ATOM 45 N ASP A 5 -7.937 0.709 -0.309 1.00 0.20 N ATOM 46 CA ASP A 5 -6.811 0.030 -0.925 1.00 0.25 C ATOM 47 C ASP A 5 -7.116 -0.356 -2.366 1.00 0.23 C ATOM 48 O ASP A 5 -8.140 -0.975 -2.655 1.00 0.26 O ATOM 49 CB ASP A 5 -6.440 -1.214 -0.120 1.00 0.32 C ATOM 50 CG ASP A 5 -7.561 -2.235 -0.080 1.00 0.40 C ATOM 51 OD1 ASP A 5 -8.712 -1.866 -0.395 1.00 1.24 O ATOM 52 OD2 ASP A 5 -7.287 -3.404 0.265 1.00 1.11 O ATOM 53 H ASP A 5 -8.798 0.255 -0.265 1.00 0.23 H ATOM 54 HA ASP A 5 -5.978 0.713 -0.919 1.00 0.33 H ATOM 55 HB2 ASP A 5 -5.571 -1.677 -0.563 1.00 0.30 H ATOM 56 HB3 ASP A 5 -6.210 -0.920 0.892 1.00 0.38 H ATOM 57 N TYR A 6 -6.211 0.013 -3.261 1.00 0.19 N ATOM 58 CA TYR A 6 -6.361 -0.292 -4.679 1.00 0.20 C ATOM 59 C TYR A 6 -6.141 -1.781 -4.954 1.00 0.19 C ATOM 60 O TYR A 6 -6.401 -2.258 -6.058 1.00 0.23 O ATOM 61 CB TYR A 6 -5.375 0.539 -5.504 1.00 0.20 C ATOM 62 CG TYR A 6 -5.961 1.074 -6.792 1.00 0.41 C ATOM 63 CD1 TYR A 6 -6.981 2.016 -6.774 1.00 1.24 C ATOM 64 CD2 TYR A 6 -5.493 0.636 -8.025 1.00 1.37 C ATOM 65 CE1 TYR A 6 -7.520 2.507 -7.948 1.00 1.33 C ATOM 66 CE2 TYR A 6 -6.026 1.123 -9.203 1.00 1.54 C ATOM 67 CZ TYR A 6 -7.039 2.058 -9.160 1.00 0.94 C ATOM 68 OH TYR A 6 -7.573 2.544 -10.331 1.00 1.21 O ATOM 69 H TYR A 6 -5.420 0.501 -2.958 1.00 0.18 H ATOM 70 HA TYR A 6 -7.367 -0.030 -4.969 1.00 0.23 H ATOM 71 HB2 TYR A 6 -5.045 1.382 -4.916 1.00 0.30 H ATOM 72 HB3 TYR A 6 -4.521 -0.073 -5.757 1.00 0.25 H ATOM 73 HD1 TYR A 6 -7.356 2.367 -5.823 1.00 2.12 H ATOM 74 HD2 TYR A 6 -4.701 -0.097 -8.056 1.00 2.21 H ATOM 75 HE1 TYR A 6 -8.313 3.240 -7.913 1.00 2.18 H ATOM 76 HE2 TYR A 6 -5.650 0.770 -10.152 1.00 2.44 H ATOM 77 HH TYR A 6 -6.897 3.022 -10.817 1.00 1.49 H ATOM 78 N LEU A 7 -5.660 -2.511 -3.948 1.00 0.18 N ATOM 79 CA LEU A 7 -5.409 -3.941 -4.099 1.00 0.19 C ATOM 80 C LEU A 7 -5.747 -4.691 -2.815 1.00 0.20 C ATOM 81 O LEU A 7 -6.080 -4.076 -1.802 1.00 0.20 O ATOM 82 CB LEU A 7 -3.951 -4.181 -4.489 1.00 0.18 C ATOM 83 CG LEU A 7 -3.671 -4.072 -5.987 1.00 0.21 C ATOM 84 CD1 LEU A 7 -2.278 -3.525 -6.227 1.00 0.24 C ATOM 85 CD2 LEU A 7 -3.842 -5.422 -6.671 1.00 0.21 C ATOM 86 H LEU A 7 -5.469 -2.081 -3.088 1.00 0.19 H ATOM 87 HA LEU A 7 -6.047 -4.306 -4.890 1.00 0.21 H ATOM 88 HB2 LEU A 7 -3.337 -3.465 -3.970 1.00 0.17 H ATOM 89 HB3 LEU A 7 -3.662 -5.156 -4.164 1.00 0.18 H ATOM 90 HG LEU A 7 -4.381 -3.387 -6.424 1.00 0.24 H ATOM 91 HD11 LEU A 7 -2.309 -2.446 -6.222 1.00 1.03 H ATOM 92 HD12 LEU A 7 -1.916 -3.873 -7.182 1.00 1.07 H ATOM 93 HD13 LEU A 7 -1.620 -3.871 -5.444 1.00 1.01 H ATOM 94 HD21 LEU A 7 -3.007 -5.599 -7.333 1.00 1.04 H ATOM 95 HD22 LEU A 7 -4.759 -5.422 -7.241 1.00 1.02 H ATOM 96 HD23 LEU A 7 -3.883 -6.200 -5.928 1.00 1.01 H ATOM 97 N PRO A 8 -5.662 -6.032 -2.833 1.00 0.21 N ATOM 98 CA PRO A 8 -5.952 -6.852 -1.672 1.00 0.23 C ATOM 99 C PRO A 8 -4.756 -6.980 -0.745 1.00 0.21 C ATOM 100 O PRO A 8 -3.634 -6.610 -1.090 1.00 0.18 O ATOM 101 CB PRO A 8 -6.335 -8.189 -2.274 1.00 0.26 C ATOM 102 CG PRO A 8 -5.490 -8.290 -3.483 1.00 0.25 C ATOM 103 CD PRO A 8 -5.251 -6.875 -3.977 1.00 0.22 C ATOM 104 HA PRO A 8 -6.789 -6.456 -1.114 1.00 0.25 H ATOM 105 HB2 PRO A 8 -6.123 -8.981 -1.571 1.00 0.26 H ATOM 106 HB3 PRO A 8 -7.385 -8.190 -2.525 1.00 0.29 H ATOM 107 HG2 PRO A 8 -4.552 -8.754 -3.216 1.00 0.23 H ATOM 108 HG3 PRO A 8 -6.000 -8.870 -4.228 1.00 0.28 H ATOM 109 HD2 PRO A 8 -4.210 -6.745 -4.191 1.00 0.20 H ATOM 110 HD3 PRO A 8 -5.836 -6.656 -4.856 1.00 0.23 H ATOM 111 N LYS A 9 -5.021 -7.493 0.436 1.00 0.23 N ATOM 112 CA LYS A 9 -3.996 -7.674 1.462 1.00 0.23 C ATOM 113 C LYS A 9 -2.777 -8.422 0.924 1.00 0.22 C ATOM 114 O LYS A 9 -1.677 -8.299 1.464 1.00 0.22 O ATOM 115 CB LYS A 9 -4.577 -8.429 2.658 1.00 0.26 C ATOM 116 CG LYS A 9 -5.942 -7.921 3.095 1.00 0.30 C ATOM 117 CD LYS A 9 -5.957 -7.544 4.569 1.00 1.00 C ATOM 118 CE LYS A 9 -7.179 -8.108 5.277 1.00 1.48 C ATOM 119 NZ LYS A 9 -7.156 -9.596 5.324 1.00 2.12 N ATOM 120 H LYS A 9 -5.940 -7.763 0.623 1.00 0.25 H ATOM 121 HA LYS A 9 -3.682 -6.695 1.789 1.00 0.22 H ATOM 122 HB2 LYS A 9 -4.672 -9.473 2.398 1.00 0.28 H ATOM 123 HB3 LYS A 9 -3.896 -8.336 3.492 1.00 0.27 H ATOM 124 HG2 LYS A 9 -6.195 -7.050 2.509 1.00 0.86 H ATOM 125 HG3 LYS A 9 -6.675 -8.696 2.923 1.00 0.79 H ATOM 126 HD2 LYS A 9 -5.069 -7.937 5.041 1.00 1.52 H ATOM 127 HD3 LYS A 9 -5.967 -6.468 4.655 1.00 1.72 H ATOM 128 HE2 LYS A 9 -7.204 -7.725 6.286 1.00 2.03 H ATOM 129 HE3 LYS A 9 -8.065 -7.787 4.749 1.00 1.89 H ATOM 130 HZ1 LYS A 9 -7.718 -9.987 4.541 1.00 2.47 H ATOM 131 HZ2 LYS A 9 -7.555 -9.932 6.224 1.00 2.52 H ATOM 132 HZ3 LYS A 9 -6.178 -9.941 5.241 1.00 2.60 H ATOM 133 N SER A 10 -2.978 -9.206 -0.128 1.00 0.22 N ATOM 134 CA SER A 10 -1.893 -9.980 -0.720 1.00 0.23 C ATOM 135 C SER A 10 -0.964 -9.109 -1.566 1.00 0.22 C ATOM 136 O SER A 10 0.180 -9.484 -1.824 1.00 0.24 O ATOM 137 CB SER A 10 -2.462 -11.114 -1.576 1.00 0.27 C ATOM 138 OG SER A 10 -1.808 -12.340 -1.299 1.00 1.24 O ATOM 139 H SER A 10 -3.877 -9.274 -0.510 1.00 0.23 H ATOM 140 HA SER A 10 -1.320 -10.411 0.087 1.00 0.23 H ATOM 141 HB2 SER A 10 -3.515 -11.228 -1.364 1.00 1.04 H ATOM 142 HB3 SER A 10 -2.329 -10.877 -2.621 1.00 0.97 H ATOM 143 HG SER A 10 -1.960 -12.585 -0.384 1.00 1.69 H ATOM 144 N GLU A 11 -1.456 -7.955 -2.010 1.00 0.23 N ATOM 145 CA GLU A 11 -0.659 -7.059 -2.838 1.00 0.26 C ATOM 146 C GLU A 11 -0.058 -5.933 -2.020 1.00 0.26 C ATOM 147 O GLU A 11 1.071 -5.505 -2.257 1.00 0.30 O ATOM 148 CB GLU A 11 -1.549 -6.456 -3.915 1.00 0.31 C ATOM 149 CG GLU A 11 -1.336 -7.034 -5.302 1.00 0.38 C ATOM 150 CD GLU A 11 -0.622 -6.073 -6.233 1.00 0.53 C ATOM 151 OE1 GLU A 11 0.147 -5.224 -5.734 1.00 1.16 O ATOM 152 OE2 GLU A 11 -0.831 -6.169 -7.460 1.00 1.31 O ATOM 153 H GLU A 11 -2.379 -7.702 -1.788 1.00 0.22 H ATOM 154 HA GLU A 11 0.133 -7.629 -3.296 1.00 0.28 H ATOM 155 HB2 GLU A 11 -2.572 -6.631 -3.636 1.00 0.26 H ATOM 156 HB3 GLU A 11 -1.378 -5.388 -3.953 1.00 0.38 H ATOM 157 HG2 GLU A 11 -0.747 -7.935 -5.218 1.00 0.38 H ATOM 158 HG3 GLU A 11 -2.303 -7.273 -5.726 1.00 0.38 H ATOM 159 N CYS A 12 -0.833 -5.445 -1.073 1.00 0.26 N ATOM 160 CA CYS A 12 -0.401 -4.353 -0.229 1.00 0.30 C ATOM 161 C CYS A 12 0.122 -4.875 1.095 1.00 0.24 C ATOM 162 O CYS A 12 -0.638 -5.351 1.939 1.00 0.28 O ATOM 163 CB CYS A 12 -1.561 -3.391 -0.019 1.00 0.46 C ATOM 164 SG CYS A 12 -1.674 -2.093 -1.271 1.00 0.80 S ATOM 165 H CYS A 12 -1.729 -5.822 -0.946 1.00 0.24 H ATOM 166 HA CYS A 12 0.396 -3.835 -0.740 1.00 0.35 H ATOM 167 HB2 CYS A 12 -2.483 -3.945 -0.055 1.00 0.48 H ATOM 168 HB3 CYS A 12 -1.464 -2.902 0.947 1.00 0.45 H ATOM 169 N THR A 13 1.432 -4.791 1.262 1.00 0.22 N ATOM 170 CA THR A 13 2.080 -5.262 