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 (180deg=-0.541) USER MOD Single : A 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : A 10 DT C7 :methyl 150:sc= -0.171 (180deg=-0.171) 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= -0.391 (180deg=-0.67) USER MOD Single : B 18 DT C7 :methyl 150:sc= -1.08 (180deg=-1.08) USER MOD Single : B 22 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 N1 DCZ A 1 27.611 9.379 28.859 1.00 0.00 N HETATM 2 C2 DCZ A 1 26.672 8.466 29.355 1.00 0.00 C HETATM 3 N3 DCZ A 1 25.952 8.740 30.466 1.00 0.00 N HETATM 4 C4 DCZ A 1 26.143 9.892 31.068 1.00 0.00 C HETATM 5 C5 DCZ A 1 27.098 10.855 30.639 1.00 0.00 C HETATM 6 C6 DCZ A 1 27.823 10.564 29.526 1.00 0.00 C HETATM 7 O2 DCZ A 1 26.426 7.402 28.784 1.00 0.00 O HETATM 8 N4 DCZ A 1 25.365 10.112 32.091 1.00 0.00 N HETATM 9 C1' DCZ A 1 28.243 9.106 27.534 1.00 0.00 C HETATM 10 C2' DCZ A 1 27.815 10.119 26.463 1.00 0.00 C HETATM 11 C3' DCZ A 1 29.127 10.672 25.911 1.00 0.00 C HETATM 12 C4' DCZ A 1 30.101 9.558 26.301 1.00 0.00 C HETATM 13 O4' DCZ A 1 29.659 9.168 27.594 1.00 0.00 O HETATM 14 O3' DCZ A 1 29.079 10.876 24.505 1.00 0.00 O HETATM 15 C5' DCZ A 1 31.578 9.988 26.308 1.00 0.00 C HETATM 16 O5' DCZ A 1 31.858 11.021 27.253 1.00 0.00 O HETATM 0 HO51 DCZ A 1 32.810 11.251 27.214 1.00 0.00 H new HETATM 0 HN42 DCZ A 1 25.447 10.983 32.616 1.00 0.00 H new HETATM 0 HN41 DCZ A 1 24.675 9.413 32.366 1.00 0.00 H new HETATM 0 H5'2 DCZ A 1 32.201 9.122 26.531 1.00 0.00 H new HETATM 0 H5'1 DCZ A 1 31.855 10.331 25.311 1.00 0.00 H new HETATM 0 H2'2 DCZ A 1 27.225 9.643 25.680 1.00 0.00 H new HETATM 0 H2'1 DCZ A 1 27.199 10.911 26.890 1.00 0.00 H new HETATM 0 H6 DCZ A 1 28.571 11.268 29.163 1.00 0.00 H new HETATM 0 H5 DCZ A 1 27.243 11.789 31.181 1.00 0.00 H new HETATM 0 H4' DCZ A 1 30.087 8.748 25.572 1.00 0.00 H new HETATM 0 H3' DCZ A 1 29.393 11.655 26.298 1.00 0.00 H new HETATM 0 H1' DCZ A 1 27.908 8.103 27.271 1.00 0.00 H new ATOM 29 P DG A 2 28.347 12.152 23.850 1.00 0.00 P ATOM 30 OP1 DG A 2 28.879 12.322 22.474 1.00 0.00 O ATOM 31 OP2 DG A 2 28.447 13.294 24.792 1.00 0.00 O ATOM 32 O5' DG A 2 26.792 11.733 23.749 1.00 0.00 O ATOM 33 C5' DG A 2 26.328 10.727 22.853 1.00 0.00 C ATOM 34 C4' DG A 2 24.849 10.887 22.439 1.00 0.00 C ATOM 35 O4' DG A 2 23.939 10.506 23.470 1.00 0.00 O ATOM 36 C3' DG A 2 24.493 12.320 22.029 1.00 0.00 C ATOM 37 O3' DG A 2 23.532 12.296 20.978 1.00 0.00 O ATOM 38 C2' DG A 2 23.942 12.872 23.344 1.00 0.00 C ATOM 39 C1' DG A 2 23.262 11.653 23.978 1.00 0.00 C ATOM 40 N9 DG A 2 23.371 11.613 25.458 1.00 0.00 N ATOM 41 C8 DG A 2 24.523 11.603 26.204 1.00 0.00 C ATOM 42 N7 DG A 2 24.346 11.418 27.484 1.00 0.00 N ATOM 43 C5 DG A 2 22.952 11.347 27.606 1.00 0.00 C ATOM 44 C6 DG A 2 22.116 11.189 28.764 1.00 0.00 C ATOM 45 O6 DG A 2 22.447 11.041 29.941 1.00 0.00 O ATOM 46 N1 DG A 2 20.768 11.223 28.482 1.00 0.00 N ATOM 47 C2 DG A 2 20.264 11.357 27.232 1.00 0.00 C ATOM 48 N2 DG A 2 18.964 11.415 27.133 1.00 0.00 N ATOM 49 N3 DG A 2 20.994 11.483 26.122 1.00 0.00 N ATOM 50 C4 DG A 2 22.343 11.479 26.373 1.00 0.00 C ATOM 0 H5' DG A 2 26.460 9.751 23.319 1.00 0.00 H new ATOM 0 H5'' DG A 2 26.949 10.739 21.957 1.00 0.00 H new ATOM 0 H4' DG A 2 24.745 10.219 21.584 1.00 0.00 H new ATOM 0 H3' DG A 2 25.311 12.922 21.632 1.00 0.00 H new ATOM 0 H2' DG A 2 24.735 13.266 23.979 1.00 0.00 H new ATOM 0 H2'' DG A 2 23.236 13.685 23.175 1.00 0.00 H new ATOM 0 H1' DG A 2 22.200 11.692 23.735 1.00 0.00 H new ATOM 0 H8 DG A 2 25.501 11.738 25.766 1.00 0.00 H new ATOM 0 H1 DG A 2 20.112 11.143 29.259 1.00 0.00 H new ATOM 0 H21 DG A 2 18.526 11.516 26.217 1.00 0.00 H new ATOM 0 H22 DG A 2 18.386 11.360 27.971 1.00 0.00 H new ATOM 62 P DA A 3 23.298 13.561 20.004 1.00 0.00 P ATOM 63 OP1 DA A 3 22.499 13.104 18.838 1.00 0.00 O ATOM 64 OP2 DA A 3 24.600 14.232 19.760 1.00 0.00 O ATOM 65 O5' DA A 3 22.391 14.530 20.911 1.00 0.00 O ATOM 66 C5' DA A 3 20.992 14.316 21.058 1.00 0.00 C ATOM 67 C4' DA A 3 20.420 14.970 22.322 1.00 0.00 C ATOM 68 O4' DA A 3 20.780 14.256 23.501 1.00 0.00 O ATOM 69 C3' DA A 3 20.890 16.408 22.577 1.00 0.00 C ATOM 70 O3' DA A 3 20.164 17.395 21.845 1.00 0.00 O ATOM 71 C2' DA A 3 20.632 16.508 24.076 1.00 0.00 C ATOM 72 C1' DA A 3 20.414 15.090 24.583 1.00 0.00 C ATOM 73 N9 DA A 3 21.172 14.861 25.832 1.00 0.00 N ATOM 74 C8 DA A 3 22.532 14.847 26.024 1.00 0.00 C ATOM 75 N7 DA A 3 22.899 14.723 27.275 1.00 0.00 N ATOM 76 C5 DA A 3 21.673 14.678 27.958 1.00 0.00 C ATOM 77 C6 DA A 3 21.285 14.575 29.317 1.00 0.00 C ATOM 78 N6 DA A 3 22.112 14.465 30.338 1.00 0.00 N ATOM 79 N1 DA A 3 20.000 14.596 29.669 1.00 0.00 N ATOM 80 C2 DA A 3 19.087 14.707 28.715 1.00 0.00 C ATOM 81 N3 DA A 3 19.292 14.820 27.408 1.00 0.00 N ATOM 82 C4 DA A 3 20.620 14.785 27.091 1.00 0.00 C ATOM 0 H5' DA A 3 20.794 13.245 21.088 1.00 0.00 H new ATOM 0 H5'' DA A 3 20.475 14.712 20.184 1.00 0.00 H new ATOM 0 H4' DA A 3 19.348 14.959 22.127 1.00 0.00 H new ATOM 0 H3' DA A 3 21.916 16.596 22.260 1.00 0.00 H new ATOM 0 H2' DA A 3 21.477 16.974 24.583 1.00 0.00 H new ATOM 0 H2'' DA A 3 19.759 17.128 24.277 1.00 0.00 H new ATOM 0 H1' DA A 3 19.384 14.879 24.869 1.00 0.00 H new ATOM 0 H8 DA A 3 23.239 14.931 25.212 1.00 0.00 H new ATOM 0 H61 DA A 3 21.744 14.396 31.287 1.00 0.00 H new ATOM 0 H62 DA A 3 23.119 14.449 30.179 1.00 0.00 H new ATOM 0 H2 DA A 3 18.056 14.705 29.038 1.00 0.00 H new ATOM 94 P DT A 4 20.383 18.987 22.076 1.00 0.00 P ATOM 95 OP1 DT A 4 19.781 19.699 20.921 1.00 0.00 O ATOM 96 OP2 DT A 4 21.811 19.229 22.397 1.00 0.00 O ATOM 97 O5' DT A 4 19.505 19.323 23.396 1.00 0.00 O ATOM 98 C5' DT A 4 18.089 19.167 23.383 1.00 0.00 C ATOM 99 C4' DT A 4 17.441 19.036 24.771 1.00 0.00 C ATOM 100 O4' DT A 4 17.981 17.961 25.536 1.00 0.00 O ATOM 101 C3' DT A 4 17.558 20.268 25.670 1.00 0.00 C ATOM 102 O3' DT A 4 16.749 21.360 25.223 1.00 0.00 O ATOM 103 C2' DT A 4 17.209 19.616 27.012 1.00 0.00 C ATOM 104 C1' DT A 4 17.940 18.278 26.923 1.00 0.00 C ATOM 105 N1 DT A 4 19.294 18.328 27.554 1.00 0.00 N ATOM 106 C2 DT A 4 19.352 18.073 28.930 1.00 0.00 C ATOM 107 O2 DT A 4 18.360 17.987 29.656 1.00 0.00 O ATOM 108 N3 DT A 4 20.599 17.917 29.472 1.00 0.00 N ATOM 109 C4 DT A 4 21.796 18.047 