 DT B 18 31.979 26.494 27.886 1.00 0.00 H new ATOM 0 H73 DT B 18 32.324 25.241 29.102 1.00 0.00 H new ATOM 0 H6 DT B 18 34.219 26.452 30.015 1.00 0.00 H new ATOM 572 P DA B 19 38.923 26.625 34.052 1.00 0.00 P ATOM 573 OP1 DA B 19 40.128 27.206 34.695 1.00 0.00 O ATOM 574 OP2 DA B 19 39.021 25.281 33.431 1.00 0.00 O ATOM 575 O5' DA B 19 37.730 26.594 35.130 1.00 0.00 O ATOM 576 C5' DA B 19 37.485 27.722 35.960 1.00 0.00 C ATOM 577 C4' DA B 19 36.106 27.673 36.621 1.00 0.00 C ATOM 578 O4' DA B 19 35.079 27.710 35.638 1.00 0.00 O ATOM 579 C3' DA B 19 35.872 26.442 37.508 1.00 0.00 C ATOM 580 O3' DA B 19 35.692 26.870 38.854 1.00 0.00 O ATOM 581 C2' DA B 19 34.629 25.814 36.871 1.00 0.00 C ATOM 582 C1' DA B 19 33.978 26.973 36.117 1.00 0.00 C ATOM 583 N9 DA B 19 33.168 26.535 34.957 1.00 0.00 N ATOM 584 C8 DA B 19 33.534 25.663 33.958 1.00 0.00 C ATOM 585 N7 DA B 19 32.627 25.480 33.036 1.00 0.00 N ATOM 586 C5 DA B 19 31.574 26.297 33.477 1.00 0.00 C ATOM 587 C6 DA B 19 30.280 26.586 32.990 1.00 0.00 C ATOM 588 N6 DA B 19 29.768 26.069 31.892 1.00 0.00 N ATOM 589 N1 DA B 19 29.471 27.436 33.621 1.00 0.00 N ATOM 590 C2 DA B 19 29.915 27.993 34.737 1.00 0.00 C ATOM 591 N3 DA B 19 31.094 27.823 35.326 1.00 0.00 N ATOM 592 C4 DA B 19 31.892 26.951 34.638 1.00 0.00 C ATOM 0 H5' DA B 19 37.567 28.632 35.365 1.00 0.00 H new ATOM 0 H5'' DA B 19 38.253 27.775 36.732 1.00 0.00 H new ATOM 0 H4' DA B 19 36.074 28.552 37.265 1.00 0.00 H new ATOM 0 H3' DA B 19 36.689 25.722 37.558 1.00 0.00 H new ATOM 0 H2' DA B 19 34.894 24.998 36.198 1.00 0.00 H new ATOM 0 H2'' DA B 19 33.959 25.401 37.625 1.00 0.00 H new ATOM 0 H1' DA B 19 33.296 27.521 36.767 1.00 0.00 H new ATOM 0 H8 DA B 19 34.494 25.169 33.938 1.00 0.00 H new ATOM 0 H61 DA B 19 28.824 26.324 31.600 1.00 0.00 H new ATOM 0 H62 DA B 19 30.315 25.414 31.334 1.00 0.00 H new ATOM 0 H2 DA B 19 29.234 28.670 35.230 1.00 0.00 H new ATOM 604 P DC B 20 35.506 25.841 40.082 1.00 0.00 P ATOM 605 OP1 DC B 20 35.902 26.539 41.331 1.00 0.00 O ATOM 606 OP2 DC B 20 36.161 24.552 39.743 1.00 0.00 O ATOM 607 O5' DC B 20 33.914 25.610 40.108 1.00 0.00 O ATOM 608 C5' DC B 20 33.036 26.697 40.369 1.00 0.00 C ATOM 609 C4' DC B 20 31.568 26.368 40.073 1.00 0.00 C ATOM 610 O4' DC B 20 31.343 26.127 38.686 1.00 0.00 O ATOM 611 C3' DC B 20 31.060 