2.473 1.00 0.20 C ATOM 171 C THR A 13 2.790 -4.112 3.170 1.00 0.22 C ATOM 172 O THR A 13 3.361 -3.243 2.514 1.00 0.23 O ATOM 173 CB THR A 13 3.076 -6.377 2.126 1.00 0.19 C ATOM 174 OG1 THR A 13 3.887 -6.007 1.028 1.00 0.19 O ATOM 175 CG2 THR A 13 2.401 -7.684 1.763 1.00 0.21 C ATOM 176 H THR A 13 1.981 -4.404 0.545 1.00 0.28 H ATOM 177 HA THR A 13 1.320 -5.656 3.129 1.00 0.25 H ATOM 178 HB THR A 13 3.723 -6.556 2.975 1.00 0.24 H ATOM 179 HG1 THR A 13 4.545 -6.688 0.871 1.00 0.78 H ATOM 180 HG21 THR A 13 3.126 -8.484 1.788 1.00 1.03 H ATOM 181 HG22 THR A 13 1.982 -7.610 0.765 1.00 1.04 H ATOM 182 HG23 THR A 13 1.611 -7.891 2.470 1.00 1.04 H ATOM 183 N GLN A 14 2.762 -4.110 4.501 1.00 0.29 N ATOM 184 CA GLN A 14 3.425 -3.059 5.269 1.00 0.33 C ATOM 185 C GLN A 14 4.840 -2.854 4.742 1.00 0.28 C ATOM 186 O GLN A 14 5.384 -1.750 4.780 1.00 0.31 O ATOM 187 CB GLN A 14 3.444 -3.416 6.756 1.00 0.42 C ATOM 188 CG GLN A 14 2.087 -3.269 7.428 1.00 0.72 C ATOM 189 CD GLN A 14 1.144 -4.413 7.103 1.00 0.88 C ATOM 190 OE1 GLN A 14 1.164 -5.453 7.761 1.00 1.81 O ATOM 191 NE2 GLN A 14 0.310 -4.228 6.082 1.00 0.77 N ATOM 192 H GLN A 14 2.298 -4.832 4.974 1.00 0.34 H ATOM 193 HA GLN A 14 2.868 -2.144 5.131 1.00 0.35 H ATOM 194 HB2 GLN A 14 3.769 -4.440 6.865 1.00 0.67 H ATOM 195 HB3 GLN A 14 4.145 -2.769 7.262 1.00 0.49 H ATOM 196 HG2 GLN A 14 2.232 -3.236 8.498 1.00 1.40 H ATOM 197 HG3 GLN A 14 1.635 -2.345 7.099 1.00 1.41 H ATOM 198 HE21 GLN A 14 0.346 -3.376 5.600 1.00 0.91 H ATOM 199 HE22 GLN A 14 -0.309 -4.954 5.854 1.00 1.26 H ATOM 200 N PHE A 15 5.405 -3.932 4.210 1.00 0.25 N ATOM 201 CA PHE A 15 6.731 -3.904 3.620 1.00 0.26 C ATOM 202 C PHE A 15 6.793 -2.919 2.460 1.00 0.22 C ATOM 203 O PHE A 15 7.789 -2.221 2.272 1.00 0.24 O ATOM 204 CB PHE A 15 7.097 -5.307 3.133 1.00 0.29 C ATOM 205 CG PHE A 15 8.041 -6.032 4.044 1.00 0.37 C ATOM 206 CD1 PHE A 15 9.394 -5.739 4.020 1.00 1.25 C ATOM 207 CD2 PHE A 15 7.583 -7.001 4.922 1.00 1.14 C ATOM 208 CE1 PHE A 15 10.275 -6.398 4.852 1.00 1.29 C ATOM 209 CE2 PHE A 15 8.461 -7.666 5.758 1.00 1.17 C ATOM 210 CZ PHE A 15 9.809 -7.363 5.724 1.00 0.52 C ATOM 211 H PHE A 15 4.900 -4.770 4.190 1.00 0.26 H ATOM 212 HA PHE A 15 7.433 -3.600 4.380 1.00 0.31 H ATOM 213 HB2 PHE A 15 6.193 -5.895 3.065 1.00 0.27 H ATOM 214 HB3 PHE A 15 7.543 -5.242 2.156 1.00 0.29 H ATOM 215 HD1 PHE A 15 9.760 -4.985 3.339 1.00 2.10 H ATOM 216 HD2 PHE A 15 6.530 -7.238 4.948 1.00 2.00 H ATOM 217 HE1 PHE A 15 11.328 -6.157 4.820 1.00 2.15 H ATOM 218 HE2 PHE A 15 8.093 -8.419 6.439 1.00 2.01 H ATOM 219 HZ PHE A 15 10.497 -7.880 6.376 1.00 0.58 H ATOM 220 N ARG A 16 5.721 -2.875 1.682 1.00 0.19 N ATOM 221 CA ARG A 16 5.640 -1.987 0.531 1.00 0.20 C ATOM 222 C ARG A 16 5.837 -0.533 0.935 1.00 0.17 C ATOM 223 O ARG A 16 6.605 0.185 0.306 1.00 0.19 O ATOM 224 CB ARG A 16 4.298 -2.171 -0.180 1.00 0.32 C ATOM 225 CG ARG A 16 3.963 -3.621 -0.455 1.00 0.24 C ATOM 226 CD ARG A 16 4.977 -4.263 -1.388 1.00 0.40 C ATOM 227 NE ARG A 16 4.885 -5.721 -1.373 1.00 0.78 N ATOM 228 CZ ARG A 16 5.880 -6.532 -1.726 1.00 0.89 C ATOM 229 NH1 ARG A 16 7.043 -6.035 -2.129 1.00 1.49 N ATOM 230 NH2 ARG A 16 5.710 -7.847 -1.677 1.00 1.39 N ATOM 231 H ARG A 16 4.963 -3.460 1.886 1.00 0.18 H ATOM 232 HA ARG A 16 6.432 -2.257 -0.149 1.00 0.26 H ATOM 233 HB2 ARG A 16 3.514 -1.755 0.432 1.00 