Browse entries in the PDBbind-CN Database
HEADER 4AV0_COMPLEX COMPND 4AV0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 158 PHE ALA CYS LYS THR ALA ASN GLY THR ALA ILE PRO ILE SEQRES 2 A 158 GLY GLY GLY SER ALA ASN VAL TYR VAL ASN LEU ALA PRO SEQRES 3 A 158 VAL VAL ASN VAL GLY GLN ASN LEU VAL VAL ASP LEU SER SEQRES 4 A 158 THR GLN ILE PHE CYS HIS ASN ASP TYR PRO GLU THR ILE SEQRES 5 A 158 THR ASP TYR VAL THR LEU GLN ARG GLY SER ALA TYR GLY SEQRES 6 A 158 GLY VAL LEU SER ASN PHE SER GLY THR VAL LYS TYR SER SEQRES 7 A 158 GLY SER SER TYR PRO PHE PRO THR THR SER GLU THR PRO SEQRES 8 A 158 ARG VAL VAL TYR ASN SER ARG THR ASP LYS PRO TRP PRO SEQRES 9 A 158 VAL ALA LEU TYR LEU THR PRO VAL SER SER ALA GLY GLY SEQRES 10 A 158 VAL ALA ILE LYS ALA GLY SER LEU ILE ALA VAL LEU ILE SEQRES 11 A 158 LEU ARG GLN THR ASN ASN TYR ASN SER ASP ASP PHE GLN SEQRES 12 A 158 PHE VAL TRP ASN ILE TYR ALA ASN ASN ASP VAL VAL VAL SEQRES 13 A 158 PRO THR HET NI A 1 1 HET HNV A 348 43 SSBOND 1 CYS A 3 CYS A 44 ATOM 1 N PHE A 1 -13.475 59.154 22.538 1.00 23.26 N ATOM 2 CA PHE A 1 -12.880 57.859 22.182 1.00 22.38 C ATOM 3 C PHE A 1 -11.776 57.475 23.149 1.00 19.57 C ATOM 4 O PHE A 1 -10.836 58.237 23.366 1.00 18.75 O ATOM 5 CB PHE A 1 -12.273 57.905 20.790 1.00 21.06 C ATOM 6 CG PHE A 1 -11.746 56.577 20.340 1.00 19.95 C ATOM 7 CD1 PHE A 1 -12.572 55.677 19.715 1.00 18.57 C ATOM 8 CD2 PHE A 1 -10.425 56.219 20.577 1.00 18.18 C ATOM 9 CE1 PHE A 1 -12.092 54.451 19.315 1.00 19.55 C ATOM 10 CE2 PHE A 1 -9.948 54.973 20.164 1.00 18.83 C ATOM 11 CZ PHE A 1 -10.782 54.096 19.558 1.00 17.13 C ATOM 12 HA PHE A 1 -13.685 57.125 22.223 1.00 0.00 H ATOM 13 HB2 PHE A 1 -13.039 58.232 20.087 1.00 0.00 H ATOM 14 HB3 PHE A 1 -11.453 58.623 20.791 1.00 0.00 H ATOM 15 HD2 PHE A 1 -9.758 56.913 21.087 1.00 0.00 H ATOM 16 HE2 PHE A 1 -8.904 54.707 20.330 1.00 0.00 H ATOM 17 HZ PHE A 1 -10.419 53.112 19.263 1.00 0.00 H ATOM 18 HE1 PHE A 1 -12.754 53.754 18.801 1.00 0.00 H ATOM 19 HD1 PHE A 1 -13.615 55.935 19.534 1.00 0.00 H ATOM 20 HN3 PHE A 1 -12.741 59.890 22.512 1.00 0.00 H ATOM 21 HN2 PHE A 1 -13.878 59.098 23.495 1.00 0.00 H ATOM 22 HN1 PHE A 1 -14.226 59.388 21.858 1.00 0.00 H ATOM 23 N ALA A 2 -11.892 56.275 23.706 1.00 19.44 N ATOM 24 CA ALA A 2 -10.868 55.734 24.577 1.00 20.72 C ATOM 25 C ALA A 2 -10.932 54.201 24.520 1.00 21.87 C ATOM 26 O ALA A 2 -11.902 53.624 24.036 1.00 22.13 O ATOM 27 CB ALA A 2 -11.073 56.238 26.015 1.00 20.00 C ATOM 28 HA ALA A 2 -9.884 56.066 24.245 1.00 0.00 H ATOM 29 HB1 ALA A 2 -11.015 57.326 26.029 1.00 0.00 H ATOM 30 HB2 ALA A 2 -12.052 55.920 26.374 1.00 0.00 H ATOM 31 HB3 ALA A 2 -10.297 55.824 26.658 1.00 0.00 H ATOM 32 H ALA A 2 -12.742 55.708 23.512 1.00 0.00 H ATOM 33 N CYS A 3 -9.888 53.563 25.036 1.00 22.83 N ATOM 34 CA CYS A 3 -9.776 52.110 25.024 1.00 22.67 C ATOM 35 C CYS A 3 -9.345 51.564 26.362 1.00 23.01 C ATOM 36 O CYS A 3 -8.718 52.270 27.175 1.00 24.50 O ATOM 37 CB CYS A 3 -8.750 51.676 23.988 1.00 21.83 C ATOM 38 SG CYS A 3 -9.311 51.904 22.339 1.00 20.64 S ATOM 39 HA CYS A 3 -10.765 51.719 24.784 1.00 0.00 H ATOM 40 HB2 CYS A 3 -8.528 50.619 24.138 1.00 0.00 H ATOM 41 HB3 CYS A 3 -7.841 52.260 24.131 1.00 0.00 H ATOM 42 H CYS A 3 -9.122 54.121 25.465 1.00 0.00 H ATOM 43 N LYS A 4 -9.641 50.299 26.579 1.00 23.55 N ATOM 44 CA LYS A 4 -9.222 49.641 27.797 1.00 24.97 C ATOM 45 C LYS A 4 -8.942 48.185 27.455 1.00 26.37 C ATOM 46 O LYS A 4 -9.346 47.708 26.382 1.00 22.06 O ATOM 47 CB LYS A 4 -10.331 49.713 28.814 1.00 24.81 C ATOM 48 CG LYS A 4 -11.490 48.850 28.441 1.00 27.29 C ATOM 49 CD LYS A 4 -12.618 48.934 29.475 1.00 39.91 C ATOM 50 CE LYS A 4 -13.759 47.983 29.121 1.00 47.57 C ATOM 51 NZ LYS A 4 -14.848 47.907 30.156 1.00 60.26 N ATOM 52 HA LYS A 4 -8.334 50.120 28.210 1.00 0.00 H ATOM 53 HB2 LYS A 4 -9.945 49.386 29.779 1.00 0.00 H ATOM 54 HB3 LYS A 4 -10.671 50.746 28.891 1.00 0.00 H ATOM 55 HG2 LYS A 4 -11.873 49.173 27.473 1.00 0.00 H ATOM 56 HG3 LYS A 4 -11.152 47.816 28.370 1.00 0.00 H ATOM 57 HD2 LYS A 4 -12.223 48.668 30.456 1.00 0.00 H ATOM 58 HD3 LYS A 4 -13.000 49.954 29.503 1.00 0.00 H ATOM 59 HE2 LYS A 4 -13.343 46.984 28.990 1.00 0.00 H ATOM 60 HE3 LYS A 4 -14.203 48.316 28.183 1.00 0.00 H ATOM 61 HZ1 LYS A 4 -14.446 47.578 31.057 1.00 0.00 H ATOM 62 HZ2 LYS A 4 -15.267 48.850 30.286 1.00 0.00 H ATOM 63 HZ3 LYS A 4 -15.581 47.241 29.838 1.00 0.00 H ATOM 64 H LYS A 4 -10.182 49.768 25.867 1.00 0.00 H ATOM 65 N THR A 5 -8.247 47.488 28.354 1.00 25.00 N ATOM 66 CA THR A 5 -8.009 46.065 28.202 1.00 26.10 C ATOM 67 C THR A 5 -8.823 45.289 29.226 1.00 26.93 C ATOM 68 O THR A 5 -9.134 45.819 30.274 1.00 29.57 O ATOM 69 CB THR A 5 -6.547 45.761 28.399 1.00 27.44 C ATOM 70 OG1 THR A 5 -6.185 46.081 29.734 1.00 29.34 O ATOM 71 CG2 THR A 5 -5.719 46.602 27.508 1.00 27.51 C ATOM 72 HA THR A 5 -8.309 45.768 27.197 1.00 0.00 H ATOM 73 HB THR A 5 -6.382 44.706 28.180 1.00 0.00 H ATOM 74 HG1 THR A 5 -5.225 45.884 29.871 1.00 0.00 H ATOM 75 HG23 THR A 5 -5.969 46.384 26.470 1.00 0.00 H ATOM 76 HG21 THR A 5 -5.915 47.654 27.718 1.00 0.00 H ATOM 77 HG22 THR A 5 -4.665 46.386 27.682 1.00 0.00 H ATOM 78 H THR A 5 -7.865 47.978 29.188 1.00 0.00 H ATOM 79 N ALA A 6 -9.170 44.042 28.923 1.00 25.50 N ATOM 80 CA ALA A 6 -9.830 43.124 29.870 1.00 28.49 C ATOM 81 C ALA A 6 -9.067 43.004 31.189 1.00 33.24 C ATOM 82 O ALA A 6 -9.639 42.751 32.251 1.00 37.47 O ATOM 83 CB ALA A 6 -9.929 41.739 29.227 1.00 26.25 C ATOM 84 HA ALA A 6 -10.817 43.528 30.093 1.00 0.00 H ATOM 85 HB1 ALA A 6 -10.513 41.807 28.309 1.00 0.00 H ATOM 86 HB2 ALA A 6 -8.928 41.375 28.996 1.00 0.00 H ATOM 87 HB3 ALA A 6 -10.416 41.052 29.919 1.00 0.00 H ATOM 88 H ALA A 6 -8.965 43.694 27.965 1.00 0.00 H ATOM 89 N ASN A 7 -7.755 43.186 31.081 1.00 39.65 N ATOM 90 CA ASN A 7 -6.768 43.019 32.163 1.00 44.63 C ATOM 91 C ASN A 7 -7.212 43.550 33.560 1.00 46.92 C ATOM 92 O ASN A 7 -7.485 42.738 34.442 1.00 57.16 O ATOM 93 CB ASN A 7 -5.389 43.543 31.628 1.00 47.82 C ATOM 94 CG ASN A 7 -4.425 44.047 32.721 1.00 53.81 C ATOM 95 OD1 ASN A 7 -4.576 45.166 33.230 1.00 50.35 O ATOM 96 ND2 ASN A 7 -3.376 43.253 33.012 1.00 53.95 N ATOM 97 HA ASN A 7 -6.666 41.961 32.403 1.00 0.00 H ATOM 98 HB2 ASN A 7 -4.900 42.729 31.093 1.00 0.00 H ATOM 99 HB3 ASN A 7 -5.582 44.365 30.939 1.00 0.00 H ATOM 100 HD22 ASN A 7 -3.289 42.320 32.561 1.00 0.00 H ATOM 101 HD21 ASN A 7 -2.653 43.573 33.688 1.00 0.00 H ATOM 102 H ASN A 7 -7.392 43.472 30.149 1.00 0.00 H ATOM 103 N GLY A 8 -7.380 44.854 33.755 1.00 40.44 N ATOM 104 CA GLY A 8 -7.314 45.813 32.692 1.00 39.38 C ATOM 105 C GLY A 8 -6.686 47.139 33.085 1.00 41.84 C ATOM 106 O GLY A 8 -6.775 47.582 34.237 1.00 44.72 O ATOM 107 HA3 GLY A 8 -8.328 46.006 32.342 1.00 0.00 H ATOM 108 HA2 GLY A 8 -6.726 45.384 31.881 1.00 0.00 H ATOM 109 H GLY A 8 -7.567 45.193 34.720 1.00 0.00 H ATOM 110 N THR A 9 -6.030 47.751 32.102 1.00 36.65 N ATOM 111 CA THR A 9 -5.594 49.111 32.171 1.00 32.84 C ATOM 112 C THR A 9 -6.316 49.893 31.076 1.00 30.89 C ATOM 113 O THR A 9 -6.940 49.318 30.200 1.00 28.10 O ATOM 114 CB THR A 9 -4.087 49.219 31.943 1.00 34.16 C ATOM 115 OG1 THR A 9 -3.654 50.549 32.271 1.00 35.62 O ATOM 116 CG2 THR A 9 -3.726 48.924 30.480 1.00 31.67 C ATOM 117 HA THR A 9 -5.820 49.509 33.160 1.00 0.00 H ATOM 118 HB THR A 9 -3.590 48.486 32.579 1.00 0.00 H ATOM 119 HG1 THR A 9 -2.678 50.623 32.124 1.00 0.00 H ATOM 120 HG23 THR A 9 -4.051 47.916 30.223 1.00 0.00 H ATOM 121 HG21 THR A 9 -4.225 49.645 29.832 1.00 0.00 H ATOM 122 HG22 THR A 9 -2.647 49.003 30.350 1.00 0.00 H ATOM 123 H THR A 9 -5.823 47.211 31.237 1.00 0.00 H ATOM 124 N ALA A 10 -6.205 51.210 31.105 1.00 28.34 N ATOM 125 CA ALA A 10 -6.895 52.028 30.131 1.00 26.61 C ATOM 126 C ALA A 10 -5.945 53.040 29.476 1.00 26.44 C ATOM 127 O ALA A 10 -4.900 53.415 30.051 1.00 25.65 O ATOM 128 CB ALA A 10 -8.072 52.716 30.790 1.00 24.50 C ATOM 129 HA ALA A 10 -7.268 51.386 29.333 1.00 0.00 H ATOM 130 HB1 ALA A 10 -8.757 51.965 31.184 1.00 0.00 H ATOM 131 HB2 ALA A 10 -7.714 53.345 31.605 1.00 0.00 H ATOM 132 HB3 ALA A 10 -8.590 53.331 30.054 1.00 0.00 H ATOM 133 H ALA A 10 -5.617 51.662 31.834 1.00 0.00 H ATOM 134 N ILE A 11 -6.282 53.429 28.246 1.00 23.39 N ATOM 135 CA ILE A 11 -5.680 54.584 27.612 1.00 21.84 C ATOM 136 C ILE A 11 -6.828 55.571 27.444 1.00 22.83 C ATOM 137 O ILE A 11 -7.805 55.273 26.784 1.00 21.83 O ATOM 138 CB ILE A 11 -5.072 54.268 26.243 1.00 20.93 C ATOM 139 CG1 ILE A 11 -3.973 53.204 26.360 1.00 19.81 C ATOM 140 CG2 ILE A 11 -4.463 55.535 25.653 1.00 20.38 C ATOM 141 CD1 ILE A 11 -3.313 52.822 25.024 1.00 17.48 C ATOM 142 HA ILE A 11 -4.856 54.964 28.217 1.00 0.00 H ATOM 143 HB ILE A 11 -5.865 53.888 25.599 1.00 0.00 H ATOM 144 HG12 ILE A 11 -3.199 53.585 27.026 1.00 0.00 H ATOM 145 HG13 ILE A 11 -4.413 52.305 26.792 1.00 0.00 H ATOM 146 HD11 ILE A 11 -4.069 52.425 24.347 1.00 0.00 H ATOM 147 HD12 ILE A 11 -2.854 53.706 24.581 1.00 0.00 H ATOM 148 HD13 ILE A 11 -2.549 52.065 25.201 1.00 0.00 H ATOM 149 HG21 ILE A 11 -5.240 56.292 25.541 1.00 0.00 H ATOM 150 HG22 ILE A 11 -3.685 55.907 26.320 1.00 0.00 H ATOM 151 HG23 ILE A 11 -4.030 55.309 24.678 1.00 0.00 H ATOM 152 H ILE A 11 -7.000 52.886 27.725 1.00 0.00 H ATOM 153 N PRO A 12 -6.718 56.753 28.048 1.00 22.64 N ATOM 154 CA PRO A 12 -7.841 57.694 28.056 1.00 22.94 C ATOM 155 C PRO A 12 -7.950 58.552 26.787 1.00 21.37 C ATOM 156 O PRO A 12 -7.147 58.411 25.853 1.00 17.93 O ATOM 157 CB PRO A 12 -7.494 58.587 29.243 1.00 24.50 C ATOM 158 CG PRO A 12 -6.008 58.692 29.167 1.00 23.00 C ATOM 159 CD PRO A 12 -5.541 57.301 28.744 1.00 24.59 C ATOM 160 HA PRO A 12 -8.797 57.174 28.112 1.00 0.00 H ATOM 161 HD3 PRO A 12 -4.683 57.362 28.074 1.00 0.00 H ATOM 162 HD2 PRO A 12 -5.281 56.694 29.611 1.00 0.00 H ATOM 163 HG3 PRO A 12 -5.591 58.959 30.138 1.00 0.00 H ATOM 164 HG2 PRO A 12 -5.712 59.438 28.429 1.00 0.00 H ATOM 165 HB2 PRO A 12 -7.961 59.567 29.145 1.00 0.00 H ATOM 166 HB3 PRO A 12 -7.806 58.129 30.182 1.00 0.00 H ATOM 167 N ILE A 13 -8.938 59.445 26.771 1.00 21.64 N ATOM 168 CA ILE A 13 -9.134 60.365 25.639 1.00 20.66 C ATOM 169 C ILE A 13 -7.819 61.077 25.308 1.00 21.33 C ATOM 170 O ILE A 13 -7.042 61.442 26.209 1.00 21.52 O ATOM 171 CB ILE A 13 -10.222 61.396 25.957 1.00 20.99 C ATOM 172 CG1 ILE A 13 -11.602 60.747 25.859 1.00 22.41 C ATOM 173 CG2 ILE A 13 -10.120 62.600 25.045 1.00 21.25 C ATOM 174 CD1 ILE A 13 -12.728 61.592 26.506 1.00 26.80 C ATOM 175 HA ILE A 13 -9.454 59.783 24.775 1.00 0.00 H ATOM 176 HB ILE A 13 -10.075 61.749 26.978 1.00 0.00 H ATOM 177 HG12 ILE A 13 -11.841 60.601 24.806 1.00 0.00 H ATOM 178 HG13 ILE A 13 -11.565 59.779 26.359 1.00 0.00 H ATOM 179 HD11 ILE A 13 -12.509 61.738 27.564 1.00 0.00 H ATOM 180 HD12 ILE A 13 -12.785 62.560 26.009 1.00 0.00 H ATOM 181 HD13 ILE A 13 -13.679 61.070 26.399 1.00 0.00 H ATOM 182 HG21 ILE A 13 -9.146 63.071 25.175 1.00 0.00 H ATOM 183 HG22 ILE A 13 -10.235 62.280 24.009 1.00 0.00 H ATOM 184 HG23 ILE A 13 -10.906 63.312 25.297 1.00 0.00 H ATOM 185 H ILE A 13 -9.589 59.494 27.581 1.00 0.00 H ATOM 186 N GLY A 14 -7.547 61.253 24.018 1.00 18.88 N ATOM 187 CA GLY A 14 -6.328 61.927 23.590 1.00 19.41 C ATOM 188 C GLY A 14 -5.144 60.979 23.373 1.00 18.31 C ATOM 189 O GLY A 14 -4.085 61.389 22.885 1.00 15.98 O ATOM 190 HA3 GLY A 14 -6.051 62.655 24.352 1.00 0.00 H ATOM 191 HA2 GLY A 14 -6.531 62.444 22.652 1.00 0.00 H ATOM 192 H GLY A 14 -8.216 60.904 23.302 1.00 0.00 H ATOM 193 N GLY A 15 -5.315 59.713 23.749 1.00 18.41 N ATOM 194 CA GLY A 15 -4.305 58.706 23.456 1.00 17.54 C ATOM 195 C GLY A 15 -3.215 58.508 24.504 1.00 19.33 C ATOM 196 O GLY A 15 -3.256 59.058 25.603 1.00 19.09 O ATOM 197 HA3 GLY A 15 -3.819 58.987 22.522 1.00 0.00 H ATOM 198 HA2 GLY A 15 -4.816 57.752 23.326 1.00 0.00 H ATOM 199 H GLY A 15 -6.180 59.440 24.258 1.00 0.00 H ATOM 200 N GLY A 16 -2.223 57.704 24.151 1.00 17.77 N ATOM 201 CA GLY A 16 -1.223 57.285 25.098 1.00 18.50 C ATOM 202 C GLY A 16 -0.785 55.862 24.791 1.00 18.26 C ATOM 203 O GLY A 16 -0.872 55.409 23.651 1.00 16.64 O ATOM 204 HA3 GLY A 16 -1.638 57.327 26.105 1.00 0.00 H ATOM 205 HA2 GLY A 16 -0.362 57.950 25.034 1.00 0.00 H ATOM 206 H GLY A 16 -2.165 57.368 23.168 1.00 0.00 H ATOM 207 N SER A 17 -0.333 55.149 25.816 1.00 18.62 N ATOM 208 CA SER A 17 0.328 53.862 25.649 1.00 18.60 C ATOM 209 C SER A 17 -0.061 52.930 26.790 1.00 18.04 C ATOM 210 O SER A 17 -0.343 53.396 27.891 1.00 17.49 O ATOM 211 CB SER A 17 1.849 54.083 25.645 1.00 19.94 C ATOM 212 OG SER A 17 2.572 52.870 25.521 1.00 26.64 O ATOM 213 HA SER A 17 0.021 53.407 24.707 1.00 0.00 H ATOM 214 HB2 SER A 17 2.135 54.567 26.579 1.00 0.00 H ATOM 215 HB3 SER A 17 2.106 54.731 24.807 1.00 0.00 H ATOM 216 HG SER A 17 3.543 53.064 25.523 1.00 0.00 H ATOM 217 H SER A 17 -0.456 55.525 26.778 1.00 0.00 H ATOM 218 N ALA A 18 -0.029 51.633 26.542 1.00 16.95 N ATOM 219 CA ALA A 18 -0.315 50.664 27.593 1.00 16.84 C ATOM 220 C ALA A 18 0.364 49.339 27.251 1.00 17.22 C ATOM 221 O ALA A 18 0.634 49.072 26.089 1.00 15.42 O ATOM 222 CB ALA A 18 -1.779 50.484 27.756 1.00 16.49 C ATOM 223 HA ALA A 18 0.078 51.032 28.541 1.00 0.00 H ATOM 224 HB1 ALA A 18 -2.234 51.438 28.022 1.00 0.00 H ATOM 225 HB2 ALA A 18 -2.206 50.125 26.820 1.00 0.00 H ATOM 226 HB3 ALA A 18 -1.969 49.757 28.545 1.00 0.00 H ATOM 227 H ALA A 18 0.203 51.299 25.585 1.00 0.00 H ATOM 228 N ASN A 19 0.674 48.554 28.283 1.00 18.11 N ATOM 229 CA ASN A 19 1.293 47.233 28.147 1.00 18.08 C ATOM 230 C ASN A 19 0.242 46.106 28.241 1.00 20.56 C ATOM 231 O ASN A 19 -0.669 46.151 29.080 1.00 21.56 O ATOM 232 CB ASN A 19 2.402 47.074 29.176 1.00 18.05 C ATOM 233 CG ASN A 19 3.424 48.204 29.092 1.00 20.75 C ATOM 234 OD1 ASN A 19 3.970 48.486 28.020 1.00 20.72 O ATOM 235 ND2 ASN A 19 3.665 48.884 30.212 1.00 19.55 N ATOM 236 HA ASN A 19 1.740 47.153 27.156 1.00 0.00 H ATOM 237 HB2 ASN A 19 1.960 47.071 30.173 1.00 0.00 H ATOM 238 HB3 ASN A 19 2.910 46.125 29.003 1.00 0.00 H ATOM 239 HD22 ASN A 19 3.186 48.617 31.096 1.00 0.00 H ATOM 240 HD21 ASN A 19 4.332 49.682 30.203 1.00 0.00 H ATOM 241 H ASN A 19 0.464 48.900 29.241 1.00 0.00 H ATOM 242 N VAL A 20 0.330 45.138 27.323 1.00 18.53 N ATOM 243 CA VAL A 20 -0.624 44.040 27.256 1.00 17.79 C ATOM 244 C VAL A 20 0.170 42.766 27.229 1.00 18.83 C ATOM 245 O VAL A 20 1.092 42.638 26.408 1.00 17.22 O ATOM 246 CB VAL A 20 -1.465 44.050 25.982 1.00 19.81 C ATOM 247 CG1 VAL A 20 -2.487 42.917 26.039 1.00 20.75 C ATOM 248 CG2 VAL A 20 -2.137 45.391 25.787 1.00 18.36 C ATOM 249 HA VAL A 20 -1.295 44.133 28.110 1.00 0.00 H ATOM 250 HB VAL A 20 -0.814 43.890 25.122 1.00 0.00 H ATOM 251 HG11 VAL A 20 -1.966 41.963 26.124 1.00 0.00 H ATOM 252 HG12 VAL A 20 -3.135 43.057 26.904 1.00 0.00 H ATOM 253 HG13 VAL A 20 -3.087 42.925 25.129 1.00 0.00 H ATOM 254 HG21 VAL A 20 -2.787 45.597 26.637 1.00 0.00 H ATOM 255 HG22 VAL A 20 -1.377 46.169 25.711 1.00 0.00 H ATOM 256 HG23 VAL A 20 -2.729 45.370 24.872 1.00 0.00 H ATOM 257 H VAL A 20 1.107 45.170 26.633 1.00 0.00 H ATOM 258 N TYR A 21 -0.182 41.829 28.119 1.00 18.70 N ATOM 259 CA TYR A 21 0.390 40.484 28.144 1.00 19.06 C ATOM 260 C TYR A 21 -0.490 39.483 27.411 1.00 20.65 C ATOM 261 O TYR A 21 -1.704 39.524 27.513 1.00 22.60 O ATOM 262 CB TYR A 21 0.624 40.027 29.604 1.00 22.39 C ATOM 263 CG TYR A 21 1.799 40.734 30.184 1.00 20.82 C ATOM 264 CD1 TYR A 21 1.668 42.033 30.650 1.00 19.45 C ATOM 265 CD2 TYR A 21 3.066 40.149 30.182 1.00 20.18 C ATOM 266 CE1 TYR A 21 2.725 42.719 31.129 1.00 17.51 C ATOM 267 CE2 TYR A 21 4.160 40.844 30.673 1.00 20.85 C ATOM 268 CZ TYR A 21 3.967 42.147 31.154 1.00 19.18 C ATOM 269 OH TYR A 21 5.020 42.876 31.664 1.00 19.05 O ATOM 270 HA TYR A 21 1.347 40.523 27.624 1.00 0.00 H ATOM 271 HB3 TYR A 21 0.806 38.952 29.620 1.00 0.00 H ATOM 272 HB2 TYR A 21 -0.261 40.253 30.198 1.00 0.00 H ATOM 273 HD2 TYR A 21 3.196 39.140 29.792 1.00 0.00 H ATOM 274 HE2 TYR A 21 5.150 40.387 30.685 1.00 0.00 H ATOM 275 HE1 TYR A 21 2.589 43.735 31.498 1.00 0.00 H ATOM 276 HD1 TYR A 21 0.688 42.510 30.629 1.00 0.00 H ATOM 277 HH TYR A 21 5.712 42.987 30.965 1.00 0.00 H ATOM 278 H TYR A 21 -0.901 42.071 28.830 1.00 0.00 H ATOM 279 N VAL A 22 0.120 38.583 26.664 1.00 19.90 N ATOM 280 CA VAL A 22 -0.652 37.550 25.986 1.00 20.36 C ATOM 281 C VAL A 22 -0.126 36.158 26.306 1.00 20.85 C ATOM 282 O VAL A 22 1.070 35.959 26.470 1.00 19.82 O ATOM 283 CB VAL A 22 -0.626 37.749 24.446 1.00 21.09 C ATOM 284 CG1 VAL A 22 -1.239 39.091 24.063 1.00 17.05 C ATOM 285 CG2 VAL A 22 0.785 37.652 23.927 1.00 18.87 C ATOM 286 HA VAL A 22 -1.676 37.639 26.349 1.00 0.00 H ATOM 287 HB VAL A 22 -1.221 36.958 23.991 1.00 0.00 H ATOM 288 HG11 VAL A 22 -2.273 39.127 24.405 1.00 0.00 H ATOM 289 HG12 VAL A 22 -0.671 39.895 24.531 1.00 0.00 H ATOM 290 HG13 VAL A 22 -1.209 39.207 22.980 1.00 0.00 H ATOM 291 HG21 VAL A 22 1.397 38.423 24.395 1.00 0.00 H ATOM 292 HG22 VAL A 22 1.192 36.669 24.165 1.00 0.00 H ATOM 293 HG23 VAL A 22 0.784 37.794 22.846 1.00 0.00 H ATOM 294 H VAL A 22 1.154 38.611 26.559 1.00 0.00 H ATOM 295 N ASN A 23 -1.050 35.208 26.398 1.00 21.42 N ATOM 296 CA ASN A 23 -0.737 33.801 26.483 1.00 23.41 C ATOM 297 C ASN A 23 -0.405 33.244 25.110 1.00 23.20 C ATOM 298 O ASN A 23 -1.087 33.532 24.133 1.00 21.72 O ATOM 299 CB ASN A 23 -1.940 33.060 27.042 1.00 24.34 C ATOM 300 CG ASN A 23 -2.211 33.415 28.482 1.00 26.05 C ATOM 301 OD1 ASN A 23 -1.282 33.590 29.265 1.00 28.31 O ATOM 302 ND2 ASN A 23 -3.480 33.534 28.838 1.00 24.85 N ATOM 303 HA ASN A 23 0.127 33.670 27.134 1.00 0.00 H ATOM 304 HB2 ASN A 23 -2.817 33.315 26.447 1.00 0.00 H ATOM 305 HB3 ASN A 23 -1.755 31.988 26.974 1.00 0.00 H ATOM 306 HD22 ASN A 23 -4.233 33.376 28.139 1.00 0.00 H ATOM 307 HD21 ASN A 23 -3.724 33.786 29.817 1.00 0.00 H ATOM 308 H ASN A 23 -2.050 35.492 26.409 1.00 0.00 H ATOM 309 N LEU A 24 0.637 32.433 25.026 1.00 23.51 N ATOM 310 CA LEU A 24 1.074 31.938 23.719 1.00 22.59 C ATOM 311 C LEU A 24 1.174 30.434 23.824 1.00 24.59 C ATOM 312 O LEU A 24 1.578 29.950 24.873 1.00 22.72 O ATOM 313 CB LEU A 24 2.435 32.551 23.381 1.00 23.13 C ATOM 314 CG LEU A 24 2.512 34.072 23.205 1.00 21.32 C ATOM 315 CD1 LEU A 24 3.960 34.510 23.061 1.00 23.34 C ATOM 316 CD2 LEU A 24 1.788 34.487 21.986 1.00 20.21 C ATOM 317 HA LEU A 24 0.374 32.212 22.929 1.00 0.00 H ATOM 318 HB2 LEU A 24 3.121 32.282 24.184 1.00 0.00 H ATOM 319 HB3 LEU A 24 2.773 32.098 22.449 1.00 0.00 H ATOM 320 HG LEU A 24 2.062 34.534 24.084 1.00 0.00 H ATOM 321 HD21 LEU A 24 2.236 34.005 21.117 1.00 0.00 H ATOM 322 HD22 LEU A 24 0.742 34.191 