HEADER PROTEIN/DNA 13-FEB-96 1TGH JRNL AUTH Z.S.JUO, T.K.CHIU, P.M.LEIBERMAN, I.BAIKALOV, JRNL AUTH 2 A.J.BERK, R.E.DICKERSON JRNL TITL HOW PROTEINS RECOGNIZE THE TATA-BOX JRNL REF J.MOL.BIOL. V. 261 239 1996 JRNL REFN ASTM JMOBAK UK ISSN 0022-2836 0070 SEQRES 1 A 185 GLY SER ARG GLY SER GLY ILE VAL PRO GLN LEU GLN ASN SEQRES 2 A 185 ILE VAL SER THR VAL ASN LEU GLY CYS LYS LEU ASP LEU SEQRES 3 A 185 LYS THR ILE ALA LEU ARG ALA ARG ASN ALA GLU TYR ASN SEQRES 4 A 185 PRO LYS ARG PHE ALA ALA VAL ILE MET ARG ILE ARG GLU SEQRES 5 A 185 PRO ARG THR THR ALA LEU ILE PHE SER SER GLY LYS MET SEQRES 6 A 185 VAL CYS THR GLY ALA LYS SER GLU GLU GLN SER ARG LEU SEQRES 7 A 185 ALA ALA ARG LYS TYR ALA ARG VAL VAL GLN LYS LEU GLY SEQRES 8 A 185 PHE PRO ALA LYS PHE LEU ASP PHE LYS ILE GLN ASN MET SEQRES 9 A 185 VAL GLY SER CYS ASP VAL LYS PHE PRO ILE ARG LEU GLU SEQRES 10 A 185 GLY LEU VAL LEU THR HIS GLN GLN PHE SER SER TYR GLU SEQRES 11 A 185 PRO GLU LEU PHE PRO GLY LEU ILE TYR ARG MET ILE LYS SEQRES 12 A 185 PRO ARG ILE VAL LEU LEU ILE PHE VAL SER GLY LYS VAL SEQRES 13 A 185 VAL LEU THR GLY ALA LYS VAL ARG ALA GLU ILE TYR GLU SEQRES 14 A 185 ALA PHE GLU ASN ILE TYR PRO ILE LEU LYS GLY PHE ARG SEQRES 15 A 185 LYS THR THR SEQRES 1 B 12 C G T A T A T A T A C G SEQRES 1 C 12 C G T A T A T A T A C G HELIX 1 LEU A 176 ARG A 182 1 HELIX 2 GLU A 223 GLY A 241 1 HELIX 3 LEU A 266 THR A 272 1 HELIX 4 ARG A 314 PHE A 331 1 SHEET A 5 SER A 166 ASN A 169 0 SHEET A 5 LYS A 214 THR A 218 -1 N CYS A 217 O SER A 166 SHEET A 5 THR A 206 PHE A 210 -1 N LEU A 208 O VAL A 216 SHEET A 5 ALA A 195 MET A 198 -1 N MET A 198 O ALA A 207 SHEET A 5 ALA A 186 TYR A 188 -1 N GLU A 187 O ILE A 197 SHEET B 5 GLY A 286 ARG A 290 0 SHEET B 5 VAL A 297 PHE A 301 -1 N ILE A 300 O LEU A 287 SHEET B 5 LYS A 305 THR A 309 -1 N THR A 309 O VAL A 297 SHEET B 5 ASN A 253 ASP A 259 -1 N CYS A 258 O VAL A 306 SHEET B 5 GLN A 160 VAL A 165 -1 N VAL A 165 O ASN A 253 CRYST1 66.965 67.397 86.226 90.00 90.00 90.00 P 21 21 21 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.014933 0.000000 0.000000 0.00000 SCALE2 0.000000 0.014837 0.000000 0.00000 SCALE3 0.000000 0.000000 0.011597 0.00000 ATOM 1 O5* C B 101 34.461 36.423 13.698 1.00 45.59 O ATOM 2 C5* C B 101 34.185 37.224 12.535 1.00 43.55 C ATOM 3 C4* C B 101 35.449 38.016 12.317 1.00 42.82 C ATOM 4 O4* C B 101 35.802 38.592 13.593 1.00 42.79 O ATOM 5 C3* C B 101 36.645 37.154 11.924 1.00 42.99 C ATOM 6 O3* C B 101 37.580 37.925 11.177 1.00 42.17 O ATOM 7 C2* C B 101 37.257 36.799 13.258 1.00 42.73 C ATOM 8 C1* C B 101 37.042 38.078 14.028 1.00 37.69 C ATOM 9 N1 C B 101 36.949 37.878 15.464 1.00 32.84 N ATOM 10 C2 C B 101 38.113 37.824 16.183 1.00 32.85 C ATOM 11 O2 C B 101 39.177 37.943 15.579 1.00 34.58 O ATOM 12 N3 C B 101 38.064 37.646 17.517 1.00 31.83 N ATOM 13 C4 C B 101 36.887 37.529 18.121 1.00 31.90 C ATOM 14 N4 C B 101 36.878 37.364 19.440 1.00 35.55 N ATOM 15 C5 C B 101 35.667 37.577 17.400 1.00 29.63 C ATOM 16 C6 C B 101 35.743 37.749 16.082 1.00 29.67 C ATOM 17 1H4 C B 101 36.000 37.264 19.934 1.00 0.00 H ATOM 18 2H4 C B 101 37.747 37.326 19.944 1.00 0.00 H ATOM 19 H5T C B 101 34.753 37.025 14.385 1.00 0.00 H ATOM 20 P G B 102 38.316 37.263 9.909 1.00 47.49 P ATOM 21 O1P G B 102 37.846 35.852 9.690 1.00 42.12 O ATOM 22 O2P G B 102 38.239 38.253 8.792 1.00 48.62 O ATOM 23 O5* G B 102 39.834 37.183 10.355 1.00 43.00 O ATOM 24 C5* G B 102 40.600 36.073 9.985 1.00 38.57 C ATOM 25 C4* G B 102 41.758 35.934 10.926 1.00 36.60 C ATOM 26 O4* G B 102 41.241 36.156 12.252 1.00 35.31 O ATOM 27 C3* G B 102 42.359 34.534 10.906 1.00 41.64 C ATOM 28 O3* G B 102 43.796 34.595 10.802 1.00 47.43 O ATOM 29 C2* G B 102 41.829 33.889 12.183 1.00 39.33 C ATOM 30 C1* G B 102 41.589 35.076 13.098 1.00 37.56 C ATOM 31 N9 G B 102 40.535 34.934 14.105 1.00 35.56 N ATOM 32 C8 G B 102 39.180 34.882 13.897 1.00 34.97 C ATOM 33 N7 