USER MOD reduce.3.24.130724 H: found=0, std=0, add=417, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 417 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: C 361 HIS HD1 : C 361 HIS ND1 : C 900 ZNZN :(H bumps) USER MOD Single : C 330 THR OG1 : rot 180:sc= 0.0471 USER MOD Single : C 337 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 338 ASN : amide:sc= -4.45! C(o=-4.4!,f=-14!) USER MOD Single : C 347 SER OG : rot 180:sc= 0 USER MOD Single : C 348 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 349 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.22) USER MOD Single : C 353 LYS NZ :NH3+ 164:sc= -0.125 (180deg=-0.538) USER MOD Single : C 358 HIS : no HE2:sc= -0.761 K(o=-0.76,f=-11!) USER MOD Single : C 362 ASN : amide:sc= -1.1 K(o=-1.1,f=-0.31) USER MOD Single : C 363 SER OG : rot 180:sc= 0 USER MOD Single : C 367 SER OG : rot 180:sc= 0 USER MOD Single : C 371 GLN : amide:sc= -0.0101 K(o=-0.01,f=-1.8!) USER MOD Single : C 373 THR OG1 : rot 180:sc= 0.0309 USER MOD Single : C 374 SER OG : rot 180:sc= 0 USER MOD Single : C 377 THR OG1 : rot 180:sc= 0 USER MOD Single : C 380 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 381 SER OG : rot -155:sc= -1.11 USER MOD Single : C 383 ASN : amide:sc= -1.8 K(o=-1.8,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA C 327 15.810 1.026 -16.743 1.00 0.00 N ATOM 2 CA ALA C 327 16.857 0.161 -17.355 1.00 0.00 C ATOM 3 C ALA C 327 17.188 -0.974 -16.396 1.00 0.00 C ATOM 4 O ALA C 327 17.749 -0.748 -15.326 1.00 0.00 O ATOM 5 CB ALA C 327 18.111 0.997 -17.626 1.00 0.00 C ATOM 0 HA ALA C 327 16.494 -0.254 -18.295 1.00 0.00 H new ATOM 0 HB1 ALA C 327 18.879 0.366 -18.074 1.00 0.00 H new ATOM 0 HB2 ALA C 327 17.866 1.810 -18.309 1.00 0.00 H new ATOM 0 HB3 ALA C 327 18.482 1.410 -16.688 1.00 0.00 H new ATOM 11 N VAL C 328 16.840 -2.197 -16.788 1.00 0.00 N ATOM 12 CA VAL C 328 17.106 -3.374 -15.957 1.00 0.00 C ATOM 13 C VAL C 328 18.262 -4.184 -16.532 1.00 0.00 C ATOM 14 O VAL C 328 18.171 -4.718 -17.635 1.00 0.00 O ATOM 15 CB VAL C 328 15.857 -4.249 -15.884 1.00 0.00 C ATOM 16 CG1 VAL C 328 16.165 -5.502 -15.059 1.00 0.00 C ATOM 17 CG2 VAL C 328 14.719 -3.462 -15.224 1.00 0.00 C ATOM 0 H VAL C 328 16.375 -2.401 -17.672 1.00 0.00 H new ATOM 0 HA VAL C 328 17.375 -3.038 -14.956 1.00 0.00 H new ATOM 0 HB VAL C 328 15.555 -4.542 -16.890 1.00 0.00 H new ATOM 0 HG11 VAL C 328 15.275 -6.130 -15.005 1.00 0.00 H new ATOM 0 HG12 VAL C 328 16.974 -6.059 -15.532 1.00 0.00 H new ATOM 0 HG13 VAL C 328 16.465 -5.210 -14.053 1.00 0.00 H new ATOM 0 HG21 VAL C 328 13.827 -4.087 -15.172 1.00 0.00 H new ATOM 0 HG22 VAL C 328 15.016 -3.168 -14.217 1.00 0.00 H new ATOM 0 HG23 VAL C 328 14.504 -2.571 -15.813 1.00 0.00 H new ATOM 27 N ALA C 329 19.349 -4.272 -15.771 1.00 0.00 N ATOM 28 CA ALA C 329 20.525 -5.024 -16.208 1.00 0.00 C ATOM 29 C ALA C 329 20.469 -6.443 -15.665 1.00 0.00 C ATOM 30 O ALA C 329 21.234 -7.312 -16.084 1.00 0.00 O ATOM 31 CB ALA C 329 21.800 -4.337 -15.714 1.00 0.00 C ATOM 0 H ALA C 329 19.442 -3.835 -14.854 1.00 0.00 H new ATOM 0 HA ALA C 329 20.533 -5.057 -17.297 1.00 0.00 H new ATOM 0 HB1 ALA C 329 22.670 -4.904 -16.044 1.00 0.00 H new ATOM 0 HB2 ALA C 329 21.850 -3.327 -16.120 1.00 0.00 H new ATOM 0 HB3 ALA C 329 21.789 -4.290 -14.625 1.00 0.00 H new ATOM 37 N THR C 330 19.560 -6.672 -14.720 1.00 0.00 N ATOM 38 CA THR C 330 19.421 -7.997 -14.119 1.00 0.00 C ATOM 39 C THR C 330 18.507 -8.884 -14.968 1.00 0.00 C ATOM 40 O THR C 330 17.594 -8.389 -15.626 1.00 0.00 O ATOM 41 CB THR C 330 18.847 -7.879 -12.702 1.00 0.00 C ATOM 42 OG1 THR C 330 17.796 -6.922 -12.700 1.00 0.00 O ATOM 43 CG2 THR C 330 19.950 -7.434 -11.740 1.00 0.00 C ATOM 0 H THR C 330 18.917 -5.968 -14.358 1.00 0.00 H new ATOM 0 HA THR C 330 20.410 -8.453 -14.072 1.00 0.00 H new ATOM 0 HB THR C 330 18.459 -8.846 -12.382 1.00 0.00 H new ATOM 0 HG1 THR C 330 17.425 -6.845 -11.796 1.00 0.00 H new ATOM 0 HG21 THR C 330 19.542 -7.350 -10.733 1.00 0.00 H new ATOM 0 HG22 THR C 330 20.756 -8.168 -11.745 1.00 0.00 H new ATOM 0 HG23 THR C 330 20.339 -6.466 -12.056 1.00 0.00 H new ATOM 51 N PRO C 331 18.727 -10.179 -14.960 1.00 0.00 N ATOM 52 CA PRO C 331 17.889 -11.141 -15.738 1.00 0.00 C ATOM 53 C PRO C 331 16.492 -11.305 -15.147 1.00 0.00 C ATOM 54 O PRO C 331 16.271 -11.052 -13.963 1.00 0.00 O ATOM 55 CB PRO C 331 18.681 -12.453 -15.642 