ATOM 28 N GLY A 3 3.367 3.215 -4.116 1.00 42.22 N ATOM 29 CA GLY A 3 4.616 3.882 -4.436 1.00 53.04 C ATOM 30 C GLY A 3 5.766 2.909 -4.603 1.00 4.41 C ATOM 31 O GLY A 3 5.869 1.926 -3.869 1.00 4.34 O ATOM 32 H GLY A 3 3.167 2.339 -4.508 1.00 25.05 H ATOM 33 HA2 GLY A 3 4.490 4.436 -5.355 1.00 22.22 H ATOM 34 HA3 GLY A 3 4.856 4.573 -3.641 1.00 72.33 H ATOM 35 N CYS A 4 6.634 3.182 -5.572 1.00 32.11 N ATOM 36 CA CYS A 4 7.782 2.323 -5.835 1.00 30.10 C ATOM 37 C CYS A 4 8.594 2.847 -7.016 1.00 71.31 C ATOM 38 O CYS A 4 9.773 3.177 -6.893 1.00 4.32 O ATOM 39 CB CYS A 4 7.321 0.891 -6.114 1.00 12.00 C ATOM 40 SG CYS A 4 7.790 -0.306 -4.824 1.00 24.13 S ATOM 41 H CYS A 4 6.498 3.981 -6.125 1.00 24.14 H ATOM 42 HA CYS A 4 8.407 2.325 -4.955 1.00 50.41 H ATOM 43 HB2 CYS A 4 6.244 0.878 -6.197 1.00 33.32 H ATOM 44 HB3 CYS A 4 7.752 0.557 -7.046 1.00 3.11 H ATOM 45 N PRO A 5 7.949 2.925 -8.189 1.00 74.34 N ATOM 46 CA PRO A 5 8.591 3.408 -9.415 1.00 53.23 C ATOM 47 C PRO A 5 8.884 4.904 -9.365 1.00 74.23 C ATOM 48 O PRO A 5 9.979 5.343 -9.715 1.00 1.14 O ATOM 49 CB PRO A 5 7.557 3.102 -10.502 1.00 31.32 C ATOM 50 CG PRO A 5 6.251 3.078 -9.786 1.00 14.22 C ATOM 51 CD PRO A 5 6.542 2.548 -8.409 1.00 63.54 C ATOM 52 HA PRO A 5 9.504 2.870 -9.623 1.00 42.43 H ATOM 53 HB2 PRO A 5 7.582 3.877 -11.255 1.00 32.12 H ATOM 54 HB3 PRO A 5 7.776 2.146 -10.954 1.00 5.15 H ATOM 55 HG2 PRO A 5 5.847 4.077 -9.725 1.00 2.41 H ATOM 56 HG3 PRO A 5 5.562 2.425 -10.301 1.00 20.42 H ATOM 57 HD2 PRO A 5 5.899 3.016 -7.680 1.00 14.40 H ATOM 58 HD3 PRO A 5 6.424 1.474 -8.386 1.00 15.32 H ATOM 59 N TRP A 6 7.899 5.680 -8.929 1.00 15.21 N ATOM 60 CA TRP A 6 8.052 7.128 -8.833 1.00 33.50 C ATOM 61 C TRP A 6 7.845 7.603 -7.399 1.00 62.01 C ATOM 62 O TRP A 6 8.473 8.565 -6.958 1.00 73.22 O ATOM 63 CB TRP A 6 7.061 7.829 -9.764 1.00 32.34 C ATOM 64 CG TRP A 6 5.848 7.003 -10.071 1.00 24.10 C ATOM 65 CD1 TRP A 6 5.645 6.224 -11.174 1.00 42.45 C ATOM 66 CD2 TRP A 6 4.672 6.876 -9.266 1.00 35.34 C ATOM 67 NE1 TRP A 6 4.413 5.621 -11.104 1.00 32.24 N ATOM 68 CE2 TRP A 6 3.796 6.003 -9.942 1.00 2.42 C ATOM 69 CE3 TRP A 6 4.273 7.412 -8.038 1.00 72.22 C ATOM 70 CZ2 TRP A 6 2.548 5.658 -9.431 1.00 11.33 C ATOM 71 CZ3 TRP A 6 3.033 7.069 -7.533 1.00 24.55 C ATOM 72 CH2 TRP A 6 2.183 6.198 -8.227 1.00 62.03 C ATOM 73 H TRP A 6 7.048 5.271 -8.665 1.00 33.03 H ATOM 74 HA TRP A 6 9.057 7.375 -9.141 1.00 22.44 H ATOM 75 HB2 TRP A 6 6.730 8.747 -9.302 1.00 23.24 H ATOM 76 HB3 TRP A 6 7.555 8.057 -10.697 1.00 30.00 H ATOM 77 HD1 TRP A 6 6.357 6.111 -11.978 1.00 11.01 H ATOM 78 HE1 TRP A 6 4.038 5.013 -11.776 1.00 14.55 H ATOM 79 HE3 TRP A 6 4.914 8.084 -7.488 1.00 0.42 H ATOM 80 HZ2 TRP A 6 1.881 4.988 -9.954 1.00 5.11 H ATOM 81 HZ3 TRP A 6 2.708 7.473 -6.586 1.00 11.55 H ATOM 82 HH2 TRP A 6 1.224 5.958 -7.795 1.00 23.32 H ATOM 83 N ASN A 7 6.962 6.922 -6.676 1.00 13.50 N ATOM 84 CA ASN A 7 6.673 7.277 -5.291 1.00 73.40 C ATOM 85 C ASN A 7 7.569 6.499 -4.332 1.00 44.13 C ATOM 86 O ASN A 7 7.208 6.266 -3.179 1.00 51.23 O ATOM 87 CB ASN A 7 5.203 7.001 -4.969 1.00 14.55 C ATOM 88 CG ASN A 7 4.377 8.272 -4.907 1.00 33.11 C ATOM 89 OD1 ASN A 7 4.753 9.298 -5.472 1.00 44.44 O ATOM 90 ND2 ASN A 7 3.244 8.208 -4.217 1.00 74.24 N ATOM 91 H ASN A 7 6.493 6.165 -7.083 1.00 74.51 H ATOM 92 HA ASN A 7 6.867 8.332 -5.171 1.00 71.24 H ATOM 93 HB2 ASN A 7 4.786 6.361 -5.733 