0.54 H ATOM 234 HB3 ARG A 16 4.321 -1.651 -1.118 1.00 0.47 H ATOM 235 HG2 ARG A 16 3.960 -4.156 0.479 1.00 0.23 H ATOM 236 HG3 ARG A 16 2.984 -3.672 -0.907 1.00 0.37 H ATOM 237 HD2 ARG A 16 4.798 -3.910 -2.393 1.00 0.87 H ATOM 238 HD3 ARG A 16 5.968 -3.970 -1.075 1.00 0.69 H ATOM 239 HE ARG A 16 4.037 -6.117 -1.082 1.00 1.52 H ATOM 240 HH11 ARG A 16 7.177 -5.045 -2.169 1.00 1.80 H ATOM 241 HH12 ARG A 16 7.785 -6.651 -2.391 1.00 1.98 H ATOM 242 HH21 ARG A 16 4.836 -8.227 -1.376 1.00 1.96 H ATOM 243 HH22 ARG A 16 6.457 -8.457 -1.942 1.00 1.54 H ATOM 244 N CYS A 17 5.151 -0.098 1.983 1.00 0.24 N ATOM 245 CA CYS A 17 5.283 1.280 2.440 1.00 0.33 C ATOM 246 C CYS A 17 6.663 1.534 3.029 1.00 0.34 C ATOM 247 O CYS A 17 7.134 2.669 3.071 1.00 0.45 O ATOM 248 CB CYS A 17 4.209 1.619 3.466 1.00 0.48 C ATOM 249 SG CYS A 17 2.617 2.111 2.734 1.00 0.58 S ATOM 250 H CYS A 17 4.551 -0.710 2.458 1.00 0.27 H ATOM 251 HA CYS A 17 5.159 1.915 1.584 1.00 0.36 H ATOM 252 HB2 CYS A 17 4.032 0.760 4.092 1.00 0.92 H ATOM 253 HB3 CYS A 17 4.559 2.437 4.073 1.00 0.83 H ATOM 254 N ARG A 18 7.305 0.475 3.490 1.00 0.30 N ATOM 255 CA ARG A 18 8.633 0.593 4.078 1.00 0.40 C ATOM 256 C ARG A 18 9.654 1.053 3.069 1.00 0.41 C ATOM 257 O ARG A 18 10.477 1.930 3.332 1.00 0.51 O ATOM 258 CB ARG A 18 9.112 -0.768 4.590 1.00 0.45 C ATOM 259 CG ARG A 18 9.586 -0.746 6.034 1.00 0.60 C ATOM 260 CD ARG A 18 10.916 -1.464 6.198 1.00 1.08 C ATOM 261 NE ARG A 18 10.740 -2.858 6.598 1.00 1.48 N ATOM 262 CZ ARG A 18 11.749 -3.693 6.839 1.00 2.14 C ATOM 263 NH1 ARG A 18 13.005 -3.280 6.721 1.00 2.62 N ATOM 264 NH2 ARG A 18 11.501 -4.946 7.198 1.00 2.87 N ATOM 265 H ARG A 18 6.875 -0.402 3.441 1.00 0.26 H ATOM 266 HA ARG A 18 8.596 1.281 4.889 1.00 0.48 H ATOM 267 HB2 ARG A 18 8.301 -1.477 4.507 1.00 0.57 H ATOM 268 HB3 ARG A 18 9.945 -1.101 3.958 1.00 0.57 H ATOM 269 HG2 ARG A 18 9.702 0.280 6.349 1.00 1.04 H ATOM 270 HG3 ARG A 18 8.846 -1.232 6.653 1.00 1.01 H ATOM 271 HD2 ARG A 18 11.445 -1.435 5.257 1.00 1.66 H ATOM 272 HD3 ARG A 18 11.496 -0.953 6.952 1.00 1.70 H ATOM 273 HE ARG A 18 9.823 -3.190 6.693 1.00 1.87 H ATOM 274 HH11 ARG A 18 13.199 -2.337 6.451 1.00 2.57 H ATOM 275 HH12 ARG A 18 13.758 -3.912 6.904 1.00 3.34 H ATOM 276 HH21 ARG A 18 10.557 -5.262 7.289 1.00 3.09 H ATOM 277 HH22 ARG A 18 12.258 -5.573 7.379 1.00 3.44 H ATOM 278 N THR A 19 9.642 0.373 1.950 1.00 0.36 N ATOM 279 CA THR A 19 10.611 0.598 0.908 1.00 0.41 C ATOM 280 C THR A 19 10.006 1.105 -0.408 1.00 0.38 C ATOM 281 O THR A 19 10.660 1.835 -1.153 1.00 0.59 O ATOM 282 CB THR A 19 11.341 -0.724 0.740 1.00 0.48 C ATOM 283 OG1 THR A 19 12.203 -0.713 -0.384 1.00 0.56 O ATOM 284 CG2 THR A 19 10.396 -1.896 0.616 1.00 0.46 C ATOM 285 H THR A 19 8.995 -0.355 1.847 1.00 0.31 H ATOM 286 HA THR A 19 11.316 1.331 1.266 1.00 0.48 H ATOM 287 HB THR A 19 11.927 -0.891 1.640 1.00 0.55 H ATOM 288 HG1 THR A 19 12.674 0.123 -0.419 1.00 1.06 H ATOM 289 HG21 THR A 19 9.829 -1.987 1.537 1.00 1.13 H ATOM 290 HG22 THR A 19 10.961 -2.801 0.449 1.00 1.04 H ATOM 291 HG23 THR A 19 9.720 -1.730 -0.208 1.00 1.15 H ATOM 292 N SER A 20 8.771 0.707 -0.703 1.00 0.33 N ATOM 293 CA SER A 20 8.110 1.118 -1.946 1.00 0.32 C ATOM 294 C SER A 20 7.106 2.250 -1.719 1.00 0.28 C ATOM 295 O SER A 20 6.146 2.103 -0.964 1.00 0.42 O ATOM 296 CB SER A 20 7.403 -0.079 -2.585 