1.00 0.00 C ATOM 56 CG PRO C 331 19.423 -12.349 -14.350 1.00 0.00 C ATOM 57 CD PRO C 331 19.794 -10.880 -14.210 1.00 0.00 C ATOM 0 HA PRO C 331 17.719 -10.806 -16.761 1.00 0.00 H new ATOM 0 HB2 PRO C 331 18.018 -13.318 -15.650 1.00 0.00 H new ATOM 0 HB3 PRO C 331 19.364 -12.567 -16.484 1.00 0.00 H new ATOM 0 HG2 PRO C 331 18.805 -12.679 -13.515 1.00 0.00 H new ATOM 0 HG3 PRO C 331 20.312 -12.979 -14.357 1.00 0.00 H new ATOM 0 HD2 PRO C 331 19.819 -10.571 -13.165 1.00 0.00 H new ATOM 0 HD3 PRO C 331 20.780 -10.674 -14.627 1.00 0.00 H new ATOM 65 N GLU C 332 15.556 -11.750 -15.979 1.00 0.00 N ATOM 66 CA GLU C 332 14.190 -11.960 -15.528 1.00 0.00 C ATOM 67 C GLU C 332 14.185 -12.878 -14.308 1.00 0.00 C ATOM 68 O GLU C 332 13.255 -12.851 -13.504 1.00 0.00 O ATOM 69 CB GLU C 332 13.361 -12.586 -16.655 1.00 0.00 C ATOM 70 CG GLU C 332 14.006 -13.908 -17.088 1.00 0.00 C ATOM 71 CD GLU C 332 13.223 -14.513 -18.247 1.00 0.00 C ATOM 72 OE1 GLU C 332 12.845 -13.767 -19.135 1.00 0.00 O ATOM 73 OE2 GLU C 332 13.010 -15.713 -18.229 1.00 0.00 O ATOM 0 H GLU C 332 15.719 -11.970 -16.962 1.00 0.00 H new ATOM 0 HA GLU C 332 13.751 -11.000 -15.255 1.00 0.00 H new ATOM 0 HB2 GLU C 332 12.340 -12.761 -16.316 1.00 0.00 H new ATOM 0 HB3 GLU C 332 13.303 -11.902 -17.502 1.00 0.00 H new ATOM 0 HG2 GLU C 332 15.040 -13.737 -17.387 1.00 0.00 H new ATOM 0 HG3 GLU C 332 14.027 -14.604 -16.249 1.00 0.00 H new ATOM 80 N GLU C 333 15.233 -13.691 -14.180 1.00 0.00 N ATOM 81 CA GLU C 333 15.340 -14.612 -13.056 1.00 0.00 C ATOM 82 C GLU C 333 15.140 -13.870 -11.746 1.00 0.00 C ATOM 83 O GLU C 333 14.312 -14.256 -10.919 1.00 0.00 O ATOM 84 CB GLU C 333 16.721 -15.277 -13.068 1.00 0.00 C ATOM 85 CG GLU C 333 16.796 -16.283 -14.215 1.00 0.00 C ATOM 86 CD GLU C 333 18.190 -16.899 -14.276 1.00 0.00 C ATOM 87 OE1 GLU C 333 18.999 -16.570 -13.423 1.00 0.00 O ATOM 88 OE2 GLU C 333 18.428 -17.689 -15.175 1.00 0.00 O ATOM 0 H GLU C 333 16.013 -13.729 -14.836 1.00 0.00 H new ATOM 0 HA GLU C 333 14.567 -15.375 -13.149 1.00 0.00 H new ATOM 0 HB2 GLU C 333 17.498 -14.522 -13.182 1.00 0.00 H new ATOM 0 HB3 GLU C 333 16.902 -15.780 -12.118 1.00 0.00 H new ATOM 0 HG2 GLU C 333 16.050 -17.065 -14.074 1.00 0.00 H new ATOM 0 HG3 GLU C 333 16.566 -15.789 -15.159 1.00 0.00 H new ATOM 95 N LEU C 334 15.898 -12.799 -11.559 1.00 0.00 N ATOM 96 CA LEU C 334 15.785 -12.014 -10.340 1.00 0.00 C ATOM 97 C LEU C 334 14.394 -11.410 -10.215 1.00 0.00 C ATOM 98 O LEU C 334 13.781 -11.452 -9.148 1.00 0.00 O ATOM 99 CB LEU C 334 16.839 -10.895 -10.332 1.00 0.00 C ATOM 100 CG LEU C 334 16.623 -9.964 -9.128 1.00 0.00 C ATOM 101 CD1 LEU C 334 16.623 -10.782 -7.829 1.00 0.00 C ATOM 102 CD2 LEU C 334 17.746 -8.925 -9.082 1.00 0.00 C ATOM 0 H LEU C 334 16.589 -12.457 -12.227 1.00 0.00 H new ATOM 0 HA LEU C 334 15.956 -12.676 -9.491 1.00 0.00 H new ATOM 0 HB2 LEU C 334 17.838 -11.328 -10.290 1.00 0.00 H new ATOM 0 HB3 LEU C 334 16.778 -10.323 -11.258 1.00 0.00 H new ATOM 0 HG LEU C 334 15.662 -9.459 -9.230 1.00 0.00 H new ATOM 0 HD11 LEU C 334 16.470 -10.116 -6.980 1.00 0.00 H new ATOM 0 HD12 LEU C 334 15.820 -11.518 -7.863 1.00 0.00 H new ATOM 0 HD13 LEU C 334 17.580 -11.293 -7.721 1.00 0.00 H new ATOM 0 HD21 LEU C 334 17.595 -8.264 -8.229 1.00 0.00 H new ATOM 0 HD22 LEU C 334 18.706 -9.431 -8.983 1.00 0.00 H new ATOM 0 HD23 LEU C 334 17.738 -8.339 -10.001 1.00 0.00 H new ATOM 114 N ALA C 335 13.906 -10.837 -11.305 1.00 0.00 N ATOM 115 CA ALA C 335 12.594 -10.214 -11.294 1.00 0.00 C ATOM 116 C ALA C 335 11.530 -11.220 -10.875 1.00 0.00 C ATOM 117 O ALA C 335 10.728 -10.957 -9.980 1.00 0.00 O ATOM 118 CB ALA C 335 12.275 -9.663 -12.689 1.00 0.00 C ATOM 0 H ALA C 335 14.394 -10.791 -12.199 1.00 0.00 H new ATOM 0 HA ALA C 335 12.598 -9.396 -10.574 1.00 0.00 H new ATOM 0 HB1 ALA C 335 11.290 -9.196 -12.679 1.00 0.00 H new ATOM 0 HB2 ALA C 335 13.025 -8.923 -12.968 1.00 0.00 H new ATOM 0 HB3 ALA C 335 12.283 -10.478 -13.413 1.00 0.00 H new ATOM 124 N VAL C 336 11.542 -12.379 -11.516 1.00 0.00 N ATOM 125 CA VAL C 336 10.575 -13.420 -11.195 1.00 0.00 C ATOM 126 C VAL C 336 10.742 -13.861 -9.751 1.00 0.00 C ATOM 127 O VAL C 336 9.766 -14.012 -9.018 1.00 0.00 O ATOM 128 CB VAL C 336 10.766 -14.613 -12.144 1.00 0.00 C ATOM 129 CG1 VAL C 336 9.878 -15.777 -11.700 1.00 0.00 C ATOM 130 CG2 VAL C 336 10.388 -14.201 -13.576 1.00 0.00 C ATOM 