1.00 4.50 H ATOM 94 HB3 ASN A 7 5.137 6.504 -4.013 1.00 35.22 H ATOM 95 HD21 ASN A 7 3.007 7.357 -3.793 1.00 20.51 H ATOM 96 HD22 ASN A 7 2.690 9.014 -4.162 1.00 11.42 H ATOM 97 N ALA A 8 8.741 6.101 -4.818 1.00 33.21 N ATOM 98 CA ALA A 8 9.690 5.352 -4.004 1.00 2.10 C ATOM 99 C ALA A 8 9.923 6.038 -2.662 1.00 30.42 C ATOM 100 O ALA A 8 10.178 5.379 -1.653 1.00 64.14 O ATOM 101 CB ALA A 8 11.007 5.185 -4.749 1.00 35.35 C ATOM 102 H ALA A 8 8.972 6.317 -5.745 1.00 61.10 H ATOM 103 HA ALA A 8 9.277 4.369 -3.828 1.00 11.30 H ATOM 104 HB1 ALA A 8 11.547 6.120 -4.738 1.00 14.32 H ATOM 105 HB2 ALA A 8 11.598 4.421 -4.266 1.00 2.31 H ATOM 106 HB3 ALA A 8 10.808 4.895 -5.770 1.00 12.15 H ATOM 107 N TYR A 9 9.834 7.363 -2.657 1.00 31.15 N ATOM 108 CA TYR A 9 10.038 8.138 -1.438 1.00 61.24 C ATOM 109 C TYR A 9 9.154 7.619 -0.308 1.00 40.23 C ATOM 110 O TYR A 9 9.505 7.725 0.866 1.00 32.24 O ATOM 111 CB TYR A 9 9.743 9.617 -1.694 1.00 71.32 C ATOM 112 CG TYR A 9 10.924 10.524 -1.434 1.00 23.33 C ATOM 113 CD1 TYR A 9 11.267 10.898 -0.140 1.00 75.42 C ATOM 114 CD2 TYR A 9 11.699 11.006 -2.482 1.00 11.13 C ATOM 115 CE1 TYR A 9 12.344 11.727 0.102 1.00 25.21 C ATOM 116 CE2 TYR A 9 12.780 11.835 -2.249 1.00 34.43 C ATOM 117 CZ TYR A 9 13.098 12.192 -0.955 1.00 40.42 C ATOM 118 OH TYR A 9 14.173 13.017 -0.718 1.00 5.41 O ATOM 119 H TYR A 9 9.628 7.832 -3.492 1.00 34.22 H ATOM 120 HA TYR A 9 11.073 8.032 -1.148 1.00 1.42 H ATOM 121 HB2 TYR A 9 9.448 9.745 -2.724 1.00 70.01 H ATOM 122 HB3 TYR A 9 8.934 9.932 -1.051 1.00 62.31 H ATOM 123 HD1 TYR A 9 10.674 10.531 0.686 1.00 64.32 H ATOM 124 HD2 TYR A 9 11.447 10.724 -3.494 1.00 11.12 H ATOM 125 HE1 TYR A 9 12.594 12.007 1.115 1.00 64.32 H ATOM 126 HE2 TYR A 9 13.370 12.200 -3.076 1.00 72.32 H ATOM 127 HH TYR A 9 14.874 12.516 -0.295 1.00 63.40 H ATOM 128 N GLU A 10 8.006 7.058 -0.674 1.00 14.21 N ATOM 129 CA GLU A 10 7.071 6.523 0.309 1.00 54.02 C ATOM 130 C GLU A 10 7.621 5.250 0.946 1.00 15.21 C ATOM 131 O GLU A 10 7.694 5.137 2.170 1.00 30.21 O ATOM 132 CB GLU A 10 5.718 6.235 -0.345 1.00 53.55 C ATOM 133 CG GLU A 10 4.759 5.470 0.551 1.00 54.32 C ATOM 134 CD GLU A 10 4.730 6.008 1.968 1.00 24.35 C ATOM 135 OE1 GLU A 10 4.476 7.218 2.140 1.00 42.12 O ATOM 136 OE2 GLU A 10 4.962 5.217 2.907 1.00 64.32 O ATOM 137 H GLU A 10 7.782 7.003 -1.626 1.00 51.44 H ATOM 138 HA GLU A 10 6.937 7.268 1.079 1.00 75.43 H ATOM 139 HB2 GLU A 10 5.255 7.173 -0.616 1.00 3.43 H ATOM 140 HB3 GLU A 10 5.881 5.654 -1.241 1.00 2.30 H ATOM 141 HG2 GLU A 10 3.764 5.541 0.136 1.00 63.21 H ATOM 142 HG3 GLU A 10 5.062 4.434 0.580 1.00 4.21 H ATOM 143 N CYS A 11 8.005 4.294 0.107 1.00 3.23 N ATOM 144 CA CYS A 11 8.548 3.029 0.586 1.00 34.53 C ATOM 145 C CYS A 11 9.890 3.240 1.280 1.00 21.14 C ATOM 146 O CYS A 11 10.286 2.454 2.142 1.00 53.32 O ATOM 147 CB CYS A 11 8.711 2.047 -0.576 1.00 12.10 C ATOM 148 SG CYS A 11 8.381 0.311 -0.135 1.00 34.31 S ATOM 149 H CYS A 11 7.922 4.443 -0.859 1.00 3.23 H ATOM 150 HA CYS A 11 7.849 2.616 1.299 1.00 41.54 H ATOM 151 HB2 CYS A 11 8.027 2.320 -1.366 1.00 53.23 H ATOM 152 HB3 CYS A 11 9.723 2.106 -0.947 1.00 62.22 H ATOM 153 N ASP A 12 10.585 4.306 0.899 1.00 23.32 N ATOM 154 CA ASP A 12 11.883 4.622 1.485 1.00 33.02 C ATOM 155 C ASP A 12 11.726 5.108 2.923 1.00 72.51 C ATOM 156 O ASP A 12 12.252 4.499 3.855 1.00 74.21 O ATOM 157 CB ASP A 12 12.598 5.685 0.650 