ATOM 44 N HIS A 4 -2.898 13.875 3.374 1.00 0.00 N ATOM 45 CA HIS A 4 -2.534 14.373 2.058 1.00 0.00 C ATOM 46 C HIS A 4 -2.101 13.206 1.169 1.00 0.00 C ATOM 47 O HIS A 4 -1.469 13.411 0.134 1.00 0.00 O ATOM 48 CB HIS A 4 -1.467 15.464 2.167 1.00 0.00 C ATOM 49 CG HIS A 4 -1.285 16.273 0.905 1.00 0.00 C ATOM 50 ND1 HIS A 4 -0.158 17.038 0.662 1.00 0.00 N ATOM 51 CD2 HIS A 4 -2.097 16.427 -0.180 1.00 0.00 C ATOM 52 CE1 HIS A 4 -0.296 17.622 -0.520 1.00 0.00 C ATOM 53 NE2 HIS A 4 -1.499 17.242 -1.040 1.00 0.00 N ATOM 54 H HIS A 4 -2.128 13.594 3.947 1.00 0.00 H ATOM 55 HA HIS A 4 -3.431 14.827 1.637 1.00 0.00 H ATOM 56 HB2 HIS A 4 -1.731 16.137 2.982 1.00 0.00 H ATOM 57 HB3 HIS A 4 -0.516 15.002 2.431 1.00 0.00 H ATOM 58 HD1 HIS A 4 0.628 17.133 1.273 1.00 0.00 H ATOM 59 HD2 HIS A 4 -3.071 15.959 -0.317 1.00 0.00 H ATOM 60 HE1 HIS A 4 0.424 18.290 -0.994 1.00 0.00 H ATOM 61 N PHE A 5 -2.459 12.007 1.606 1.00 0.00 N ATOM 62 CA PHE A 5 -2.115 10.807 0.862 1.00 0.00 C ATOM 63 C PHE A 5 -3.373 10.060 0.413 1.00 0.00 C ATOM 64 O PHE A 5 -3.900 9.228 1.150 1.00 0.00 O ATOM 65 CB PHE A 5 -1.313 9.910 1.806 1.00 0.00 C ATOM 66 CG PHE A 5 -1.584 10.169 3.290 1.00 0.00 C ATOM 67 CD1 PHE A 5 -1.223 11.354 3.851 1.00 0.00 C ATOM 68 CD2 PHE A 5 -2.186 9.213 4.048 1.00 0.00 C ATOM 69 CE1 PHE A 5 -1.475 11.594 5.227 1.00 0.00 C ATOM 70 CE2 PHE A 5 -2.437 9.453 5.424 1.00 0.00 C ATOM 71 CZ PHE A 5 -2.077 10.638 5.985 1.00 0.00 C ATOM 72 H PHE A 5 -2.973 11.849 2.449 1.00 0.00 H ATOM 73 HA PHE A 5 -1.549 11.121 -0.016 1.00 0.00 H ATOM 74 HB2 PHE A 5 -1.541 8.868 1.583 1.00 0.00 H ATOM 75 HB3 PHE A 5 -0.250 10.052 1.611 1.00 0.00 H ATOM 76 HD1 PHE A 5 -0.740 12.120 3.243 1.00 0.00 H ATOM 77 HD2 PHE A 5 -2.475 8.263 3.598 1.00 0.00 H ATOM 78 HE1 PHE A 5 -1.185 12.544 5.677 1.00 0.00 H ATOM 79 HE2 PHE A 5 -2.920 8.687 6.032 1.00 0.00 H ATOM 80 HZ PHE A 5 -2.269 10.823 7.042 1.00 0.00 H ATOM 81 N ASN A 6 -3.817 10.385 -0.792 1.00 0.00 N ATOM 82 CA ASN A 6 -5.003 9.756 -1.347 1.00 0.00 C ATOM 83 C ASN A 6 -4.582 8.664 -2.332 1.00 0.00 C ATOM 84 O ASN A 6 -4.629 7.479 -2.008 1.00 0.00 O ATOM 85 CB ASN A 6 -5.862 10.771 -2.104 1.00 0.00 C ATOM 86 CG ASN A 6 -7.233 10.930 -1.444 1.00 0.00 C ATOM 87 OD1 ASN A 6 -8.269 10.895 -2.087 1.00 0.00 O ATOM 88 ND2 ASN A 6 -7.181 11.107 -0.126 1.00 0.00 N ATOM 89 H ASN A 6 -3.382 11.064 -1.384 1.00 0.00 H ATOM 90 HA ASN A 6 -5.544 9.357 -0.489 1.00 0.00 H ATOM 91 HB2 ASN A 6 -5.353 11.734 -2.132 1.00 0.00 H ATOM 92 HB3 ASN A 6 -5.988 10.447 -3.138 1.00 0.00 H ATOM 93 HD21 ASN A 6 -6.526 11.751 0.267 1.00 0.00 H ATOM 94 HD22 ASN A 6 -7.798 10.594 0.472 1.00 0.00 H ATOM 95 N ASP A 7 -4.180 9.103 -3.516 1.00 0.00 N ATOM 96 CA ASP A 7 -3.751 8.178 -4.551 1.00 0.00 C ATOM 97 C ASP A 7 -2.714 7.214 -3.970 1.00 0.00 C ATOM 98 O ASP A 7 -2.376 7.299 -2.791 1.00 0.00 O ATOM 99 CB ASP A 7 -3.101 8.921 -5.720 1.00 0.00 C ATOM 100 CG ASP A 7 -3.739 10.269 -6.063 1.00 0.00 C ATOM 101 OD1 ASP A 7 -4.987 10.216 -6.381 1.00 0.00 O ATOM 102 OD2 ASP A 7 -3.077 11.316 -6.027 1.00 0.00 O ATOM 103 H ASP A 7 -4.144 10.069 -3.772 1.00 0.00 H ATOM 104 HA ASP A 7 -4.658 7.669 -4.875 1.00 0.00 H ATOM 105 HB2 ASP A 7 -2.048 9.084 -5.488 1.00 0.00 H ATOM 106 HB3 ASP A 7 -3.139 8.284 -6.603 1.00 0.00 H ATOM 107 N CYS A 8 -2.240 6.320 -4.824 1.00 0.00 N ATOM 108 CA CYS A 8 -1.248 5.341 -4.410 1.00 0.00 C ATOM 109 C CYS A 8 -1.301 4.163 -5.385 1.00 0.00 C ATOM 110 O CYS A 8 -0.271 3.731 -5.899 1.00 0.00 O ATOM 111 CB CYS A 8 -1.465 4.896 -2.963 1.00 0.00 C ATOM 112 SG CYS A 8 -0.996 3.160 -2.616 1.00 0.00 S ATOM 113 H CYS A 8 -2.520 6.258 -5.783 1.00 0.00 H ATOM 114 HA CYS A 8 -0.279 5.838 -4.456 1.00 0.00 H ATOM 115 HB2 CYS A 8 -0.891 5.550 -2.306 1.00 0.00 H ATOM 116 HB3 CYS A 8 -2.516 5.031 -2.708 1.00 0.00 H ATOM 117 N PRO A 9 -2.544 3.662 -5.614 1.00 0.00 N ATOM 118 CA PRO A 9 -2.745 2.542 -6.517 1.00 0.00 C ATOM 119 C PRO A 9 -2.616 2.983 -7.977 1.00 0.00 C ATOM 120 O PRO A 9 -3.325 3.885 -8.420 1.00 0.00 O ATOM 121 CB PRO A 9 -4.127 2.006 -6.178 1.00 0.00 C ATOM 122 CG PRO A 9 -4.835 3.122 -5.428 1.00 0.00 C ATOM 123 CD PRO A 9 -3.788 4.147 -5.022 1.00 0.00 C ATOM 124 HA PRO A 9 -1.974 1.788 -6.358 1.00 