22.068 1.00 0.00 H ATOM 323 HD23 LEU A 24 1.853 35.570 21.877 1.00 0.00 H ATOM 324 HD11 LEU A 24 4.515 34.225 23.955 1.00 0.00 H ATOM 325 HD12 LEU A 24 4.400 34.026 22.189 1.00 0.00 H ATOM 326 HD13 LEU A 24 4.000 35.592 22.937 1.00 0.00 H ATOM 327 H LEU A 24 1.145 32.147 25.887 1.00 0.00 H ATOM 328 N ALA A 25 0.787 29.684 22.785 1.00 24.84 N ATOM 329 CA ALA A 25 0.970 28.233 22.821 1.00 25.40 C ATOM 330 C ALA A 25 2.432 27.919 23.152 1.00 25.12 C ATOM 331 O ALA A 25 3.333 28.475 22.527 1.00 24.23 O ATOM 332 CB ALA A 25 0.576 27.592 21.491 1.00 24.51 C ATOM 333 HA ALA A 25 0.321 27.816 23.591 1.00 0.00 H ATOM 334 HB1 ALA A 25 -0.472 27.805 21.283 1.00 0.00 H ATOM 335 HB2 ALA A 25 1.197 28.001 20.694 1.00 0.00 H ATOM 336 HB3 ALA A 25 0.724 26.514 21.551 1.00 0.00 H ATOM 337 H ALA A 25 0.356 30.133 21.952 1.00 0.00 H ATOM 338 N PRO A 26 2.676 27.029 24.134 1.00 25.86 N ATOM 339 CA PRO A 26 4.052 26.799 24.615 1.00 27.83 C ATOM 340 C PRO A 26 4.947 26.052 23.628 1.00 28.18 C ATOM 341 O PRO A 26 6.158 26.107 23.779 1.00 27.49 O ATOM 342 CB PRO A 26 3.862 25.973 25.882 1.00 29.90 C ATOM 343 CG PRO A 26 2.550 25.284 25.701 1.00 29.51 C ATOM 344 CD PRO A 26 1.694 26.200 24.848 1.00 29.37 C ATOM 345 HA PRO A 26 4.564 27.749 24.768 1.00 0.00 H ATOM 346 HD3 PRO A 26 1.088 25.625 24.148 1.00 0.00 H ATOM 347 HD2 PRO A 26 1.044 26.816 25.470 1.00 0.00 H ATOM 348 HG3 PRO A 26 2.075 25.118 26.668 1.00 0.00 H ATOM 349 HG2 PRO A 26 2.693 24.327 25.199 1.00 0.00 H ATOM 350 HB2 PRO A 26 4.666 25.245 25.989 1.00 0.00 H ATOM 351 HB3 PRO A 26 3.838 26.618 26.760 1.00 0.00 H ATOM 352 N VAL A 27 4.355 25.412 22.626 1.00 27.42 N ATOM 353 CA VAL A 27 5.114 24.648 21.655 1.00 28.77 C ATOM 354 C VAL A 27 4.535 24.882 20.271 1.00 29.77 C ATOM 355 O VAL A 27 3.326 24.767 20.065 1.00 30.17 O ATOM 356 CB VAL A 27 5.094 23.139 22.007 1.00 32.11 C ATOM 357 CG1 VAL A 27 5.713 22.300 20.890 1.00 32.09 C ATOM 358 CG2 VAL A 27 5.808 22.898 23.327 1.00 31.10 C ATOM 359 HA VAL A 27 6.152 24.979 21.672 1.00 0.00 H ATOM 360 HB VAL A 27 4.055 22.827 22.112 1.00 0.00 H ATOM 361 HG11 VAL A 27 5.149 22.449 19.970 1.00 0.00 H ATOM 362 HG12 VAL A 27 6.748 22.607 20.737 1.00 0.00 H ATOM 363 HG13 VAL A 27 5.683 21.247 21.169 1.00 0.00 H ATOM 364 HG21 VAL A 27 6.842 23.232 23.245 1.00 0.00 H ATOM 365 HG22 VAL A 27 5.306 23.456 24.117 1.00 0.00 H ATOM 366 HG23 VAL A 27 5.786 21.834 23.561 1.00 0.00 H ATOM 367 H VAL A 27 3.320 25.460 22.535 1.00 0.00 H ATOM 368 N VAL A 28 5.380 25.256 19.318 1.00 29.62 N ATOM 369 CA VAL A 28 4.897 25.434 17.961 1.00 29.81 C ATOM 370 C VAL A 28 5.943 24.937 16.966 1.00 34.19 C ATOM 371 O VAL A 28 7.135 25.138 17.140 1.00 32.39 O ATOM 372 CB VAL A 28 4.481 26.901 17.675 1.00 29.96 C ATOM 373 CG1 VAL A 28 5.552 27.861 18.107 1.00 30.48 C ATOM 374 CG2 VAL A 28 4.140 27.098 16.198 1.00 33.38 C ATOM 375 HA VAL A 28 3.994 24.835 17.842 1.00 0.00 H ATOM 376 HB VAL A 28 3.585 27.111 18.259 1.00 0.00 H ATOM 377 HG11 VAL A 28 5.727 27.750 19.177 1.00 0.00 H ATOM 378 HG12 VAL A 28 6.472 27.646 17.563 1.00 0.00 H ATOM 379 HG13 VAL A 28 5.232 28.881 17.894 1.00 0.00 H ATOM 380 HG21 VAL A 28 5.012 26.857 15.590 1.00 0.00 H ATOM 381 HG22 VAL A 28 3.314 26.441 15.927 1.00 0.00 H ATOM 382 HG23 VAL A 28 3.852 28.136 16.028 1.00 0.00 H ATOM 383 H VAL A 28 6.382 25.420 19.542 1.00 0.00 H ATOM 384 N ASN A 29 5.490 24.248 15.931 1.00 36.52 N ATOM 385 CA ASN A 29 6.410 23.717 14.942 1.00 38.47 C ATOM 386 C ASN A 29 6.485 24.582 13.714 1.00 37.47 C ATOM 387 O ASN A 29 5.604 25.397 13.447 1.00 35.05 O ATOM 388 CB ASN A 29 5.998 22.299 14.541 1.00 41.00 C ATOM 389 CG ASN A 29 6.289 21.299 15.628 1.00 41.84 C ATOM 390 OD1 ASN A 29 7.443 20.904 15.836 1.00 44.96 O ATOM 391 ND2 ASN A 29 5.251 20.905 16.356 1.00 45.15 N ATOM 392 HA ASN A 29 7.398 23.700 15.402 1.00 0.00 H ATOM 393 HB2 ASN A 29 4.929 22.289 14.330 1.00 0.00 H ATOM 394 HB3 ASN A 29 6.546 22.013 13.643 1.00 0.00 H ATOM 395 HD22 ASN A 29 4.299 21.265 16.142 1.00 0.00 H ATOM 396 HD21 ASN A 29 5.390 20.236 17.140 1.00 0.00 H ATOM 397 H ASN A 29 4.468 24.086 15.826 1.00 0.00 H ATOM 398 N VAL A 30 7.557 24.400 12.961 1.00 38.63 N ATOM 399 CA VAL A 30 7.627 24.988 11.642 1.00 37.35 C ATOM 400 C VAL A 30 6.338 24.583 10.931 1.00 40.50 C ATOM 401 O VAL A 30 5.890 23.429 11.021 1.00 37.32 O ATOM 402 CB VAL A 30 8.863 24.496 10.890 1.00 38.32 C ATOM 403 CG1 VAL A 30 8.907 25.096 9.518 1.00 38.98 C ATOM 404 CG2 VAL A 30 10.130 24.858 11.678 1.00 39.01 C ATOM 405 HA VAL A 30 7.719 26.073 11.692 1.00 0.00 H ATOM 406 HB VAL A 30 8.811 23.412 10.789 1.00 0.00 H ATOM 407 HG11 VAL A 30 8.013 24.804 8.966 1.00 0.00 H ATOM 408 HG12 VAL A 30 8.947 26.182 9.599 1.00 0.00 H ATOM 409 HG13 VAL A 30 9.793 24.737 8.994 1.00 0.00 H ATOM 410 HG21 VAL A 30 10.186 25.940 11.796 1.00 0.00 H ATOM 411 HG22 VAL A 30 10.093 24.386 12.660 1.00 0.00 H ATOM 412 HG23 VAL A 30 11.007 24.504 11.136 1.00 0.00 H ATOM 413 H VAL A 30 8.352 23.832 13.319 1.00 0.00 H ATOM 414 N GLY A 31 5.704 25.550 10.279 1.00 39.83 N ATOM 415 CA GLY A 31 4.511 25.254 9.508 1.00 41.50 C ATOM 416 C GLY A 31 3.210 25.450 10.255 1.00 40.06 C ATOM 417 O GLY A 31 2.142 25.411 9.646 1.00 42.43 O ATOM 418 HA3 GLY A 31 4.564 24.214 9.186 1.00 0.00 H ATOM 419 HA2 GLY A 31 4.502 25.904 8.633 1.00 0.00 H ATOM 420 H GLY A 31 6.064 26.525 10.321 1.00 0.00 H ATOM 421 N GLN A 32 3.297 25.647 11.565 1.00 38.89 N ATOM 422 CA GLN A 32 2.133 25.969 12.384 1.00 38.15 C ATOM 423 C GLN A 32 2.117 27.455 12.751 1.00 36.06 C ATOM 424 O GLN A 32 3.161 28.109 12.779 1.00 35.88 O ATOM 425 CB GLN A 32 2.165 25.191 13.684 1.00 37.63 C ATOM 426 CG GLN A 32 2.174 23.708 13.549 1.00 42.35 C ATOM 427 CD GLN A 32 2.140 23.036 14.924 1.00 46.57 C ATOM 428 OE1 GLN A 32 3.056 23.213 15.759 1.00 41.69 O ATOM 429 NE2 GLN A 32 1.072 22.269 15.175 1.00 51.10 N ATOM 430 HA GLN A 32 1.251 25.711 11.799 1.00 0.00 H ATOM 431 HB2 GLN A 32 3.063 25.484 14.228 1.00 0.00 H ATOM 432 HB3 GLN A 32 1.285 25.470 14.263 1.00 0.00 H ATOM 433 HG2 GLN A 32 1.300 23.396 12.977 1.00 0.00 H ATOM 434 HG3 GLN A 32 3.079 23.402 13.024 1.00 0.00 H ATOM 435 HE22 GLN A 32 0.335 22.151 14.451 1.00 0.00 H ATOM 436 HE21 GLN A 32 0.979 21.791 16.094 1.00 0.00 H ATOM 437 H GLN A 32 4.227 25.569 12.024 1.00 0.00 H ATOM 438 N ASN A 33 0.930 27.965 13.062 1.00 35.18 N ATOM 439 CA ASN A 33 0.758 29.336 13.520 1.00 34.64 C ATOM 440 C ASN A 33 0.560 29.429 15.017 1.00 29.90 C ATOM 441 O ASN A 33 -0.212 28.672 15.570 1.00 32.00 O ATOM 442 CB ASN A 33 -0.481 29.942 12.863 1.00 33.70 C ATOM 443 CG ASN A 33 -0.207 30.438 11.474 1.00 38.51 C ATOM 444 OD1 ASN A 33 0.947 30.724 11.135 1.00 38.73 O ATOM 445 ND2 ASN A 33 -1.259 30.550 10.648 1.00 39.55 N ATOM 446 HA ASN A 33 1.669 29.871 13.249 1.00 0.00 H ATOM 447 HB2 ASN A 33 -1.260 29.181 12.816 1.00 0.00 H ATOM 448 HB3 ASN A 33 -0.827 30.778 13.471 1.00 0.00 H ATOM 449 HD22 ASN A 33 -2.211 30.296 10.981 1.00 0.00 H ATOM 450 HD21 ASN A 33 -1.122 30.890 9.675 1.00 0.00 H ATOM 451 H ASN A 33 0.089 27.360 12.975 1.00 0.00 H ATOM 452 N LEU A 34 1.265 30.358 15.655 1.00 29.89 N ATOM 453 CA LEU A 34 0.784 31.010 16.876 1.00 28.75 C ATOM 454 C LEU A 34 -0.279 32.038 16.467 1.00 28.59 C ATOM 455 O LEU A 34 -0.069 32.856 15.546 1.00 25.53 O ATOM 456 CB LEU A 34 1.887 31.805 17.571 1.00 26.30 C ATOM 457 CG LEU A 34 3.068 31.126 18.227 1.00 28.46 C ATOM 458 CD1 LEU A 34 3.937 32.192 18.878 1.00 26.31 C ATOM 459 CD2 LEU A 34 2.605 30.133 19.255 1.00 28.46 C ATOM 460 HA LEU A 34 0.412 30.235 17.546 1.00 0.00 H ATOM 461 HB2 LEU A 34 2.300 32.478 16.819 1.00 0.00 H ATOM 462 HB3 LEU A 34 1.398 32.389 18.351 1.00 0.00 H ATOM 463 HG LEU A 34 3.642 30.584 17.475 1.00 0.00 H ATOM 464 HD21 LEU A 34 2.024 30.648 20.020 1.00 0.00 H ATOM 465 HD22 LEU A 34 1.985 29.376 18.774 1.00 0.00 H ATOM 466 HD23 LEU A 34 3.471 29.657 19.714 1.00 0.00 H ATOM 467 HD11 LEU A 34 4.284 32.891 18.117 1.00 0.00 H ATOM 468 HD12 LEU A 34 3.353 32.728 19.626 1.00 0.00 H ATOM 469 HD13 LEU A 34 4.794 31.718 19.356 1.00 0.00 H ATOM 470 H LEU A 34 2.193 30.632 15.273 1.00 0.00 H ATOM 471 N VAL A 35 -1.413 32.015 17.149 1.00 27.09 N ATOM 472 CA VAL A 35 -2.438 33.016 16.895 1.00 25.53 C ATOM 473 C VAL A 35 -2.590 33.892 18.119 1.00 25.48 C ATOM 474 O VAL A 35 -2.944 33.407 19.181 1.00 27.45 O ATOM 475 CB VAL A 35 -3.797 32.385 16.563 1.00 29.13 C ATOM 476 CG1 VAL A 35 -4.802 33.484 16.165 1.00 27.46 C ATOM 477 CG2 VAL A 35 -3.650 31.367 15.442 1.00 31.93 C ATOM 478 HA VAL A 35 -2.121 33.601 16.032 1.00 0.00 H ATOM 479 HB VAL A 35 -4.172 31.869 17.447 1.00 0.00 H ATOM 480 HG11 VAL A 35 -4.922 34.182 16.993 1.00 0.00 H ATOM 481 HG12 VAL A 35 -4.429 34.016 15.290 1.00 0.00 H ATOM 482 HG13 VAL A 35 -5.764 33.028 15.931 1.00 0.00 H ATOM 483 HG21 VAL A 35 -3.261 31.862 14.552 1.00 0.00 H ATOM 484 HG22 VAL A 35 -2.960 30.582 15.754 1.00 0.00 H ATOM 485 HG23 VAL A 35 -4.623 30.930 15.220 1.00 0.00 H ATOM 486 H VAL A 35 -1.572 31.280 17.868 1.00 0.00 H ATOM 487 N VAL A 36 -2.315 35.180 17.969 1.00 23.40 N ATOM 488 CA VAL A 36 -2.410 36.103 19.086 1.00 22.90 C ATOM 489 C VAL A 36 -3.567 37.000 18.805 1.00 21.93 C ATOM 490 O VAL A 36 -3.415 37.973 18.058 1.00 19.01 O ATOM 491 CB VAL A 36 -1.152 36.976 19.197 1.00 24.19 C ATOM 492 CG1 VAL A 36 -1.174 37.758 20.480 1.00 22.45 C ATOM 493 CG2 VAL A 36 0.071 36.129 19.120 1.00 23.15 C ATOM 494 HA VAL A 36 -2.524 35.543 20.014 1.00 0.00 H ATOM 495 HB VAL A 36 -1.137 37.680 18.365 1.00 0.00 H ATOM 496 HG11 VAL A 36 -2.056 38.398 20.499 1.00 0.00 H ATOM 497 HG12 VAL A 36 -1.206 37.069 21.324 1.00 0.00 H ATOM 498 HG13 VAL A 36 -0.276 38.372 20.545 1.00 0.00 H ATOM 499 HG21 VAL A 36 0.064 35.407 19.937 1.00 0.00 H ATOM 500 HG22 VAL A 36 0.086 35.600 18.167 1.00 0.00 H ATOM 501 HG23 VAL A 36 0.955 36.762 19.200 1.00 0.00 H ATOM 502 H VAL A 36 -2.026 35.536 17.035 1.00 0.00 H ATOM 503 N ASP A 37 -4.730 36.671 19.376 1.00 21.09 N ATOM 504 CA ASP A 37 -5.939 37.405 19.050 1.00 23.40 C ATOM 505 C ASP A 37 -6.150 38.532 20.062 1.00 20.79 C ATOM 506 O ASP A 37 -6.508 38.277 21.179 1.00 23.51 O ATOM 507 CB ASP A 37 -7.156 36.467 18.996 1.00 23.05 C ATOM 508 CG ASP A 37 -8.453 37.202 18.613 1.00 24.17 C ATOM 509 OD1 ASP A 37 -8.441 38.399 18.230 1.00 23.67 O ATOM 510 OD2 ASP A 37 -9.520 36.576 18.686 1.00 31.49 O ATOM 511 HA ASP A 37 -5.827 37.846 18.059 1.00 0.00 H ATOM 512 HB2 ASP A 37 -6.965 35.688 18.258 1.00 0.00 H ATOM 513 HB3 ASP A 37 -7.289 36.011 19.977 1.00 0.00 H ATOM 514 H ASP A 37 -4.769 35.886 20.057 1.00 0.00 H ATOM 515 N LEU A 38 -5.894 39.778 19.681 1.00 21.14 N ATOM 516 CA LEU A 38 -6.053 40.884 20.627 1.00 20.48 C ATOM 517 C LEU A 38 -7.500 41.346 20.822 1.00 20.15 C ATOM 518 O LEU A 38 -7.775 42.086 21.741 1.00 21.10 O ATOM 519 CB LEU A 38 -5.180 42.075 20.237 1.00 21.00 C ATOM 520 CG LEU A 38 -3.676 41.963 20.525 1.00 22.56 C ATOM 521 CD1 LEU A 38 -3.396 41.386 21.936 1.00 21.64 C ATOM 522 CD2 LEU A 38 -3.050 41.109 19.466 1.00 23.51 C ATOM 523 HA LEU A 38 -5.725 40.480 21.585 1.00 0.00 H ATOM 524 HB2 LEU A 38 -5.299 42.233 19.165 1.00 0.00 H ATOM 525 HB3 LEU A 38 -5.554 42.947 20.775 1.00 0.00 H ATOM 526 HG LEU A 38 -3.239 42.961 20.507 1.00 0.00 H ATOM 527 HD21 LEU A 38 -3.507 40.119 19.482 1.00 0.00 H ATOM 528 HD22 LEU A 38 -3.209 41.568 18.490 1.00 0.00 H ATOM 529 HD23 LEU A 38 -1.981 41.020 19.658 1.00 0.00 H ATOM 530 HD11 LEU A 38 -3.839 42.038 22.688 1.00 0.00 H ATOM 531 HD12 LEU A 38 -3.833 40.390 22.013 1.00 0.00 H ATOM 532 HD13 LEU A 38 -2.319 41.325 22.095 1.00 0.00 H ATOM 533 H LEU A 38 -5.580 39.969 18.708 1.00 0.00 H ATOM 534 N SER A 39 -8.423 40.907 19.982 1.00 19.86 N ATOM 535 CA SER A 39 -9.812 41.359 20.064 1.00 20.64 C ATOM 536 C SER A 39 -10.548 40.884 21.338 1.00 21.67 C ATOM 537 O SER A 39 -11.586 41.450 21.728 1.00 21.13 O ATOM 538 CB SER A 39 -10.590 40.915 18.820 1.00 21.63 C ATOM 539 OG SER A 39 -10.756 39.500 18.783 1.00 22.81 O ATOM 540 HA SER A 39 -9.771 42.447 20.116 1.00 0.00 H ATOM 541 HB2 SER A 39 -10.045 41.231 17.930 1.00 0.00 H ATOM 542 HB3 SER A 39 -11.573 41.387 18.830 1.00 0.00 H ATOM 543 HG SER A 39 -9.867 39.065 18.768 1.00 0.00 H ATOM 544 H SER A 39 -8.155 40.224 19.245 1.00 0.00 H ATOM 545 N THR A 40 -10.022 39.863 21.999 1.00 19.72 N ATOM 546 CA THR A 40 -10.548 39.482 23.306 1.00 20.16 C ATOM 547 C THR A 40 -9.905 40.281 24.462 1.00 21.27 C ATOM 548 O THR A 40 -10.284 40.101 25.629 1.00 18.44 O ATOM 549 CB THR A 40 -10.315 38.007 23.592 1.00 20.07 C ATOM 550 OG1 THR A 40 -8.906 37.753 23.602 1.00 20.32 O ATOM 551 CG2 THR A 40 -10.990 37.159 22.553 1.00 22.34 C ATOM 552 HA THR A 40 -11.614 39.702 23.259 1.00 0.00 H ATOM 553 HB THR A 40 -10.739 37.753 24.563 1.00 0.00 H ATOM 554 HG1 THR A 40 -8.746 36.794 23.788 1.00 0.00 H ATOM 555 HG23 THR A 40 -12.061 37.364 22.558 1.00 0.00 H ATOM 556 HG21 THR A 40 -10.579 37.393 21.571 1.00 0.00 H ATOM 557 HG22 THR A 40 -10.819 36.106 22.778 1.00 0.00 H ATOM 558 H THR A 40 -9.231 39.331 21.584 1.00 0.00 H ATOM 559 N GLN A 41 -8.934 41.143 24.138 1.00 19.20 N ATOM 560 CA GLN A 41 -8.280 41.958 25.155 1.00 20.57 C ATOM 561 C GLN A 41 -8.425 43.482 25.035 1.00 20.25 C ATOM 562 O GLN A 41 -8.469 44.172 26.039 1.00 21.25 O ATOM 563 CB GLN A 41 -6.811 41.595 25.256 1.00 22.76 C ATOM 564 CG GLN A 41 -6.625 40.204 25.791 1.00 25.36 C ATOM 565 CD GLN A 41 -5.219 39.915 26.187 1.00 27.98 C ATOM 566 OE1 GLN A 41 -4.650 40.600 27.041 1.00 31.67 O ATOM 567 NE2 GLN A 41 -4.640 38.888 25.579 1.00 30.18 N ATOM 568 HA GLN A 41 -8.826 41.709 26.065 1.00 0.00 H ATOM 569 HB2 GLN A 41 -6.361 41.657 24.265 1.00 0.00 H ATOM 570 HB3 GLN A 41 -6.316 42.301 25.923 1.00 0.00 H ATOM 571 HG2 GLN A 41 -7.265 40.079 26.665 1.00 0.00 H ATOM 572 HG3 GLN A 41 -6.922 39.493 25.020 1.00 0.00 H ATOM 573 HE22 GLN A 41 -5.165 38.343 24.866 1.00 0.00 H ATOM 574 HE21 GLN A 41 -3.661 38.628 25.816 1.00 0.00 H ATOM 575 H GLN A 41 -8.641 41.233 23.144 1.00 0.00 H ATOM 576 N ILE A 42 -8.492 44.024 23.836 1.00 17.69 N ATOM 577 CA ILE A 42 -8.512 45.462 23.712 1.00 17.35 C ATOM 578 C ILE A 42 -9.885 45.887 23.238 1.00 17.90 C ATOM 579 O ILE A 42 -10.399 45.352 22.250 1.00 17.61 O ATOM 580 CB ILE A 42 -7.441 45.937 22.745 1.00 15.86 C ATOM 581 CG1 ILE A 42 -6.073 45.430 23.189 1.00 17.60 C ATOM 582 CG2 ILE A 42 -7.477 47.445 22.656 1.00 17.95 C ATOM 583 CD1 ILE A 42 -4.938 45.808 22.232 1.00 17.08 C ATOM 584 HA ILE A 42 -8.301 45.914 24.681 1.00 0.00 H ATOM 585 HB ILE A 42 -7.633 45.533 21.751 1.00 0.00 H ATOM 586 HG12 ILE A 42 -5.851 45.850 24.170 1.00 0.00 H ATOM 587 HG13 ILE A 42 -6.115 44.343 23.262 1.00 0.00 H ATOM 588 HD11 ILE A 42 -5.139 45.385 21.248 1.00 0.00 H ATOM 589 HD12 ILE A 42 -4.874 46.894 22.156 1.00 0.00 H ATOM 590 HD13 ILE A 42 -3.996 45.413 22.613 1.00 0.00 H ATOM 591 HG21 ILE A 42 -8.457 47.763 22.300 1.00 0.00 H ATOM 592 HG22 ILE A 42 -7.292 47.870 23.642 1.00 0.00 H ATOM 593 HG23 ILE A 42 -6.708 47.785 21.962 1.00 0.00 H ATOM 594 H ILE A 42 -8.530 43.423 22.988 1.00 0.00 H ATOM 595 N PHE A 43 -10.473 46.851 23.940 1.00 19.53 N ATOM 596 CA PHE A 43 -11.833 47.307 23.657 1.00 20.67 C ATOM 597 C PHE A 43 -11.852 48.828 23.582 1.00 21.51 C ATOM 598 O PHE A 43 -11.246 49.489 24.401 1.00 21.12 O ATOM 599 CB PHE A 43 -12.784 46.820 24.763 1.00 21.93 C ATOM 600 CG PHE A 43 -12.854 45.298 24.895 1.00 21.49 C ATOM 601 CD1 PHE A 43 -11.916 44.605 25.636 1.00 23.09 C ATOM 602 CD2 PHE A 43 -13.864 44.570 24.266 1.00 23.57 C ATOM 603 CE1 PHE A 43 -11.977 43.214 25.751 1.00 24.28 C ATOM 604 CE2 PHE A 43 -13.927 43.182 24.376 1.00 22.43 C ATOM 605 CZ PHE A 43 -12.983 42.511 25.120 1.00 22.73 C ATOM 606 HA PHE A 43 -12.164 46.898 22.702 1.00 0.00 H ATOM 607 HB2 PHE A 43 -12.445 47.232 25.713 1.00 0.00 H ATOM 608 HB3 PHE A 43 -13.785 47.192 24.544 1.00 0.00 H ATOM 609 HD2 PHE A 43 -14.617 45.096 23.678 1.00 0.00 H ATOM 610 HE2 PHE A 43 -14.721 42.629 23.874 1.00 0.00 H ATOM 611 HZ PHE A 43 -13.030 41.426 25.211 1.00 0.00 H ATOM 612 HE1 PHE A 43 -11.229 42.683 26.340 1.00 0.00 H ATOM 613 HD1 PHE A 43 -11.117 45.151 26.138 1.00 0.00 H ATOM 614 H PHE A 43 -9.947 47.297 24.718 1.00 0.00 H ATOM 615 N CYS A 44 -12.558 49.367 22.594 1.00 21.92 N ATOM 616 CA CYS A 44 -12.682 50.804 22.421 1.00 22.65 C ATOM 617 C CYS A 44 -14.137 51.229 22.353 1.00 22.61 C ATOM 618 O CYS A 44 -15.013 50.417 22.110 1.00 21.43 O ATOM 619 CB CYS A 44 -12.006 51.222 21.132 1.00 21.66 C ATOM 620 SG CYS A 44 -10.309 50.700 21.039 1.00 21.24 S ATOM 621 HA CYS A 44 -12.210 51.282 23.279 1.00 0.00 H ATOM 622 HB2 CYS A 44 -12.040 52.309 21.058 1.00 0.00 H ATOM 623 HB3 CYS A 44 -12.551 50.785 20.296 1.00 0.00 H ATOM 624 H CYS A 44 -13.039 48.738 21.920 1.00 0.00 H ATOM 625 N HIS A 45 -14.379 52.521 22.543 1.00 23.06 N ATOM 626 CA HIS A 45 -15.729 53.025 22.422 1.00 24.50 C ATOM 627 C HIS A 45 -15.702 54.484 22.015 1.00 22.32 C ATOM 628 O HIS A 45 -14.697 55.172 22.189 1.00 21.01 O ATOM 629 CB HIS A 45 -16.503 52.839 23.743 1.00 25.10 C ATOM 630 CG HIS A 45 -16.056 53.764 24.829 1.00 25.34 C ATOM 631 ND1 HIS A 45 -14.938 53.524 25.596 1.00 27.27 N ATOM 632 CD2 HIS A 45 -16.541 54.959 25.239 1.00 25.94 C ATOM 633 CE1 HIS A 45 -14.768 54.507 26.454 1.00 25.47 C ATOM 634 NE2 HIS A 45 -15.738 55.391 26.272 1.00 29.95 N ATOM 635 HA HIS A 45 -16.246 52.457 21.649 1.00 0.00 H ATOM 636 HB2 HIS A 45 -17.561 53.016 23.552 1.00 0.00 H ATOM 637 HB3 HIS A 45 -16.364 51.813 24.084 1.00 0.00 H ATOM 638 HD2 HIS A 45 -17.405 55.482 24.829 1.00 0.00 H ATOM 639 HE1 HIS A 45 -13.966 54.581 27.189 1.00 0.00 H ATOM 640 H HIS A 45 -13.600 53.168 22.778 1.00 0.00 H ATOM 641 N ASN A 46 -16.832 54.922 21.474 1.00 22.60 N ATOM 642 CA ASN A 46 -17.051 56.280 21.019 1.00 22.50 C ATOM 643 C ASN A 46 -17.776 57.039 22.143 1.00 26.21 C ATOM 644 O ASN A 46 -18.814 56.593 22.630 1.00 23.68 O ATOM 645 CB ASN A 46 -17.912 56.212 19.753 1.00 23.59 C ATOM 646 CG ASN A 46 -18.237 57.590 19.150 1.00 25.78 C ATOM 647 OD1 ASN A 46 -18.414 58.581 19.853 1.00 24.57 O ATOM 648 ND2 ASN A 46 -18.333 57.635 17.821 1.00 24.67 N ATOM 649 HA ASN A 46 -16.119 56.796 20.788 1.00 0.00 H ATOM 650 HB2 ASN A 46 -17.378 55.626 19.005 1.00 0.00 H ATOM 651 HB3 ASN A 46 -18.850 55.715 20.001 1.00 0.00 H ATOM 652 HD22 ASN A 46 -18.176 56.774 17.259 1.00 0.00 H ATOM 653 HD21 ASN A 46 -18.565 58.531 17.346 1.00 0.00 H ATOM 654 H ASN A 46 -17.614 54.244 21.370 1.00 0.00 H ATOM 655 N ASP A 47 -17.223 58.164 22.574 1.00 24.84 N ATOM 656 CA ASP A 47 -17.836 58.926 23.656 1.00 29.31 C ATOM 657 C ASP A 47 -19.070 59.793 23.290 1.00 34.03 C ATOM 658 O ASP A 47 -19.815 60.195 24.177 1.00 