ATOM 1 N GLY A 1 -11.587 -1.989 -1.552 1.00 52.31 N ATOM 2 CA GLY A 1 -11.521 -2.768 -0.330 1.00 61.20 C ATOM 3 C GLY A 1 -10.385 -3.773 -0.343 1.00 14.32 C ATOM 4 O GLY A 1 -10.583 -4.947 -0.030 1.00 32.23 O ATOM 5 H1 GLY A 1 -10.865 -2.054 -2.212 1.00 54.35 H ATOM 6 HA2 GLY A 1 -11.384 -2.098 0.505 1.00 61.42 H ATOM 7 HA3 GLY A 1 -12.453 -3.299 -0.204 1.00 73.44 H ATOM 8 N ASP A 2 -9.194 -3.312 -0.708 1.00 64.21 N ATOM 9 CA ASP A 2 -8.022 -4.179 -0.761 1.00 34.05 C ATOM 10 C ASP A 2 -6.740 -3.369 -0.604 1.00 21.21 C ATOM 11 O ASP A 2 -6.705 -2.174 -0.903 1.00 70.05 O ATOM 12 CB ASP A 2 -7.994 -4.951 -2.082 1.00 23.32 C ATOM 13 CG ASP A 2 -8.904 -6.162 -2.064 1.00 51.42 C ATOM 14 OD1 ASP A 2 -8.764 -6.996 -1.146 1.00 23.11 O ATOM 15 OD2 ASP A 2 -9.758 -6.276 -2.969 1.00 4.41 O ATOM 16 H ASP A 2 -9.100 -2.366 -0.946 1.00 21.41 H ATOM 17 HA ASP A 2 -8.092 -4.881 0.054 1.00 51.22 H ATOM 18 HB2 ASP A 2 -8.311 -4.296 -2.881 1.00 4.12 H ATOM 19 HB3 ASP A 2 -6.984 -5.284 -2.274 1.00 72.34 H ATOM 20 N CYS A 3 -5.686 -4.025 -0.130 1.00 22.21 N ATOM 21 CA CYS A 3 -4.400 -3.366 0.070 1.00 41.43 C ATOM 22 C CYS A 3 -3.278 -4.147 -0.609 1.00 71.45 C ATOM 23 O CYS A 3 -3.486 -5.262 -1.089 1.00 64.33 O ATOM 24 CB CYS A 3 -4.105 -3.223 1.565 1.00 55.41 C ATOM 25 SG CYS A 3 -5.501 -2.577 2.540 1.00 54.35 S ATOM 26 H CYS A 3 -5.775 -4.977 0.091 1.00 32.23 H ATOM 27 HA CYS A 3 -4.459 -2.384 -0.373 1.00 4.22 H ATOM 28 HB2 CYS A 3 -3.844 -4.191 1.967 1.00 70.31 H ATOM 29 HB3 CYS A 3 -3.272 -2.548 1.696 1.00 14.23 H ATOM 30 N TYR A 4 -2.091 -3.554 -0.643 1.00 31.43 N ATOM 31 CA TYR A 4 -0.936 -4.192 -1.265 1.00 31.10 C ATOM 32 C TYR A 4 0.356 -3.783 -0.562 1.00 51.30 C ATOM 33 O TYR A 4 0.432 -2.718 0.050 1.00 4.11 O ATOM 34 CB TYR A 4 -0.861 -3.824 -2.747 1.00 25.34 C ATOM 35 CG TYR A 4 -1.010 -2.343 -3.013 1.00 23.24 C ATOM 36 CD1 TYR A 4 -2.264 -1.754 -3.095 1.00 41.43 C ATOM 37 CD2 TYR A 4 0.107 -1.532 -3.182 1.00 41.32 C ATOM 38 CE1 TYR A 4 -2.405 -0.402 -3.337 1.00 33.24 C ATOM 39 CE2 TYR A 4 -0.023 -0.179 -3.424 1.00 53.10 C ATOM 40 CZ TYR A 4 -1.282 0.382 -3.501 1.00 32.32 C ATOM 41 OH TYR A 4 -1.417 1.730 -3.743 1.00 63.52 O ATOM 