ATOM 56 N LYS A 5 -2.426 16.081 6.144 1.00 0.00 N ATOM 57 CA LYS A 5 -1.394 15.587 7.081 1.00 0.00 C ATOM 58 C LYS A 5 -1.159 14.083 6.864 1.00 0.00 C ATOM 59 O LYS A 5 -2.113 13.304 6.835 1.00 0.00 O ATOM 60 CB LYS A 5 -1.812 15.847 8.561 1.00 0.00 C ATOM 61 CG LYS A 5 -0.813 15.292 9.617 1.00 0.00 C ATOM 62 CD LYS A 5 -1.263 15.515 11.081 1.00 0.00 C ATOM 63 CE LYS A 5 -1.311 16.997 11.476 1.00 0.00 C ATOM 64 NZ LYS A 5 -1.731 17.184 12.887 1.00 0.00 N1+ ATOM 65 H LYS A 5 -3.359 15.852 6.325 1.00 0.00 H ATOM 66 HA LYS A 5 -0.468 16.118 6.882 1.00 0.00 H ATOM 67 HB2 LYS A 5 -1.908 16.920 8.711 1.00 0.00 H ATOM 68 HB3 LYS A 5 -2.781 15.391 8.734 1.00 0.00 H ATOM 69 HG2 LYS A 5 -0.693 14.223 9.457 1.00 0.00 H ATOM 70 HG3 LYS A 5 0.150 15.772 9.468 1.00 0.00 H ATOM 71 HD2 LYS A 5 -2.251 15.090 11.213 1.00 0.00 H ATOM 72 HD3 LYS A 5 -0.570 15.002 11.744 1.00 0.00 H ATOM 73 HE2 LYS A 5 -0.328 17.430 11.352 1.00 0.00 H ATOM 74 HE3 LYS A 5 -2.014 17.514 10.833 1.00 0.00 H ATOM 75 HZ1 LYS A 5 -1.798 18.197 13.109 1.00 0.00 H ATOM 76 HZ2 LYS A 5 -1.038 16.749 13.529 1.00 0.00 H ATOM 77 HZ3 LYS A 5 -2.657 16.742 13.050 1.00 0.00 H ATOM 78 N CYS A 6 0.110 13.683 6.689 1.00 0.00 N ATOM 79 CA CYS A 6 0.500 12.260 6.713 1.00 0.00 C ATOM 80 C CYS A 6 0.491 11.773 8.160 1.00 0.00 C ATOM 81 O CYS A 6 1.261 12.279 8.976 1.00 0.00 O ATOM 82 CB CYS A 6 1.894 12.074 6.106 1.00 0.00 C ATOM 83 SG CYS A 6 2.542 10.379 6.187 1.00 0.00 S ATOM 84 H CYS A 6 0.805 14.359 6.532 1.00 0.00 H ATOM 85 HA CYS A 6 -0.224 11.695 6.131 1.00 0.00 H ATOM 86 HB2 CYS A 6 1.868 12.359 5.068 1.00 0.00 H ATOM 87 HB3 CYS A 6 2.596 12.722 6.623 1.00 0.00 H ATOM 88 N ASN A 7 -0.375 10.792 8.473 1.00 0.00 N ATOM 89 CA ASN A 7 -0.607 10.343 9.860 1.00 0.00 C ATOM 90 C ASN A 7 0.624 9.594 10.428 1.00 0.00 C ATOM 91 O ASN A 7 0.872 9.628 11.641 1.00 0.00 O ATOM 92 CB ASN A 7 -1.886 9.465 9.917 1.00 0.00 C ATOM 93 CG ASN A 7 -2.318 9.094 11.346 1.00 0.00 C ATOM 94 OD1 ASN A 7 -3.064 9.825 11.995 1.00 0.00 O ATOM 95 ND2 ASN A 7 -1.857 7.958 11.844 1.00 0.00 N ATOM 96 H ASN A 7 -0.857 10.341 7.748 1.00 0.00 H ATOM 97 HA ASN A 7 -0.778 11.235 10.459 1.00 0.00 H ATOM 98 HB2 ASN A 7 -2.700 10.003 9.444 1.00 0.00 H ATOM 99 HB3 ASN A 7 -1.713 8.552 9.360 1.00 0.00 H ATOM 100 HD21 ASN A 7 -1.268 7.409 11.284 1.00 0.00 H ATOM 101 HD22 ASN A 7 -2.117 7.716 12.756 1.00 0.00 H ATOM 102 N VAL A 8 1.407 8.932 9.542 1.00 0.00 N ATOM 103 CA VAL A 8 2.654 8.220 9.927 1.00 0.00 C ATOM 104 C VAL A 8 3.717 9.213 10.448 1.00 0.00 C ATOM 105 O VAL A 8 4.299 9.028 11.518 1.00 0.00 O ATOM 106 CB VAL A 8 3.281 7.413 8.722 1.00 0.00 C ATOM 107 CG1 VAL A 8 4.485 6.555 9.182 1.00 0.00 C ATOM 108 CG2 VAL A 8 2.221 6.552 8.004 1.00 0.00 C ATOM 109 H VAL A 8 1.127 8.900 8.602 1.00 0.00 H ATOM 110 HA VAL A 8 2.410 7.515 10.720 1.00 0.00 H ATOM 111 HB VAL A 8 3.662 8.138 7.997 1.00 0.00 H ATOM 112 HG11 VAL A 8 4.919 6.029 8.336 1.00 0.00 H ATOM 113 HG12 VAL A 8 4.158 5.834 9.919 1.00 0.00 H ATOM 114 HG13 VAL A 8 5.239 7.196 9.623 1.00 0.00 H ATOM 115 HG21 VAL A 8 1.825 5.808 8.685 1.00 0.00 H ATOM 116 HG22 VAL A 8 2.660 6.058 7.149 1.00 0.00 H ATOM 117 HG23 VAL A 8 1.410 7.189 7.666 1.00 0.00 H ATOM 118 N CYS A 9 3.931 10.280 9.664 1.00 0.00 N ATOM 119 CA CYS A 9 5.034 11.248 9.890 1.00 0.00 C ATOM 120 C CYS A 9 4.629 12.367 10.862 1.00 0.00 C ATOM 121 O CYS A 9 5.489 12.988 11.499 1.00 0.00 O ATOM 122 CB CYS A 9 5.450 11.871 8.553 1.00 0.00 C ATOM 123 SG CYS A 9 6.165 10.687 7.374 1.00 0.00 S ATOM 124 H CYS A 9 3.296 10.451 8.940 1.00 0.00 H ATOM 125 HA CYS A 9 5.885 10.706 10.300 1.00 0.00 H ATOM 126 HB2 CYS A 9 4.580 12.311 8.079 1.00 0.00 H ATOM 127 HB3 CYS A 9 6.177 12.643 8.729 1.00 0.00 H ATOM 128 N SER A 10 3.315 12.639 10.897 1.00 0.00 N ATOM 129 CA SER A 10 2.669 13.685 11.723 1.00 0.00 C ATOM 130 C SER A 10 2.941 15.101 11.162 1.00 0.00 C ATOM 131 O SER A 10 2.728 16.110 11.845 1.00 0.00 O ATOM 132 CB SER A 10 3.054 13.556 13.225 1.00 0.00 C ATOM 133 OG SER A 10 2.785 12.244 13.700 1.00 0.00 O ATOM 134 H SER A 10 2.737 12.132 10.311 1.00 0.00 H ATOM 135 HA SER A 10 1.597 13.515 11.632 1.00 0.00 H ATOM 136 HB2 SER A 10 4.112 13.762 13.355 1.00 0.00 H ATOM 137 HB3 SER A 10 2.480 14.263 13.812 1.00 0.00 H ATOM 138 HG SER A 10 1.846 12.159 13.894 1.00 0.00 H ATOM 139 N ARG A 11 3.387 15.156 9.883 1.00 0.00 N ATOM 140 CA ARG A 11 3.676 16.412 9.157 1.00 0.00 C ATOM 141 C ARG A 11 2.635 16.632 8.042 1.00 0.00 C ATOM 142 O ARG A 11 1.798 15.760 7.787 1.00 0.00 O ATOM 143 CB ARG A 11 5.097 16.358 8.536 1.00 0.00 C ATOM 144 CG ARG A 11 6.248 16.089 9.528 1.00 0.00 C ATOM 145 CD ARG A 11 7.617 16.111 8.827 1.00 0.00 C ATOM 146 NE ARG A 11 8.727 15.781 9.734 1.00 0.00 N ATOM 147 CZ ARG A 11 10.024 15.910 9.428 1.00 0.00 C ATOM 148 NH1 ARG A 11 10.406 16.506 8.306 1.00 0.00 N1+ ATOM 149 NH2 ARG A 11 10.939 15.459 10.263 1.00 0.00 N ATOM 