0.00 H ATOM 125 HB2 PRO A 9 -4.673 1.736 -7.082 1.00 0.00 H ATOM 126 HB3 PRO A 9 -4.058 1.106 -5.567 1.00 0.00 H ATOM 127 HG2 PRO A 9 -5.596 3.583 -6.058 1.00 0.00 H ATOM 128 HG3 PRO A 9 -5.344 2.728 -4.549 1.00 0.00 H ATOM 129 HD2 PRO A 9 -4.041 5.140 -5.392 1.00 0.00 H ATOM 130 HD3 PRO A 9 -3.707 4.222 -3.938 1.00 0.00 H ATOM 131 N ASP A 10 -1.706 2.327 -8.681 1.00 0.00 N ATOM 132 CA ASP A 10 -1.475 2.641 -10.082 1.00 0.00 C ATOM 133 C ASP A 10 -2.028 1.511 -10.951 1.00 0.00 C ATOM 134 O ASP A 10 -1.371 1.070 -11.893 1.00 0.00 O ATOM 135 CB ASP A 10 0.021 2.777 -10.376 1.00 0.00 C ATOM 136 CG ASP A 10 0.619 4.150 -10.066 1.00 0.00 C ATOM 137 OD1 ASP A 10 0.354 5.136 -10.769 1.00 0.00 O ATOM 138 OD2 ASP A 10 1.399 4.185 -9.038 1.00 0.00 O ATOM 139 H ASP A 10 -1.134 1.596 -8.313 1.00 0.00 H ATOM 140 HA ASP A 10 -1.989 3.588 -10.251 1.00 0.00 H ATOM 141 HB2 ASP A 10 0.558 2.024 -9.800 1.00 0.00 H ATOM 142 HB3 ASP A 10 0.189 2.554 -11.429 1.00 0.00 H ATOM 143 N SER A 11 -3.230 1.074 -10.605 1.00 0.00 N ATOM 144 CA SER A 11 -3.878 0.004 -11.342 1.00 0.00 C ATOM 145 C SER A 11 -3.326 -1.351 -10.893 1.00 0.00 C ATOM 146 O SER A 11 -3.350 -2.318 -11.652 1.00 0.00 O ATOM 147 CB SER A 11 -3.689 0.180 -12.850 1.00 0.00 C ATOM 148 OG SER A 11 -2.530 -0.498 -13.325 1.00 0.00 O ATOM 149 H SER A 11 -3.757 1.438 -9.837 1.00 0.00 H ATOM 150 HA SER A 11 -4.937 0.084 -11.098 1.00 0.00 H ATOM 151 HB2 SER A 11 -4.568 -0.196 -13.372 1.00 0.00 H ATOM 152 HB3 SER A 11 -3.610 1.241 -13.083 1.00 0.00 H ATOM 153 HG SER A 11 -1.903 0.154 -13.752 1.00 0.00 H ATOM 154 N HIS A 12 -2.841 -1.377 -9.659 1.00 0.00 N ATOM 155 CA HIS A 12 -2.283 -2.596 -9.101 1.00 0.00 C ATOM 156 C HIS A 12 -1.227 -3.162 -10.052 1.00 0.00 C ATOM 157 O HIS A 12 -1.558 -3.873 -10.999 1.00 0.00 O ATOM 158 CB HIS A 12 -3.390 -3.601 -8.778 1.00 0.00 C ATOM 159 CG HIS A 12 -4.780 -3.109 -9.101 1.00 0.00 C ATOM 160 ND1 HIS A 12 -5.368 -2.040 -8.446 1.00 0.00 N ATOM 161 CD2 HIS A 12 -5.692 -3.548 -10.015 1.00 0.00 C ATOM 162 CE1 HIS A 12 -6.579 -1.855 -8.951 1.00 0.00 C ATOM 163 NE2 HIS A 12 -6.778 -2.791 -9.924 1.00 0.00 N ATOM 164 H HIS A 12 -2.825 -0.585 -9.049 1.00 0.00 H ATOM 165 HA HIS A 12 -1.803 -2.319 -8.162 1.00 0.00 H ATOM 166 HB2 HIS A 12 -3.205 -4.521 -9.332 1.00 0.00 H ATOM 167 HB3 HIS A 12 -3.341 -3.853 -7.719 1.00 0.00 H ATOM 168 HD1 HIS A 12 -4.950 -1.500 -7.716 1.00 0.00 H ATOM 169 HD2 HIS A 12 -5.553 -4.380 -10.705 1.00 0.00 H ATOM 170 HE1 HIS A 12 -7.290 -1.088 -8.644 1.00 0.00 H ATOM 171 N THR A 13 0.022 -2.824 -9.767 1.00 0.00 N ATOM 172 CA THR A 13 1.128 -3.288 -10.586 1.00 0.00 C ATOM 173 C THR A 13 1.910 -4.383 -9.856 1.00 0.00 C ATOM 174 O THR A 13 1.962 -5.524 -10.314 1.00 0.00 O ATOM 175 CB THR A 13 1.984 -2.076 -10.957 1.00 0.00 C ATOM 176 OG1 THR A 13 2.726 -1.799 -9.774 1.00 0.00 O ATOM 177 CG2 THR A 13 1.148 -0.813 -11.177 1.00 0.00 C ATOM 178 H THR A 13 0.282 -2.244 -8.995 1.00 0.00 H ATOM 179 HA THR A 13 0.720 -3.737 -11.493 1.00 0.00 H ATOM 180 HB THR A 13 2.604 -2.289 -11.829 1.00 0.00 H ATOM 181 HG1 THR A 13 3.678 -2.082 -9.892 1.00 0.00 H ATOM 182 HG21 THR A 13 0.405 -1.000 -11.953 1.00 0.00 H ATOM 183 HG22 THR A 13 0.644 -0.546 -10.248 1.00 0.00 H ATOM 184 HG23 THR A 13 1.799 0.004 -11.486 1.00 0.00 H ATOM 185 N GLN A 14 2.497 -3.997 -8.733 1.00 0.00 N ATOM 186 CA GLN A 14 3.272 -4.931 -7.935 1.00 0.00 C ATOM 187 C GLN A 14 3.641 -4.302 -6.590 1.00 0.00 C ATOM 188 O GLN A 14 4.738 -4.520 -6.079 1.00 0.00 O ATOM 189 CB GLN A 14 4.524 -5.388 -8.688 1.00 0.00 C ATOM 190 CG GLN A 14 4.210 -6.576 -9.601 1.00 0.00 C ATOM 191 CD GLN A 14 5.371 -7.574 -9.620 1.00 0.00 C ATOM 192 OE1 GLN A 14 6.395 -7.362 -10.247 1.00 0.00 O ATOM 193 NE2 GLN A 14 5.152 -8.670 -8.899 1.00 0.00 N ATOM 194 H GLN A 14 2.449 -3.067 -8.368 1.00 0.00 H ATOM 195 HA GLN A 14 2.619 -5.788 -7.775 1.00 0.00 H ATOM 196 HB2 GLN A 14 4.917 -4.563 -9.280 1.00 0.00 H ATOM 197 HB3 GLN A 14 5.300 -5.668 -7.976 1.00 0.00 H ATOM 198 HG2 GLN A 14 3.303 -7.073 -9.259 1.00 0.00 H ATOM 199 HG3 GLN A 14 4.017 -6.219 -10.613 1.00 0.00 H ATOM 200 HE21 GLN A 14 5.363 -8.676 -7.921 1.00 0.00 H ATOM 201 HE22 GLN A 14 4.776 -9.488 -9.335 1.00 0.00 H ATOM 202 N PHE A 15 