28.813 1.00 0.00 C ATOM 110 O4 DT A 4 22.833 17.847 29.446 1.00 0.00 O ATOM 111 C5 DT A 4 21.673 18.409 27.399 1.00 0.00 C ATOM 112 C7 DT A 4 22.918 18.629 26.559 1.00 0.00 C ATOM 113 C6 DT A 4 20.447 18.551 26.824 1.00 0.00 C ATOM 0 H5' DT A 4 17.841 18.282 22.797 1.00 0.00 H new ATOM 0 H5'' DT A 4 17.648 20.022 22.871 1.00 0.00 H new ATOM 0 H4' DT A 4 16.396 18.873 24.507 1.00 0.00 H new ATOM 0 H3' DT A 4 18.518 20.784 25.697 1.00 0.00 H new ATOM 0 H2' DT A 4 17.554 20.213 27.856 1.00 0.00 H new ATOM 0 H2'' DT A 4 16.134 19.485 27.133 1.00 0.00 H new ATOM 0 H1' DT A 4 17.423 17.499 27.483 1.00 0.00 H new ATOM 0 H3 DT A 4 20.643 17.681 30.463 1.00 0.00 H new ATOM 0 H71 DT A 4 23.724 19.000 27.193 1.00 0.00 H new ATOM 0 H72 DT A 4 23.220 17.686 26.102 1.00 0.00 H new ATOM 0 H73 DT A 4 22.706 19.359 25.778 1.00 0.00 H new ATOM 0 H6 DT A 4 20.374 18.841 25.786 1.00 0.00 H new ATOM 126 P DG A 5 15.151 21.490 25.430 1.00 0.00 P ATOM 127 OP1 DG A 5 14.527 20.157 25.249 1.00 0.00 O ATOM 128 OP2 DG A 5 14.679 22.621 24.598 1.00 0.00 O ATOM 129 O5' DG A 5 15.001 21.921 26.969 1.00 0.00 O ATOM 130 C5' DG A 5 14.016 21.344 27.811 1.00 0.00 C ATOM 131 C4' DG A 5 13.798 22.123 29.115 1.00 0.00 C ATOM 132 O4' DG A 5 14.914 22.015 29.989 1.00 0.00 O ATOM 133 C3' DG A 5 13.536 23.618 28.898 1.00 0.00 C ATOM 134 O3' DG A 5 12.563 24.039 29.847 1.00 0.00 O ATOM 135 C2' DG A 5 14.940 24.212 29.066 1.00 0.00 C ATOM 136 C1' DG A 5 15.647 23.232 30.005 1.00 0.00 C ATOM 137 N9 DG A 5 17.057 22.909 29.668 1.00 0.00 N ATOM 138 C8 DG A 5 17.688 22.768 28.452 1.00 0.00 C ATOM 139 N7 DG A 5 18.889 22.247 28.525 1.00 0.00 N ATOM 140 C5 DG A 5 19.080 22.050 29.899 1.00 0.00 C ATOM 141 C6 DG A 5 20.168 21.480 30.659 1.00 0.00 C ATOM 142 O6 DG A 5 21.211 20.950 30.270 1.00 0.00 O ATOM 143 N1 DG A 5 19.990 21.573 32.025 1.00 0.00 N ATOM 144 C2 DG A 5 18.910 22.149 32.599 1.00 0.00 C ATOM 145 N2 DG A 5 18.957 22.371 33.876 1.00 0.00 N ATOM 146 N3 DG A 5 17.844 22.593 31.951 1.00 0.00 N ATOM 147 C4 DG A 5 17.990 22.522 30.597 1.00 0.00 C ATOM 0 H5' DG A 5 14.308 20.322 28.051 1.00 0.00 H new ATOM 0 H5'' DG A 5 13.072 21.287 27.268 1.00 0.00 H new ATOM 0 H4' DG A 5 12.913 21.665 29.556 1.00 0.00 H new ATOM 0 H3' DG A 5 13.116 23.923 27.940 1.00 0.00 H new ATOM 0 H2' DG A 5 15.457 24.292 28.110 1.00 0.00 H new ATOM 0 H2'' DG A 5 14.901 25.215 29.492 1.00 0.00 H new ATOM 0 H1' DG A 5 15.680 23.726 30.976 1.00 0.00 H new ATOM 0 H8 DG A 5 17.232 23.062 27.518 1.00 0.00 H new ATOM 0 H1 DG A 5 20.712 21.187 32.633 1.00 0.00 H new ATOM 0 H21 DG A 5 18.163 22.804 34.348 1.00 0.00 H new ATOM 0 H22 DG A 5 19.788 22.113 34.408 1.00 0.00 H new ATOM 159 P DT A 6 12.020 25.551 29.958 1.00 0.00 P ATOM 160 OP1 DT A 6 10.587 25.502 30.343 1.00 0.00 O ATOM 161 OP2 DT A 6 12.412 26.311 28.744 1.00 0.00 O ATOM 162 O5' DT A 6 12.872 26.101 31.204 1.00 0.00 O ATOM 163 C5' DT A 6 12.637 25.597 32.515 1.00 0.00 C ATOM 164 C4' DT A 6 13.762 25.966 33.482 1.00 0.00 C ATOM 165 O4' DT A 6 14.982 25.411 33.024 1.00 0.00 O ATOM 166 C3' DT A 6 14.004 27.470 33.625 1.00 0.00 C ATOM 167 O3' DT A 6 13.196 28.049 34.645 1.00 0.00 O ATOM 168 C2' DT A 6 15.477 27.493 34.012 1.00 0.00 C ATOM 169 C1' DT A 6 16.038 26.144 33.610 1.00 0.00 C ATOM 170 N1 DT A 6 17.188 26.176 32.685 1.00 0.00 N ATOM 171 C2 DT A 6 18.408 25.671 33.149 1.00 0.00 C ATOM 172 O2 DT A 6 18.655 25.450 34.335 1.00 0.00 O ATOM 173 N3 DT A 6 19.360 25.409 32.198 1.00 0.00 N ATOM 174 C4 DT A 6 19.191 25.570 30.841 1.00 0.00 C ATOM 175 O4 DT A 6 20.054 25.127 30.091 1.00 0.00 O ATOM 176 C5 DT A 6 17.961 26.256 30.444 1.00 0.00 C ATOM 177 C7 DT A 6 17.716 26.630 28.992 1.00 0.00 C ATOM 178 C6 DT A 6 17.007 26.537 31.368 1.00 0.00 C ATOM 0 H5' DT A 6 12.536 24.512 32.474 1.00 0.00 H new ATOM 0 H5'' DT A 6 11.693 25.991 32.891 1.00 0.00 H new ATOM 0 H4' DT A 6 13.444 25.574 34.448 1.00 0.00 H new ATOM 0 H3' DT A 6 13.758 28.043 32.731 1.00 0.00 H new ATOM 0 H2' DT A 6 16.001 28.301 33.502 1.00 0.00 H new ATOM 0 H2'' DT A 6 15.596 27.661 35.082 1.00 0.00 H new ATOM 0 H1' DT A 6 16.433 25.685 34.516 1.00 0.00 H new ATOM 0 H3 DT A 6 20.265 25.068 32.521 1.00 0.00 H new ATOM 0 H71 DT A 6 16.645 26.621 28.790 1.00 0.00 H new ATOM 0 H72 DT A 6 18.113 27.627 28.801 1.00 0.00 H new ATOM 0 H73 DT A 6 18.214 25.911 28.342 1.00 0.00 H new ATOM 0 H6 DT A 6 16.102 27.046 31.069 1.00 0.00 H new ATOM 191 P DA A 7 13.201 29.639 34.951 1.00 0.00 P ATOM 192 OP1 DA A 7 12.094 29.919 35.899 1.00 0.00 O ATOM 193 OP2 DA A 7 13.229 30.364 33.656 1.00 0.00 O ATOM 194 O5' DA A 7 14.600 29.920 35.709 1.00 0.00 O ATOM 195 C5' DA A 7 14.874 29.369 36.995 1.00 0.00 C ATOM 196 C4' DA A 7 16.349 29.505 37.412 1.00 0.00 C ATOM 197 O4' DA A 7 17.213 28.896 36.451 1.00 0.00 O ATOM 198 C3' DA A 7 16.807 30.960 37.594 1.00 0.00 C ATOM 199 O3' DA A 7 17.462 31.091 38.851 1.00 0.00 O ATOM 200 C2' DA A 7 17.715 31.157 36.382 1.00 0.00 C ATOM 201 C1' DA A 7 18.292 29.762 36.146 1.00 0.00 C ATOM 202 N9 DA A 7 18.698 29.548 34.734 1.00 0.00 N ATOM 203 C8 DA A 7 17.981 29.880 33.607 1.00 0.00 C ATOM 204 N7 DA A 7 18.523 29.508 32.482 1.00 0.00 N ATOM 205 C5 DA A 7 19.723 28.920 32.905 1.00 0.00 C ATOM 206 C6 DA A 7 20.806 28.317 32.227 1.00 0.00 C ATOM 207 N6 DA A 7 20.857 28.175 30.920 1.00 0.00 N ATOM 208 N1 DA A 7 21.848 27.810 32.885 1.00 0.00 N ATOM 209 C2 DA A 7 21.833 27.903 34.208 1.00 0.00 C ATOM 210 N3 DA A 7 20.895 28.432 34.992 1.00 0.00 N ATOM 211 C4 DA A 7 19.846 28.932 34.270 1.00 0.00 C ATOM 0 H5' DA A 7 14.598 28.314 36.997 1.00 0.00 H new ATOM 0 H5'' DA A 7 14.247 29.864 37.736 1.00 0.00 H new ATOM 0 H4' DA A 7 16.414 29.000 38.376 1.00 0.00 H new ATOM 0 H3' DA A 7 16.021 31.714 37.624 1.00 0.00 H new ATOM 0 H2' DA A 7 17.158 31.514 35.516 1.00 0.00 H new ATOM 0 H2'' DA A 7 18.498 31.888 36.581 1.00 0.00 H new ATOM 0 H1' DA A 7 19.187 29.599 36.747 1.00 0.00 H new ATOM 0 H8 DA A 7 17.040 30.409 33.652 1.00 0.00 H new ATOM 0 H61 DA A 7 21.666 27.731 30.486 1.00 0.00 H new ATOM 0 H62 DA A 7 20.087 28.509 30.340 1.00 0.00 H new ATOM 0 H2 DA A 7 22.695 27.496 34.717 1.00 0.00 H new ATOM 223 P DC A 8 18.091 32.481 39.379 1.00 0.00 P ATOM 224 OP1 DC A 8 18.029 32.479 40.862 1.00 0.00 O ATOM 225 OP2 DC A 8 17.477 