150 H ARG A 11 3.517 14.314 9.405 1.00 0.00 H ATOM 151 HA ARG A 11 3.623 17.243 9.854 1.00 0.00 H ATOM 152 HB2 ARG A 11 5.115 15.572 7.789 1.00 0.00 H ATOM 153 HB3 ARG A 11 5.294 17.309 8.036 1.00 0.00 H ATOM 154 HG2 ARG A 11 6.235 16.846 10.301 1.00 0.00 H ATOM 155 HG3 ARG A 11 6.102 15.113 9.980 1.00 0.00 H ATOM 156 HD2 ARG A 11 7.611 15.385 8.018 1.00 0.00 H ATOM 157 HD3 ARG A 11 7.784 17.103 8.411 1.00 0.00 H ATOM 158 HE ARG A 11 8.489 15.397 10.608 1.00 0.00 H ATOM 159 HH11 ARG A 11 9.726 16.875 7.670 1.00 0.00 H ATOM 160 HH12 ARG A 11 11.384 16.583 8.086 1.00 0.00 H ATOM 161 HH21 ARG A 11 10.668 15.026 11.124 1.00 0.00 H ATOM 162 HH22 ARG A 11 11.914 15.554 10.040 1.00 0.00 H ATOM 163 N THR A 12 2.753 17.760 7.329 1.00 0.00 N ATOM 164 CA THR A 12 1.816 18.150 6.261 1.00 0.00 C ATOM 165 C THR A 12 2.597 18.532 4.990 1.00 0.00 C ATOM 166 O THR A 12 3.764 18.953 5.066 1.00 0.00 O ATOM 167 CB THR A 12 0.895 19.345 6.716 1.00 0.00 C ATOM 168 OG1 THR A 12 -0.099 19.630 5.714 1.00 0.00 O ATOM 169 CG2 THR A 12 1.708 20.629 6.987 1.00 0.00 C ATOM 170 H THR A 12 3.535 18.331 7.492 1.00 0.00 H ATOM 171 HA THR A 12 1.177 17.295 6.032 1.00 0.00 H ATOM 172 HB THR A 12 0.383 19.058 7.629 1.00 0.00 H ATOM 173 HG1 THR A 12 -0.938 19.226 5.961 1.00 0.00 H ATOM 174 HG21 THR A 12 2.218 20.926 6.079 1.00 0.00 H ATOM 175 HG22 THR A 12 2.442 20.445 7.762 1.00 0.00 H ATOM 176 HG23 THR A 12 1.048 21.426 7.304 1.00 0.00 H ATOM 177 N PHE A 13 1.958 18.361 3.825 1.00 0.00 N ATOM 178 CA PHE A 13 2.477 18.846 2.532 1.00 0.00 C ATOM 179 C PHE A 13 1.579 20.000 2.083 1.00 0.00 C ATOM 180 O PHE A 13 0.359 19.941 2.265 1.00 0.00 O ATOM 181 CB PHE A 13 2.496 17.721 1.456 1.00 0.00 C ATOM 182 CG PHE A 13 3.448 17.973 0.274 1.00 0.00 C ATOM 183 CD1 PHE A 13 3.076 18.784 -0.801 1.00 0.00 C ATOM 184 CD2 PHE A 13 4.715 17.389 0.237 1.00 0.00 C ATOM 185 CE1 PHE A 13 3.932 18.992 -1.869 1.00 0.00 C ATOM 186 CE2 PHE A 13 5.569 17.600 -0.830 1.00 0.00 C ATOM 187 CZ PHE A 13 5.175 18.403 -1.884 1.00 0.00 C ATOM 188 H PHE A 13 1.095 17.904 3.836 1.00 0.00 H ATOM 189 HA PHE A 13 3.490 19.220 2.681 1.00 0.00 H ATOM 190 HB2 PHE A 13 2.787 16.788 1.925 1.00 0.00 H ATOM 191 HB3 PHE A 13 1.494 17.585 1.054 1.00 0.00 H ATOM 192 HD1 PHE A 13 2.099 19.253 -0.798 1.00 0.00 H ATOM 193 HD2 PHE A 13 5.035 16.762 1.061 1.00 0.00 H ATOM 194 HE1 PHE A 13 3.626 19.624 -2.692 1.00 0.00 H ATOM 195 HE2 PHE A 13 6.548 17.138 -0.840 1.00 0.00 H ATOM 196 HZ PHE A 13 5.842 18.562 -2.723 1.00 0.00 H ATOM 197 N PHE A 14 2.186 21.030 1.479 1.00 0.00 N ATOM 198 CA PHE A 14 1.500 22.280 1.084 1.00 0.00 C ATOM 199 C PHE A 14 0.431 22.086 -0.024 1.00 0.00 C ATOM 200 O PHE A 14 -0.303 23.031 -0.348 1.00 0.00 O ATOM 201 CB PHE A 14 2.560 23.337 0.667 1.00 0.00 C ATOM 202 CG PHE A 14 3.620 23.579 1.753 1.00 0.00 C ATOM 203 CD1 PHE A 14 3.411 24.506 2.778 1.00 0.00 C ATOM 204 CD2 PHE A 14 4.816 22.854 1.763 1.00 0.00 C ATOM 205 CE1 PHE A 14 4.363 24.706 3.763 1.00 0.00 C ATOM 206 CE2 PHE A 14 5.761 23.052 2.751 1.00 0.00 C ATOM 207 CZ PHE A 14 5.535 23.978 3.749 1.00 0.00 C ATOM 208 H PHE A 14 3.151 20.983 1.334 1.00 0.00 H ATOM 209 HA PHE A 14 0.991 22.652 1.966 1.00 0.00 H ATOM 210 HB2 PHE A 14 3.062 23.005 -0.236 1.00 0.00 H ATOM 211 HB3 PHE A 14 2.064 24.282 0.462 1.00 0.00 H ATOM 212 HD1 PHE A 14 2.489 25.078 2.798 1.00 0.00 H ATOM 213 HD2 PHE A 14 5.002 22.128 0.981 1.00 0.00 H ATOM 214 HE1 PHE A 14 4.189 25.435 4.544 1.00 0.00 H ATOM 215 HE2 PHE A 14 6.681 22.478 2.744 1.00 0.00 H ATOM 216 HZ PHE A 14 6.278 24.134 4.523 1.00 0.00 H ATOM 217 N SER A 15 0.347 20.869 -0.594 1.00 0.00 N ATOM 218 CA SER A 15 -0.736 20.462 -1.504 1.00 0.00 C ATOM 219 C SER A 15 -1.328 19.112 -1.043 1.00 0.00 C ATOM 220 O SER A 15 -0.606 18.274 -0.472 1.00 0.00 O ATOM 221 CB SER A 15 -0.204 20.355 -2.952 1.00 0.00 C ATOM 222 OG SER A 15 0.854 19.416 -3.046 1.00 0.00 O ATOM 223 H SER A 15 1.051 20.217 -0.430 1.00 0.00 H ATOM 224 HA SER A 15 -1.524 21.208 -1.467 1.00 0.00 H ATOM 225 HB2 SER A 15 -1.000 20.042 -3.617 1.00 0.00 H ATOM 226 HB3 SER A 15 0.165 21.323 -3.275 1.00 0.00 H ATOM 227 HG SER A 15 1.132 19.335 -3.965 1.00 0.00 H ATOM 228 N GLU A 16 -2.655 18.925 -1.268 1.00 0.00 N ATOM 229 CA GLU A 16 -3.321 17.612 -1.108 1.00 0.00 C ATOM 230 C GLU A 16 -2.614 16.562 -1.969 1.00 0.00 C ATOM 231 O GLU A 16 -2.142 15.557 -1.457 1.00 0.00 O ATOM 232 CB GLU A 16 -4.823 17.676 -1.520 1.00 0.00 C ATOM 233 CG GLU A 16 -5.756 18.434 -0.559 1.00 0.00 C ATOM 234 CD GLU A 16 -5.890 17.780 0.827 1.00 0.00 C ATOM 235 OE1 GLU A 16 -6.175 16.565 0.894 1.00 0.00 O ATOM 236 OE2 GLU A 16 -5.762 18.488 1.847 1.00 0.00 O1- ATOM 237 H GLU A 16 -3.200 19.697 -1.525 1.00 0.00 H ATOM 238 HA GLU A 16 -3.249 17.325 -0.063 1.00 0.00 H ATOM 239 HB2 GLU A 16 -4.895 18.154 -2.489 1.00 0.00 H ATOM 240 HB3 GLU A 16 -5.205 16.662 -1.612 1.00 0.00 H ATOM 241 HG2 GLU A 16 -5.376 19.446 -0.443 1.00 0.00 H ATOM 242 HG3 GLU A 16 -6.744 18.492 -1.008 1.00 0.00 H ATOM 243 N ASN A 17 -2.476 16.874 -3.273 1.00 0.00 N ATOM 244 CA ASN A 17 -1.938 15.945 -4.287 1.00 0.00 C ATOM 245 C ASN A 17 -0.486 15.525 -3.967 1.00 0.00 C ATOM 246 O ASN A 17 -0.075 14.409 -4.285 1.00 0.00 O ATOM 247 CB ASN A 17 -2.029 16.607 -5.688 1.00 0.00 C ATOM 248 CG ASN A 17 -1.634 15.684 -6.850 1.00 0.00 C ATOM 249 OD1 ASN A 17 -2.453 14.919 -7.362 1.00 0.00 O ATOM 250 ND2 ASN A 17 -0.383 15.753 -7.283 1.00 0.00 N ATOM 251 H ASN A 17 -2.733 17.773 -3.569 1.00 0.00 H ATOM 252 HA ASN A 17 -2.568 15.061 -4.279 1.00 0.00 H ATOM 253 HB2 ASN A 17 -3.048 16.934 -5.855 1.00 0.00 H ATOM 254 HB3 ASN A 17 -1.382 17.479 -5.711 1.00 0.00 H ATOM 255 HD21 ASN A 17 0.224 16.387 -6.848 1.00 0.00 H ATOM 256 HD22 ASN A 17 -0.115 15.168 -8.019 1.00 0.00 H ATOM 257 N GLY A 18 0.259 16.423 -3.298 1.00 0.00 N ATOM 258 CA GLY A 18 1.647 16.169 -2.919 1.00 0.00 C ATOM 259 C GLY A 18 1.760 15.216 -1.739 1.00 0.00 C ATOM 260 O GLY A 18 2.605 14.317 -1.747 1.00 0.00 O ATOM 261 H GLY A 18 -0.155 17.271 -3.035 1.00 0.00 H ATOM 262 HA2 GLY A 18 2.183 15.756 -3.764 1.00 0.00 H ATOM 263 HA3 GLY A 18 2.109 17.113 -2.655 1.00 0.00 H ATOM 264 N LEU A 19 0.910 15.429 -0.711 1.00 0.00 N ATOM 265 CA LEU A 19 0.830 14.542 0.464 1.00 0.00 C ATOM 266 C LEU A 19 0.348 13.141 0.056 1.00 0.00 C ATOM 267 O LEU A 19 0.907 12.147 0.495 1.00 0.00 O ATOM 268 CB LEU A 19 -0.126 15.169 1.529 1.00 0.00 C ATOM 269 CG LEU A 19 -0.026 14.628 3.001 1.00 0.00 C ATOM 270 CD1 LEU A 19 -0.667 13.231 3.197 1.00 0.00 C ATOM 271 CD2 LEU A 19 1.434 14.659 3.507 1.00 0.00 C ATOM 272 H LEU A 19 0.355 16.238 -0.710 1.00 0.00 H ATOM 273 HA LEU A 19 1.828 14.467 0.892 1.00 0.00 H ATOM 274 HB2 LEU A 19 0.065 16.237 1.557 1.00 0.00 H ATOM 275 HB3 LEU A 19 -1.148 15.034 1.190 1.00 0.00 H ATOM 276 HG LEU A 19 -0.585 15.302 3.637 1.00 0.00 H ATOM 277 HD11 LEU A 19 -0.623 12.951 4.240 1.00 0.00 H ATOM 278 HD12 LEU A 19 -0.136 12.495 2.607 1.00 0.00 H ATOM 279 HD13 LEU A 19 -1.702 13.261 2.882 1.00 0.00 H ATOM 280 HD21 LEU A 19 1.464 14.356 4.548 1.00 0.00 H ATOM 281 HD22 LEU A 19 1.829 15.662 3.421 1.00 0.00 H ATOM 282 HD23 LEU A 19 2.041 13.982 2.921 1.00 0.00 H ATOM 283 N ARG A 20 -0.742 13.102 -0.719 1.00 0.00 N ATOM 284 CA ARG A 20 -1.319 11.857 -1.272 1.00 0.00 C ATOM 285 C ARG A 20 -0.281 11.054 -2.098 1.00 0.00 C ATOM 286 O ARG A 20 -0.271 9.821 -2.067 1.00 0.00 O ATOM 287 CB ARG A 20 -2.576 12.182 -2.098 1.00 0.00 C ATOM 288 CG ARG A 20 -3.689 12.869 -1.269 1.00 0.00 C ATOM 289 CD ARG A 20 -4.961 13.107 -2.082 1.00 0.00 C ATOM 290 NE ARG A 20 -5.899 14.046 -1.422 1.00 0.00 N ATOM 291 CZ ARG A 20 -7.087 14.440 -1.912 1.00 0.00 C ATOM 292 NH1 ARG A 20 -7.581 13.911 -3.036 1.00 0.00 N1+ ATOM 293 NH2 ARG A 20 -7.792 15.357 -1.271 1.00 0.00 N ATOM 294 H ARG A 20 -1.212 13.944 -0.868 1.00 0.00 H ATOM 295 HA ARG A 20 -1.637 11.252 -0.431 1.00 0.00 H ATOM 296 HB2 ARG A 20 -2.299 12.839 -2.919 1.00 0.00 H ATOM 297 HB3 ARG A 20 -2.976 11.258 -2.510 1.00 0.00 H ATOM 298 HG2 ARG A 20 -3.930 12.247 -0.413 1.00 0.00 H ATOM 299 HG3 ARG A 20 -3.317 13.825 -0.912 1.00 0.00 H ATOM 300 HD2 ARG A 20 -4.683 13.512 -3.048 1.00 0.00 H ATOM 301 HD3 ARG A 20 -5.449 12.152 -2.226 1.00 0.00 H ATOM 302 HE ARG A 20 -5.606 14.430 -0.569 1.00 0.00 H ATOM 303 HH11 ARG A 20 -7.071 13.202 -3.528 1.00 0.00 H ATOM 304 HH12 ARG A 20 -8.469 14.221 -3.388 1.00 0.00 H ATOM 305 HH21 ARG A 20 -7.439 15.753 -0.416 1.00 0.00 H ATOM 306 HH22 ARG A 20 -8.676 15.660 -1.637 1.00 0.00 H ATOM 307 N GLU A 21 0.602 11.791 -2.802 1.00 0.00 N ATOM 308 CA GLU A 21 1.734 11.222 -3.563 1.00 0.00 C ATOM 309 C GLU A 21 2.800 10.638 -2.604 1.00 0.00 C ATOM 310 O GLU A 21 3.365 9.564 -2.851 1.00 0.00 O ATOM 311 CB GLU A 21 2.353 12.332 -4.459 1.00 0.00 C ATOM 312 CG GLU A 21 3.474 11.888 -5.424 1.00 0.00 C ATOM 313 CD GLU A 21 3.027 10.866 -6.482 1.00 0.00 C ATOM 314 OE1 GLU A 21 2.021 11.118 -7.182 1.00 0.00 O1- ATOM 315 OE2 GLU A 21 3.675 9.807 -6.619 1.00 0.00 O ATOM 316 H GLU A 21 0.476 12.760 -2.805 1.00 0.00 H ATOM 317 HA GLU A 21 1.344 10.433 -4.193 1.00 0.00 H ATOM 318 HB2 GLU A 21 1.558 12.768 -5.057 1.00 0.00 H ATOM 319 HB3 GLU A 21 2.749 13.110 -3.814 1.00 0.00 H ATOM 320 HG2 GLU A 21 3.850 12.765 -5.939 1.00 0.00 H ATOM 321 HG3 GLU A 21 4.284 11.463 -4.830 1.00 0.00 H ATOM 322 N HIS A 22 3.048 11.375 -1.505 1.00 0.00 N ATOM 323 CA HIS A 22 4.011 11.013 -0.449 1.00 0.00 C ATOM 324 C HIS A 22 3.559 9.754 0.335 1.00 0.00 C ATOM 325 O HIS A 22 4.369 8.894 0.655 1.00 0.00 O ATOM 326 CB HIS A 22 4.207 12.250 0.493 1.00 0.00 C ATOM 327 CG HIS A 22 4.820 11.948 1.836 1.00 0.00 C ATOM 328 ND1 HIS A 22 6.163 11.788 2.059 1.00 0.00 N ATOM 329 CD2 HIS A 22 4.215 11.706 3.027 1.00 0.00 C ATOM 330 CE1 HIS A 22 6.324 11.454 3.342 1.00 0.00 C ATOM 331 NE2 HIS A 22 5.167 11.380 3.980 1.00 