G B 102 38.495 34.772 15.005 1.00 33.35 N ATOM 34 C5 G B 102 39.456 34.745 16.000 1.00 36.37 C ATOM 35 C6 G B 102 39.325 34.636 17.412 1.00 39.35 C ATOM 36 O6 G B 102 38.303 34.541 18.090 1.00 42.57 O ATOM 37 N1 G B 102 40.555 34.647 18.043 1.00 39.32 N ATOM 38 C2 G B 102 41.757 34.749 17.414 1.00 39.37 C ATOM 39 N2 G B 102 42.824 34.743 18.207 1.00 43.50 N ATOM 40 N3 G B 102 41.903 34.851 16.104 1.00 38.35 N ATOM 41 C4 G B 102 40.719 34.842 15.462 1.00 36.78 C ATOM 42 H1 G B 102 40.545 34.574 19.042 1.00 0.00 H ATOM 43 1H2 G B 102 43.753 34.816 17.817 1.00 0.00 H ATOM 44 2H2 G B 102 42.697 34.662 19.207 1.00 0.00 H ATOM 45 P T B 103 44.605 33.399 10.056 1.00 48.11 P ATOM 46 O1P T B 103 45.853 34.006 9.525 1.00 49.69 O ATOM 47 O2P T B 103 43.695 32.685 9.124 1.00 48.33 O ATOM 48 O5* T B 103 44.948 32.427 11.271 1.00 45.39 O ATOM 49 C5* T B 103 44.265 32.613 12.509 1.00 42.73 C ATOM 50 C4* T B 103 45.013 31.965 13.640 1.00 40.92 C ATOM 51 O4* T B 103 44.212 32.255 14.801 1.00 41.08 O ATOM 52 C3* T B 103 45.024 30.455 13.491 1.00 43.12 C ATOM 53 O3* T B 103 46.284 29.838 13.624 1.00 45.19 O ATOM 54 C2* T B 103 44.126 29.926 14.582 1.00 43.04 C ATOM 55 C1* T B 103 43.830 31.086 15.489 1.00 41.51 C ATOM 56 N1 T B 103 42.364 31.099 15.684 1.00 41.64 N ATOM 57 C2 T B 103 41.859 30.942 16.954 1.00 41.05 C ATOM 58 O2 T B 103 42.552 30.833 17.944 1.00 45.01 O ATOM 59 N3 T B 103 40.501 30.904 17.025 1.00 40.05 N ATOM 60 C4 T B 103 39.608 30.996 15.988 1.00 39.90 C ATOM 61 O4 T B 103 38.412 30.929 16.218 1.00 39.63 O ATOM 62 C5 T B 103 40.191 31.167 14.685 1.00 39.60 C ATOM 63 C5M T B 103 39.289 31.274 13.497 1.00 39.51 C ATOM 64 C6 T B 103 41.525 31.220 14.597 1.00 40.41 C ATOM 65 H3 T B 103 40.112 30.787 17.949 1.00 0.00 H ATOM 66 P A B 104 46.451 28.359 13.028 1.00 42.99 P ATOM 67 O1P A B 104 45.804 28.409 11.677 1.00 42.26 O ATOM 68 O2P A B 104 47.866 27.914 13.142 1.00 47.97 O ATOM 69 O5* A B 104 45.573 27.483 14.025 1.00 37.48 O ATOM 70 C5* A B 104 46.064 27.141 15.314 1.00 36.51 C ATOM 71 C4* A B 104 45.353 25.903 15.803 1.00 35.69 C ATOM 72 O4* A B 104 44.036 26.275 16.277 1.00 36.72 O ATOM 73 C3* A B 104 45.124 24.907 14.664 1.00 36.89 C ATOM 74 O3* A B 104 45.151 23.554 15.147 1.00 35.84 O ATOM 75 C2* A B 104 43.734 25.278 14.183 1.00 39.21 C ATOM 76 C1* A B 104 43.053 25.592 15.505 1.00 38.34 C ATOM 77 N9 A B 104 41.839 26.421 15.419 1.00 35.31 N ATOM 78 C8 A B 104 41.593 27.511 14.617 1.00 33.41 C ATOM 79 N7 A B 104 40.396 28.029 14.777 1.00 30.60 N ATOM 80 C5 A B 104 39.813 27.224 15.748 1.00 29.11 C ATOM 81 C6 A B 104 38.546 27.247 16.363 1.00 28.37 C ATOM 82 N6 A B 104 37.595 28.150 16.087 1.00 24.14 N ATOM 83 N1 A B 104 38.288 26.300 17.290 1.00 28.55 N ATOM 84 C2 A B 104 39.241 25.397 17.572 1.00 28.16 C ATOM 85 N3 A B 104 40.462 25.273 17.064 1.00 27.34 N ATOM 86 C4 A B 104 40.690 26.229 16.150 1.00 29.56 C ATOM 87 1H6 A B 104 37.765 28.869 15.398 1.00 0.00 H ATOM 88 2H6 A B 104 36.706 28.108 16.567 1.00 0.00 H ATOM 89 P T B 105 45.306 22.327 14.107 1.00 31.60 P ATOM 90 O1P T B 105 44.548 22.615 12.852 1.00 27.41 O ATOM 91 O2P T B 105 46.722 21.956 14.014 1.00 39.85 O ATOM 92 O5* T B 105 44.663 21.124 14.912 1.00 31.08 O ATOM 93 C5* T B 105 43.466 21.332 15.640 1.00 34.03 C ATOM 94 C4* T B 105 42.615 20.094 15.597 1.00 30.98 C ATOM 95 O4* T B 105 41.281 20.498 15.962 1.00 30.01 O ATOM 96 C3* T B 105 42.512 19.535 14.179 1.00 26.89 C ATOM 97 O3* T B 105 42.283 18.129 14.219 1.00 24.51 O ATOM 98 C2* T B 105 41.293 20.233 13.630 1.00 31.45 C ATOM 99 C1* T B 105 40.404 20.306 14.858 1.00 33.31 C ATOM 100 N1 T B 105 39.464 21.430 14.822 1.00 30.69 N ATOM 101 C2 T B 105 38.319 21.397 15.587 1.00 31.87 C ATOM 102 O2 T B 105 38.010 20.466 16.311 1.00 33.10 O ATOM 103 N3 T B 105 37.536 22.508 15.471 1.00 32.42 N ATOM 104 C4 T B 105 37.777 23.614 14.685 1.00 33.54 C ATOM 105 O4 T B 105 36.986 24.539 14.677 1.00 