2.704 -3.533 -6.056 1.00 0.00 N ATOM 203 CA PHE A 15 2.917 -2.870 -4.781 1.00 0.00 C ATOM 204 C PHE A 15 1.855 -3.289 -3.761 1.00 0.00 C ATOM 205 O PHE A 15 2.150 -3.430 -2.575 1.00 0.00 O ATOM 206 CB PHE A 15 2.798 -1.366 -5.033 1.00 0.00 C ATOM 207 CG PHE A 15 3.833 -0.525 -4.281 1.00 0.00 C ATOM 208 CD1 PHE A 15 4.092 -0.778 -2.971 1.00 0.00 C ATOM 209 CD2 PHE A 15 4.494 0.475 -4.925 1.00 0.00 C ATOM 210 CE1 PHE A 15 5.052 0.001 -2.273 1.00 0.00 C ATOM 211 CE2 PHE A 15 5.454 1.254 -4.227 1.00 0.00 C ATOM 212 CZ PHE A 15 5.713 1.001 -2.917 1.00 0.00 C ATOM 213 H PHE A 15 1.814 -3.361 -6.478 1.00 0.00 H ATOM 214 HA PHE A 15 3.902 -3.169 -4.421 1.00 0.00 H ATOM 215 HB2 PHE A 15 2.900 -1.178 -6.101 1.00 0.00 H ATOM 216 HB3 PHE A 15 1.800 -1.036 -4.744 1.00 0.00 H ATOM 217 HD1 PHE A 15 3.562 -1.579 -2.455 1.00 0.00 H ATOM 218 HD2 PHE A 15 4.286 0.677 -5.975 1.00 0.00 H ATOM 219 HE1 PHE A 15 5.260 -0.201 -1.223 1.00 0.00 H ATOM 220 HE2 PHE A 15 5.983 2.055 -4.742 1.00 0.00 H ATOM 221 HZ PHE A 15 6.450 1.599 -2.380 1.00 0.00 H ATOM 222 N CYS A 16 0.643 -3.477 -4.260 1.00 0.00 N ATOM 223 CA CYS A 16 -0.464 -3.877 -3.408 1.00 0.00 C ATOM 224 C CYS A 16 -1.569 -4.456 -4.295 1.00 0.00 C ATOM 225 O CYS A 16 -1.918 -3.871 -5.319 1.00 0.00 O ATOM 226 CB CYS A 16 -0.970 -2.713 -2.554 1.00 0.00 C ATOM 227 SG CYS A 16 -0.657 -1.052 -3.256 1.00 0.00 S ATOM 228 H CYS A 16 0.411 -3.360 -5.227 1.00 0.00 H ATOM 229 HA CYS A 16 -0.077 -4.635 -2.727 1.00 0.00 H ATOM 230 HB2 CYS A 16 -2.043 -2.831 -2.401 1.00 0.00 H ATOM 231 HB3 CYS A 16 -0.500 -2.770 -1.572 1.00 0.00 H ATOM 232 N PHE A 17 -2.087 -5.598 -3.869 1.00 0.00 N ATOM 233 CA PHE A 17 -3.145 -6.263 -4.611 1.00 0.00 C ATOM 234 C PHE A 17 -4.388 -6.455 -3.741 1.00 0.00 C ATOM 235 O PHE A 17 -5.482 -6.681 -4.256 1.00 0.00 O ATOM 236 CB PHE A 17 -2.608 -7.634 -5.022 1.00 0.00 C ATOM 237 CG PHE A 17 -2.677 -7.904 -6.527 1.00 0.00 C ATOM 238 CD1 PHE A 17 -2.067 -7.056 -7.398 1.00 0.00 C ATOM 239 CD2 PHE A 17 -3.347 -8.992 -6.994 1.00 0.00 C ATOM 240 CE1 PHE A 17 -2.130 -7.305 -8.794 1.00 0.00 C ATOM 241 CE2 PHE A 17 -3.409 -9.242 -8.390 1.00 0.00 C ATOM 242 CZ PHE A 17 -2.800 -8.394 -9.261 1.00 0.00 C ATOM 243 H PHE A 17 -1.798 -6.068 -3.035 1.00 0.00 H ATOM 244 HA PHE A 17 -3.393 -5.626 -5.461 1.00 0.00 H ATOM 245 HB2 PHE A 17 -1.573 -7.722 -4.695 1.00 0.00 H ATOM 246 HB3 PHE A 17 -3.174 -8.406 -4.500 1.00 0.00 H ATOM 247 HD1 PHE A 17 -1.530 -6.184 -7.024 1.00 0.00 H ATOM 248 HD2 PHE A 17 -3.835 -9.672 -6.296 1.00 0.00 H ATOM 249 HE1 PHE A 17 -1.642 -6.625 -9.492 1.00 0.00 H ATOM 250 HE2 PHE A 17 -3.946 -10.114 -8.764 1.00 0.00 H ATOM 251 HZ PHE A 17 -2.849 -8.586 -10.333 1.00 0.00 H ATOM 252 N HIS A 18 -4.180 -6.357 -2.436 1.00 0.00 N ATOM 253 CA HIS A 18 -5.271 -6.517 -1.489 1.00 0.00 C ATOM 254 C HIS A 18 -4.898 -5.856 -0.161 1.00 0.00 C ATOM 255 O HIS A 18 -4.752 -6.534 0.854 1.00 0.00 O ATOM 256 CB HIS A 18 -5.643 -7.993 -1.334 1.00 0.00 C ATOM 257 CG HIS A 18 -4.653 -8.793 -0.521 1.00 0.00 C ATOM 258 ND1 HIS A 18 -3.574 -9.448 -1.087 1.00 0.00 N ATOM 259 CD2 HIS A 18 -4.592 -9.036 0.819 1.00 0.00 C ATOM 260 CE1 HIS A 18 -2.900 -10.055 -0.122 1.00 0.00 C ATOM 261 NE2 HIS A 18 -3.533 -9.799 1.059 1.00 0.00 N ATOM 262 H HIS A 18 -3.288 -6.172 -2.025 1.00 0.00 H ATOM 263 HA HIS A 18 -6.131 -5.999 -1.914 1.00 0.00 H ATOM 264 HB2 HIS A 18 -6.624 -8.061 -0.864 1.00 0.00 H ATOM 265 HB3 HIS A 18 -5.731 -8.440 -2.324 1.00 0.00 H ATOM 266 HD1 HIS A 18 -3.342 -9.460 -2.060 1.00 0.00 H ATOM 267 HD2 HIS A 18 -5.294 -8.666 1.567 1.00 0.00 H ATOM 268 HE1 HIS A 18 -1.999 -10.655 -0.248 1.00 0.00 H ATOM 269 N GLY A 19 -4.754 -4.539 -0.211 1.00 0.00 N ATOM 270 CA GLY A 19 -4.401 -3.780 0.977 1.00 0.00 C ATOM 271 C GLY A 19 -4.710 -2.294 0.788 1.00 0.00 C ATOM 272 O GLY A 19 -5.187 -1.885 -0.268 1.00 0.00 O ATOM 273 H GLY A 19 -4.874 -3.995 -1.041 1.00 0.00 H ATOM 274 HA2 GLY A 19 -4.951 -4.164 1.835 1.00 0.00 H ATOM 275 HA3 GLY A 19 -3.340 -3.910 1.193 1.00 0.00 H ATOM 276 N THR A 20 -4.427 -1.526 1.831 1.00 0.00 N ATOM 277 CA THR A 20 -4.670 -0.094 1.794 1.00 0.00 C ATOM 278 C THR A 20 -3.596 0.608 0.959 1.00 0.00 C ATOM 279 O THR A 20 -2.482 0.105 0.828 1.00 0.00 O ATOM 