25.143 40.848 1.00 0.00 C ATOM 612 O3' DC B 20 30.077 25.555 41.792 1.00 0.00 O ATOM 613 C2' DC B 20 30.521 24.247 39.726 1.00 0.00 C ATOM 614 C1' DC B 20 30.254 25.227 38.579 1.00 0.00 C ATOM 615 N1 DC B 20 30.223 24.618 37.211 1.00 0.00 N ATOM 616 C2 DC B 20 29.089 24.777 36.390 1.00 0.00 C ATOM 617 O2 DC B 20 28.086 25.386 36.764 1.00 0.00 O ATOM 618 N3 DC B 20 29.057 24.262 35.130 1.00 0.00 N ATOM 619 C4 DC B 20 30.117 23.609 34.698 1.00 0.00 C ATOM 620 N4 DC B 20 30.079 23.161 33.474 1.00 0.00 N ATOM 621 C5 DC B 20 31.299 23.435 35.465 1.00 0.00 C ATOM 622 C6 DC B 20 31.318 23.952 36.719 1.00 0.00 C ATOM 0 H5' DC B 20 33.339 27.554 39.767 1.00 0.00 H new ATOM 0 H5'' DC B 20 33.133 26.992 41.414 1.00 0.00 H new ATOM 0 H4' DC B 20 31.017 27.251 40.396 1.00 0.00 H new ATOM 0 H3' DC B 20 31.804 24.617 41.447 1.00 0.00 H new ATOM 0 H2' DC B 20 31.244 23.483 39.441 1.00 0.00 H new ATOM 0 H2'' DC B 20 29.612 23.728 40.029 1.00 0.00 H new ATOM 0 H1' DC B 20 29.262 25.669 38.675 1.00 0.00 H new ATOM 0 H41 DC B 20 30.875 22.649 33.093 1.00 0.00 H new ATOM 0 H42 DC B 20 29.253 23.322 32.897 1.00 0.00 H new ATOM 0 H5 DC B 20 32.153 22.909 35.064 1.00 0.00 H new ATOM 0 H6 DC B 20 32.199 23.839 37.333 1.00 0.00 H new ATOM 634 P DA B 21 29.537 24.584 42.966 1.00 0.00 P ATOM 635 OP1 DA B 21 29.009 25.438 44.060 1.00 0.00 O ATOM 636 OP2 DA B 21 30.577 23.576 43.288 1.00 0.00 O ATOM 637 O5' DA B 21 28.302 23.830 42.264 1.00 0.00 O ATOM 638 C5' DA B 21 27.106 24.533 41.951 1.00 0.00 C ATOM 639 C4' DA B 21 26.275 23.840 40.866 1.00 0.00 C ATOM 640 O4' DA B 21 27.000 23.717 39.650 1.00 0.00 O ATOM 641 C3' DA B 21 25.851 22.411 41.207 1.00 0.00 C ATOM 642 O3' DA B 21 24.686 22.396 42.023 1.00 0.00 O ATOM 643 C2' DA B 21 25.619 21.811 39.816 1.00 0.00 C ATOM 644 C1' DA B 21 26.272 22.804 38.854 1.00 0.00 C ATOM 645 N9 DA B 21 27.107 22.179 37.807 1.00 0.00 N ATOM 646 C8 DA B 21 28.365 21.635 37.912 1.00 0.00 C ATOM 647 N7 DA B 21 28.815 21.107 36.801 1.00 0.00 N ATOM 648 C5 DA B 21 27.762 21.329 35.894 1.00 0.00 C ATOM 649 C6 DA B 21 27.530 21.043 34.523 1.00 0.00 C ATOM 650 N6 DA B 21 28.367 20.426 33.711 1.00 0.00 N ATOM 651 N1 DA B 21 26.399 21.409 33.918 1.00 0.00 N ATOM 652 C2 DA B 21 25.492 22.047 34.639 1.00 0.00 C ATOM 653 N3 DA B 21 25.551 22.383 35.922 1.00 0.00 