38.21 O ATOM 106 C5 T B 105 38.985 23.573 13.915 1.00 32.13 C ATOM 107 C5M T B 105 39.321 24.726 13.032 1.00 31.19 C ATOM 108 C6 T B 105 39.757 22.500 14.021 1.00 31.58 C ATOM 109 H3 T B 105 36.686 22.510 16.018 1.00 0.00 H ATOM 110 P A B 106 42.763 17.205 12.991 1.00 25.11 P ATOM 111 O1P A B 106 42.865 17.972 11.706 1.00 17.06 O ATOM 112 O2P A B 106 43.901 16.363 13.455 1.00 28.28 O ATOM 113 O5* A B 106 41.558 16.204 12.806 1.00 28.78 O ATOM 114 C5* A B 106 40.846 15.706 13.915 1.00 20.61 C ATOM 115 C4* A B 106 39.522 15.181 13.426 1.00 16.56 C ATOM 116 O4* A B 106 38.646 16.313 13.324 1.00 14.85 O ATOM 117 C3* A B 106 39.605 14.589 12.022 1.00 12.52 C ATOM 118 O3* A B 106 39.026 13.300 11.920 1.00 15.10 O ATOM 119 C2* A B 106 38.901 15.596 11.142 1.00 9.78 C ATOM 120 C1* A B 106 37.991 16.321 12.085 1.00 9.95 C ATOM 121 N9 A B 106 37.774 17.723 11.743 1.00 13.25 N ATOM 122 C8 A B 106 38.467 18.439 10.827 1.00 15.74 C ATOM 123 N7 A B 106 38.078 19.679 10.733 1.00 16.63 N ATOM 124 C5 A B 106 37.064 19.779 11.642 1.00 12.90 C ATOM 125 C6 A B 106 36.255 20.850 11.993 1.00 14.97 C ATOM 126 N6 A B 106 36.364 22.034 11.445 1.00 13.23 N ATOM 127 N1 A B 106 35.317 20.645 12.950 1.00 17.86 N ATOM 128 C2 A B 106 35.210 19.424 13.497 1.00 16.28 C ATOM 129 N3 A B 106 35.922 18.339 13.223 1.00 18.97 N ATOM 130 C4 A B 106 36.847 18.588 12.272 1.00 16.58 C ATOM 131 1H6 A B 106 35.757 22.795 11.723 1.00 0.00 H ATOM 132 2H6 A B 106 37.068 22.179 10.741 1.00 0.00 H ATOM 133 P T B 107 39.250 12.441 10.580 1.00 22.52 P ATOM 134 O1P T B 107 40.511 12.869 9.881 1.00 17.96 O ATOM 135 O2P T B 107 39.030 11.000 10.897 1.00 19.46 O ATOM 136 O5* T B 107 38.088 12.976 9.647 1.00 17.44 O ATOM 137 C5* T B 107 36.757 12.575 9.847 1.00 19.47 C ATOM 138 C4* T B 107 35.936 13.073 8.697 1.00 18.45 C ATOM 139 O4* T B 107 35.585 14.469 8.941 1.00 17.79 O ATOM 140 C3* T B 107 36.805 13.057 7.446 1.00 15.84 C ATOM 141 O3* T B 107 36.216 12.341 6.394 1.00 13.72 O ATOM 142 C2* T B 107 36.896 14.515 7.047 1.00 22.34 C ATOM 143 C1* T B 107 35.719 15.165 7.736 1.00 19.53 C ATOM 144 N1 T B 107 35.922 16.613 8.016 1.00 24.39 N ATOM 145 C2 T B 107 34.975 17.346 8.702 1.00 26.57 C ATOM 146 O2 T B 107 33.949 16.868 9.141 1.00 26.67 O ATOM 147 N3 T B 107 35.290 18.677 8.852 1.00 26.49 N ATOM 148 C4 T B 107 36.431 19.317 8.397 1.00 26.71 C ATOM 149 O4 T B 107 36.587 20.505 8.587 1.00 29.65 O ATOM 150 C5 T B 107 37.361 18.500 7.714 1.00 24.82 C ATOM 151 C5M T B 107 38.618 19.122 7.205 1.00 25.73 C ATOM 152 C6 T B 107 37.070 17.210 7.555 1.00 25.26 C ATOM 153 H3 T B 107 34.628 19.265 9.338 1.00 0.00 H ATOM 154 P A B 108 37.138 11.798 5.189 1.00 18.74 P ATOM 155 O1P A B 108 38.235 12.755 4.887 1.00 18.46 O ATOM 156 O2P A B 108 37.476 10.398 5.443 1.00 18.49 O ATOM 157 O5* A B 108 36.103 11.849 3.990 1.00 19.54 O ATOM 158 C5* A B 108 34.770 11.372 4.211 1.00 18.19 C ATOM 159 C4* A B 108 33.779 12.118 3.354 1.00 15.77 C ATOM 160 O4* A B 108 33.470 13.395 3.953 1.00 15.80 O ATOM 161 C3* A B 108 34.368 12.407 1.985 1.00 14.17 C ATOM 162 O3* A B 108 33.696 11.730 0.983 1.00 17.65 O ATOM 163 C2* A B 108 34.220 13.896 1.781 1.00 15.68 C ATOM 164 C1* A B 108 33.521 14.435 3.006 1.00 15.83 C ATOM 165 N9 A B 108 34.384 15.483 3.531 1.00 19.06 N ATOM 166 C8 A B 108 35.751 15.472 3.484 1.00 19.64 C ATOM 167 N7 A B 108 36.303 16.551 3.969 1.00 22.09 N ATOM 168 C5 A B 108 35.226 17.316 4.374 1.00 22.56 C ATOM 169 C6 A B 108 35.148 18.568 4.966 1.00 25.34 C ATOM 170 N6 A B 108 36.218 19.286 5.275 1.00 28.29 N ATOM 171 N1 A B 108 33.925 19.071 5.238 1.00 27.52 N ATOM 172 C2 A B 108 32.853 18.334 4.925 1.00 26.46 C ATOM 173 N3 A B 108 32.801 17.127 4.370 1.00 27.21 N ATOM 174 C4 A B 108 34.038 16.669 4.114 1.00 22.53 C ATOM 175 1H6 A B 108 36.120 20.192 5.712 1.00 0.00 H ATOM 176 2H6 A B 108 37.132 18.914 5.072 1.00 0.00 H ATOM 177 P T B 109 34.387 11.579 -0.448 1.00 24.16 P