36.60 O ATOM 659 CB ASP A 47 -16.771 59.774 24.353 1.00 28.43 C ATOM 660 CG ASP A 47 -15.937 58.958 25.345 1.00 25.97 C ATOM 661 OD1 ASP A 47 -16.510 58.309 26.255 1.00 26.20 O ATOM 662 OD2 ASP A 47 -14.706 58.913 25.166 1.00 26.18 O ATOM 663 HA ASP A 47 -18.248 58.170 24.324 1.00 0.00 H ATOM 664 HB2 ASP A 47 -16.107 60.193 23.598 1.00 0.00 H ATOM 665 HB3 ASP A 47 -17.264 60.584 24.891 1.00 0.00 H ATOM 666 H ASP A 47 -16.344 58.506 22.137 1.00 0.00 H ATOM 667 N TYR A 48 -19.302 60.072 22.013 1.00 32.42 N ATOM 668 CA TYR A 48 -20.455 60.895 21.603 1.00 36.06 C ATOM 669 C TYR A 48 -20.996 60.463 20.252 1.00 36.16 C ATOM 670 O TYR A 48 -20.937 61.229 19.282 1.00 35.30 O ATOM 671 CB TYR A 48 -20.078 62.374 21.508 1.00 40.84 C ATOM 672 CG TYR A 48 -19.781 63.030 22.836 1.00 50.26 C ATOM 673 CD1 TYR A 48 -20.803 63.561 23.616 1.00 57.87 C ATOM 674 CD2 TYR A 48 -18.474 63.130 23.316 1.00 50.77 C ATOM 675 CE1 TYR A 48 -20.534 64.170 24.858 1.00 63.44 C ATOM 676 CE2 TYR A 48 -18.193 63.740 24.554 1.00 54.76 C ATOM 677 CZ TYR A 48 -19.231 64.255 25.315 1.00 61.66 C ATOM 678 OH TYR A 48 -18.968 64.859 26.525 1.00 68.88 O ATOM 679 HA TYR A 48 -21.218 60.754 22.368 1.00 0.00 H ATOM 680 HB3 TYR A 48 -20.906 62.908 21.042 1.00 0.00 H ATOM 681 HB2 TYR A 48 -19.192 62.460 20.879 1.00 0.00 H ATOM 682 HD2 TYR A 48 -17.654 62.728 22.721 1.00 0.00 H ATOM 683 HE2 TYR A 48 -17.166 63.807 24.912 1.00 0.00 H ATOM 684 HE1 TYR A 48 -21.351 64.573 25.457 1.00 0.00 H ATOM 685 HD1 TYR A 48 -21.832 63.505 23.260 1.00 0.00 H ATOM 686 HH TYR A 48 -19.817 65.167 26.930 1.00 0.00 H ATOM 687 H TYR A 48 -18.657 59.702 21.286 1.00 0.00 H ATOM 688 N PRO A 49 -21.549 59.247 20.188 1.00 35.72 N ATOM 689 CA PRO A 49 -21.887 58.596 18.916 1.00 35.60 C ATOM 690 C PRO A 49 -23.043 59.249 18.155 1.00 38.35 C ATOM 691 O PRO A 49 -23.195 59.041 16.956 1.00 36.61 O ATOM 692 CB PRO A 49 -22.277 57.187 19.338 1.00 31.84 C ATOM 693 CG PRO A 49 -22.694 57.298 20.775 1.00 34.23 C ATOM 694 CD PRO A 49 -21.991 58.472 21.359 1.00 36.08 C ATOM 695 HA PRO A 49 -21.048 58.656 18.222 1.00 0.00 H ATOM 696 HD3 PRO A 49 -22.668 59.060 21.979 1.00 0.00 H ATOM 697 HD2 PRO A 49 -21.137 58.154 21.957 1.00 0.00 H ATOM 698 HG3 PRO A 49 -22.416 56.392 21.314 1.00 0.00 H ATOM 699 HG2 PRO A 49 -23.773 57.441 20.839 1.00 0.00 H ATOM 700 HB2 PRO A 49 -23.104 56.822 18.729 1.00 0.00 H ATOM 701 HB3 PRO A 49 -21.428 56.511 19.239 1.00 0.00 H ATOM 702 N GLU A 50 -23.843 60.032 18.860 1.00 40.41 N ATOM 703 CA GLU A 50 -25.016 60.657 18.280 1.00 43.38 C ATOM 704 C GLU A 50 -24.635 61.845 17.372 1.00 42.07 C ATOM 705 O GLU A 50 -25.410 62.238 16.507 1.00 44.64 O ATOM 706 CB GLU A 50 -25.977 61.076 19.407 1.00 46.37 C ATOM 707 CG GLU A 50 -25.505 62.281 20.243 1.00 53.19 C ATOM 708 CD GLU A 50 -24.264 62.022 21.145 1.00 54.20 C ATOM 709 OE1 GLU A 50 -24.152 60.926 21.777 1.00 49.36 O ATOM 710 OE2 GLU A 50 -23.413 62.957 21.234 1.00 54.14 O ATOM 711 HA GLU A 50 -25.525 59.937 17.639 1.00 0.00 H ATOM 712 HB2 GLU A 50 -26.937 61.330 18.958 1.00 0.00 H ATOM 713 HB3 GLU A 50 -26.104 60.226 20.078 1.00 0.00 H ATOM 714 HG2 GLU A 50 -25.259 63.091 19.557 1.00 0.00 H ATOM 715 HG3 GLU A 50 -26.330 62.589 20.886 1.00 0.00 H ATOM 716 H GLU A 50 -23.624 60.205 19.862 1.00 0.00 H ATOM 717 N THR A 51 -23.438 62.395 17.552 1.00 38.82 N ATOM 718 CA THR A 51 -22.965 63.481 16.701 1.00 39.76 C ATOM 719 C THR A 51 -21.595 63.248 16.049 1.00 38.67 C ATOM 720 O THR A 51 -21.270 63.891 15.044 1.00 36.43 O ATOM 721 CB THR A 51 -22.861 64.803 17.480 1.00 41.39 C ATOM 722 OG1 THR A 51 -22.174 64.581 18.712 1.00 44.86 O ATOM 723 CG2 THR A 51 -24.255 65.380 17.761 1.00 45.09 C ATOM 724 HA THR A 51 -23.718 63.525 15.914 1.00 0.00 H ATOM 725 HB THR A 51 -22.306 65.520 16.875 1.00 0.00 H ATOM 726 HG1 THR A 51 -22.674 63.919 19.252 1.00 0.00 H ATOM 727 HG23 THR A 51 -24.775 65.547 16.817 1.00 0.00 H ATOM 728 HG21 THR A 51 -24.822 64.676 18.370 1.00 0.00 H ATOM 729 HG22 THR A 51 -24.155 66.325 18.295 1.00 0.00 H ATOM 730 H THR A 51 -22.826 62.043 18.316 1.00 0.00 H ATOM 731 N ILE A 52 -20.786 62.365 16.632 1.00 34.18 N ATOM 732 CA ILE A 52 -19.442 62.142 16.130 1.00 30.59 C ATOM 733 C ILE A 52 -19.295 60.715 15.701 1.00 29.39 C ATOM 734 O ILE A 52 -19.846 59.804 16.331 1.00 28.70 O ATOM 735 CB ILE A 52 -18.373 62.447 17.179 1.00 30.84 C ATOM 736 CG1 ILE A 52 -18.590 63.851 17.737 1.00 34.50 C ATOM 737 CG2 ILE A 52 -16.967 62.344 16.563 1.00 28.12 C ATOM 738 CD1 ILE A 52 -17.545 64.297 18.727 1.00 37.88 C ATOM 739 HA ILE A 52 -19.297 62.819 15.288 1.00 0.00 H ATOM 740 HB ILE A 52 -18.454 61.717 17.985 1.00 0.00 H ATOM 741 HG12 ILE A 52 -18.591 64.553 16.903 1.00 0.00 H ATOM 742 HG13 ILE A 52 -19.561 63.875 18.232 1.00 0.00 H ATOM 743 HD11 ILE A 52 -17.537 63.615 19.577 1.00 0.00 H ATOM 744 HD12 ILE A 52 -16.566 64.293 18.247 1.00 0.00 H ATOM 745 HD13 ILE A 52 -17.779 65.305 19.071 1.00 0.00 H ATOM 746 HG21 ILE A 52 -16.812 61.335 16.182 1.00 0.00 H ATOM 747 HG22 ILE A 52 -16.876 63.060 15.746 1.00 0.00 H ATOM 748 HG23 ILE A 52 -16.220 62.565 17.326 1.00 0.00 H ATOM 749 H ILE A 52 -21.121 61.828 17.457 1.00 0.00 H ATOM 750 N THR A 53 -18.577 60.530 14.595 1.00 29.86 N ATOM 751 CA THR A 53 -18.166 59.192 14.143 1.00 25.39 C ATOM 752 C THR A 53 -16.635 59.060 14.279 1.00 24.45 C ATOM 753 O THR A 53 -15.877 59.892 13.773 1.00 26.06 O ATOM 754 CB THR A 53 -18.654 58.915 12.691 1.00 26.88 C ATOM 755 OG1 THR A 53 -20.089 58.839 12.690 1.00 29.00 O ATOM 756 CG2 THR A 53 -18.082 57.607 12.146 1.00 26.00 C ATOM 757 HA THR A 53 -18.634 58.435 14.772 1.00 0.00 H ATOM 758 HB THR A 53 -18.309 59.727 12.052 1.00 0.00 H ATOM 759 HG1 THR A 53 -20.464 59.697 13.012 1.00 0.00 H ATOM 760 HG23 THR A 53 -16.993 57.660 12.145 1.00 0.00 H ATOM 761 HG21 THR A 53 -18.406 56.779 12.777 1.00 0.00 H ATOM 762 HG22 THR A 53 -18.440 57.451 11.128 1.00 0.00 H ATOM 763 H THR A 53 -18.298 61.359 14.032 1.00 0.00 H ATOM 764 N ASP A 54 -16.193 58.023 14.984 1.00 21.94 N ATOM 765 CA ASP A 54 -14.782 57.743 15.132 1.00 22.36 C ATOM 766 C ASP A 54 -14.274 56.715 14.084 1.00 20.76 C ATOM 767 O ASP A 54 -14.938 55.730 13.773 1.00 22.65 O ATOM 768 CB ASP A 54 -14.504 57.255 16.559 1.00 21.33 C ATOM 769 CG ASP A 54 -14.635 58.362 17.604 1.00 23.33 C ATOM 770 OD1 ASP A 54 -14.221 59.537 17.335 1.00 23.12 O ATOM 771 OD2 ASP A 54 -15.143 58.040 18.709 1.00 22.81 O ATOM 772 HA ASP A 54 -14.233 58.667 14.952 1.00 0.00 H ATOM 773 HB2 ASP A 54 -15.213 56.463 16.800 1.00 0.00 H ATOM 774 HB3 ASP A 54 -13.490 56.857 16.599 1.00 0.00 H ATOM 775 H ASP A 54 -16.883 57.394 15.443 1.00 0.00 H ATOM 776 N TYR A 55 -13.074 56.948 13.576 1.00 20.38 N ATOM 777 CA TYR A 55 -12.424 56.065 12.613 1.00 20.94 C ATOM 778 C TYR A 55 -11.122 55.544 13.197 1.00 19.46 C ATOM 779 O TYR A 55 -10.288 56.311 13.643 1.00 17.66 O ATOM 780 CB TYR A 55 -12.069 56.817 11.330 1.00 22.73 C ATOM 781 CG TYR A 55 -13.217 57.569 10.704 1.00 26.47 C ATOM 782 CD1 TYR A 55 -14.352 56.903 10.250 1.00 25.68 C ATOM 783 CD2 TYR A 55 -13.167 58.956 10.579 1.00 26.38 C ATOM 784 CE1 TYR A 55 -15.419 57.604 9.688 1.00 25.74 C ATOM 785 CE2 TYR A 55 -14.210 59.656 10.026 1.00 29.39 C ATOM 786 CZ TYR A 55 -15.337 58.971 9.576 1.00 30.76 C ATOM 787 OH TYR A 55 -16.372 59.680 9.016 1.00 32.46 O ATOM 788 HA TYR A 55 -13.117 55.253 12.392 1.00 0.00 H ATOM 789 HB3 TYR A 55 -11.699 56.094 10.603 1.00 0.00 H ATOM 790 HB2 TYR A 55 -11.280 57.532 11.562 1.00 0.00 H ATOM 791 HD2 TYR A 55 -12.285 59.494 10.926 1.00 0.00 H ATOM 792 HE2 TYR A 55 -14.157 60.741 9.939 1.00 0.00 H ATOM 793 HE1 TYR A 55 -16.307 57.074 9.342 1.00 0.00 H ATOM 794 HD1 TYR A 55 -14.408 55.818 10.335 1.00 0.00 H ATOM 795 HH TYR A 55 -17.092 59.055 8.749 1.00 0.00 H ATOM 796 H TYR A 55 -12.568 57.805 13.879 1.00 0.00 H ATOM 797 N VAL A 56 -10.935 54.236 13.146 1.00 17.62 N ATOM 798 CA VAL A 56 -9.821 53.617 13.824 1.00 18.20 C ATOM 799 C VAL A 56 -9.099 52.702 12.836 1.00 16.19 C ATOM 800 O VAL A 56 -9.711 51.832 12.226 1.00 14.70 O ATOM 801 CB VAL A 56 -10.331 52.843 15.056 1.00 17.04 C ATOM 802 CG1 VAL A 56 -9.225 51.956 15.675 1.00 15.98 C ATOM 803 CG2 VAL A 56 -10.903 53.812 16.082 1.00 16.74 C ATOM 804 HA VAL A 56 -9.116 54.369 14.179 1.00 0.00 H ATOM 805 HB VAL A 56 -11.126 52.173 14.730 1.00 0.00 H ATOM 806 HG11 VAL A 56 -8.883 51.234 14.934 1.00 0.00 H ATOM 807 HG12 VAL A 56 -8.389 52.583 15.986 1.00 0.00 H ATOM 808 HG13 VAL A 56 -9.626 51.428 16.540 1.00 0.00 H ATOM 809 HG21 VAL A 56 -10.126 54.510 16.393 1.00 0.00 H ATOM 810 HG22 VAL A 56 -11.731 54.363 15.637 1.00 0.00 H ATOM 811 HG23 VAL A 56 -11.260 53.254 16.948 1.00 0.00 H ATOM 812 H VAL A 56 -11.601 53.644 12.609 1.00 0.00 H ATOM 813 N THR A 57 -7.804 52.923 12.681 1.00 14.75 N ATOM 814 CA THR A 57 -6.958 52.067 11.853 1.00 15.94 C ATOM 815 C THR A 57 -5.863 51.437 12.691 1.00 17.14 C ATOM 816 O THR A 57 -5.508 51.948 13.784 1.00 16.13 O ATOM 817 CB THR A 57 -6.208 52.908 10.781 1.00 19.50 C ATOM 818 OG1 THR A 57 -5.316 53.816 11.438 1.00 19.47 O ATOM 819 CG2 THR A 57 -7.182 53.707 9.878 1.00 17.56 C ATOM 820 HA THR A 57 -7.613 51.322 11.402 1.00 0.00 H ATOM 821 HB THR A 57 -5.656 52.219 10.141 1.00 0.00 H ATOM 822 HG1 THR A 57 -4.836 54.354 10.760 1.00 0.00 H ATOM 823 HG23 THR A 57 -7.861 53.016 9.378 1.00 0.00 H ATOM 824 HG21 THR A 57 -7.755 54.403 10.491 1.00 0.00 H ATOM 825 HG22 THR A 57 -6.612 54.262 9.133 1.00 0.00 H ATOM 826 H THR A 57 -7.373 53.735 13.166 1.00 0.00 H ATOM 827 N LEU A 58 -5.307 50.338 12.180 1.00 17.12 N ATOM 828 CA LEU A 58 -3.990 49.870 12.607 1.00 16.10 C ATOM 829 C LEU A 58 -2.956 50.663 11.810 1.00 16.98 C ATOM 830 O LEU A 58 -2.782 50.457 10.608 1.00 16.66 O ATOM 831 CB LEU A 58 -3.818 48.394 12.352 1.00 14.79 C ATOM 832 CG LEU A 58 -2.452 47.798 12.729 1.00 15.13 C ATOM 833 CD1 LEU A 58 -2.155 47.785 14.225 1.00 14.33 C ATOM 834 CD2 LEU A 58 -2.360 46.377 12.177 1.00 16.80 C ATOM 835 HA LEU A 58 -3.870 50.022 13.680 1.00 0.00 H ATOM 836 HB2 LEU A 58 -4.581 47.866 12.923 1.00 0.00 H ATOM 837 HB3 LEU A 58 -3.976 48.219 11.288 1.00 0.00 H ATOM 838 HG LEU A 58 -1.701 48.452 12.285 1.00 0.00 H ATOM 839 HD21 LEU A 58 -3.157 45.770 12.605 1.00 0.00 H ATOM 840 HD22 LEU A 58 -2.464 46.403 11.092 1.00 0.00 H ATOM 841 HD23 LEU A 58 -1.393 45.948 12.441 1.00 0.00 H ATOM 842 HD11 LEU A 58 -2.171 48.806 14.606 1.00 0.00 H ATOM 843 HD12 LEU A 58 -2.912 47.192 14.739 1.00 0.00 H ATOM 844 HD13 LEU A 58 -1.171 47.347 14.395 1.00 0.00 H ATOM 845 H LEU A 58 -5.825 49.799 11.457 1.00 0.00 H ATOM 846 N GLN A 59 -2.288 51.607 12.460 1.00 18.12 N ATOM 847 CA GLN A 59 -1.381 52.473 11.730 1.00 19.70 C ATOM 848 C GLN A 59 -0.101 51.724 11.385 1.00 18.01 C ATOM 849 O GLN A 59 0.440 51.873 10.306 1.00 18.44 O ATOM 850 CB GLN A 59 -1.069 53.721 12.532 1.00 22.33 C ATOM 851 CG GLN A 59 -0.172 54.710 11.815 1.00 23.26 C ATOM 852 CD GLN A 59 0.460 55.712 12.772 1.00 29.24 C ATOM 853 OE1 GLN A 59 -0.068 56.003 13.844 1.00 28.00 O ATOM 854 NE2 GLN A 59 1.606 56.249 12.380 1.00 40.51 N ATOM 855 HA GLN A 59 -1.866 52.779 10.803 1.00 0.00 H ATOM 856 HB2 GLN A 59 -2.009 54.220 12.768 1.00 0.00 H ATOM 857 HB3 GLN A 59 -0.576 53.420 13.457 1.00 0.00 H ATOM 858 HG2 GLN A 59 0.621 54.161 11.307 1.00 0.00 H ATOM 859 HG3 GLN A 59 -0.765 55.253 11.079 1.00 0.00 H ATOM 860 HE22 GLN A 59 2.022 55.978 11.466 1.00 0.00 H ATOM 861 HE21 GLN A 59 2.090 56.942 12.986 1.00 0.00 H ATOM 862 H GLN A 59 -2.414 51.726 13.486 1.00 0.00 H ATOM 863 N ARG A 60 0.350 50.904 12.313 1.00 17.52 N ATOM 864 CA ARG A 60 1.611 50.201 12.191 1.00 18.67 C ATOM 865 C ARG A 60 1.693 49.052 13.212 1.00 18.54 C ATOM 866 O ARG A 60 1.169 49.128 14.328 1.00 17.12 O ATOM 867 CB ARG A 60 2.761 51.178 12.336 1.00 23.38 C ATOM 868 CG ARG A 60 4.100 50.518 12.422 1.00 27.74 C ATOM 869 CD ARG A 60 5.217 51.500 12.139 1.00 33.93 C ATOM 870 NE ARG A 60 6.071 50.941 11.089 1.00 44.06 N ATOM 871 CZ ARG A 60 6.352 51.515 9.911 1.00 54.45 C ATOM 872 NH1 ARG A 60 5.888 52.730 9.569 1.00 47.64 N ATOM 873 NH2 ARG A 60 7.137 50.857 9.063 1.00 61.69 N ATOM 874 HA ARG A 60 1.680 49.751 11.201 1.00 0.00 H ATOM 875 HB2 ARG A 60 2.759 51.843 11.473 1.00 0.00 H ATOM 876 HB3 ARG A 60 2.605 51.762 13.243 1.00 0.00 H ATOM 877 HG2 ARG A 60 4.231 50.110 13.424 1.00 0.00 H ATOM 878 HG3 ARG A 60 4.145 49.709 11.693 1.00 0.00 H ATOM 879 HD2 ARG A 60 5.803 51.661 13.044 1.00 0.00 H ATOM 880 HD3 ARG A 60 4.797 52.449 11.806 1.00 0.00 H ATOM 881 HE ARG A 60 6.499 50.012 11.275 1.00 0.00 H ATOM 882 HH12 ARG A 60 6.131 53.138 8.644 1.00 0.00 H ATOM 883 HH11 ARG A 60 5.286 53.262 10.230 1.00 0.00 H ATOM 884 HH22 ARG A 60 7.373 51.276 8.141 1.00 0.00 H ATOM 885 HH21 ARG A 60 7.515 49.923 9.322 1.00 0.00 H ATOM 886 H ARG A 60 -0.223 50.755 13.168 1.00 0.00 H ATOM 887 N GLY A 61 2.294 47.960 12.774 1.00 19.16 N ATOM 888 CA GLY A 61 2.471 46.764 13.578 1.00 18.37 C ATOM 889 C GLY A 61 3.921 46.395 13.395 1.00 20.68 C ATOM 890 O GLY A 61 4.374 46.247 12.259 1.00 19.17 O ATOM 891 HA3 GLY A 61 1.822 45.963 13.225 1.00 0.00 H ATOM 892 HA2 GLY A 61 2.255 46.969 14.627 1.00 0.00 H ATOM 893 H GLY A 61 2.660 47.957 11.801 1.00 0.00 H ATOM 894 N SER A 62 4.649 46.296 14.508 1.00 18.95 N ATOM 895 CA SER A 62 6.073 46.036 14.509 1.00 18.91 C ATOM 896 C SER A 62 6.379 44.845 15.394 1.00 18.92 C ATOM 897 O SER A 62 5.694 44.639 16.417 1.00 15.68 O ATOM 898 CB SER A 62 6.822 47.249 15.043 1.00 20.60 C ATOM 899 OG SER A 62 6.594 48.393 14.253 1.00 22.10 O ATOM 900 HA SER A 62 6.390 45.828 13.487 1.00 0.00 H ATOM 901 HB2 SER A 62 7.890 47.031 15.049 1.00 0.00 H ATOM 902 HB3 SER A 62 6.488 47.450 16.061 1.00 0.00 H ATOM 903 HG SER A 62 6.900 48.220 13.328 1.00 0.00 H ATOM 904 H SER A 62 4.169 46.412 15.423 1.00 0.00 H ATOM 905 N ALA A 63 7.405 44.079 15.019 1.00 17.81 N ATOM 906 CA ALA A 63 7.809 42.898 15.779 1.00 17.66 C ATOM 907 C ALA A 63 9.088 43.209 16.569 1.00 17.46 C ATOM 908 O ALA A 63 9.837 44.083 16.189 1.00 16.92 O ATOM 909 CB ALA A 63 8.024 41.702 14.863 1.00 18.62 C ATOM 910 HA ALA A 63 7.010 42.641 16.474 1.00 0.00 H ATOM 911 HB1 ALA A 63 7.096 41.477 14.337 1.00 0.00 H ATOM 912 HB2 ALA A 63 8.806 41.936 14.140 1.00 0.00 H ATOM 913 HB3 ALA A 63 8.324 40.839 15.458 1.00 0.00 H ATOM 914 H ALA A 63 7.934 44.330 14.159 1.00 0.00 H ATOM 915 N TYR A 64 9.302 42.492 17.675 1.00 17.95 N ATOM 916 CA TYR A 64 10.455 42.679 18.543 1.00 18.47 C ATOM 917 C TYR A 64 10.919 41.338 19.093 1.00 18.70 C ATOM 918 O TYR A 64 10.184 40.374 19.050 1.00 17.38 O ATOM 919 CB TYR A 64 10.093 43.570 19.744 1.00 18.38 C ATOM 920 CG TYR A 64 9.914 45.009 19.371 1.00 18.72 C ATOM 921 CD1 TYR A 64 8.703 45.480 18.906 1.00 17.16 C ATOM 922 CD2 TYR A 64 10.976 45.890 19.453 1.00 21.02 C ATOM 923 CE1 TYR A 64 8.559 46.789 18.525 1.00 17.76 C ATOM 924 CE2 TYR A 64 10.838 47.193 19.084 1.00 22.51 C ATOM 925 CZ TYR A 64 9.632 47.637 18.619 1.00 20.61 C ATOM 926 OH TYR A 64 9.541 48.953 18.269 1.00 25.24 O ATOM 927 HA TYR A 64 11.241 43.147 17.950 1.00 0.00 H ATOM 928 HB3 TYR A 64 10.891 43.499 20.483 1.00 0.00 H ATOM 929 HB2 TYR A 64 9.163 43.205 20.180 1.00 0.00 H ATOM 930 HD2 TYR A 64 11.940 45.536 19.819 1.00 0.00 H ATOM 931 HE2 TYR A 64 11.683 47.877 19.159 1.00 0.00 H ATOM 932 HE1 TYR A 64 7.601 47.152 18.151 1.00 0.00 H ATOM 933 HD1 TYR A 64 7.851 44.803 18.841 1.00 0.00 H ATOM 934 HH TYR A 64 8.624 49.146 17.951 1.00 0.00 H ATOM 935 H TYR A 64 8.608 41.761 17.930 1.00 0.00 H ATOM 936 N GLY A 65 12.127 41.326 19.657 1.00 19.20 N ATOM 937 CA GLY A 65 12.679 40.177 20.331 1.00 19.45 C ATOM 938 C GLY A 65 12.615 38.901 19.522 1.00 21.15 C ATOM 939 O GLY A 65 13.039 38.853 18.345 1.00 21.07 O ATOM 940 HA3 GLY A 65 12.126 40.024 21.258 1.00 0.00 H ATOM 941 HA2 GLY A 65 13.724 40.384 20.563 1.00 0.00 H ATOM 942 H GLY A 65 12.702 42.191 19.608 1.00 0.00 H ATOM 943 N GLY A 66 12.075 37.862 20.152 1.00 18.73 N ATOM 944 CA GLY A 66 12.040 36.541 19.549 1.00 21.23 C ATOM 945 C GLY A 66 11.105 36.442 18.363 1.00 21.02 C ATOM 946 O GLY A 66 11.276 35.599 17.479 1.00 20.58 O ATOM 947 HA3 GLY A 66 11.716 35.825 20.305 1.00 0.00 H ATOM 948 HA2 GLY A 66 13.047 36.286 19.217 1.00 0.00 H ATOM 949 H GLY A 66 11.668 37.998 21.099 1.00 0.00 H ATOM 950 N VAL A 67 10.091 37.299 18.350 1.00 19.34 N ATOM 951 CA VAL A 67 9.153 37.317 17.255 1.00 19.54 C ATOM 952 C VAL A 67 9.808 37.891 16.012 1.00 21.16 C ATOM 953 O VAL A 67 9.695 37.314 14.951 1.00 21.41 O ATOM 954 CB VAL A 67 7.888 38.073 17.613 1.00 19.92 C ATOM 955 CG1 VAL A 67 7.069 38.363 16.350 1.00 20.42 C ATOM 956 CG2 VAL A 67 7.085 37.254 18.607 1.00 16.44 C ATOM 957 HA VAL A 67 8.858 36.289 17.045 1.00 0.00 H ATOM 958 HB VAL A 67 8.146 39.029 18.069 1.00 0.00 H ATOM 959 HG11 VAL A 67 7.663 38.966 15.664 1.00 0.00 H ATOM 960 HG12 VAL A 67 6.799 37.423 15.869 1.00 0.00 H ATOM 961 HG13 VAL A 67 6.164 38.906 16.622 1.00 0.00 H ATOM 962 HG21 VAL A 67 6.825 36.295 18.160 1.00 0.00 H ATOM 963 HG22 VAL A 67 7.681 37.089 19.505 1.00 0.00 H ATOM 964 HG23 VAL A 67 6.174 37.793 18.868 1.00 0.00 H ATOM 965 H VAL A 67 9.972 37.966 19.139 1.00 0.00 H ATOM 966 N LEU A 68 10.510 39.006 16.157 1.00 20.59 N ATOM 967 CA LEU A 68 11.262 39.606 15.066 1.00 19.60 C ATOM 968 C LEU A 68 12.364 38.679 14.505 1.00 24.65 C ATOM 969 O LEU A 68 12.626 38.661 13.285 1.00 24.87 O ATOM 970 CB LEU A 68 11.877 40.914 15.553 1.00 20.91 C ATOM 971 CG LEU A 68 12.854 41.627 14.604 1.00 25.21 C ATOM 972 CD1 LEU A 68 12.140 42.123 13.305 1.00 22.91 C ATOM 973 CD2 LEU A 68 13.510 42.778 15.350 1.00 22.09 C ATOM 974 HA LEU A 68 10.566 39.786 14.246 1.00 0.00 H ATOM 975 HB2 LEU A 68 11.059 41.604 15.761 1.00 0.00 H ATOM 976 HB3 LEU A 68 12.414 40.700 16.477 1.00 0.00 H ATOM 977 HG LEU A 68 13.619 40.920 14.283 1.00 0.00 H ATOM 978 HD21 LEU A 68 12.743 43.477 15.684 1.00 0.00 H ATOM 979 HD22 LEU A 68 14.050 42.389 16.213 1.00 0.00 H ATOM 980 HD23 LEU A 68 14.205 43.291 14.685 1.00 0.00 H ATOM 981 HD11 LEU A 68 11.711 41.270 12.779 1.00 0.00 H ATOM 982 HD12 LEU A 68 11.348 42.823 13.572 1.00 0.00 H ATOM 983 HD13 LEU A 68 12.865 42.621 12.661 1.00 0.00 H ATOM 984 H LEU A 68 10.524 39.470 17.088 1.00 0.00 H ATOM 985 N SER A 69 13.028 37.910 15.365 1.00 23.24 N ATOM 986 CA SER A 69 14.172 37.118 14.884 1.00 25.55 C ATOM 987 C SER A 69 13.818 35.697 14.452 1.00 26.58 C ATOM 988 O SER A 69 14.502 35.129 13.604 1.00 26.73 O ATOM 989 CB SER A 69 15.333 37.098 15.887 1.00 25.04 C ATOM 990 OG SER A 69 14.943 36.628 17.144 1.00 29.22 O ATOM 991 HA SER A 69 14.497 37.641 13.985 1.00 0.00 H ATOM 992 HB2 SER A 69 15.719 38.111 15.996 1.00 0.00 H ATOM 993 HB3 SER