33.611 38.638 1.00 0.00 O ATOM 226 O5' DC A 8 19.630 32.356 38.932 1.00 0.00 O ATOM 227 C5' DC A 8 20.432 31.301 39.446 1.00 0.00 C ATOM 228 C4' DC A 8 21.823 31.225 38.815 1.00 0.00 C ATOM 229 O4' DC A 8 21.697 30.966 37.421 1.00 0.00 O ATOM 230 C3' DC A 8 22.664 32.489 39.012 1.00 0.00 C ATOM 231 O3' DC A 8 23.926 32.144 39.580 1.00 0.00 O ATOM 232 C2' DC A 8 22.757 33.019 37.584 1.00 0.00 C ATOM 233 C1' DC A 8 22.625 31.764 36.716 1.00 0.00 C ATOM 234 N1 DC A 8 22.086 31.965 35.336 1.00 0.00 N ATOM 235 C2 DC A 8 22.740 31.382 34.238 1.00 0.00 C ATOM 236 O2 DC A 8 23.836 30.835 34.343 1.00 0.00 O ATOM 237 N3 DC A 8 22.182 31.396 33.000 1.00 0.00 N ATOM 238 C4 DC A 8 21.005 31.965 32.855 1.00 0.00 C ATOM 239 N4 DC A 8 20.503 31.942 31.655 1.00 0.00 N ATOM 240 C5 DC A 8 20.288 32.572 33.922 1.00 0.00 C ATOM 241 C6 DC A 8 20.863 32.560 35.149 1.00 0.00 C ATOM 0 H5' DC A 8 19.917 30.354 39.286 1.00 0.00 H new ATOM 0 H5'' DC A 8 20.538 31.428 40.523 1.00 0.00 H new ATOM 0 H4' DC A 8 22.346 30.417 39.326 1.00 0.00 H new ATOM 0 H3' DC A 8 22.256 33.231 39.698 1.00 0.00 H new ATOM 0 H2' DC A 8 21.965 33.737 37.372 1.00 0.00 H new ATOM 0 H2'' DC A 8 23.704 33.529 37.408 1.00 0.00 H new ATOM 0 H1' DC A 8 23.621 31.348 36.563 1.00 0.00 H new ATOM 0 H41 DC A 8 19.593 32.366 31.475 1.00 0.00 H new ATOM 0 H42 DC A 8 21.019 31.500 30.895 1.00 0.00 H new ATOM 0 H5 DC A 8 19.321 33.026 33.761 1.00 0.00 H new ATOM 0 H6 DC A 8 20.357 33.021 35.984 1.00 0.00 H new ATOM 253 P DA A 9 24.877 33.224 40.319 1.00 0.00 P ATOM 254 OP1 DA A 9 25.774 32.487 41.245 1.00 0.00 O ATOM 255 OP2 DA A 9 24.038 34.320 40.865 1.00 0.00 O ATOM 256 O5' DA A 9 25.768 33.826 39.119 1.00 0.00 O ATOM 257 C5' DA A 9 26.780 33.030 38.518 1.00 0.00 C ATOM 258 C4' DA A 9 27.133 33.458 37.090 1.00 0.00 C ATOM 259 O4' DA A 9 25.978 33.406 36.253 1.00 0.00 O ATOM 260 C3' DA A 9 27.738 34.866 36.972 1.00 0.00 C ATOM 261 O3' DA A 9 28.946 34.785 36.222 1.00 0.00 O ATOM 262 C2' DA A 9 26.608 35.621 36.275 1.00 0.00 C ATOM 263 C1' DA A 9 25.985 34.535 35.402 1.00 0.00 C ATOM 264 N9 DA A 9 24.604 34.866 34.972 1.00 0.00 N ATOM 265 C8 DA A 9 23.600 35.455 35.707 1.00 0.00 C ATOM 266 N7 DA A 9 22.476 35.625 35.061 1.00 0.00 N ATOM 267 C5 DA A 9 22.782 35.144 33.782 1.00 0.00 C ATOM 268 C6 DA A 9 22.076 35.060 32.559 1.00 0.00 C ATOM 269 N6 DA A 9 20.833 35.459 32.366 1.00 0.00 N ATOM 270 N1 DA A 9 22.639 34.537 31.475 1.00 0.00 N ATOM 271 C2 DA A 9 23.877 34.080 31.576 1.00 0.00 C ATOM 272 N3 DA A 9 24.671 34.088 32.640 1.00 0.00 N ATOM 273 C4 DA A 9 24.062 34.654 33.722 1.00 0.00 C ATOM 0 H5' DA A 9 26.453 31.990 38.506 1.00 0.00 H new ATOM 0 H5'' DA A 9 27.678 33.074 39.134 1.00 0.00 H new ATOM 0 H4' DA A 9 27.897 32.748 36.772 1.00 0.00 H new ATOM 0 H3' DA A 9 28.030 35.356 37.901 1.00 0.00 H new ATOM 0 H2' DA A 9 25.892 36.031 36.987 1.00 0.00 H new ATOM 0 H2'' DA A 9 26.981 36.456 35.682 1.00 0.00 H new ATOM 0 H1' DA A 9 26.539 34.392 34.474 1.00 0.00 H new ATOM 0 H8 DA A 9 23.731 35.753 36.737 1.00 0.00 H new ATOM 0 H61 DA A 9 20.402 35.359 31.447 1.00 0.00 H new ATOM 0 H62 DA A 9 20.303 35.867 33.136 1.00 0.00 H new ATOM 0 H2 DA A 9 24.294 33.646 30.679 1.00 0.00 H new ATOM 285 P DT A 10 29.830 36.077 35.842 1.00 0.00 P ATOM 286 OP1 DT A 10 31.236 35.634 35.661 1.00 0.00 O ATOM 287 OP2 DT A 10 29.541 37.167 36.810 1.00 0.00 O ATOM 288 O5' DT A 10 29.220 36.484 34.408 1.00 0.00 O ATOM 289 C5' DT A 10 29.451 35.656 33.277 1.00 0.00 C ATOM 290 C4' DT A 10 28.797 36.158 31.987 1.00 0.00 C ATOM 291 O4' DT A 10 27.387 36.036 32.004 1.00 0.00 O ATOM 292 C3' DT A 10 29.043 37.635 31.700 1.00 0.00 C ATOM 293 O3' DT A 10 30.376 37.876 31.274 1.00 0.00 O ATOM 294 C2' DT A 10 28.019 37.833 30.588 1.00 0.00 C ATOM 295 C1' DT A 10 26.885 36.871 30.968 1.00 0.00 C ATOM 296 N1 DT A 10 25.627 37.545 31.393 1.00 0.00 N ATOM 297 C2 DT A 10 24.685 37.816 30.398 1.00 0.00 C ATOM 298 O2 DT A 10 24.927 37.728 29.196 1.00 0.00 O ATOM 299 N3 DT A 10 23.437 38.205 30.817 1.00 0.00 N ATOM 300 C4 DT A 10 23.058 38.429 32.119 1.00 0.00 C ATOM 301 O4 DT A 10 21.881 38.708 32.348 1.00 0.00 O ATOM 302 C5 DT A 10 24.142 38.301 33.097 1.00 0.00 C ATOM 303 C7 DT A 10 23.898 38.648 34.554 1.00 0.00 C ATOM 304 C6 DT A 10 25.369 37.849 32.715 1.00 0.00 C ATOM 0 H5' DT A 10 29.080 34.654 33.493 1.00 0.00 H new ATOM 0 H5'' DT A 10 30.526 35.571 33.117 1.00 0.00 H new ATOM 0 H4' DT A 10 29.261 35.527 31.229 1.00 0.00 H new ATOM 0 H3' DT A 10 28.936 38.310 32.549 1.00 0.00 H new ATOM 0 H2' DT A 10 27.671 38.865 30.542 1.00 0.00 H new ATOM 0 H2'' DT A 10 28.437 37.594 29.610 1.00 0.00 H new ATOM 0 H1' DT A 10 26.600 36.302 30.083 1.00 0.00 H new ATOM 0 H3 DT A 10 22.727 38.340 30.097 1.00 0.00 H new ATOM 0 H71 DT A 10 24.543 38.038 35.186 1.00 0.00 H new ATOM 0 H72 DT A 10 24.120 39.702 34.719 1.00 0.00 H new ATOM 0 H73 DT A 10 22.855 38.454 34.805 1.00 0.00 H new ATOM 0 H6 DT A 10 26.148 37.727 33.453 1.00 0.00 H new ATOM 317 P DC A 11 31.129 39.264 31.598 1.00 0.00 P ATOM 318 OP1 DC A 11 32.553 39.118 31.205 1.00 0.00 O ATOM 319 OP2 DC A 11 30.811 39.686 32.985 1.00 0.00 O ATOM 320 O5' DC A 11 30.424 40.301 30.594 1.00 0.00 O ATOM 321 C5' DC A 11 30.658 40.252 29.192 1.00 0.00 C ATOM 322 C4' DC A 11 29.668 41.127 28.408 1.00 0.00 C ATOM 323 O4' DC A 11 28.342 40.631 28.612 1.00 0.00 O ATOM 324 C3' DC A 11 29.683 42.607 28.838 1.00 0.00 C ATOM 325 O3' DC A 11 29.457 43.482 27.749 1.00 0.00 O ATOM 326 C2' DC A 11 28.454 42.670 29.724 1.00 0.00 C ATOM 327 C1' DC A 11 27.521 41.736 28.943 1.00 0.00 C ATOM 328 N1 DC A 11 26.299 41.365 29.708 1.00 0.00 N ATOM 329 C2 DC A 11 25.053 41.483 29.074 1.00 0.00 C ATOM 330 O2 DC A 11 24.918 41.496 27.848 1.00 0.00 O ATOM 331 N3 DC A 11 23.924 41.604 29.807 1.00 0.00 N ATOM 332 C4 DC A 11 24.017 41.545 31.119 1.00 0.00 C ATOM 333 N4 DC A 11 22.909 41.709 31.775 1.00 0.00 N ATOM 334 C5 DC A 11 25.220 41.250 31.809 1.00 0.00 C ATOM 335 C6 DC A 11 26.348 41.152 31.067 1.00 0.00 C ATOM 0 H5' DC A 11 30.580 39.221 28.848 1.00 0.00 H new ATOM 0 H5'' DC A 11 31.676 40.582 28.983 1.00 0.00 H new ATOM 0 H4' DC A 11 29.974 41.078 27.363 1.00 0.00 H new ATOM 0 H3' DC A 11 30.632 42.898 29.288 1.00 0.00 H new ATOM 0 H2' DC A 11 28.650 42.314 