ATOM 178 O1P T B 109 35.841 11.934 -0.351 1.00 25.91 O ATOM 179 O2P T B 109 33.976 10.283 -1.060 1.00 27.36 O ATOM 180 O5* T B 109 33.686 12.725 -1.286 1.00 25.48 O ATOM 181 C5* T B 109 33.243 13.896 -0.642 1.00 21.15 C ATOM 182 C4* T B 109 32.215 14.563 -1.501 1.00 18.51 C ATOM 183 O4* T B 109 31.874 15.761 -0.802 1.00 24.07 O ATOM 184 C3* T B 109 32.808 14.986 -2.835 1.00 20.02 C ATOM 185 O3* T B 109 32.063 14.556 -3.955 1.00 21.82 O ATOM 186 C2* T B 109 33.005 16.484 -2.741 1.00 20.78 C ATOM 187 C1* T B 109 32.493 16.886 -1.368 1.00 24.21 C ATOM 188 N1 T B 109 33.620 17.246 -0.492 1.00 26.93 N ATOM 189 C2 T B 109 33.557 18.387 0.274 1.00 28.10 C ATOM 190 O2 T B 109 32.597 19.128 0.308 1.00 27.34 O ATOM 191 N3 T B 109 34.674 18.634 1.008 1.00 35.02 N ATOM 192 C4 T B 109 35.830 17.875 1.064 1.00 36.86 C ATOM 193 O4 T B 109 36.774 18.236 1.783 1.00 37.97 O ATOM 194 C5 T B 109 35.821 16.687 0.243 1.00 33.72 C ATOM 195 C5M T B 109 37.029 15.807 0.237 1.00 31.35 C ATOM 196 C6 T B 109 34.729 16.435 -0.479 1.00 27.86 C ATOM 197 H3 T B 109 34.648 19.470 1.577 1.00 0.00 H ATOM 198 P A B 110 32.848 14.105 -5.295 1.00 32.21 P ATOM 199 O1P A B 110 34.218 13.615 -4.917 1.00 30.66 O ATOM 200 O2P A B 110 31.952 13.231 -6.115 1.00 37.81 O ATOM 201 O5* A B 110 33.050 15.459 -6.103 1.00 27.19 O ATOM 202 C5* A B 110 33.549 16.586 -5.410 1.00 30.76 C ATOM 203 C4* A B 110 33.869 17.691 -6.373 1.00 29.95 C ATOM 204 O4* A B 110 34.338 18.787 -5.568 1.00 25.88 O ATOM 205 C3* A B 110 34.982 17.366 -7.355 1.00 30.61 C ATOM 206 O3* A B 110 34.720 17.958 -8.629 1.00 41.09 O ATOM 207 C2* A B 110 36.202 17.968 -6.700 1.00 29.12 C ATOM 208 C1* A B 110 35.679 19.088 -5.832 1.00 25.05 C ATOM 209 N9 A B 110 36.357 19.124 -4.557 1.00 23.63 N ATOM 210 C8 A B 110 36.488 18.087 -3.682 1.00 23.59 C ATOM 211 N7 A B 110 37.149 18.386 -2.607 1.00 24.02 N ATOM 212 C5 A B 110 37.479 19.715 -2.777 1.00 15.88 C ATOM 213 C6 A B 110 38.166 20.578 -1.978 1.00 13.91 C ATOM 214 N6 A B 110 38.663 20.205 -0.774 1.00 17.16 N ATOM 215 N1 A B 110 38.333 21.832 -2.427 1.00 12.79 N ATOM 216 C2 A B 110 37.816 22.157 -3.607 1.00 19.97 C ATOM 217 N3 A B 110 37.140 21.424 -4.454 1.00 19.13 N ATOM 218 C4 A B 110 37.001 20.190 -3.969 1.00 18.17 C ATOM 219 1H6 A B 110 39.158 20.855 -0.233 1.00 0.00 H ATOM 220 2H6 A B 110 38.535 19.263 -0.466 1.00 0.00 H ATOM 221 P C B 111 35.627 17.564 -9.912 1.00 48.15 P ATOM 222 O1P C B 111 36.163 16.177 -9.718 1.00 43.81 O ATOM 223 O2P C B 111 34.915 17.923 -11.175 1.00 45.40 O ATOM 224 O5* C B 111 36.829 18.585 -9.799 1.00 43.55 O ATOM 225 C5* C B 111 36.634 19.966 -10.046 1.00 37.03 C ATOM 226 C4* C B 111 37.987 20.608 -10.153 1.00 34.46 C ATOM 227 O4* C B 111 38.522 20.873 -8.826 1.00 29.93 O ATOM 228 C3* C B 111 38.913 19.572 -10.780 1.00 34.15 C ATOM 229 O3* C B 111 39.898 20.206 -11.569 1.00 41.16 O ATOM 230 C2* C B 111 39.552 18.939 -9.567 1.00 29.85 C ATOM 231 C1* C B 111 39.726 20.156 -8.698 1.00 25.48 C ATOM 232 N1 C B 111 39.969 19.871 -7.292 1.00 21.67 N ATOM 233 C2 C B 111 40.306 20.920 -6.438 1.00 22.49 C ATOM 234 O2 C B 111 40.365 22.065 -6.915 1.00 25.52 O ATOM 235 N3 C B 111 40.555 20.667 -5.120 1.00 17.54 N ATOM 236 C4 C B 111 40.467 19.416 -4.669 1.00 19.20 C ATOM 237 N4 C B 111 40.703 19.178 -3.379 1.00 22.14 N ATOM 238 C5 C B 111 40.120 18.334 -5.528 1.00 19.90 C ATOM 239 C6 C B 111 39.882 18.600 -6.818 1.00 18.72 C ATOM 240 1H4 C B 111 40.644 18.238 -3.024 1.00 0.00 H ATOM 241 2H4 C B 111 40.946 19.941 -2.770 1.00 0.00 H ATOM 242 P G B 112 39.803 20.116 -13.158 1.00 48.18 P ATOM 243 O1P G B 112 40.295 18.780 -13.604 1.00 46.06 O ATOM 244 O2P G B 112 38.419 20.553 -13.533 1.00 51.39 O ATOM 245 O5* G B 112 40.819 21.239 -13.634 1.00 46.15 O ATOM 246 C5* G B 112 40.480 22.619 -13.508 1.00 45.99 C ATOM 247 C4* G B 112 41.714 23.400 -13.143 1.00 46.22 C ATOM 248 O4* G B 112 41.997 23.244 -11.726 1.00 42.31 O ATOM 249 