A 69 16.120 36.451 15.499 1.00 0.00 H ATOM 994 HG SER A 69 14.233 37.214 17.509 1.00 0.00 H ATOM 995 H SER A 69 12.742 37.869 16.364 1.00 0.00 H ATOM 996 N ASN A 70 12.727 35.157 14.986 1.00 22.99 N ATOM 997 CA ASN A 70 12.427 33.741 14.840 1.00 23.30 C ATOM 998 C ASN A 70 11.097 33.434 14.173 1.00 21.65 C ATOM 999 O ASN A 70 10.736 32.274 14.036 1.00 22.86 O ATOM 1000 CB ASN A 70 12.454 33.064 16.216 1.00 23.35 C ATOM 1001 CG ASN A 70 13.825 33.122 16.867 1.00 27.40 C ATOM 1002 OD1 ASN A 70 14.855 32.988 16.190 1.00 28.31 O ATOM 1003 ND2 ASN A 70 13.851 33.341 18.166 1.00 23.29 N ATOM 1004 HA ASN A 70 13.200 33.350 14.178 1.00 0.00 H ATOM 1005 HB2 ASN A 70 11.737 33.565 16.866 1.00 0.00 H ATOM 1006 HB3 ASN A 70 12.167 32.019 16.097 1.00 0.00 H ATOM 1007 HD22 ASN A 70 12.961 33.447 18.693 1.00 0.00 H ATOM 1008 HD21 ASN A 70 14.762 33.408 18.664 1.00 0.00 H ATOM 1009 H ASN A 70 12.072 35.762 15.521 1.00 0.00 H ATOM 1010 N PHE A 71 10.330 34.459 13.822 1.00 22.73 N ATOM 1011 CA PHE A 71 9.018 34.232 13.204 1.00 23.65 C ATOM 1012 C PHE A 71 8.784 35.110 11.999 1.00 22.76 C ATOM 1013 O PHE A 71 9.354 36.178 11.888 1.00 23.98 O ATOM 1014 CB PHE A 71 7.888 34.488 14.200 1.00 22.88 C ATOM 1015 CG PHE A 71 7.791 33.472 15.286 1.00 21.17 C ATOM 1016 CD1 PHE A 71 8.648 33.515 16.381 1.00 18.46 C ATOM 1017 CD2 PHE A 71 6.839 32.475 15.222 1.00 20.89 C ATOM 1018 CE1 PHE A 71 8.557 32.582 17.367 1.00 17.55 C ATOM 1019 CE2 PHE A 71 6.735 31.535 16.223 1.00 20.25 C ATOM 1020 CZ PHE A 71 7.581 31.583 17.283 1.00 21.87 C ATOM 1021 HA PHE A 71 9.019 33.189 12.887 1.00 0.00 H ATOM 1022 HB2 PHE A 71 8.049 35.464 14.658 1.00 0.00 H ATOM 1023 HB3 PHE A 71 6.945 34.496 13.653 1.00 0.00 H ATOM 1024 HD2 PHE A 71 6.162 32.431 14.369 1.00 0.00 H ATOM 1025 HE2 PHE A 71 5.976 30.755 16.164 1.00 0.00 H ATOM 1026 HZ PHE A 71 7.500 30.838 18.075 1.00 0.00 H ATOM 1027 HE1 PHE A 71 9.240 32.613 18.216 1.00 0.00 H ATOM 1028 HD1 PHE A 71 9.398 34.303 16.450 1.00 0.00 H ATOM 1029 H PHE A 71 10.661 35.431 13.986 1.00 0.00 H ATOM 1030 N SER A 72 7.931 34.638 11.097 1.00 24.05 N ATOM 1031 CA SER A 72 7.377 35.491 10.064 1.00 28.81 C ATOM 1032 C SER A 72 5.889 35.564 10.402 1.00 29.64 C ATOM 1033 O SER A 72 5.366 34.662 11.093 1.00 30.31 O ATOM 1034 CB SER A 72 7.625 34.925 8.647 1.00 28.96 C ATOM 1035 OG SER A 72 6.851 33.776 8.395 1.00 30.81 O ATOM 1036 HA SER A 72 7.845 36.475 10.045 1.00 0.00 H ATOM 1037 HB2 SER A 72 8.680 34.667 8.550 1.00 0.00 H ATOM 1038 HB3 SER A 72 7.370 35.689 7.913 1.00 0.00 H ATOM 1039 HG SER A 72 7.039 33.447 7.481 1.00 0.00 H ATOM 1040 H SER A 72 7.655 33.636 11.132 1.00 0.00 H ATOM 1041 N GLY A 73 5.215 36.627 9.975 1.00 25.11 N ATOM 1042 CA GLY A 73 3.836 36.793 10.363 1.00 24.34 C ATOM 1043 C GLY A 73 2.948 37.533 9.394 1.00 24.17 C ATOM 1044 O GLY A 73 3.386 38.091 8.374 1.00 20.32 O ATOM 1045 HA3 GLY A 73 3.821 37.336 11.308 1.00 0.00 H ATOM 1046 HA2 GLY A 73 3.411 35.800 10.510 1.00 0.00 H ATOM 1047 H GLY A 73 5.678 37.332 9.367 1.00 0.00 H ATOM 1048 N THR A 74 1.665 37.485 9.740 1.00 21.08 N ATOM 1049 CA THR A 74 0.660 38.295 9.084 1.00 21.14 C ATOM 1050 C THR A 74 -0.277 38.811 10.169 1.00 20.20 C ATOM 1051 O THR A 74 -0.314 38.290 11.289 1.00 19.68 O ATOM 1052 CB THR A 74 -0.133 37.509 7.999 1.00 22.12 C ATOM 1053 OG1 THR A 74 -0.985 36.549 8.625 1.00 24.32 O ATOM 1054 CG2 THR A 74 0.811 36.803 7.029 1.00 22.41 C ATOM 1055 HA THR A 74 1.146 39.115 8.555 1.00 0.00 H ATOM 1056 HB THR A 74 -0.734 38.221 7.434 1.00 0.00 H ATOM 1057 HG1 THR A 74 -1.487 36.052 7.931 1.00 0.00 H ATOM 1058 HG23 THR A 74 1.459 37.539 6.554 1.00 0.00 H ATOM 1059 HG21 THR A 74 1.418 36.081 7.575 1.00 0.00 H ATOM 1060 HG22 THR A 74 0.227 36.286 6.268 1.00 0.00 H ATOM 1061 H THR A 74 1.374 36.845 10.506 1.00 0.00 H ATOM 1062 N VAL A 75 -0.968 39.889 9.871 1.00 18.04 N ATOM 1063 CA VAL A 75 -1.942 40.429 10.789 1.00 18.95 C ATOM 1064 C VAL A 75 -3.267 40.474 10.074 1.00 17.22 C ATOM 1065 O VAL A 75 -3.339 40.809 8.904 1.00 16.87 O ATOM 1066 CB VAL A 75 -1.556 41.834 11.321 1.00 18.14 C ATOM 1067 CG1 VAL A 75 -1.219 42.774 10.210 1.00 18.12 C ATOM 1068 CG2 VAL A 75 -2.668 42.409 12.201 1.00 17.74 C ATOM 1069 HA VAL A 75 -1.992 39.786 11.668 1.00 0.00 H ATOM 1070 HB VAL A 75 -0.661 41.716 11.932 1.00 0.00 H ATOM 1071 HG11 VAL A 75 -0.376 42.378 9.644 1.00 0.00 H ATOM 1072 HG12 VAL A 75 -2.082 42.881 9.552 1.00 0.00 H ATOM 1073 HG13 VAL A 75 -0.954 43.746 10.626 1.00 0.00 H ATOM 1074 HG21 VAL A 75 -3.584 42.494 11.617 1.00 0.00 H ATOM 1075 HG22 VAL A 75 -2.837 41.746 13.050 1.00 0.00 H ATOM 1076 HG23 VAL A 75 -2.372 43.394 12.561 1.00 0.00 H ATOM 1077 H VAL A 75 -0.810 40.361 8.958 1.00 0.00 H ATOM 1078 N LYS A 76 -4.302 40.087 10.785 1.00 15.80 N ATOM 1079 CA LYS A 76 -5.662 40.199 10.315 1.00 18.80 C ATOM 1080 C LYS A 76 -6.304 41.389 11.038 1.00 20.09 C ATOM 1081 O LYS A 76 -6.336 41.432 12.293 1.00 19.14 O ATOM 1082 CB LYS A 76 -6.379 38.917 10.671 1.00 21.40 C ATOM 1083 CG LYS A 76 -7.630 38.610 9.929 1.00 27.68 C ATOM 1084 CD LYS A 76 -8.027 37.167 10.332 1.00 36.40 C ATOM 1085 CE LYS A 76 -9.255 36.650 9.626 1.00 39.12 C ATOM 1086 NZ LYS A 76 -9.072 36.777 8.158 1.00 41.28 N ATOM 1087 HA LYS A 76 -5.713 40.355 9.237 1.00 0.00 H ATOM 1088 HB2 LYS A 76 -5.685 38.094 10.499 1.00 0.00 H ATOM 1089 HB3 LYS A 76 -6.629 38.964 11.731 1.00 0.00 H ATOM 1090 HG2 LYS A 76 -8.417 39.311 10.208 1.00 0.00 H ATOM 1091 HG3 LYS A 76 -7.457 38.669 8.854 1.00 0.00 H ATOM 1092 HD2 LYS A 76 -7.193 36.504 10.100 1.00 0.00 H ATOM 1093 HD3 LYS A 76 -8.216 37.150 11.405 1.00 0.00 H ATOM 1094 HE2 LYS A 76 -10.124 37.230 9.936 1.00 0.00 H ATOM 1095 HE3 LYS A 76 -9.409 35.602 9.884 1.00 0.00 H ATOM 1096 HZ1 LYS A 76 -8.926 37.777 7.913 1.00 0.00 H ATOM 1097 HZ2 LYS A 76 -8.243 36.222 7.864 1.00 0.00 H ATOM 1098 HZ3 LYS A 76 -9.919 36.420 7.672 1.00 0.00 H ATOM 1099 H LYS A 76 -4.134 39.682 11.728 1.00 0.00 H ATOM 1100 N TYR A 77 -6.760 42.374 10.273 1.00 18.11 N ATOM 1101 CA TYR A 77 -7.456 43.532 10.848 1.00 17.36 C ATOM 1102 C TYR A 77 -8.828 43.694 10.217 1.00 17.67 C ATOM 1103 O TYR A 77 -8.937 43.933 9.020 1.00 16.73 O ATOM 1104 CB TYR A 77 -6.668 44.823 10.641 1.00 16.17 C ATOM 1105 CG TYR A 77 -7.253 46.020 11.366 1.00 17.27 C ATOM 1106 CD1 TYR A 77 -7.390 46.020 12.777 1.00 19.05 C ATOM 1107 CD2 TYR A 77 -7.684 47.141 10.669 1.00 16.63 C ATOM 1108 CE1 TYR A 77 -7.923 47.117 13.461 1.00 15.94 C ATOM 1109 CE2 TYR A 77 -8.192 48.254 11.333 1.00 16.47 C ATOM 1110 CZ TYR A 77 -8.313 48.229 12.730 1.00 16.38 C ATOM 1111 OH TYR A 77 -8.847 49.323 13.363 1.00 16.12 O ATOM 1112 HA TYR A 77 -7.555 43.346 11.918 1.00 0.00 H ATOM 1113 HB3 TYR A 77 -6.645 45.045 9.574 1.00 0.00 H ATOM 1114 HB2 TYR A 77 -5.651 44.667 11.000 1.00 0.00 H ATOM 1115 HD2 TYR A 77 -7.623 47.150 9.581 1.00 0.00 H ATOM 1116 HE2 TYR A 77 -8.493 49.138 10.771 1.00 0.00 H ATOM 1117 HE1 TYR A 77 -8.030 47.098 14.546 1.00 0.00 H ATOM 1118 HD1 TYR A 77 -7.072 45.144 13.342 1.00 0.00 H ATOM 1119 HH TYR A 77 -8.289 50.118 13.172 1.00 0.00 H ATOM 1120 H TYR A 77 -6.621 42.324 9.244 1.00 0.00 H ATOM 1121 N SER A 78 -9.863 43.547 11.035 1.00 19.37 N ATOM 1122 CA SER A 78 -11.236 43.689 10.601 1.00 22.70 C ATOM 1123 C SER A 78 -11.536 42.899 9.307 1.00 21.75 C ATOM 1124 O SER A 78 -12.016 43.444 8.333 1.00 20.63 O ATOM 1125 CB SER A 78 -11.551 45.179 10.404 1.00 20.69 C ATOM 1126 OG SER A 78 -12.945 45.333 10.310 1.00 23.71 O ATOM 1127 HA SER A 78 -11.876 43.268 11.376 1.00 0.00 H ATOM 1128 HB2 SER A 78 -11.079 45.537 9.489 1.00 0.00 H ATOM 1129 HB3 SER A 78 -11.174 45.750 11.253 1.00 0.00 H ATOM 1130 HG SER A 78 -13.282 44.811 9.539 1.00 0.00 H ATOM 1131 H SER A 78 -9.679 43.319 12.033 1.00 0.00 H ATOM 1132 N GLY A 79 -11.216 41.617 9.294 1.00 22.06 N ATOM 1133 CA GLY A 79 -11.537 40.787 8.166 1.00 24.86 C ATOM 1134 C GLY A 79 -10.556 40.724 7.002 1.00 24.95 C ATOM 1135 O GLY A 79 -10.718 39.864 6.159 1.00 30.32 O ATOM 1136 HA3 GLY A 79 -12.487 41.141 7.766 1.00 0.00 H ATOM 1137 HA2 GLY A 79 -11.658 39.770 8.539 1.00 0.00 H ATOM 1138 H GLY A 79 -10.725 41.203 10.112 1.00 0.00 H ATOM 1139 N SER A 80 -9.584 41.619 6.930 1.00 21.19 N ATOM 1140 CA SER A 80 -8.535 41.573 5.924 1.00 20.60 C ATOM 1141 C SER A 80 -7.156 41.228 6.531 1.00 20.83 C ATOM 1142 O SER A 80 -6.875 41.558 7.707 1.00 19.20 O ATOM 1143 CB SER A 80 -8.409 42.930 5.262 1.00 24.01 C ATOM 1144 OG SER A 80 -9.626 43.333 4.683 1.00 30.07 O ATOM 1145 HA SER A 80 -8.815 40.798 5.211 1.00 0.00 H ATOM 1146 HB2 SER A 80 -7.647 42.877 4.485 1.00 0.00 H ATOM 1147 HB3 SER A 80 -8.112 43.664 6.011 1.00 0.00 H ATOM 1148 HG SER A 80 -9.899 42.672 3.998 1.00 0.00 H ATOM 1149 H SER A 80 -9.570 42.392 7.626 1.00 0.00 H ATOM 1150 N SER A 81 -6.296 40.608 5.713 1.00 18.28 N ATOM 1151 CA SER A 81 -4.965 40.199 6.127 1.00 15.78 C ATOM 1152 C SER A 81 -3.847 40.976 5.451 1.00 16.12 C ATOM 1153 O SER A 81 -3.951 41.334 4.283 1.00 15.28 O ATOM 1154 CB SER A 81 -4.787 38.708 5.894 1.00 18.85 C ATOM 1155 OG SER A 81 -5.810 37.984 6.560 1.00 21.76 O ATOM 1156 HA SER A 81 -4.888 40.426 7.190 1.00 0.00 H ATOM 1157 HB2 SER A 81 -3.816 38.396 6.278 1.00 0.00 H ATOM 1158 HB3 SER A 81 -4.837 38.502 4.825 1.00 0.00 H ATOM 1159 HG SER A 81 -6.693 38.265 6.210 1.00 0.00 H ATOM 1160 H SER A 81 -6.595 40.410 4.737 1.00 0.00 H ATOM 1161 N TYR A 82 -2.768 41.212 6.209 1.00 16.71 N ATOM 1162 CA TYR A 82 -1.630 42.018 5.799 1.00 15.85 C ATOM 1163 C TYR A 82 -0.332 41.410 6.332 1.00 18.14 C ATOM 1164 O TYR A 82 -0.337 40.665 7.295 1.00 16.70 O ATOM 1165 CB TYR A 82 -1.749 43.434 6.352 1.00 16.83 C ATOM 1166 CG TYR A 82 -3.108 44.086 6.132 1.00 19.91 C ATOM 1167 CD1 TYR A 82 -4.174 43.863 7.030 1.00 16.64 C ATOM 1168 CD2 TYR A 82 -3.331 44.925 5.024 1.00 18.32 C ATOM 1169 CE1 TYR A 82 -5.379 44.441 6.829 1.00 17.10 C ATOM 1170 CE2 TYR A 82 -4.553 45.498 4.803 1.00 17.98 C ATOM 1171 CZ TYR A 82 -5.569 45.276 5.722 1.00 19.14 C ATOM 1172 OH TYR A 82 -6.806 45.851 5.503 1.00 18.32 O ATOM 1173 HA TYR A 82 -1.617 42.044 4.709 1.00 0.00 H ATOM 1174 HB3 TYR A 82 -0.992 44.053 5.870 1.00 0.00 H ATOM 1175 HB2 TYR A 82 -1.558 43.398 7.425 1.00 0.00 H ATOM 1176 HD2 TYR A 82 -2.515 45.122 4.329 1.00 0.00 H ATOM 1177 HE2 TYR A 82 -4.726 46.117 3.922 1.00 0.00 H ATOM 1178 HE1 TYR A 82 -6.198 44.258 7.525 1.00 0.00 H ATOM 1179 HD1 TYR A 82 -4.024 43.217 7.895 1.00 0.00 H ATOM 1180 HH TYR A 82 -7.419 45.602 6.239 1.00 0.00 H ATOM 1181 H TYR A 82 -2.743 40.788 7.158 1.00 0.00 H ATOM 1182 N PRO A 83 0.800 41.731 5.694 1.00 18.35 N ATOM 1183 CA PRO A 83 2.075 41.311 6.256 1.00 18.67 C ATOM 1184 C PRO A 83 2.253 41.862 7.660 1.00 18.13 C ATOM 1185 O PRO A 83 1.776 42.954 7.976 1.00 16.42 O ATOM 1186 CB PRO A 83 3.109 41.982 5.339 1.00 19.57 C ATOM 1187 CG PRO A 83 2.412 42.298 4.107 1.00 20.36 C ATOM 1188 CD PRO A 83 0.966 42.512 4.460 1.00 18.06 C ATOM 1189 HA PRO A 83 2.161 40.226 6.314 1.00 0.00 H ATOM 1190 HD3 PRO A 83 0.758 43.568 4.635 1.00 0.00 H ATOM 1191 HD2 PRO A 83 0.312 42.140 3.671 1.00 0.00 H ATOM 1192 HG3 PRO A 83 2.507 41.473 3.401 1.00 0.00 H ATOM 1193 HG2 PRO A 83 2.827 43.203 3.664 1.00 0.00 H ATOM 1194 HB2 PRO A 83 3.491 42.892 5.802 1.00 0.00 H ATOM 1195 HB3 PRO A 83 3.937 41.301 5.141 1.00 0.00 H ATOM 1196 N PHE A 84 2.956 41.117 8.493 1.00 18.64 N ATOM 1197 CA PHE A 84 3.370 41.627 9.775 1.00 20.30 C ATOM 1198 C PHE A 84 4.835 41.311 9.959 1.00 20.94 C ATOM 1199 O PHE A 84 5.229 40.149 9.860 1.00 21.38 O ATOM 1200 CB PHE A 84 2.562 41.001 10.911 1.00 19.52 C ATOM 1201 CG PHE A 84 3.029 41.454 12.268 1.00 18.61 C ATOM 1202 CD1 PHE A 84 2.708 42.710 12.737 1.00 18.91 C ATOM 1203 CD2 PHE A 84 3.838 40.639 13.053 1.00 22.04 C ATOM 1204 CE1 PHE A 84 3.184 43.156 13.995 1.00 20.39 C ATOM 1205 CE2 PHE A 84 4.306 41.076 14.320 1.00 20.65 C ATOM 1206 CZ PHE A 84 3.986 42.335 14.768 1.00 17.80 C ATOM 1207 HA PHE A 84 3.200 42.703 9.802 1.00 0.00 H ATOM 1208 HB2 PHE A 84 1.515 41.279 10.790 1.00 0.00 H ATOM 1209 HB3 PHE A 84 2.657 39.917 10.852 1.00 0.00 H ATOM 1210 HD2 PHE A 84 4.117 39.650 12.690 1.00 0.00 H ATOM 1211 HE2 PHE A 84 4.917 40.415 14.935 1.00 0.00 H ATOM 1212 HZ PHE A 84 4.363 42.686 15.729 1.00 0.00 H ATOM 1213 HE1 PHE A 84 2.917 44.150 14.355 1.00 0.00 H ATOM 1214 HD1 PHE A 84 2.081 43.367 12.134 1.00 0.00 H ATOM 1215 H PHE A 84 3.215 40.148 8.220 1.00 0.00 H ATOM 1216 N PRO A 85 5.667 42.328 10.226 1.00 23.54 N ATOM 1217 CA PRO A 85 5.432 43.770 10.372 1.00 21.69 C ATOM 1218 C PRO A 85 4.730 44.388 9.184 1.00 20.34 C ATOM 1219 O PRO A 85 4.849 43.913 8.048 1.00 20.02 O ATOM 1220 CB PRO A 85 6.842 44.351 10.493 1.00 22.69 C ATOM 1221 CG PRO A 85 7.649 43.227 11.060 1.00 25.39 C ATOM 1222 CD PRO A 85 7.091 41.993 10.433 1.00 24.25 C ATOM 1223 HA PRO A 85 4.781 43.974 11.222 1.00 0.00 H ATOM 1224 HD3 PRO A 85 7.584 41.780 9.484 1.00 0.00 H ATOM 1225 HD2 PRO A 85 7.198 41.135 11.097 1.00 0.00 H ATOM 1226 HG3 PRO A 85 7.542 43.188 12.144 1.00 0.00 H ATOM 1227 HG2 PRO A 85 8.702 43.344 10.804 1.00 0.00 H ATOM 1228 HB2 PRO A 85 7.224 44.648 9.516 1.00 0.00 H ATOM 1229 HB3 PRO A 85 6.851 45.211 11.163 1.00 0.00 H ATOM 1230 N THR A 86 3.983 45.450 9.455 1.00 19.13 N ATOM 1231 CA THR A 86 3.092 46.011 8.448 1.00 19.27 C ATOM 1232 C THR A 86 3.882 46.888 7.459 1.00 19.44 C ATOM 1233 O THR A 86 4.961 47.375 7.774 1.00 17.81 O ATOM 1234 CB THR A 86 1.956 46.820 9.123 1.00 19.08 C ATOM 1235 OG1 THR A 86 2.533 47.855 9.924 1.00 17.74 O ATOM 1236 CG2 THR A 86 1.074 45.913 10.023 1.00 17.78 C ATOM 1237 HA THR A 86 2.639 45.193 7.887 1.00 0.00 H ATOM 1238 HB THR A 86 1.325 47.245 8.342 1.00 0.00 H ATOM 1239 HG1 THR A 86 3.073 48.453 9.349 1.00 0.00 H ATOM 1240 HG23 THR A 86 0.632 45.122 9.417 1.00 0.00 H ATOM 1241 HG21 THR A 86 1.690 45.471 10.806 1.00 0.00 H ATOM 1242 HG22 THR A 86 0.283 46.511 10.475 1.00 0.00 H ATOM 1243 H THR A 86 4.034 45.887 10.397 1.00 0.00 H ATOM 1244 N THR A 87 3.315 47.090 6.274 1.00 17.03 N ATOM 1245 CA THR A 87 3.947 47.893 5.233 1.00 20.16 C ATOM 1246 C THR A 87 3.177 49.200 4.975 1.00 22.27 C ATOM 1247 O THR A 87 3.671 50.080 4.309 1.00 25.93 O ATOM 1248 CB THR A 87 4.067 47.095 3.909 1.00 21.37 C ATOM 1249 OG1 THR A 87 2.771 46.670 3.460 1.00 21.28 O ATOM 1250 CG2 THR A 87 4.920 45.873 4.111 1.00 22.20 C ATOM 1251 HA THR A 87 4.945 48.144 5.592 1.00 0.00 H ATOM 1252 HB THR A 87 4.522 47.749 3.165 1.00 0.00 H ATOM 1253 HG1 THR A 87 2.358 46.092 4.149 1.00 0.00 H ATOM 1254 HG23 THR A 87 5.910 46.175 4.453 1.00 0.00 H ATOM 1255 HG21 THR A 87 4.457 45.228 4.858 1.00 0.00 H ATOM 1256 HG22 THR A 87 5.009 45.333 3.168 1.00 0.00 H ATOM 1257 H THR A 87 2.388 46.660 6.082 1.00 0.00 H ATOM 1258 N SER A 88 1.959 49.321 5.487 1.00 21.57 N ATOM 1259 CA SER A 88 1.237 50.593 5.409 1.00 23.64 C ATOM 1260 C SER A 88 0.071 50.566 6.395 1.00 20.47 C ATOM 1261 O SER A 88 -0.336 49.495 6.846 1.00 20.60 O ATOM 1262 CB SER A 88 0.693 50.836 3.991 1.00 22.89 C ATOM 1263 OG SER A 88 -0.360 49.926 3.724 1.00 24.91 O ATOM 1264 HA SER A 88 1.928 51.399 5.656 1.00 0.00 H ATOM 1265 HB2 SER A 88 1.493 50.689 3.265 1.00 0.00 H ATOM 1266 HB3 SER A 88 0.319 51.857 3.916 1.00 0.00 H ATOM 1267 HG SER A 88 -0.708 50.085 2.811 1.00 0.00 H ATOM 1268 H SER A 88 1.512 48.503 5.949 1.00 0.00 H ATOM 1269 N GLU A 89 -0.463 51.738 6.712 1.00 18.24 N ATOM 1270 CA GLU A 89 -1.673 51.860 7.496 1.00 17.50 C ATOM 1271 C GLU A 89 -2.896 51.179 6.826 1.00 19.70 C ATOM 1272 O GLU A 89 -3.097 51.295 5.613 1.00 18.72 O ATOM 1273 CB GLU A 89 -1.950 53.333 7.704 1.00 17.36 C ATOM 1274 CG GLU A 89 -3.195 53.655 8.545 1.00 20.23 C ATOM 1275 CD GLU A 89 -3.338 55.158 8.816 1.00 27.56 C ATOM 1276 OE1 GLU A 89 -2.801 55.976 8.031 1.00 34.63 O ATOM 1277 OE2 GLU A 89 -4.023 55.534 9.783 1.00 27.14 O ATOM 1278 HA GLU A 89 -1.520 51.348 8.446 1.00 0.00 H ATOM 1279 HB2 GLU A 89 -1.085 53.772 8.201 1.00 0.00 H ATOM 1280 HB3 GLU A 89 -2.077 53.794 6.724 1.00 0.00 H ATOM 1281 HG2 GLU A 89 -4.079 53.309 8.010 1.00 0.00 H ATOM 1282 HG3 GLU A 89 -3.120 53.132 9.498 1.00 0.00 H ATOM 1283 H GLU A 89 0.008 52.605 6.383 1.00 0.00 H ATOM 1284 N THR A 90 -3.708 50.482 7.621 1.00 18.10 N ATOM 1285 CA THR A 90 -4.895 49.771 7.123 1.00 17.83 C ATOM 1286 C THR A 90 -6.027 50.713 6.772 1.00 17.04 C ATOM 1287 O THR A 90 -5.953 51.917 7.056 1.00 17.71 O ATOM 1288 CB THR A 90 -5.476 48.820 8.193 1.00 18.33 C ATOM 1289 OG1 THR A 90 -5.903 49.580 9.321 1.00 17.01 O ATOM 1290 CG2 THR A 90 -4.454 47.822 8.661 1.00 19.50 C ATOM 1291 HA THR A 90 -4.546 49.231 6.243 1.00 0.00 H ATOM 1292 HB THR A 90 -6.311 48.285 7.740 1.00 0.00 H ATOM 1293 HG1 THR A 90 -6.599 50.225 9.039 1.00 0.00 H ATOM 1294 HG23 THR A 90 -4.113 47.228 7.813 1.00 0.00 H ATOM 1295 HG21 THR A 90 -3.608 48.350 9.101 1.00 0.00 H ATOM 1296 HG22 THR A 90 -4.903 47.167 9.407 1.00 0.00 H ATOM 1297 H THR A 90 -3.493 50.439 8.638 1.00 0.00 H ATOM 1298 N PRO A 91 -7.081 50.177 6.132 1.00 17.08 N ATOM 1299 CA PRO A 91 -8.352 50.904 6.068 1.00 17.69 C ATOM 1300 C PRO A 91 -8.943 51.046 7.475 1.00 18.94 C ATOM 1301 O PRO A 91 -8.570 50.360 8.431 1.00 17.39 O ATOM 1302 CB PRO A 91 -9.262 49.997 5.216 1.00 17.09 C ATOM 1303 CG PRO A 91 -8.319 49.113 4.447 1.00 19.54 C ATOM 1304 CD PRO A 91 -7.116 48.934 5.341 1.00 19.51 C ATOM 1305 HA PRO A 91 -8.242 51.907 5.655 1.00 0.00 H ATOM 1306 HD3 PRO A 91 -7.237 48.065 5.987 1.00 0.00 H ATOM 1307 HD2 PRO A 91 -6.206 48.822 4.751 1.00 0.00 H ATOM 1308 HG3 PRO A 91 -8.030 49.588 3.509 1.00 0.00 H ATOM 1309 HG2 PRO A 91 -8.785 48.150 4.237 1.00 0.00 H ATOM 1310 HB2 PRO A 91 -9.914 49.400 5.854 1.00 0.00 H ATOM 1311 HB3 PRO A 91 -9.869 50.594 4.535 1.00 0.00 H ATOM 1312 N ARG A 92 -9.889 51.948 7.582 1.00 19.57 N ATOM 1313 CA ARG A 92 -10.466 52.265 8.869 1.00 22.24 C ATOM 1314 C ARG A 92 -11.651 51.388 9.256 1.00 21.19 C ATOM 1315 O ARG A 92 -12.252 50.704 8.427 1.00 22.67 O ATOM 1316 CB ARG A 92 -10.837 53.735 8.915 1.00 22.22 C ATOM 1317 CG ARG A 92 -11.948 54.094 8.008 1.00 25.14 C ATOM 1318 CD ARG A 92 -11.867 55.533 7.677 1.00 25.77 C ATOM 1319 NE ARG A 92 -13.165 55.955 7.157 1.00 30.53 N ATOM 1320 CZ ARG A 92 -13.416 57.175 6.685 1.00 32.03 C ATOM 1321 NH1 ARG A 92 -12.454 58.101 6.672 1.00 32.03 N ATOM 1322 NH2 ARG A 92 -14.629 57.462 6.247 1.00 33.78 N ATOM 1323 HA ARG A 92 -9.700 52.050 9.614 1.00 0.00 H ATOM 1324 HB2 ARG A 92 -11.130 53.985 9.935 1.00 0.00 H ATOM 1325 HB3 ARG A 92 -9.961 54.321 8.636 1.00 0.00 H ATOM 1326 HG2 ARG A 92 -11.876 53.506 7.093 1.00 0.00 H ATOM 1327 HG3 ARG A 92 -12.899 53.886 8.498 1.00 0.00 H ATOM 1328 HD2 ARG A 92 -11.096 55.696 6.923 1.00 