30.736 1.00 0.00 H new ATOM 0 H2'' DC A 11 28.055 43.680 29.813 1.00 0.00 H new ATOM 0 H1' DC A 11 27.107 42.210 28.053 1.00 0.00 H new ATOM 0 H41 DC A 11 22.910 41.675 32.794 1.00 0.00 H new ATOM 0 H42 DC A 11 22.037 41.872 31.271 1.00 0.00 H new ATOM 0 H5 DC A 11 25.236 41.110 32.880 1.00 0.00 H new ATOM 0 H6 DC A 11 27.287 40.907 31.541 1.00 0.00 H new ATOM 347 P DG A 12 30.637 44.341 27.092 1.00 0.00 P ATOM 348 OP1 DG A 12 31.859 43.502 26.995 1.00 0.00 O ATOM 349 OP2 DG A 12 30.701 45.654 27.782 1.00 0.00 O ATOM 350 O5' DG A 12 30.049 44.569 25.607 1.00 0.00 O ATOM 351 C5' DG A 12 29.755 43.466 24.756 1.00 0.00 C ATOM 352 C4' DG A 12 28.276 43.404 24.330 1.00 0.00 C ATOM 353 O4' DG A 12 27.403 43.217 25.446 1.00 0.00 O ATOM 354 C3' DG A 12 27.805 44.682 23.611 1.00 0.00 C ATOM 355 O3' DG A 12 26.967 44.362 22.494 1.00 0.00 O ATOM 356 C2' DG A 12 26.993 45.376 24.702 1.00 0.00 C ATOM 357 C1' DG A 12 26.349 44.164 25.356 1.00 0.00 C ATOM 358 N9 DG A 12 25.751 44.477 26.673 1.00 0.00 N ATOM 359 C8 DG A 12 26.373 44.863 27.835 1.00 0.00 C ATOM 360 N7 DG A 12 25.565 45.018 28.857 1.00 0.00 N ATOM 361 C5 DG A 12 24.297 44.750 28.316 1.00 0.00 C ATOM 362 C6 DG A 12 22.978 44.755 28.906 1.00 0.00 C ATOM 363 O6 DG A 12 22.633 44.976 30.071 1.00 0.00 O ATOM 364 N1 DG A 12 21.972 44.479 28.002 1.00 0.00 N ATOM 365 C2 DG A 12 22.184 44.223 26.690 1.00 0.00 C ATOM 366 N2 DG A 12 21.132 44.024 25.945 1.00 0.00 N ATOM 367 N3 DG A 12 23.377 44.185 26.104 1.00 0.00 N ATOM 368 C4 DG A 12 24.404 44.454 26.971 1.00 0.00 C ATOM 0 H5' DG A 12 30.018 42.540 25.268 1.00 0.00 H new ATOM 0 H5'' DG A 12 30.380 43.526 23.865 1.00 0.00 H new ATOM 0 H4' DG A 12 28.226 42.553 23.650 1.00 0.00 H new ATOM 0 H3' DG A 12 28.620 45.283 23.207 1.00 0.00 H new ATOM 0 H2' DG A 12 27.619 45.940 25.393 1.00 0.00 H new ATOM 0 H2'' DG A 12 26.258 46.072 24.297 1.00 0.00 H new ATOM 0 HO3' DG A 12 26.679 45.189 22.054 1.00 0.00 H new ATOM 0 H1' DG A 12 25.506 43.786 24.777 1.00 0.00 H new ATOM 0 H8 DG A 12 27.439 45.025 27.902 1.00 0.00 H new ATOM 0 H1 DG A 12 21.011 44.467 28.343 1.00 0.00 H new ATOM 0 H21 DG A 12 21.241 43.828 24.950 1.00 0.00 H new ATOM 0 H22 DG A 12 20.200 44.065 26.357 1.00 0.00 H new TER 381 DG A 12 HETATM 382 N1 DCZ B 13 16.980 43.864 28.752 1.00 0.00 N HETATM 383 C2 DCZ B 13 18.286 44.139 28.325 1.00 0.00 C HETATM 384 N3 DCZ B 13 19.311 44.198 29.208 1.00 0.00 N HETATM 385 C4 DCZ B 13 19.060 43.934 30.474 1.00 0.00 C HETATM 386 C5 DCZ B 13 17.772 43.577 30.963 1.00 0.00 C HETATM 387 C6 DCZ B 13 16.750 43.543 30.069 1.00 0.00 C HETATM 388 O2 DCZ B 13 18.563 44.341 27.141 1.00 0.00 O HETATM 389 N4 DCZ B 13 20.072 44.067 31.285 1.00 0.00 N HETATM 390 C1' DCZ B 13 15.866 43.972 27.768 1.00 0.00 C HETATM 391 C2' DCZ B 13 15.557 42.641 27.094 1.00 0.00 C HETATM 392 C3' DCZ B 13 14.171 42.933 26.528 1.00 0.00 C HETATM 393 C4' DCZ B 13 13.553 43.755 27.671 1.00 0.00 C HETATM 394 O4' DCZ B 13 14.638 44.371 28.372 1.00 0.00 O HETATM 395 O3' DCZ B 13 14.289 43.712 25.339 1.00 0.00 O HETATM 396 C5' DCZ B 13 12.681 42.917 28.631 1.00 0.00 C HETATM 397 O5' DCZ B 13 13.365 41.835 29.266 1.00 0.00 O HETATM 0 HO51 DCZ B 13 12.745 41.358 29.856 1.00 0.00 H new HETATM 0 HN42 DCZ B 13 19.955 43.880 32.281 1.00 0.00 H new HETATM 0 HN41 DCZ B 13 20.980 44.358 30.924 1.00 0.00 H new HETATM 0 H5'2 DCZ B 13 12.276 43.575 29.400 1.00 0.00 H new HETATM 0 H5'1 DCZ B 13 11.833 42.517 28.075 1.00 0.00 H new HETATM 0 H2'2 DCZ B 13 16.279 42.393 26.316 1.00 0.00 H new HETATM 0 H2'1 DCZ B 13 15.550 41.810 27.800 1.00 0.00 H new HETATM 0 H6 DCZ B 13 15.749 43.262 30.395 1.00 0.00 H new HETATM 0 H5 DCZ B 13 17.612 43.340 32.015 1.00 0.00 H new HETATM 0 H4' DCZ B 13 12.872 44.495 27.250 1.00 0.00 H new HETATM 0 H3' DCZ B 13 13.589 42.054 26.251 1.00 0.00 H new HETATM 0 H1' DCZ B 13 16.219 44.715 27.053 1.00 0.00 H new ATOM 410 P DG B 14 14.089 43.050 23.887 1.00 0.00 P ATOM 411 OP1 DG B 14 14.567 44.025 22.876 1.00 0.00 O ATOM 412 OP2 DG B 14 12.705 42.525 23.793 1.00 0.00 O ATOM 413 O5' DG B 14 15.106 41.808 23.953 1.00 0.00 O ATOM 414 C5' DG B 14 15.778 41.288 22.816 1.00 0.00 C ATOM 415 C4' DG B 14 16.625 40.065 23.204 1.00 0.00 C ATOM 416 O4' DG B 14 17.598 40.432 24.191 1.00 0.00 O ATOM 417 C3' DG B 14 15.766 38.935 23.803 1.00 0.00 C ATOM 418 O3' DG B 14 16.148 37.651 23.346 1.00 0.00 O ATOM 419 C2' DG B 14 16.116 39.045 25.274 1.00 0.00 C ATOM 420 C1' DG B 14 17.597 39.428 25.193 1.00 0.00 C ATOM 421 N9 DG B 14 18.131 39.879 26.507 1.00 0.00 N ATOM 422 C8 DG B 14 17.455 39.956 27.706 1.00 0.00 C ATOM 423 N7 DG B 14 18.167 40.388 28.706 1.00 0.00 N ATOM 424 C5 DG B 14 19.430 40.579 28.142 1.00 0.00 C ATOM 425 C6 DG B 14 20.660 40.998 28.746 1.00 0.00 C ATOM 426 O6 DG B 14 20.862 41.316 29.915 1.00 0.00 O ATOM 427 N1 DG B 14 21.727 41.022 27.876 1.00 0.00 N ATOM 428 C2 DG B 14 21.634 40.688 26.567 1.00 0.00 C ATOM 429 N2 DG B 14 22.743 40.760 25.879 1.00 0.00 N ATOM 430 N3 DG B 14 20.514 40.294 25.956 1.00 0.00 N ATOM 431 C4 DG B 14 19.431 40.258 26.799 1.00 0.00 C ATOM 0 H5' DG B 14 16.416 42.057 22.380 1.00 0.00 H new ATOM 0 H5'' DG B 14 15.051 41.007 22.053 1.00 0.00 H new ATOM 0 H4' DG B 14 17.102 39.712 22.289 1.00 0.00 H new ATOM 0 H3' DG B 14 14.712 39.036 23.545 1.00 0.00 H new ATOM 0 H2' DG B 14 15.521 39.803 25.784 1.00 0.00 H new ATOM 0 H2'' DG B 14 15.961 38.107 25.806 1.00 0.00 H new ATOM 0 H1' DG B 14 18.259 38.599 24.943 1.00 0.00 H new ATOM 0 H8 DG B 14 16.416 39.679 27.807 1.00 0.00 H new ATOM 0 H1 DG B 14 22.637 41.307 28.237 1.00 0.00 H new ATOM 0 H21 DG B 14 22.744 40.522 24.887 1.00 0.00 H new ATOM 0 H22 DG B 14 23.607 41.054 26.334 1.00 0.00 H new ATOM 443 P DA B 15 15.502 37.006 22.027 1.00 0.00 P ATOM 444 OP1 DA B 15 15.324 38.069 21.005 1.00 0.00 O ATOM 445 OP2 DA B 15 14.324 36.203 22.439 1.00 0.00 O ATOM 446 O5' DA B 15 16.640 35.989 21.507 1.00 0.00 O ATOM 447 C5' DA B 15 17.930 36.441 21.098 1.00 0.00 C ATOM 448 C4' DA B 15 19.045 36.091 22.100 1.00 0.00 C ATOM 449 O4' DA B 15 18.920 36.793 23.327 1.00 0.00 O ATOM 450 C3' DA B 15 19.086 34.605 22.481 1.00 0.00 C ATOM 451 O3' DA B 15 19.867 33.849 21.560 1.00 0.00 O ATOM 452 C2' DA B 15 19.684 34.648 23.889 1.00 0.00 C ATOM 453 C1' DA B 15 