C3* G B 112 42.927 22.845 -13.886 1.00 47.82 C ATOM 250 O3* G B 112 43.867 23.880 -14.208 1.00 54.15 O ATOM 251 C2* G B 112 43.508 21.863 -12.881 1.00 44.68 C ATOM 252 C1* G B 112 43.239 22.574 -11.563 1.00 39.40 C ATOM 253 N9 G B 112 43.134 21.663 -10.429 1.00 33.01 N ATOM 254 C8 G B 112 42.782 20.340 -10.483 1.00 30.62 C ATOM 255 N7 G B 112 42.791 19.760 -9.313 1.00 29.51 N ATOM 256 C5 G B 112 43.167 20.760 -8.431 1.00 28.28 C ATOM 257 C6 G B 112 43.349 20.717 -7.025 1.00 31.24 C ATOM 258 O6 G B 112 43.198 19.764 -6.261 1.00 29.59 O ATOM 259 N1 G B 112 43.750 21.948 -6.518 1.00 32.35 N ATOM 260 C2 G B 112 43.945 23.077 -7.271 1.00 31.11 C ATOM 261 N2 G B 112 44.332 24.163 -6.582 1.00 31.23 N ATOM 262 N3 G B 112 43.773 23.136 -8.594 1.00 26.64 N ATOM 263 C4 G B 112 43.386 21.946 -9.102 1.00 28.57 C ATOM 264 H1 G B 112 43.908 22.011 -5.522 1.00 0.00 H ATOM 265 1H2 G B 112 44.499 25.035 -7.063 1.00 0.00 H ATOM 266 2H2 G B 112 44.459 24.114 -5.579 1.00 0.00 H ATOM 267 H3T G B 112 44.606 23.469 -14.663 1.00 0.00 H TER 268 G B 112 ATOM 269 O5* C C 113 48.153 22.216 0.758 1.00 40.61 O ATOM 270 C5* C C 113 49.160 22.952 0.032 1.00 39.83 C ATOM 271 C4* C C 113 48.597 24.258 -0.477 1.00 38.40 C ATOM 272 O4* C C 113 47.922 24.104 -1.757 1.00 36.36 O ATOM 273 C3* C C 113 47.553 24.858 0.452 1.00 37.79 C ATOM 274 O3* C C 113 47.623 26.277 0.312 1.00 41.47 O ATOM 275 C2* C C 113 46.255 24.288 -0.101 1.00 34.40 C ATOM 276 C1* C C 113 46.509 24.160 -1.595 1.00 26.82 C ATOM 277 N1 C C 113 45.960 22.925 -2.183 1.00 20.17 N ATOM 278 C2 C C 113 45.400 22.960 -3.474 1.00 21.55 C ATOM 279 O2 C C 113 45.357 24.030 -4.083 1.00 27.90 O ATOM 280 N3 C C 113 44.917 21.827 -4.026 1.00 17.92 N ATOM 281 C4 C C 113 44.965 20.691 -3.341 1.00 18.56 C ATOM 282 N4 C C 113 44.476 19.605 -3.919 1.00 18.77 N ATOM 283 C5 C C 113 45.521 20.624 -2.026 1.00 15.95 C ATOM 284 C6 C C 113 46.003 21.756 -1.489 1.00 15.80 C ATOM 285 1H4 C C 113 44.493 18.724 -3.430 1.00 0.00 H ATOM 286 2H4 C C 113 44.077 19.657 -4.837 1.00 0.00 H ATOM 287 H5T C C 113 47.949 22.745 1.534 1.00 0.00 H ATOM 288 P G C 114 46.641 27.212 1.152 1.00 41.89 P ATOM 289 O1P G C 114 45.394 26.399 1.396 1.00 45.92 O ATOM 290 O2P G C 114 47.414 27.735 2.308 1.00 39.93 O ATOM 291 O5* G C 114 46.295 28.376 0.112 1.00 37.00 O ATOM 292 C5* G C 114 46.167 28.075 -1.284 1.00 36.17 C ATOM 293 C4* G C 114 44.854 28.589 -1.860 1.00 38.16 C ATOM 294 O4* G C 114 44.112 27.537 -2.535 1.00 36.10 O ATOM 295 C3* G C 114 43.829 29.306 -0.978 1.00 36.80 C ATOM 296 O3* G C 114 43.244 30.366 -1.776 1.00 38.21 O ATOM 297 C2* G C 114 42.826 28.204 -0.683 1.00 31.51 C ATOM 298 C1* G C 114 42.809 27.412 -1.985 1.00 31.49 C ATOM 299 N9 G C 114 42.567 25.986 -1.803 1.00 28.52 N ATOM 300 C8 G C 114 42.796 25.279 -0.654 1.00 26.36 C ATOM 301 N7 G C 114 42.509 24.013 -0.775 1.00 25.89 N ATOM 302 C5 G C 114 42.064 23.873 -2.082 1.00 22.40 C ATOM 303 C6 G C 114 41.614 22.718 -2.774 1.00 24.53 C ATOM 304 O6 G C 114 41.524 21.566 -2.355 1.00 27.41 O ATOM 305 N1 G C 114 41.247 23.006 -4.074 1.00 22.19 N ATOM 306 C2 G C 114 41.305 24.252 -4.638 1.00 25.21 C ATOM 307 N2 G C 114 40.905 24.326 -5.912 1.00 23.90 N ATOM 308 N3 G C 114 41.725 25.348 -4.001 1.00 25.15 N ATOM 309 C4 G C 114 42.087 25.083 -2.731 1.00 24.33 C ATOM 310 H1 G C 114 40.913 22.238 -4.637 1.00 0.00 H ATOM 311 1H2 G C 114 40.926 25.211 -6.392 1.00 0.00 H ATOM 312 2H2 G C 114 40.591 23.495 -6.392 1.00 0.00 H ATOM 313 P T C 115 42.257 31.460 -1.103 1.00 37.95 P ATOM 314 O1P T C 115 42.696 31.712 0.303 1.00 34.51 O ATOM 315 O2P T C 115 42.177 32.596 -2.058 1.00 34.00 O ATOM 316 O5* T C 115 40.847 30.713 -1.137 1.00 33.40 O ATOM 317 C5* T C 115 40.246 30.403 -2.392 1.00 30.25 C ATOM 318 C4* T C 115 38.946 29.661 -2.201 1.00 28.94 C ATOM 319 O4* T C 115 39.149 28.232 -2.225 1.00 25.40 O ATOM 320 C3* T C 115 38.184 29.970 -0.907 1.00 30.22 C ATOM 321 O3* T