0.00 N ATOM 332 H HIS A 22 2.551 12.212 -1.389 1.00 0.00 H ATOM 333 HA HIS A 22 4.957 10.795 -0.934 1.00 0.00 H ATOM 334 HB2 HIS A 22 4.849 12.967 0.003 1.00 0.00 H ATOM 335 HB3 HIS A 22 3.243 12.715 0.668 1.00 0.00 H ATOM 336 HD1 HIS A 22 6.876 11.899 1.394 1.00 0.00 H ATOM 337 HD2 HIS A 22 3.148 11.745 3.215 1.00 0.00 H ATOM 338 HE1 HIS A 22 7.279 11.266 3.806 1.00 0.00 H ATOM 339 N LEU A 23 2.258 9.683 0.639 1.00 0.00 N ATOM 340 CA LEU A 23 1.624 8.614 1.429 1.00 0.00 C ATOM 341 C LEU A 23 1.831 7.227 0.761 1.00 0.00 C ATOM 342 O LEU A 23 1.970 6.206 1.446 1.00 0.00 O ATOM 343 CB LEU A 23 0.117 8.994 1.578 1.00 0.00 C ATOM 344 CG LEU A 23 -0.698 8.373 2.767 1.00 0.00 C ATOM 345 CD1 LEU A 23 -2.033 9.128 2.958 1.00 0.00 C ATOM 346 CD2 LEU A 23 -0.971 6.865 2.584 1.00 0.00 C ATOM 347 H LEU A 23 1.683 10.404 0.347 1.00 0.00 H ATOM 348 HA LEU A 23 2.083 8.610 2.410 1.00 0.00 H ATOM 349 HB2 LEU A 23 0.069 10.076 1.685 1.00 0.00 H ATOM 350 HB3 LEU A 23 -0.384 8.740 0.652 1.00 0.00 H ATOM 351 HG LEU A 23 -0.125 8.497 3.678 1.00 0.00 H ATOM 352 HD11 LEU A 23 -2.648 9.018 2.070 1.00 0.00 H ATOM 353 HD12 LEU A 23 -1.834 10.176 3.122 1.00 0.00 H ATOM 354 HD13 LEU A 23 -2.558 8.726 3.813 1.00 0.00 H ATOM 355 HD21 LEU A 23 -0.033 6.333 2.530 1.00 0.00 H ATOM 356 HD22 LEU A 23 -1.527 6.701 1.667 1.00 0.00 H ATOM 357 HD23 LEU A 23 -1.543 6.493 3.423 1.00 0.00 H ATOM 358 N GLN A 24 1.902 7.237 -0.583 1.00 0.00 N ATOM 359 CA GLN A 24 2.091 6.034 -1.422 1.00 0.00 C ATOM 360 C GLN A 24 3.409 5.272 -1.128 1.00 0.00 C ATOM 361 O GLN A 24 3.516 4.088 -1.461 1.00 0.00 O ATOM 362 CB GLN A 24 2.015 6.444 -2.914 1.00 0.00 C ATOM 363 CG GLN A 24 0.646 7.033 -3.321 1.00 0.00 C ATOM 364 CD GLN A 24 0.580 7.612 -4.735 1.00 0.00 C ATOM 365 OE1 GLN A 24 -0.466 7.563 -5.383 1.00 0.00 O ATOM 366 NE2 GLN A 24 1.666 8.204 -5.208 1.00 0.00 N ATOM 367 H GLN A 24 1.803 8.102 -1.036 1.00 0.00 H ATOM 368 HA GLN A 24 1.262 5.369 -1.210 1.00 0.00 H ATOM 369 HB2 GLN A 24 2.785 7.184 -3.126 1.00 0.00 H ATOM 370 HB3 GLN A 24 2.199 5.573 -3.531 1.00 0.00 H ATOM 371 HG2 GLN A 24 -0.100 6.254 -3.244 1.00 0.00 H ATOM 372 HG3 GLN A 24 0.391 7.825 -2.625 1.00 0.00 H ATOM 373 HE21 GLN A 24 2.462 8.246 -4.641 1.00 0.00 H ATOM 374 HE22 GLN A 24 1.631 8.584 -6.113 1.00 0.00 H ATOM 375 N THR A 25 4.381 5.943 -0.471 1.00 0.00 N ATOM 376 CA THR A 25 5.691 5.353 -0.133 1.00 0.00 C ATOM 377 C THR A 25 5.572 4.462 1.119 1.00 0.00 C ATOM 378 O THR A 25 6.329 3.503 1.282 1.00 0.00 O ATOM 379 CB THR A 25 6.762 6.465 0.100 1.00 0.00 C ATOM 380 OG1 THR A 25 6.417 7.267 1.243 1.00 0.00 O ATOM 381 CG2 THR A 25 6.907 7.370 -1.137 1.00 0.00 C ATOM 382 H THR A 25 4.186 6.847 -0.165 1.00 0.00 H ATOM 383 HA THR A 25 6.017 4.736 -0.969 1.00 0.00 H ATOM 384 HB THR A 25 7.714 5.993 0.290 1.00 0.00 H ATOM 385 HG1 THR A 25 6.346 8.191 0.979 1.00 0.00 H ATOM 386 HG21 THR A 25 7.660 8.130 -0.950 1.00 0.00 H ATOM 387 HG22 THR A 25 5.961 7.854 -1.346 1.00 0.00 H ATOM 388 HG23 THR A 25 7.205 6.778 -1.991 1.00 0.00 H ATOM 389 N HIS A 26 4.572 4.781 1.977 1.00 0.00 N ATOM 390 CA HIS A 26 4.240 3.986 3.181 1.00 0.00 C ATOM 391 C HIS A 26 3.396 2.761 2.793 1.00 0.00 C ATOM 392 O HIS A 26 3.160 1.877 3.615 1.00 0.00 O ATOM 393 CB HIS A 26 3.480 4.840 4.221 1.00 0.00 C ATOM 394 CG HIS A 26 4.247 6.043 4.697 1.00 0.00 C ATOM 395 ND1 HIS A 26 5.271 5.978 5.610 1.00 0.00 N ATOM 396 CD2 HIS A 26 4.114 7.358 4.381 1.00 0.00 C ATOM 397 CE1 HIS A 26 5.710 7.225 5.821 1.00 0.00 C ATOM 398 NE2 HIS A 26 5.037 8.104 5.102 1.00 0.00 N ATOM 399 H HIS A 26 4.017 5.557 1.760 1.00 0.00 H ATOM 400 HA HIS A 26 5.174 3.639 3.618 1.00 0.00 H ATOM 401 HB2 HIS A 26 2.548 5.187 3.786 1.00 0.00 H ATOM 402 HB3 HIS A 26 3.253 4.226 5.091 1.00 0.00 H ATOM 403 HD1 HIS A 26 5.619 5.162 6.033 1.00 0.00 H ATOM 404 HD2 HIS A 26 3.398 7.774 3.682 1.00 0.00 H ATOM 405 HE1 HIS A 26 6.512 7.481 6.495 1.00 0.00 H ATOM 501 N TYR A 33 5.529 -5.407 -10.744 1.00 0.00 N ATOM 502 CA TYR A 33 6.363 -5.822 -11.879 1.00 0.00 C ATOM 503 C TYR A 33 7.816 -5.419 -11.573 1.00 0.00 C ATOM 504 O TYR A 33 8.307 -4.351 -11.935 1.00 0.00 O ATOM 505 CB TYR A 33 5.837 -5.264 -13.246 1.00 0.00 C ATOM 506 CG TYR A 33 5.342 -3.792 -13.245 1.00 0.00 C ATOM 507 CD1 TYR A 33 6.234 -2.712 -13.296 1.00 0.00 C ATOM 508 CD2 TYR A 33 3.980 -3.493 -13.207 1.00 0.00 C ATOM 509 CE1 TYR A 33 5.785 -1.406 -13.309 1.00 0.00 C ATOM 510 CE2 TYR A 33 3.530 -2.185 -13.221 1.00 0.00 C ATOM 511 CZ TYR A 33 4.437 -1.149 -13.271 1.00 0.00 C ATOM 512 OH TYR A 33 3.986 0.151 -13.296 1.00 0.00 O ATOM 513 H TYR A 33 5.792 -4.593 -10.264 1.00 0.00 H ATOM 514 HA TYR A 33 6.334 -6.913 -11.927 1.00 0.00 H ATOM 515 HB2 TYR A 33 6.627 -5.348 -13.985 1.00 0.00 H ATOM 516 HB3 TYR A 33 5.011 -5.895 -13.571 1.00 0.00 H ATOM 517 HD1 TYR A 33 7.300 -2.908 -13.328 1.00 0.00 H ATOM 518 HD2 TYR A 33 3.265 -4.305 -13.168 1.00 0.00 H ATOM 