19.740 36.124 24.261 1.00 0.00 C ATOM 454 N9 DA B 15 19.311 36.357 25.657 1.00 0.00 N ATOM 455 C8 DA B 15 18.065 36.232 26.223 1.00 0.00 C ATOM 456 N7 DA B 15 18.022 36.533 27.499 1.00 0.00 N ATOM 457 C5 DA B 15 19.361 36.852 27.794 1.00 0.00 C ATOM 458 C6 DA B 15 20.082 37.262 28.947 1.00 0.00 C ATOM 459 N6 DA B 15 19.582 37.462 30.151 1.00 0.00 N ATOM 460 N1 DA B 15 21.392 37.500 28.890 1.00 0.00 N ATOM 461 C2 DA B 15 22.014 37.321 27.733 1.00 0.00 C ATOM 462 N3 DA B 15 21.488 36.935 26.580 1.00 0.00 N ATOM 463 C4 DA B 15 20.147 36.728 26.679 1.00 0.00 C ATOM 0 H5' DA B 15 17.901 37.522 20.960 1.00 0.00 H new ATOM 0 H5'' DA B 15 18.171 36.002 20.130 1.00 0.00 H new ATOM 0 H4' DA B 15 19.952 36.375 21.567 1.00 0.00 H new ATOM 0 H3' DA B 15 18.116 34.109 22.454 1.00 0.00 H new ATOM 0 H2' DA B 15 19.069 34.088 24.594 1.00 0.00 H new ATOM 0 H2'' DA B 15 20.678 34.200 23.907 1.00 0.00 H new ATOM 0 H1' DA B 15 20.761 36.504 24.218 1.00 0.00 H new ATOM 0 H8 DA B 15 17.197 35.914 25.666 1.00 0.00 H new ATOM 0 H61 DA B 15 20.191 37.757 30.914 1.00 0.00 H new ATOM 0 H62 DA B 15 18.586 37.321 30.319 1.00 0.00 H new ATOM 0 H2 DA B 15 23.077 37.513 27.730 1.00 0.00 H new ATOM 475 P DT B 16 20.111 32.257 21.725 1.00 0.00 P ATOM 476 OP1 DT B 16 20.506 31.720 20.399 1.00 0.00 O ATOM 477 OP2 DT B 16 18.942 31.661 22.420 1.00 0.00 O ATOM 478 O5' DT B 16 21.385 32.172 22.713 1.00 0.00 O ATOM 479 C5' DT B 16 22.659 32.665 22.308 1.00 0.00 C ATOM 480 C4' DT B 16 23.646 32.810 23.477 1.00 0.00 C ATOM 481 O4' DT B 16 23.134 33.707 24.452 1.00 0.00 O ATOM 482 C3' DT B 16 23.962 31.489 24.186 1.00 0.00 C ATOM 483 O3' DT B 16 25.080 30.885 23.542 1.00 0.00 O ATOM 484 C2' DT B 16 24.313 31.980 25.590 1.00 0.00 C ATOM 485 C1' DT B 16 23.619 33.341 25.732 1.00 0.00 C ATOM 486 N1 DT B 16 22.490 33.350 26.709 1.00 0.00 N ATOM 487 C2 DT B 16 22.712 33.957 27.951 1.00 0.00 C ATOM 488 O2 DT B 16 23.797 34.416 28.304 1.00 0.00 O ATOM 489 N3 DT B 16 21.643 34.038 28.807 1.00 0.00 N ATOM 490 C4 DT B 16 20.369 33.591 28.554 1.00 0.00 C ATOM 491 O4 DT B 16 19.502 33.782 29.407 1.00 0.00 O ATOM 492 C5 DT B 16 20.200 32.939 27.254 1.00 0.00 C ATOM 493 C7 DT B 16 18.839 32.395 26.854 1.00 0.00 C ATOM 494 C6 DT B 16 21.250 32.827 26.392 1.00 0.00 C ATOM 0 H5' DT B 16 22.531 33.634 21.826 1.00 0.00 H new ATOM 0 H5'' DT B 16 23.083 31.992 21.563 1.00 0.00 H new ATOM 0 H4' DT B 16 24.566 33.185 23.028 1.00 0.00 H new ATOM 0 H3' DT B 16 23.168 30.743 24.182 1.00 0.00 H new ATOM 0 H2' DT B 16 23.964 31.280 26.349 1.00 0.00 H new ATOM 0 H2'' DT B 16 25.392 32.074 25.715 1.00 0.00 H new ATOM 0 H1' DT B 16 24.353 34.048 26.120 1.00 0.00 H new ATOM 0 H3 DT B 16 21.810 34.470 29.716 1.00 0.00 H new ATOM 0 H71 DT B 16 18.294 32.086 27.746 1.00 0.00 H new ATOM 0 H72 DT B 16 18.276 33.170 26.335 1.00 0.00 H new ATOM 0 H73 DT B 16 18.970 31.538 26.194 1.00 0.00 H new ATOM 0 H6 DT B 16 21.111 32.322 25.447 1.00 0.00 H new ATOM 507 P DG B 17 25.183 29.309 23.200 1.00 0.00 P ATOM 508 OP1 DG B 17 26.047 29.173 22.001 1.00 0.00 O ATOM 509 OP2 DG B 17 23.821 28.723 23.158 1.00 0.00 O ATOM 510 O5' DG B 17 25.958 28.653 24.452 1.00 0.00 O ATOM 511 C5' DG B 17 27.318 28.958 24.722 1.00 0.00 C ATOM 512 C4' DG B 17 27.964 28.116 25.838 1.00 0.00 C ATOM 513 O4' DG B 17 27.444 28.415 27.125 1.00 0.00 O ATOM 514 C3' DG B 17 27.860 26.594 25.690 1.00 0.00 C ATOM 515 O3' DG B 17 29.122 26.066 26.111 1.00 0.00 O ATOM 516 C2' DG B 17 26.609 26.297 26.533 1.00 0.00 C ATOM 517 C1' DG B 17 26.475 27.460 27.526 1.00 0.00 C ATOM 518 N9 DG B 17 25.119 28.094 27.625 1.00 0.00 N ATOM 519 C8 DG B 17 24.093 28.183 26.709 1.00 0.00 C ATOM 520 N7 DG B 17 23.067 28.901 27.096 1.00 0.00 N ATOM 521 C5 DG B 17 23.416 29.299 28.392 1.00 0.00 C ATOM 522 C6 DG B 17 22.734 30.112 29.374 1.00 0.00 C ATOM 523 O6 DG B 17 21.672 30.730 29.287 1.00 0.00 O ATOM 524 N1 DG B 17 23.388 30.184 30.587 1.00 0.00 N ATOM 525 C2 DG B 17 24.565 29.572 30.832 1.00 0.00 C ATOM 526 N2 DG B 17 25.072 29.688 32.024 1.00 0.00 N ATOM 527 N3 DG B 17 25.271 28.895 29.934 1.00 0.00 N ATOM 528 C4 DG B 17 24.645 28.774 28.730 1.00 0.00 C ATOM 0 H5' DG B 17 27.392 30.011 24.993 1.00 0.00 H new ATOM 0 H5'' DG B 17 27.894 28.823 23.806 1.00 0.00 H new ATOM 0 H4' DG B 17 29.010 28.405 25.734 1.00 0.00 H new ATOM 0 H3' DG B 17 27.718 26.143 24.708 1.00 0.00 H new ATOM 0 H2' DG B 17 25.724 26.220 25.902 1.00 0.00 H new ATOM 0 H2'' DG B 17 26.710 25.347 27.058 1.00 0.00 H new ATOM 0 H1' DG B 17 26.630 27.066 28.531 1.00 0.00 H new ATOM 0 H8 DG B 17 24.132 27.698 25.745 1.00 0.00 H new ATOM 0 H1 DG B 17 22.960 30.728 31.336 1.00 0.00 H new ATOM 0 H21 DG B 17 25.960 29.239 32.246 1.00 0.00 H new ATOM 0 H22 DG B 17 24.581 30.228 32.737 1.00 0.00 H new ATOM 540 P DT B 18 29.401 24.583 26.686 1.00 0.00 P ATOM 541 OP1 DT B 18 30.828 24.264 26.426 1.00 0.00 O ATOM 542 OP2 DT B 18 28.362 23.646 26.196 1.00 0.00 O ATOM 543 O5' DT B 18 29.218 24.801 28.272 1.00 0.00 O ATOM 544 C5' DT B 18 30.051 25.731 28.961 1.00 0.00 C ATOM 545 C4' DT B 18 29.719 25.884 30.449 1.00 0.00 C ATOM 546 O4' DT B 18 28.378 26.324 30.572 1.00 0.00 O ATOM 547 C3' DT B 18 29.880 24.599 31.275 1.00 0.00 C ATOM 548 O3' DT B 18 30.597 24.871 32.477 1.00 0.00 O ATOM 549 C2' DT B 18 28.434 24.191 31.539 1.00 0.00 C ATOM 550 C1' DT B 18 27.703 25.534 31.529 1.00 0.00 C ATOM 551 N1 DT B 18 26.271 25.505 31.124 1.00 0.00 N ATOM 552 C2 DT B 18 25.352 26.230 31.898 1.00 0.00 C ATOM 553 O2 DT B 18 25.588 26.672 33.020 1.00 0.00 O ATOM 554 N3 DT B 18 24.107 26.436 31.354 1.00 0.00 N ATOM 555 C4 DT B 18 23.717 26.026 30.102 1.00 0.00 C ATOM 556 O4 DT B 18 22.651 26.436 29.655 1.00 0.00 O ATOM 557 C5 DT B 18 24.645 25.126 29.425 1.00 0.00 C ATOM 558 C7 DT B 18 24.232 24.433 28.137 1.00 0.00 C ATOM 559 C6 DT B 18 25.884 24.910 29.938 1.00 0.00 C ATOM 0 H5' DT B 18 29.967 26.705 28.479 1.00 0.00 H new ATOM 0 H5'' DT B 18 31.090 25.415 28.862 1.00 0.00 H new ATOM 0 H4' DT B 18 30.436 26.602 30.847 1.00 0.00 H new ATOM 0 H3' DT B 18 30.449 23.812 30.780 1.00 0.00 H new ATOM 0 H2' DT B 18 28.056 23.518 30.770 1.00 0.00 H new ATOM 0 H2'' DT B 18 28.325 23.677 32.494 1.00 0.00 H new ATOM 0 H1' DT B 18 27.710 25.902 32.555 1.00 0.00 H new ATOM 0 H3 DT B 18 