N ATOM 654 C4 DA B 21 26.727 21.994 36.497 1.00 0.00 C ATOM 0 H5' DA B 21 27.358 25.541 41.620 1.00 0.00 H new ATOM 0 H5'' DA B 21 26.503 24.635 42.854 1.00 0.00 H new ATOM 0 H4' DA B 21 25.399 24.483 40.781 1.00 0.00 H new ATOM 0 H3' DA B 21 26.580 21.851 41.793 1.00 0.00 H new ATOM 0 H2' DA B 21 26.069 20.822 39.731 1.00 0.00 H new ATOM 0 H2'' DA B 21 24.556 21.696 39.606 1.00 0.00 H new ATOM 0 H1' DA B 21 25.496 23.310 38.279 1.00 0.00 H new ATOM 0 H8 DA B 21 28.933 21.642 38.831 1.00 0.00 H new ATOM 0 H61 DA B 21 28.108 20.266 32.737 1.00 0.00 H new ATOM 0 H62 DA B 21 29.273 20.109 34.057 1.00 0.00 H new ATOM 0 H2 DA B 21 24.589 22.330 34.118 1.00 0.00 H new ATOM 666 P DT B 22 24.069 21.024 42.601 1.00 0.00 P ATOM 667 OP1 DT B 22 23.177 21.369 43.738 1.00 0.00 O ATOM 668 OP2 DT B 22 25.176 20.062 42.832 1.00 0.00 O ATOM 669 O5' DT B 22 23.169 20.475 41.379 1.00 0.00 O ATOM 670 C5' DT B 22 21.898 21.043 41.084 1.00 0.00 C ATOM 671 C4' DT B 22 21.215 20.389 39.875 1.00 0.00 C ATOM 672 O4' DT B 22 21.849 20.729 38.649 1.00 0.00 O ATOM 673 C3' DT B 22 21.218 18.859 39.910 1.00 0.00 C ATOM 674 O3' DT B 22 20.273 18.327 40.826 1.00 0.00 O ATOM 675 C2' DT B 22 20.841 18.586 38.458 1.00 0.00 C ATOM 676 C1' DT B 22 21.538 19.720 37.697 1.00 0.00 C ATOM 677 N1 DT B 22 22.786 19.253 37.031 1.00 0.00 N ATOM 678 C2 DT B 22 22.727 18.962 35.661 1.00 0.00 C ATOM 679 O2 DT B 22 21.699 19.050 34.989 1.00 0.00 O ATOM 680 N3 DT B 22 23.895 18.550 35.065 1.00 0.00 N ATOM 681 C4 DT B 22 25.100 18.367 35.699 1.00 0.00 C ATOM 682 O4 DT B 22 26.064 17.995 35.030 1.00 0.00 O ATOM 683 C5 DT B 22 25.083 18.627 37.140 1.00 0.00 C ATOM 684 C7 DT B 22 26.324 18.375 37.976 1.00 0.00 C ATOM 685 C6 DT B 22 23.945 19.048 37.754 1.00 0.00 C ATOM 0 H5' DT B 22 22.018 22.109 40.894 1.00 0.00 H new ATOM 0 H5'' DT B 22 21.251 20.946 41.956 1.00 0.00 H new ATOM 0 H4' DT B 22 20.196 20.771 39.934 1.00 0.00 H new ATOM 0 H3' DT B 22 22.150 18.405 40.246 1.00 0.00 H new ATOM 0 H2' DT B 22 21.189 17.607 38.129 1.00 0.00 H new ATOM 0 H2'' DT B 22 19.761 18.607 38.311 1.00 0.00 H new ATOM 0 H1' DT B 22 20.881 20.095 36.912 1.00 0.00 H new ATOM 0 H3 DT B 22 23.864 18.363 34.063 1.00 0.00 H new ATOM 0 H71 DT B 22 26.902 17.564 37.534 1.00 0.00 H new ATOM 0 H72 DT B 22 26.932 19.279 38.006 1.00 0.00 H