280 CB THR A 20 -4.745 0.410 3.237 1.00 0.00 C ATOM 281 OG1 THR A 20 -4.279 -0.690 4.013 1.00 0.00 O ATOM 282 CG2 THR A 20 -6.185 0.618 3.710 1.00 0.00 C ATOM 283 H THR A 20 -4.040 -1.867 2.688 1.00 0.00 H ATOM 284 HA THR A 20 -5.625 0.080 1.298 1.00 0.00 H ATOM 285 HB THR A 20 -4.158 1.321 3.361 1.00 0.00 H ATOM 286 HG1 THR A 20 -4.523 -0.557 4.974 1.00 0.00 H ATOM 287 HG21 THR A 20 -6.872 0.386 2.897 1.00 0.00 H ATOM 288 HG22 THR A 20 -6.387 -0.038 4.556 1.00 0.00 H ATOM 289 HG23 THR A 20 -6.320 1.656 4.015 1.00 0.00 H ATOM 290 N CYS A 21 -3.970 1.757 0.419 1.00 0.00 N ATOM 291 CA CYS A 21 -3.053 2.533 -0.399 1.00 0.00 C ATOM 292 C CYS A 21 -2.877 3.908 0.248 1.00 0.00 C ATOM 293 O CYS A 21 -3.838 4.488 0.751 1.00 0.00 O ATOM 294 CB CYS A 21 -3.539 2.641 -1.846 1.00 0.00 C ATOM 295 SG CYS A 21 -2.305 2.157 -3.108 1.00 0.00 S ATOM 296 H CYS A 21 -4.880 2.159 0.531 1.00 0.00 H ATOM 297 HA CYS A 21 -2.109 1.988 -0.414 1.00 0.00 H ATOM 298 HB2 CYS A 21 -4.424 2.017 -1.966 1.00 0.00 H ATOM 299 HB3 CYS A 21 -3.846 3.670 -2.035 1.00 0.00 H ATOM 300 N ARG A 22 -1.643 4.389 0.215 1.00 0.00 N ATOM 301 CA ARG A 22 -1.330 5.685 0.792 1.00 0.00 C ATOM 302 C ARG A 22 -0.087 6.277 0.124 1.00 0.00 C ATOM 303 O ARG A 22 1.024 5.790 0.330 1.00 0.00 O ATOM 304 CB ARG A 22 -1.086 5.572 2.299 1.00 0.00 C ATOM 305 CG ARG A 22 -1.855 4.390 2.891 1.00 0.00 C ATOM 306 CD ARG A 22 -1.553 4.233 4.383 1.00 0.00 C ATOM 307 NE ARG A 22 -2.797 3.914 5.121 1.00 0.00 N ATOM 308 CZ ARG A 22 -3.753 4.817 5.418 1.00 0.00 C ATOM 309 NH1 ARG A 22 -3.493 6.140 5.344 1.00 0.00 N ATOM 310 NH2 ARG A 22 -4.947 4.388 5.785 1.00 0.00 N ATOM 311 H ARG A 22 -0.867 3.911 -0.196 1.00 0.00 H ATOM 312 HA ARG A 22 -2.209 6.298 0.596 1.00 0.00 H ATOM 313 HB2 ARG A 22 -0.020 5.449 2.490 1.00 0.00 H ATOM 314 HB3 ARG A 22 -1.393 6.496 2.790 1.00 0.00 H ATOM 315 HG2 ARG A 22 -2.925 4.540 2.747 1.00 0.00 H ATOM 316 HG3 ARG A 22 -1.587 3.476 2.365 1.00 0.00 H ATOM 317 HD2 ARG A 22 -0.819 3.442 4.532 1.00 0.00 H ATOM 318 HD3 ARG A 22 -1.116 5.152 4.773 1.00 0.00 H ATOM 319 HE ARG A 22 -2.935 2.968 5.416 1.00 0.00 H ATOM 320 N PHE A 23 -0.316 7.318 -0.662 1.00 0.00 N ATOM 321 CA PHE A 23 0.771 7.981 -1.362 1.00 0.00 C ATOM 322 C PHE A 23 1.010 9.384 -0.799 1.00 0.00 C ATOM 323 O PHE A 23 0.210 10.290 -1.021 1.00 0.00 O ATOM 324 CB PHE A 23 0.354 8.098 -2.830 1.00 0.00 C ATOM 325 CG PHE A 23 1.527 8.249 -3.800 1.00 0.00 C ATOM 326 CD1 PHE A 23 2.713 8.747 -3.361 1.00 0.00 C ATOM 327 CD2 PHE A 23 1.383 7.884 -5.102 1.00 0.00 C ATOM 328 CE1 PHE A 23 3.802 8.887 -4.262 1.00 0.00 C ATOM 329 CE2 PHE A 23 2.471 8.024 -6.003 1.00 0.00 C ATOM 330 CZ PHE A 23 3.658 8.523 -5.564 1.00 0.00 C ATOM 331 H PHE A 23 -1.222 7.707 -0.825 1.00 0.00 H ATOM 332 HA PHE A 23 1.666 7.376 -1.217 1.00 0.00 H ATOM 333 HB2 PHE A 23 -0.221 7.213 -3.104 1.00 0.00 H ATOM 334 HB3 PHE A 23 -0.310 8.955 -2.940 1.00 0.00 H ATOM 335 HD1 PHE A 23 2.829 9.039 -2.316 1.00 0.00 H ATOM 336 HD2 PHE A 23 0.432 7.485 -5.455 1.00 0.00 H ATOM 337 HE1 PHE A 23 4.753 9.287 -3.908 1.00 0.00 H ATOM 338 HE2 PHE A 23 2.356 7.733 -7.047 1.00 0.00 H ATOM 339 HZ PHE A 23 4.493 8.630 -6.255 1.00 0.00 H ATOM 340 N LEU A 24 2.116 9.518 -0.082 1.00 0.00 N ATOM 341 CA LEU A 24 2.471 10.795 0.514 1.00 0.00 C ATOM 342 C LEU A 24 2.994 11.734 -0.575 1.00 0.00 C ATOM 343 O LEU A 24 4.184 12.040 -0.616 1.00 0.00 O ATOM 344 CB LEU A 24 3.450 10.592 1.673 1.00 0.00 C ATOM 345 CG LEU A 24 3.157 11.389 2.945 1.00 0.00 C ATOM 346 CD1 LEU A 24 1.957 10.806 3.695 1.00 0.00 C ATOM 347 CD2 LEU A 24 4.399 11.479 3.834 1.00 0.00 C ATOM 348 H LEU A 24 2.762 8.776 0.094 1.00 0.00 H ATOM 349 HA LEU A 24 1.561 11.224 0.932 1.00 0.00 H ATOM 350 HB2 LEU A 24 3.466 9.531 1.928 1.00 0.00 H ATOM 351 HB3 LEU A 24 4.450 10.852 1.327 1.00 0.00 H ATOM 352 HG LEU A 24 2.893 12.407 2.657 1.00 0.00 H ATOM 353 HD11 LEU A 24 1.965 9.720 3.602 1.00 0.00 H ATOM 354 HD12 LEU A 24 2.018 11.081 4.747 1.00 0.00 H ATOM 355 HD13 LEU A 24 1.035 11.201 3.267 1.00 0.00 H ATOM 356 HD21 LEU A 24 5.262 11.091 3.292 1.00 0.00 H ATOM 357 HD22 LEU A 24 4.578 12.520 4.105 1.00 0.00 H ATOM 358 HD23 LEU A 24 4.243 10.890 4.737 1.00 0.00 H ATOM 359 N VAL A 25 