1.00 50.00 C ATOM 158 CG ASP A 12 13.721 6.361 1.412 1.00 63.44 C ATOM 159 OD1 ASP A 12 13.436 7.312 2.169 1.00 60.42 O ATOM 160 OD2 ASP A 12 14.886 5.939 1.250 1.00 72.11 O ATOM 161 H ASP A 12 10.217 4.895 0.208 1.00 74.45 H ATOM 162 HA ASP A 12 12.475 3.720 1.486 1.00 20.51 H ATOM 163 HB2 ASP A 12 13.015 5.220 -0.232 1.00 12.41 H ATOM 164 HB3 ASP A 12 11.885 6.439 0.352 1.00 54.14 H ATOM 165 N ARG A 13 11.000 6.208 3.095 1.00 62.44 N ATOM 166 CA ARG A 13 10.776 6.776 4.418 1.00 2.23 C ATOM 167 C ARG A 13 10.061 5.778 5.325 1.00 43.33 C ATOM 168 O ARG A 13 10.095 5.901 6.550 1.00 43.24 O ATOM 169 CB ARG A 13 9.956 8.063 4.312 1.00 41.22 C ATOM 170 CG ARG A 13 10.732 9.234 3.731 1.00 24.21 C ATOM 171 CD ARG A 13 10.997 10.302 4.780 1.00 25.04 C ATOM 172 NE ARG A 13 11.201 11.618 4.182 1.00 44.40 N ATOM 173 CZ ARG A 13 11.114 12.756 4.862 1.00 53.32 C ATOM 174 NH1 ARG A 13 10.828 12.739 6.156 1.00 31.43 N ATOM 175 NH2 ARG A 13 11.313 13.915 4.247 1.00 53.13 N ATOM 176 H ARG A 13 10.607 6.648 2.313 1.00 54.15 H ATOM 177 HA ARG A 13 11.739 7.008 4.847 1.00 5.12 H ATOM 178 HB2 ARG A 13 9.099 7.879 3.680 1.00 4.42 H ATOM 179 HB3 ARG A 13 9.614 8.340 5.298 1.00 72.15 H ATOM 180 HG2 ARG A 13 11.678 8.874 3.353 1.00 40.44 H ATOM 181 HG3 ARG A 13 10.161 9.668 2.924 1.00 32.42 H ATOM 182 HD2 ARG A 13 10.151 10.349 5.449 1.00 21.53 H ATOM 183 HD3 ARG A 13 11.881 10.029 5.337 1.00 24.22 H ATOM 184 HE ARG A 13 11.414 11.655 3.226 1.00 34.34 H ATOM 185 HH11 ARG A 13 10.679 11.867 6.623 1.00 75.14 H ATOM 186 HH12 ARG A 13 10.764 13.597 6.666 1.00 33.22 H ATOM 187 HH21 ARG A 13 11.529 13.932 3.271 1.00 54.31 H ATOM 188 HH22 ARG A 13 11.246 14.771 4.759 1.00 64.30 H ATOM 189 N HIS A 14 9.414 4.791 4.714 1.00 31.35 N ATOM 190 CA HIS A 14 8.691 3.771 5.466 1.00 14.33 C ATOM 191 C HIS A 14 9.629 3.024 6.410 1.00 55.32 C ATOM 192 O HIS A 14 9.290 2.771 7.567 1.00 43.35 O ATOM 193 CB HIS A 14 8.017 2.785 4.512 1.00 41.14 C ATOM 194 CG HIS A 14 7.256 1.701 5.210 1.00 75.23 C ATOM 195 ND1 HIS A 14 5.892 1.747 5.408 1.00 33.12 N ATOM 196 CD2 HIS A 14 7.674 0.535 5.756 1.00 44.23 C ATOM 197 CE1 HIS A 14 5.505 0.658 6.048 1.00 70.44 C ATOM 198 NE2 HIS A 14 6.568 -0.094 6.270 1.00 72.50 N ATOM 199 H HIS A 14 9.423 4.746 3.736 1.00 43.22 H ATOM 200 HA HIS A 14 7.932 4.267 6.052 1.00 55.31 H ATOM 201 HB2 HIS A 14 7.325 3.322 3.880 1.00 70.24 H ATOM 202 HB3 HIS A 14 8.772 2.318 3.895 1.00 32.24 H ATOM 203 HD1 HIS A 14 5.296 2.471 5.124 1.00 4.22 H ATOM 204 HD2 HIS A 14 8.691 0.168 5.783 1.00 71.12 H ATOM 205 HE1 HIS A 14 4.493 0.421 6.339 1.00 54.11 H ATOM 206 N CYS A 15 10.808 2.673 5.908 1.00 11.24 N ATOM 207 CA CYS A 15 11.795 1.954 6.705 1.00 14.10 C ATOM 208 C CYS A 15 12.725 2.926 7.425 1.00 32.15 C ATOM 209 O CYS A 15 13.193 2.651 8.530 1.00 33.15 O ATOM 210 CB CYS A 15 12.611 1.014 5.816 1.00 30.54 C ATOM 211 SG CYS A 15 11.612 -0.224 4.928 1.00 32.14 S ATOM 212 H CYS A 15 11.020 2.903 4.979 1.00 42.13 H ATOM 213 HA CYS A 15 11.265 1.370 7.441 1.00 34.45 H ATOM 214 HB2 CYS A 15 13.141 1.598 5.078 1.00 33.10 H ATOM 215 HB3 CYS A 15 13.325 0.483 6.428 1.00 65.31 H ATOM 216 N VAL A 16 12.989 4.064 6.791 1.00 14.14 N ATOM 217 CA VAL A 16 13.861 5.078 7.372 1.00 63.25 C ATOM 218 C VAL A 16 13.433 5.424 8.793 1.00 74.10 C ATOM 219 O VAL A 16 14.257 5.795 9.628 1.00 23.52 O ATOM 220 CB VAL A 16 13.870 6.363 6.523 1.00 64.05 C ATOM 221 