C 115 36.805 30.212 -1.174 1.00 30.82 O ATOM 322 C2* T C 115 38.301 28.685 -0.113 1.00 28.13 C ATOM 323 C1* T C 115 38.310 27.676 -1.236 1.00 26.95 C ATOM 324 N1 T C 115 38.795 26.331 -0.871 1.00 25.81 N ATOM 325 C2 T C 115 38.505 25.286 -1.716 1.00 26.38 C ATOM 326 O2 T C 115 37.895 25.425 -2.763 1.00 30.49 O ATOM 327 N3 T C 115 38.950 24.069 -1.293 1.00 21.37 N ATOM 328 C4 T C 115 39.632 23.797 -0.144 1.00 23.77 C ATOM 329 O4 T C 115 39.952 22.641 0.111 1.00 28.48 O ATOM 330 C5 T C 115 39.914 24.937 0.691 1.00 20.95 C ATOM 331 C5M T C 115 40.657 24.731 1.966 1.00 19.43 C ATOM 332 C6 T C 115 39.492 26.131 0.290 1.00 21.82 C ATOM 333 H3 T C 115 38.748 23.278 -1.882 1.00 0.00 H ATOM 334 P A C 116 35.911 30.977 -0.082 1.00 34.09 P ATOM 335 O1P A C 116 35.332 32.208 -0.690 1.00 37.06 O ATOM 336 O2P A C 116 36.663 31.065 1.199 1.00 30.11 O ATOM 337 O5* A C 116 34.657 30.024 0.096 1.00 33.63 O ATOM 338 C5* A C 116 34.700 28.672 -0.313 1.00 28.81 C ATOM 339 C4* A C 116 33.423 28.011 0.118 1.00 26.10 C ATOM 340 O4* A C 116 33.580 26.580 0.105 1.00 29.07 O ATOM 341 C3* A C 116 33.114 28.387 1.559 1.00 24.57 C ATOM 342 O3* A C 116 31.709 28.526 1.705 1.00 20.97 O ATOM 343 C2* A C 116 33.674 27.233 2.361 1.00 26.29 C ATOM 344 C1* A C 116 33.509 26.057 1.422 1.00 29.47 C ATOM 345 N9 A C 116 34.560 25.059 1.520 1.00 32.36 N ATOM 346 C8 A C 116 35.900 25.281 1.626 1.00 30.83 C ATOM 347 N7 A C 116 36.608 24.186 1.662 1.00 34.00 N ATOM 348 C5 A C 116 35.669 23.175 1.580 1.00 33.70 C ATOM 349 C6 A C 116 35.787 21.785 1.560 1.00 36.60 C ATOM 350 N6 A C 116 36.958 21.138 1.629 1.00 36.14 N ATOM 351 N1 A C 116 34.646 21.062 1.468 1.00 41.56 N ATOM 352 C2 A C 116 33.477 21.710 1.408 1.00 38.07 C ATOM 353 N3 A C 116 33.246 23.013 1.417 1.00 39.06 N ATOM 354 C4 A C 116 34.401 23.699 1.501 1.00 35.29 C ATOM 355 1H6 A C 116 37.815 21.669 1.706 1.00 0.00 H ATOM 356 2H6 A C 116 36.993 20.129 1.632 1.00 0.00 H ATOM 357 P T C 117 31.099 28.883 3.126 1.00 20.74 P ATOM 358 O1P T C 117 32.087 29.548 4.002 1.00 20.75 O ATOM 359 O2P T C 117 29.804 29.536 2.841 1.00 24.03 O ATOM 360 O5* T C 117 30.808 27.466 3.753 1.00 21.27 O ATOM 361 C5* T C 117 29.800 26.659 3.192 1.00 25.64 C ATOM 362 C4* T C 117 29.367 25.659 4.218 1.00 28.75 C ATOM 363 O4* T C 117 30.189 24.461 4.124 1.00 33.94 O ATOM 364 C3* T C 117 29.587 26.244 5.606 1.00 27.81 C ATOM 365 O3* T C 117 28.470 25.978 6.425 1.00 29.37 O ATOM 366 C2* T C 117 30.790 25.478 6.123 1.00 33.44 C ATOM 367 C1* T C 117 30.683 24.140 5.407 1.00 34.07 C ATOM 368 N1 T C 117 31.992 23.456 5.265 1.00 36.93 N ATOM 369 C2 T C 117 32.063 22.110 4.997 1.00 38.11 C ATOM 370 O2 T C 117 31.102 21.399 4.845 1.00 42.66 O ATOM 371 N3 T C 117 33.327 21.615 4.924 1.00 40.82 N ATOM 372 C4 T C 117 34.504 22.304 5.093 1.00 44.04 C ATOM 373 O4 T C 117 35.578 21.723 5.004 1.00 48.38 O ATOM 374 C5 T C 117 34.364 23.691 5.368 1.00 42.57 C ATOM 375 C5M T C 117 35.595 24.510 5.574 1.00 46.09 C ATOM 376 C6 T C 117 33.133 24.197 5.432 1.00 41.59 C ATOM 377 H3 T C 117 33.413 20.629 4.731 1.00 0.00 H ATOM 378 P A C 118 28.183 26.893 7.720 1.00 27.25 P ATOM 379 O1P A C 118 29.448 27.305 8.406 1.00 29.99 O ATOM 380 O2P A C 118 27.198 27.926 7.335 1.00 29.33 O ATOM 381 O5* A C 118 27.457 25.844 8.649 1.00 24.23 O ATOM 382 C5* A C 118 27.825 24.493 8.571 1.00 19.57 C ATOM 383 C4* A C 118 27.367 23.799 9.817 1.00 22.93 C ATOM 384 O4* A C 118 28.356 22.798 10.111 1.00 28.12 O ATOM 385 C3* A C 118 27.378 24.764 10.995 1.00 21.46 C ATOM 386 O3* A C 118 26.372 24.408 11.932 1.00 23.43 O ATOM 387 C2* A C 118 28.776 24.644 11.562 1.00 24.72 C ATOM 388 C1* A C 118 29.291 23.296 11.071 1.00 29.09 C ATOM 389 N9 A C 118 30.593 23.419 10.395 1.00 27.45 N ATOM 390 C8 A C 118 31.154 24.579 9.935 1.00 24.87 C ATOM 391 N7 A C 118 32.322 24.415 9.373 1.00 27.21 N ATOM 392 C5 A C 118 32.548 23.049 9.464 1.00 27.00 C ATOM 393 C6 A C 118 33.608 