0.00 H ATOM 1329 HD3 ARG A 92 -11.624 56.105 8.573 1.00 0.00 H ATOM 1330 HE ARG A 92 -13.940 55.261 7.155 1.00 0.00 H ATOM 1331 HH12 ARG A 92 -12.653 59.053 6.303 1.00 0.00 H ATOM 1332 HH11 ARG A 92 -11.506 57.871 7.031 1.00 0.00 H ATOM 1333 HH22 ARG A 92 -14.837 58.411 5.876 1.00 0.00 H ATOM 1334 HH21 ARG A 92 -15.376 56.739 6.273 1.00 0.00 H ATOM 1335 H ARG A 92 -10.228 52.441 6.731 1.00 0.00 H ATOM 1336 N VAL A 93 -11.902 51.381 10.562 1.00 19.80 N ATOM 1337 CA VAL A 93 -13.021 50.688 11.182 1.00 18.81 C ATOM 1338 C VAL A 93 -13.828 51.781 11.883 1.00 20.11 C ATOM 1339 O VAL A 93 -13.264 52.707 12.477 1.00 18.53 O ATOM 1340 CB VAL A 93 -12.528 49.659 12.207 1.00 18.45 C ATOM 1341 CG1 VAL A 93 -13.686 49.101 13.066 1.00 21.28 C ATOM 1342 CG2 VAL A 93 -11.767 48.538 11.516 1.00 19.85 C ATOM 1343 HA VAL A 93 -13.612 50.142 10.447 1.00 0.00 H ATOM 1344 HB VAL A 93 -11.845 50.170 12.886 1.00 0.00 H ATOM 1345 HG11 VAL A 93 -14.164 49.919 13.605 1.00 0.00 H ATOM 1346 HG12 VAL A 93 -14.416 48.616 12.418 1.00 0.00 H ATOM 1347 HG13 VAL A 93 -13.292 48.376 13.778 1.00 0.00 H ATOM 1348 HG21 VAL A 93 -12.424 48.040 10.803 1.00 0.00 H ATOM 1349 HG22 VAL A 93 -10.907 48.954 10.991 1.00 0.00 H ATOM 1350 HG23 VAL A 93 -11.426 47.819 12.261 1.00 0.00 H ATOM 1351 H VAL A 93 -11.254 51.907 11.183 1.00 0.00 H ATOM 1352 N VAL A 94 -15.147 51.699 11.784 1.00 21.58 N ATOM 1353 CA VAL A 94 -15.995 52.750 12.346 1.00 22.96 C ATOM 1354 C VAL A 94 -16.388 52.405 13.778 1.00 20.69 C ATOM 1355 O VAL A 94 -16.765 51.286 14.066 1.00 22.74 O ATOM 1356 CB VAL A 94 -17.253 53.001 11.450 1.00 25.48 C ATOM 1357 CG1 VAL A 94 -18.255 53.878 12.159 1.00 26.29 C ATOM 1358 CG2 VAL A 94 -16.849 53.649 10.137 1.00 24.14 C ATOM 1359 HA VAL A 94 -15.424 53.679 12.367 1.00 0.00 H ATOM 1360 HB VAL A 94 -17.715 52.035 11.247 1.00 0.00 H ATOM 1361 HG11 VAL A 94 -18.573 53.392 13.081 1.00 0.00 H ATOM 1362 HG12 VAL A 94 -17.794 54.838 12.393 1.00 0.00 H ATOM 1363 HG13 VAL A 94 -19.119 54.036 11.513 1.00 0.00 H ATOM 1364 HG21 VAL A 94 -16.361 54.602 10.339 1.00 0.00 H ATOM 1365 HG22 VAL A 94 -16.160 52.992 9.606 1.00 0.00 H ATOM 1366 HG23 VAL A 94 -17.737 53.816 9.527 1.00 0.00 H ATOM 1367 H VAL A 94 -15.581 50.884 11.305 1.00 0.00 H ATOM 1368 N TYR A 95 -16.249 53.368 14.682 1.00 22.40 N ATOM 1369 CA TYR A 95 -16.768 53.235 16.050 1.00 22.43 C ATOM 1370 C TYR A 95 -17.885 54.259 16.216 1.00 24.67 C ATOM 1371 O TYR A 95 -17.656 55.474 16.121 1.00 22.53 O ATOM 1372 CB TYR A 95 -15.639 53.411 17.111 1.00 22.59 C ATOM 1373 CG TYR A 95 -14.763 52.186 17.203 1.00 21.87 C ATOM 1374 CD1 TYR A 95 -13.894 51.842 16.157 1.00 21.42 C ATOM 1375 CD2 TYR A 95 -14.838 51.323 18.301 1.00 22.28 C ATOM 1376 CE1 TYR A 95 -13.106 50.656 16.212 1.00 20.31 C ATOM 1377 CE2 TYR A 95 -14.055 50.167 18.370 1.00 23.19 C ATOM 1378 CZ TYR A 95 -13.193 49.834 17.315 1.00 22.62 C ATOM 1379 OH TYR A 95 -12.427 48.676 17.378 1.00 20.83 O ATOM 1380 HA TYR A 95 -17.163 52.232 16.212 1.00 0.00 H ATOM 1381 HB3 TYR A 95 -16.094 53.594 18.084 1.00 0.00 H ATOM 1382 HB2 TYR A 95 -15.023 54.266 16.833 1.00 0.00 H ATOM 1383 HD2 TYR A 95 -15.520 51.556 19.119 1.00 0.00 H ATOM 1384 HE2 TYR A 95 -14.115 49.522 19.247 1.00 0.00 H ATOM 1385 HE1 TYR A 95 -12.440 50.401 15.388 1.00 0.00 H ATOM 1386 HD1 TYR A 95 -13.820 52.494 15.286 1.00 0.00 H ATOM 1387 HH TYR A 95 -13.024 47.890 17.455 1.00 0.00 H ATOM 1388 H TYR A 95 -15.757 54.244 14.413 1.00 0.00 H ATOM 1389 N ASN A 96 -19.102 53.756 16.433 1.00 25.31 N ATOM 1390 CA ASN A 96 -20.279 54.603 16.524 1.00 26.34 C ATOM 1391 C ASN A 96 -21.207 54.260 17.698 1.00 29.98 C ATOM 1392 O ASN A 96 -22.410 54.320 17.561 1.00 30.52 O ATOM 1393 CB ASN A 96 -21.062 54.517 15.236 1.00 25.99 C ATOM 1394 CG ASN A 96 -21.354 53.093 14.830 1.00 29.90 C ATOM 1395 OD1 ASN A 96 -21.139 52.142 15.594 1.00 34.33 O ATOM 1396 ND2 ASN A 96 -21.792 52.928 13.596 1.00 34.68 N ATOM 1397 HA ASN A 96 -19.912 55.614 16.701 1.00 0.00 H ATOM 1398 HB2 ASN A 96 -22.007 55.045 15.365 1.00 0.00 H ATOM 1399 HB3 ASN A 96 -20.486 54.995 14.444 1.00 0.00 H ATOM 1400 HD22 ASN A 96 -21.959 53.755 12.989 1.00 0.00 H ATOM 1401 HD21 ASN A 96 -21.970 51.971 13.231 1.00 0.00 H ATOM 1402 H ASN A 96 -19.211 52.727 16.540 1.00 0.00 H ATOM 1403 N SER A 97 -20.643 53.910 18.848 1.00 29.87 N ATOM 1404 CA SER A 97 -21.444 53.458 19.977 1.00 29.88 C ATOM 1405 C SER A 97 -20.673 53.698 21.255 1.00 29.65 C ATOM 1406 O SER A 97 -19.448 53.680 21.228 1.00 26.62 O ATOM 1407 CB SER A 97 -21.734 51.972 19.827 1.00 30.82 C ATOM 1408 OG SER A 97 -22.369 51.453 20.983 1.00 32.43 O ATOM 1409 HA SER A 97 -22.385 54.007 20.008 1.00 0.00 H ATOM 1410 HB2 SER A 97 -20.796 51.441 19.668 1.00 0.00 H ATOM 1411 HB3 SER A 97 -22.385 51.822 18.966 1.00 0.00 H ATOM 1412 HG SER A 97 -22.545 50.487 20.856 1.00 0.00 H ATOM 1413 H SER A 97 -19.609 53.960 18.944 1.00 0.00 H ATOM 1414 N ARG A 98 -21.369 53.939 22.374 1.00 31.41 N ATOM 1415 CA ARG A 98 -20.676 54.065 23.661 1.00 33.83 C ATOM 1416 C ARG A 98 -20.376 52.677 24.240 1.00 30.04 C ATOM 1417 O ARG A 98 -19.620 52.567 25.190 1.00 28.67 O ATOM 1418 CB ARG A 98 -21.451 54.892 24.709 1.00 36.40 C ATOM 1419 CG ARG A 98 -21.559 56.351 24.421 1.00 39.20 C ATOM 1420 CD ARG A 98 -21.986 57.163 25.664 1.00 46.66 C ATOM 1421 NE ARG A 98 -22.352 58.529 25.276 1.00 51.10 N ATOM 1422 CZ ARG A 98 -23.456 58.825 24.582 1.00 55.31 C ATOM 1423 NH1 ARG A 98 -24.307 57.856 24.213 1.00 58.37 N ATOM 1424 NH2 ARG A 98 -23.717 60.084 24.244 1.00 52.41 N ATOM 1425 HA ARG A 98 -19.753 54.605 23.449 1.00 0.00 H ATOM 1426 HB2 ARG A 98 -22.461 54.487 24.778 1.00 0.00 H ATOM 1427 HB3 ARG A 98 -20.948 54.775 25.669 1.00 0.00 H ATOM 1428 HG2 ARG A 98 -20.589 56.714 24.081 1.00 0.00 H ATOM 1429 HG3 ARG A 98 -22.298 56.500 23.634 1.00 0.00 H ATOM 1430 HD2 ARG A 98 -21.158 57.199 26.372 1.00 0.00 H ATOM 1431 HD3 ARG A 98 -22.843 56.680 26.133 1.00 0.00 H ATOM 1432 HE ARG A 98 -21.721 59.307 25.555 1.00 0.00 H ATOM 1433 HH12 ARG A 98 -25.164 58.094 23.673 1.00 0.00 H ATOM 1434 HH11 ARG A 98 -24.110 56.867 24.467 1.00 0.00 H ATOM 1435 HH22 ARG A 98 -24.577 60.310 23.704 1.00 0.00 H ATOM 1436 HH21 ARG A 98 -23.061 60.843 24.519 1.00 0.00 H ATOM 1437 H ARG A 98 -22.403 54.037 22.330 1.00 0.00 H ATOM 1438 N THR A 99 -20.991 51.643 23.682 1.00 30.00 N ATOM 1439 CA THR A 99 -20.740 50.266 24.103 1.00 33.41 C ATOM 1440 C THR A 99 -19.389 49.757 23.602 1.00 30.11 C ATOM 1441 O THR A 99 -19.134 49.771 22.409 1.00 29.13 O ATOM 1442 CB THR A 99 -21.821 49.325 23.548 1.00 35.02 C ATOM 1443 OG1 THR A 99 -23.045 49.571 24.237 1.00 39.26 O ATOM 1444 CG2 THR A 99 -21.430 47.848 23.733 1.00 32.43 C ATOM 1445 HA THR A 99 -20.750 50.270 25.193 1.00 0.00 H ATOM 1446 HB THR A 99 -21.931 49.519 22.481 1.00 0.00 H ATOM 1447 HG1 THR A 99 -23.747 48.968 23.885 1.00 0.00 H ATOM 1448 HG23 THR A 99 -20.495 47.653 23.209 1.00 0.00 H ATOM 1449 HG21 THR A 99 -21.304 47.637 24.795 1.00 0.00 H ATOM 1450 HG22 THR A 99 -22.216 47.212 23.326 1.00 0.00 H ATOM 1451 H THR A 99 -21.675 51.818 22.919 1.00 0.00 H ATOM 1452 N ASP A 100 -18.538 49.320 24.524 1.00 29.89 N ATOM 1453 CA ASP A 100 -17.255 48.729 24.167 1.00 30.27 C ATOM 1454 C ASP A 100 -17.392 47.772 22.999 1.00 32.03 C ATOM 1455 O ASP A 100 -18.271 46.904 22.984 1.00 30.98 O ATOM 1456 CB ASP A 100 -16.676 47.935 25.322 1.00 35.24 C ATOM 1457 CG ASP A 100 -16.252 48.814 26.476 1.00 41.05 C ATOM 1458 OD1 ASP A 100 -15.647 49.892 26.229 1.00 36.44 O ATOM 1459 OD2 ASP A 100 -16.552 48.420 27.627 1.00 52.15 O ATOM 1460 HA ASP A 100 -16.601 49.561 23.905 1.00 0.00 H ATOM 1461 HB2 ASP A 100 -17.431 47.233 25.676 1.00 0.00 H ATOM 1462 HB3 ASP A 100 -15.807 47.383 24.965 1.00 0.00 H ATOM 1463 H ASP A 100 -18.795 49.402 25.528 1.00 0.00 H ATOM 1464 N LYS A 101 -16.500 47.936 22.035 1.00 24.91 N ATOM 1465 CA LYS A 101 -16.420 47.060 20.893 1.00 25.21 C ATOM 1466 C LYS A 101 -14.956 46.657 20.783 1.00 22.04 C ATOM 1467 O LYS A 101 -14.075 47.485 21.010 1.00 20.40 O ATOM 1468 CB LYS A 101 -16.885 47.861 19.677 1.00 29.33 C ATOM 1469 CG LYS A 101 -16.741 47.235 18.339 1.00 28.19 C ATOM 1470 CD LYS A 101 -16.740 48.367 17.327 1.00 29.94 C ATOM 1471 CE LYS A 101 -17.273 47.944 16.008 1.00 38.72 C ATOM 1472 NZ LYS A 101 -17.132 49.031 15.011 1.00 32.54 N ATOM 1473 HA LYS A 101 -17.040 46.167 20.971 1.00 0.00 H ATOM 1474 HB2 LYS A 101 -17.942 48.084 19.820 1.00 0.00 H ATOM 1475 HB3 LYS A 101 -16.317 48.791 19.664 1.00 0.00 H ATOM 1476 HG2 LYS A 101 -15.805 46.679 18.283 1.00 0.00 H ATOM 1477 HG3 LYS A 101 -17.575 46.560 18.148 1.00 0.00 H ATOM 1478 HD2 LYS A 101 -17.356 49.180 17.710 1.00 0.00 H ATOM 1479 HD3 LYS A 101 -15.717 48.719 17.195 1.00 0.00 H ATOM 1480 HE2 LYS A 101 -18.328 47.690 16.113 1.00 0.00 H ATOM 1481 HE3 LYS A 101 -16.722 47.069 15.663 1.00 0.00 H ATOM 1482 HZ1 LYS A 101 -17.660 49.867 15.334 1.00 0.00 H ATOM 1483 HZ2 LYS A 101 -16.126 49.274 14.905 1.00 0.00 H ATOM 1484 HZ3 LYS A 101 -17.511 48.712 14.097 1.00 0.00 H ATOM 1485 H LYS A 101 -15.830 48.728 22.104 1.00 0.00 H ATOM 1486 N PRO A 102 -14.691 45.385 20.468 1.00 20.75 N ATOM 1487 CA PRO A 102 -13.313 44.894 20.377 1.00 20.99 C ATOM 1488 C PRO A 102 -12.517 45.558 19.250 1.00 20.10 C ATOM 1489 O PRO A 102 -13.065 45.866 18.192 1.00 21.65 O ATOM 1490 CB PRO A 102 -13.492 43.396 20.060 1.00 22.66 C ATOM 1491 CG PRO A 102 -14.889 43.053 20.496 1.00 21.70 C ATOM 1492 CD PRO A 102 -15.681 44.310 20.260 1.00 24.03 C ATOM 1493 HA PRO A 102 -12.756 45.105 21.290 1.00 0.00 H ATOM 1494 HD3 PRO A 102 -16.078 44.336 19.245 1.00 0.00 H ATOM 1495 HD2 PRO A 102 -16.502 44.393 20.972 1.00 0.00 H ATOM 1496 HG3 PRO A 102 -14.907 42.779 21.551 1.00 0.00 H ATOM 1497 HG2 PRO A 102 -15.287 42.230 19.902 1.00 0.00 H ATOM 1498 HB2 PRO A 102 -13.372 43.216 18.992 1.00 0.00 H ATOM 1499 HB3 PRO A 102 -12.764 42.801 20.612 1.00 0.00 H ATOM 1500 N TRP A 103 -11.231 45.773 19.460 1.00 19.83 N ATOM 1501 CA TRP A 103 -10.358 46.188 18.367 1.00 18.53 C ATOM 1502 C TRP A 103 -9.968 44.910 17.625 1.00 18.51 C ATOM 1503 O TRP A 103 -9.287 44.069 18.179 1.00 18.55 O ATOM 1504 CB TRP A 103 -9.127 46.872 18.923 1.00 17.70 C ATOM 1505 CG TRP A 103 -8.313 47.590 17.912 1.00 17.24 C ATOM 1506 CD1 TRP A 103 -8.770 48.326 16.864 1.00 16.47 C ATOM 1507 CD2 TRP A 103 -6.879 47.663 17.865 1.00 16.61 C ATOM 1508 NE1 TRP A 103 -7.719 48.850 16.162 1.00 15.14 N ATOM 1509 CE2 TRP A 103 -6.542 48.450 16.747 1.00 15.93 C ATOM 1510 CE3 TRP A 103 -5.849 47.129 18.657 1.00 16.80 C ATOM 1511 CZ2 TRP A 103 -5.224 48.739 16.410 1.00 14.96 C ATOM 1512 CZ3 TRP A 103 -4.538 47.394 18.313 1.00 15.39 C ATOM 1513 CH2 TRP A 103 -4.232 48.188 17.200 1.00 15.39 C ATOM 1514 HA TRP A 103 -10.854 46.894 17.701 1.00 0.00 H ATOM 1515 HB2 TRP A 103 -9.448 47.592 19.676 1.00 0.00 H ATOM 1516 HB3 TRP A 103 -8.498 46.114 19.391 1.00 0.00 H ATOM 1517 HE1 TRP A 103 -7.798 49.455 15.320 1.00 0.00 H ATOM 1518 HD1 TRP A 103 -9.821 48.477 16.619 1.00 0.00 H ATOM 1519 HZ2 TRP A 103 -4.983 49.374 15.558 1.00 0.00 H ATOM 1520 HH2 TRP A 103 -3.188 48.376 16.951 1.00 0.00 H ATOM 1521 HZ3 TRP A 103 -3.730 46.980 18.916 1.00 0.00 H ATOM 1522 HE3 TRP A 103 -6.081 46.516 19.528 1.00 0.00 H ATOM 1523 H TRP A 103 -10.837 45.645 20.414 1.00 0.00 H ATOM 1524 N PRO A 104 -10.403 44.763 16.368 1.00 17.85 N ATOM 1525 CA PRO A 104 -10.352 43.471 15.665 1.00 19.60 C ATOM 1526 C PRO A 104 -8.992 43.113 15.028 1.00 19.71 C ATOM 1527 O PRO A 104 -8.911 43.031 13.809 1.00 18.24 O ATOM 1528 CB PRO A 104 -11.431 43.631 14.577 1.00 20.05 C ATOM 1529 CG PRO A 104 -11.496 45.103 14.295 1.00 19.86 C ATOM 1530 CD PRO A 104 -11.045 45.822 15.568 1.00 17.61 C ATOM 1531 HA PRO A 104 -10.511 42.651 16.366 1.00 0.00 H ATOM 1532 HD3 PRO A 104 -10.335 46.616 15.334 1.00 0.00 H ATOM 1533 HD2 PRO A 104 -11.899 46.244 16.098 1.00 0.00 H ATOM 1534 HG3 PRO A 104 -12.516 45.392 14.043 1.00 0.00 H ATOM 1535 HG2 PRO A 104 -10.833 45.356 13.467 1.00 0.00 H ATOM 1536 HB2 PRO A 104 -11.151 43.082 13.678 1.00 0.00 H ATOM 1537 HB3 PRO A 104 -12.394 43.268 14.938 1.00 0.00 H ATOM 1538 N VAL A 105 -7.969 42.891 15.854 1.00 18.96 N ATOM 1539 CA VAL A 105 -6.612 42.607 15.413 1.00 17.30 C ATOM 1540 C VAL A 105 -6.185 41.257 15.944 1.00 19.08 C ATOM 1541 O VAL A 105 -6.415 40.942 17.121 1.00 19.73 O ATOM 1542 CB VAL A 105 -5.552 43.641 15.945 1.00 18.90 C ATOM 1543 CG1 VAL A 105 -4.162 43.330 15.381 1.00 19.22 C ATOM 1544 CG2 VAL A 105 -5.882 45.061 15.579 1.00 17.80 C ATOM 1545 HA VAL A 105 -6.638 42.651 14.324 1.00 0.00 H ATOM 1546 HB VAL A 105 -5.568 43.544 17.031 1.00 0.00 H ATOM 1547 HG11 VAL A 105 -3.863 42.328 15.688 1.00 0.00 H ATOM 1548 HG12 VAL A 105 -4.192 43.384 14.293 1.00 0.00 H ATOM 1549 HG13 VAL A 105 -3.445 44.058 15.762 1.00 0.00 H ATOM 1550 HG21 VAL A 105 -5.922 45.155 14.494 1.00 0.00 H ATOM 1551 HG22 VAL A 105 -6.849 45.329 16.004 1.00 0.00 H ATOM 1552 HG23 VAL A 105 -5.113 45.725 15.975 1.00 0.00 H ATOM 1553 H VAL A 105 -8.153 42.923 16.877 1.00 0.00 H ATOM 1554 N ALA A 106 -5.546 40.476 15.076 1.00 17.68 N ATOM 1555 CA ALA A 106 -4.959 39.195 15.438 1.00 19.22 C ATOM 1556 C ALA A 106 -3.666 38.982 14.635 1.00 19.93 C ATOM 1557 O ALA A 106 -3.589 39.318 13.438 1.00 18.56 O ATOM 1558 CB ALA A 106 -5.933 38.057 15.173 1.00 20.66 C ATOM 1559 HA ALA A 106 -4.731 39.202 16.504 1.00 0.00 H ATOM 1560 HB1 ALA A 106 -6.836 38.209 15.764 1.00 0.00 H ATOM 1561 HB2 ALA A 106 -6.189 38.039 14.114 1.00 0.00 H ATOM 1562 HB3 ALA A 106 -5.469 37.111 15.452 1.00 0.00 H ATOM 1563 H ALA A 106 -5.462 40.797 14.090 1.00 0.00 H ATOM 1564 N LEU A 107 -2.653 38.449 15.296 1.00 18.85 N ATOM 1565 CA LEU A 107 -1.394 38.184 14.641 1.00 19.38 C ATOM 1566 C LEU A 107 -1.349 36.708 14.418 1.00 21.98 C ATOM 1567 O LEU A 107 -1.742 35.948 15.301 1.00 20.65 O ATOM 1568 CB LEU A 107 -0.224 38.558 15.527 1.00 19.61 C ATOM 1569 CG LEU A 107 -0.241 39.953 16.106 1.00 20.96 C ATOM 1570 CD1 LEU A 107 0.920 40.066 17.091 1.00 18.73 C ATOM 1571 CD2 LEU A 107 -0.171 40.999 14.983 1.00 21.20 C ATOM 1572 HA LEU A 107 -1.322 38.762 13.720 1.00 0.00 H ATOM 1573 HB2 LEU A 107 -0.198 37.854 16.358 1.00 0.00 H ATOM 1574 HB3 LEU A 107 0.686 38.454 14.936 1.00 0.00 H ATOM 1575 HG LEU A 107 -1.172 40.145 16.640 1.00 0.00 H ATOM 1576 HD21 LEU A 107 0.749 40.860 14.416 1.00 0.00 H ATOM 1577 HD22 LEU A 107 -1.029 40.878 14.321 1.00 0.00 H ATOM 1578 HD23 LEU A 107 -0.184 41.998 15.418 1.00 0.00 H ATOM 1579 HD11 LEU A 107 0.797 39.327 17.882 1.00 0.00 H ATOM 1580 HD12 LEU A 107 1.858 39.886 16.567 1.00 0.00 H ATOM 1581 HD13 LEU A 107 0.931 41.066 17.525 1.00 0.00 H ATOM 1582 H LEU A 107 -2.765 38.217 16.304 1.00 0.00 H ATOM 1583 N TYR A 108 -0.852 36.308 13.251 1.00 21.23 N ATOM 1584 CA TYR A 108 -0.556 34.903 12.945 1.00 24.16 C ATOM 1585 C TYR A 108 0.950 34.774 12.680 1.00 23.97 C ATOM 1586 O TYR A 108 1.470 35.284 11.686 1.00 25.24 O ATOM 1587 CB TYR A 108 -1.366 34.433 11.730 1.00 27.72 C ATOM 1588 CG TYR A 108 -2.874 34.493 11.955 1.00 26.92 C ATOM 1589 CD1 TYR A 108 -3.547 35.701 11.952 1.00 26.68 C ATOM 1590 CD2 TYR A 108 -3.609 33.339 12.207 1.00 31.53 C ATOM 1591 CE1 TYR A 108 -4.933 35.757 12.184 1.00 29.02 C ATOM 1592 CE2 TYR A 108 -4.989 33.384 12.444 1.00 34.57 C ATOM 1593 CZ TYR A 108 -5.643 34.597 12.439 1.00 33.12 C ATOM 1594 OH TYR A 108 -7.008 34.651 12.665 1.00 36.76 O ATOM 1595 HA TYR A 108 -0.837 34.271 13.788 1.00 0.00 H ATOM 1596 HB3 TYR A 108 -1.089 33.403 11.506 1.00 0.00 H ATOM 1597 HB2 TYR A 108 -1.116 35.068 10.880 1.00 0.00 H ATOM 1598 HD2 TYR A 108 -3.099 32.376 12.220 1.00 0.00 H ATOM 1599 HE2 TYR A 108 -5.543 32.464 12.631 1.00 0.00 H ATOM 1600 HE1 TYR A 108 -5.449 36.717 12.163 1.00 0.00 H ATOM 1601 HD1 TYR A 108 -2.995 36.623 11.767 1.00 0.00 H ATOM 1602 HH TYR A 108 -7.311 35.593 12.626 1.00 0.00 H ATOM 1603 H TYR A 108 -0.664 37.024 12.521 1.00 0.00 H ATOM 1604 N LEU A 109 1.641 34.117 13.596 1.00 23.10 N ATOM 1605 CA LEU A 109 3.086 34.046 13.575 1.00 24.98 C ATOM 1606 C LEU A 109 3.491 32.601 13.356 1.00 25.40 C ATOM 1607 O LEU A 109 2.935 31.686 13.963 1.00 28.33 O ATOM 1608 CB LEU A 109 3.655 34.555 14.905 1.00 21.98 C ATOM 1609 CG LEU A 109 3.200 35.942 15.395 1.00 25.02 C ATOM 1610 CD1 LEU A 109 3.792 36.252 16.756 1.00 22.12 C ATOM 1611 CD2 LEU A 109 3.556 37.049 14.436 1.00 23.28 C ATOM 1612 HA LEU A 109 3.479 34.669 12.772 1.00 0.00 H ATOM 1613 HB2 LEU A 109 3.382 33.832 15.674 1.00 0.00 H ATOM 1614 HB3 LEU A 109 4.740 34.585 14.805 1.00 0.00 H ATOM 1615 HG LEU A 109 2.113 35.897 15.462 1.00 0.00 H ATOM 1616 HD21 LEU A 109 4.638 37.081 14.305 1.00 0.00 H ATOM 1617 HD22 LEU A 109 3.078 36.863 13.474 1.00 0.00 H ATOM 1618 HD23 LEU A 109 3.209 38.001 14.837 1.00 0.00 H ATOM 1619 HD11 LEU A 109 3.464 35.500 17.473 1.00 0.00 H ATOM 1620 HD12 LEU A 109 4.880 36.242 16.689 1.00 0.00 H ATOM 1621 HD13 LEU A 109 3.456 37.237 17.081 1.00 0.00 H ATOM 1622 H LEU A 109 1.127 33.633 14.360 1.00 0.00 H ATOM 1623 N THR A 110 4.468 32.391 12.501 1.00 24.48 N ATOM 1624 CA THR A 110 4.906 31.047 12.165 1.00 27.29 C ATOM 1625 C THR A 110 6.436 31.054 12.219 1.00 25.46 C ATOM 1626 O THR A 110 7.068 31.976 11.701 1.00 25.72 O ATOM 1627 CB THR A 110 4.351 30.604 10.744 1.00 30.76 C ATOM 1628 OG1 THR A 110 4.569 29.201 10.522 1.00 36.51 O ATOM 1629 CG2 THR A 110 4.998 31.399 9.597 1.00 33.08 C ATOM 1630 HA THR A 110 4.514 30.315 12.871 1.00 0.00 H ATOM 1631 HB THR A 110 3.281 30.814 10.751 1.00 0.00 H ATOM 1632 HG1 THR A 110 4.102 28.681 11.223 1.00 0.00 H ATOM 1633 HG23 THR A 110 4.836 32.465 9.759 1.00 0.00 H ATOM 1634 HG21 THR A 110 6.068 31.192 9.572 1.00 0.00 H ATOM 1635 HG22 THR A 110 4.547 31.101 8.651 1.00 0.00 H ATOM 1636 H THR A 110 4.938 33.205 12.055 1.00 0.00 H ATOM 1637 N PRO A 111 7.037 30.037 12.856 1.00 27.02 N ATOM 1638 CA PRO A 111 8.496 30.009 13.033 1.00 27.54 C ATOM 1639 C PRO A 111 9.222 29.903 11.711 1.00 28.62 C ATOM 1640 O PRO A 111 8.728 29.181 10.846 1.00 32.30 O ATOM 1641 CB PRO A 111 8.734 28.732 13.841 1.00 29.36 C ATOM 1642 CG PRO A 111 7.390 28.406 14.471 1.00 30.44 C ATOM 1643 CD PRO A 111 6.377 28.879 13.490 1.00 29.67 C ATOM 1644 HA PRO A 111 8.862 30.917 13.512 1.00 0.00 H ATOM 1645 HD3 PRO A 111 6.153 28.106 12.755 1.00 0.00 H ATOM 1646 HD2 PRO A 111 5.457 29.179 13.992 1.00 0.00 H ATOM 1647 HG3 PRO A 111 7.276 28.928 15.421 1.00 0.00 H ATOM 1648 HG2 PRO A 111 7.294 27.333 14.634 1.00 0.00 H ATOM 1649 HB2 PRO A 111 9.058 27.921 13.189 1.00 0.00 H ATOM 1650 HB3 PRO A 111 9.487 28.901 14.611 1.00 0.00 H ATOM 1651 N VAL A 112 10.328 30.627 11.557 1.00 27.39 N ATOM 1652 CA