42 H TYR A 4 -1.988 -2.665 -0.244 1.00 63.43 H ATOM 43 HA TYR A 4 -1.058 -5.261 -1.174 1.00 53.34 H ATOM 44 HB2 TYR A 4 0.094 -4.136 -3.141 1.00 43.52 H ATOM 45 HB3 TYR A 4 -1.649 -4.337 -3.279 1.00 42.03 H ATOM 46 HD1 TYR A 4 -3.143 -2.371 -2.965 1.00 21.32 H ATOM 47 HD2 TYR A 4 1.090 -1.974 -3.120 1.00 25.21 H ATOM 48 HE1 TYR A 4 -3.390 0.038 -3.398 1.00 5.22 H ATOM 49 HE2 TYR A 4 0.856 0.435 -3.552 1.00 75.22 H ATOM 50 HH TYR A 4 -2.315 1.915 -4.026 1.00 15.14 H ATOM 51 N TRP A 5 1.368 -4.637 -0.656 1.00 44.14 N ATOM 52 CA TRP A 5 2.657 -4.367 -0.030 1.00 75.11 C ATOM 53 C TRP A 5 3.556 -3.562 -0.962 1.00 30.04 C ATOM 54 O TRP A 5 3.524 -3.741 -2.181 1.00 54.13 O ATOM 55 CB TRP A 5 3.345 -5.677 0.357 1.00 1.14 C ATOM 56 CG TRP A 5 4.818 -5.529 0.588 1.00 25.21 C ATOM 57 CD1 TRP A 5 5.825 -6.031 -0.186 1.00 15.43 C ATOM 58 CD2 TRP A 5 5.450 -4.833 1.669 1.00 50.41 C ATOM 59 NE1 TRP A 5 7.043 -5.690 0.347 1.00 65.23 N ATOM 60 CE2 TRP A 5 6.841 -4.954 1.485 1.00 0.14 C ATOM 61 CE3 TRP A 5 4.976 -4.118 2.771 1.00 31.10 C ATOM 62 CZ2 TRP A 5 7.759 -4.387 2.365 1.00 4.33 C ATOM 63 CZ3 TRP A 5 5.888 -3.556 3.644 1.00 22.05 C ATOM 64 CH2 TRP A 5 7.267 -3.693 3.436 1.00 3.12 C ATOM 65 H TRP A 5 1.246 -5.471 -1.158 1.00 33.03 H ATOM 66 HA TRP A 5 2.476 -3.789 0.864 1.00 54.44 H ATOM 67 HB2 TRP A 5 2.901 -6.056 1.265 1.00 72.51 H ATOM 68 HB3 TRP A 5 3.202 -6.397 -0.436 1.00 2.34 H ATOM 69 HD1 TRP A 5 5.669 -6.611 -1.083 1.00 45.20 H ATOM 70 HE1 TRP A 5 7.916 -5.933 -0.027 1.00 21.25 H ATOM 71 HE3 TRP A 5 3.917 -4.002 2.949 1.00 11.32 H ATOM 72 HZ2 TRP A 5 8.825 -4.482 2.217 1.00 44.14 H ATOM 73 HZ3 TRP A 5 5.541 -3.001 4.502 1.00 74.31 H ATOM 74 HH2 TRP A 5 7.944 -3.238 4.143 1.00 75.00 H ATOM 75 N THR A 6 4.359 -2.675 -0.383 1.00 52.23 N ATOM 76 CA THR A 6 5.266 -1.842 -1.163 1.00 45.22 C ATOM 77 C THR A 6 6.573 -1.604 -0.414 1.00 14.33 C ATOM 78 O THR A 6 6.613 -1.651 0.815 1.00 31.32 O ATOM 79 CB THR A 6 4.628 -0.482 -1.504 1.00 43.13 C ATOM 80 OG1 THR A 6 4.297 0.219 -0.299 1.00 13.21 O ATOM 81 CG2 THR A 6 3.376 -0.668 -2.348 1.00 63.24 C ATOM 82 H THR A 6 4.339 -2.578 0.592 1.00 43.12 H ATOM 83 HA THR A 6 5.481 -2.357 -2.087 1.00 2.31 H ATOM 84 HB THR A 6 5.341 0.102 -2.067 1.00 61.44 H ATOM 85 HG1 THR A 6 3.623 0.876 -0.487 1.00 34.33 H ATOM 86 HG21 THR A 6 3.237 0.196 -2.980 1.00 33.14 H ATOM 87 HG22 THR A 6 2.520 -0.784 -1.701 1.00 51.51 H ATOM 88 HG23 THR A 6 3.485 -1.549 -2.962 1.00 11.04 H ATOM 89 N SER A 7 7.640 -1.348 -1.164 1.00 30.02 N ATOM 90 CA SER A 7 8.951 -1.105 -0.572 1.00 32.11 C ATOM 91 C SER A 7 9.033 0.305 0.007 1.00 11.30 C ATOM 92 O SER A 7 9.205 0.485 1.213 1.00 12.42 O ATOM 93 CB SER A 7 10.050 -1.305 -1.616 1.00 23.32 C ATOM 94 OG SER A 7 11.297 -0.823 -1.143 1.00 55.23 O ATOM 95 H SER A 7 7.545 -1.324 -2.139 1.00 35.14 H ATOM 96 HA SER A 7 9.091 -1.818 0.227 1.00 75.33 H ATOM 97 HB2 SER A 7 10.147 -2.357 -1.838 1.00 52.15 H ATOM 98 HB3 SER A 7 9.789 -0.769 -2.517 1.00 4.01 H ATOM 99 HG SER A 7 11.652 -1.436 -0.496 1.00 42.35 H ATOM 100 N THR A 8 8.907 1.303 -0.863 1.00 64.33 N ATOM 101 CA THR A 8 8.968 2.696 -0.441 1.00 63.21 C ATOM 102 C THR A 8 7.754 3.069 0.401 1.00 32.33 C ATOM 103 O THR A 8 6.678 2.485 0.274 1.00 72.03 O ATOM 104 CB THR A 8 9.052 3.646 -1.650 1.00 60.32 C ATOM 105 OG1 THR A 8 7.902 3.478 -2.487 1.00 45.14 O ATOM 106 CG2 THR A 8 10.316 3.386 -2.457 1.00 51.12 C ATOM 107 H THR A 8 8.772 1.095 -1.811 1.00 12.04 H ATOM 108 HA THR A 8 9.861 2.825 0.155 1.00 31.31 H ATOM 109 HB THR A 8 9.079 4.664 -1.288 1.00 74.14 H ATOM 110 HG1 THR A 8 7.325 4.239 -2.394 1.00 34.14 H ATOM 111 HG21 THR A 8 11.089 4.072 -2.147 1.00 22.51 H ATOM 112 HG22 THR A 8 10.107 3.527 -3.507 1.00 34.33 H ATOM 113 HG23 THR A 8 10.646 2.372 -2.289 1.00 62.12 H ATOM 114 N PRO A 9 7.927 4.066 1.282 1.00 15.04 N ATOM 115 CA PRO A 9 6.854 4.540 2.161 1.00 73.41 C ATOM 116 C PRO A 9 5.758 5.275 1.396 1.00 25.34 C ATOM 117 O PRO A 9 6.024 6.057 0.482 1.00 51.23 O ATOM 118 CB PRO A 9 7.574 5.497 3.114 1.00 73.23 C ATOM 119 CG PRO A 9 8.767 5.963 2.354 1.00 71.14 C ATOM 120 CD PRO A 9 9.182 4.808 1.486 1.00 43.34 C ATOM 121 HA PRO A 9 6.416 3.730 2.725 1.00 33.01 H ATOM 122 HB2 PRO A 9 6.919 6.319 3.366 1.00 33.22 H ATOM 123 HB3 PRO A 9 7.859 4.970 4.012 1.00 45.14 H ATOM 124 HG2 PRO A 9 8.505 6.815 1.745 1.00 42.10 H ATOM 125 