23.420 26.931 31.923 1.00 0.00 H new ATOM 0 H71 DT B 18 25.112 24.263 27.517 1.00 0.00 H new ATOM 0 H72 DT B 18 23.764 23.477 28.372 1.00 0.00 H new ATOM 0 H73 DT B 18 23.524 25.061 27.597 1.00 0.00 H new ATOM 0 H6 DT B 18 26.574 24.266 29.413 1.00 0.00 H new ATOM 572 P DA B 19 31.377 23.711 33.298 1.00 0.00 P ATOM 573 OP1 DA B 19 32.443 24.364 34.099 1.00 0.00 O ATOM 574 OP2 DA B 19 31.765 22.632 32.356 1.00 0.00 O ATOM 575 O5' DA B 19 30.268 23.111 34.309 1.00 0.00 O ATOM 576 C5' DA B 19 29.955 23.789 35.521 1.00 0.00 C ATOM 577 C4' DA B 19 28.567 23.461 36.080 1.00 0.00 C ATOM 578 O4' DA B 19 27.568 23.778 35.126 1.00 0.00 O ATOM 579 C3' DA B 19 28.311 22.028 36.572 1.00 0.00 C ATOM 580 O3' DA B 19 28.216 22.052 37.996 1.00 0.00 O ATOM 581 C2' DA B 19 26.995 21.676 35.870 1.00 0.00 C ATOM 582 C1' DA B 19 26.421 23.026 35.443 1.00 0.00 C ATOM 583 N9 DA B 19 25.581 22.959 34.229 1.00 0.00 N ATOM 584 C8 DA B 19 25.928 22.425 33.011 1.00 0.00 C ATOM 585 N7 DA B 19 25.036 22.591 32.073 1.00 0.00 N ATOM 586 C5 DA B 19 24.006 23.264 32.745 1.00 0.00 C ATOM 587 C6 DA B 19 22.737 23.755 32.365 1.00 0.00 C ATOM 588 N6 DA B 19 22.246 23.653 31.149 1.00 0.00 N ATOM 589 N1 DA B 19 21.953 24.405 33.221 1.00 0.00 N ATOM 590 C2 DA B 19 22.395 24.557 34.461 1.00 0.00 C ATOM 591 N3 DA B 19 23.553 24.152 34.978 1.00 0.00 N ATOM 592 C4 DA B 19 24.326 23.504 34.055 1.00 0.00 C ATOM 0 H5' DA B 19 30.022 24.864 35.351 1.00 0.00 H new ATOM 0 H5'' DA B 19 30.706 23.537 36.270 1.00 0.00 H new ATOM 0 H4' DA B 19 28.524 24.079 36.977 1.00 0.00 H new ATOM 0 H3' DA B 19 29.085 21.294 36.348 1.00 0.00 H new ATOM 0 H2' DA B 19 27.164 21.026 35.011 1.00 0.00 H new ATOM 0 H2'' DA B 19 26.316 21.149 36.540 1.00 0.00 H new ATOM 0 H1' DA B 19 25.784 23.430 36.229 1.00 0.00 H new ATOM 0 H8 DA B 19 26.863 21.910 32.844 1.00 0.00 H new ATOM 0 H61 DA B 19 21.321 24.029 30.939 1.00 0.00 H new ATOM 0 H62 DA B 19 22.790 23.198 30.416 1.00 0.00 H new ATOM 0 H2 DA B 19 21.732 25.075 35.138 1.00 0.00 H new ATOM 604 P DC B 20 27.929 20.743 38.905 1.00 0.00 P ATOM 605 OP1 DC B 20 28.491 20.998 40.256 1.00 0.00 O ATOM 606 OP2 DC B 20 28.369 19.535 38.164 1.00 0.00 O ATOM 607 O5' DC B 20 26.322 20.706 39.027 1.00 0.00 O ATOM 608 C5' DC B 20 25.622 21.772 39.662 1.00 0.00 C ATOM 609 C4' DC B 20 24.114 21.777 39.377 1.00 0.00 C ATOM 610 O4' DC B 20 23.887 21.823 37.970 1.00 0.00 O ATOM 611 C3' DC B 20 23.352 20.563 39.935 1.00 0.00 C ATOM 612 O3' DC B 20 22.195 21.009 40.643 1.00 0.00 O ATOM 613 C2' DC B 20 23.011 19.795 38.657 1.00 0.00 C ATOM 614 C1' DC B 20 22.829 20.938 37.658 1.00 0.00 C ATOM 615 N1 DC B 20 22.916 20.565 36.214 1.00 0.00 N ATOM 616 C2 DC B 20 21.920 21.009 35.333 1.00 0.00 C ATOM 617 O2 DC B 20 20.903 21.573 35.731 1.00 0.00 O ATOM 618 N3 DC B 20 22.038 20.831 33.992 1.00 0.00 N ATOM 619 C4 DC B 20 23.119 20.235 33.536 1.00 0.00 C ATOM 620 N4 DC B 20 23.199 20.102 32.243 1.00 0.00 N ATOM 621 C5 DC B 20 24.155 19.741 34.374 1.00 0.00 C ATOM 622 C6 DC B 20 24.014 19.913 35.713 1.00 0.00 C ATOM 0 H5' DC B 20 26.048 22.720 39.334 1.00 0.00 H new ATOM 0 H5'' DC B 20 25.779 21.707 40.739 1.00 0.00 H new ATOM 0 H4' DC B 20 23.732 22.662 39.887 1.00 0.00 H new ATOM 0 H3' DC B 20 23.901 19.952 40.651 1.00 0.00 H new ATOM 0 H2' DC B 20 23.809 19.114 38.361 1.00 0.00 H new ATOM 0 H2'' DC B 20 22.106 19.197 38.766 1.00 0.00 H new ATOM 0 H1' DC B 20 21.822 21.342 37.759 1.00 0.00 H new ATOM 0 H41 DC B 20 24.012 19.649 31.826 1.00 0.00 H new ATOM 0 H42 DC B 20 22.449 20.451 31.647 1.00 0.00 H new ATOM 0 H5 DC B 20 25.022 19.247 33.961 1.00 0.00 H new ATOM 0 H6 DC B 20 24.769 19.535 36.386 1.00 0.00 H new ATOM 634 P DA B 21 21.444 20.099 41.752 1.00 0.00 P ATOM 635 OP1 DA B 21 20.666 21.004 42.637 1.00 0.00 O ATOM 636 OP2 DA B 21 22.433 19.183 42.376 1.00 0.00 O ATOM 637 O5' DA B 21 20.407 19.207 40.896 1.00 0.00 O ATOM 638 C5' DA B 21 19.207 19.782 40.396 1.00 0.00 C ATOM 639 C4' DA B 21 18.644 19.055 39.173 1.00 0.00 C ATOM 640 O4' DA B 21 19.575 19.075 38.100 1.00 0.00 O ATOM 641 C3' DA B 21 18.194 17.602 39.374 1.00 0.00 C ATOM 642 O3' DA B 21 16.771 17.539 39.354 1.00 0.00 O ATOM 643 C2' DA B 21 18.851 16.890 38.187 1.00 0.00 C ATOM 644 C1' DA B 21 19.212 18.027 37.234 1.00 0.00 C ATOM 645 N9 DA B 21 20.334 17.709 36.323 1.00 0.00 N ATOM 646 C8 DA B 21 21.574 17.202 36.630 1.00 0.00 C ATOM 647 N7 DA B 21 22.335 16.968 35.592 1.00 0.00 N ATOM 648 C5 DA B 21 21.523 17.363 34.515 1.00 0.00 C ATOM 649 C6 DA B 21 21.669 17.395 33.105 1.00 0.00 C ATOM 650 N6 DA B 21 22.733 17.005 32.426 1.00 0.00 N ATOM 651 N1 DA B 21 20.696 17.866 32.327 1.00 0.00 N ATOM 652 C2 DA B 21 19.590 18.307 32.900 1.00 0.00 C ATOM 653 N3 DA B 21 19.297 18.331 34.193 1.00 0.00 N ATOM 654 C4 DA B 21 20.317 17.840 34.955 1.00 0.00 C ATOM 0 H5' DA B 21 19.394 20.824 40.135 1.00 0.00 H new ATOM 0 H5'' DA B 21 18.456 19.781 41.186 1.00 0.00 H new ATOM 0 H4' DA B 21 17.739 19.623 38.956 1.00 0.00 H new ATOM 0 H3' DA B 21 18.480 17.150 40.324 1.00 0.00 H new ATOM 0 H2' DA B 21 19.734 16.331 38.495 1.00 0.00 H new ATOM 0 H2'' DA B 21 18.170 16.178 37.721 1.00 0.00 H new ATOM 0 H1' DA B 21 18.380 18.256 36.568 1.00 0.00 H new ATOM 0 H8 DA B 21 21.894 17.012 37.644 1.00 0.00 H new ATOM 0 H61 DA B 21 22.740 17.068 31.408 1.00 0.00 H new ATOM 0 H62 DA B 21 23.548 16.641 32.920 1.00 0.00 H new ATOM 0 H2 DA B 21 18.833 18.695 32.235 1.00 0.00 H new ATOM 666 P DT B 22 15.946 16.182 39.646 1.00 0.00 P ATOM 667 OP1 DT B 22 14.664 16.560 40.296 1.00 0.00 O ATOM 668 OP2 DT B 22 16.837 15.220 40.342 1.00 0.00 O ATOM 669 O5' DT B 22 15.631 15.597 38.173 1.00 0.00 O ATOM 670 C5' DT B 22 14.517 16.068 37.419 1.00 0.00 C ATOM 671 C4' DT B 22 14.485 15.554 35.975 1.00 0.00 C ATOM 672 O4' DT B 22 15.581 16.073 35.237 1.00 0.00 O ATOM 673 C3' DT B 22 14.589 14.034 35.834 1.00 0.00 C ATOM 674 O3' DT B 22 13.354 13.356 36.030 1.00 0.00 O ATOM 675 C2' DT B 22 15.028 13.943 34.376 1.00 0.00 C ATOM 676 C1' DT B 22 15.784 15.243 34.105 1.00 0.00 C ATOM 677 N1 DT B 22 17.234 15.010 33.887 1.00 0.00 N ATOM 678 C2 DT B 22 17.713 15.045 32.573 1.00 0.00 C ATOM 679 O2 DT B 22 17.009 15.281 31.593 1.00 0.00 O ATOM 680 N3 DT B 22 19.048 14.787 32.399 1.00 0.00 N ATOM 681 C4 DT B 