519 HE1 TYR A 33 6.495 -0.593 -13.345 1.00 0.00 H ATOM 520 HE2 TYR A 33 2.467 -1.979 -13.188 1.00 0.00 H ATOM 521 HH TYR A 33 4.470 0.648 -13.963 1.00 0.00 H ATOM 522 N MET A 34 8.470 -6.307 -10.841 1.00 0.00 N ATOM 523 CA MET A 34 9.860 -6.181 -10.414 1.00 0.00 C ATOM 524 C MET A 34 10.541 -7.497 -10.747 1.00 0.00 C ATOM 525 O MET A 34 10.088 -8.556 -10.291 1.00 0.00 O ATOM 526 CB MET A 34 9.932 -5.903 -8.889 1.00 0.00 C ATOM 527 CG MET A 34 11.354 -5.826 -8.303 1.00 0.00 C ATOM 528 SD MET A 34 11.352 -5.644 -6.501 1.00 0.00 S ATOM 529 CE MET A 34 10.604 -7.191 -5.973 1.00 0.00 C ATOM 530 H MET A 34 7.987 -7.107 -10.567 1.00 0.00 H ATOM 531 HA MET A 34 10.336 -5.368 -10.958 1.00 0.00 H ATOM 532 HB2 MET A 34 9.436 -4.959 -8.688 1.00 0.00 H ATOM 533 HB3 MET A 34 9.395 -6.684 -8.363 1.00 0.00 H ATOM 534 HG2 MET A 34 11.893 -6.732 -8.559 1.00 0.00 H ATOM 535 HG3 MET A 34 11.868 -4.976 -8.735 1.00 0.00 H ATOM 536 HE1 MET A 34 10.579 -7.225 -4.894 1.00 0.00 H ATOM 537 HE2 MET A 34 11.183 -8.025 -6.350 1.00 0.00 H ATOM 538 HE3 MET A 34 9.599 -7.250 -6.357 1.00 0.00 H ATOM 539 N CYS A 35 11.601 -7.452 -11.553 1.00 0.00 N ATOM 540 CA CYS A 35 12.309 -8.662 -11.955 1.00 0.00 C ATOM 541 C CYS A 35 13.170 -9.180 -10.785 1.00 0.00 C ATOM 542 O CYS A 35 14.006 -8.430 -10.274 1.00 0.00 O ATOM 543 CB CYS A 35 13.188 -8.375 -13.169 1.00 0.00 C ATOM 544 SG CYS A 35 13.993 -9.872 -13.790 1.00 0.00 S ATOM 545 H CYS A 35 11.935 -6.586 -11.874 1.00 0.00 H ATOM 546 HA CYS A 35 11.568 -9.410 -12.233 1.00 0.00 H ATOM 547 HB2 CYS A 35 12.604 -7.944 -13.954 1.00 0.00 H ATOM 548 HB3 CYS A 35 13.955 -7.671 -12.896 1.00 0.00 H ATOM 549 N PRO A 36 12.971 -10.458 -10.325 1.00 0.00 N ATOM 550 CA PRO A 36 13.736 -11.037 -9.185 1.00 0.00 C ATOM 551 C PRO A 36 15.276 -11.009 -9.380 1.00 0.00 C ATOM 552 O PRO A 36 16.015 -10.793 -8.414 1.00 0.00 O ATOM 553 CB PRO A 36 13.195 -12.489 -9.087 1.00 0.00 C ATOM 554 CG PRO A 36 11.837 -12.423 -9.712 1.00 0.00 C ATOM 555 CD PRO A 36 11.961 -11.426 -10.840 1.00 0.00 C ATOM 556 HA PRO A 36 13.503 -10.505 -8.268 1.00 0.00 H ATOM 557 HB2 PRO A 36 13.846 -13.173 -9.631 1.00 0.00 H ATOM 558 HB3 PRO A 36 13.143 -12.797 -8.048 1.00 0.00 H ATOM 559 HG2 PRO A 36 11.551 -13.398 -10.098 1.00 0.00 H ATOM 560 HG3 PRO A 36 11.107 -12.084 -8.983 1.00 0.00 H ATOM 561 HD2 PRO A 36 12.319 -11.906 -11.745 1.00 0.00 H ATOM 562 HD3 PRO A 36 11.011 -10.934 -11.024 1.00 0.00 H ATOM 563 N ILE A 37 15.749 -11.232 -10.628 1.00 0.00 N ATOM 564 CA ILE A 37 17.188 -11.233 -10.927 1.00 0.00 C ATOM 565 C ILE A 37 17.752 -9.807 -11.173 1.00 0.00 C ATOM 566 O ILE A 37 18.688 -9.389 -10.487 1.00 0.00 O ATOM 567 CB ILE A 37 17.442 -12.115 -12.207 1.00 0.00 C ATOM 568 CG1 ILE A 37 16.977 -13.590 -11.964 1.00 0.00 C ATOM 569 CG2 ILE A 37 18.924 -12.066 -12.657 1.00 0.00 C ATOM 570 CD1 ILE A 37 17.100 -14.501 -13.176 1.00 0.00 C ATOM 571 H ILE A 37 15.132 -11.470 -11.343 1.00 0.00 H ATOM 572 HA ILE A 37 17.716 -11.689 -10.092 1.00 0.00 H ATOM 573 HB ILE A 37 16.842 -11.695 -13.015 1.00 0.00 H ATOM 574 HG12 ILE A 37 17.575 -14.029 -11.178 1.00 0.00 H ATOM 575 HG13 ILE A 37 15.937 -13.593 -11.656 1.00 0.00 H ATOM 576 HG21 ILE A 37 19.198 -11.047 -12.886 1.00 0.00 H ATOM 577 HG22 ILE A 37 19.057 -12.678 -13.539 1.00 0.00 H ATOM 578 HG23 ILE A 37 19.554 -12.435 -11.864 1.00 0.00 H ATOM 579 HD11 ILE A 37 18.134 -14.554 -13.490 1.00 0.00 H ATOM 580 HD12 ILE A 37 16.496 -14.119 -13.990 1.00 0.00 H ATOM 581 HD13 ILE A 37 16.757 -15.493 -12.917 1.00 0.00 H ATOM 582 N CYS A 38 17.169 -9.054 -12.135 1.00 0.00 N ATOM 583 CA CYS A 38 17.781 -7.790 -12.615 1.00 0.00 C ATOM 584 C CYS A 38 16.897 -6.545 -12.417 1.00 0.00 C ATOM 585 O CYS A 38 17.313 -5.441 -12.783 1.00 0.00 O ATOM 586 CB CYS A 38 18.203 -7.971 -14.091 1.00 0.00 C ATOM 587 SG CYS A 38 16.876 -7.841 -15.333 1.00 0.00 S ATOM 588 H CYS A 38 16.401 -9.410 -12.601 1.00 0.00 H ATOM 589 HA CYS A 38 18.689 -7.622 -12.035 1.00 0.00 H ATOM 590 HB2 CYS A 38 18.924 -7.224 -14.338 1.00 0.00 H ATOM 591 HB3 CYS A 38 18.669 -8.944 -14.204 1.00 0.00 H ATOM 592 N GLY A 39 15.691 -6.720 -11.845 1.00 0.00 N ATOM 593 CA GLY A 39 14.831 -5.613 -11.386 1.00 0.00 C ATOM 594 C GLY A 39 14.351 -4.627 -12.451 1.00 0.00 C ATOM 595 O GLY A 39 14.054 -3.469 -12.133 1.00 0.00 O ATOM 596 H GLY A 39 15.352 -7.621 -11.712 1.00 0.00 H ATOM 597 HA2 GLY A 39 13.944 -6.063 -10.950 1.00 0.00 H ATOM 598 HA3 GLY A 39 15.355 -5.071 -10.608 1.00 0.00 H ATOM 599 N GLU A 40 14.298 -5.079 -13.710 1.00 0.00 N ATOM 600 CA GLU A 40 13.692 -4.300 -14.804 1.00 0.00 C ATOM 601 C GLU A 40 12.169 -4.098 -14.598 1.00 0.00 C ATOM 602 O GLU A 40 11.450 -5.031 -14.208 1.00 0.00 O ATOM 603 CB GLU A 40 14.002 -4.966 -16.163 1.00 0.00 C ATOM 604 CG GLU A 40 15.489 -4.886 -16.573 1.00 0.00 C ATOM 605 CD GLU A 40 15.741 -5.333 -18.018 1.00 0.00 C ATOM 606 OE1 GLU A 40 15.477 -4.537 -18.945 1.00 