1.00 0.35 C ATOM 297 OG SER A 20 8.339 -1.030 -3.062 1.00 0.73 O ATOM 298 H SER A 20 8.298 0.114 -0.083 1.00 0.47 H ATOM 299 HA SER A 20 8.875 1.468 -2.623 1.00 0.40 H ATOM 300 HB2 SER A 20 6.768 -0.553 -1.852 1.00 0.64 H ATOM 301 HB3 SER A 20 6.801 0.263 -3.415 1.00 0.58 H ATOM 302 HG SER A 20 8.104 -1.291 -3.955 1.00 0.97 H ATOM 303 N MET A 21 7.331 3.378 -2.388 1.00 0.27 N ATOM 304 CA MET A 21 6.447 4.537 -2.268 1.00 0.25 C ATOM 305 C MET A 21 5.185 4.370 -3.115 1.00 0.25 C ATOM 306 O MET A 21 4.093 4.767 -2.709 1.00 0.38 O ATOM 307 CB MET A 21 7.183 5.809 -2.695 1.00 0.35 C ATOM 308 CG MET A 21 8.391 6.138 -1.834 1.00 0.42 C ATOM 309 SD MET A 21 9.899 5.345 -2.422 1.00 0.95 S ATOM 310 CE MET A 21 10.102 6.141 -4.014 1.00 1.66 C ATOM 311 H MET A 21 8.109 3.432 -2.981 1.00 0.40 H ATOM 312 HA MET A 21 6.161 4.630 -1.231 1.00 0.26 H ATOM 313 HB2 MET A 21 7.517 5.692 -3.715 1.00 0.43 H ATOM 314 HB3 MET A 21 6.496 6.641 -2.645 1.00 0.42 H ATOM 315 HG2 MET A 21 8.539 7.208 -1.840 1.00 0.66 H ATOM 316 HG3 MET A 21 8.197 5.809 -0.825 1.00 0.42 H ATOM 317 HE1 MET A 21 9.634 7.114 -3.992 1.00 2.14 H ATOM 318 HE2 MET A 21 9.640 5.536 -4.780 1.00 2.17 H ATOM 319 HE3 MET A 21 11.154 6.253 -4.229 1.00 2.19 H ATOM 320 N LYS A 22 5.350 3.799 -4.303 1.00 0.28 N ATOM 321 CA LYS A 22 4.237 3.594 -5.229 1.00 0.35 C ATOM 322 C LYS A 22 3.067 2.853 -4.578 1.00 0.32 C ATOM 323 O LYS A 22 1.913 3.257 -4.715 1.00 0.47 O ATOM 324 CB LYS A 22 4.723 2.817 -6.455 1.00 0.45 C ATOM 325 CG LYS A 22 3.700 2.736 -7.575 1.00 0.58 C ATOM 326 CD LYS A 22 3.759 3.960 -8.474 1.00 1.33 C ATOM 327 CE LYS A 22 3.194 3.667 -9.855 1.00 1.62 C ATOM 328 NZ LYS A 22 4.001 4.303 -10.932 1.00 2.35 N ATOM 329 H LYS A 22 6.249 3.518 -4.573 1.00 0.37 H ATOM 330 HA LYS A 22 3.895 4.566 -5.550 1.00 0.39 H ATOM 331 HB2 LYS A 22 5.610 3.297 -6.842 1.00 0.48 H ATOM 332 HB3 LYS A 22 4.974 1.811 -6.152 1.00 0.47 H ATOM 333 HG2 LYS A 22 3.901 1.857 -8.169 1.00 1.38 H ATOM 334 HG3 LYS A 22 2.713 2.663 -7.144 1.00 1.13 H ATOM 335 HD2 LYS A 22 3.184 4.754 -8.022 1.00 1.94 H ATOM 336 HD3 LYS A 22 4.789 4.271 -8.575 1.00 2.10 H ATOM 337 HE2 LYS A 22 3.187 2.598 -10.008 1.00 1.80 H ATOM 338 HE3 LYS A 22 2.183 4.044 -9.904 1.00 2.10 H ATOM 339 HZ1 LYS A 22 3.418 4.439 -11.783 1.00 2.86 H ATOM 340 HZ2 LYS A 22 4.813 3.700 -11.175 1.00 2.67 H ATOM 341 HZ3 LYS A 22 4.354 5.229 -10.615 1.00 2.77 H ATOM 342 N TYR A 23 3.369 1.760 -3.890 1.00 0.24 N ATOM 343 CA TYR A 23 2.341 0.948 -3.239 1.00 0.23 C ATOM 344 C TYR A 23 1.606 1.713 -2.144 1.00 0.25 C ATOM 345 O TYR A 23 0.486 1.362 -1.773 1.00 0.33 O ATOM 346 CB TYR A 23 2.974 -0.296 -2.625 1.00 0.25 C ATOM 347 CG TYR A 23 3.311 -1.371 -3.627 1.00 0.25 C ATOM 348 CD1 TYR A 23 4.049 -1.079 -4.764 1.00 1.26 C ATOM 349 CD2 TYR A 23 2.895 -2.678 -3.429 1.00 1.16 C ATOM 350 CE1 TYR A 23 4.364 -2.065 -5.680 1.00 1.26 C ATOM 351 CE2 TYR A 23 3.205 -3.670 -4.336 1.00 1.18 C ATOM 352 CZ TYR A 23 3.940 -3.359 -5.462 1.00 0.36 C ATOM 353 OH TYR A 23 4.251 -4.345 -6.370 1.00 0.44 O ATOM 354 H TYR A 23 4.306 1.482 -3.828 1.00 0.30 H ATOM 355 HA TYR A 23 1.632 0.643 -3.992 1.00 0.26 H ATOM 356 HB2 TYR A 23 3.888 -0.015 -2.125 1.00 0.29 H ATOM 357 HB3 TYR A 23 2.290 -0.718 -1.902 1.00 0.27 H ATOM 358 HD1 TYR A 23 4.378 -0.063 -4.928 1.00 2.17 H ATOM 359 HD2 TYR A 23 2.318 -2.917 -2.548 1.00 2.06 H ATOM 360 HE1 TYR A 23 4.939 -1.820 -6.560 1.00 2.17 H ATOM 361 HE2 TYR A 23 2.873 -4.681 -4.160 1.00 2.10 H ATOM 362 HH TYR A 23 3.458 -4.605 -6.845 1.00 0.83 H ATOM 363 N ARG A 24 2.256 2.729 -1.604 1.00 0.25 N ATOM 364 CA ARG A 24 1.678 3.515 -0.513 1.00 0.29 C ATOM 365 C ARG A 24 0.647 4.528 -0.998 1.00 0.31 C ATOM 366 O ARG A 24 -0.507 4.507 -0.575 1.00 0.32 O ATOM 367 CB ARG A 24 2.777 4.261 0.250 1.00 0.35 C ATOM 368 CG ARG A 24 4.144 3.605 0.178 1.00 0.36 C ATOM 369 CD ARG A 24 5.138 4.296 1.097 1.00 0.31 C ATOM 370 NE ARG A 24 6.493 3.780 0.923 1.00 0.36 N ATOM 371 CZ ARG A 24 7.595 4.495 1.148 1.00 0.39 C ATOM 372 NH1 ARG A 24 7.509 5.752 1.565 1.00 0.38 N ATOM 373 NH2 ARG A 24 8.787 3.948 0.963 1.00 0.47 N ATOM 374 H ARG A 24 3.157 2.940 -1.926 1.00 0.28 H ATOM 375 HA ARG A 24 1.193 2.831 0.164 1.00 0.30 H ATOM 376 HB2 ARG A 24 2.864 5.255 -0.156 1.00 0.49 H ATOM 377 HB3 ARG A 24 2.491 4.333 1.289 1.00 0.61 H ATOM 378 HG2 ARG A 24 4.050 2.573 0.470 1.00 0.65 H ATOM 379 HG3 ARG A 24 4.507 3.663 -0.836 1.00 0.54 H ATOM 380 HD2 ARG A 24 5.133 5.353 0.877 1.00 0.33 H ATOM 381 HD3 ARG A 24 4.831 4.141 2.121 1.00 0.42 H ATOM 382 HE ARG A 24 6.589 2.848 0.622 1.00 0.40 H ATOM 383 HH11 ARG A 24 6.615 6.172 1.714 1.00 0.36 H ATOM 384 HH12 ARG A 24 8.342 6.281 1.730 1.00 0.42 H ATOM 385 HH21 ARG A 24 8.859 3.000 0.654 1.00 0.52 H ATOM 386 HH22 ARG A 24 9.615 4.483 1.131 1.00 0.50 H ATOM 387 N LEU A 25 1.083 5.440 -1.847 1.00 0.32 N ATOM 388 CA LEU A 25 0.213 6.494 -2.349 1.00 0.37 C ATOM 389 C LEU A 25 -0.448 6.130 -3.674 1.00 0.36 C ATOM 390 O LEU A 25 -1.615 6.448 -3.903 1.00 0.39 O ATOM 391 CB LEU A 25 1.028 7.775 -2.518 1.00 0.42 C ATOM 392 CG LEU A 25 1.980 8.113 -1.355 1.00 0.43 C ATOM 393 CD1 LEU A 25 1.394 7.685 -0.011 1.00 0.42 C ATOM 394 CD2 LEU A 25 3.345 7.468 -1.571 1.00 0.42 C ATOM 395 H LEU A 25 2.023 5.425 -2.121 1.00 0.32 H ATOM 396 HA LEU A 25 -0.558 6.667 -1.614 1.00 0.39 H ATOM 397 HB2 LEU A 25 1.616 7.677 -3.423 1.00 0.42 H ATOM 398 HB3 LEU A 25 0.342 8.599 -2.643 1.00 0.45 H ATOM 399 HG LEU A 25 2.123 9.183 -1.324 1.00 0.47 H ATOM 400 HD11 LEU A 25 0.327 7.555 -0.106 1.00 1.09 H ATOM 401 HD12 LEU A 25 1.598 8.444 0.729 1.00 1.08 H ATOM 402 HD13 LEU A 25 1.843 6.752 0.302 1.00 1.09 H ATOM 403 HD21 LEU A 25 3.611 6.884 -0.701 1.00 1.04 H ATOM 404 HD22 LEU A 25 4.085 8.238 -1.725 1.00 1.13 H ATOM 405 HD23 LEU A 25 3.309 6.826 -2.438 1.00 1.06 H ATOM 406 N ASN A 26 0.312 5.500 -4.555 1.00 0.34 N ATOM 407 CA ASN A 26 -0.190 5.136 -5.874 1.00 0.36 C ATOM 408 C ASN A 26 -1.199 3.987 -5.822 1.00 0.32 C ATOM 409 O ASN A 26 -2.183 3.993 -6.563 1.00 0.38 O ATOM 410 CB ASN A 26 0.981 4.775 -6.779 1.00 0.37 C ATOM 411 CG ASN A 26 0.750 5.193 -8.218 1.00 0.54 C ATOM 412 OD1 ASN A 26 -0.016 4.561 -8.945 1.00 1.22 O ATOM 413 ND2 ASN A 26 1.414 6.264 -8.637 1.00 1.28 N ATOM 414 H ASN A 26 1.243 5.300 -4.326 1.00 0.32 H ATOM 415 HA ASN A 26 -0.684 6.004 -6.283 1.00 0.42 H ATOM 416 HB2 ASN A 26 1.868 5.276 -6.413 1.00 0.36 H ATOM 417 HB3 ASN A 26 1.135 3.708 -6.750 1.00 0.34 H ATOM 418 HD21 ASN A 26 2.008 6.718 -8.003 1.00 1.98 H ATOM 419 HD22 ASN A 26 1.283 6.556 -9.563 1.00 1.37 H ATOM 420 N LEU A 27 -0.967 3.007 -4.954 1.00 0.27 N ATOM 421 CA LEU A 27 -1.883 1.873 -4.839 1.00 0.27 C ATOM 422 C LEU A 27 -2.855 2.077 -3.673 1.00 0.25 