22 19.946 14.480 33.392 1.00 0.00 C ATOM 682 O4 DT B 22 21.121 14.301 33.080 1.00 0.00 O ATOM 683 C5 DT B 22 19.376 14.409 34.738 1.00 0.00 C ATOM 684 C7 DT B 22 20.241 14.051 35.933 1.00 0.00 C ATOM 685 C6 DT B 22 18.061 14.683 34.943 1.00 0.00 C ATOM 0 H5' DT B 22 14.533 17.158 37.407 1.00 0.00 H new ATOM 0 H5'' DT B 22 13.597 15.769 37.922 1.00 0.00 H new ATOM 0 H4' DT B 22 13.515 15.884 35.603 1.00 0.00 H new ATOM 0 H3' DT B 22 15.246 13.571 36.570 1.00 0.00 H new ATOM 0 H2' DT B 22 15.665 13.075 34.210 1.00 0.00 H new ATOM 0 H2'' DT B 22 14.170 13.840 33.712 1.00 0.00 H new ATOM 0 H1' DT B 22 15.411 15.708 33.193 1.00 0.00 H new ATOM 0 H3 DT B 22 19.407 14.827 31.445 1.00 0.00 H new ATOM 0 H71 DT B 22 19.848 14.538 36.826 1.00 0.00 H new ATOM 0 H72 DT B 22 20.234 12.970 36.076 1.00 0.00 H new ATOM 0 H73 DT B 22 21.263 14.387 35.756 1.00 0.00 H new ATOM 0 H6 DT B 22 17.658 14.645 35.944 1.00 0.00 H new ATOM 698 P DC B 23 13.284 11.750 36.219 1.00 0.00 P ATOM 699 OP1 DC B 23 11.869 11.390 36.492 1.00 0.00 O ATOM 700 OP2 DC B 23 14.321 11.344 37.198 1.00 0.00 O ATOM 701 O5' DC B 23 13.691 11.143 34.778 1.00 0.00 O ATOM 702 C5' DC B 23 12.858 11.322 33.638 1.00 0.00 C ATOM 703 C4' DC B 23 13.542 10.948 32.311 1.00 0.00 C ATOM 704 O4' DC B 23 14.779 11.651 32.142 1.00 0.00 O ATOM 705 C3' DC B 23 13.847 9.445 32.168 1.00 0.00 C ATOM 706 O3' DC B 23 13.426 9.016 30.875 1.00 0.00 O ATOM 707 C2' DC B 23 15.360 9.428 32.358 1.00 0.00 C ATOM 708 C1' DC B 23 15.745 10.731 31.660 1.00 0.00 C ATOM 709 N1 DC B 23 17.152 11.141 31.943 1.00 0.00 N ATOM 710 C2 DC B 23 18.033 11.317 30.865 1.00 0.00 C ATOM 711 O2 DC B 23 17.643 11.417 29.700 1.00 0.00 O ATOM 712 N3 DC B 23 19.370 11.365 31.066 1.00 0.00 N ATOM 713 C4 DC B 23 19.822 11.295 32.300 1.00 0.00 C ATOM 714 N4 DC B 23 21.115 11.291 32.428 1.00 0.00 N ATOM 715 C5 DC B 23 18.980 11.240 33.444 1.00 0.00 C ATOM 716 C6 DC B 23 17.642 11.166 33.229 1.00 0.00 C ATOM 0 H5' DC B 23 12.538 12.363 33.592 1.00 0.00 H new ATOM 0 H5'' DC B 23 11.959 10.717 33.757 1.00 0.00 H new ATOM 0 H4' DC B 23 12.818 11.232 31.547 1.00 0.00 H new ATOM 0 H3' DC B 23 13.343 8.775 32.864 1.00 0.00 H new ATOM 0 H2' DC B 23 15.645 9.422 33.410 1.00 0.00 H new ATOM 0 H2'' DC B 23 15.826 8.557 31.896 1.00 0.00 H new ATOM 0 H1' DC B 23 15.734 10.654 30.573 1.00 0.00 H new ATOM 0 H41 DC B 23 21.535 11.239 33.356 1.00 0.00 H new ATOM 0 H42 DC B 23 21.709 11.340 31.601 1.00 0.00 H new ATOM 0 H5 DC B 23 19.388 11.256 34.444 1.00 0.00 H new ATOM 0 H6 DC B 23 16.962 11.127 34.067 1.00 0.00 H new ATOM 728 P DG B 24 13.662 7.524 30.310 1.00 0.00 P ATOM 729 OP1 DG B 24 12.565 7.217 29.358 1.00 0.00 O ATOM 730 OP2 DG B 24 13.898 6.602 31.447 1.00 0.00 O ATOM 731 O5' DG B 24 15.036 7.664 29.478 1.00 0.00 O ATOM 732 C5' DG B 24 15.106 8.465 28.301 1.00 0.00 C ATOM 733 C4' DG B 24 16.389 8.247 27.482 1.00 0.00 C ATOM 734 O4' DG B 24 17.522 8.725 28.199 1.00 0.00 O ATOM 735 C3' DG B 24 16.646 6.765 27.144 1.00 0.00 C ATOM 736 O3' DG B 24 17.179 6.611 25.829 1.00 0.00 O ATOM 737 C2' DG B 24 17.695 6.392 28.187 1.00 0.00 C ATOM 738 C1' DG B 24 18.491 7.693 28.253 1.00 0.00 C ATOM 739 N9 DG B 24 19.297 7.809 29.486 1.00 0.00 N ATOM 740 C8 DG B 24 18.869 7.901 30.787 1.00 0.00 C ATOM 741 N7 DG B 24 19.835 8.001 31.665 1.00 0.00 N ATOM 742 C5 DG B 24 20.998 7.955 30.879 1.00 0.00 C ATOM 743 C6 DG B 24 22.400 8.008 31.222 1.00 0.00 C ATOM 744 O6 DG B 24 22.943 8.171 32.318 1.00 0.00 O ATOM 745 N1 DG B 24 23.233 7.831 30.137 1.00 0.00 N ATOM 746 C2 DG B 24 22.800 7.694 28.862 1.00 0.00 C ATOM 747 N2 DG B 24 23.702 7.505 27.938 1.00 0.00 N ATOM 748 N3 DG B 24 21.527 7.685 28.486 1.00 0.00 N ATOM 749 C4 DG B 24 20.670 7.812 29.546 1.00 0.00 C ATOM 0 H5' DG B 24 15.039 9.516 28.583 1.00 0.00 H new ATOM 0 H5'' DG B 24 14.243 8.248 27.672 1.00 0.00 H new ATOM 0 H4' DG B 24 16.243 8.797 26.552 1.00 0.00 H new ATOM 0 H3' DG B 24 15.745 6.152 27.163 1.00 0.00 H new ATOM 0 H2' DG B 24 17.251 6.128 29.147 1.00 0.00 H new ATOM 0 H2'' DG B 24 18.308 5.546 27.876 1.00 0.00 H new ATOM 0 HO3' DG B 24 17.332 5.660 25.647 1.00 0.00 H new ATOM 0 H1' DG B 24 19.209 7.742 27.434 1.00 0.00 H new ATOM 0 H8 DG B 24 17.825 7.892 31.063 1.00 0.00 H new ATOM 0 H1 DG B 24 24.238 7.802 30.306 1.00 0.00 H new ATOM 0 H21 DG B 24 23.419 7.397 26.964 1.00 0.00 H new ATOM 0 H22 DG B 24 24.690 7.466 28.190 1.00 0.00 H new TER 762 DG B 24 HETATM 763 O81 9U2 A 100 15.203 25.554 38.218 1.00 0.00 O HETATM 764 C81 9U2 A 100 15.835 25.053 37.300 1.00 0.00 C HETATM 765 C82 9U2 A 100 15.275 24.060 36.313 1.00 0.00 C HETATM 766 C84 9U2 A 100 13.959 23.596 36.268 1.00 0.00 C HETATM 767 C85 9U2 A 100 12.775 23.954 37.160 1.00 0.00 C HETATM 768 S81 9U2 A 100 13.694 22.527 34.910 1.00 0.00 S HETATM 769 C83 9U2 A 100 15.376 22.716 34.506 1.00 0.00 C HETATM 770 N81 9U2 A 100 16.067 23.515 35.303 1.00 0.00 N HETATM 771 CM8 9U2 A 100 12.289 25.417 37.013 1.00 0.00 C HETATM 772 CM9 9U2 A 100 12.894 23.491 38.635 1.00 0.00 C HETATM 781 N PYB A 101 17.166 25.405 37.072 1.00 0.00 N HETATM 782 CA PYB A 101 17.972 26.211 37.873 1.00 0.00 C HETATM 783 CB1 PYB A 101 19.286 26.642 37.551 1.00 0.00 C HETATM 784 CB PYB A 101 17.658 26.662 39.127 1.00 0.00 C HETATM 785 CG1 PYB A 101 19.772 27.322 38.645 1.00 0.00 C HETATM 786 NG2 PYB A 101 18.748 27.373 39.600 1.00 0.00 N HETATM 787 CD PYB A 101 18.739 28.056 40.903 1.00 0.00 C HETATM 788 C PYB A 101 21.137 27.843 38.949 1.00 0.00 C HETATM 789 O PYB A 101 21.455 28.184 40.083 1.00 0.00 O HETATM 0 HD3 PYB A 101 17.943 28.801 40.918 1.00 0.00 H new HETATM 0 HD2 PYB A 101 18.568 27.327 41.695 1.00 0.00 H new HETATM 0 HD1 PYB A 101 19.699 28.547 41.063 1.00 0.00 H new HETATM 0 HB1 PYB A 101 19.812 26.467 36.612 1.00 0.00 H new HETATM 0 HB PYB A 101 16.721 26.492 39.657 1.00 0.00 H new HETATM 0 H PYB A 101 17.511 25.075 36.171 1.00 0.00 H new HETATM 796 N PYB A 102 22.031 27.938 37.888 1.00 0.00 N HETATM 797 CA PYB A 102 23.373 28.321 37.999 1.00 0.00 C HETATM 798 CB1 PYB A 102 24.177 28.849 36.958 1.00 0.00 C HETATM 799 CB PYB A 102 24.123 28.294 39.147 1.00 0.00 C HETATM 800 CG1 PYB A 102 25.398 29.186 37.501 1.00 0.00 C HETATM 801 NG2 PYB A 102 25.378 28.800 38.845 1.00 0.00 N HETATM 802 CD PYB A 