0.00 O1- ATOM 607 OE2 GLU A 40 16.189 -6.469 -18.233 1.00 0.00 O ATOM 608 H GLU A 40 14.749 -5.909 -13.922 1.00 0.00 H ATOM 609 HA GLU A 40 14.167 -3.325 -14.789 1.00 0.00 H ATOM 610 HB2 GLU A 40 13.713 -6.014 -16.116 1.00 0.00 H ATOM 611 HB3 GLU A 40 13.412 -4.487 -16.934 1.00 0.00 H ATOM 612 HG2 GLU A 40 15.831 -3.857 -16.468 1.00 0.00 H ATOM 613 HG3 GLU A 40 16.070 -5.511 -15.896 1.00 0.00 H ATOM 614 N ARG A 41 11.721 -2.850 -14.830 1.00 0.00 N ATOM 615 CA ARG A 41 10.312 -2.431 -14.726 1.00 0.00 C ATOM 616 C ARG A 41 9.645 -2.491 -16.109 1.00 0.00 C ATOM 617 O ARG A 41 10.243 -2.087 -17.111 1.00 0.00 O ATOM 618 CB ARG A 41 10.248 -0.984 -14.177 1.00 0.00 C ATOM 619 CG ARG A 41 10.783 -0.816 -12.739 1.00 0.00 C ATOM 620 CD ARG A 41 10.938 0.661 -12.325 1.00 0.00 C ATOM 621 NE ARG A 41 9.687 1.436 -12.467 1.00 0.00 N ATOM 622 CZ ARG A 41 9.381 2.549 -11.783 1.00 0.00 C ATOM 623 NH1 ARG A 41 10.175 3.000 -10.817 1.00 0.00 N1+ ATOM 624 NH2 ARG A 41 8.269 3.198 -12.059 1.00 0.00 N ATOM 625 H ARG A 41 12.380 -2.169 -15.088 1.00 0.00 H ATOM 626 HA ARG A 41 9.792 -3.102 -14.040 1.00 0.00 H ATOM 627 HB2 ARG A 41 10.829 -0.338 -14.829 1.00 0.00 H ATOM 628 HB3 ARG A 41 9.215 -0.646 -14.191 1.00 0.00 H ATOM 629 HG2 ARG A 41 10.098 -1.301 -12.048 1.00 0.00 H ATOM 630 HG3 ARG A 41 11.752 -1.304 -12.665 1.00 0.00 H ATOM 631 HD2 ARG A 41 11.262 0.698 -11.287 1.00 0.00 H ATOM 632 HD3 ARG A 41 11.700 1.116 -12.943 1.00 0.00 H ATOM 633 HE ARG A 41 9.053 1.124 -13.147 1.00 0.00 H ATOM 634 HH11 ARG A 41 11.024 2.514 -10.591 1.00 0.00 H ATOM 635 HH12 ARG A 41 9.933 3.834 -10.312 1.00 0.00 H ATOM 636 HH21 ARG A 41 7.656 2.868 -12.783 1.00 0.00 H ATOM 637 HH22 ARG A 41 8.028 4.033 -11.555 1.00 0.00 H ATOM 638 N PHE A 42 8.402 -3.003 -16.154 1.00 0.00 N ATOM 639 CA PHE A 42 7.652 -3.215 -17.412 1.00 0.00 C ATOM 640 C PHE A 42 6.289 -2.498 -17.378 1.00 0.00 C ATOM 641 O PHE A 42 5.790 -2.198 -16.301 1.00 0.00 O ATOM 642 CB PHE A 42 7.502 -4.743 -17.637 1.00 0.00 C ATOM 643 CG PHE A 42 8.832 -5.401 -17.974 1.00 0.00 C ATOM 644 CD1 PHE A 42 9.662 -5.893 -16.979 1.00 0.00 C ATOM 645 CD2 PHE A 42 9.269 -5.477 -19.293 1.00 0.00 C ATOM 646 CE1 PHE A 42 10.884 -6.441 -17.284 1.00 0.00 C ATOM 647 CE2 PHE A 42 10.488 -6.032 -19.597 1.00 0.00 C ATOM 648 CZ PHE A 42 11.295 -6.510 -18.594 1.00 0.00 C ATOM 649 H PHE A 42 7.988 -3.295 -15.313 1.00 0.00 H ATOM 650 HA PHE A 42 8.228 -2.795 -18.235 1.00 0.00 H ATOM 651 HB2 PHE A 42 7.103 -5.209 -16.742 1.00 0.00 H ATOM 652 HB3 PHE A 42 6.816 -4.925 -18.459 1.00 0.00 H ATOM 653 HD1 PHE A 42 9.338 -5.839 -15.944 1.00 0.00 H ATOM 654 HD2 PHE A 42 8.637 -5.099 -20.088 1.00 0.00 H ATOM 655 HE1 PHE A 42 11.521 -6.822 -16.494 1.00 0.00 H ATOM 656 HE2 PHE A 42 10.815 -6.087 -20.626 1.00 0.00 H ATOM 657 HZ PHE A 42 12.257 -6.947 -18.833 1.00 0.00 H ATOM 658 N PRO A 43 5.665 -2.186 -18.566 1.00 0.00 N ATOM 659 CA PRO A 43 4.350 -1.486 -18.622 1.00 0.00 C ATOM 660 C PRO A 43 3.201 -2.309 -17.993 1.00 0.00 C ATOM 661 O PRO A 43 2.128 -1.766 -17.712 1.00 0.00 O ATOM 662 CB PRO A 43 4.122 -1.266 -20.145 1.00 0.00 C ATOM 663 CG PRO A 43 4.943 -2.335 -20.800 1.00 0.00 C ATOM 664 CD PRO A 43 6.178 -2.465 -19.940 1.00 0.00 C ATOM 665 HA PRO A 43 4.404 -0.529 -18.117 1.00 0.00 H ATOM 666 HB2 PRO A 43 3.067 -1.363 -20.394 1.00 0.00 H ATOM 667 HB3 PRO A 43 4.462 -0.275 -20.430 1.00 0.00 H ATOM 668 HG2 PRO A 43 4.389 -3.272 -20.817 1.00 0.00 H ATOM 669 HG3 PRO A 43 5.208 -2.043 -21.811 1.00 0.00 H ATOM 670 HD2 PRO A 43 6.585 -3.467 -20.005 1.00 0.00 H ATOM 671 HD3 PRO A 43 6.930 -1.734 -20.221 1.00 0.00 H ATOM 672 N SER A 44 3.448 -3.614 -17.768 1.00 0.00 N ATOM 673 CA SER A 44 2.462 -4.541 -17.204 1.00 0.00 C ATOM 674 C SER A 44 3.143 -5.678 -16.446 1.00 0.00 C ATOM 675 O SER A 44 4.367 -5.841 -16.499 1.00 0.00 O ATOM 676 CB SER A 44 1.603 -5.131 -18.343 1.00 0.00 C ATOM 677 OG SER A 44 2.416 -5.701 -19.363 1.00 0.00 O ATOM 678 H SER A 44 4.333 -3.968 -18.000 1.00 0.00 H ATOM 679 HA SER A 44 1.822 -3.995 -16.516 1.00 0.00 H ATOM 680 HB2 SER A 44 0.951 -5.905 -17.953 1.00 0.00 H ATOM 681 HB3 SER A 44 0.999 -4.353 -18.776 1.00 0.00 H ATOM 682 HG SER A 44 2.044 -5.477 -20.226 1.00 0.00 H ATOM 683 N LEU A 45 2.312 -6.485 -15.769 1.00 0.00 N ATOM 684 CA LEU A 45 2.718 -7.784 -15.209 1.00 0.00 C ATOM 685 C LEU A 45 2.333 -8.876 -16.236 1.00 0.00 C ATOM 686 O LEU A 45 1.600 -9.826 -15.956 1.00 0.00 O ATOM 687 CB LEU A 45 2.069 -8.002 -13.807 1.00 0.00 C ATOM 688 CG LEU A 45 2.434 -9.339 -13.072 1.00 0.00 C ATOM 689 CD1 LEU A 45 3.964 -9.532 -12.979 1.00 0.00 C ATOM 690 CD2 LEU A 45 1.781 -9.410 -11.670 1.00 0.00 C ATOM 691 H LEU A 45 1.379 -6.202 -15.658 1.00 0.00 H ATOM 692 HA LEU A 45 3.809 -7.787 -15.098 1.00 0.00 H ATOM 693 HB2 LEU A 45 2.365 -7.171 -13.173 1.00 0.00 H ATOM 694 HB3 LEU A 45 0.991 -7.963 -13.925 1.00 0.00 H ATOM 695 HG LEU A 45 2.043 -10.174 -13.653 