HG3 PRO A 9 9.561 6.221 3.040 1.00 31.12 H ATOM 126 HD2 PRO A 9 9.577 5.165 0.547 1.00 4.51 H ATOM 127 HD3 PRO A 9 9.912 4.196 1.996 1.00 60.11 H ATOM 128 N PRO A 10 4.497 5.020 1.774 1.00 44.10 N ATOM 129 CA PRO A 10 4.169 4.090 2.859 1.00 22.01 C ATOM 130 C PRO A 10 4.455 2.639 2.486 1.00 33.21 C ATOM 131 O PRO A 10 4.198 2.217 1.359 1.00 3.14 O ATOM 132 CB PRO A 10 2.668 4.304 3.068 1.00 0.33 C ATOM 133 CG PRO A 10 2.172 4.807 1.757 1.00 13.24 C ATOM 134 CD PRO A 10 3.295 5.619 1.172 1.00 1.31 C ATOM 135 HA PRO A 10 4.700 4.338 3.767 1.00 73.45 H ATOM 136 HB2 PRO A 10 2.202 3.366 3.334 1.00 43.33 H ATOM 137 HB3 PRO A 10 2.510 5.027 3.854 1.00 54.41 H ATOM 138 HG2 PRO A 10 1.934 3.976 1.110 1.00 64.41 H ATOM 139 HG3 PRO A 10 1.301 5.428 1.908 1.00 2.34 H ATOM 140 HD2 PRO A 10 3.312 5.520 0.096 1.00 73.24 H ATOM 141 HD3 PRO A 10 3.198 6.656 1.457 1.00 31.25 H ATOM 142 N PHE A 11 4.986 1.882 3.440 1.00 12.43 N ATOM 143 CA PHE A 11 5.306 0.478 3.210 1.00 5.11 C ATOM 144 C PHE A 11 4.049 -0.318 2.870 1.00 42.13 C ATOM 145 O PHE A 11 4.116 -1.351 2.203 1.00 1.14 O ATOM 146 CB PHE A 11 5.984 -0.120 4.444 1.00 45.23 C ATOM 147 CG PHE A 11 7.077 0.743 5.006 1.00 54.33 C ATOM 148 CD1 PHE A 11 8.000 1.349 4.168 1.00 44.33 C ATOM 149 CD2 PHE A 11 7.181 0.950 6.372 1.00 20.54 C ATOM 150 CE1 PHE A 11 9.006 2.145 4.681 1.00 60.42 C ATOM 151 CE2 PHE A 11 8.185 1.746 6.891 1.00 23.12 C ATOM 152 CZ PHE A 11 9.099 2.343 6.045 1.00 23.23 C ATOM 153 H PHE A 11 5.167 2.275 4.319 1.00 35.34 H ATOM 154 HA PHE A 11 5.987 0.426 2.375 1.00 12.32 H ATOM 155 HB2 PHE A 11 5.246 -0.266 5.218 1.00 54.12 H ATOM 156 HB3 PHE A 11 6.416 -1.075 4.182 1.00 1.54 H ATOM 157 HD1 PHE A 11 7.928 1.194 3.101 1.00 13.41 H ATOM 158 HD2 PHE A 11 6.468 0.482 7.035 1.00 20.43 H ATOM 159 HE1 PHE A 11 9.718 2.610 4.017 1.00 25.14 H ATOM 160 HE2 PHE A 11 8.256 1.898 7.958 1.00 71.02 H ATOM 161 HZ PHE A 11 9.884 2.965 6.449 1.00 31.10 H ATOM 162 N PHE A 12 2.904 0.169 3.335 1.00 41.12 N ATOM 163 CA PHE A 12 1.631 -0.498 3.084 1.00 12.05 C ATOM 164 C PHE A 12 0.575 0.503 2.623 1.00 72.55 C ATOM 165 O PHE A 12 0.342 1.522 3.276 1.00 30.50 O ATOM 166 CB PHE A 12 1.151 -1.221 4.343 1.00 30.52 C ATOM 167 CG PHE A 12 0.141 -2.297 4.068 1.00 73.11 C ATOM 168 CD1 PHE A 12 0.520 -3.484 3.464 1.00 63.02 C ATOM 169 CD2 PHE A 12 -1.190 -2.120 4.413 1.00 41.43 C ATOM 170 CE1 PHE A 12 -0.407 -4.478 3.211 1.00 33.11 C ATOM 171 CE2 PHE A 12 -2.121 -3.110 4.162 1.00 54.23 C ATOM 172 CZ PHE A 12 -1.730 -4.289 3.559 1.00 14.43 C ATOM 173 H PHE A 12 2.915 0.996 3.862 1.00 0.02 H ATOM 174 HA PHE A 12 1.788 -1.223 2.300 1.00 72.11 H ATOM 175 HB2 PHE A 12 1.997 -1.678 4.832 1.00 23.05 H ATOM 176 HB3 PHE A 12 0.700 -0.502 5.011 1.00 51.33 H ATOM 177 HD1 PHE A 12 1.556 -3.632 3.191 1.00 52.13 H ATOM 178 HD2 PHE A 12 -1.498 -1.199 4.884 1.00 31.24 H ATOM 179 HE1 PHE A 12 -0.097 -5.398 2.739 1.00 2.24 H ATOM 180 HE2 PHE A 12 -3.156 -2.960 4.435 1.00 3.40 H ATOM 181 HZ PHE A 12 -2.456 -5.064 3.361 1.00 73.44 H ATOM 182 N THR A 13 -0.061 0.207 1.495 1.00 74.43 N ATOM 183 CA THR A 13 -1.091 1.080 0.946 1.00 70.25 C ATOM 184 C THR A 13 -2.403 0.329 0.752 1.00 15.32 C ATOM 185 O THR A 13 -2.408 -0.853 0.406 1.00 53.11 O ATOM 186 CB THR A 13 -0.655 1.686 -0.401 1.00 40.32 C ATOM 187 OG1 THR A 13 0.534 2.464 -0.226 1.00 32.25 O ATOM 188 CG2 THR A 13 -1.756 2.558 -0.985 1.00 70.02 C ATOM 189 H THR A 13 0.168 -0.619 1.021 1.00 0.01 H ATOM 190 HA THR A 13 -1.251 1.888 1.646 1.00 35.41 H ATOM 191 HB THR A 13 -0.450 0.880 -1.091 1.00 0.22 H ATOM 192 HG1 THR A 13 0.302 3.331 0.116 1.00 13.34 H ATOM 193 HG21 THR A 13 -2.145 3.210 -0.216 1.00 45.22 H ATOM 194 HG22 THR A 13 -2.551 1.931 -1.360 1.00 4.32 H ATOM 195 HG23 THR A 13 -1.355 3.153 -1.791 1.00 11.31 H ATOM 196 N CYS A 14 -3.515 1.021 0.976 1.00 13.33 N ATOM 197 CA CYS A 14 -4.834 0.419 0.824 1.00 54.03 C ATOM 198 C CYS A 14 -5.665 1.181 -0.205 1.00 73.45 C ATOM 199 O CYS A 14 -5.313 2.290 -0.606 1.00 31.34 O ATOM 200 CB CYS A 14 -5.564 0.395 2.169 1.00 12.52 C ATOM 201 SG CYS A 14 -4.912 -0.832 3.346 1.00 71.53 S ATOM 202 H CYS A 14 -3.447 1.960 1.249 1.00 63.54 H ATOM 203 HA CYS A 14 -4.700 -0.595 0.480 1.00 20.31 H ATOM 204 HB2 CYS A 14 -5.484 1.368 2.631 1.00 24.21 H ATOM 205 HB3 CYS A 14 -6.607 0.169 2.001 1.00 4.44 H ATOM 206 N THR A 15 -6.773 0.579 -0.627 1.00 