new ATOM 0 H73 DT B 22 26.031 18.101 38.989 1.00 0.00 H new ATOM 0 H6 DT B 22 23.947 19.224 38.820 1.00 0.00 H new ATOM 698 P DC B 23 20.436 16.846 41.441 1.00 0.00 P ATOM 699 OP1 DC B 23 19.424 16.684 42.514 1.00 0.00 O ATOM 700 OP2 DC B 23 21.865 16.606 41.764 1.00 0.00 O ATOM 701 O5' DC B 23 20.042 15.878 40.220 1.00 0.00 O ATOM 702 C5' DC B 23 18.739 15.898 39.653 1.00 0.00 C ATOM 703 C4' DC B 23 18.571 14.863 38.532 1.00 0.00 C ATOM 704 O4' DC B 23 19.517 15.091 37.485 1.00 0.00 O ATOM 705 C3' DC B 23 18.749 13.422 39.036 1.00 0.00 C ATOM 706 O3' DC B 23 17.712 12.604 38.504 1.00 0.00 O ATOM 707 C2' DC B 23 20.144 13.074 38.525 1.00 0.00 C ATOM 708 C1' DC B 23 20.263 13.904 37.244 1.00 0.00 C ATOM 709 N1 DC B 23 21.681 14.247 36.915 1.00 0.00 N ATOM 710 C2 DC B 23 22.229 13.839 35.690 1.00 0.00 C ATOM 711 O2 DC B 23 21.558 13.280 34.823 1.00 0.00 O ATOM 712 N3 DC B 23 23.538 14.054 35.404 1.00 0.00 N ATOM 713 C4 DC B 23 24.275 14.684 36.294 1.00 0.00 C ATOM 714 N4 DC B 23 25.526 14.861 35.979 1.00 0.00 N ATOM 715 C5 DC B 23 23.771 15.178 37.526 1.00 0.00 C ATOM 716 C6 DC B 23 22.465 14.941 37.806 1.00 0.00 C ATOM 0 H5' DC B 23 18.533 16.893 39.259 1.00 0.00 H new ATOM 0 H5'' DC B 23 18.003 15.706 40.434 1.00 0.00 H new ATOM 0 H4' DC B 23 17.554 14.982 38.159 1.00 0.00 H new ATOM 0 H3' DC B 23 18.676 13.281 40.114 1.00 0.00 H new ATOM 0 H2' DC B 23 20.915 13.337 39.249 1.00 0.00 H new ATOM 0 H2'' DC B 23 20.245 12.007 38.325 1.00 0.00 H new ATOM 0 H1' DC B 23 19.888 13.338 36.391 1.00 0.00 H new ATOM 0 H41 DC B 23 26.151 15.342 36.625 1.00 0.00 H new ATOM 0 H42 DC B 23 25.880 14.518 35.086 1.00 0.00 H new ATOM 0 H5 DC B 23 24.403 15.721 38.213 1.00 0.00 H new ATOM 0 H6 DC B 23 22.040 15.299 38.732 1.00 0.00 H new ATOM 728 P DG B 24 17.461 11.089 38.999 1.00 0.00 P ATOM 729 OP1 DG B 24 16.043 10.746 38.724 1.00 0.00 O ATOM 730 OP2 DG B 24 17.983 10.929 40.379 1.00 0.00 O ATOM 731 O5' DG B 24 18.397 10.245 37.999 1.00 0.00 O ATOM 732 C5' DG B 24 18.089 10.174 36.612 1.00 0.00 C ATOM 733 C4' DG B 24 19.244 9.620 35.768 1.00 0.00 C ATOM 734 O4' DG B 24 20.372 10.494 35.807 1.00 0.00 O ATOM 735 C3' DG B 24 19.727 8.226 36.217 1.00 0.00 C ATOM 736 O3' DG B 24 19.796 7.325 35.112 1.00 0.00 O ATOM 737 C2' DG B 24 21.131 8.526 36.734 1.00 0.00 C ATOM 738 C1' DG B 