VAL A 112 11.232 30.490 10.413 1.00 32.45 C ATOM 1653 C VAL A 112 12.103 29.241 10.604 1.00 37.22 C ATOM 1654 O VAL A 112 12.118 28.656 11.691 1.00 33.95 O ATOM 1655 CB VAL A 112 12.140 31.720 10.266 1.00 35.00 C ATOM 1656 CG1 VAL A 112 11.299 33.003 10.088 1.00 30.77 C ATOM 1657 CG2 VAL A 112 13.107 31.850 11.480 1.00 33.33 C ATOM 1658 HA VAL A 112 10.628 30.400 9.510 1.00 0.00 H ATOM 1659 HB VAL A 112 12.747 31.586 9.370 1.00 0.00 H ATOM 1660 HG11 VAL A 112 10.683 32.911 9.194 1.00 0.00 H ATOM 1661 HG12 VAL A 112 10.659 33.140 10.959 1.00 0.00 H ATOM 1662 HG13 VAL A 112 11.964 33.861 9.986 1.00 0.00 H ATOM 1663 HG21 VAL A 112 12.526 31.952 12.396 1.00 0.00 H ATOM 1664 HG22 VAL A 112 13.732 30.959 11.542 1.00 0.00 H ATOM 1665 HG23 VAL A 112 13.737 32.729 11.348 1.00 0.00 H ATOM 1666 H VAL A 112 10.563 31.328 12.289 1.00 0.00 H ATOM 1667 N SER A 113 12.836 28.839 9.567 1.00 38.75 N ATOM 1668 CA SER A 113 13.582 27.569 9.610 1.00 42.25 C ATOM 1669 C SER A 113 14.724 27.571 10.635 1.00 40.97 C ATOM 1670 O SER A 113 15.014 26.532 11.242 1.00 39.81 O ATOM 1671 CB SER A 113 14.138 27.173 8.230 1.00 46.03 C ATOM 1672 OG SER A 113 13.102 26.915 7.280 1.00 52.89 O ATOM 1673 HA SER A 113 12.848 26.827 9.925 1.00 0.00 H ATOM 1674 HB2 SER A 113 14.744 26.274 8.341 1.00 0.00 H ATOM 1675 HB3 SER A 113 14.761 27.986 7.857 1.00 0.00 H ATOM 1676 HG SER A 113 13.507 26.665 6.412 1.00 0.00 H ATOM 1677 H SER A 113 12.883 29.431 8.713 1.00 0.00 H ATOM 1678 N SER A 114 15.351 28.727 10.849 1.00 38.12 N ATOM 1679 CA SER A 114 16.412 28.832 11.857 1.00 40.59 C ATOM 1680 C SER A 114 15.931 28.726 13.322 1.00 41.33 C ATOM 1681 O SER A 114 16.752 28.518 14.232 1.00 42.56 O ATOM 1682 CB SER A 114 17.206 30.130 11.677 1.00 41.02 C ATOM 1683 OG SER A 114 16.408 31.267 11.962 1.00 44.24 O ATOM 1684 HA SER A 114 17.046 27.963 11.681 1.00 0.00 H ATOM 1685 HB2 SER A 114 17.557 30.192 10.647 1.00 0.00 H ATOM 1686 HB3 SER A 114 18.062 30.119 12.351 1.00 0.00 H ATOM 1687 HG SER A 114 16.948 32.087 11.837 1.00 0.00 H ATOM 1688 H SER A 114 15.085 29.566 10.294 1.00 0.00 H ATOM 1689 N ALA A 115 14.624 28.870 13.557 1.00 39.48 N ATOM 1690 CA ALA A 115 14.082 28.806 14.917 1.00 36.98 C ATOM 1691 C ALA A 115 14.265 27.421 15.526 1.00 36.44 C ATOM 1692 O ALA A 115 14.109 26.403 14.846 1.00 37.96 O ATOM 1693 CB ALA A 115 12.607 29.181 14.927 1.00 31.50 C ATOM 1694 HA ALA A 115 14.637 29.523 15.522 1.00 0.00 H ATOM 1695 HB1 ALA A 115 12.489 30.196 14.548 1.00 0.00 H ATOM 1696 HB2 ALA A 115 12.053 28.488 14.294 1.00 0.00 H ATOM 1697 HB3 ALA A 115 12.226 29.126 15.947 1.00 0.00 H ATOM 1698 H ALA A 115 13.978 29.031 12.758 1.00 0.00 H ATOM 1699 N GLY A 116 14.557 27.405 16.818 1.00 35.88 N ATOM 1700 CA GLY A 116 14.701 26.180 17.579 1.00 37.44 C ATOM 1701 C GLY A 116 15.049 26.517 19.010 1.00 32.87 C ATOM 1702 O GLY A 116 15.736 27.481 19.276 1.00 38.78 O ATOM 1703 HA3 GLY A 116 15.495 25.573 17.145 1.00 0.00 H ATOM 1704 HA2 GLY A 116 13.764 25.623 17.554 1.00 0.00 H ATOM 1705 H GLY A 116 14.689 28.313 17.308 1.00 0.00 H ATOM 1706 N GLY A 117 14.578 25.732 19.955 1.00 36.41 N ATOM 1707 CA GLY A 117 14.770 26.081 21.346 1.00 33.53 C ATOM 1708 C GLY A 117 13.784 27.162 21.742 1.00 31.43 C ATOM 1709 O GLY A 117 12.730 27.319 21.101 1.00 31.56 O ATOM 1710 HA3 GLY A 117 15.787 26.446 21.491 1.00 0.00 H ATOM 1711 HA2 GLY A 117 14.610 25.199 21.967 1.00 0.00 H ATOM 1712 H GLY A 117 14.068 24.861 19.702 1.00 0.00 H ATOM 1713 N VAL A 118 14.121 27.921 22.781 1.00 28.53 N ATOM 1714 CA VAL A 118 13.231 28.961 23.256 1.00 29.00 C ATOM 1715 C VAL A 118 13.232 30.115 22.240 1.00 28.38 C ATOM 1716 O VAL A 118 14.185 30.900 22.174 1.00 28.92 O ATOM 1717 CB VAL A 118 13.629 29.435 24.670 1.00 27.35 C ATOM 1718 CG1 VAL A 118 12.665 30.491 25.166 1.00 27.25 C ATOM 1719 CG2 VAL A 118 13.622 28.257 25.627 1.00 30.55 C ATOM 1720 HA VAL A 118 12.218 28.567 23.340 1.00 0.00 H ATOM 1721 HB VAL A 118 14.630 29.864 24.623 1.00 0.00 H ATOM 1722 HG11 VAL A 118 12.682 31.344 24.488 1.00 0.00 H ATOM 1723 HG12 VAL A 118 11.658 30.074 25.202 1.00 0.00 H ATOM 1724 HG13 VAL A 118 12.962 30.812 26.164 1.00 0.00 H ATOM 1725 HG21 VAL A 118 12.623 27.823 25.659 1.00 0.00 H ATOM 1726 HG22 VAL A 118 14.334 27.507 25.283 1.00 0.00 H ATOM 1727 HG23 VAL A 118 13.904 28.598 26.623 1.00 0.00 H ATOM 1728 H VAL A 118 15.033 27.766 23.257 1.00 0.00 H ATOM 1729 N ALA A 119 12.173 30.198 21.440 1.00 25.44 N ATOM 1730 CA ALA A 119 12.083 31.222 20.399 1.00 23.36 C ATOM 1731 C ALA A 119 11.429 32.526 20.897 1.00 23.19 C ATOM 1732 O ALA A 119 11.650 33.587 20.338 1.00 22.28 O ATOM 1733 CB ALA A 119 11.362 30.671 19.186 1.00 23.08 C ATOM 1734 HA ALA A 119 13.102 31.486 20.115 1.00 0.00 H ATOM 1735 HB1 ALA A 119 11.911 29.813 18.798 1.00 0.00 H ATOM 1736 HB2 ALA A 119 10.357 30.362 19.472 1.00 0.00 H ATOM 1737 HB3 ALA A 119 11.302 31.443 18.419 1.00 0.00 H ATOM 1738 H ALA A 119 11.392 29.521 21.557 1.00 0.00 H ATOM 1739 N ILE A 120 10.644 32.444 21.959 1.00 23.13 N ATOM 1740 CA ILE A 120 10.112 33.626 22.609 1.00 21.72 C ATOM 1741 C ILE A 120 10.266 33.470 24.121 1.00 21.88 C ATOM 1742 O ILE A 120 9.791 32.488 24.709 1.00 22.48 O ATOM 1743 CB ILE A 120 8.616 33.847 22.243 1.00 21.18 C ATOM 1744 CG1 ILE A 120 8.479 34.109 20.743 1.00 19.87 C ATOM 1745 CG2 ILE A 120 8.004 35.015 23.037 1.00 18.28 C ATOM 1746 CD1 ILE A 120 7.088 34.110 20.259 1.00 17.68 C ATOM 1747 HA ILE A 120 10.668 34.498 22.265 1.00 0.00 H ATOM 1748 HB ILE A 120 8.071 32.941 22.507 1.00 0.00 H ATOM 1749 HG12 ILE A 120 8.919 35.082 20.523 1.00 0.00 H ATOM 1750 HG13 ILE A 120 9.028 33.334 20.208 1.00 0.00 H ATOM 1751 HD11 ILE A 120 6.634 33.139 20.459 1.00 0.00 H ATOM 1752 HD12 ILE A 120 6.526 34.889 20.775 1.00 0.00 H ATOM 1753 HD13 ILE A 120 7.078 34.303 19.186 1.00 0.00 H ATOM 1754 HG21 ILE A 120 8.070 34.801 24.104 1.00 0.00 H ATOM 1755 HG22 ILE A 120 8.552 35.931 22.814 1.00 0.00 H ATOM 1756 HG23 ILE A 120 6.959 35.137 22.753 1.00 0.00 H ATOM 1757 H ILE A 120 10.402 31.506 22.338 1.00 0.00 H ATOM 1758 N LYS A 121 10.914 34.445 24.750 1.00 20.02 N ATOM 1759 CA LYS A 121 11.118 34.422 26.202 1.00 23.96 C ATOM 1760 C LYS A 121 9.938 34.998 26.995 1.00 23.36 C ATOM 1761 O LYS A 121 9.402 36.062 26.641 1.00 18.48 O ATOM 1762 CB LYS A 121 12.362 35.240 26.567 1.00 27.63 C ATOM 1763 CG LYS A 121 13.685 34.520 26.345 1.00 32.91 C ATOM 1764 CD LYS A 121 14.855 35.494 26.394 1.00 42.58 C ATOM 1765 CE LYS A 121 16.063 34.953 25.593 1.00 53.00 C ATOM 1766 NZ LYS A 121 17.143 35.973 25.350 1.00 55.75 N ATOM 1767 HA LYS A 121 11.228 33.371 26.469 1.00 0.00 H ATOM 1768 HB2 LYS A 121 12.363 36.146 25.961 1.00 0.00 H ATOM 1769 HB3 LYS A 121 12.294 35.509 27.621 1.00 0.00 H ATOM 1770 HG2 LYS A 121 13.816 33.767 27.122 1.00 0.00 H ATOM 1771 HG3 LYS A 121 13.667 34.034 25.370 1.00 0.00 H ATOM 1772 HD2 LYS A 121 14.543 36.448 25.968 1.00 0.00 H ATOM 1773 HD3 LYS A 121 15.153 35.641 27.432 1.00 0.00 H ATOM 1774 HE2 LYS A 121 15.703 34.598 24.627 1.00 0.00 H ATOM 1775 HE3 LYS A 121 16.496 34.120 26.147 1.00 0.00 H ATOM 1776 HZ1 LYS A 121 16.750 36.771 24.812 1.00 0.00 H ATOM 1777 HZ2 LYS A 121 17.507 36.315 26.262 1.00 0.00 H ATOM 1778 HZ3 LYS A 121 17.916 35.536 24.809 1.00 0.00 H ATOM 1779 H LYS A 121 11.286 35.245 24.199 1.00 0.00 H ATOM 1780 N ALA A 122 9.579 34.321 28.098 1.00 23.27 N ATOM 1781 CA ALA A 122 8.587 34.840 29.033 1.00 23.51 C ATOM 1782 C ALA A 122 8.884 36.288 29.441 1.00 22.88 C ATOM 1783 O ALA A 122 10.032 36.639 29.796 1.00 21.19 O ATOM 1784 CB ALA A 122 8.521 33.969 30.271 1.00 25.80 C ATOM 1785 HA ALA A 122 7.625 34.824 28.521 1.00 0.00 H ATOM 1786 HB1 ALA A 122 8.244 32.954 29.985 1.00 0.00 H ATOM 1787 HB2 ALA A 122 9.496 33.957 30.758 1.00 0.00 H ATOM 1788 HB3 ALA A 122 7.776 34.371 30.957 1.00 0.00 H ATOM 1789 H ALA A 122 10.021 33.400 28.291 1.00 0.00 H ATOM 1790 N GLY A 123 7.857 37.128 29.372 1.00 20.37 N ATOM 1791 CA GLY A 123 7.982 38.484 29.851 1.00 20.39 C ATOM 1792 C GLY A 123 8.583 39.413 28.810 1.00 21.95 C ATOM 1793 O GLY A 123 8.623 40.620 29.032 1.00 21.98 O ATOM 1794 HA3 GLY A 123 8.622 38.486 30.734 1.00 0.00 H ATOM 1795 HA2 GLY A 123 6.992 38.853 30.120 1.00 0.00 H ATOM 1796 H GLY A 123 6.954 36.805 28.969 1.00 0.00 H ATOM 1797 N SER A 124 9.023 38.884 27.665 1.00 19.50 N ATOM 1798 CA SER A 124 9.695 39.736 26.681 1.00 20.77 C ATOM 1799 C SER A 124 8.688 40.485 25.780 1.00 18.73 C ATOM 1800 O SER A 124 7.568 40.015 25.557 1.00 16.98 O ATOM 1801 CB SER A 124 10.681 38.924 25.822 1.00 20.28 C ATOM 1802 OG SER A 124 10.013 38.054 24.951 1.00 18.56 O ATOM 1803 HA SER A 124 10.257 40.482 27.242 1.00 0.00 H ATOM 1804 HB2 SER A 124 11.325 38.340 26.479 1.00 0.00 H ATOM 1805 HB3 SER A 124 11.290 39.613 25.236 1.00 0.00 H ATOM 1806 HG SER A 124 9.462 37.421 25.477 1.00 0.00 H ATOM 1807 H SER A 124 8.889 37.871 27.473 1.00 0.00 H ATOM 1808 N LEU A 125 9.095 41.664 25.316 1.00 17.03 N ATOM 1809 CA LEU A 125 8.316 42.426 24.346 1.00 18.17 C ATOM 1810 C LEU A 125 8.349 41.697 22.998 1.00 17.75 C ATOM 1811 O LEU A 125 9.417 41.392 22.493 1.00 18.69 O ATOM 1812 CB LEU A 125 8.927 43.837 24.188 1.00 18.23 C ATOM 1813 CG LEU A 125 8.238 44.757 23.186 1.00 19.11 C ATOM 1814 CD1 LEU A 125 6.845 45.073 23.708 1.00 16.31 C ATOM 1815 CD2 LEU A 125 9.045 46.035 22.960 1.00 18.30 C ATOM 1816 HA LEU A 125 7.286 42.518 24.689 1.00 0.00 H ATOM 1817 HB2 LEU A 125 8.898 44.324 25.163 1.00 0.00 H ATOM 1818 HB3 LEU A 125 9.964 43.718 23.873 1.00 0.00 H ATOM 1819 HG LEU A 125 8.166 44.258 22.220 1.00 0.00 H ATOM 1820 HD21 LEU A 125 9.151 46.568 23.905 1.00 0.00 H ATOM 1821 HD22 LEU A 125 10.031 45.777 22.574 1.00 0.00 H ATOM 1822 HD23 LEU A 125 8.526 46.668 22.241 1.00 0.00 H ATOM 1823 HD11 LEU A 125 6.280 44.147 23.816 1.00 0.00 H ATOM 1824 HD12 LEU A 125 6.925 45.567 24.677 1.00 0.00 H ATOM 1825 HD13 LEU A 125 6.335 45.731 23.004 1.00 0.00 H ATOM 1826 H LEU A 125 9.997 42.055 25.656 1.00 0.00 H ATOM 1827 N ILE A 126 7.189 41.393 22.432 1.00 17.28 N ATOM 1828 CA ILE A 126 7.129 40.690 21.164 1.00 16.78 C ATOM 1829 C ILE A 126 6.575 41.516 19.979 1.00 15.69 C ATOM 1830 O ILE A 126 6.825 41.178 18.813 1.00 14.28 O ATOM 1831 CB ILE A 126 6.274 39.442 21.307 1.00 15.75 C ATOM 1832 CG1 ILE A 126 4.831 39.810 21.629 1.00 15.90 C ATOM 1833 CG2 ILE A 126 6.866 38.528 22.374 1.00 19.46 C ATOM 1834 CD1 ILE A 126 3.921 38.665 21.374 1.00 17.16 C ATOM 1835 HA ILE A 126 8.167 40.457 20.926 1.00 0.00 H ATOM 1836 HB ILE A 126 6.270 38.904 20.359 1.00 0.00 H ATOM 1837 HG12 ILE A 126 4.761 40.095 22.679 1.00 0.00 H ATOM 1838 HG13 ILE A 126 4.530 40.651 21.005 1.00 0.00 H ATOM 1839 HD11 ILE A 126 3.984 38.379 20.324 1.00 0.00 H ATOM 1840 HD12 ILE A 126 4.216 37.822 21.999 1.00 0.00 H ATOM 1841 HD13 ILE A 126 2.898 38.956 21.612 1.00 0.00 H ATOM 1842 HG21 ILE A 126 7.877 38.241 22.085 1.00 0.00 H ATOM 1843 HG22 ILE A 126 6.895 39.056 23.327 1.00 0.00 H ATOM 1844 HG23 ILE A 126 6.247 37.636 22.470 1.00 0.00 H ATOM 1845 H ILE A 126 6.304 41.664 22.907 1.00 0.00 H ATOM 1846 N ALA A 127 5.821 42.578 20.272 1.00 15.03 N ATOM 1847 CA ALA A 127 5.225 43.400 19.232 1.00 14.50 C ATOM 1848 C ALA A 127 4.755 44.726 19.786 1.00 15.51 C ATOM 1849 O ALA A 127 4.494 44.852 20.987 1.00 15.84 O ATOM 1850 CB ALA A 127 4.031 42.676 18.580 1.00 14.24 C ATOM 1851 HA ALA A 127 5.995 43.580 18.481 1.00 0.00 H ATOM 1852 HB1 ALA A 127 4.373 41.741 18.137 1.00 0.00 H ATOM 1853 HB2 ALA A 127 3.277 42.466 19.338 1.00 0.00 H ATOM 1854 HB3 ALA A 127 3.602 43.311 17.805 1.00 0.00 H ATOM 1855 H ALA A 127 5.656 42.823 21.269 1.00 0.00 H ATOM 1856 N VAL A 128 4.615 45.696 18.880 1.00 14.84 N ATOM 1857 CA VAL A 128 3.939 46.959 19.140 1.00 14.85 C ATOM 1858 C VAL A 128 2.921 47.225 18.048 1.00 15.62 C ATOM 1859 O VAL A 128 3.224 47.145 16.838 1.00 15.50 O ATOM 1860 CB VAL A 128 4.892 48.127 19.241 1.00 15.63 C ATOM 1861 CG1 VAL A 128 4.098 49.447 19.423 1.00 16.08 C ATOM 1862 CG2 VAL A 128 5.828 47.937 20.406 1.00 14.83 C ATOM 1863 HA VAL A 128 3.446 46.865 20.108 1.00 0.00 H ATOM 1864 HB VAL A 128 5.474 48.181 18.321 1.00 0.00 H ATOM 1865 HG11 VAL A 128 3.439 49.594 18.567 1.00 0.00 H ATOM 1866 HG12 VAL A 128 3.504 49.389 20.335 1.00 0.00 H ATOM 1867 HG13 VAL A 128 4.795 50.282 19.495 1.00 0.00 H ATOM 1868 HG21 VAL A 128 5.250 47.867 21.327 1.00 0.00 H ATOM 1869 HG22 VAL A 128 6.401 47.020 20.265 1.00 0.00 H ATOM 1870 HG23 VAL A 128 6.509 48.786 20.466 1.00 0.00 H ATOM 1871 H VAL A 128 5.013 45.540 17.932 1.00 0.00 H ATOM 1872 N LEU A 129 1.694 47.474 18.483 1.00 13.86 N ATOM 1873 CA LEU A 129 0.584 47.778 17.587 1.00 15.31 C ATOM 1874 C LEU A 129 0.107 49.176 17.903 1.00 16.17 C ATOM 1875 O LEU A 129 -0.186 49.477 19.079 1.00 16.10 O ATOM 1876 CB LEU A 129 -0.578 46.800 17.790 1.00 14.65 C ATOM 1877 CG LEU A 129 -0.217 45.313 17.709 1.00 15.83 C ATOM 1878 CD1 LEU A 129 -1.385 44.500 18.172 1.00 18.39 C ATOM 1879 CD2 LEU A 129 0.213 44.906 16.329 1.00 14.61 C ATOM 1880 HA LEU A 129 0.922 47.693 16.554 1.00 0.00 H ATOM 1881 HB2 LEU A 129 -1.006 46.988 18.775 1.00 0.00 H ATOM 1882 HB3 LEU A 129 -1.326 47.005 17.025 1.00 0.00 H ATOM 1883 HG LEU A 129 0.637 45.130 18.361 1.00 0.00 H ATOM 1884 HD21 LEU A 129 -0.598 45.096 15.626 1.00 0.00 H ATOM 1885 HD22 LEU A 129 1.090 45.484 16.038 1.00 0.00 H ATOM 1886 HD23 LEU A 129 0.458 43.844 16.325 1.00 0.00 H ATOM 1887 HD11 LEU A 129 -1.625 44.764 19.202 1.00 0.00 H ATOM 1888 HD12 LEU A 129 -2.244 44.705 17.534 1.00 0.00 H ATOM 1889 HD13 LEU A 129 -1.134 43.441 18.116 1.00 0.00 H ATOM 1890 H LEU A 129 1.515 47.452 19.507 1.00 0.00 H ATOM 1891 N ILE A 130 0.064 50.027 16.880 1.00 14.69 N ATOM 1892 CA ILE A 130 -0.345 51.388 17.038 1.00 14.92 C ATOM 1893 C ILE A 130 -1.738 51.561 16.440 1.00 17.04 C ATOM 1894 O ILE A 130 -1.954 51.351 15.246 1.00 17.13 O ATOM 1895 CB ILE A 130 0.627 52.365 16.386 1.00 16.99 C ATOM 1896 CG1 ILE A 130 2.036 52.217 16.985 1.00 18.07 C ATOM 1897 CG2 ILE A 130 0.128 53.792 16.580 1.00 16.95 C ATOM 1898 CD1 ILE A 130 3.064 53.080 16.327 1.00 20.97 C ATOM 1899 HA ILE A 130 -0.357 51.615 18.104 1.00 0.00 H ATOM 1900 HB ILE A 130 0.682 52.140 15.321 1.00 0.00 H ATOM 1901 HG12 ILE A 130 1.990 52.481 18.042 1.00 0.00 H ATOM 1902 HG13 ILE A 130 2.345 51.177 16.885 1.00 0.00 H ATOM 1903 HD11 ILE A 130 3.132 52.821 15.270 1.00 0.00 H ATOM 1904 HD12 ILE A 130 2.777 54.127 16.428 1.00 0.00 H ATOM 1905 HD13 ILE A 130 4.031 52.920 16.804 1.00 0.00 H ATOM 1906 HG21 ILE A 130 -0.855 53.898 16.120 1.00 0.00 H ATOM 1907 HG22 ILE A 130 0.057 54.009 17.646 1.00 0.00 H ATOM 1908 HG23 ILE A 130 0.826 54.486 16.112 1.00 0.00 H ATOM 1909 H ILE A 130 0.337 49.691 15.935 1.00 0.00 H ATOM 1910 N LEU A 131 -2.671 51.931 17.303 1.00 15.23 N ATOM 1911 CA LEU A 131 -4.023 52.284 16.931 1.00 15.38 C ATOM 1912 C LEU A 131 -4.116 53.779 16.665 1.00 16.16 C ATOM 1913 O LEU A 131 -3.768 54.575 17.523 1.00 16.47 O ATOM 1914 CB LEU A 131 -4.970 51.915 18.091 1.00 16.03 C ATOM 1915 CG LEU A 131 -6.505 52.064 17.905 1.00 15.33 C ATOM 1916 CD1 LEU A 131 -7.230 51.303 18.976 1.00 15.25 C ATOM 1917 CD2 LEU A 131 -6.967 53.525 17.938 1.00 16.77 C ATOM 1918 HA LEU A 131 -4.304 51.743 16.027 1.00 0.00 H ATOM 1919 HB2 LEU A 131 -4.780 50.870 18.335 1.00 0.00 H ATOM 1920 HB3 LEU A 131 -4.691 52.541 18.939 1.00 0.00 H ATOM 1921 HG LEU A 131 -6.740 51.661 16.920 1.00 0.00 H ATOM 1922 HD21 LEU A 131 -6.702 53.967 18.899 1.00 0.00 H ATOM 1923 HD22 LEU A 131 -6.478 54.078 17.136 1.00 0.00 H ATOM 1924 HD23 LEU A 131 -8.048 53.566 17.803 1.00 0.00 H ATOM 1925 HD11 LEU A 131 -6.962 50.248 18.915 1.00 0.00 H ATOM 1926 HD12 LEU A 131 -6.948 51.695 19.953 1.00 0.00 H ATOM 1927 HD13 LEU A 131 -8.305 51.415 18.835 1.00 0.00 H ATOM 1928 H LEU A 131 -2.416 51.970 18.310 1.00 0.00 H ATOM 1929 N ARG A 132 -4.590 54.178 15.485 1.00 16.75 N ATOM 1930 CA ARG A 132 -4.754 55.595 15.175 1.00 16.25 C ATOM 1931 C ARG A 132 -6.230 55.923 15.070 1.00 17.01 C ATOM 1932 O ARG A 132 -6.993 55.247 14.346 1.00 16.00 O ATOM 1933 CB ARG A 132 -4.035 55.954 13.878 1.00 18.21 C ATOM 1934 CG ARG A 132 -4.238 57.365 13.433 1.00 22.57 C ATOM 1935 CD ARG A 132 -3.531 57.636 12.120 1.00 26.37 C ATOM 1936 NE ARG A 132 -3.586 59.031 11.707 1.00 30.18 N ATOM 1937 CZ ARG A 132 -3.294 59.470 10.477 1.00 36.47 C ATOM 1938 NH1 ARG A 132 -2.950 58.616 9.516 1.00 36.07 N ATOM 1939 NH2 ARG A 132 -3.359 60.768 10.194 1.00 34.90 N ATOM 1940 HA ARG A 132 -4.311 56.184 15.978 1.00 0.00 H ATOM 1941 HB2 ARG A 132 -2.967 55.792 14.023 1.00 0.00 H ATOM 1942 HB3 ARG A 132 -4.398 55.292 13.092 1.00 0.00 H ATOM 1943 HG2 ARG A 132 -5.305 57.548 13.306 1.00 0.00 H ATOM 1944 HG3 ARG A 132 -3.844 58.038 14.194 1.00 0.00 H ATOM 1945 HD2 ARG A 132 -3.997 57.028 11.345 1.00 0.00 H ATOM 1946 HD3 ARG A 132 -2.485 57.348 12.225 1.00 0.00 H ATOM 1947 HE ARG A 132 -3.872 59.735 12.417 1.00 0.00 H ATOM 1948 HH12 ARG A 132 -2.725 58.968 8.564 1.00 0.00 H ATOM 1949 HH11 ARG A 132 -2.906 57.597 9.717 1.00 0.00 H ATOM 1950 HH22 ARG A 132 -3.131 61.103 9.236 1.00 0.00 H ATOM 1951 HH21 ARG A 132 -3.638 61.447 10.930 1.00 0.00 H ATOM 1952 H ARG A 132 -4.848 53.466 14.772 1.00 0.00 H ATOM 1953 N GLN A 133 -6.626 56.972 15.780 1.00 16.96 N ATOM 1954 CA GLN A 133 -8.041 57.335 15.898 1.00 19.81 C ATOM 1955 C GLN A 133 -8.265 58.759 15.426 1.00 18.94 C ATOM 1956 O GLN A 133 -7.573 59.682 15.853 1.00 19.86 O ATOM 1957 CB GLN A 133 -8.538 57.205 17.344 1.00 19.00 C ATOM 1958 CG GLN A 133 -9.993 57.676 17.551 1.00 17.99 C ATOM 1959 CD GLN A 133 -10.093 59.078 18.194 1.00 20.38 C ATOM 1960 OE1 GLN A 133 -9.368 59.382 19.130 1.00 18.80 O ATOM 1961 NE2 GLN A 133 -11.009 59.918 17.691 1.00 20.63 N ATOM 1962 HA GLN A 133 -8.604 56.644 15.271 1.00 0.00 H ATOM 1963 HB2 GLN A 133 -8.471 56.157 17.637 1.00 0.00 H ATOM 1964 HB3 GLN A 133 -7.889 57.802 17.985 1.00 0.00 H ATOM 1965 HG2 GLN A 133 -10.490 57.703 16.581 1.00 0.00 H ATOM 1966 HG3 GLN A 133 -10.500 56.961 18.198 1.00 0.00 H ATOM 1967 HE22 GLN A 133 -11.606 59.619 16.893 1.00 0.00 H ATOM 1968 HE21 GLN A 133 -11.123 60.868 18.098 1.00 0.00 H ATOM 1969 H GLN A 133 -5.913 57.552 16.266 1.00 0.00 H ATOM 1970 N THR A 134 -9.212 58.925 14.521 1.00 18.50 N ATOM 1971 CA THR A 134 -9.600 60.240 14.029 1.00 19.64 C ATOM 1972 C THR A 134 -11.097 60.269 14.070 1.00 20.18 C ATOM 1973 O THR A 134 -11.710 59.298 14.505 1.00 20.45 O ATOM 1974 CB THR A 134 -9.119 60.503 12.572 1.00 24.65 C ATOM 1975 OG1 THR A 134 -9.563 59.458 11.691 1.00 21.76 O ATOM 1976 CG2 THR A 134 -7.589 60.614 12.490 1.00 24.31 C ATOM 1977 HA THR A 134 -9.141 61.013 14.646 1.00 0.00 H