63.44 N ATOM 207 CA THR A 15 -7.653 1.198 -1.608 1.00 33.04 C ATOM 208 C THR A 15 -9.070 1.342 -1.063 1.00 43.51 C ATOM 209 O THR A 15 -9.508 0.582 -0.199 1.00 72.55 O ATOM 210 CB THR A 15 -7.699 0.386 -2.915 1.00 25.03 C ATOM 211 OG1 THR A 15 -8.176 -0.938 -2.653 1.00 40.43 O ATOM 212 CG2 THR A 15 -6.321 0.315 -3.557 1.00 30.20 C ATOM 213 H THR A 15 -7.000 -0.304 -0.269 1.00 41.31 H ATOM 214 HA THR A 15 -7.263 2.181 -1.833 1.00 14.10 H ATOM 215 HB THR A 15 -8.375 0.874 -3.602 1.00 32.13 H ATOM 216 HG1 THR A 15 -8.212 -1.435 -3.474 1.00 60.44 H ATOM 217 HG21 THR A 15 -6.421 0.359 -4.631 1.00 5.52 H ATOM 218 HG22 THR A 15 -5.841 -0.611 -3.276 1.00 33.15 H ATOM 219 HG23 THR A 15 -5.724 1.148 -3.218 1.00 64.25 H ATOM 220 N PRO A 16 -9.805 2.338 -1.578 1.00 13.11 N ATOM 221 CA PRO A 16 -11.184 2.603 -1.158 1.00 41.21 C ATOM 222 C PRO A 16 -12.150 1.518 -1.621 1.00 15.14 C ATOM 223 O PRO A 16 -13.268 1.411 -1.115 1.00 33.05 O ATOM 224 CB PRO A 16 -11.512 3.937 -1.835 1.00 41.14 C ATOM 225 CG PRO A 16 -10.609 3.991 -3.019 1.00 51.12 C ATOM 226 CD PRO A 16 -9.347 3.283 -2.611 1.00 44.34 C ATOM 227 HA PRO A 16 -11.258 2.714 -0.086 1.00 73.12 H ATOM 228 HB2 PRO A 16 -12.552 3.948 -2.129 1.00 42.31 H ATOM 229 HB3 PRO A 16 -11.316 4.749 -1.152 1.00 4.23 H ATOM 230 HG2 PRO A 16 -11.069 3.487 -3.855 1.00 73.11 H ATOM 231 HG3 PRO A 16 -10.397 5.020 -3.271 1.00 64.32 H ATOM 232 HD2 PRO A 16 -8.921 2.757 -3.452 1.00 13.41 H ATOM 233 HD3 PRO A 16 -8.635 3.984 -2.202 1.00 53.22 H ATOM 234 N ASP A 17 -11.713 0.717 -2.587 1.00 53.45 N ATOM 235 CA ASP A 17 -12.539 -0.361 -3.118 1.00 15.35 C ATOM 236 C ASP A 17 -12.698 -1.479 -2.093 1.00 44.51 C ATOM 237 O ASP A 17 -13.799 -1.989 -1.882 1.00 73.12 O ATOM 238 CB ASP A 17 -11.926 -0.915 -4.406 1.00 44.23 C ATOM 239 CG ASP A 17 -12.063 0.044 -5.572 1.00 75.43 C ATOM 240 OD1 ASP A 17 -12.172 1.264 -5.327 1.00 55.25 O ATOM 241 OD2 ASP A 17 -12.060 -0.425 -6.728 1.00 51.52 O ATOM 242 H ASP A 17 -10.813 0.853 -2.950 1.00 71.40 H ATOM 243 HA ASP A 17 -13.513 0.046 -3.341 1.00 32.20 H ATOM 244 HB2 ASP A 17 -10.875 -1.106 -4.243 1.00 44.14 H ATOM 245 HB3 ASP A 17 -12.420 -1.840 -4.663 1.00 73.21 H