CG1 VAL A 16 14.745 7.425 7.171 1.00 15.42 C ATOM 222 CG2 VAL A 16 14.343 6.063 5.108 1.00 55.11 C ATOM 223 H VAL A 16 12.586 4.226 5.913 1.00 51.11 H ATOM 224 HA VAL A 16 14.865 4.680 7.395 1.00 4.13 H ATOM 225 HB VAL A 16 12.861 6.743 6.470 1.00 75.54 H ATOM 226 HG11 VAL A 16 15.720 7.010 7.380 1.00 53.41 H ATOM 227 HG12 VAL A 16 14.846 8.267 6.502 1.00 74.04 H ATOM 228 HG13 VAL A 16 14.288 7.752 8.094 1.00 4.12 H ATOM 229 HG21 VAL A 16 13.558 6.306 4.407 1.00 42.41 H ATOM 230 HG22 VAL A 16 15.219 6.655 4.889 1.00 54.04 H ATOM 231 HG23 VAL A 16 14.587 5.014 5.024 1.00 20.02 H ATOM 232 N SER A 17 12.137 5.300 9.061 1.00 34.22 N ATOM 233 CA SER A 17 11.597 5.603 10.382 1.00 72.35 C ATOM 234 C SER A 17 11.882 4.466 11.359 1.00 44.52 C ATOM 235 O SER A 17 12.182 4.699 12.530 1.00 1.41 O ATOM 236 CB SER A 17 10.089 5.850 10.295 1.00 25.42 C ATOM 237 OG SER A 17 9.742 7.094 10.877 1.00 4.20 O ATOM 238 H SER A 17 11.529 5.000 8.353 1.00 72.20 H ATOM 239 HA SER A 17 12.080 6.500 10.739 1.00 30.44 H ATOM 240 HB2 SER A 17 9.787 5.853 9.259 1.00 14.42 H ATOM 241 HB3 SER A 17 9.568 5.062 10.820 1.00 50.11 H ATOM 242 HG SER A 17 8.796 7.121 11.036 1.00 21.54 H ATOM 243 N LYS A 18 11.787 3.235 10.869 1.00 41.12 N ATOM 244 CA LYS A 18 12.036 2.061 11.696 1.00 32.50 C ATOM 245 C LYS A 18 13.501 1.989 12.113 1.00 2.11 C ATOM 246 O LYS A 18 13.818 1.608 13.239 1.00 64.41 O ATOM 247 CB LYS A 18 11.647 0.788 10.941 1.00 71.34 C ATOM 248 CG LYS A 18 10.170 0.447 11.042 1.00 2.14 C ATOM 249 CD LYS A 18 9.397 0.952 9.835 1.00 21.45 C ATOM 250 CE LYS A 18 8.448 -0.108 9.299 1.00 75.51 C ATOM 251 NZ LYS A 18 7.096 -0.006 9.916 1.00 40.12 N ATOM 252 H LYS A 18 11.544 3.113 9.926 1.00 2.45 H ATOM 253 HA LYS A 18 11.425 2.144 12.582 1.00 23.34 H ATOM 254 HB2 LYS A 18 11.895 0.913 9.897 1.00 62.20 H ATOM 255 HB3 LYS A 18 12.214 -0.041 11.340 1.00 42.11 H ATOM 256 HG2 LYS A 18 10.061 -0.625 11.104 1.00 73.52 H ATOM 257 HG3 LYS A 18 9.766 0.904 11.934 1.00 35.25 H ATOM 258 HD2 LYS A 18 8.823 1.820 10.123 1.00 24.13 H ATOM 259 HD3 LYS A 18 10.097 1.222 9.058 1.00 44.22 H ATOM 260 HE2 LYS A 18 8.357 0.016 8.231 1.00 75.22 H ATOM 261 HE3 LYS A 18 8.859 -1.084 9.514 1.00 1.40 H ATOM 262 HZ1 LYS A 18 6.544 -0.864 9.713 1.00 42.41 H ATOM 263 HZ2 LYS A 18 6.590 0.818 9.532 1.00 1.11 H ATOM 264 HZ3 LYS A 18 7.181 0.103 10.946 1.00 0.24 H ATOM 265 N GLY A 19 14.391 2.360 11.198 1.00 44.42 N ATOM 266 CA GLY A 19 15.812 2.332 11.491 1.00 44.33 C ATOM 267 C GLY A 19 16.650 2.016 10.268 1.00 44.23 C ATOM 268 O GLY A 19 17.705 2.616 10.057 1.00 31.13 O ATOM 269 H GLY A 19 14.080 2.656 10.316 1.00 25.24 H ATOM 270 HA2 GLY A 19 16.108 3.296 11.878 1.00 63.21 H ATOM 271 HA3 GLY A 19 15.998 1.580 12.244 1.00 42.52 H ATOM 272 N TYR A 20 16.182 1.071 9.460 1.00 2.21 N ATOM 273 CA TYR A 20 16.898 0.673 8.254 1.00 51.53 C ATOM 274 C TYR A 20 17.236 1.888 7.395 1.00 12.51 C ATOM 275 O TYR A 20 16.759 2.995 7.648 1.00 2.53 O ATOM 276 CB TYR A 20 16.063 -0.320 7.444 1.00 20.55 C ATOM 277 CG TYR A 20 15.540 -1.479 8.263 1.00 71.21 C ATOM 278 CD1 TYR A 20 16.358 -2.556 8.580 1.00 25.35 C ATOM 279 CD2 TYR A 20 14.227 -1.498 8.718 1.00 43.32 C ATOM 280 CE1 TYR A 20 15.885 -3.618 9.327 1.00 12.44 C ATOM 281 CE2 TYR A 20 13.746 -2.554 9.466 1.00 34.04 C ATOM 282 CZ TYR A 20 14.578 -3.612 9.768 1.00 10.44 C ATOM 283 OH TYR A 20 14.101 -4.666 10.513 1.00 65.32 O