C ATOM 423 O LEU A 27 -3.741 2.928 -3.749 1.00 0.28 O ATOM 424 CB LEU A 27 -1.108 0.561 -4.686 1.00 0.29 C ATOM 425 CG LEU A 27 -0.645 -0.076 -5.996 1.00 0.63 C ATOM 426 CD1 LEU A 27 0.383 0.806 -6.686 1.00 0.91 C ATOM 427 CD2 LEU A 27 -0.076 -1.462 -5.738 1.00 1.05 C ATOM 428 H LEU A 27 -0.171 3.045 -4.383 1.00 0.27 H ATOM 429 HA LEU A 27 -2.457 1.830 -5.754 1.00 0.32 H ATOM 430 HB2 LEU A 27 -0.241 0.748 -4.072 1.00 0.49 H ATOM 431 HB3 LEU A 27 -1.742 -0.149 -4.177 1.00 0.63 H ATOM 432 HG LEU A 27 -1.493 -0.179 -6.658 1.00 0.93 H ATOM 433 HD11 LEU A 27 1.281 0.847 -6.088 1.00 1.50 H ATOM 434 HD12 LEU A 27 -0.019 1.801 -6.803 1.00 1.21 H ATOM 435 HD13 LEU A 27 0.615 0.394 -7.657 1.00 1.49 H ATOM 436 HD21 LEU A 27 -0.045 -2.017 -6.665 1.00 1.42 H ATOM 437 HD22 LEU A 27 -0.704 -1.981 -5.029 1.00 1.50 H ATOM 438 HD23 LEU A 27 0.922 -1.373 -5.338 1.00 1.69 H ATOM 439 N CYS A 28 -2.697 1.306 -2.595 1.00 0.25 N ATOM 440 CA CYS A 28 -3.574 1.435 -1.443 1.00 0.23 C ATOM 441 C CYS A 28 -3.000 2.422 -0.441 1.00 0.22 C ATOM 442 O CYS A 28 -1.785 2.529 -0.285 1.00 0.22 O ATOM 443 CB CYS A 28 -3.707 0.085 -0.774 1.00 0.25 C ATOM 444 SG CYS A 28 -2.125 -0.500 -0.125 1.00 0.50 S ATOM 445 H CYS A 28 -1.978 0.638 -2.569 1.00 0.29 H ATOM 446 HA CYS A 28 -4.543 1.773 -1.769 1.00 0.25 H ATOM 447 HB2 CYS A 28 -4.401 0.159 0.050 1.00 0.40 H ATOM 448 HB3 CYS A 28 -4.065 -0.640 -1.489 1.00 0.26 H ATOM 449 N LYS A 29 -3.880 3.113 0.254 1.00 0.24 N ATOM 450 CA LYS A 29 -3.472 4.068 1.266 1.00 0.27 C ATOM 451 C LYS A 29 -3.173 3.378 2.591 1.00 0.27 C ATOM 452 O LYS A 29 -2.084 3.498 3.141 1.00 0.30 O ATOM 453 CB LYS A 29 -4.552 5.133 1.453 1.00 0.33 C ATOM 454 CG LYS A 29 -4.798 5.963 0.203 1.00 0.31 C ATOM 455 CD LYS A 29 -4.467 7.430 0.428 1.00 0.81 C ATOM 456 CE LYS A 29 -3.747 8.029 -0.769 1.00 0.97 C ATOM 457 NZ LYS A 29 -4.196 9.421 -1.048 1.00 1.30 N ATOM 458 H LYS A 29 -4.831 2.956 0.104 1.00 0.26 H ATOM 459 HA LYS A 29 -2.570 4.548 0.917 1.00 0.27 H ATOM 460 HB2 LYS A 29 -5.477 4.648 1.728 1.00 0.39 H ATOM 461 HB3 LYS A 29 -4.252 5.798 2.250 1.00 0.39 H ATOM 462 HG2 LYS A 29 -4.177 5.583 -0.597 1.00 0.44 H ATOM 463 HG3 LYS A 29 -5.839 5.876 -0.075 1.00 0.56 H ATOM 464 HD2 LYS A 29 -5.384 7.975 0.594 1.00 1.21 H ATOM 465 HD3 LYS A 29 -3.833 7.516 1.299 1.00 1.28 H ATOM 466 HE2 LYS A 29 -2.686 8.038 -0.568 1.00 1.60 H ATOM 467 HE3 LYS A 29 -3.944 7.416 -1.636 1.00 1.31 H ATOM 468 HZ1 LYS A 29 -3.988 9.673 -2.036 1.00 1.81 H ATOM 469 HZ2 LYS A 29 -3.705 10.089 -0.421 1.00 1.53 H ATOM 470 HZ3 LYS A 29 -5.221 9.504 -0.890 1.00 1.88 H ATOM 471 N LYS A 30 -4.176 2.687 3.116 1.00 0.27 N ATOM 472 CA LYS A 30 -4.057 2.010 4.401 1.00 0.31 C ATOM 473 C LYS A 30 -3.400 0.632 4.324 1.00 0.29 C ATOM 474 O LYS A 30 -2.455 0.354 5.060 1.00 0.31 O ATOM 475 CB LYS A 30 -5.436 1.874 5.041 1.00 0.36 C ATOM 476 CG LYS A 30 -5.433 1.023 6.298 1.00 0.46 C ATOM 477 CD LYS A 30 -4.848 1.777 7.478 1.00 0.57 C ATOM 478 CE LYS A 30 -5.877 2.691 8.122 1.00 1.03 C ATOM 479 NZ LYS A 30 -5.331 3.382 9.323 1.00 1.66 N ATOM 480 H LYS A 30 -5.032 2.655 2.639 1.00 0.26 H ATOM 481 HA LYS A 30 -3.452 2.635 5.037 1.00 0.35 H ATOM 482 HB2 LYS A 30 -5.802 2.857 5.296 1.00 0.41 H ATOM 483 HB3 LYS A 30 -6.107 1.421 4.327 1.00 0.33 H ATOM 484 HG2 LYS A 30 -6.446 0.735 6.532 1.00 0.47 H ATOM 485 HG3 LYS A 30 -4.836 0.140 6.117 1.00 0.48 H ATOM 486 HD2 LYS A 30 -4.503 1.064 8.211 1.00 0.73 H ATOM 487 HD3 LYS A 30 -4.016 2.372 7.132 1.00 0.87 H ATOM 488 HE2 LYS A 30 -6.185 3.432 7.400 1.00 1.61 H ATOM 489 HE3 LYS A 30 -6.732 2.099 8.416 1.00 1.65 H ATOM 490 HZ1 LYS A 30 -5.750 4.331 9.410 1.00 2.20 H ATOM 491 HZ2 LYS A 30 -4.299 3.478 9.242 1.00 2.11 H ATOM 492 HZ3 LYS A 30 -5.552 2.837 10.181 1.00 2.11 H ATOM 493 N THR A 31 -3.940 -0.251 3.491 1.00 0.28 N ATOM 494 CA THR A 31 -3.425 -1.616 3.404 1.00 0.32 C ATOM 495 C THR A 31 -1.909 -1.665 3.262 1.00 0.30 C ATOM 496 O THR A 31 -1.270 -2.618 3.709 1.00 0.37 O ATOM 497 CB THR A 31 -4.079 -2.371 2.256 1.00 0.33 C ATOM 498 OG1 THR A 31 -5.490 -2.360 2.384 1.00 0.44 O ATOM 499 CG2 THR A 31 -3.634 -3.811 2.191 1.00 0.54 C ATOM 500 H THR A 31 -4.723 0.002 2.954 1.00 0.28 H ATOM 501 HA THR A 31 -3.690 -2.112 4.327 1.00 0.36 H ATOM 502 HB THR A 31 -3.815 -1.898 1.323 1.00 0.27 H ATOM 503 HG1 THR A 31 -5.881 -2.863 1.667 1.00 1.01 H ATOM 504 HG21 THR A 31 -3.916 -4.232 1.241 1.00 1.19 H ATOM 505 HG22 THR A 31 -4.105 -4.365 2.988 1.00 1.16 H ATOM 506 HG23 THR A 31 -2.560 -3.859 2.307 1.00 1.18 H ATOM 507 N CYS A 32 -1.336 -0.648 2.646 1.00 0.24 N ATOM 508 CA CYS A 32 0.120 -0.610 2.463 1.00 0.26 C ATOM 509 C CYS A 32 0.815 -0.270 3.778 1.00 0.24 C ATOM 510 O CYS A 32 2.021 -0.465 3.927 1.00 0.26 O ATOM 511 CB CYS A 32 0.523 0.392 1.373 1.00 0.31 C ATOM 512 SG CYS A 32 2.312 0.727 1.283 1.00 0.89 S ATOM 513 H CYS A 32 -1.900 0.087 2.312 1.00 0.22 H ATOM 514 HA CYS A 32 0.433 -1.598 2.159 1.00 0.31 H ATOM 515 HB2 CYS A 32 0.227 0.002 0.414 1.00 0.47 H ATOM 516 HB3 CYS A 32 0.019 1.330 1.549 1.00 0.43 H ATOM 517 N GLY A 33 0.038 0.224 4.731 1.00 0.24 N ATOM 518 CA GLY A 33 0.580 0.571 6.033 1.00 0.29 C ATOM 519 C GLY A 33 1.089 2.001 6.119 1.00 0.35 C ATOM 520 O GLY A 33 2.140 2.251 6.709 1.00 0.46 O ATOM 521 H GLY A 33 -0.918 0.339 4.551 1.00 0.24 H ATOM 522 HA2 GLY A 33 -0.192 0.435 6.775 1.00 0.35 H ATOM 523 HA3 GLY A 33 1.396 -0.101 6.257 1.00 0.29 H ATOM 524 N THR A 34 0.344 2.945 5.547 1.00 0.34 N ATOM 525 CA THR A 34 0.740 4.353 5.589 1.00 0.44 C ATOM 526 C THR A 34 -0.414 5.243 6.041 1.00 0.52 C ATOM 527 O THR A 34 -0.199 6.262 6.699 1.00 0.68 O ATOM 528 CB THR A 34 1.255 4.825 4.227 1.00 0.51 C ATOM 529 OG1 THR A 34 1.474 6.224 4.234 1.00 1.06 O ATOM 530 CG2 THR A 34 0.320 4.518 3.081 1.00 0.54 C ATOM 531 H THR A 34 -0.489 2.692 5.098 1.00 0.32 H ATOM 532 HA THR A 34 1.540 4.442 6.310 1.00 0.50 H ATOM 533 HB THR A 34 2.193 4.340 4.024 1.00 0.78 H ATOM 534 HG1 THR A 34 1.880 6.489 3.405 1.00 1.39 H ATOM 535 HG21 THR A 34 0.110 3.458 3.061 1.00 1.16 H ATOM 536 HG22 THR A 34 0.784 4.810 2.150 1.00 1.26 H ATOM 537 HG23 THR A 34 -0.600 5.066 3.212 1.00 1.18 H ATOM 538 N CYS A 35 -1.637 4.860 5.688 1.00 0.49 N ATOM 539 CA CYS A 35 -2.814 5.639 6.066 1.00 0.62 C ATOM 540 C CYS A 35 -2.888 5.815 7.580 1.00 0.95 C ATOM 541 O CYS A 35 -2.773 6.968 8.047 1.00 1.71 O ATOM 542 CB CYS A 35 -4.091 4.966 5.561 1.00 1.04 C ATOM 543 SG CYS A 35 -5.593 5.980 5.760 1.00 1.59 S ATOM 544 OXT CYS A 35 -3.058 4.798 8.285 1.00 1.64 O ATOM 545 H CYS A 35 -1.751 4.040 5.162 1.00 0.43 H ATOM 546 HA CYS A 35 -2.726 6.612 5.607 1.00 1.30 H ATOM 547 HB2 CYS A 35 -3.982 4.745 4.510 1.00 1.71 H ATOM 548 HB3 CYS A 35 -4.243 4.045 6.104 1.00 1.53 H