2.078 12.165 -1.429 1.00 0.00 N ATOM 360 CA VAL A 25 2.432 13.062 -2.517 1.00 0.00 C ATOM 361 C VAL A 25 3.373 14.146 -1.989 1.00 0.00 C ATOM 362 O VAL A 25 4.392 14.445 -2.611 1.00 0.00 O ATOM 363 CB VAL A 25 1.165 13.631 -3.159 1.00 0.00 C ATOM 364 CG1 VAL A 25 0.816 14.998 -2.567 1.00 0.00 C ATOM 365 CG2 VAL A 25 1.310 13.713 -4.679 1.00 0.00 C ATOM 366 H VAL A 25 1.111 11.910 -1.389 1.00 0.00 H ATOM 367 HA VAL A 25 2.958 12.476 -3.269 1.00 0.00 H ATOM 368 HB VAL A 25 0.342 12.951 -2.938 1.00 0.00 H ATOM 369 HG11 VAL A 25 1.661 15.675 -2.693 1.00 0.00 H ATOM 370 HG12 VAL A 25 -0.055 15.405 -3.080 1.00 0.00 H ATOM 371 HG13 VAL A 25 0.593 14.888 -1.505 1.00 0.00 H ATOM 372 HG21 VAL A 25 2.358 13.582 -4.951 1.00 0.00 H ATOM 373 HG22 VAL A 25 0.714 12.928 -5.144 1.00 0.00 H ATOM 374 HG23 VAL A 25 0.964 14.686 -5.026 1.00 0.00 H ATOM 375 N GLN A 26 3.000 14.707 -0.849 1.00 0.00 N ATOM 376 CA GLN A 26 3.798 15.753 -0.231 1.00 0.00 C ATOM 377 C GLN A 26 5.277 15.362 -0.234 1.00 0.00 C ATOM 378 O GLN A 26 6.150 16.221 -0.349 1.00 0.00 O ATOM 379 CB GLN A 26 3.312 16.048 1.188 1.00 0.00 C ATOM 380 CG GLN A 26 2.771 14.783 1.857 1.00 0.00 C ATOM 381 CD GLN A 26 3.191 14.716 3.327 1.00 0.00 C ATOM 382 OE1 GLN A 26 2.375 14.621 4.229 1.00 0.00 O ATOM 383 NE2 GLN A 26 4.506 14.771 3.516 1.00 0.00 N ATOM 384 H GLN A 26 2.169 14.459 -0.350 1.00 0.00 H ATOM 385 HA GLN A 26 3.648 16.637 -0.852 1.00 0.00 H ATOM 386 HB2 GLN A 26 4.133 16.454 1.781 1.00 0.00 H ATOM 387 HB3 GLN A 26 2.533 16.809 1.159 1.00 0.00 H ATOM 388 HG2 GLN A 26 1.684 14.765 1.784 1.00 0.00 H ATOM 389 HG3 GLN A 26 3.139 13.903 1.330 1.00 0.00 H ATOM 390 HE21 GLN A 26 5.125 14.787 2.730 1.00 0.00 H ATOM 391 HE22 GLN A 26 4.877 14.796 4.445 1.00 0.00 H ATOM 392 N GLU A 27 5.514 14.064 -0.108 1.00 0.00 N ATOM 393 CA GLU A 27 6.872 13.549 -0.093 1.00 0.00 C ATOM 394 C GLU A 27 7.045 12.478 -1.173 1.00 0.00 C ATOM 395 O GLU A 27 7.991 11.693 -1.128 1.00 0.00 O ATOM 396 CB GLU A 27 7.236 12.999 1.287 1.00 0.00 C ATOM 397 CG GLU A 27 8.237 13.915 1.995 1.00 0.00 C ATOM 398 CD GLU A 27 9.675 13.455 1.743 1.00 0.00 C ATOM 399 OE1 GLU A 27 9.898 12.294 1.368 1.00 0.00 O ATOM 400 OE2 GLU A 27 10.579 14.353 1.948 1.00 0.00 O ATOM 401 H GLU A 27 4.798 13.371 -0.014 1.00 0.00 H ATOM 402 HA GLU A 27 7.510 14.406 -0.317 1.00 0.00 H ATOM 403 HB2 GLU A 27 6.336 12.902 1.892 1.00 0.00 H ATOM 404 HB3 GLU A 27 7.661 12.001 1.184 1.00 0.00 H ATOM 405 HG2 GLU A 27 8.112 14.938 1.642 1.00 0.00 H ATOM 406 HG3 GLU A 27 8.037 13.920 3.066 1.00 0.00 H ATOM 407 N ASP A 28 6.117 12.482 -2.119 1.00 0.00 N ATOM 408 CA ASP A 28 6.154 11.521 -3.208 1.00 0.00 C ATOM 409 C ASP A 28 6.677 10.182 -2.683 1.00 0.00 C ATOM 410 O ASP A 28 7.624 9.623 -3.234 1.00 0.00 O ATOM 411 CB ASP A 28 7.090 11.990 -4.324 1.00 0.00 C ATOM 412 CG ASP A 28 6.691 13.306 -4.993 1.00 0.00 C ATOM 413 OD1 ASP A 28 5.533 13.741 -4.906 1.00 0.00 O ATOM 414 OD2 ASP A 28 7.639 13.902 -5.633 1.00 0.00 O ATOM 415 H ASP A 28 5.351 13.125 -2.148 1.00 0.00 H ATOM 416 HA ASP A 28 5.127 11.456 -3.568 1.00 0.00 H ATOM 417 HB2 ASP A 28 8.094 12.098 -3.914 1.00 0.00 H ATOM 418 HB3 ASP A 28 7.139 11.212 -5.087 1.00 0.00 H ATOM 419 N LYS A 29 6.037 9.707 -1.625 1.00 0.00 N ATOM 420 CA LYS A 29 6.425 8.444 -1.021 1.00 0.00 C ATOM 421 C LYS A 29 5.289 7.433 -1.187 1.00 0.00 C ATOM 422 O LYS A 29 4.379 7.375 -0.361 1.00 0.00 O ATOM 423 CB LYS A 29 6.852 8.656 0.433 1.00 0.00 C ATOM 424 CG LYS A 29 8.303 9.134 0.515 1.00 0.00 C ATOM 425 CD LYS A 29 9.155 8.164 1.335 1.00 0.00 C ATOM 426 CE LYS A 29 10.412 8.854 1.869 1.00 0.00 C ATOM 427 NZ LYS A 29 11.472 7.859 2.143 1.00 0.00 N ATOM 428 H LYS A 29 5.267 10.169 -1.184 1.00 0.00 H ATOM 429 HA LYS A 29 7.297 8.077 -1.561 1.00 0.00 H ATOM 430 HB2 LYS A 29 6.197 9.388 0.907 1.00 0.00 H ATOM 431 HB3 LYS A 29 6.740 7.724 0.988 1.00 0.00 H ATOM 432 HG2 LYS A 29 8.716 9.226 -0.490 1.00 0.00 H ATOM 433 HG3 LYS A 29 8.338 10.125 0.966 1.00 0.00 H ATOM 434 HD2 LYS A 29 8.569 7.774 2.168 1.00 0.00 H ATOM 435 HD3 LYS A 29 9.438 7.311 0.719 1.00 0.00 H ATOM 436 HE2 LYS A 29 10.769 9.584 1.142 1.00 0.00 H ATOM 437 HE3 LYS A 29 10.175 9.402 2.781 1.00 0.00 H ATOM 438 HZ1 LYS A 29 