ATOM 284 H TYR A 20 15.336 0.629 9.681 1.00 40.20 H ATOM 285 HA TYR A 20 17.817 0.194 8.556 1.00 22.23 H ATOM 286 HB2 TYR A 20 15.215 0.194 7.020 1.00 41.04 H ATOM 287 HB3 TYR A 20 16.670 -0.724 6.647 1.00 34.31 H ATOM 288 HD1 TYR A 20 17.382 -2.558 8.234 1.00 72.14 H ATOM 289 HD2 TYR A 20 13.578 -0.668 8.479 1.00 52.10 H ATOM 290 HE1 TYR A 20 16.536 -4.446 9.564 1.00 3.24 H ATOM 291 HE2 TYR A 20 12.722 -2.550 9.811 1.00 2.25 H ATOM 292 HH TYR A 20 14.818 -5.043 11.029 1.00 10.33 H ATOM 293 N THR A 21 18.062 1.674 6.376 1.00 23.51 N ATOM 294 CA THR A 21 18.466 2.749 5.479 1.00 14.12 C ATOM 295 C THR A 21 17.275 3.284 4.692 1.00 12.53 C ATOM 296 O THR A 21 17.248 4.452 4.307 1.00 53.43 O ATOM 297 CB THR A 21 19.550 2.280 4.491 1.00 21.31 C ATOM 298 OG1 THR A 21 20.086 3.403 3.782 1.00 22.54 O ATOM 299 CG2 THR A 21 18.982 1.273 3.502 1.00 51.41 C ATOM 300 H THR A 21 18.409 0.769 6.226 1.00 52.33 H ATOM 301 HA THR A 21 18.877 3.548 6.080 1.00 74.33 H ATOM 302 HB THR A 21 20.343 1.804 5.050 1.00 4.22 H ATOM 303 HG1 THR A 21 20.491 3.102 2.965 1.00 25.44 H ATOM 304 HG21 THR A 21 18.113 0.798 3.932 1.00 40.24 H ATOM 305 HG22 THR A 21 19.729 0.525 3.281 1.00 55.04 H ATOM 306 HG23 THR A 21 18.701 1.782 2.592 1.00 42.41 H ATOM 307 N GLY A 22 16.290 2.422 4.458 1.00 42.24 N ATOM 308 CA GLY A 22 15.109 2.828 3.718 1.00 64.10 C ATOM 309 C GLY A 22 14.564 1.717 2.843 1.00 54.34 C ATOM 310 O GLY A 22 15.316 0.873 2.358 1.00 34.21 O ATOM 311 H GLY A 22 16.366 1.503 4.789 1.00 4.05 H ATOM 312 HA2 GLY A 22 14.345 3.129 4.419 1.00 71.14 H ATOM 313 HA3 GLY A 22 15.363 3.672 3.093 1.00 73.53 H ATOM 314 N GLY A 23 13.249 1.717 2.640 1.00 23.34 N ATOM 315 CA GLY A 23 12.626 0.696 1.819 1.00 34.53 C ATOM 316 C GLY A 23 12.637 1.050 0.346 1.00 75.05 C ATOM 317 O GLY A 23 12.022 2.033 -0.068 1.00 25.42 O ATOM 318 H GLY A 23 12.699 2.415 3.052 1.00 11.43 H ATOM 319 HA2 GLY A 23 13.154 -0.236 1.959 1.00 40.31 H ATOM 320 HA3 GLY A 23 11.602 0.568 2.139 1.00 12.43 H ATOM 321 N ASN A 24 13.338 0.248 -0.449 1.00 42.32 N ATOM 322 CA ASN A 24 13.429 0.484 -1.886 1.00 15.15 C ATOM 323 C ASN A 24 12.870 -0.701 -2.668 1.00 14.35 C ATOM 324 O ASN A 24 12.904 -1.839 -2.200 1.00 22.31 O ATOM 325 CB ASN A 24 14.882 0.738 -2.291 1.00 72.54 C ATOM 326 CG ASN A 24 15.668 1.453 -1.210 1.00 30.45 C ATOM 327 OD1 ASN A 24 16.776 1.046 -0.860 1.00 30.50 O ATOM 328 ND2 ASN A 24 15.096 2.525 -0.673 1.00 62.44 N ATOM 329 H ASN A 24 13.807 -0.520 -0.061 1.00 14.23 H ATOM 330 HA ASN A 24 12.842 1.361 -2.115 1.00 30.11 H ATOM 331 HB2 ASN A 24 15.363 -0.209 -2.493 1.00 50.51 H ATOM 332 HB3 ASN A 24 14.900 1.344 -3.185 1.00 32.44 H ATOM 333 HD21 ASN A 24 14.212 2.791 -1.001 1.00 75.42 H ATOM 334 HD22 ASN A 24 15.583 3.006 0.028 1.00 53.33 H ATOM 335 N CYS A 25 12.355 -0.425 -3.861 1.00 41.13 N ATOM 336 CA CYS A 25 11.789 -1.466 -4.710 1.00 33.55 C ATOM 337 C CYS A 25 12.743 -1.821 -5.846 1.00 61.31 C ATOM 338 O CYS A 25 13.498 -0.974 -6.324 1.00 32.11 O ATOM 339 CB CYS A 25 10.444 -1.013 -5.281 1.00 50.31 C ATOM 340 SG CYS A 25 9.329 -0.262 -4.052 1.00 11.33 S ATOM 341 H CYS A 25 12.356 0.503 -4.180 1.00 21.20 H ATOM 342 HA CYS A 25 11.633 -2.343 -4.100 1.00 22.34 H ATOM 343 HB2 CYS A 25 10.620 -0.280 -6.055 1.00 55.31 H ATOM 344 HB3 CYS A 25 9.937 -1.865 -5.708 1.00 71.22 H ATOM 345 N ARG A 26 12.703 -3.079 -6.274 1.00 3.01 N ATOM 346 CA ARG A 26 13.565 -3.546 -7.353 1.00 73.52 C ATOM 347 C ARG A 26 12.859 -4.608 -8.191 1.00 75.14 C ATOM 348 O ARG A 26 11.711 -4.962 -7.925 1.00 31.14 O ATOM 349 CB ARG A 26 14.868 -4.113 -6.786 1.00 15.14 C ATOM 350 CG ARG A 26 15.661 -3.110 -5.964 1.00 33.12 C ATOM 351 CD ARG A 26 16.233 -2.003 -6.836 1.00 35.30 C ATOM 352 NE ARG A 26 17.683 -1.898 -6.705 1.00 43.04 N ATOM 353 CZ ARG A 26 18.443 -1.167 -7.514 1.00 32.11 C ATOM 354 NH1 ARG A 26 17.892 -0.481 -8.505 1.00 51.44 N ATOM 355 NH2 ARG A 26 19.756 -1.122 -7.331 1.00 2.41 N ATOM 356 H ARG A 26 12.080 -3.708 -5.853 1.00 44.12 H ATOM 357 HA ARG A 26 13.795 -2.701 -7.984 1.00 51.00 H ATOM 358 HB2 ARG A 26 14.634 -4.958 -6.154 1.00 44.13 H ATOM 359 HB3 ARG A 26 15.488 -4.446 -7.604 1.00 52.41 H ATOM 360 HG2 ARG A 26 15.009 -2.669 -5.224 1.00 21.43 H ATOM 361 HG3 ARG A 26 16.472 -3.624 -5.471 1.00 64.53 H ATOM 362 HD2 ARG A 26 15.988 -2.213 -7.867 1.00 11.34 H ATOM 363 HD3 ARG A 26 15.785 -1.065 -6.543 1.00 72.43 H ATOM 364 HE ARG A 26 18.111 -2.397 -5.979 1.00 61.33 H ATOM 365 HH11 ARG A 26 16.902 -0.512 -8.645 1.00 24.21 H ATOM 366 HH12 ARG A 26 18.466 0.070 -9.112 1.00 11.00 H ATOM 367 HH21 ARG A 26 20.175 -1.638 -6.584 1.00 40.44 H ATOM 368 HH22 ARG A 26 20.327 -0.571 -7.940 1.00 32.52 H ATOM 369 N GLY A 27 13.553 -5.112 -9.207 1.00 43.10 N ATOM 370 CA GLY A 27 12.977 -6.127 -10.069 1.00 73.01 C ATOM 371 C GLY A 27 13.295 -7.533 -9.602 1.00 24.40 C ATOM 372 O GLY A 27 13.504 -8.434 -10.415 1.00 54.03 O ATOM 373 H GLY A 27 14.465 -4.791 -9.372 1.00 73.43 H ATOM 374 HA2 GLY A 27 11.905 -6.000 -10.090 1.00 13.24 H ATOM 375 HA3 GLY A 27 13.364 -5.996 -11.069 1.00 31.01 H ATOM 376 N LYS A 28 13.335 -7.724 -8.288 1.00 4.24 N ATOM 377 CA LYS A 28 13.632 -9.030 -7.712 1.00 35.21 C ATOM 378 C LYS A 28 12.590 -10.061 -8.137 1.00 3.32 C ATOM 379 O LYS A 28 12.920 -11.219 -8.396 1.00 55.54 O ATOM 380 CB LYS A 28 13.680 -8.938 -6.185 1.00 61.40 C ATOM 381 CG LYS A 28 12.495 -8.205 -5.582 1.00 12.02 C ATOM 382 CD LYS A 28 12.935 -6.971 -4.812 1.00 44.03 C ATOM 383 CE LYS A 28 13.263 -7.304 -3.365 1.00 33.12 C ATOM 384 NZ LYS A 28 12.076 -7.829 -2.635 1.00 31.35 N ATOM 385 H LYS A 28 13.161 -6.966 -7.690 1.00 35.54 H ATOM 386 HA LYS A 28 14.599 -9.342 -8.076 1.00 54.13 H ATOM 387 HB2 LYS A 28 13.704 -9.938 -5.777 1.00 21.11 H ATOM 388 HB3 LYS A 28 14.583 -8.419 -5.896 1.00 72.32 H ATOM 389 HG2 LYS A 28 11.828 -7.902 -6.376 1.00 4.14 H ATOM 390 HG3 LYS A 28 11.975 -8.872 -4.908 1.00 45.21 H ATOM 391 HD2 LYS A 28 13.816 -6.559 -5.283 1.00 32.12 H ATOM 392 HD3 LYS A 28 12.139 -6.241 -4.833 1.00 53.25 H ATOM 393 HE2 LYS A 28 14.043 -8.049 -3.348 1.00 44.11 H ATOM 394 HE3 LYS A 28 13.610 -6.408 -2.873 1.00 0.43 H ATOM 395 HZ1 LYS A 28 11.254 -7.214 -2.799 1.00 72.21 H ATOM 396 HZ2 LYS A 28 12.271 -7.863 -1.613 1.00 64.45 H ATOM 397 HZ3 LYS A 28 11.849 -8.789 -2.965 1.00 2.05 H ATOM 398 N ILE A 29 11.335 -9.632 -8.207 1.00 34.00 N ATOM 399 CA ILE A 29 10.247 -10.517 -8.603 1.00 73.52 C ATOM 400 C ILE A 29 9.084 -9.729 -9.196 1.00 42.33 C ATOM 401 O ILE A 29 8.023 -9.612 -8.583 1.00 71.23 O ATOM 402 CB ILE A 29 9.734 -11.348 -7.412 1.00 1.44 C ATOM 403 CG1 ILE A 29 9.587 -10.463 -6.172 1.00 30.44 C ATOM 404 CG2 ILE A 29 10.675 -12.510 -7.132 1.00 4.54 C ATOM 405 CD1 ILE A 29 8.548 -10.964 -5.192 1.00 45.13 C ATOM 406 H ILE A 29 11.135 -8.698 -7.988 1.00 23.21 H ATOM 407 HA ILE A 29 10.626 -11.197 -9.353 1.00 4.23 H ATOM 408 HB ILE A 29 8.769 -11.753 -7.673 1.00 15.13 H ATOM 409 HG12 ILE A 29 10.533 -10.417 -5.656 1.00 1.11 H ATOM 410 HG13 ILE A 29 9.301 -9.468 -6.480 1.00 72.34 H ATOM 411 HG21 ILE A 29 11.106 -12.856 -8.060 1.00 0.43 H ATOM 412 HG22 ILE A 29 11.464 -12.182 -6.470 1.00 74.43 H ATOM 413 HG23 ILE A 29 10.126 -13.315 -6.667 1.00 41.43 H ATOM 414 HD11 ILE A 29 8.721 -12.011 -4.988 1.00 45.03 H ATOM 415 HD12 ILE A 29 8.620 -10.403 -4.272 1.00 45.33 H ATOM 416 HD13 ILE A 29 7.563 -10.838 -5.616 1.00 25.33 H ATOM 417 N ARG A 30 9.291 -9.190 -10.393 1.00 64.15 N ATOM 418 CA ARG A 30 8.260 -8.413 -11.070 1.00 44.34 C ATOM 419 C ARG A 30 7.930 -7.147 -10.284 1.00 72.34 C ATOM 420 O ARG A 30 6.765 -6.866 -10.006 1.00 13.51 O ATOM 421 CB ARG A 30 6.997 -9.255 -11.257 1.00 51.30 C ATOM 422 CG ARG A 30 7.267 -10.642 -11.817 1.00 14.23 C ATOM 423 CD ARG A 30 6.083 -11.158 -12.620 1.00 31.45 C ATOM 424 NE ARG A 30 6.507 -11.948 -13.773 1.00 55.40 N ATOM 425 CZ ARG A 30 6.884 -13.219 -13.695 1.00 54.12 C ATOM 426 NH1 ARG A 30 6.889 -13.842 -12.525 1.00 3.33 N ATOM 427 NH2 ARG A 30 7.256 -13.870 -14.790 1.00 34.12 N ATOM 428 H ARG A 30 10.159 -9.318 -10.832 1.00 14.21 H ATOM 429 HA ARG A 30 8.641 -8.131 -12.041 1.00 12.54 H ATOM 430 HB2 ARG A 30 6.507 -9.366 -10.300 1.00 44.45 H ATOM 431 HB3 ARG A 30 6.333 -8.740 -11.935 1.00 13.35 H ATOM 432 HG2 ARG A 30 8.132 -10.598 -12.461 1.00 24.12 H ATOM 433 HG3 ARG A 30 7.458 -11.319 -10.998 1.00 4.02 H ATOM 434 HD2 ARG A 30 5.472 -11.776 -11.978 1.00 52.21 H ATOM 435 HD3 ARG A 30 5.504 -10.315 -12.965 1.00 10.12 H ATOM 436 HE ARG A 30 6.510 -11.507 -14.648 1.00 31.01 H ATOM 437 HH11 ARG A 30 6.609 -13.354 -11.698 1.00 55.24 H ATOM 438 HH12 ARG A 30 7.173 -14.799 -12.469 1.00 34.40 H ATOM 439 HH21 ARG A 30 7.252 -13.404 -15.674 1.00 64.00 H ATOM 440 HH22 ARG A 30 7.539 -14.827 -14.730 1.00 44.42 H ATOM 441 N GLN A 31 8.963 -6.390 -9.930 1.00 60.01 N ATOM 442 CA GLN A 31 8.782 -5.156 -9.175 1.00 54.22 C ATOM 443 C GLN A 31 8.219 -5.444 -7.787 1.00 65.21 C ATOM 444 O GLN A 31 7.076 -5.879 -7.646 1.00 53.51 O ATOM 445 CB GLN A 31 7.850 -4.205 -9.928 1.00 53.23 C ATOM 446 CG GLN A 31 8.388 -2.787 -10.040 1.00 35.33 C ATOM 447 CD GLN A 31 8.265 -2.225 -11.442 1.00 64.34 C ATOM 448 OE1 GLN A 31 7.170 -2.145 -11.998 1.00 55.30 O ATOM 449 NE2 GLN A 31 9.393 -1.833 -12.023 1.00 40.43 N ATOM 450 H GLN A 31 9.868 -6.668 -10.182 1.00 12.14 H ATOM 451 HA GLN A 31 9.748 -4.688 -9.068 1.00 44.22 H ATOM 452 HB2 GLN A 31 7.694 -4.587 -10.926 1.00 31.51 H ATOM 453 HB3 GLN A 31 6.901 -4.167 -9.414 1.00 10.05 H ATOM 454 HG2 GLN A 31 7.834 -2.152 -9.365 1.00 12.42 H ATOM 455 HG3 GLN A 31 9.430 -2.789 -9.757 1.00 50.34 H ATOM 456 HE21 GLN A 31 10.230 -1.928 -11.521 1.00 14.13 H ATOM 457 HE22 GLN A 31 9.343 -1.466 -12.930 1.00 25.31 H ATOM 458 N THR A 32 9.031 -5.200 -6.763 1.00 22.42 N ATOM 459 CA THR A 32 8.616 -5.435 -5.386 1.00 32.32 C ATOM 460 C THR A 32 9.419 -4.577 -4.415 1.00 64.51 C ATOM 461 O THR A 32 10.607 -4.331 -4.626 1.00 3.34 O ATOM 462 CB THR A 32 8.775 -6.917 -4.996 1.00 75.11 C ATOM 463 OG1 THR A 32 7.950 -7.735 -5.834 1.00 1.01 O ATOM 464 CG2 THR A 32 8.400 -7.136 -3.538 1.00 70.31 C ATOM 465 H THR A 32 9.931 -4.855 -6.939 1.00 41.03 H ATOM 466 HA THR A 32 7.571 -5.173 -5.303 1.00 40.11 H ATOM 467 HB THR A 32 9.808 -7.201 -5.134 1.00 2.05 H ATOM 468 