0 H VAL C 336 12.203 -12.622 -12.254 1.00 0.00 H new ATOM 0 HA VAL C 336 9.567 -13.025 -11.321 1.00 0.00 H new ATOM 0 HB VAL C 336 11.810 -14.925 -12.118 1.00 0.00 H new ATOM 0 HG11 VAL C 336 10.018 -16.620 -12.377 1.00 0.00 H new ATOM 0 HG12 VAL C 336 10.149 -16.076 -10.687 1.00 0.00 H new ATOM 0 HG13 VAL C 336 8.834 -15.466 -11.719 1.00 0.00 H new ATOM 0 HG21 VAL C 336 10.525 -15.049 -14.247 1.00 0.00 H new ATOM 0 HG22 VAL C 336 9.346 -13.884 -13.600 1.00 0.00 H new ATOM 0 HG23 VAL C 336 11.026 -13.378 -13.898 1.00 0.00 H new ATOM 140 N ASN C 337 11.987 -14.073 -9.346 1.00 0.00 N ATOM 141 CA ASN C 337 12.265 -14.504 -7.987 1.00 0.00 C ATOM 142 C ASN C 337 11.687 -13.496 -7.002 1.00 0.00 C ATOM 143 O ASN C 337 11.175 -13.869 -5.946 1.00 0.00 O ATOM 144 CB ASN C 337 13.777 -14.626 -7.771 1.00 0.00 C ATOM 145 CG ASN C 337 14.071 -15.032 -6.331 1.00 0.00 C ATOM 146 OD1 ASN C 337 14.623 -14.243 -5.561 1.00 0.00 O ATOM 147 ND2 ASN C 337 13.735 -16.223 -5.916 1.00 0.00 N ATOM 0 H ASN C 337 12.812 -13.954 -9.934 1.00 0.00 H new ATOM 0 HA ASN C 337 11.804 -15.478 -7.823 1.00 0.00 H new ATOM 0 HB2 ASN C 337 14.191 -15.365 -8.457 1.00 0.00 H new ATOM 0 HB3 ASN C 337 14.262 -13.676 -7.995 1.00 0.00 H new ATOM 0 HD21 ASN C 337 13.929 -16.501 -4.954 1.00 0.00 H new ATOM 0 HD22 ASN C 337 13.278 -16.875 -6.554 1.00 0.00 H new ATOM 154 N ASN C 338 11.766 -12.212 -7.361 1.00 0.00 N ATOM 155 CA ASN C 338 11.239 -11.151 -6.507 1.00 0.00 C ATOM 156 C ASN C 338 9.784 -10.893 -6.850 1.00 0.00 C ATOM 157 O ASN C 338 8.920 -11.628 -6.399 1.00 0.00 O ATOM 158 CB ASN C 338 12.049 -9.875 -6.685 1.00 0.00 C ATOM 159 CG ASN C 338 11.524 -8.801 -5.744 1.00 0.00 C ATOM 160 OD1 ASN C 338 10.430 -8.929 -5.193 1.00 0.00 O ATOM 161 ND2 ASN C 338 12.249 -7.744 -5.516 1.00 0.00 N ATOM 0 H ASN C 338 12.187 -11.886 -8.231 1.00 0.00 H new ATOM 0 HA ASN C 338 11.313 -11.467 -5.467 1.00 0.00 H new ATOM 0 HB2 ASN C 338 13.102 -10.069 -6.480 1.00 0.00 H new ATOM 0 HB3 ASN C 338 11.983 -9.532 -7.717 1.00 0.00 H new ATOM 0 HD21 ASN C 338 11.911 -7.021 -4.881 1.00 0.00 H new ATOM 0 HD22 ASN C 338 13.155 -7.639 -5.973 1.00 0.00 H new ATOM 168 N ASP C 339 9.529 -9.853 -7.659 1.00 0.00 N ATOM 169 CA ASP C 339 8.167 -9.503 -8.068 1.00 0.00 C ATOM 170 C ASP C 339 7.427 -8.801 -6.923 1.00 0.00 C ATOM 171 O ASP C 339 6.199 -8.731 -6.913 1.00 0.00 O ATOM 172 CB ASP C 339 7.398 -10.784 -8.510 1.00 0.00 C ATOM 173 CG ASP C 339 6.399 -11.260 -7.426 1.00 0.00 C ATOM 174 OD1 ASP C 339 6.742 -11.227 -6.248 1.00 0.00 O ATOM 175 OD2 ASP C 339 5.294 -11.625 -7.791 1.00 0.00 O ATOM 0 H ASP C 339 10.251 -9.242 -8.041 1.00 0.00 H new ATOM 0 HA ASP C 339 8.220 -8.816 -8.913 1.00 0.00 H new ATOM 0 HB2 ASP C 339 6.860 -10.583 -9.436 1.00 0.00 H new ATOM 0 HB3 ASP C 339 8.111 -11.581 -8.722 1.00 0.00 H new ATOM 180 N ASP C 340 8.172 -8.291 -5.958 1.00 0.00 N ATOM 181 CA ASP C 340 7.573 -7.619 -4.806 1.00 0.00 C ATOM 182 C ASP C 340 8.252 -6.290 -4.559 1.00 0.00 C ATOM 183 O ASP C 340 9.466 -6.226 -4.393 1.00 0.00 O ATOM 184 CB ASP C 340 7.715 -8.505 -3.567 1.00 0.00 C ATOM 185 CG ASP C 340 7.066 -7.823 -2.371 1.00 0.00 C ATOM 186 OD1 ASP C 340 6.624 -6.698 -2.529 1.00 0.00 O ATOM 187 OD2 ASP C 340 7.022 -8.431 -1.314 1.00 0.00 O ATOM 0 H ASP C 340 9.191 -8.326 -5.944 1.00 0.00 H new ATOM 0 HA ASP C 340 6.517 -7.441 -5.012 1.00 0.00 H new ATOM 0 HB2 ASP C 340 7.246 -9.473 -3.745 1.00 0.00 H new ATOM 0 HB3 ASP C 340 8.769 -8.694 -3.362 1.00 0.00 H new ATOM 192 N CYS C 341 7.454 -5.226 -4.538 1.00 0.00 N ATOM 193 CA CYS C 341 7.985 -3.883 -4.307 1.00 0.00 C ATOM 194 C CYS C 341 7.636 -3.399 -2.903 1.00 0.00 C ATOM 195 O CYS C 341 6.477 -3.394 -2.509 1.00 0.00 O ATOM 196 CB CYS C 341 7.405 -2.907 -5.356 1.00 0.00 C ATOM 197 SG CYS C 341 8.697 -2.401 -6.527 1.00 0.00 S ATOM 0 H CYS C 341 6.444 -5.265 -4.677 1.00 0.00 H new ATOM 0 HA CYS C 341 9.070 -3.917 -4.401 1.00 0.00 H new ATOM 0 HB2 CYS C 341 6.585 -3.384 -5.893 1.00 0.00 H new ATOM 0 HB3 CYS C 341 6.992 -2.030 -4.858 1.00 0.00 H new ATOM 202 N ALA C 342 8.646 -2.988 -2.162 1.00 0.00 N ATOM 203 CA ALA C 342 8.428 -2.486 -0.811 1.00 0.00 C ATOM 204 C ALA C 342 7.945 -1.037 -0.855 1.00 0.00 C ATOM 205 O ALA C 342 7.518 -0.484 0.156 1.00 0.00 O ATOM 206 CB ALA C 342 9.724 -2.564 -0.009 1.00 0.00 C ATOM 0 H ALA C 342 9.620 -2.990 -2.465 1.00 0.00 H new ATOM 0 HA ALA C 342 