12.053 7.687 1.329 1.00 0.00 H ATOM 439 HZ2 LYS A 29 11.090 6.962 2.423 1.00 0.00 H ATOM 440 N PRO A 30 5.381 6.642 -2.289 1.00 0.00 N ATOM 441 CA PRO A 30 4.372 5.636 -2.574 1.00 0.00 C ATOM 442 C PRO A 30 4.526 4.427 -1.650 1.00 0.00 C ATOM 443 O PRO A 30 5.572 3.780 -1.638 1.00 0.00 O ATOM 444 CB PRO A 30 4.564 5.291 -4.042 1.00 0.00 C ATOM 445 CG PRO A 30 5.962 5.767 -4.402 1.00 0.00 C ATOM 446 CD PRO A 30 6.443 6.683 -3.289 1.00 0.00 C ATOM 447 HA PRO A 30 3.376 6.039 -2.385 1.00 0.00 H ATOM 448 HB2 PRO A 30 4.462 4.219 -4.207 1.00 0.00 H ATOM 449 HB3 PRO A 30 3.813 5.782 -4.661 1.00 0.00 H ATOM 450 HG2 PRO A 30 6.637 4.920 -4.518 1.00 0.00 H ATOM 451 HG3 PRO A 30 5.950 6.298 -5.355 1.00 0.00 H ATOM 452 HD2 PRO A 30 7.390 6.339 -2.874 1.00 0.00 H ATOM 453 HD3 PRO A 30 6.606 7.698 -3.653 1.00 0.00 H ATOM 454 N ALA A 31 3.468 4.157 -0.898 1.00 0.00 N ATOM 455 CA ALA A 31 3.474 3.037 0.026 1.00 0.00 C ATOM 456 C ALA A 31 2.033 2.632 0.339 1.00 0.00 C ATOM 457 O ALA A 31 1.231 3.460 0.769 1.00 0.00 O ATOM 458 CB ALA A 31 4.259 3.416 1.284 1.00 0.00 C ATOM 459 H ALA A 31 2.622 4.688 -0.914 1.00 0.00 H ATOM 460 HA ALA A 31 3.979 2.204 -0.464 1.00 0.00 H ATOM 461 HB1 ALA A 31 4.817 4.334 1.101 1.00 0.00 H ATOM 462 HB2 ALA A 31 3.567 3.572 2.112 1.00 0.00 H ATOM 463 HB3 ALA A 31 4.952 2.614 1.536 1.00 0.00 H ATOM 464 N CYS A 32 1.746 1.359 0.111 1.00 0.00 N ATOM 465 CA CYS A 32 0.414 0.834 0.362 1.00 0.00 C ATOM 466 C CYS A 32 0.497 -0.142 1.538 1.00 0.00 C ATOM 467 O CYS A 32 1.333 -1.044 1.543 1.00 0.00 O ATOM 468 CB CYS A 32 -0.180 0.177 -0.884 1.00 0.00 C ATOM 469 SG CYS A 32 1.052 -0.511 -2.050 1.00 0.00 S ATOM 470 H CYS A 32 2.404 0.692 -0.239 1.00 0.00 H ATOM 471 HA CYS A 32 -0.216 1.687 0.612 1.00 0.00 H ATOM 472 HB2 CYS A 32 -0.850 -0.624 -0.572 1.00 0.00 H ATOM 473 HB3 CYS A 32 -0.786 0.913 -1.412 1.00 0.00 H ATOM 474 N VAL A 33 -0.382 0.072 2.506 1.00 0.00 N ATOM 475 CA VAL A 33 -0.419 -0.777 3.685 1.00 0.00 C ATOM 476 C VAL A 33 -1.197 -2.054 3.362 1.00 0.00 C ATOM 477 O VAL A 33 -2.112 -2.038 2.540 1.00 0.00 O ATOM 478 CB VAL A 33 -1.003 -0.004 4.868 1.00 0.00 C ATOM 479 CG1 VAL A 33 -1.311 -0.942 6.037 1.00 0.00 C ATOM 480 CG2 VAL A 33 -0.066 1.124 5.302 1.00 0.00 C ATOM 481 H VAL A 33 -1.059 0.809 2.495 1.00 0.00 H ATOM 482 HA VAL A 33 0.609 -1.045 3.929 1.00 0.00 H ATOM 483 HB VAL A 33 -1.941 0.446 4.545 1.00 0.00 H ATOM 484 HG11 VAL A 33 -0.417 -1.513 6.290 1.00 0.00 H ATOM 485 HG12 VAL A 33 -1.624 -0.356 6.901 1.00 0.00 H ATOM 486 HG13 VAL A 33 -2.110 -1.626 5.754 1.00 0.00 H ATOM 487 HG21 VAL A 33 0.209 1.723 4.434 1.00 0.00 H ATOM 488 HG22 VAL A 33 -0.570 1.755 6.034 1.00 0.00 H ATOM 489 HG23 VAL A 33 0.833 0.698 5.748 1.00 0.00 H ATOM 490 N CYS A 34 -0.805 -3.132 4.027 1.00 0.00 N ATOM 491 CA CYS A 34 -1.454 -4.416 3.821 1.00 0.00 C ATOM 492 C CYS A 34 -2.891 -4.315 4.335 1.00 0.00 C ATOM 493 O CYS A 34 -3.365 -3.225 4.654 1.00 0.00 O ATOM 494 CB CYS A 34 -0.684 -5.552 4.497 1.00 0.00 C ATOM 495 SG CYS A 34 0.926 -5.954 3.726 1.00 0.00 S ATOM 496 H CYS A 34 -0.059 -3.137 4.693 1.00 0.00 H ATOM 497 HA CYS A 34 -1.439 -4.606 2.748 1.00 0.00 H ATOM 498 HB2 CYS A 34 -0.516 -5.288 5.541 1.00 0.00 H ATOM 499 HB3 CYS A 34 -1.307 -6.447 4.490 1.00 0.00 H ATOM 500 N HIS A 35 -3.545 -5.466 4.400 1.00 0.00 N ATOM 501 CA HIS A 35 -4.919 -5.520 4.869 1.00 0.00 C ATOM 502 C HIS A 35 -5.032 -6.536 6.009 1.00 0.00 C ATOM 503 O HIS A 35 -4.956 -6.170 7.181 1.00 0.00 O ATOM 504 CB HIS A 35 -5.876 -5.817 3.714 1.00 0.00 C ATOM 505 CG HIS A 35 -7.004 -4.821 3.580 1.00 0.00 C ATOM 506 ND1 HIS A 35 -6.837 -3.465 3.802 1.00 0.00 N ATOM 507 CD2 HIS A 35 -8.314 -4.998 3.243 1.00 0.00 C ATOM 508 CE1 HIS A 35 -8.001 -2.864 3.606 1.00 0.00 C ATOM 509 NE2 HIS A 35 -8.915 -3.815 3.260 1.00 0.00 N ATOM 510 H HIS A 35 -3.152 -6.347 4.139 1.00 0.00 H ATOM 511 HA HIS A 35 -5.158 -4.528 5.253 1.00 0.00 H ATOM 512 HB2 HIS A 35 -5.311 -5.837 2.782 1.00 0.00 H ATOM 513 HB3 HIS A 35 -6.299 -6.813 3.852 1.00 0.00 H ATOM 514 HD1 HIS A 35 -5.984 -3.017 4.066 1.00 0.00 H ATOM 515 HD2 HIS A 35 -8.787 -5.951 3.000 1.00 0.00 H ATOM 516 HE1 HIS A 35 -8.195 -1.795 3.704 1.00 0.00 H ATOM 517 N SER A 36 -5.211 -7.790 5.624 