22.243 9.041 1.00 26.91 C ATOM 394 N6 A C 118 34.694 22.710 8.410 1.00 27.16 N ATOM 395 N1 A C 118 33.522 20.919 9.281 1.00 24.26 N ATOM 396 C2 A C 118 32.441 20.453 9.897 1.00 23.78 C ATOM 397 N3 A C 118 31.381 21.106 10.339 1.00 22.25 N ATOM 398 C4 A C 118 31.493 22.422 10.090 1.00 26.10 C ATOM 399 1H6 A C 118 35.425 22.054 8.142 1.00 0.00 H ATOM 400 2H6 A C 118 34.786 23.697 8.218 1.00 0.00 H ATOM 401 P T C 119 26.281 25.184 13.330 1.00 29.41 P ATOM 402 O1P T C 119 26.775 26.583 13.115 1.00 23.32 O ATOM 403 O2P T C 119 24.911 24.943 13.896 1.00 28.79 O ATOM 404 O5* T C 119 27.310 24.406 14.255 1.00 22.06 O ATOM 405 C5* T C 119 26.930 23.230 14.936 1.00 18.24 C ATOM 406 C4* T C 119 27.964 22.916 15.984 1.00 20.42 C ATOM 407 O4* T C 119 29.171 22.400 15.349 1.00 20.66 O ATOM 408 C3* T C 119 28.368 24.187 16.726 1.00 19.12 C ATOM 409 O3* T C 119 28.250 24.047 18.123 1.00 22.77 O ATOM 410 C2* T C 119 29.825 24.390 16.363 1.00 22.63 C ATOM 411 C1* T C 119 30.303 23.028 15.913 1.00 19.67 C ATOM 412 N1 T C 119 31.373 23.127 14.890 1.00 20.72 N ATOM 413 C2 T C 119 32.098 22.015 14.524 1.00 24.02 C ATOM 414 O2 T C 119 31.899 20.901 14.975 1.00 29.33 O ATOM 415 N3 T C 119 33.078 22.259 13.590 1.00 20.93 N ATOM 416 C4 T C 119 33.386 23.464 12.999 1.00 19.85 C ATOM 417 O4 T C 119 34.273 23.538 12.173 1.00 24.24 O ATOM 418 C5 T C 119 32.605 24.561 13.416 1.00 19.21 C ATOM 419 C5M T C 119 32.890 25.900 12.819 1.00 17.17 C ATOM 420 C6 T C 119 31.645 24.350 14.327 1.00 21.24 C ATOM 421 H3 T C 119 33.634 21.470 13.293 1.00 0.00 H ATOM 422 P A C 120 28.033 25.346 19.045 1.00 23.89 P ATOM 423 O1P A C 120 28.799 26.453 18.468 1.00 22.51 O ATOM 424 O2P A C 120 26.584 25.516 19.283 1.00 24.59 O ATOM 425 O5* A C 120 28.689 24.860 20.400 1.00 21.66 O ATOM 426 C5* A C 120 28.518 23.494 20.800 1.00 24.40 C ATOM 427 C4* A C 120 29.735 23.021 21.556 1.00 27.60 C ATOM 428 O4* A C 120 30.805 22.656 20.645 1.00 25.57 O ATOM 429 C3* A C 120 30.258 24.167 22.408 1.00 29.03 C ATOM 430 O3* A C 120 30.562 23.801 23.738 1.00 34.79 O ATOM 431 C2* A C 120 31.493 24.640 21.683 1.00 26.09 C ATOM 432 C1* A C 120 31.958 23.413 20.923 1.00 22.82 C ATOM 433 N9 A C 120 32.549 23.836 19.655 1.00 22.33 N ATOM 434 C8 A C 120 32.475 25.118 19.188 1.00 23.08 C ATOM 435 N7 A C 120 33.102 25.305 18.057 1.00 20.72 N ATOM 436 C5 A C 120 33.616 24.060 17.761 1.00 15.01 C ATOM 437 C6 A C 120 34.358 23.637 16.712 1.00 12.64 C ATOM 438 N6 A C 120 34.711 24.448 15.739 1.00 14.47 N ATOM 439 N1 A C 120 34.731 22.352 16.675 1.00 14.35 N ATOM 440 C2 A C 120 34.348 21.556 17.681 1.00 19.38 C ATOM 441 N3 A C 120 33.627 21.848 18.752 1.00 18.46 N ATOM 442 C4 A C 120 33.280 23.144 18.735 1.00 18.14 C ATOM 443 1H6 A C 120 35.258 24.120 14.966 1.00 0.00 H ATOM 444 2H6 A C 120 34.424 25.413 15.767 1.00 0.00 H ATOM 445 P T C 121 31.003 24.954 24.747 1.00 39.12 P ATOM 446 O1P T C 121 30.295 26.169 24.273 1.00 35.80 O ATOM 447 O2P T C 121 30.851 24.499 26.170 1.00 36.64 O ATOM 448 O5* T C 121 32.525 25.182 24.343 1.00 34.43 O ATOM 449 C5* T C 121 33.428 24.091 24.324 1.00 31.48 C ATOM 450 C4* T C 121 34.833 24.611 24.441 1.00 26.66 C ATOM 451 O4* T C 121 35.380 24.754 23.108 1.00 25.35 O ATOM 452 C3* T C 121 34.805 26.002 25.058 1.00 26.01 C ATOM 453 O3* T C 121 35.683 26.154 26.157 1.00 26.99 O ATOM 454 C2* T C 121 35.166 26.926 23.915 1.00 27.54 C ATOM 455 C1* T C 121 35.905 26.043 22.930 1.00 24.05 C ATOM 456 N1 T C 121 35.664 26.459 21.535 1.00 21.74 N ATOM 457 C2 T C 121 36.396 25.906 20.537 1.00 20.39 C ATOM 458 O2 T C 121 37.231 25.062 20.728 1.00 21.72 O ATOM 459 N3 T C 121 36.118 26.394 19.288 1.00 23.84 N ATOM 460 C4 T C 121 35.188 27.369 18.950 1.00 26.96 C ATOM 461 O4 T C 121 35.042 27.727 17.763 1.00 29.94 O ATOM 462 C5 T C 121 34.451 27.893 20.048 1.00 24.38 C ATOM 463 C5M T C 121 33.424 28.939 19.783 1.00 26.43 C ATOM 464 C6 T C 121 34.716 27.419 21.269 1.00 23.96 