7.667 -3.102 -0.332 1.00 0.00 H new ATOM 0 HB1 ALA C 342 9.551 -2.187 0.999 1.00 0.00 H new ATOM 0 HB2 ALA C 342 10.058 -3.600 0.044 1.00 0.00 H new ATOM 0 HB3 ALA C 342 10.490 -1.961 -0.496 1.00 0.00 H new ATOM 212 N ILE C 343 8.028 -0.426 -2.037 1.00 0.00 N ATOM 213 CA ILE C 343 7.599 0.967 -2.211 1.00 0.00 C ATOM 214 C ILE C 343 6.147 1.051 -2.679 1.00 0.00 C ATOM 215 O ILE C 343 5.266 1.466 -1.926 1.00 0.00 O ATOM 216 CB ILE C 343 8.501 1.662 -3.228 1.00 0.00 C ATOM 217 CG1 ILE C 343 9.932 1.708 -2.685 1.00 0.00 C ATOM 218 CG2 ILE C 343 7.998 3.088 -3.462 1.00 0.00 C ATOM 219 CD1 ILE C 343 10.890 2.104 -3.808 1.00 0.00 C ATOM 0 H ILE C 343 8.385 -0.868 -2.884 1.00 0.00 H new ATOM 0 HA ILE C 343 7.675 1.464 -1.244 1.00 0.00 H new ATOM 0 HB ILE C 343 8.485 1.112 -4.169 1.00 0.00 H new ATOM 0 HG12 ILE C 343 9.999 2.424 -1.866 1.00 0.00 H new ATOM 0 HG13 ILE C 343 10.211 0.735 -2.281 1.00 0.00 H new ATOM 0 HG21 ILE C 343 8.641 3.586 -4.188 1.00 0.00 H new ATOM 0 HG22 ILE C 343 6.977 3.056 -3.843 1.00 0.00 H new ATOM 0 HG23 ILE C 343 8.017 3.639 -2.522 1.00 0.00 H new ATOM 0 HD11 ILE C 343 11.909 2.137 -3.422 1.00 0.00 H new ATOM 0 HD12 ILE C 343 10.830 1.371 -4.613 1.00 0.00 H new ATOM 0 HD13 ILE C 343 10.615 3.087 -4.191 1.00 0.00 H new ATOM 231 N CYS C 344 5.912 0.661 -3.930 1.00 0.00 N ATOM 232 CA CYS C 344 4.569 0.706 -4.496 1.00 0.00 C ATOM 233 C CYS C 344 3.711 -0.427 -3.949 1.00 0.00 C ATOM 234 O CYS C 344 2.535 -0.546 -4.293 1.00 0.00 O ATOM 235 CB CYS C 344 4.645 0.612 -6.023 1.00 0.00 C ATOM 236 SG CYS C 344 5.234 -1.023 -6.522 1.00 0.00 S ATOM 0 H CYS C 344 6.630 0.313 -4.566 1.00 0.00 H new ATOM 0 HA CYS C 344 4.108 1.652 -4.214 1.00 0.00 H new ATOM 0 HB2 CYS C 344 3.662 0.800 -6.455 1.00 0.00 H new ATOM 0 HB3 CYS C 344 5.315 1.381 -6.409 1.00 0.00 H new ATOM 241 N TRP C 345 4.301 -1.256 -3.095 1.00 0.00 N ATOM 242 CA TRP C 345 3.574 -2.377 -2.507 1.00 0.00 C ATOM 243 C TRP C 345 2.726 -3.079 -3.561 1.00 0.00 C ATOM 244 O TRP C 345 1.497 -3.093 -3.475 1.00 0.00 O ATOM 245 CB TRP C 345 2.680 -1.876 -1.377 1.00 0.00 C ATOM 246 CG TRP C 345 3.530 -1.297 -0.289 1.00 0.00 C ATOM 247 CD1 TRP C 345 4.511 -1.961 0.368 1.00 0.00 C ATOM 248 CD2 TRP C 345 3.495 0.046 0.273 1.00 0.00 C ATOM 249 NE1 TRP C 345 5.076 -1.111 1.301 1.00 0.00 N ATOM 250 CE2 TRP C 345 4.485 0.138 1.280 1.00 0.00 C ATOM 251 CE3 TRP C 345 2.708 1.180 0.011 1.00 0.00 C ATOM 252 CZ2 TRP C 345 4.686 1.316 2.003 1.00 0.00 C ATOM 253 CZ3 TRP C 345 2.907 2.367 0.736 1.00 0.00 C ATOM 254 CH2 TRP C 345 3.894 2.434 1.729 1.00 0.00 C ATOM 0 H TRP C 345 5.273 -1.175 -2.796 1.00 0.00 H new ATOM 0 HA TRP C 345 4.297 -3.090 -2.110 1.00 0.00 H new ATOM 0 HB2 TRP C 345 1.988 -1.122 -1.753 1.00 0.00 H new ATOM 0 HB3 TRP C 345 2.077 -2.695 -0.985 1.00 0.00 H new ATOM 0 HD1 TRP C 345 4.804 -2.986 0.192 1.00 0.00 H new ATOM 0 HE1 TRP C 345 5.836 -1.374 1.928 1.00 0.00 H new ATOM 0 HE3 TRP C 345 1.945 1.139 -0.753 1.00 0.00 H new ATOM 0 HZ2 TRP C 345 5.447 1.362 2.768 1.00 0.00 H new ATOM 0 HZ3 TRP C 345 2.296 3.233 0.527 1.00 0.00 H new ATOM 0 HH2 TRP C 345 4.042 3.350 2.282 1.00 0.00 H new ATOM 265 N ASP C 346 3.387 -3.662 -4.558 1.00 0.00 N ATOM 266 CA ASP C 346 2.679 -4.364 -5.623 1.00 0.00 C ATOM 267 C ASP C 346 3.609 -5.353 -6.321 1.00 0.00 C ATOM 268 O ASP C 346 4.607 -5.792 -5.748 1.00 0.00 O ATOM 269 CB ASP C 346 2.136 -3.353 -6.642 1.00 0.00 C ATOM 270 CG ASP C 346 1.000 -3.978 -7.448 1.00 0.00 C ATOM 271 OD1 ASP C 346 0.816 -5.180 -7.337 1.00 0.00 O ATOM 272 OD2 ASP C 346 0.335 -3.248 -8.164 1.00 0.00 O ATOM 0 H ASP C 346 4.403 -3.662 -4.650 1.00 0.00 H new ATOM 0 HA ASP C 346 1.848 -4.916 -5.184 1.00 0.00 H new ATOM 0 HB2 ASP C 346 1.779 -2.462 -6.126 1.00 0.00 H new ATOM 0 HB3 ASP C 346 2.935 -3.035 -7.312 1.00 0.00 H new ATOM 277 N SER C 347 3.275 -5.701 -7.562 1.00 0.00 N ATOM 278 CA SER C 347 4.085 -6.638 -8.333 1.00 0.00 C ATOM 279 C SER C 347 3.926 -6.378 -9.826 1.00 0.00 C ATOM 280 O SER C 347 2.945 -5.774 -10.262 1.00 0.00 O ATOM 281 CB SER C 347 3.662 -8.071 -8.014 1.00 0.00 C ATOM 282 OG SER C 347 2.358 -8.300 -8.527 1.00 0.00 O ATOM 0 H SER C 347 2.453 -5.349 -8.052 1.00 0.00 H new ATOM 0 HA SER C 347 5.131 -6.498 -8.062 1.00 0.00 H new ATOM 0 HB2 SER C 347 4.367 -8.777 -8.453 1.00 0.00 H new ATOM 0 HB3 SER C 347 3.676 -8.235 -6.937 1.00 0.00 H new ATOM 0 HG SER C 347 2.084 -9.219 -8.326 1.00 0.00 H new ATOM 288 N MET C 348 4.898 -6.835 -10.605 1.00 0.00 N ATOM 289 CA MET C 348 4.857 -6.648 -12.048 1.00 0.00 C ATOM 290 C MET C 348 5.975 -7.447 -12.716 1.00 0.00 C ATOM 291 O MET C 348 6.148 -8.633 -12.439 1.00 0.00 O ATOM 292 CB MET C 348 4.998 -5.157 -12.391 1.00 0.00 C ATOM 293 CG MET C 348 4.474 -4.897 -13.808 1.00 0.00 C ATOM 294 SD MET C 348 2.664 -4.860 -13.770 1.00 0.00 S ATOM 295 CE MET C 348 2.480 -3.074 -13.567 1.00 0.00 C ATOM 0 H MET C 348 5.719 -7.335 -10.264 1.00 0.00 H new ATOM 0 HA MET C 348 3.898 -7.007 -12.421 1.00 0.00 H new ATOM 0 HB2 MET C 348 4.442 -4.555 -11.672 1.00 0.00 H new ATOM 0 HB3 MET C 348 6.043 -4.855 -12.319 1.00 0.00 H new ATOM 0 HG2 MET C 348 4.862 -3.951 -14.185 1.00 0.00 H new ATOM 0 HG3 MET C 348 4.820 -5.677 -14.486 1.00 0.00 H new ATOM 0 HE1 MET C 348 1.421 -2.820 -13.519 1.00 0.00 H new ATOM 0 HE2 MET C 348 2.971 -2.760 -12.646 1.00 0.00 H new ATOM 0 HE3 MET C 348 2.937 -2.563 -14.414 1.00 0.00 H new ATOM 305 N GLN C 349 6.729 -6.786 -13.597 1.00 0.00 N ATOM 306 CA GLN C 349 7.833 -7.429 -14.311 1.00 0.00 C ATOM 307 C GLN C 349 9.122 -6.638 -14.130 1.00 0.00 C ATOM 308 O GLN C 349 10.154 -7.199 -13.756 1.00 0.00 O ATOM 309 CB GLN C 349 7.497 -7.525 -15.800 1.00 0.00 C ATOM 310 CG GLN C 349 6.382 -8.555 -16.013 1.00 0.00 C ATOM 311 CD GLN C 349 6.901 -9.955 -15.697 1.00 0.00 C ATOM 312 OE1 GLN C 349 7.890 -10.396 -16.282 1.00 0.00 O ATOM 313 NE2 GLN C 349 6.295 -10.683 -14.799 1.00 0.00 N ATOM 0 H GLN C 349 6.594 -5.803 -13.833 1.00 0.00 H new ATOM 0 HA GLN C 349 7.976 -8.429 -13.901 1.00 0.00 H new ATOM 0 HB2 GLN C 349 7.182 -6.551 -16.175 1.00 0.00 H new ATOM 0 HB3 GLN C 349 8.384 -7.813 -16.365 1.00 0.00 H new ATOM 0 HG2 GLN C 349 5.531 -8.320 -15.374 1.00 0.00 H new ATOM 0 HG3 GLN C 349 6.028 -8.513 -17.043 1.00 0.00 H new ATOM 0 HE21 GLN C 349 5.475 -10.317 -14.314 1.00 0.00 H new ATOM 0 HE22 GLN C 349 6.641 -11.618 -14.582 1.00 0.00 H new ATOM 322 N ALA C 350 9.063 -5.340 -14.395 1.00 0.00 N ATOM 323 CA ALA C 350 10.240 -4.496 -14.262 1.00 0.00 C ATOM 324 C ALA C 350 10.888 -4.700 -12.899 1.00 0.00 C ATOM 325 O ALA C 350 10.220 -4.653 -11.870 1.00 0.00 O ATOM 326 CB ALA C 350 9.851 -3.026 -14.431 1.00 0.00 C ATOM 0 H ALA C 350 8.220 -4.853 -14.701 1.00 0.00 H new ATOM 0 HA ALA C 350 10.954 -4.772 -15.038 1.00 0.00 H new ATOM 0 HB1 ALA C 350 10.738 -2.401 -14.330 1.00 0.00 H new ATOM 0 HB2 ALA C 350 9.412 -2.877 -15.418 1.00 0.00 H new ATOM 0 HB3 ALA C 350 9.125 -2.752 -13.666 1.00 0.00 H new ATOM 332 N ALA C 351 12.201 -4.926 -12.903 1.00 0.00 N ATOM 333 CA ALA C 351 12.941 -5.139 -11.661 1.00 0.00 C ATOM 334 C ALA C 351 14.301 -4.464 -11.727 1.00 0.00 C ATOM 335 O ALA C 351 15.043 -4.639 -12.689 1.00 0.00 O ATOM 336 CB ALA C 351 13.126 -6.631 -11.424 1.00 0.00 C ATOM 0 H ALA C 351 12.771 -4.966 -13.748 1.00 0.00 H new ATOM 0 HA ALA C 351 12.373 -4.704 -10.839 1.00 0.00 H new ATOM 0 HB1 ALA C 351 13.678 -6.786 -10.497 1.00 0.00 H new ATOM 0 HB2 ALA C 351 12.150 -7.111 -11.350 1.00 0.00 H new ATOM 0 HB3 ALA C 351 13.682 -7.065 -12.255 1.00 0.00 H new ATOM 342 N ARG C 352 14.627 -3.683 -10.695 1.00 0.00 N ATOM 343 CA ARG C 352 15.903 -2.980 -10.641 1.00 0.00 C ATOM 344 C ARG C 352 16.552 -3.193 -9.284 1.00 0.00 C ATOM 345 O ARG C 352 15.870 -3.249 -8.268 1.00 0.00 O ATOM 346 CB ARG C 352 15.673 -1.467 -10.898 1.00 0.00 C ATOM 347 CG ARG C 352 16.566 -0.968 -12.022 1.00 0.00 C ATOM 348 CD ARG C 352 18.001 -0.897 -11.518 1.00 0.00 C ATOM 349 NE ARG C 352 18.876 -0.366 -12.555 1.00 0.00 N ATOM 350 CZ ARG C 352 20.193 -0.550 -12.515 1.00 0.00 C ATOM 351 NH1 ARG C 352 20.731 -1.224 -11.535 1.00 0.00 N ATOM 352 NH2 ARG C 352 20.947 -0.057 -13.459 1.00 0.00 N ATOM 0 H ARG C 352 14.024 -3.524 -9.888 1.00 0.00 H new ATOM 0 HA ARG C 352 16.567 -3.373 -11.411 1.00 0.00 H new ATOM 0 HB2 ARG C 352 14.628 -1.292 -11.153 1.00 0.00 H new ATOM 0 HB3 ARG C 352 15.878 -0.904 -9.988 1.00 0.00 H new ATOM 0 HG2 ARG C 352 16.501 -1.637 -12.880 1.00 0.00 H new ATOM 0 HG3 ARG C 352 16.235 0.015 -12.358 1.00 0.00 H new ATOM 0 HD2 ARG C 352 18.051 -0.265 -10.632 1.00 0.00 H new ATOM 0 HD3 ARG C 352 18.339 -1.890 -11.221 1.00 0.00 H new ATOM 0 HE ARG C 352 18.469 0.159 -13.329 1.00 0.00 H new ATOM 0 HH11 ARG C 352 20.141 -1.611 -10.798 1.00 0.00 H new ATOM 0 HH12 ARG C 352 21.741 -1.364 -11.506 1.00 0.00 H new