1.00 0.00 N ATOM 518 CA SER A 36 -5.334 -8.861 6.598 1.00 0.00 C ATOM 519 C SER A 36 -6.150 -10.014 6.009 1.00 0.00 C ATOM 520 O SER A 36 -6.870 -9.831 5.029 1.00 0.00 O ATOM 521 CB SER A 36 -5.983 -8.358 7.890 1.00 0.00 C ATOM 522 OG SER A 36 -7.025 -7.420 7.634 1.00 0.00 O ATOM 523 H SER A 36 -5.271 -8.080 4.669 1.00 0.00 H ATOM 524 HA SER A 36 -4.314 -9.182 6.806 1.00 0.00 H ATOM 525 HB2 SER A 36 -6.386 -9.205 8.447 1.00 0.00 H ATOM 526 HB3 SER A 36 -5.224 -7.894 8.520 1.00 0.00 H ATOM 527 HG SER A 36 -7.648 -7.380 8.415 1.00 0.00 H ATOM 528 N GLY A 37 -6.010 -11.175 6.632 1.00 0.00 N ATOM 529 CA GLY A 37 -6.724 -12.356 6.182 1.00 0.00 C ATOM 530 C GLY A 37 -6.084 -12.937 4.919 1.00 0.00 C ATOM 531 O GLY A 37 -6.760 -13.569 4.110 1.00 0.00 O ATOM 532 H GLY A 37 -5.422 -11.315 7.429 1.00 0.00 H ATOM 533 HA2 GLY A 37 -6.727 -13.108 6.971 1.00 0.00 H ATOM 534 HA3 GLY A 37 -7.765 -12.102 5.982 1.00 0.00 H ATOM 535 N TYR A 38 -4.786 -12.701 4.791 1.00 0.00 N ATOM 536 CA TYR A 38 -4.046 -13.193 3.641 1.00 0.00 C ATOM 537 C TYR A 38 -2.695 -13.771 4.065 1.00 0.00 C ATOM 538 O TYR A 38 -2.519 -14.172 5.214 1.00 0.00 O ATOM 539 CB TYR A 38 -3.810 -11.978 2.742 1.00 0.00 C ATOM 540 CG TYR A 38 -2.823 -10.960 3.319 1.00 0.00 C ATOM 541 CD1 TYR A 38 -3.258 -10.016 4.227 1.00 0.00 C ATOM 542 CD2 TYR A 38 -1.500 -10.986 2.931 1.00 0.00 C ATOM 543 CE1 TYR A 38 -2.331 -9.058 4.770 1.00 0.00 C ATOM 544 CE2 TYR A 38 -0.571 -10.028 3.473 1.00 0.00 C ATOM 545 CZ TYR A 38 -1.033 -9.111 4.366 1.00 0.00 C ATOM 546 OH TYR A 38 -0.156 -8.206 4.879 1.00 0.00 O ATOM 547 H TYR A 38 -4.244 -12.187 5.454 1.00 0.00 H ATOM 548 HA TYR A 38 -4.638 -13.979 3.171 1.00 0.00 H ATOM 549 HB2 TYR A 38 -3.438 -12.321 1.776 1.00 0.00 H ATOM 550 HB3 TYR A 38 -4.763 -11.482 2.560 1.00 0.00 H ATOM 551 HD1 TYR A 38 -4.305 -9.996 4.533 1.00 0.00 H ATOM 552 HD2 TYR A 38 -1.155 -11.731 2.214 1.00 0.00 H ATOM 553 HE1 TYR A 38 -2.661 -8.307 5.488 1.00 0.00 H ATOM 554 HE2 TYR A 38 0.477 -10.036 3.176 1.00 0.00 H ATOM 555 HH TYR A 38 -0.036 -8.364 5.859 1.00 0.00 H ATOM 556 N VAL A 39 -1.773 -13.796 3.113 1.00 0.00 N ATOM 557 CA VAL A 39 -0.442 -14.317 3.373 1.00 0.00 C ATOM 558 C VAL A 39 0.477 -13.170 3.799 1.00 0.00 C ATOM 559 O VAL A 39 0.054 -12.265 4.515 1.00 0.00 O ATOM 560 CB VAL A 39 0.074 -15.071 2.146 1.00 0.00 C ATOM 561 CG1 VAL A 39 1.154 -16.082 2.538 1.00 0.00 C ATOM 562 CG2 VAL A 39 -1.074 -15.758 1.402 1.00 0.00 C ATOM 563 H VAL A 39 -1.924 -13.467 2.181 1.00 0.00 H ATOM 564 HA VAL A 39 -0.522 -15.027 4.197 1.00 0.00 H ATOM 565 HB VAL A 39 0.523 -14.345 1.470 1.00 0.00 H ATOM 566 HG11 VAL A 39 1.365 -15.993 3.603 1.00 0.00 H ATOM 567 HG12 VAL A 39 0.805 -17.091 2.319 1.00 0.00 H ATOM 568 HG13 VAL A 39 2.062 -15.880 1.970 1.00 0.00 H ATOM 569 HG21 VAL A 39 -1.710 -16.280 2.117 1.00 0.00 H ATOM 570 HG22 VAL A 39 -1.663 -15.008 0.872 1.00 0.00 H ATOM 571 HG23 VAL A 39 -0.668 -16.473 0.687 1.00 0.00 H ATOM 572 N GLY A 40 1.717 -13.246 3.340 1.00 0.00 N ATOM 573 CA GLY A 40 2.699 -12.226 3.665 1.00 0.00 C ATOM 574 C GLY A 40 3.680 -12.022 2.509 1.00 0.00 C ATOM 575 O GLY A 40 4.137 -12.988 1.899 1.00 0.00 O ATOM 576 H GLY A 40 2.053 -13.987 2.758 1.00 0.00 H ATOM 577 HA2 GLY A 40 2.193 -11.286 3.887 1.00 0.00 H ATOM 578 HA3 GLY A 40 3.245 -12.515 4.563 1.00 0.00 H ATOM 579 N ALA A 41 3.975 -10.758 2.241 1.00 0.00 N ATOM 580 CA ALA A 41 4.894 -10.415 1.169 1.00 0.00 C ATOM 581 C ALA A 41 4.665 -8.960 0.754 1.00 0.00 C ATOM 582 O ALA A 41 5.411 -8.070 1.163 1.00 0.00 O ATOM 583 CB ALA A 41 4.706 -11.389 0.003 1.00 0.00 C ATOM 584 H ALA A 41 3.599 -9.978 2.741 1.00 0.00 H ATOM 585 HA ALA A 41 5.908 -10.519 1.554 1.00 0.00 H ATOM 586 HB1 ALA A 41 3.658 -11.682 -0.059 1.00 0.00 H ATOM 587 HB2 ALA A 41 5.005 -10.906 -0.926 1.00 0.00 H ATOM 588 HB3 ALA A 41 5.321 -12.274 0.167 1.00 0.00 H ATOM 589 N ARG A 42 3.633 -8.763 -0.053 1.00 0.00 N ATOM 590 CA ARG A 42 3.299 -7.431 -0.527 1.00 0.00 C ATOM 591 C ARG A 42 1.797 -7.176 -0.379 1.00 0.00 C ATOM 592 O ARG A 42 1.291 -6.148 -0.826 1.00 0.00 O ATOM 593 CB ARG A 42 3.696 -7.252 -1.994 1.00 0.00 C ATOM 594 CG ARG A 42 5.122 -6.711 -2.114 1.00 0.00 C ATOM 595 CD ARG A 42 6.031 -7.713 -2.828 