ATOM 1978 HB THR A 134 -9.555 61.453 12.261 1.00 0.00 H ATOM 1979 HG1 THR A 134 -9.246 59.646 10.772 1.00 0.00 H ATOM 1980 HG23 THR A 134 -7.247 61.406 13.157 1.00 0.00 H ATOM 1981 HG21 THR A 134 -7.141 59.667 12.789 1.00 0.00 H ATOM 1982 HG22 THR A 134 -7.297 60.848 11.466 1.00 0.00 H ATOM 1983 H THR A 134 -9.699 58.086 14.146 1.00 0.00 H ATOM 1984 N ASN A 135 -11.705 61.372 13.629 1.00 22.76 N ATOM 1985 CA ASN A 135 -13.169 61.448 13.561 1.00 23.92 C ATOM 1986 C ASN A 135 -13.670 62.343 12.426 1.00 23.40 C ATOM 1987 O ASN A 135 -12.879 62.909 11.695 1.00 22.88 O ATOM 1988 CB ASN A 135 -13.707 61.948 14.884 1.00 21.17 C ATOM 1989 CG ASN A 135 -13.220 63.333 15.208 1.00 23.42 C ATOM 1990 OD1 ASN A 135 -13.116 64.203 14.338 1.00 22.20 O ATOM 1991 ND2 ASN A 135 -12.897 63.546 16.464 1.00 23.09 N ATOM 1992 HA ASN A 135 -13.535 60.443 13.353 1.00 0.00 H ATOM 1993 HB2 ASN A 135 -14.796 61.960 14.838 1.00 0.00 H ATOM 1994 HB3 ASN A 135 -13.385 61.269 15.673 1.00 0.00 H ATOM 1995 HD22 ASN A 135 -13.001 62.784 17.164 1.00 0.00 H ATOM 1996 HD21 ASN A 135 -12.538 64.477 16.758 1.00 0.00 H ATOM 1997 H ASN A 135 -11.134 62.188 13.330 1.00 0.00 H ATOM 1998 N ASN A 136 -14.987 62.466 12.303 1.00 24.00 N ATOM 1999 CA ASN A 136 -15.629 63.340 11.309 1.00 26.00 C ATOM 2000 C ASN A 136 -16.113 64.667 11.898 1.00 26.91 C ATOM 2001 O ASN A 136 -17.106 65.225 11.428 1.00 29.22 O ATOM 2002 CB ASN A 136 -16.854 62.643 10.729 1.00 24.50 C ATOM 2003 CG ASN A 136 -18.010 62.546 11.734 1.00 26.45 C ATOM 2004 OD1 ASN A 136 -17.806 62.596 12.943 1.00 27.02 O ATOM 2005 ND2 ASN A 136 -19.225 62.387 11.231 1.00 27.17 N ATOM 2006 HA ASN A 136 -14.870 63.545 10.554 1.00 0.00 H ATOM 2007 HB2 ASN A 136 -17.195 63.203 9.858 1.00 0.00 H ATOM 2008 HB3 ASN A 136 -16.571 61.636 10.424 1.00 0.00 H ATOM 2009 HD22 ASN A 136 -19.360 62.349 10.201 1.00 0.00 H ATOM 2010 HD21 ASN A 136 -20.044 62.300 11.867 1.00 0.00 H ATOM 2011 H ASN A 136 -15.596 61.916 12.942 1.00 0.00 H ATOM 2012 N TYR A 137 -15.437 65.166 12.931 1.00 28.21 N ATOM 2013 CA TYR A 137 -15.936 66.313 13.708 1.00 28.52 C ATOM 2014 C TYR A 137 -14.904 67.441 13.860 1.00 30.00 C ATOM 2015 O TYR A 137 -15.222 68.621 13.687 1.00 29.87 O ATOM 2016 CB TYR A 137 -16.427 65.846 15.085 1.00 30.31 C ATOM 2017 CG TYR A 137 -16.816 66.982 16.012 1.00 36.54 C ATOM 2018 CD1 TYR A 137 -18.025 67.654 15.842 1.00 41.33 C ATOM 2019 CD2 TYR A 137 -15.974 67.391 17.049 1.00 36.62 C ATOM 2020 CE1 TYR A 137 -18.389 68.706 16.677 1.00 48.10 C ATOM 2021 CE2 TYR A 137 -16.322 68.452 17.884 1.00 47.08 C ATOM 2022 CZ TYR A 137 -17.536 69.104 17.690 1.00 55.88 C ATOM 2023 OH TYR A 137 -17.905 70.153 18.505 1.00 67.73 O ATOM 2024 HA TYR A 137 -16.768 66.734 13.143 1.00 0.00 H ATOM 2025 HB3 TYR A 137 -15.630 65.273 15.559 1.00 0.00 H ATOM 2026 HB2 TYR A 137 -17.297 65.206 14.941 1.00 0.00 H ATOM 2027 HD2 TYR A 137 -15.029 66.872 17.208 1.00 0.00 H ATOM 2028 HE2 TYR A 137 -15.649 68.768 18.681 1.00 0.00 H ATOM 2029 HE1 TYR A 137 -19.343 69.214 16.533 1.00 0.00 H ATOM 2030 HD1 TYR A 137 -18.698 67.350 15.040 1.00 0.00 H ATOM 2031 HH TYR A 137 -18.791 70.492 18.223 1.00 0.00 H ATOM 2032 H TYR A 137 -14.530 64.733 13.197 1.00 0.00 H ATOM 2033 N ASN A 138 -13.673 67.088 14.199 1.00 25.96 N ATOM 2034 CA ASN A 138 -12.628 68.085 14.379 1.00 26.71 C ATOM 2035 C ASN A 138 -11.262 67.541 13.923 1.00 26.24 C ATOM 2036 O ASN A 138 -11.194 66.534 13.206 1.00 25.87 O ATOM 2037 CB ASN A 138 -12.601 68.578 15.845 1.00 29.17 C ATOM 2038 CG ASN A 138 -12.178 67.488 16.844 1.00 29.44 C ATOM 2039 OD1 ASN A 138 -11.695 66.422 16.464 1.00 24.52 O ATOM 2040 ND2 ASN A 138 -12.365 67.765 18.135 1.00 33.05 N ATOM 2041 HA ASN A 138 -12.851 68.945 13.748 1.00 0.00 H ATOM 2042 HB2 ASN A 138 -11.898 69.408 15.919 1.00 0.00 H ATOM 2043 HB3 ASN A 138 -13.599 68.925 16.112 1.00 0.00 H ATOM 2044 HD22 ASN A 138 -12.776 68.678 18.417 1.00 0.00 H ATOM 2045 HD21 ASN A 138 -12.100 67.068 18.860 1.00 0.00 H ATOM 2046 H ASN A 138 -13.450 66.082 14.339 1.00 0.00 H ATOM 2047 N SER A 139 -10.177 68.179 14.343 1.00 24.79 N ATOM 2048 CA SER A 139 -8.858 67.745 13.900 1.00 30.06 C ATOM 2049 C SER A 139 -8.190 66.663 14.760 1.00 28.66 C ATOM 2050 O SER A 139 -7.011 66.366 14.542 1.00 29.40 O ATOM 2051 CB SER A 139 -7.916 68.941 13.782 1.00 31.96 C ATOM 2052 OG SER A 139 -7.784 69.584 15.031 1.00 36.26 O ATOM 2053 HA SER A 139 -9.039 67.281 12.930 1.00 0.00 H ATOM 2054 HB2 SER A 139 -8.319 69.646 13.055 1.00 0.00 H ATOM 2055 HB3 SER A 139 -6.937 68.597 13.449 1.00 0.00 H ATOM 2056 HG SER A 139 -8.672 69.900 15.334 1.00 0.00 H ATOM 2057 H SER A 139 -10.268 68.989 14.989 1.00 0.00 H ATOM 2058 N ASP A 140 -8.924 66.056 15.692 1.00 24.78 N ATOM 2059 CA ASP A 140 -8.347 64.993 16.529 1.00 26.20 C ATOM 2060 C ASP A 140 -7.662 63.889 15.727 1.00 23.65 C ATOM 2061 O ASP A 140 -8.229 63.290 14.815 1.00 24.59 O ATOM 2062 CB ASP A 140 -9.405 64.363 17.448 1.00 22.99 C ATOM 2063 CG ASP A 140 -9.827 65.311 18.612 1.00 27.16 C ATOM 2064 OD1 ASP A 140 -9.181 66.373 18.797 1.00 27.32 O ATOM 2065 OD2 ASP A 140 -10.825 65.000 19.309 1.00 26.47 O ATOM 2066 HA ASP A 140 -7.583 65.489 17.128 1.00 0.00 H ATOM 2067 HB2 ASP A 140 -10.287 64.125 16.854 1.00 0.00 H ATOM 2068 HB3 ASP A 140 -8.997 63.446 17.874 1.00 0.00 H ATOM 2069 H ASP A 140 -9.916 66.337 15.829 1.00 0.00 H ATOM 2070 N ASP A 141 -6.435 63.608 16.093 1.00 21.86 N ATOM 2071 CA ASP A 141 -5.677 62.586 15.424 1.00 23.03 C ATOM 2072 C ASP A 141 -4.757 61.986 16.509 1.00 21.58 C ATOM 2073 O ASP A 141 -3.704 62.543 16.829 1.00 20.96 O ATOM 2074 CB ASP A 141 -4.896 63.212 14.259 1.00 25.71 C ATOM 2075 CG ASP A 141 -4.314 62.175 13.305 1.00 29.42 C ATOM 2076 OD1 ASP A 141 -3.983 61.045 13.739 1.00 27.38 O ATOM 2077 OD2 ASP A 141 -4.167 62.507 12.111 1.00 31.57 O ATOM 2078 HA ASP A 141 -6.296 61.803 14.985 1.00 0.00 H ATOM 2079 HB2 ASP A 141 -5.569 63.861 13.698 1.00 0.00 H ATOM 2080 HB3 ASP A 141 -4.078 63.805 14.668 1.00 0.00 H ATOM 2081 H ASP A 141 -6.003 64.133 16.880 1.00 0.00 H ATOM 2082 N PHE A 142 -5.175 60.869 17.091 1.00 19.30 N ATOM 2083 CA PHE A 142 -4.520 60.360 18.307 1.00 20.21 C ATOM 2084 C PHE A 142 -4.001 58.936 18.119 1.00 19.75 C ATOM 2085 O PHE A 142 -4.616 58.128 17.417 1.00 19.80 O ATOM 2086 CB PHE A 142 -5.496 60.370 19.479 1.00 19.24 C ATOM 2087 CG PHE A 142 -6.019 61.729 19.842 1.00 18.82 C ATOM 2088 CD1 PHE A 142 -5.173 62.800 19.997 1.00 22.43 C ATOM 2089 CD2 PHE A 142 -7.362 61.920 20.086 1.00 20.51 C ATOM 2090 CE1 PHE A 142 -5.670 64.052 20.372 1.00 23.86 C ATOM 2091 CE2 PHE A 142 -7.867 63.163 20.446 1.00 20.91 C ATOM 2092 CZ PHE A 142 -7.018 64.226 20.585 1.00 22.95 C ATOM 2093 HA PHE A 142 -3.675 61.018 18.512 1.00 0.00 H ATOM 2094 HB2 PHE A 142 -6.344 59.736 19.221 1.00 0.00 H ATOM 2095 HB3 PHE A 142 -4.987 59.957 20.350 1.00 0.00 H ATOM 2096 HD2 PHE A 142 -8.044 61.075 19.994 1.00 0.00 H ATOM 2097 HE2 PHE A 142 -8.936 63.291 20.617 1.00 0.00 H ATOM 2098 HZ PHE A 142 -7.407 65.206 20.863 1.00 0.00 H ATOM 2099 HE1 PHE A 142 -4.987 64.893 20.496 1.00 0.00 H ATOM 2100 HD1 PHE A 142 -4.104 62.673 19.826 1.00 0.00 H ATOM 2101 H PHE A 142 -5.976 60.346 16.683 1.00 0.00 H ATOM 2102 N GLN A 143 -2.864 58.644 18.742 1.00 18.64 N ATOM 2103 CA GLN A 143 -2.308 57.318 18.748 1.00 18.31 C ATOM 2104 C GLN A 143 -2.528 56.630 20.115 1.00 18.43 C ATOM 2105 O GLN A 143 -2.338 57.220 21.193 1.00 17.24 O ATOM 2106 CB GLN A 143 -0.811 57.356 18.432 1.00 18.84 C ATOM 2107 CG GLN A 143 -0.399 57.918 17.048 1.00 22.09 C ATOM 2108 CD GLN A 143 1.145 58.051 16.922 1.00 23.42 C ATOM 2109 OE1 GLN A 143 1.787 58.776 17.679 1.00 22.68 O ATOM 2110 NE2 GLN A 143 1.725 57.333 15.988 1.00 24.69 N ATOM 2111 HA GLN A 143 -2.822 56.744 17.977 1.00 0.00 H ATOM 2112 HB2 GLN A 143 -0.329 57.970 19.193 1.00 0.00 H ATOM 2113 HB3 GLN A 143 -0.435 56.335 18.498 1.00 0.00 H ATOM 2114 HG2 GLN A 143 -0.761 57.245 16.270 1.00 0.00 H ATOM 2115 HG3 GLN A 143 -0.851 58.901 16.916 1.00 0.00 H ATOM 2116 HE22 GLN A 143 1.151 56.730 15.364 1.00 0.00 H ATOM 2117 HE21 GLN A 143 2.758 57.367 15.872 1.00 0.00 H ATOM 2118 H GLN A 143 -2.358 59.402 19.243 1.00 0.00 H ATOM 2119 N PHE A 144 -2.919 55.367 20.026 1.00 16.76 N ATOM 2120 CA PHE A 144 -3.025 54.477 21.164 1.00 17.56 C ATOM 2121 C PHE A 144 -2.005 53.350 20.932 1.00 15.01 C ATOM 2122 O PHE A 144 -2.179 52.508 20.049 1.00 14.45 O ATOM 2123 CB PHE A 144 -4.465 53.954 21.287 1.00 15.07 C ATOM 2124 CG PHE A 144 -5.460 55.021 21.638 1.00 16.17 C ATOM 2125 CD1 PHE A 144 -5.784 56.039 20.715 1.00 17.18 C ATOM 2126 CD2 PHE A 144 -6.036 55.057 22.901 1.00 17.59 C ATOM 2127 CE1 PHE A 144 -6.695 57.056 21.051 1.00 17.97 C ATOM 2128 CE2 PHE A 144 -6.958 56.074 23.252 1.00 17.54 C ATOM 2129 CZ PHE A 144 -7.285 57.064 22.346 1.00 18.96 C ATOM 2130 HA PHE A 144 -2.805 54.981 22.105 1.00 0.00 H ATOM 2131 HB2 PHE A 144 -4.755 53.512 20.334 1.00 0.00 H ATOM 2132 HB3 PHE A 144 -4.490 53.189 22.063 1.00 0.00 H ATOM 2133 HD2 PHE A 144 -5.775 54.292 23.633 1.00 0.00 H ATOM 2134 HE2 PHE A 144 -7.412 56.075 24.243 1.00 0.00 H ATOM 2135 HZ PHE A 144 -7.991 57.847 22.621 1.00 0.00 H ATOM 2136 HE1 PHE A 144 -6.947 57.831 20.327 1.00 0.00 H ATOM 2137 HD1 PHE A 144 -5.321 56.037 19.728 1.00 0.00 H ATOM 2138 H PHE A 144 -3.163 54.994 19.087 1.00 0.00 H ATOM 2139 N VAL A 145 -0.938 53.368 21.719 1.00 14.91 N ATOM 2140 CA VAL A 145 0.180 52.479 21.507 1.00 15.79 C ATOM 2141 C VAL A 145 0.114 51.236 22.426 1.00 15.57 C ATOM 2142 O VAL A 145 0.162 51.339 23.632 1.00 15.47 O ATOM 2143 CB VAL A 145 1.500 53.239 21.695 1.00 16.36 C ATOM 2144 CG1 VAL A 145 2.721 52.345 21.374 1.00 16.55 C ATOM 2145 CG2 VAL A 145 1.489 54.519 20.832 1.00 18.15 C ATOM 2146 HA VAL A 145 0.129 52.114 20.481 1.00 0.00 H ATOM 2147 HB VAL A 145 1.592 53.526 22.742 1.00 0.00 H ATOM 2148 HG11 VAL A 145 2.722 51.481 22.039 1.00 0.00 H ATOM 2149 HG12 VAL A 145 2.661 52.008 20.339 1.00 0.00 H ATOM 2150 HG13 VAL A 145 3.637 52.918 21.519 1.00 0.00 H ATOM 2151 HG21 VAL A 145 1.373 54.247 19.783 1.00 0.00 H ATOM 2152 HG22 VAL A 145 0.658 55.155 21.138 1.00 0.00 H ATOM 2153 HG23 VAL A 145 2.428 55.056 20.968 1.00 0.00 H ATOM 2154 H VAL A 145 -0.905 54.041 22.511 1.00 0.00 H ATOM 2155 N TRP A 146 0.006 50.064 21.821 1.00 14.00 N ATOM 2156 CA TRP A 146 -0.133 48.843 22.587 1.00 15.67 C ATOM 2157 C TRP A 146 1.160 48.035 22.498 1.00 15.11 C ATOM 2158 O TRP A 146 1.503 47.531 21.440 1.00 13.18 O ATOM 2159 CB TRP A 146 -1.296 48.027 22.058 1.00 14.59 C ATOM 2160 CG TRP A 146 -2.558 48.785 22.025 1.00 16.66 C ATOM 2161 CD1 TRP A 146 -3.108 49.419 20.949 1.00 16.92 C ATOM 2162 CD2 TRP A 146 -3.433 49.037 23.126 1.00 15.93 C ATOM 2163 NE1 TRP A 146 -4.297 50.007 21.299 1.00 16.40 N ATOM 2164 CE2 TRP A 146 -4.512 49.802 22.634 1.00 17.43 C ATOM 2165 CE3 TRP A 146 -3.416 48.678 24.468 1.00 14.66 C ATOM 2166 CZ2 TRP A 146 -5.561 50.220 23.450 1.00 17.39 C ATOM 2167 CZ3 TRP A 146 -4.465 49.091 25.281 1.00 16.70 C ATOM 2168 CH2 TRP A 146 -5.513 49.844 24.774 1.00 19.01 C ATOM 2169 HA TRP A 146 -0.328 49.093 23.630 1.00 0.00 H ATOM 2170 HB2 TRP A 146 -1.060 47.699 21.046 1.00 0.00 H ATOM 2171 HB3 TRP A 146 -1.430 47.155 22.699 1.00 0.00 H ATOM 2172 HE1 TRP A 146 -4.930 50.523 20.656 1.00 0.00 H ATOM 2173 HD1 TRP A 146 -2.666 49.453 19.953 1.00 0.00 H ATOM 2174 HZ2 TRP A 146 -6.383 50.818 23.058 1.00 0.00 H ATOM 2175 HH2 TRP A 146 -6.320 50.146 25.441 1.00 0.00 H ATOM 2176 HZ3 TRP A 146 -4.464 48.818 26.336 1.00 0.00 H ATOM 2177 HE3 TRP A 146 -2.597 48.085 24.875 1.00 0.00 H ATOM 2178 H TRP A 146 0.021 50.019 20.782 1.00 0.00 H ATOM 2179 N ASN A 147 1.861 47.940 23.624 1.00 14.30 N ATOM 2180 CA ASN A 147 3.073 47.176 23.724 1.00 15.12 C ATOM 2181 C ASN A 147 2.683 45.783 24.146 1.00 15.60 C ATOM 2182 O ASN A 147 2.112 45.605 25.197 1.00 16.20 O ATOM 2183 CB ASN A 147 3.998 47.794 24.759 1.00 16.38 C ATOM 2184 CG ASN A 147 4.433 49.209 24.383 1.00 19.38 C ATOM 2185 OD1 ASN A 147 4.818 49.463 23.255 1.00 16.62 O ATOM 2186 ND2 ASN A 147 4.353 50.132 25.333 1.00 22.22 N ATOM 2187 HA ASN A 147 3.601 47.161 22.771 1.00 0.00 H ATOM 2188 HB2 ASN A 147 3.478 47.831 25.716 1.00 0.00 H ATOM 2189 HB3 ASN A 147 4.886 47.168 24.853 1.00 0.00 H ATOM 2190 HD22 ASN A 147 4.019 49.873 26.283 1.00 0.00 H ATOM 2191 HD21 ASN A 147 4.624 51.115 25.127 1.00 0.00 H ATOM 2192 H ASN A 147 1.517 48.440 24.468 1.00 0.00 H ATOM 2193 N ILE A 148 2.965 44.806 23.306 1.00 15.86 N ATOM 2194 CA ILE A 148 2.503 43.436 23.521 1.00 15.65 C ATOM 2195 C ILE A 148 3.664 42.594 24.098 1.00 16.50 C ATOM 2196 O ILE A 148 4.733 42.516 23.453 1.00 16.59 O ATOM 2197 CB ILE A 148 2.038 42.811 22.204 1.00 14.65 C ATOM 2198 CG1 ILE A 148 1.092 43.746 21.439 1.00 13.71 C ATOM 2199 CG2 ILE A 148 1.401 41.423 22.455 1.00 16.38 C ATOM 2200 CD1 ILE A 148 -0.023 44.385 22.269 1.00 13.47 C ATOM 2201 HA ILE A 148 1.665 43.453 24.218 1.00 0.00 H ATOM 2202 HB ILE A 148 2.913 42.665 21.571 1.00 0.00 H ATOM 2203 HG12 ILE A 148 1.690 44.548 21.007 1.00 0.00 H ATOM 2204 HG13 ILE A 148 0.627 43.171 20.639 1.00 0.00 H ATOM 2205 HD11 ILE A 148 -0.648 43.602 22.700 1.00 0.00 H ATOM 2206 HD12 ILE A 148 0.417 44.981 23.068 1.00 0.00 H ATOM 2207 HD13 ILE A 148 -0.630 45.025 21.628 1.00 0.00 H ATOM 2208 HG21 ILE A 148 2.137 40.766 22.918 1.00 0.00 H ATOM 2209 HG22 ILE A 148 0.542 41.533 23.117 1.00 0.00 H ATOM 2210 HG23 ILE A 148 1.077 40.996 21.506 1.00 0.00 H ATOM 2211 H ILE A 148 3.535 45.017 22.462 1.00 0.00 H ATOM 2212 N TYR A 149 3.450 41.994 25.282 1.00 15.51 N ATOM 2213 CA TYR A 149 4.450 41.164 25.984 1.00 17.18 C ATOM 2214 C TYR A 149 4.039 39.697 26.059 1.00 17.61 C ATOM 2215 O TYR A 149 2.864 39.400 26.268 1.00 18.58 O ATOM 2216 CB TYR A 149 4.673 41.648 27.444 1.00 17.11 C ATOM 2217 CG TYR A 149 5.410 42.930 27.521 1.00 16.23 C ATOM 2218 CD1 TYR A 149 4.743 44.154 27.376 1.00 16.36 C ATOM 2219 CD2 TYR A 149 6.776 42.942 27.691 1.00 17.54 C ATOM 2220 CE1 TYR A 149 5.442 45.338 27.393 1.00 16.92 C ATOM 2221 CE2 TYR A 149 7.482 44.122 27.717 1.00 18.34 C ATOM 2222 CZ TYR A 149 6.812 45.313 27.570 1.00 17.92 C ATOM 2223 OH TYR A 149 7.538 46.490 27.614 1.00 21.45 O ATOM 2224 HA TYR A 149 5.364 41.265 25.399 1.00 0.00 H ATOM 2225 HB3 TYR A 149 5.241 40.887 27.980 1.00 0.00 H ATOM 2226 HB2 TYR A 149 3.701 41.776 27.920 1.00 0.00 H ATOM 2227 HD2 TYR A 149 7.308 41.998 27.807 1.00 0.00 H ATOM 2228 HE2 TYR A 149 8.563 44.113 27.853 1.00 0.00 H ATOM 2229 HE1 TYR A 149 4.920 46.287 27.268 1.00 0.00 H ATOM 2230 HD1 TYR A 149 3.661 44.168 27.249 1.00 0.00 H ATOM 2231 HH TYR A 149 7.994 46.563 28.490 1.00 0.00 H ATOM 2232 H TYR A 149 2.521 42.122 25.732 1.00 0.00 H ATOM 2233 N ALA A 150 5.012 38.785 25.925 1.00 19.01 N ATOM 2234 CA ALA A 150 4.765 37.343 26.111 1.00 18.55 C ATOM 2235 C ALA A 150 4.585 36.983 27.564 1.00 21.74 C ATOM 2236 O ALA A 150 5.387 37.343 28.443 1.00 21.36 O ATOM 2237 CB ALA A 150 5.885 36.488 25.524 1.00 17.62 C ATOM 2238 HA ALA A 150 3.840 37.131 25.575 1.00 0.00 H ATOM 2239 HB1 ALA A 150 5.968 36.684 24.455 1.00 0.00 H ATOM 2240 HB2 ALA A 150 6.826 36.738 26.014 1.00 0.00 H ATOM 2241 HB3 ALA A 150 5.658 35.434 25.685 1.00 0.00 H ATOM 2242 H ALA A 150 5.972 39.104 25.682 1.00 0.00 H ATOM 2243 N ASN A 151 3.530 36.236 27.826 1.00 23.61 N ATOM 2244 CA ASN A 151 3.321 35.759 29.176 1.00 26.52 C ATOM 2245 C ASN A 151 4.233 34.589 29.517 1.00 27.27 C ATOM 2246 O ASN A 151 4.680 34.457 30.646 1.00 29.03 O ATOM 2247 CB ASN A 151 1.907 35.334 29.353 1.00 25.37 C ATOM 2248 CG ASN A 151 1.720 34.609 30.612 1.00 35.96 C ATOM 2249 OD1 ASN A 151 1.849 33.379 30.662 1.00 39.22 O ATOM 2250 ND2 ASN A 151 1.433 35.345 31.668 1.00 38.90 N ATOM 2251 HA ASN A 151 3.557 36.584 29.848 1.00 0.00 H ATOM 2252 HB2 ASN A 151 1.268 36.217 29.354 1.00 0.00 H ATOM 2253 HB3 ASN A 151 1.625 34.684 28.524 1.00 0.00 H ATOM 2254 HD22 ASN A 151 1.335 36.376 31.572 1.00 0.00 H ATOM 2255 HD21 ASN A 151 1.304 34.894 32.596 1.00 0.00 H ATOM 2256 H ASN A 151 2.857 35.993 27.072 1.00 0.00 H ATOM 2257 N ASN A 152 4.529 33.769 28.520 1.00 23.74 N ATOM 2258 CA ASN A 152 5.213 32.521 28.736 1.00 26.76 C ATOM 2259 C ASN A 152 6.214 32.244 27.617 1.00 24.83 C ATOM 2260 O ASN A 152 6.118 32.807 26.517 1.00 23.01 O ATOM 2261 CB ASN A 152 4.164 31.400 28.805 1.00 26.24 C ATOM 2262 CG ASN A 152 3.315 31.321 27.529 1.00 26.50 C ATOM 2263 OD1 ASN A 152 2.371 32.092 27.335 1.00 24.13 O ATOM 2264 ND2 ASN A 152 3.674 30.400 26.644 1.00 22.79 N ATOM 2265 HA ASN A 152 5.773 32.570 29.670 1.00 0.00 H ATOM 2266 HB2 ASN A 152 4.676 30.448 28.946 1.00 0.00 H ATOM 2267 HB3 ASN A 152 3.506 31.586 29.654 1.00 0.00 H ATOM 2268 HD22 ASN A 152 4.476 29.769 26.846 1.00 0.00 H ATOM 2269 HD21 ASN A 152 3.153 30.309 25.748 1.00 0.00 H ATOM 2270 H ASN A 152 4.259 34.035 27.551 1.00 0.00 H ATOM 2271 N ASP A 153 7.176 31.375 27.913 1.00 25.83 N ATOM 2272 CA ASP A 153 8.141 30.870 26.938 1.00 24.05 C ATOM 2273 C ASP A 153 7.405 30.148 25.796 1.00 24.66 C ATOM 2274 O ASP A 153 6.376 29.504 26.016 1.00 24.45 O ATOM 2275 CB ASP A 153 9.070 29.856 27.606 1.00 27.31 C ATOM 2276 CG ASP A 153 10.276 30.484 28.274 1.00 29.86 C ATOM 2277 OD1 ASP A 153 10.341 31.723 28.440 1.00 28.21 O ATOM 2278 OD2 ASP A 153 11.176 29.697 28.667 1.00 34.41 O ATOM 2279 HA ASP A 153 8.711 31.714 26.550 1.00 0.00 H ATOM 2280 HB2 ASP A 153 8.502 29.313 28.361 1.00 0.00 H ATOM 2281 HB3 ASP A 153 9.421 29.158 26.846 1.00 0.00 H ATOM 2282 H ASP A 153 7.246 31.035 28.894 1.00 0.00 H ATOM 2283 N VAL A 154 7.930 30.270 24.576 1.00 23.90 N ATOM 2284 CA VAL A 154 7.450 29.495 23.445 1.00 22.08 C ATOM 2285 C VAL A 154 8.646 28.731 22.871 1.00 25.14 C ATOM 2286 O VAL A 154 9.666 29.338 22.504 1.00 23.87 O ATOM 2287 CB VAL A 154 6.861 30.389 22.341 1.00 20.99 C ATOM 2288 CG1 VAL A 154 6.481 29.543 21.142 1.00 24.51 C ATOM 2289 CG2 VAL A 154 5.660 31.151 22.841 1.00 20.51 C ATOM 2290 HA VAL A 154 6.659 28.827 23.786 1.00 0.00 H ATOM 2291 HB VAL A 154 7.620 31.113 22.046 1.00 0.00 H ATOM 2292 HG11 VAL A 154 7.368 29.036 20.761 1.00 0.00 H ATOM 2293 HG12 VAL A 154 5.739 28.803 21.442 1.00 0.00 H ATOM 2294 HG13 VAL A 154 6.065 30.183 20.364 1.00 0.00 H ATOM 2295 HG21 VAL A 154 4.894 30.447 23.165 1.00 0.00 H ATOM 2296 HG22 VAL A 154 5.955 31.781 23.680 1.00 0.00 H ATOM 2297 HG23 VAL A 154 5.266 31.774 22.038 1.00 0.00 H ATOM 2298 H VAL A 154 8.709 30.943 24.429 1.00 0.00 H ATOM 2299 N VAL A 155 8.523 27.410 22.804 1.00 25.21 N ATOM 2300 CA VAL A 155 9.586 26.568 22.268 1.00 27.47 C ATOM 2301 C VAL A 155 9.258 26.074 20.859 1.00 28.79 C ATOM 2302 O VAL A 155 8.168 25.562 20.591 