HG1 THR A 32 7.683 -8.521 -5.351 1.00 1.10 H ATOM 469 HG21 THR A 32 7.464 -6.640 -3.329 1.00 22.41 H ATOM 470 HG22 THR A 32 9.173 -6.729 -2.903 1.00 34.23 H ATOM 471 HG23 THR A 32 8.297 -8.194 -3.348 1.00 65.30 H ATOM 472 N CYS A 33 8.765 -4.126 -3.351 1.00 12.53 N ATOM 473 CA CYS A 33 9.418 -3.295 -2.346 1.00 41.04 C ATOM 474 C CYS A 33 10.168 -4.155 -1.333 1.00 62.14 C ATOM 475 O CYS A 33 9.776 -5.288 -1.053 1.00 74.22 O ATOM 476 CB CYS A 33 8.388 -2.422 -1.627 1.00 74.41 C ATOM 477 SG CYS A 33 8.829 -0.657 -1.555 1.00 5.43 S ATOM 478 H CYS A 33 7.818 -4.356 -3.238 1.00 21.13 H ATOM 479 HA CYS A 33 10.126 -2.657 -2.853 1.00 24.03 H ATOM 480 HB2 CYS A 33 7.440 -2.502 -2.139 1.00 74.22 H ATOM 481 HB3 CYS A 33 8.274 -2.775 -0.613 1.00 34.22 H ATOM 482 N HIS A 34 11.250 -3.609 -0.787 1.00 13.41 N ATOM 483 CA HIS A 34 12.055 -4.325 0.196 1.00 71.11 C ATOM 484 C HIS A 34 12.908 -3.356 1.010 1.00 75.42 C ATOM 485 O HIS A 34 13.355 -2.328 0.501 1.00 73.11 O ATOM 486 CB HIS A 34 12.950 -5.352 -0.498 1.00 44.21 C ATOM 487 CG HIS A 34 13.247 -6.554 0.344 1.00 72.40 C ATOM 488 ND1 HIS A 34 14.438 -7.245 0.277 1.00 64.14 N ATOM 489 CD2 HIS A 34 12.499 -7.188 1.278 1.00 51.54 C ATOM 490 CE1 HIS A 34 14.410 -8.252 1.131 1.00 32.21 C ATOM 491 NE2 HIS A 34 13.244 -8.239 1.752 1.00 71.24 N ATOM 492 H HIS A 34 11.512 -2.702 -1.051 1.00 20.24 H ATOM 493 HA HIS A 34 11.382 -4.841 0.864 1.00 54.33 H ATOM 494 HB2 HIS A 34 12.465 -5.691 -1.401 1.00 74.30 H ATOM 495 HB3 HIS A 34 13.891 -4.885 -0.754 1.00 73.14 H ATOM 496 HD1 HIS A 34 15.192 -7.030 -0.311 1.00 71.23 H ATOM 497 HD2 HIS A 34 11.501 -6.917 1.592 1.00 15.20 H ATOM 498 HE1 HIS A 34 15.204 -8.965 1.295 1.00 2.34 H ATOM 499 N CYS A 35 13.128 -3.691 2.277 1.00 64.03 N ATOM 500 CA CYS A 35 13.926 -2.851 3.162 1.00 20.20 C ATOM 501 C CYS A 35 15.328 -3.427 3.341 1.00 33.25 C ATOM 502 O CYS A 35 15.491 -4.612 3.636 1.00 15.40 O ATOM 503 CB CYS A 35 13.241 -2.714 4.523 1.00 30.12 C ATOM 504 SG CYS A 35 11.754 -1.662 4.504 1.00 34.55 S ATOM 505 H CYS A 35 12.745 -4.524 2.625 1.00 1.14 H ATOM 506 HA CYS A 35 14.007 -1.875 2.710 1.00 52.45 H ATOM 507 HB2 CYS A 35 12.945 -3.694 4.869 1.00 41.01 H ATOM 508 HB3 CYS A 35 13.939 -2.285 5.227 1.00 34.32 H ATOM 509 N TYR A 36 16.336 -2.581 3.162 1.00 20.41 N ATOM 510 CA TYR A 36 17.724 -3.006 3.302 1.00 71.02 C ATOM 511 C TYR A 36 18.661 -1.802 3.341 1.00 74.40 C ATOM 512 O TYR A 36 19.313 -1.544 4.351 1.00 61.22 O ATOM 513 CB TYR A 36 18.114 -3.933 2.149 1.00 1.22 C ATOM 514 CG TYR A 36 18.313 -3.213 0.834 1.00 33.23 C ATOM 515 CD1 TYR A 36 17.267 -2.527 0.230 1.00 14.13 C ATOM 516 CD2 TYR A 36 19.547 -3.219 0.196 1.00 21.04 C ATOM 517 CE1 TYR A 36 17.443 -1.869 -0.971 1.00 45.23 C ATOM 518 CE2 TYR A 36 19.734 -2.562 -1.005 1.00 34.53 C ATOM 519 CZ TYR A 36 18.679 -1.889 -1.585 1.00 33.32 C ATOM 520 OH TYR A 36 18.859 -1.234 -2.781 1.00 43.22 O ATOM 521 H TYR A 36 16.143 -1.649 2.929 1.00 70.55 H ATOM 522 HA TYR A 36 17.813 -3.548 4.232 1.00 10.42 H ATOM 523 HB2 TYR A 36 19.038 -4.433 2.395 1.00 30.05 H ATOM 524 HB3 TYR A 36 17.337 -4.670 2.010 1.00 30.03 H ATOM 525 HD1 TYR A 36 16.300 -2.512 0.714 1.00 64.51 H ATOM 526 HD2 TYR A 36 20.372 -3.747 0.653 1.00 34.32 H ATOM 527 HE1 TYR A 36 16.618 -1.341 -1.425 1.00 73.24 H ATOM 528 HE2 TYR A 36 20.701 -2.578 -1.486 1.00 34.43 H ATOM 529 HH TYR A 36 18.334 -0.430 -2.788 1.00 21.11 H