ATOM 0 HH21 ARG C 352 20.526 0.468 -14.226 1.00 0.00 H new ATOM 0 HH22 ARG C 352 21.957 -0.197 -13.430 1.00 0.00 H new ATOM 366 N LYS C 353 17.876 -3.308 -9.287 1.00 0.00 N ATOM 367 CA LYS C 353 18.628 -3.511 -8.055 1.00 0.00 C ATOM 368 C LYS C 353 19.493 -2.303 -7.731 1.00 0.00 C ATOM 369 O LYS C 353 20.417 -1.965 -8.475 1.00 0.00 O ATOM 370 CB LYS C 353 19.512 -4.743 -8.198 1.00 0.00 C ATOM 371 CG LYS C 353 20.353 -4.924 -6.931 1.00 0.00 C ATOM 372 CD LYS C 353 21.112 -6.246 -7.004 1.00 0.00 C ATOM 373 CE LYS C 353 21.940 -6.426 -5.730 1.00 0.00 C ATOM 374 NZ LYS C 353 21.027 -6.526 -4.554 1.00 0.00 N ATOM 0 H LYS C 353 18.450 -3.264 -10.129 1.00 0.00 H new ATOM 0 HA LYS C 353 17.917 -3.651 -7.240 1.00 0.00 H new ATOM 0 HB2 LYS C 353 18.897 -5.627 -8.367 1.00 0.00 H new ATOM 0 HB3 LYS C 353 20.163 -4.637 -9.066 1.00 0.00 H new ATOM 0 HG2 LYS C 353 21.054 -4.096 -6.827 1.00 0.00 H new ATOM 0 HG3 LYS C 353 19.710 -4.910 -6.051 1.00 0.00 H new ATOM 0 HD2 LYS C 353 20.412 -7.074 -7.117 1.00 0.00 H new ATOM 0 HD3 LYS C 353 21.762 -6.257 -7.879 1.00 0.00 H new ATOM 0 HE2 LYS C 353 22.553 -7.324 -5.806 1.00 0.00 H new ATOM 0 HE3 LYS C 353 22.622 -5.585 -5.604 1.00 0.00 H new ATOM 0 HZ1 LYS C 353 21.548 -6.913 -3.742 1.00 0.00 H new ATOM 0 HZ2 LYS C 353 20.664 -5.581 -4.315 1.00 0.00 H new ATOM 0 HZ3 LYS C 353 20.231 -7.154 -4.785 1.00 0.00 H new ATOM 388 N LEU C 354 19.199 -1.660 -6.610 1.00 0.00 N ATOM 389 CA LEU C 354 19.964 -0.493 -6.200 1.00 0.00 C ATOM 390 C LEU C 354 21.405 -0.896 -5.869 1.00 0.00 C ATOM 391 O LEU C 354 21.665 -2.049 -5.520 1.00 0.00 O ATOM 392 CB LEU C 354 19.304 0.136 -4.959 1.00 0.00 C ATOM 393 CG LEU C 354 18.176 1.093 -5.374 1.00 0.00 C ATOM 394 CD1 LEU C 354 17.193 1.248 -4.214 1.00 0.00 C ATOM 395 CD2 LEU C 354 18.737 2.472 -5.747 1.00 0.00 C ATOM 0 H LEU C 354 18.445 -1.923 -5.975 1.00 0.00 H new ATOM 0 HA LEU C 354 19.980 0.231 -7.015 1.00 0.00 H new ATOM 0 HB2 LEU C 354 18.905 -0.648 -4.316 1.00 0.00 H new ATOM 0 HB3 LEU C 354 20.051 0.676 -4.377 1.00 0.00 H new ATOM 0 HG LEU C 354 17.670 0.675 -6.245 1.00 0.00 H new ATOM 0 HD11 LEU C 354 16.391 1.927 -4.505 1.00 0.00 H new ATOM 0 HD12 LEU C 354 16.771 0.275 -3.962 1.00 0.00 H new ATOM 0 HD13 LEU C 354 17.714 1.653 -3.347 1.00 0.00 H new ATOM 0 HD21 LEU C 354 17.919 3.131 -6.037 1.00 0.00 H new ATOM 0 HD22 LEU C 354 19.259 2.897 -4.889 1.00 0.00 H new ATOM 0 HD23 LEU C 354 19.433 2.369 -6.580 1.00 0.00 H new ATOM 407 N PRO C 355 22.327 0.032 -5.956 1.00 0.00 N ATOM 408 CA PRO C 355 23.763 -0.221 -5.646 1.00 0.00 C ATOM 409 C PRO C 355 23.972 -0.529 -4.165 1.00 0.00 C ATOM 410 O PRO C 355 25.013 -1.053 -3.770 1.00 0.00 O ATOM 411 CB PRO C 355 24.463 1.094 -6.056 1.00 0.00 C ATOM 412 CG PRO C 355 23.392 2.142 -6.000 1.00 0.00 C ATOM 413 CD PRO C 355 22.101 1.429 -6.368 1.00 0.00 C ATOM 0 HA PRO C 355 24.159 -1.089 -6.172 1.00 0.00 H new ATOM 0 HB2 PRO C 355 25.283 1.332 -5.378 1.00 0.00 H new ATOM 0 HB3 PRO C 355 24.888 1.018 -7.057 1.00 0.00 H new ATOM 0 HG2 PRO C 355 23.326 2.582 -5.005 1.00 0.00 H new ATOM 0 HG3 PRO C 355 23.602 2.955 -6.695 1.00 0.00 H new ATOM 0 HD2 PRO C 355 21.245 1.863 -5.851 1.00 0.00 H new ATOM 0 HD3 PRO C 355 21.897 1.501 -7.436 1.00 0.00 H new ATOM 421 N CYS C 356 22.975 -0.201 -3.343 1.00 0.00 N ATOM 422 CA CYS C 356 23.069 -0.445 -1.905 1.00 0.00 C ATOM 423 C CYS C 356 22.728 -1.892 -1.572 1.00 0.00 C ATOM 424 O CYS C 356 23.408 -2.535 -0.771 1.00 0.00 O ATOM 425 CB CYS C 356 22.126 0.517 -1.149 1.00 0.00 C ATOM 426 SG CYS C 356 20.485 -0.222 -0.913 1.00 0.00 S ATOM 0 H CYS C 356 22.101 0.230 -3.645 1.00 0.00 H new ATOM 0 HA CYS C 356 24.096 -0.262 -1.590 1.00 0.00 H new ATOM 0 HB2 CYS C 356 22.558 0.767 -0.180 1.00 0.00 H new ATOM 0 HB3 CYS C 356 22.031 1.449 -1.706 1.00 0.00 H new ATOM 431 N GLY C 357 21.669 -2.401 -2.201 1.00 0.00 N ATOM 432 CA GLY C 357 21.231 -3.782 -1.972 1.00 0.00 C ATOM 433 C GLY C 357 19.719 -3.852 -1.796 1.00 0.00 C ATOM 434 O GLY C 357 19.227 -4.395 -0.810 1.00 0.00 O ATOM 0 H GLY C 357 21.100 -1.883 -2.870 1.00 0.00 H new ATOM 0 HA2 GLY C 357 21.532 -4.407 -2.812 1.00 0.00 H new ATOM 0 HA3 GLY C 357 21.723 -4.181 -1.085 1.00 0.00 H new ATOM 438 N HIS C 358 18.980 -3.317 -2.767 1.00 0.00 N ATOM 439 CA HIS C 358 17.514 -3.336 -2.709 1.00 0.00 C ATOM 440 C HIS C 358 16.943 -3.573 -4.095 1.00 0.00 C ATOM 441 O HIS C 358 