1.00 0.00 C ATOM 596 NE ARG A 42 6.319 -7.245 -4.202 1.00 0.00 N ATOM 597 CZ ARG A 42 7.556 -7.189 -4.740 1.00 0.00 C ATOM 598 NH1 ARG A 42 8.127 -8.295 -5.262 1.00 0.00 N ATOM 599 NH2 ARG A 42 8.200 -6.037 -4.746 1.00 0.00 N ATOM 600 H ARG A 42 3.033 -9.492 -0.381 1.00 0.00 H ATOM 601 HA ARG A 42 3.875 -6.756 0.105 1.00 0.00 H ATOM 602 HB2 ARG A 42 3.621 -8.208 -2.513 1.00 0.00 H ATOM 603 HB3 ARG A 42 3.001 -6.569 -2.482 1.00 0.00 H ATOM 604 HG2 ARG A 42 5.112 -5.769 -2.661 1.00 0.00 H ATOM 605 HG3 ARG A 42 5.518 -6.498 -1.121 1.00 0.00 H ATOM 606 HD2 ARG A 42 6.962 -7.832 -2.274 1.00 0.00 H ATOM 607 HD3 ARG A 42 5.552 -8.692 -2.861 1.00 0.00 H ATOM 608 HE ARG A 42 5.548 -6.951 -4.769 1.00 0.00 H ATOM 609 N CYS A 43 1.127 -8.130 0.251 1.00 0.00 N ATOM 610 CA CYS A 43 -0.305 -8.023 0.465 1.00 0.00 C ATOM 611 C CYS A 43 -1.009 -8.228 -0.879 1.00 0.00 C ATOM 612 O CYS A 43 -1.947 -7.505 -1.208 1.00 0.00 O ATOM 613 CB CYS A 43 -0.683 -6.687 1.109 1.00 0.00 C ATOM 614 SG CYS A 43 0.655 -5.896 2.075 1.00 0.00 S ATOM 615 H CYS A 43 1.546 -8.964 0.612 1.00 0.00 H ATOM 616 HA CYS A 43 -0.578 -8.811 1.168 1.00 0.00 H ATOM 617 HB2 CYS A 43 -1.002 -5.999 0.325 1.00 0.00 H ATOM 618 HB3 CYS A 43 -1.541 -6.844 1.763 1.00 0.00 H ATOM 619 N GLU A 44 -0.526 -9.216 -1.617 1.00 0.00 N ATOM 620 CA GLU A 44 -1.096 -9.525 -2.918 1.00 0.00 C ATOM 621 C GLU A 44 -1.720 -10.922 -2.906 1.00 0.00 C ATOM 622 O GLU A 44 -2.670 -11.188 -3.640 1.00 0.00 O ATOM 623 CB GLU A 44 -0.043 -9.404 -4.021 1.00 0.00 C ATOM 624 CG GLU A 44 -0.582 -9.930 -5.354 1.00 0.00 C ATOM 625 CD GLU A 44 0.047 -9.183 -6.531 1.00 0.00 C ATOM 626 OE1 GLU A 44 0.371 -7.959 -6.290 1.00 0.00 O ATOM 627 OE2 GLU A 44 0.210 -9.762 -7.616 1.00 0.00 O ATOM 628 H GLU A 44 0.238 -9.799 -1.342 1.00 0.00 H ATOM 629 HA GLU A 44 -1.871 -8.776 -3.080 1.00 0.00 H ATOM 630 HB2 GLU A 44 0.255 -8.362 -4.131 1.00 0.00 H ATOM 631 HB3 GLU A 44 0.849 -9.963 -3.740 1.00 0.00 H ATOM 632 HG2 GLU A 44 -0.371 -10.996 -5.439 1.00 0.00 H ATOM 633 HG3 GLU A 44 -1.666 -9.815 -5.382 1.00 0.00 H ATOM 634 N HIS A 45 -1.160 -11.778 -2.064 1.00 0.00 N ATOM 635 CA HIS A 45 -1.649 -13.141 -1.947 1.00 0.00 C ATOM 636 C HIS A 45 -2.350 -13.320 -0.599 1.00 0.00 C ATOM 637 O HIS A 45 -1.936 -12.738 0.403 1.00 0.00 O ATOM 638 CB HIS A 45 -0.516 -14.146 -2.163 1.00 0.00 C ATOM 639 CG HIS A 45 -0.363 -14.600 -3.594 1.00 0.00 C ATOM 640 ND1 HIS A 45 0.088 -15.863 -3.936 1.00 0.00 N ATOM 641 CD2 HIS A 45 -0.606 -13.947 -4.768 1.00 0.00 C ATOM 642 CE1 HIS A 45 0.111 -15.955 -5.258 1.00 0.00 C ATOM 643 NE2 HIS A 45 -0.319 -14.767 -5.771 1.00 0.00 N ATOM 644 H HIS A 45 -0.387 -11.554 -1.469 1.00 0.00 H ATOM 645 HA HIS A 45 -2.375 -13.283 -2.746 1.00 0.00 H ATOM 646 HB2 HIS A 45 0.422 -13.698 -1.833 1.00 0.00 H ATOM 647 HB3 HIS A 45 -0.691 -15.018 -1.533 1.00 0.00 H ATOM 648 HD1 HIS A 45 0.350 -16.584 -3.295 1.00 0.00 H ATOM 649 HD2 HIS A 45 -0.974 -12.925 -4.864 1.00 0.00 H ATOM 650 HE1 HIS A 45 0.419 -16.828 -5.834 1.00 0.00 H ATOM 651 N ALA A 46 -3.400 -14.129 -0.616 1.00 0.00 N ATOM 652 CA ALA A 46 -4.162 -14.392 0.592 1.00 0.00 C ATOM 653 C ALA A 46 -4.580 -15.864 0.617 1.00 0.00 C ATOM 654 O ALA A 46 -5.223 -16.346 -0.314 1.00 0.00 O ATOM 655 CB ALA A 46 -5.363 -13.445 0.654 1.00 0.00 C ATOM 656 H ALA A 46 -3.730 -14.598 -1.435 1.00 0.00 H ATOM 657 HA ALA A 46 -3.513 -14.193 1.444 1.00 0.00 H ATOM 658 HB1 ALA A 46 -5.037 -12.430 0.428 1.00 0.00 H ATOM 659 HB2 ALA A 46 -6.111 -13.758 -0.074 1.00 0.00 H ATOM 660 HB3 ALA A 46 -5.796 -13.473 1.655 1.00 0.00 H ATOM 661 N ASP A 47 -4.196 -16.537 1.691 1.00 0.00 N ATOM 662 CA ASP A 47 -4.521 -17.944 1.849 1.00 0.00 C ATOM 663 C ASP A 47 -5.950 -18.190 1.361 1.00 0.00 C ATOM 664 O ASP A 47 -6.799 -17.303 1.442 1.00 0.00 O ATOM 665 CB ASP A 47 -4.444 -18.366 3.318 1.00 0.00 C ATOM 666 CG ASP A 47 -4.760 -19.838 3.585 1.00 0.00 C ATOM 667 OD1 ASP A 47 -5.877 -20.309 3.325 1.00 0.00 O ATOM 668 OD2 ASP A 47 -3.789 -20.522 4.088 1.00 0.00 O ATOM 669 H ASP A 47 -3.673 -16.137 2.444 1.00 0.00 H ATOM 670 HA ASP A 47 -3.780 -18.478 1.255 1.00 0.00 H ATOM 671 HB2 ASP A 47 -3.442 -18.152 3.690 1.00 0.00 H ATOM 672 HB3 ASP A 47 -5.136 -17.752 3.894 1.00 0.00 H