C ATOM 465 H3 T C 121 36.654 26.005 18.526 1.00 0.00 H ATOM 466 P A C 122 35.493 27.416 27.134 1.00 32.51 P ATOM 467 O1P A C 122 34.261 28.147 26.755 1.00 32.60 O ATOM 468 O2P A C 122 35.678 26.969 28.539 1.00 30.65 O ATOM 469 O5* A C 122 36.708 28.366 26.763 1.00 32.71 O ATOM 470 C5* A C 122 38.024 27.862 26.854 1.00 36.15 C ATOM 471 C4* A C 122 38.990 28.819 26.214 1.00 34.99 C ATOM 472 O4* A C 122 38.812 28.883 24.780 1.00 29.54 O ATOM 473 C3* A C 122 38.889 30.255 26.716 1.00 36.66 C ATOM 474 O3* A C 122 40.233 30.711 26.846 1.00 39.66 O ATOM 475 C2* A C 122 38.195 30.957 25.555 1.00 32.32 C ATOM 476 C1* A C 122 38.825 30.235 24.401 1.00 29.23 C ATOM 477 N9 A C 122 38.159 30.324 23.120 1.00 29.48 N ATOM 478 C8 A C 122 36.835 30.209 22.811 1.00 30.23 C ATOM 479 N7 A C 122 36.584 30.306 21.528 1.00 27.79 N ATOM 480 C5 A C 122 37.827 30.506 20.963 1.00 25.95 C ATOM 481 C6 A C 122 38.240 30.677 19.650 1.00 25.68 C ATOM 482 N6 A C 122 37.406 30.680 18.616 1.00 27.36 N ATOM 483 N1 A C 122 39.555 30.847 19.424 1.00 26.92 N ATOM 484 C2 A C 122 40.388 30.848 20.467 1.00 30.18 C ATOM 485 N3 A C 122 40.121 30.700 21.753 1.00 30.45 N ATOM 486 C4 A C 122 38.808 30.527 21.933 1.00 28.75 C ATOM 487 1H6 A C 122 36.418 30.556 18.756 1.00 0.00 H ATOM 488 2H6 A C 122 37.762 30.819 17.692 1.00 0.00 H ATOM 489 P C C 123 40.632 31.816 27.942 1.00 37.71 P ATOM 490 O1P C C 123 39.489 32.672 28.352 1.00 42.33 O ATOM 491 O2P C C 123 41.412 31.084 28.962 1.00 42.19 O ATOM 492 O5* C C 123 41.582 32.717 27.071 1.00 30.93 O ATOM 493 C5* C C 123 41.501 32.582 25.682 1.00 28.69 C ATOM 494 C4* C C 123 42.754 33.096 25.043 1.00 31.99 C ATOM 495 O4* C C 123 42.524 32.956 23.627 1.00 37.30 O ATOM 496 C3* C C 123 42.906 34.580 25.316 1.00 32.49 C ATOM 497 O3* C C 123 44.253 34.980 25.452 1.00 34.56 O ATOM 498 C2* C C 123 42.250 35.246 24.133 1.00 35.39 C ATOM 499 C1* C C 123 42.214 34.198 23.032 1.00 34.30 C ATOM 500 N1 C C 123 40.851 34.121 22.469 1.00 32.54 N ATOM 501 C2 C C 123 40.681 34.160 21.085 1.00 32.54 C ATOM 502 O2 C C 123 41.681 34.216 20.354 1.00 30.99 O ATOM 503 N3 C C 123 39.432 34.142 20.572 1.00 31.19 N ATOM 504 C4 C C 123 38.378 34.086 21.389 1.00 31.69 C ATOM 505 N4 C C 123 37.169 34.078 20.839 1.00 30.65 N ATOM 506 C5 C C 123 38.523 34.036 22.808 1.00 30.82 C ATOM 507 C6 C C 123 39.763 34.048 23.297 1.00 31.27 C ATOM 508 1H4 C C 123 36.340 34.022 21.415 1.00 0.00 H ATOM 509 2H4 C C 123 37.093 34.098 19.832 1.00 0.00 H ATOM 510 P G C 124 44.574 36.464 25.965 1.00 34.23 P ATOM 511 O1P G C 124 43.301 37.161 26.253 1.00 37.81 O ATOM 512 O2P G C 124 45.594 36.352 27.036 1.00 36.30 O ATOM 513 O5* G C 124 45.146 37.182 24.661 1.00 34.05 O ATOM 514 C5* G C 124 46.152 36.565 23.849 1.00 33.74 C ATOM 515 C4* G C 124 46.421 37.402 22.620 1.00 30.32 C ATOM 516 O4* G C 124 45.324 37.246 21.696 1.00 31.24 O ATOM 517 C3* G C 124 46.512 38.897 22.889 1.00 28.51 C ATOM 518 O3* G C 124 47.130 39.490 21.776 1.00 30.26 O ATOM 519 C2* G C 124 45.064 39.336 22.755 1.00 30.74 C ATOM 520 C1* G C 124 44.529 38.428 21.654 1.00 28.52 C ATOM 521 N9 G C 124 43.139 38.010 21.821 1.00 26.42 N ATOM 522 C8 G C 124 42.523 37.668 22.992 1.00 28.13 C ATOM 523 N7 G C 124 41.276 37.313 22.829 1.00 27.20 N ATOM 524 C5 G C 124 41.064 37.427 21.471 1.00 25.87 C ATOM 525 C6 G C 124 39.915 37.183 20.720 1.00 30.94 C ATOM 526 O6 G C 124 38.820 36.799 21.112 1.00 38.01 O ATOM 527 N1 G C 124 40.117 37.431 19.376 1.00 31.49 N ATOM 528 C2 G C 124 41.289 37.865 18.836 1.00 32.28 C ATOM 529 N2 G C 124 41.309 38.050 17.513 1.00 36.21 N ATOM 530 N3 G C 124 42.375 38.102 19.534 1.00 31.07 N ATOM 531 C4 G C 124 42.194 37.863 20.836 1.00 25.85 C ATOM 532 H1 G C 124 39.342 37.286 18.744 1.00 0.00 H ATOM 533 1H2 G C 124 42.161 38.363 17.068 1.00 0.00 H ATOM 534 2H2 G C 124 40.486 37.875 16.951 1.00 0.00 H ATOM 535 H3T G C 124 47.761 38.855 21.426 1.00 0.00 H TER 536 G C 124 END