24 21.524 9.672 35.805 1.00 0.00 C ATOM 739 N9 DG B 24 22.748 10.380 36.247 1.00 0.00 N ATOM 740 C8 DG B 24 23.059 10.881 37.490 1.00 0.00 C ATOM 741 N7 DG B 24 24.285 11.325 37.599 1.00 0.00 N ATOM 742 C5 DG B 24 24.832 11.098 36.326 1.00 0.00 C ATOM 743 C6 DG B 24 26.155 11.324 35.795 1.00 0.00 C ATOM 744 O6 DG B 24 27.155 11.779 36.353 1.00 0.00 O ATOM 745 N1 DG B 24 26.292 10.944 34.472 1.00 0.00 N ATOM 746 C2 DG B 24 25.290 10.401 33.736 1.00 0.00 C ATOM 747 N2 DG B 24 25.553 10.069 32.499 1.00 0.00 N ATOM 748 N3 DG B 24 24.062 10.160 34.185 1.00 0.00 N ATOM 749 C4 DG B 24 23.890 10.535 35.491 1.00 0.00 C ATOM 0 H5' DG B 24 17.828 11.169 36.252 1.00 0.00 H new ATOM 0 H5'' DG B 24 17.210 9.544 36.473 1.00 0.00 H new ATOM 0 H4' DG B 24 18.837 9.539 34.760 1.00 0.00 H new ATOM 0 H3' DG B 24 19.069 7.755 36.947 1.00 0.00 H new ATOM 0 H2' DG B 24 21.133 8.822 37.783 1.00 0.00 H new ATOM 0 H2'' DG B 24 21.799 7.670 36.643 1.00 0.00 H new ATOM 0 HO3' DG B 24 20.106 6.449 35.423 1.00 0.00 H new ATOM 0 H1' DG B 24 21.794 9.333 34.805 1.00 0.00 H new ATOM 0 H8 DG B 24 22.352 10.906 38.306 1.00 0.00 H new ATOM 0 H1 DG B 24 27.198 11.080 34.024 1.00 0.00 H new ATOM 0 H21 DG B 24 24.824 9.658 31.915 1.00 0.00 H new ATOM 0 H22 DG B 24 26.487 10.221 32.118 1.00 0.00 H new TER 762 DG B 24 HETATM 763 O81 9TK A 101 23.201 29.921 38.426 1.00 0.00 O HETATM 764 C81 9TK A 101 23.808 29.359 37.518 1.00 0.00 C HETATM 765 C83 9TK A 101 21.678 26.905 35.859 1.00 0.00 C HETATM 766 N81 9TK A 101 21.899 27.865 36.818 1.00 0.00 N HETATM 767 C88 9TK A 101 20.879 28.322 37.769 1.00 0.00 C HETATM 768 C82 9TK A 101 23.222 28.272 36.661 1.00 0.00 C HETATM 769 N82 9TK A 101 23.824 27.598 35.685 1.00 0.00 N HETATM 770 C84 9TK A 101 22.861 26.749 35.193 1.00 0.00 C HETATM 776 N PYB A 102 25.117 29.703 37.181 1.00 0.00 N HETATM 777 CA PYB A 102 25.942 30.615 37.831 1.00 0.00 C HETATM 778 CB1 PYB A 102 27.223 31.025 37.380 1.00 0.00 C HETATM 779 CB PYB A 102 25.664 31.250 39.011 1.00 0.00 C HETATM 780 CG1 PYB A 102 27.714 31.926 38.298 1.00 0.00 C HETATM 781 NG2 PYB A 102 26.735 32.086 39.290 1.00 0.00 N HETATM 782 CD PYB A 102 26.730 33.006 40.436 1.00 0.00 C HETATM 783 C PYB A 102 29.029 32.623 38.389 1.00 0.00 C HETATM 784 O PYB A 102 29.337 33.279 39.375 1.00 0.00 O HETATM 0 HD3 PYB A 102 