17.497 -3.101 -5.079 1.00 0.00 O ATOM 442 CB HIS C 358 16.996 -2.004 -2.146 1.00 0.00 C ATOM 443 CG HIS C 358 17.088 -2.021 -0.649 1.00 0.00 C ATOM 444 ND1 HIS C 358 18.116 -1.398 0.041 1.00 0.00 N ATOM 445 CD2 HIS C 358 16.290 -2.597 0.303 1.00 0.00 C ATOM 446 CE1 HIS C 358 17.908 -1.617 1.353 1.00 0.00 C ATOM 447 NE2 HIS C 358 16.807 -2.340 1.564 1.00 0.00 N ATOM 0 H HIS C 358 19.366 -2.868 -3.598 1.00 0.00 H new ATOM 0 HA HIS C 358 17.194 -4.146 -2.053 1.00 0.00 H new ATOM 0 HB2 HIS C 358 17.581 -1.176 -2.547 1.00 0.00 H new ATOM 0 HB3 HIS C 358 15.963 -1.844 -2.455 1.00 0.00 H new ATOM 0 HD1 HIS C 358 18.887 -0.871 -0.369 1.00 0.00 H new ATOM 0 HD2 HIS C 358 15.394 -3.165 0.102 1.00 0.00 H new ATOM 0 HE1 HIS C 358 18.553 -1.252 2.138 1.00 0.00 H new ATOM 455 N LEU C 359 15.839 -4.317 -4.164 1.00 0.00 N ATOM 456 CA LEU C 359 15.210 -4.622 -5.456 1.00 0.00 C ATOM 457 C LEU C 359 13.973 -3.765 -5.686 1.00 0.00 C ATOM 458 O LEU C 359 12.969 -3.964 -5.011 1.00 0.00 O ATOM 459 CB LEU C 359 14.777 -6.081 -5.467 1.00 0.00 C ATOM 460 CG LEU C 359 15.942 -6.973 -5.032 1.00 0.00 C ATOM 461 CD1 LEU C 359 15.519 -8.442 -5.095 1.00 0.00 C ATOM 462 CD2 LEU C 359 17.138 -6.736 -5.956 1.00 0.00 C ATOM 0 H LEU C 359 15.364 -4.716 -3.354 1.00 0.00 H new ATOM 0 HA LEU C 359 15.938 -4.417 -6.241 1.00 0.00 H new ATOM 0 HB2 LEU C 359 13.929 -6.223 -4.797 1.00 0.00 H new ATOM 0 HB3 LEU C 359 14.445 -6.363 -6.466 1.00 0.00 H new ATOM 0 HG LEU C 359 16.224 -6.728 -4.008 1.00 0.00 H new ATOM 0 HD11 LEU C 359 16.351 -9.074 -4.785 1.00 0.00 H new ATOM 0 HD12 LEU C 359 14.671 -8.605 -4.430 1.00 0.00 H new ATOM 0 HD13 LEU C 359 15.233 -8.695 -6.116 1.00 0.00 H new ATOM 0 HD21 LEU C 359 17.968 -7.371 -5.647 1.00 0.00 H new ATOM 0 HD22 LEU C 359 16.859 -6.978 -6.982 1.00 0.00 H new ATOM 0 HD23 LEU C 359 17.440 -5.690 -5.899 1.00 0.00 H new ATOM 474 N PHE C 360 14.070 -2.829 -6.641 1.00 0.00 N ATOM 475 CA PHE C 360 12.973 -1.902 -6.971 1.00 0.00 C ATOM 476 C PHE C 360 12.668 -1.937 -8.447 1.00 0.00 C ATOM 477 O PHE C 360 13.559 -2.114 -9.274 1.00 0.00 O ATOM 478 CB PHE C 360 13.394 -0.484 -6.553 1.00 0.00 C ATOM 479 CG PHE C 360 13.361 -0.295 -5.033 1.00 0.00 C ATOM 480 CD1 PHE C 360 12.735 -1.212 -4.163 1.00 0.00 C ATOM 481 CD2 PHE C 360 14.072 0.764 -4.485 1.00 0.00 C ATOM 482 CE1 PHE C 360 12.815 -1.052 -2.797 1.00 0.00 C ATOM 483 CE2 PHE C 360 14.138 0.924 -3.103 1.00 0.00 C ATOM 484 CZ PHE C 360 13.509 0.022 -2.262 1.00 0.00 C ATOM 0 H PHE C 360 14.908 -2.692 -7.206 1.00 0.00 H new ATOM 0 HA PHE C 360 12.071 -2.201 -6.437 1.00 0.00 H new ATOM 0 HB2 PHE C 360 14.400 -0.282 -6.921 1.00 0.00 H new ATOM 0 HB3 PHE C 360 12.731 0.243 -7.022 1.00 0.00 H new ATOM 0 HD1 PHE C 360 12.187 -2.048 -4.572 1.00 0.00 H new ATOM 0 HD2 PHE C 360 14.576 1.466 -5.133 1.00 0.00 H new ATOM 0 HE1 PHE C 360 12.336 -1.765 -2.142 1.00 0.00 H new ATOM 0 HE2 PHE C 360 14.683 1.757 -2.685 1.00 0.00 H new ATOM 0 HZ PHE C 360 13.559 0.155 -1.191 1.00 0.00 H new ATOM 494 N HIS C 361 11.385 -1.787 -8.747 1.00 0.00 N ATOM 495 CA HIS C 361 10.937 -1.828 -10.120 1.00 0.00 C ATOM 496 C HIS C 361 11.402 -0.577 -10.847 1.00 0.00 C ATOM 497 O HIS C 361 11.734 0.423 -10.214 1.00 0.00 O ATOM 498 CB HIS C 361 9.409 -1.935 -10.175 1.00 0.00 C ATOM 499 CG HIS C 361 8.960 -3.155 -9.424 1.00 0.00 C ATOM 500 ND1 HIS C 361 7.672 -3.286 -8.923 1.00 0.00 N ATOM 501 CD2 HIS C 361 9.610 -4.313 -9.079 1.00 0.00 C ATOM 502 CE1 HIS C 361 7.594 -4.481 -8.309 1.00 0.00 C ATOM 503 NE2 HIS C 361 8.746 -5.146 -8.378 1.00 0.00 N ATOM 0 H HIS C 361 10.646 -1.637 -8.060 1.00 0.00 H new ATOM 0 HA HIS C 361 11.364 -2.704 -10.609 1.00 0.00 H new ATOM 0 HB2 HIS C 361 8.957 -1.043 -9.742 1.00 0.00 H new ATOM 0 HB3 HIS C 361 9.076 -1.991 -11.211 1.00 0.00 H new ATOM 0 HD2 HIS C 361 10.638 -4.543 -9.316 1.00 0.00 H new ATOM 0 HE1 HIS C 361 6.706 -4.855 -7.820 1.00 0.00 H new ATOM 0 HE2 HIS C 361 8.951 -6.070 -7.997 1.00 0.00 H new ATOM 511 N ASN C 362 11.439 -0.639 -12.167 1.00 0.00 N ATOM 512 CA ASN C 362 11.886 0.500 -12.960 1.00 0.00 C ATOM 513 C ASN C 362 11.015 1.724 -12.688 1.00 0.00 C ATOM 514 O ASN C 362 11.527 2.807 -12.401 1.00 0.00 O ATOM 515 CB ASN C 362 11.812 0.147 -14.445 1.00 0.00 C ATOM 516 CG ASN C 362 12.238 1.344 -15.290 1.00 0.00 C ATOM 517 OD1 ASN C 362 11.399 1.994 -15.915 1.00 0.00 O ATOM 518 ND2 ASN C 362 13.497 1.673 -15.343 