102 26.451 28.897 39.842 1.00 0.00 C HETATM 803 C PYB A 102 26.597 29.827 36.886 1.00 0.00 C HETATM 804 O PYB A 102 27.671 29.959 37.456 1.00 0.00 O HETATM 0 HD3 PYB A 102 26.128 29.537 40.663 1.00 0.00 H new HETATM 0 HD2 PYB A 102 26.682 27.903 40.226 1.00 0.00 H new HETATM 0 HD1 PYB A 102 27.341 29.323 39.378 1.00 0.00 H new HETATM 0 HB1 PYB A 102 23.882 28.967 35.915 1.00 0.00 H new HETATM 0 HB PYB A 102 23.792 27.938 40.123 1.00 0.00 H new HETATM 0 H PYB A 102 21.547 28.030 36.995 1.00 0.00 H new HETATM 811 N PYB A 103 26.401 30.324 35.610 1.00 0.00 N HETATM 812 CA PYB A 103 27.337 30.966 34.803 1.00 0.00 C HETATM 813 CB1 PYB A 103 26.992 31.677 33.637 1.00 0.00 C HETATM 814 CB PYB A 103 28.700 31.032 34.967 1.00 0.00 C HETATM 815 CG1 PYB A 103 28.153 32.122 33.056 1.00 0.00 C HETATM 816 NG2 PYB A 103 29.211 31.753 33.890 1.00 0.00 N HETATM 817 CD PYB A 103 30.640 32.044 33.703 1.00 0.00 C HETATM 818 C PYB A 103 28.334 32.770 31.738 1.00 0.00 C HETATM 819 O PYB A 103 29.402 33.030 31.209 1.00 0.00 O HETATM 0 HD3 PYB A 103 31.008 32.619 34.552 1.00 0.00 H new HETATM 0 HD2 PYB A 103 31.195 31.109 33.630 1.00 0.00 H new HETATM 0 HD1 PYB A 103 30.777 32.620 32.788 1.00 0.00 H new HETATM 0 HB1 PYB A 103 25.982 31.844 33.263 1.00 0.00 H new HETATM 0 HB PYB A 103 29.274 30.601 35.787 1.00 0.00 H new HETATM 0 H PYB A 103 25.411 30.355 35.367 1.00 0.00 H new HETATM 826 N ABU A 104 27.139 33.037 31.122 1.00 0.00 N HETATM 827 CA ABU A 104 26.967 33.437 29.724 1.00 0.00 C HETATM 828 CB ABU A 104 26.338 32.296 28.904 1.00 0.00 C HETATM 829 CG ABU A 104 27.347 31.329 28.247 1.00 0.00 C HETATM 830 CD ABU A 104 28.392 30.666 29.160 1.00 0.00 C HETATM 831 OE1 ABU A 104 29.583 30.787 28.925 1.00 0.00 O HETATM 0 H ABU A 104 26.251 32.971 31.620 1.00 0.00 H new HETATM 0 HB1 ABU A 104 25.679 31.722 29.555 1.00 0.00 H new HETATM 0 HB2 ABU A 104 25.714 32.731 28.123 1.00 0.00 H new HETATM 0 HG1 ABU A 104 26.807 30.561 27.693 1.00 0.00 H new HETATM 0 HG2 ABU A 104 27.991 31.884 27.565 1.00 0.00 H new HETATM 0 HE2 ABU A 104 27.956 30.858 29.019 1.00 0.00 H new HETATM 839 N IMT A 105 27.904 29.947 30.229 1.00 0.00 N HETATM 840 CA IMT A 105 28.575 29.366 31.278 1.00 0.00 C HETATM 841 NB1 IMT A 105 27.968 28.742 32.339 1.00 0.00 N HETATM 842 CB IMT A 105 29.936 29.375 31.432 1.00 0.00 C HETATM 843 CG1 IMT A 105 28.962 28.384 33.155 1.00 0.00 C HETATM 844 NG2 IMT A 105 30.200 28.744 32.627 1.00 0.00 N HETATM 845 CD IMT A 105 31.549 28.514 33.163 1.00 0.00 C HETATM 846 C IMT A 105 28.881 27.721 34.510 1.00 0.00 C HETATM 847 O IMT A 105 29.849 27.552 35.245 1.00 0.00 O HETATM 0 HN2 IMT A 105 26.884 29.932 30.205 1.00 0.00 H new HETATM 0 HD3 IMT A 105 32.120 27.904 32.463 1.00 0.00 H new HETATM 0 HD2 IMT A 105 32.052 29.470 33.305 1.00 0.00 H new HETATM 0 HD1 IMT A 105 31.477 27.997 34.120 1.00 0.00 H new HETATM 0 HB IMT A 105 30.667 29.799 30.743 1.00 0.00 H new HETATM 853 N PYB A 106 27.612 27.298 34.896 1.00 0.00 N HETATM 854 CA PYB A 106 27.240 26.725 36.113 1.00 0.00 C HETATM 855 CB1 PYB A 106 25.955 26.197 36.398 1.00 0.00 C HETATM 856 CB PYB A 106 28.017 26.607 37.236 1.00 0.00 C HETATM 857 CG1 PYB A 106 25.963 25.761 37.703 1.00 0.00 C HETATM 858 NG2 PYB A 106 27.254 25.968 38.206 1.00 0.00 N HETATM 859 CD PYB A 106 27.808 25.516 39.491 1.00 0.00 C HETATM 860 C PYB A 106 24.859 25.252 38.565 1.00 0.00 C HETATM 861 O PYB A 106 24.986 25.094 39.773 1.00 0.00 O HETATM 0 HD3 PYB A 106 28.606 24.795 39.310 1.00 0.00 H new HETATM 0 HD2 PYB A 106 28.208 26.371 40.036 1.00 0.00 H new HETATM 0 HD1 PYB A 106 27.021 25.046 40.081 1.00 0.00 H new HETATM 0 HB1 PYB A 106 25.113 26.146 35.708 1.00 0.00 H new HETATM 0 HB PYB A 106 29.045 26.951 37.348 1.00 0.00 H new HETATM 0 H PYB A 106 26.937 27.359 34.133 1.00 0.00 H new HETATM 868 N PYB A 107 23.666 24.971 37.919 1.00 0.00 N HETATM 869 CA PYB A 107 22.456 24.658 38.539 1.00 0.00 C HETATM 870 CB1 PYB A 107 21.366 23.997 37.925 1.00 0.00 C HETATM 871 CB PYB A 107 22.126 24.921 39.843 1.00 0.00 C HETATM 872 CG1 PYB A 107 20.387 23.829 38.878 1.00 0.00 C HETATM 873 NG2 PYB A 107 20.840 24.444 40.053 1.00 0.00 N HETATM 874 CD PYB A 107 20.136 24.580 41.336 1.00 0.00 C HETATM 875 C PYB A 107 19.061 23.148 38.804 1.00 0.00 C HETATM 876 O PYB A 107 18.235 23.191 39.707 1.00 0.00 O HETATM 0 HD3 PYB A 107 20.703 24.074 42.117 1.00 0.00 H new HETATM 0 HD2 PYB A 107 20.036 25.636 41.586 1.00 0.00 H new HETATM 0 HD1 PYB A 107 19.146 24.131 41.257 1.00 0.00 H new HETATM 0 HB1 PYB A 107 21.311 23.678 36.884 1.00 0.00 H new HETATM 0 HB PYB A 107 22.758 25.415 40.581 1.00 0.00 H new HETATM 0 H PYB A 107 23.818 24.720 36.942 1.00 0.00 H new HETATM 883 N PYB A 108 18.838 22.411 37.651 1.00 0.00 N HETATM 884 CA PYB A 108 17.704 21.659 37.345 1.00 0.00 C HETATM 885 CB1 PYB A 108 17.601 20.786 36.237 1.00 0.00 C HETATM 886 CB PYB A 108 16.521 21.609 38.044 1.00 0.00 C HETATM 887 CG1 PYB A 108 16.335 20.252 36.233 1.00 0.00 C HETATM 888 NG2 PYB A 108 15.699 20.691 37.397 1.00 0.00 N HETATM 889 CD PYB A 108 14.405 20.249 37.927 1.00 0.00 C HETATM 890 C PYB A 108 15.640 19.448 35.191 1.00 0.00 C HETATM 891 O PYB A 108 14.473 19.094 35.248 1.00 0.00 O HETATM 0 HD3 PYB A 108 14.552 19.778 38.899 1.00 0.00 H new HETATM 0 HD2 PYB A 108 13.744 21.109 38.037 1.00 0.00 H new HETATM 0 HD1 PYB A 108 13.956 19.532 37.240 1.00 0.00 H new HETATM 0 HB1 PYB A 108 18.388 20.574 35.513 1.00 0.00 H new HETATM 0 HB PYB A 108 16.273 22.181 38.938 1.00 0.00 H new HETATM 0 H PYB A 108 19.665 22.351 37.057 1.00 0.00 H new HETATM 898 C01 9T8 A 109 11.517 18.793 26.065 1.00 0.00 C HETATM 899 N02 9T8 A 109 15.486 17.845 29.789 1.00 0.00 N HETATM 900 C03 9T8 A 109 13.180 17.656 27.536 1.00 0.00 C HETATM 901 C05 9T8 A 109 14.904 16.641 29.168 1.00 0.00 C HETATM 902 C06 9T8 A 109 14.790 18.664 30.647 1.00 0.00 C HETATM 903 C07 9T8 A 109 15.617 19.388 31.704 1.00 0.00 C HETATM 904 C04 9T8 A 109 14.474 16.835 27.696 1.00 0.00 C HETATM 905 N01 9T8 A 109 12.888 18.123 26.108 1.00 0.00 N HETATM 906 C02 9T8 A 109 12.899 16.962 25.112 1.00 0.00 C HETATM 907 N03 9T8 A 109 16.412 19.185 34.081 1.00 0.00 N HETATM 908 C08 9T8 A 109 15.928 18.461 32.894 1.00 0.00 C HETATM 909 O01 9T8 A 109 13.571 18.728 30.613 1.00 0.00 O