25.898 33.703 40.339 1.00 0.00 H new HETATM 0 HD2 PYB A 102 26.621 32.437 41.359 1.00 0.00 H new HETATM 0 HD1 PYB A 102 27.668 33.561 40.461 1.00 0.00 H new HETATM 0 HB1 PYB A 102 27.726 30.689 36.473 1.00 0.00 H new HETATM 0 HB PYB A 102 24.768 31.123 39.618 1.00 0.00 H new HETATM 0 H PYB A 102 25.421 29.272 36.308 1.00 0.00 H new HETATM 791 N PYB A 103 29.891 32.507 37.301 1.00 0.00 N HETATM 792 CA PYB A 103 31.205 32.985 37.267 1.00 0.00 C HETATM 793 CB1 PYB A 103 31.985 33.260 36.110 1.00 0.00 C HETATM 794 CB PYB A 103 31.954 33.289 38.372 1.00 0.00 C HETATM 795 CG1 PYB A 103 33.191 33.783 36.531 1.00 0.00 C HETATM 796 NG2 PYB A 103 33.168 33.787 37.936 1.00 0.00 N HETATM 797 CD PYB A 103 34.199 34.243 38.881 1.00 0.00 C HETATM 798 C PYB A 103 34.394 34.269 35.787 1.00 0.00 C HETATM 799 O PYB A 103 35.401 34.630 36.380 1.00 0.00 O HETATM 0 HD3 PYB A 103 33.802 35.057 39.488 1.00 0.00 H new HETATM 0 HD2 PYB A 103 34.490 33.416 39.529 1.00 0.00 H new HETATM 0 HD1 PYB A 103 35.070 34.594 38.328 1.00 0.00 H new HETATM 0 HB1 PYB A 103 31.684 33.089 35.076 1.00 0.00 H new HETATM 0 HB PYB A 103 31.648 33.161 39.410 1.00 0.00 H new HETATM 0 H PYB A 103 29.394 32.319 36.430 1.00 0.00 H new HETATM 806 N PYB A 104 34.332 34.313 34.395 1.00 0.00 N HETATM 807 CA PYB A 104 35.372 34.709 33.538 1.00 0.00 C HETATM 808 CB1 PYB A 104 35.286 34.841 32.125 1.00 0.00 C HETATM 809 CB PYB A 104 36.645 35.062 33.916 1.00 0.00 C HETATM 810 CG1 PYB A 104 36.509 35.287 31.669 1.00 0.00 C HETATM 811 NG2 PYB A 104 37.324 35.482 32.785 1.00 0.00 N HETATM 812 CD PYB A 104 38.658 36.095 32.840 1.00 0.00 C HETATM 813 C PYB A 104 37.027 35.512 30.290 1.00 0.00 C HETATM 814 O PYB A 104 38.166 35.871 30.031 1.00 0.00 O HETATM 0 HD3 PYB A 104 38.616 37.004 33.440 1.00 0.00 H new HETATM 0 HD2 PYB A 104 39.362 35.395 33.290 1.00 0.00 H new HETATM 0 HD1 PYB A 104 38.987 36.341 31.831 1.00 0.00 H new HETATM 0 HB1 PYB A 104 34.410 34.628 31.512 1.00 0.00 H new HETATM 0 HB PYB A 104 37.049 35.019 34.928 1.00 0.00 H new HETATM 0 H PYB A 104 33.413 34.090 34.013 1.00 0.00 H new HETATM 821 N ABU A 105 36.152 35.233 29.267 1.00 0.00 N HETATM 822 CA ABU A 105 36.610 35.210 27.867 1.00 0.00 C HETATM 823 CB ABU A 105 35.665 34.487 26.885 1.00 0.00 C HETATM 824 CG ABU A 105 35.318 33.019 27.256 1.00 