1.00 28.43 O ATOM 2303 CB VAL A 155 9.826 25.355 23.182 1.00 32.93 C ATOM 2304 CG1 VAL A 155 10.900 24.448 22.610 1.00 30.09 C ATOM 2305 CG2 VAL A 155 10.181 25.816 24.622 1.00 30.56 C ATOM 2306 HA VAL A 155 10.487 27.180 22.222 1.00 0.00 H ATOM 2307 HB VAL A 155 8.903 24.778 23.234 1.00 0.00 H ATOM 2308 HG11 VAL A 155 10.587 24.091 21.629 1.00 0.00 H ATOM 2309 HG12 VAL A 155 11.832 25.005 22.515 1.00 0.00 H ATOM 2310 HG13 VAL A 155 11.049 23.599 23.277 1.00 0.00 H ATOM 2311 HG21 VAL A 155 11.086 26.423 24.595 1.00 0.00 H ATOM 2312 HG22 VAL A 155 9.358 26.406 25.026 1.00 0.00 H ATOM 2313 HG23 VAL A 155 10.347 24.942 25.252 1.00 0.00 H ATOM 2314 H VAL A 155 7.646 26.965 23.142 1.00 0.00 H ATOM 2315 N VAL A 156 10.204 26.246 19.947 1.00 30.88 N ATOM 2316 CA VAL A 156 10.099 25.621 18.636 1.00 31.50 C ATOM 2317 C VAL A 156 10.938 24.334 18.676 1.00 36.86 C ATOM 2318 O VAL A 156 12.162 24.389 18.835 1.00 35.89 O ATOM 2319 CB VAL A 156 10.559 26.547 17.513 1.00 31.17 C ATOM 2320 CG1 VAL A 156 10.452 25.839 16.166 1.00 34.55 C ATOM 2321 CG2 VAL A 156 9.736 27.833 17.505 1.00 29.67 C ATOM 2322 HA VAL A 156 9.055 25.396 18.419 1.00 0.00 H ATOM 2323 HB VAL A 156 11.603 26.809 17.688 1.00 0.00 H ATOM 2324 HG11 VAL A 156 11.081 24.949 16.174 1.00 0.00 H ATOM 2325 HG12 VAL A 156 9.415 25.552 15.989 1.00 0.00 H ATOM 2326 HG13 VAL A 156 10.784 26.512 15.376 1.00 0.00 H ATOM 2327 HG21 VAL A 156 8.685 27.589 17.354 1.00 0.00 H ATOM 2328 HG22 VAL A 156 9.857 28.347 18.459 1.00 0.00 H ATOM 2329 HG23 VAL A 156 10.081 28.478 16.697 1.00 0.00 H ATOM 2330 H VAL A 156 11.032 26.835 20.170 1.00 0.00 H ATOM 2331 N PRO A 157 10.273 23.166 18.572 1.00 40.16 N ATOM 2332 CA PRO A 157 11.035 21.931 18.718 1.00 43.78 C ATOM 2333 C PRO A 157 12.135 21.845 17.662 1.00 48.97 C ATOM 2334 O PRO A 157 11.999 22.339 16.523 1.00 44.64 O ATOM 2335 CB PRO A 157 9.984 20.833 18.504 1.00 43.47 C ATOM 2336 CG PRO A 157 8.676 21.504 18.726 1.00 39.81 C ATOM 2337 CD PRO A 157 8.877 22.888 18.200 1.00 38.63 C ATOM 2338 HA PRO A 157 11.539 21.853 19.681 1.00 0.00 H ATOM 2339 HD3 PRO A 157 8.742 22.923 17.119 1.00 0.00 H ATOM 2340 HD2 PRO A 157 8.194 23.593 18.673 1.00 0.00 H ATOM 2341 HG3 PRO A 157 8.428 21.526 19.787 1.00 0.00 H ATOM 2342 HG2 PRO A 157 7.883 20.994 18.179 1.00 0.00 H ATOM 2343 HB2 PRO A 157 10.044 20.437 17.490 1.00 0.00 H ATOM 2344 HB3 PRO A 157 10.125 20.022 19.219 1.00 0.00 H ATOM 2345 N THR A 158 13.241 21.242 18.086 1.00 52.77 N ATOM 2346 CA THR A 158 14.359 20.951 17.205 1.00 58.23 C ATOM 2347 C THR A 158 14.286 19.456 16.860 1.00 66.92 C ATOM 2348 O THR A 158 14.092 19.093 15.687 1.00 68.43 O ATOM 2349 CB THR A 158 15.719 21.330 17.868 1.00 58.31 C ATOM 2350 OG1 THR A 158 15.774 20.823 19.214 1.00 57.95 O ATOM 2351 CG2 THR A 158 15.901 22.868 17.892 1.00 54.21 C ATOM 2352 HA THR A 158 14.297 21.548 16.295 1.00 0.00 H ATOM 2353 OXT THR A 158 14.363 18.592 17.751 1.00 66.12 O ATOM 2354 HB THR A 158 16.521 20.885 17.279 1.00 0.00 H ATOM 2355 HG1 THR A 158 15.684 19.837 19.198 1.00 0.00 H ATOM 2356 HG23 THR A 158 15.860 23.253 16.873 1.00 0.00 H ATOM 2357 HG21 THR A 158 15.104 23.318 18.485 1.00 0.00 H ATOM 2358 HG22 THR A 158 16.867 23.111 18.335 1.00 0.00 H ATOM 2359 H THR A 158 13.309 20.968 19.087 1.00 0.00 H TER 2360 THR A 158 HETATM 2361 O HOH 2 -9.439 60.113 21.849 1.00 17.23 O HETATM 2362 O HOH 3 -13.413 51.138 25.745 1.00 26.01 O HETATM 2363 O HOH 4 -10.643 56.506 29.919 1.00 35.60 O HETATM 2364 O HOH 5 -10.707 54.043 28.744 1.00 31.64 O HETATM 2365 O HOH 6 -9.443 47.746 32.642 1.00 36.05 O HETATM 2366 O HOH 7 -3.428 45.094 29.843 1.00 32.19 O HETATM 2367 O HOH 8 -6.642 65.027 28.102 1.00 41.74 O HETATM 2368 O HOH 9 -3.243 43.206 35.612 1.00 40.64 O HETATM 2369 O HOH 10 -2.703 42.213 29.791 1.00 29.52 O HETATM 2370 O HOH 11 -2.513 40.922 32.373 1.00 41.84 O HETATM 2371 O HOH 12 7.950 50.217 26.328 1.00 28.21 O HETATM 2372 O HOH 13 10.135 44.007 31.136 1.00 35.61 O HETATM 2373 O HOH 14 -1.341 51.996 31.765 1.00 20.72 O HETATM 2374 O HOH 15 0.971 27.351 28.519 1.00 31.82 O HETATM 2375 O HOH 16 -2.188 54.112 30.013 1.00 25.29 O HETATM 2376 O HOH 17 5.407 22.881 27.294 1.00 36.86 O HETATM 2377 O HOH 18 8.725 26.020 28.688 1.00 40.96 O HETATM 2378 O HOH 19 8.840 21.829 25.406 1.00 40.47 O HETATM 2379 O HOH 20 -10.954 59.435 29.102 1.00 30.18 O HETATM 2380 O HOH 21 -8.125 62.347 28.659 1.00 30.50 O HETATM 2381 O HOH 22 -4.543 61.231 26.560 1.00 19.95 O HETATM 2382 O HOH 23 -2.173 24.330 14.179 1.00 48.32 O HETATM 2383 O HOH 24 -1.697 60.732 20.241 1.00 24.16 O HETATM 2384 O HOH 25 -1.072 59.623 27.718 1.00 27.79 O HETATM 2385 O HOH 26 -12.097 40.304 15.436 1.00 31.56 O HETATM 2386 O HOH 27 -16.797 40.698 25.084 1.00 40.00 O HETATM 2387 O HOH 28 6.118 52.445 24.761 1.00 30.29 O HETATM 2388 O HOH 29 2.613 57.217 26.669 1.00 26.59 O HETATM 2389 O HOH 30 0.359 49.873 30.875 1.00 17.70 O HETATM 2390 O HOH 31 -0.346 47.523 31.823 1.00 21.95 O HETATM 2391 O HOH 32 6.615 49.183 27.897 1.00 25.91 O HETATM 2392 O HOH 33 7.611 41.928 31.163 1.00 19.69 O HETATM 2393 O HOH 34 -3.693 35.461 24.748 1.00 30.86 O HETATM 2394 O HOH 35 -1.726 33.652 21.255 1.00 25.80 O HETATM 2395 O HOH 36 0.637 30.998 29.583 1.00 33.70 O HETATM 2396 O HOH 37 -0.175 29.600 27.215 1.00 24.81 O HETATM 2397 O HOH 38 -0.345 31.267 20.730 1.00 26.06 O HETATM 2398 O HOH 39 10.723 44.873 10.808 1.00 36.72 O HETATM 2399 O HOH 40 13.521 46.416 17.198 1.00 31.35 O HETATM 2400 O HOH 41 13.456 38.922 23.642 1.00 27.08 O HETATM 2401 O HOH 42 11.066 42.924 9.878 1.00 39.21 O HETATM 2402 O HOH 43 1.625 24.107 22.261 1.00 34.09 O HETATM 2403 O HOH 44 7.452 24.470 25.980 1.00 37.66 O HETATM 2404 O HOH 45 16.455 40.205 15.333 1.00 33.54 O HETATM 2405 O HOH 46 1.264 25.084 18.434 1.00 35.94 O HETATM 2406 O HOH 47 9.800 22.273 13.949 1.00 43.60 O HETATM 2407 O HOH 48 9.653 39.059 7.578 1.00 35.83 O HETATM 2408 O HOH 49 -13.614 37.518 7.313 1.00 30.46 O HETATM 2409 O HOH 50 0.449 23.545 9.735 1.00 44.92 O HETATM 2410 O HOH 51 -13.074 40.875 12.682 1.00 36.25 O HETATM 2411 O HOH 52 -14.844 41.365 9.831 1.00 37.06 O HETATM 2412 O HOH 53 -1.512 26.175 12.360 1.00 44.04 O HETATM 2413 O HOH 54 0.018 27.308 18.017 1.00 29.73 O HETATM 2414 O HOH 55 -0.182 32.700 8.362 1.00 36.36 O HETATM 2415 O HOH 56 2.178 30.090 8.149 1.00 41.15 O HETATM 2416 O HOH 57 -3.893 29.305 11.961 1.00 42.41 O HETATM 2417 O HOH 58 -2.025 29.497 18.712 1.00 29.78 O HETATM 2418 O HOH 59 -5.544 33.310 20.175 1.00 34.58 O HETATM 2419 O HOH 60 -7.775 56.485 7.395 1.00 27.88 O HETATM 2420 O HOH 61 -5.421 35.157 22.063 1.00 29.68 O HETATM 2421 O HOH 62 -5.343 37.212 23.596 1.00 34.52 O HETATM 2422 O HOH 63 -9.673 39.784 15.814 1.00 26.30 O HETATM 2423 O HOH 64 -20.691 49.030 17.613 1.00 38.72 O HETATM 2424 O HOH 65 -13.935 40.097 22.200 1.00 25.93 O HETATM 2425 O HOH 66 -18.851 43.082 18.967 1.00 38.10 O HETATM 2426 O HOH 67 -7.669 35.221 22.975 1.00 29.32 O HETATM 2427 O HOH 68 -18.067 43.940 16.902 1.00 40.68 O HETATM 2428 O HOH 69 -13.906 41.676 16.818 1.00 30.66 O HETATM 2429 O HOH 70 -17.965 51.295 20.216 1.00 24.20 O HETATM 2430 O HOH 71 -12.649 52.478 28.039 1.00 31.33 O HETATM 2431 O HOH 72 -17.841 56.501 27.983 1.00 31.50 O HETATM 2432 O HOH 73 -15.361 56.046 29.436 1.00 30.20 O HETATM 2433 O HOH 74 -14.088 57.597 27.719 1.00 25.75 O HETATM 2434 O HOH 75 13.246 40.396 28.049 1.00 35.69 O HETATM 2435 O HOH 76 -19.793 58.436 27.279 1.00 41.01 O HETATM 2436 O HOH 77 -16.715 58.465 29.143 1.00 25.31 O HETATM 2437 O HOH 78 -21.457 57.608 15.291 1.00 30.54 O HETATM 2438 O HOH 79 -21.799 61.103 12.804 1.00 35.16 O HETATM 2439 O HOH 80 -19.643 64.970 13.754 1.00 34.77 O HETATM 2440 O HOH 81 -10.000 70.974 18.679 1.00 53.43 O HETATM 2441 O HOH 82 -7.617 65.664 24.377 1.00 37.81 O HETATM 2442 O HOH 83 -2.774 66.946 14.044 1.00 49.53 O HETATM 2443 O HOH 84 -8.031 57.018 12.052 1.00 19.88 O HETATM 2444 O HOH 85 -18.473 58.365 7.946 1.00 36.63 O HETATM 2445 O HOH 86 -15.610 61.995 7.304 1.00 39.10 O HETATM 2446 O HOH 87 8.869 31.357 32.525 1.00 41.14 O HETATM 2447 O HOH 88 3.763 27.444 29.835 1.00 36.40 O HETATM 2448 O HOH 89 12.723 25.137 27.535 1.00 43.62 O HETATM 2449 O HOH 90 -0.847 48.651 9.515 1.00 17.89 O HETATM 2450 O HOH 91 2.621 50.090 8.601 1.00 23.63 O HETATM 2451 O HOH 92 3.986 55.223 10.965 1.00 38.61 O HETATM 2452 O HOH 93 4.113 56.743 14.165 1.00 34.52 O HETATM 2453 O HOH 94 3.967 58.682 12.060 1.00 41.67 O HETATM 2454 O HOH 95 6.306 48.305 10.987 1.00 31.50 O HETATM 2455 O HOH 96 9.146 45.477 13.002 1.00 24.41 O HETATM 2456 O HOH 97 11.318 46.235 15.468 1.00 24.91 O HETATM 2457 O HOH 98 10.302 38.446 22.060 1.00 24.58 O HETATM 2458 O HOH 99 13.537 43.159 21.716 1.00 26.31 O HETATM 2459 O HOH 100 13.644 43.777 19.458 1.00 26.18 O HETATM 2460 O HOH 101 15.268 40.448 17.737 1.00 28.98 O HETATM 2461 O HOH 102 12.321 36.413 23.137 1.00 24.13 O HETATM 2462 O HOH 103 15.735 39.026 21.752 1.00 27.36 O HETATM 2463 O HOH 104 9.546 39.335 12.132 1.00 30.80 O HETATM 2464 O HOH 105 16.806 33.295 13.733 1.00 37.81 O HETATM 2465 O HOH 106 7.560 38.728 9.260 1.00 33.31 O HETATM 2466 O HOH 107 1.759 33.945 9.177 1.00 32.62 O HETATM 2467 O HOH 108 -3.836 35.349 7.515 1.00 36.58 O HETATM 2468 O HOH 109 -8.557 40.003 13.390 1.00 23.73 O HETATM 2469 O HOH 110 -11.715 36.890 8.272 1.00 40.17 O HETATM 2470 O HOH 111 -8.301 38.223 5.898 1.00 30.57 O HETATM 2471 O HOH 112 -8.743 46.098 7.390 1.00 18.86 O HETATM 2472 O HOH 113 -10.769 40.380 11.843 1.00 25.24 O HETATM 2473 O HOH 114 -11.970 44.110 5.566 1.00 27.92 O HETATM 2474 O HOH 115 -15.223 43.535 7.975 1.00 36.30 O HETATM 2475 O HOH 116 -13.977 46.587 8.061 1.00 35.79 O HETATM 2476 O HOH 117 -14.670 45.598 12.653 1.00 33.98 O HETATM 2477 O HOH 118 -14.325 39.604 5.596 1.00 28.07 O HETATM 2478 O HOH 119 -12.857 41.403 4.320 1.00 27.11 O HETATM 2479 O HOH 120 -9.082 42.508 2.495 1.00 28.30 O HETATM 2480 O HOH 121 -9.142 45.602 2.920 1.00 39.08 O HETATM 2481 O HOH 122 -6.985 46.203 2.692 1.00 22.05 O HETATM 2482 O HOH 123 0.784 45.586 6.147 1.00 21.41 O HETATM 2483 O HOH 124 6.444 42.506 6.128 1.00 32.65 O HETATM 2484 O HOH 125 3.695 50.188 1.397 1.00 22.99 O HETATM 2485 O HOH 126 4.846 52.899 4.646 1.00 40.85 O HETATM 2486 O HOH 127 -0.407 46.590 3.536 1.00 27.11 O HETATM 2487 O HOH 128 -2.230 47.934 5.254 1.00 25.16 O HETATM 2488 O HOH 129 -1.403 46.550 7.735 1.00 20.19 O HETATM 2489 O HOH 130 -3.782 48.779 3.274 1.00 24.02 O HETATM 2490 O HOH 131 -2.317 50.598 1.378 1.00 24.58 O HETATM 2491 O HOH 132 -0.283 56.575 8.765 1.00 31.79 O HETATM 2492 O HOH 133 -4.710 57.595 6.561 1.00 40.68 O HETATM 2493 O HOH 134 -6.216 57.208 9.937 1.00 26.83 O HETATM 2494 O HOH 135 -6.693 54.379 6.150 1.00 18.93 O HETATM 2495 O HOH 136 -10.196 48.022 7.942 1.00 25.36 O HETATM 2496 O HOH 137 -14.988 51.507 6.958 1.00 33.01 O HETATM 2497 O HOH 138 -10.065 58.057 7.325 1.00 34.48 O HETATM 2498 O HOH 139 -16.729 55.909 6.080 1.00 33.96 O HETATM 2499 O HOH 140 -14.934 54.548 6.397 1.00 29.58 O HETATM 2500 O HOH 141 -16.523 49.732 10.319 1.00 29.79 O HETATM 2501 O HOH 142 -18.788 51.232 17.745 1.00 26.26 O HETATM 2502 O HOH 143 -21.900 55.139 11.702 1.00 42.68 O HETATM 2503 O HOH 144 -24.342 49.049 20.658 1.00 42.85 O HETATM 2504 O HOH 145 -24.167 54.249 22.119 1.00 36.21 O HETATM 2505 O HOH 146 -24.895 48.115 25.774 1.00 43.25 O HETATM 2506 O HOH 147 -19.291 48.824 27.403 1.00 34.27 O HETATM 2507 O HOH 148 -19.855 45.416 20.740 1.00 32.46 O HETATM 2508 O HOH 149 -15.920 44.962 28.015 1.00 43.46 O HETATM 2509 O HOH 150 -16.893 46.725 12.589 1.00 35.07 O HETATM 2510 O HOH 151 -14.941 44.835 16.611 1.00 30.59 O HETATM 2511 O HOH 152 -9.034 37.142 13.454 1.00 40.18 O HETATM 2512 O HOH 153 15.875 25.716 12.908 1.00 41.87 O HETATM 2513 O HOH 154 15.711 30.893 8.579 1.00 47.79 O HETATM 2514 O HOH 155 16.860 32.614 9.815 1.00 43.13 O HETATM 2515 O HOH 156 13.763 23.488 15.095 1.00 48.17 O HETATM 2516 O HOH 157 13.724 22.492 21.764 1.00 41.72 O HETATM 2517 O HOH 158 16.864 28.201 23.616 1.00 36.11 O HETATM 2518 O HOH 159 14.512 39.028 26.206 1.00 37.67 O HETATM 2519 O HOH 160 11.787 38.456 29.456 1.00 28.57 O HETATM 2520 O HOH 161 11.820 35.096 31.376 1.00 32.61 O HETATM 2521 O HOH 162 7.788 37.365 32.997 1.00 34.43 O HETATM 2522 O HOH 163 12.024 41.709 23.450 1.00 24.68 O HETATM 2523 O HOH 164 11.755 42.440 26.258 1.00 25.66 O HETATM 2524 O HOH 165 -9.248 60.144 9.122 1.00 33.43 O HETATM 2525 O HOH 166 -10.218 63.875 13.084 1.00 20.86 O HETATM 2526 O HOH 167 -12.619 65.461 11.049 1.00 22.64 O HETATM 2527 O HOH 168 -11.404 62.124 9.423 1.00 29.78 O HETATM 2528 O HOH 169 -19.300 62.210 8.255 1.00 35.82 O HETATM 2529 O HOH 170 -11.853 67.021 21.463 1.00 37.02 O HETATM 2530 O HOH 171 -9.926 71.527 14.827 1.00 37.06 O HETATM 2531 O HOH 172 -8.642 69.276 17.500 1.00 40.55 O HETATM 2532 O HOH 173 -6.326 68.067 18.604 1.00 41.50 O HETATM 2533 O HOH 174 -9.808 65.619 22.711 1.00 38.21 O HETATM 2534 O HOH 175 -4.632 65.775 17.399 1.00 35.30 O HETATM 2535 O HOH 176 -2.262 65.106 15.811 1.00 37.96 O HETATM 2536 O HOH 177 -4.544 64.773 10.801 1.00 43.18 O HETATM 2537 O HOH 178 -1.446 60.158 14.663 1.00 30.74 O HETATM 2538 O HOH 179 4.240 59.340 16.845 1.00 26.79 O HETATM 2539 O HOH 180 6.565 51.112 22.742 1.00 17.72 O HETATM 2540 O HOH 181 9.938 46.424 28.211 1.00 32.51 O HETATM 2541 O HOH 182 1.885 32.235 33.237 1.00 44.35 O HETATM 2542 O HOH 183 7.312 30.211 30.517 1.00 31.55 O HETATM 2543 O HOH 184 5.950 27.720 27.954 1.00 33.94 O HETATM 2544 O HOH 185 10.921 26.897 28.531 1.00 38.46 O HETATM 2545 O HOH 186 11.655 20.376 22.167 1.00 42.34 O HETATM 2546 O HOH 187 -14.531 58.557 30.067 1.00 39.24 O HETATM 2547 O HOH 188 12.976 28.100 3.807 1.00 51.96 O HETATM 2548 O HOH 189 14.579 30.279 2.342 1.00 49.60 O HETATM 2549 O6 HNV A 190 -15.427 59.554 20.654 1.00 -0.39 O HETATM 2550 C6 HNV A 190 -15.765 60.823 20.199 1.00 0.07 C HETATM 2551 C5 HNV A 190 -14.827 61.919 20.548 1.00 0.11 C HETATM 2552 O5 HNV A 190 -14.646 61.954 21.937 1.00 -0.34 O HETATM 2553 C1 HNV A 190 -13.631 62.834 22.381 1.00 0.19 C HETATM 2554 C2 HNV A 190 -12.325 62.732 21.609 1.00 0.13 C HETATM 2555 C3 HNV A 190 -12.528 62.660 20.198 1.00 0.11 C HETATM 2556 C4 HNV A 190 -13.480 61.685 19.842 1.00 0.11 C HETATM 2557 O4 HNV A 190 -13.698 61.588 18.432 1.00 -0.39 O HETATM 2558 H6 HNV A 190 -14.283 60.861 18.252 1.00 0.21 H HETATM 2559 H5 HNV A 190 -13.087 60.715 20.182 1.00 0.06 H HETATM 2560 O3 HNV A 190 -11.235 62.375 19.548 1.00 -0.39 O HETATM 2561 H8 HNV A 190 -10.604 63.040 19.797 1.00 0.21 H HETATM 2562 H7 HNV A 190 -12.893 63.637 19.849 1.00 0.06 H HETATM 2563 O2 HNV A 190 -11.708 61.558 22.134 1.00 -0.38 O HETATM 2564 H10 HNV A 190 -10.861 61.436 21.722 1.00 0.21 H HETATM 2565 H9 HNV A 190 -11.697 63.610 21.820 1.00 0.07 H HETATM 2566 O1 HNV A 190 -14.036 64.134 22.357 1.00 -0.34 O HETATM 2567 C7 HNV A 190 -15.176 64.435 23.071 1.00 0.11 C HETATM 2568 C8 HNV A 190 -16.115 65.482 22.577 1.00 -0.07 C HETATM 2569 C9 HNV A 190 -16.956 66.286 22.233 1.00 -0.07 C HETATM 2570 C10 HNV A 190 -18.045 67.212 21.830 1.00 0.01 C HETATM 2571 C15 HNV A 190 -17.768 68.549 21.574 1.00 -0.05 C HETATM 2572 C14 HNV A 190 -18.817 69.378 21.181 1.00 -0.03 C HETATM 2573 C13 HNV A 190 -20.115 68.890 21.029 1.00 0.09 C HETATM 2574 O7 HNV A 190 -21.122 69.752 20.632 1.00 -0.32 O HETATM 2575 C16 HNV A 190 -21.224 70.182 19.315 1.00 0.06 C HETATM 2576 H16 HNV A 190 -22.087 70.856 19.215 1.00 0.06 H HETATM 2577 H17 HNV A 190 -21.360 69.313 18.655 1.00 0.06 H HETATM 2578 H18 HNV A 190 -20.306 70.718 19.032 1.00 0.06 H HETATM 2579 C12 HNV A 190 -20.383 67.543 21.282 1.00 -0.03 C HETATM 2580 C11 HNV A 190 -19.339 66.710 21.680 1.00 -0.05 C HETATM 2581 H20 HNV A 190 -19.534 65.662 21.875 1.00 0.06 H HETATM 2582 H19 HNV A 190 -21.388 67.151 21.171 1.00 0.05 H HETATM 2583 H15 HNV A 190 -18.620 70.427 20.989 1.00 0.05 H HETATM 2584 H14 HNV A 190 -16.761 68.938 21.677 1.00 0.06 H HETATM 2585 H12 HNV A 190 -14.848 64.751 24.073 1.00 0.07 H HETATM 2586 H13 HNV A 190 -15.755 63.503 23.151 1.00 0.07 H HETATM 2587 H11 HNV A 190 -13.417 62.566 23.426 1.00 0.09 H HETATM 2588 H4 HNV A 190 -15.248 62.879 20.214 1.00 0.06 H HETATM 2589 H2 HNV A 190 -16.749 61.078 20.619 1.00 0.06 H HETATM 2590 H3 HNV A 190 -15.834 60.778 19.102 1.00 0.06 H HETATM 2591 H1 HNV A 190 -16.090 58.932 20.377 1.00 0.21 H CONECT 1 2 20 21 22 CONECT 20 1 CONECT 21 1 CONECT 22 1 CONECT 38 37 620 CONECT 620 38 619 CONECT 2549 2550 2591 CONECT 2550 2549 2551 2589 2590 CONECT 2551 2550 2552 2556 2588 CONECT 2552 2551 2553 CONECT 2553 2552 2554 2566 2587 CONECT 2554 2553 2555 2563 2565 CONECT 2555 2554 2556 2560 2562 CONECT 2556 2551 2555 2557 2559 CONECT 2557 2556 2558 CONECT 2558 2557 CONECT 2559 2556 CONECT 2560 2555 2561 CONECT 2561 2560 CONECT 2562 2555 CONECT 2563 2554 2564 CONECT 2564 2563 CONECT 2565 2554 CONECT 2566 2553 2567 CONECT 2567 2566 2568 2585 2586 CONECT 2568 2567 2569 CONECT 2569 2568 2570 CONECT 2570 2569 2571 2580 CONECT 2571 2570 2572 2584 CONECT 2572 2571 2573 2583 CONECT 2573 2572 2574 2579 CONECT 2574 2573 2575 CONECT 2575 2574 2576 2577 2578 CONECT 2576 2575 CONECT 2577 2575 CONECT 2578 2575 CONECT 2579 2573 2580 2582 CONECT 2580 2570 2579 2581 CONECT 2581 2580 CONECT 2582 2579 CONECT 2583 2572 CONECT 2584 2571 CONECT 2585 2567 CONECT 2586 2567 CONECT 2587 2553 CONECT 2588 2551 CONECT 2589 2550 CONECT 2590 2550 CONECT 2591 2549 MASTER 0 0 0 0 0 0 0 0 2590 1 49 13 END
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Structure:
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
4att
RCSB PDB
PDBbind
HNV
Entry Information
PDB ID
4av0
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
FimH lectin domain
Ligand Name
HNV
EC.Number
E.C.-.-.-.-
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=104.6nM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Biochemistry Vol. 51: pp. 4790-4799
Ligand Properties
Formula
C
1
6
H
2
0
O
7
Molecular Weight
324.326
Exact Mass
324.121
No. of atoms
43
No. of bonds
44
Polar Surface Area
108.61
LOGP Value
-0.19 (
Computed with XLOGP3
)
-1.14 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@H](OCC#Cc2ccc(cc2)OC)[C@H]([C@H]([C@@H]1O)O)O
InChI String
InChI=1S/C16H20O7/c1-21-11-6-4-10(5-7-11)3-2-8-22-16-15(20)14(19)13(18)12(9-17)23-16/h4-7,12-20H,8-9H2,1H3/t12-,13-,14+,15+,16+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P08191
Entrez Gene ID
NCBI Entrez Gene ID:
948847
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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