1.00 0.00 H ATOM 696 HD11 LEU A 45 4.179 -10.464 -12.478 1.00 0.00 H ATOM 697 HD12 LEU A 45 4.406 -8.715 -12.419 1.00 0.00 H ATOM 698 HD13 LEU A 45 4.393 -9.558 -13.973 1.00 0.00 H ATOM 699 HD21 LEU A 45 2.008 -10.365 -11.213 1.00 0.00 H ATOM 700 HD22 LEU A 45 0.707 -9.308 -11.754 1.00 0.00 H ATOM 701 HD23 LEU A 45 2.167 -8.613 -11.044 1.00 0.00 H ATOM 702 N LEU A 46 2.822 -8.672 -17.463 1.00 0.00 N ATOM 703 CA LEU A 46 2.614 -9.576 -18.605 1.00 0.00 C ATOM 704 C LEU A 46 3.959 -9.689 -19.322 1.00 0.00 C ATOM 705 O LEU A 46 4.506 -10.778 -19.484 1.00 0.00 O ATOM 706 CB LEU A 46 1.526 -9.014 -19.575 1.00 0.00 C ATOM 707 CG LEU A 46 0.077 -8.846 -18.996 1.00 0.00 C ATOM 708 CD1 LEU A 46 -0.849 -8.114 -19.995 1.00 0.00 C ATOM 709 CD2 LEU A 46 -0.523 -10.214 -18.593 1.00 0.00 C ATOM 710 H LEU A 46 3.393 -7.890 -17.599 1.00 0.00 H ATOM 711 HA LEU A 46 2.308 -10.553 -18.237 1.00 0.00 H ATOM 712 HB2 LEU A 46 1.865 -8.044 -19.930 1.00 0.00 H ATOM 713 HB3 LEU A 46 1.468 -9.680 -20.437 1.00 0.00 H ATOM 714 HG LEU A 46 0.131 -8.235 -18.100 1.00 0.00 H ATOM 715 HD11 LEU A 46 -0.920 -8.684 -20.912 1.00 0.00 H ATOM 716 HD12 LEU A 46 -0.447 -7.133 -20.215 1.00 0.00 H ATOM 717 HD13 LEU A 46 -1.835 -8.002 -19.564 1.00 0.00 H ATOM 718 HD21 LEU A 46 -1.513 -10.070 -18.185 1.00 0.00 H ATOM 719 HD22 LEU A 46 0.103 -10.684 -17.842 1.00 0.00 H ATOM 720 HD23 LEU A 46 -0.583 -10.862 -19.460 1.00 0.00 H ATOM 721 N THR A 47 4.495 -8.508 -19.684 1.00 0.00 N ATOM 722 CA THR A 47 5.856 -8.340 -20.227 1.00 0.00 C ATOM 723 C THR A 47 6.935 -8.807 -19.221 1.00 0.00 C ATOM 724 O THR A 47 7.954 -9.363 -19.624 1.00 0.00 O ATOM 725 CB THR A 47 6.101 -6.837 -20.644 1.00 0.00 C ATOM 726 OG1 THR A 47 5.407 -5.968 -19.725 1.00 0.00 O ATOM 727 CG2 THR A 47 5.648 -6.530 -22.082 1.00 0.00 C ATOM 728 H THR A 47 3.920 -7.716 -19.617 1.00 0.00 H ATOM 729 HA THR A 47 5.933 -8.964 -21.114 1.00 0.00 H ATOM 730 HB THR A 47 7.165 -6.619 -20.571 1.00 0.00 H ATOM 731 HG1 THR A 47 4.511 -5.824 -20.036 1.00 0.00 H ATOM 732 HG21 THR A 47 5.854 -5.495 -22.316 1.00 0.00 H ATOM 733 HG22 THR A 47 4.589 -6.715 -22.178 1.00 0.00 H ATOM 734 HG23 THR A 47 6.185 -7.170 -22.775 1.00 0.00 H ATOM 735 N LEU A 48 6.686 -8.571 -17.916 1.00 0.00 N ATOM 736 CA LEU A 48 7.582 -9.012 -16.826 1.00 0.00 C ATOM 737 C LEU A 48 7.603 -10.552 -16.727 1.00 0.00 C ATOM 738 O LEU A 48 8.663 -11.144 -16.490 1.00 0.00 O ATOM 739 CB LEU A 48 7.142 -8.314 -15.489 1.00 0.00 C ATOM 740 CG LEU A 48 8.027 -8.512 -14.181 1.00 0.00 C ATOM 741 CD1 LEU A 48 7.704 -9.825 -13.431 1.00 0.00 C ATOM 742 CD2 LEU A 48 9.540 -8.419 -14.482 1.00 0.00 C ATOM 743 H LEU A 48 5.879 -8.066 -17.678 1.00 0.00 H ATOM 744 HA LEU A 48 8.583 -8.677 -17.079 1.00 0.00 H ATOM 745 HB2 LEU A 48 7.091 -7.246 -15.686 1.00 0.00 H ATOM 746 HB3 LEU A 48 6.132 -8.646 -15.266 1.00 0.00 H ATOM 747 HG LEU A 48 7.794 -7.708 -13.492 1.00 0.00 H ATOM 748 HD11 LEU A 48 6.658 -9.834 -13.158 1.00 0.00 H ATOM 749 HD12 LEU A 48 8.303 -9.893 -12.532 1.00 0.00 H ATOM 750 HD13 LEU A 48 7.913 -10.675 -14.069 1.00 0.00 H ATOM 751 HD21 LEU A 48 9.830 -9.208 -15.168 1.00 0.00 H ATOM 752 HD22 LEU A 48 10.102 -8.519 -13.564 1.00 0.00 H ATOM 753 HD23 LEU A 48 9.764 -7.460 -14.926 1.00 0.00 H ATOM 754 N THR A 49 6.436 -11.184 -16.948 1.00 0.00 N ATOM 755 CA THR A 49 6.278 -12.652 -16.882 1.00 0.00 C ATOM 756 C THR A 49 7.073 -13.336 -18.020 1.00 0.00 C ATOM 757 O THR A 49 7.818 -14.305 -17.801 1.00 0.00 O ATOM 758 CB THR A 49 4.764 -13.054 -16.982 1.00 0.00 C ATOM 759 OG1 THR A 49 3.986 -12.250 -16.073 1.00 0.00 O ATOM 760 CG2 THR A 49 4.548 -14.548 -16.663 1.00 0.00 C ATOM 761 H THR A 49 5.649 -10.647 -17.176 1.00 0.00 H ATOM 762 HA THR A 49 6.660 -12.988 -15.925 1.00 0.00 H ATOM 763 HB THR A 49 4.415 -12.859 -17.993 1.00 0.00 H ATOM 764 HG1 THR A 49 3.083 -12.585 -16.036 1.00 0.00 H ATOM 765 HG21 THR A 49 3.495 -14.791 -16.752 1.00 0.00 H ATOM 766 HG22 THR A 49 4.874 -14.762 -15.655 1.00 0.00 H ATOM 767 HG23 THR A 49 5.117 -15.155 -17.358 1.00 0.00 H ATOM 768 N GLU A 50 6.895 -12.781 -19.230 1.00 0.00 N ATOM 769 CA GLU A 50 7.582 -13.227 -20.456 1.00 0.00 C ATOM 770 C GLU A 50 9.108 -13.110 -20.307 1.00 0.00 C ATOM 771 O GLU A 50 9.841 -14.065 -20.580 1.00 0.00 O ATOM 772 CB GLU A 50 7.071 -12.388 -21.654 1.00 0.00 C ATOM 773 CG GLU A 50 5.565 -12.574 -21.938 1.00 0.00 C ATOM 774 CD GLU A 50 5.015 -11.600 -22.985 1.00 0.00 C ATOM 775 OE1 GLU A 50 5.304 -11.779 -24.180 1.00 0.00 O ATOM 776 OE2 GLU A 50 4.287 -10.656 -22.620 1.00 0.00 O1- ATOM 777 H GLU A 50 6.238 -12.049 -19.293 1.00 0.00 H ATOM 778 HA GLU A 50 7.319 -14.269 -20.624 1.00 0.00 H ATOM 779 HB2 GLU A 50 7.256 -11.337 -21.447 1.00 0.00 H ATOM 780 HB3 GLU A 50 7.623 -12.671 -22.544 1.00 0.00 H ATOM 781 HG2 GLU A 50 5.397 -13.589 -22.290 1.00 0.00 H ATOM 782 HG3 GLU A 50 5.020 -12.441 -21.005 1.00 0.00 H ATOM 783 N HIS A 51 9.551 -11.942 -19.821 1.00 0.00 N ATOM 784 CA HIS A 51 10.976 -11.626 -19.600 1.00 0.00 C ATOM 785 C HIS A 51 11.618 -12.554 -18.537 1.00 0.00 C ATOM 786 O HIS A 51 12.796 -12.927 -18.656 1.00 0.00 O ATOM 787 CB HIS A 51 11.093 -10.134 -19.182 1.00 0.00 C ATOM 788 CG HIS A 51 12.426 -9.728 -18.606 1.00 0.00 C ATOM 789 ND1 HIS A 51 13.531 -9.434 -19.359 1.00 0.00 N ATOM 790 CD2 HIS A 51 12.802 -9.572 -17.309 1.00 0.00 C ATOM 791 CE1 HIS A 51 14.522 -9.127 -18.519 1.00 0.00 C ATOM 792 NE2 HIS A 51 14.130 -9.196 -17.250 1.00 0.00 N ATOM 793 H HIS A 51 8.888 -11.255 -19.588 1.00 0.00 H ATOM 794 HA HIS A 51 11.496 -11.766 -20.545 1.00 0.00 H ATOM 795 HB2 HIS A 51 10.911 -9.509 -20.049 1.00 0.00 H ATOM 796 HB3 HIS A 51 10.331 -9.916 -18.439 1.00 0.00 H ATOM 797 HD1 HIS A 51 13.584 -9.453 -20.341 1.00 0.00 H ATOM 798 HD2 HIS A 51 12.168 -9.717 -16.447 1.00 0.00 H ATOM 799 HE1 HIS A 51 15.514 -8.835 -18.836 1.00 0.00 H ATOM 800 N LYS A 52 10.825 -12.895 -17.502 1.00 0.00 N ATOM 801 CA LYS A 52 11.282 -13.667 -16.333 1.00 0.00 C ATOM 802 C LYS A 52 11.776 -15.063 -16.772 1.00 0.00 C ATOM 803 O LYS A 52 12.886 -15.476 -16.422 1.00 0.00 O ATOM 804 CB LYS A 52 10.119 -13.753 -15.276 1.00 0.00 C ATOM 805 CG LYS A 52 10.522 -14.104 -13.804 1.00 0.00 C ATOM 806 CD LYS A 52 10.873 -15.601 -13.567 1.00 0.00 C ATOM 807 CE LYS A 52 9.682 -16.548 -13.807 1.00 0.00 C ATOM 808 NZ LYS A 52 8.598 -16.345 -12.825 1.00 0.00 N1+ ATOM 809 H LYS A 52 9.885 -12.613 -17.531 1.00 0.00 H ATOM 810 HA LYS A 52 12.113 -13.127 -15.888 1.00 0.00 H ATOM 811 HB2 LYS A 52 9.626 -12.784 -15.246 1.00 0.00 H ATOM 812 HB3 LYS A 52 9.389 -14.485 -15.617 1.00 0.00 H ATOM 813 HG2 LYS A 52 11.384 -13.502 -13.539 1.00 0.00 H ATOM 814 HG3 LYS A 52 9.699 -13.831 -13.145 1.00 0.00 H ATOM 815 HD2 LYS A 52 11.676 -15.883 -14.243 1.00 0.00 H ATOM 816 HD3 LYS A 52 11.219 -15.724 -12.543 1.00 0.00 H ATOM 817 HE2 LYS A 52 9.282 -16.384 -14.800 1.00 0.00 H ATOM 818 HE3 LYS A 52 10.024 -17.574 -13.733 1.00 0.00 H ATOM 819 HZ1 LYS A 52 8.317 -15.347 -12.803 1.00 0.00 H ATOM 820 HZ2 LYS A 52 8.918 -16.629 -11.876 1.00 0.00 H ATOM 821 HZ3 LYS A 52 7.775 -16.920 -13.086 1.00 0.00 H ATOM 822 N VAL A 53 10.961 -15.768 -17.564 1.00 0.00 N ATOM 823 CA VAL A 53 11.230 -17.166 -17.944 1.00 0.00 C ATOM 824 C VAL A 53 12.296 -17.279 -19.067 1.00 0.00 C ATOM 825 O VAL A 53 13.156 -18.169 -19.028 1.00 0.00 O ATOM 826 CB VAL A 53 9.895 -17.888 -18.361 1.00 0.00 C ATOM 827 CG1 VAL A 53 8.937 -18.017 -17.155 1.00 0.00 C ATOM 828 CG2 VAL A 53 9.182 -17.161 -19.526 1.00 0.00 C ATOM 829 H VAL A 53 10.164 -15.338 -17.935 1.00 0.00 H ATOM 830 HA VAL A 53 11.622 -17.676 -17.065 1.00 0.00 H ATOM 831 HB VAL A 53 10.151 -18.890 -18.691 1.00 0.00 H ATOM 832 HG11 VAL A 53 8.689 -17.034 -16.775 1.00 0.00 H ATOM 833 HG12 VAL A 53 9.410 -18.592 -16.369 1.00 0.00 H ATOM 834 HG13 VAL A 53 8.027 -18.522 -17.460 1.00 0.00 H ATOM 835 HG21 VAL A 53 8.922 -16.151 -19.222 1.00 0.00 H ATOM 836 HG22 VAL A 53 8.282 -17.692 -19.798 1.00 0.00 H ATOM 837 HG23 VAL A 53 9.839 -17.117 -20.387 1.00 0.00 H ATOM 838 N THR A 54 12.238 -16.365 -20.051 1.00 0.00 N ATOM 839 CA THR A 54 13.146 -16.354 -21.225 1.00 0.00 C ATOM 840 C THR A 54 14.405 -15.512 -20.943 1.00 0.00 C ATOM 841 O THR A 54 14.945 -14.866 -21.858 1.00 0.00 O ATOM 842 CB THR A 54 12.398 -15.821 -22.494 1.00 0.00 C ATOM 843 OG1 THR A 54 11.972 -14.470 -22.276 1.00 0.00 O ATOM 844 CG2 THR A 54 11.176 -16.682 -22.858 1.00 0.00 C ATOM 845 H THR A 54 11.543 -15.676 -19.997 1.00 0.00 H ATOM 846 HA THR A 54 13.463 -17.373 -21.422 1.00 0.00 H ATOM 847 HB THR A 54 13.089 -15.825 -23.337 1.00 0.00 H ATOM 848 HG1 THR A 54 11.005 -14.445 -22.222 1.00 0.00 H ATOM 849 HG21 THR A 54 11.481 -17.702 -23.047 1.00 0.00 H ATOM 850 HG22 THR A 54 10.701 -16.283 -23.747 1.00 0.00 H ATOM 851 HG23 THR A 54 10.465 -16.666 -22.041 1.00 0.00 H ATOM 852 N HIS A 55 14.895 -15.566 -19.681 1.00 0.00 N ATOM 853 CA HIS A 55 15.820 -14.563 -19.131 1.00 0.00 C ATOM 854 C HIS A 55 17.196 -14.647 -19.845 1.00 0.00 C ATOM 855 O HIS A 55 18.012 -15.517 -19.485 1.00 0.00 O ATOM 856 CB HIS A 55 15.990 -14.756 -17.595 1.00 0.00 C ATOM 857 CG HIS A 55 16.351 -13.486 -16.883 1.00 0.00 C ATOM 858 ND1 HIS A 55 17.621 -12.957 -16.785 1.00 0.00 N ATOM 859 CD2 HIS A 55 15.537 -12.590 -16.299 1.00 0.00 C ATOM 860 CE1 HIS A 55 17.519 -11.768 -16.162 1.00 0.00 C ATOM 861 NE2 HIS A 55 16.262 -11.500 -15.849 1.00 0.00 N ATOM 862 OXT HIS A 55 17.453 -13.843 -20.757 1.00 0.00 O ATOM 863 H HIS A 55 14.727 -16.372 -19.154 1.00 0.00 H ATOM 864 HA HIS A 55 15.373 -13.581 -19.316 1.00 0.00 H ATOM 865 HB2 HIS A 55 15.062 -15.116 -17.173 1.00 0.00 H ATOM 866 HB3 HIS A 55 16.770 -15.481 -17.400 1.00 0.00 H ATOM 867 HD1 HIS A 55 18.444 -13.371 -17.113 1.00 0.00 H ATOM 868 HD2 HIS A 55 14.464 -12.693 -16.197 1.00 0.00 H ATOM 869 HE1 HIS A 55 18.350 -11.118 -15.949 1.00 0.00 H