0.00 C HETATM 825 CD ABU A 105 36.317 32.345 28.206 1.00 0.00 C HETATM 826 OE1 ABU A 105 37.490 32.159 27.918 1.00 0.00 O HETATM 0 H ABU A 105 35.161 35.029 29.396 1.00 0.00 H new HETATM 0 HB1 ABU A 105 34.738 35.055 26.814 1.00 0.00 H new HETATM 0 HB2 ABU A 105 36.121 34.496 25.895 1.00 0.00 H new HETATM 0 HG1 ABU A 105 34.649 32.602 26.503 1.00 0.00 H new HETATM 0 HG2 ABU A 105 36.233 32.428 27.296 1.00 0.00 H new HETATM 0 HE2 ABU A 105 34.828 32.996 28.229 1.00 0.00 H new HETATM 834 N IMT A 106 35.782 32.043 29.431 1.00 0.00 N HETATM 835 CA IMT A 106 36.404 31.864 30.631 1.00 0.00 C HETATM 836 NB1 IMT A 106 35.723 31.609 31.789 1.00 0.00 N HETATM 837 CB IMT A 106 37.742 32.021 30.860 1.00 0.00 C HETATM 838 CG1 IMT A 106 36.650 31.609 32.742 1.00 0.00 C HETATM 839 NG2 IMT A 106 37.917 31.848 32.215 1.00 0.00 N HETATM 840 CD IMT A 106 39.219 31.887 32.894 1.00 0.00 C HETATM 841 C IMT A 106 36.452 31.383 34.217 1.00 0.00 C HETATM 842 O IMT A 106 37.351 31.480 35.047 1.00 0.00 O HETATM 0 HN2 IMT A 106 34.765 31.989 29.370 1.00 0.00 H new HETATM 0 HD3 IMT A 106 39.864 31.108 32.489 1.00 0.00 H new HETATM 0 HD2 IMT A 106 39.683 32.861 32.736 1.00 0.00 H new HETATM 0 HD1 IMT A 106 39.077 31.722 33.962 1.00 0.00 H new HETATM 0 HB IMT A 106 38.513 32.239 30.121 1.00 0.00 H new HETATM 848 N PYB A 107 35.154 31.026 34.585 1.00 0.00 N HETATM 849 CA PYB A 107 34.668 30.809 35.873 1.00 0.00 C HETATM 850 CB1 PYB A 107 33.383 30.295 36.203 1.00 0.00 C HETATM 851 CB PYB A 107 35.346 31.065 37.032 1.00 0.00 C HETATM 852 CG1 PYB A 107 33.304 30.224 37.578 1.00 0.00 C HETATM 853 NG2 PYB A 107 34.534 30.674 38.082 1.00 0.00 N HETATM 854 CD PYB A 107 35.001 30.718 39.477 1.00 0.00 C HETATM 855 C PYB A 107 32.191 29.841 38.504 1.00 0.00 C HETATM 856 O PYB A 107 32.319 29.958 39.715 1.00 0.00 O HETATM 0 HD3 PYB A 107 35.875 30.076 39.589 1.00 0.00 H new HETATM 0 HD2 PYB A 107 35.267 31.742 39.739 1.00 0.00 H new HETATM 0 HD1 PYB A 107 34.207 30.369 40.138 1.00 0.00 H new HETATM 0 HB1 PYB A 107 32.603 30.009 35.497 1.00 0.00 H new HETATM 0 HB PYB A 107 36.343 31.498 37.114 1.00 0.00 H new HETATM 0 H PYB A 107 34.570 30.811 33.777 1.00 0.00 H new HETATM 863 N PYB A 108 31.005 29.339 37.966 1.00 0.00 N HETATM 864 CA PYB A 108 29.835 29.107 38.708 1.00 0.00 C HETATM 865 CB1 PYB A 108 28.724 28.285 38.356 1.00 0.00 C HETATM 866 CB PYB A 108 29.577 29.656 39.937 1.00 0.00 C HETATM 867 CG1 PYB A 108 27.836 28.298 39.418 1.00 0.00 C HETATM 868 NG2 PYB A 108 28.365 29.167 40.382 1.00 0.00 N HETATM 869 CD PYB A 108 27.797 29.570 41.678 1.00 0.00 C HETATM 870 C PYB A 108 26.519 27.622 39.657 1.00 0.00 C HETATM 871 O PYB A 108 25.890 27.783 40.694 1.00 0.00 O HETATM 0 HD3 PYB A 108 28.483 29.292 42.478 1.00 0.00 H new HETATM 0 HD2 PYB A 108 27.645 30.649 41.689 1.00 0.00 H new HETATM 0 HD1 PYB A 108 26.841 29.068 41.828 1.00 0.00 H new HETATM 0 HB1 PYB A 108 28.597 27.743 37.419 1.00 0.00 H new HETATM 0 HB PYB A 108 30.218 30.358 40.471 1.00 0.00 H new HETATM 0 H PYB A 108 31.130 28.892 37.058 1.00 0.00 H new HETATM 878 N PYB A 109 26.028 26.783 38.667 1.00 0.00 N HETATM 879 CA PYB A 109 24.781 26.145 38.677 1.00 0.00 C HETATM 880 CB1 PYB A 109 24.329 25.239 37.690 1.00 0.00 C HETATM 881 CB PYB A 109 23.772 26.294 39.602 1.00 0.00 C HETATM 882 CG1 PYB A 109 23.056 24.833 38.027 1.00 0.00 C HETATM 883 NG2 PYB A 109 22.713 25.481 39.213 1.00 0.00 N HETATM 884 CD PYB A 109 21.460 25.368 39.971 1.00 0.00 C HETATM 885 C PYB A 109 22.108 23.952 37.294 1.00 0.00 C HETATM 886 O PYB A 109 20.942 23.752 37.598 1.00 0.00 O HETATM 0 HD3 PYB A 109 21.674 25.001 40.975 1.00 0.00 H new HETATM 0 HD2 PYB A 109 20.985 26.347 40.037 1.00 0.00 H new HETATM 0 HD1 PYB A 109 20.790 24.673 39.465 1.00 0.00 H new HETATM 0 HB1 PYB A 109 24.891 24.917 36.813 1.00 0.00 H new HETATM 0 HB PYB A 109 23.799 26.935 40.483 1.00 0.00 H new HETATM 0 H PYB A 109 26.685 26.606 37.908 1.00 0.00 H new HETATM 893 C01 9T8 A 110 13.416 24.566 32.232 1.00 0.00 C HETATM 894 N02 9T8 A 110 19.245 22.575 33.539 1.00 0.00 N HETATM 895 C03 9T8 A 110 15.567 23.438 32.791 1.00 0.00 C HETATM 896 C05 9T8 A 110 17.786 22.602 33.715 1.00 0.00 C HETATM 897 C06 9T8 A 110 20.063 23.630 33.883 1.00 0.00 C HETATM 898 C07 9T8 A 110 21.546 23.298 33.944 1.00 0.00 C HETATM 899 C04 9T8 A 110 17.079 23.295 32.535 1.00 0.00 C HETATM 900 N01 9T8 A 110 14.835 24.272 31.743 1.00 0.00 N HETATM 901 C02 9T8 A 110 14.763 23.523 30.409 1.00 0.00 C HETATM 902 N03 9T8 A 110 22.660 23.375 36.178 1.00 0.00 N HETATM 903 C08 9T8 A 110 21.931 22.527 35.225 1.00 0.00 C HETATM 904 O01 9T8 A 110 19.622 24.737 34.137 1.00 0.00 O