1.00 0.00 N ATOM 0 H ASN C 362 11.168 -1.458 -12.712 1.00 0.00 H new ATOM 0 HA ASN C 362 12.914 0.734 -12.683 1.00 0.00 H new ATOM 0 HB2 ASN C 362 12.457 -0.706 -14.657 1.00 0.00 H new ATOM 0 HB3 ASN C 362 10.796 -0.149 -14.706 1.00 0.00 H new ATOM 0 HD21 ASN C 362 13.792 2.472 -15.904 1.00 0.00 H new ATOM 0 HD22 ASN C 362 14.188 1.132 -14.824 1.00 0.00 H new ATOM 525 N SER C 363 9.703 1.548 -12.773 1.00 0.00 N ATOM 526 CA SER C 363 8.778 2.647 -12.525 1.00 0.00 C ATOM 527 C SER C 363 8.869 3.114 -11.075 1.00 0.00 C ATOM 528 O SER C 363 8.816 4.312 -10.789 1.00 0.00 O ATOM 529 CB SER C 363 7.350 2.204 -12.836 1.00 0.00 C ATOM 530 OG SER C 363 7.190 2.086 -14.244 1.00 0.00 O ATOM 0 H SER C 363 9.257 0.662 -13.010 1.00 0.00 H new ATOM 0 HA SER C 363 9.050 3.479 -13.175 1.00 0.00 H new ATOM 0 HB2 SER C 363 7.140 1.249 -12.353 1.00 0.00 H new ATOM 0 HB3 SER C 363 6.638 2.926 -12.437 1.00 0.00 H new ATOM 0 HG SER C 363 6.275 1.800 -14.446 1.00 0.00 H new ATOM 536 N CYS C 364 8.998 2.156 -10.160 1.00 0.00 N ATOM 537 CA CYS C 364 9.088 2.480 -8.744 1.00 0.00 C ATOM 538 C CYS C 364 10.392 3.200 -8.436 1.00 0.00 C ATOM 539 O CYS C 364 10.400 4.260 -7.798 1.00 0.00 O ATOM 540 CB CYS C 364 9.006 1.200 -7.909 1.00 0.00 C ATOM 541 SG CYS C 364 7.387 0.427 -8.150 1.00 0.00 S ATOM 0 H CYS C 364 9.042 1.160 -10.373 1.00 0.00 H new ATOM 0 HA CYS C 364 8.256 3.137 -8.492 1.00 0.00 H new ATOM 0 HB2 CYS C 364 9.798 0.510 -8.202 1.00 0.00 H new ATOM 0 HB3 CYS C 364 9.158 1.430 -6.854 1.00 0.00 H new ATOM 546 N LEU C 365 11.496 2.626 -8.892 1.00 0.00 N ATOM 547 CA LEU C 365 12.789 3.231 -8.647 1.00 0.00 C ATOM 548 C LEU C 365 12.912 4.580 -9.343 1.00 0.00 C ATOM 549 O LEU C 365 13.262 5.582 -8.720 1.00 0.00 O ATOM 550 CB LEU C 365 13.909 2.298 -9.137 1.00 0.00 C ATOM 551 CG LEU C 365 15.274 2.997 -9.031 1.00 0.00 C ATOM 552 CD1 LEU C 365 15.481 3.531 -7.613 1.00 0.00 C ATOM 553 CD2 LEU C 365 16.390 1.998 -9.352 1.00 0.00 C ATOM 0 H LEU C 365 11.520 1.756 -9.425 1.00 0.00 H new ATOM 0 HA LEU C 365 12.884 3.389 -7.573 1.00 0.00 H new ATOM 0 HB2 LEU C 365 13.915 1.384 -8.544 1.00 0.00 H new ATOM 0 HB3 LEU C 365 13.722 2.006 -10.170 1.00 0.00 H new ATOM 0 HG LEU C 365 15.300 3.825 -9.740 1.00 0.00 H new ATOM 0 HD11 LEU C 365 16.451 4.024 -7.548 1.00 0.00 H new ATOM 0 HD12 LEU C 365 14.693 4.246 -7.375 1.00 0.00 H new ATOM 0 HD13 LEU C 365 15.447 2.704 -6.904 1.00 0.00 H new ATOM 0 HD21 LEU C 365 17.357 2.496 -9.276 1.00 0.00 H new ATOM 0 HD22 LEU C 365 16.352 1.170 -8.644 1.00 0.00 H new ATOM 0 HD23 LEU C 365 16.257 1.616 -10.364 1.00 0.00 H new ATOM 565 N ARG C 366 12.622 4.599 -10.634 1.00 0.00 N ATOM 566 CA ARG C 366 12.727 5.827 -11.403 1.00 0.00 C ATOM 567 C ARG C 366 11.957 6.937 -10.703 1.00 0.00 C ATOM 568 O ARG C 366 12.486 8.024 -10.468 1.00 0.00 O ATOM 569 CB ARG C 366 12.167 5.598 -12.807 1.00 0.00 C ATOM 570 CG ARG C 366 12.392 6.845 -13.654 1.00 0.00 C ATOM 571 CD ARG C 366 11.956 6.565 -15.094 1.00 0.00 C ATOM 572 NE ARG C 366 12.290 7.700 -15.954 1.00 0.00 N ATOM 573 CZ ARG C 366 11.442 8.708 -16.134 1.00 0.00 C ATOM 574 NH1 ARG C 366 10.282 8.700 -15.537 1.00 0.00 N ATOM 575 NH2 ARG C 366 11.773 9.709 -16.905 1.00 0.00 N ATOM 0 H ARG C 366 12.315 3.785 -11.167 1.00 0.00 H new ATOM 0 HA ARG C 366 13.774 6.121 -11.482 1.00 0.00 H new ATOM 0 HB2 ARG C 366 12.654 4.739 -13.269 1.00 0.00 H new ATOM 0 HB3 ARG C 366 11.103 5.370 -12.753 1.00 0.00 H new ATOM 0 HG2 ARG C 366 11.825 7.682 -13.247 1.00 0.00 H new ATOM 0 HG3 ARG C 366 13.444 7.130 -13.629 1.00 0.00 H new ATOM 0 HD2 ARG C 366 12.447 5.664 -15.462 1.00 0.00 H new ATOM 0 HD3 ARG C 366 10.883 6.378 -15.127 1.00 0.00 H new ATOM 0 HE ARG C 366 13.194 7.719 -16.426 1.00 0.00 H new ATOM 0 HH11 ARG C 366 10.025 7.920 -14.932 1.00 0.00 H new ATOM 0 HH12 ARG C 366 9.632 9.474 -15.675 1.00 0.00 H new ATOM 0 HH21 ARG C 366 12.682 9.717 -17.369 1.00 0.00 H new ATOM 0 HH22 ARG C 366 11.123 10.483 -17.044 1.00 0.00 H new ATOM 589 N SER C 367 10.707 6.654 -10.368 1.00 0.00 N ATOM 590 CA SER C 367 9.875 7.644 -9.694 1.00 0.00 C ATOM 591 C SER C 367 10.599 8.175 -8.458 1.00 0.00 C ATOM 592 O SER C 367 10.612 9.383 -8.196 1.00 0.00 O ATOM 593 CB SER C 367 8.547 7.011 -9.278 1.00 0.00 C ATOM 594 OG SER C 367 7.729 7.989 -8.646 1.00 0.00 O ATOM 0 H SER C 367 10.250 5.760 -10.548 1.00 0.00 H new ATOM 0 HA SER C 367 9.680 8.469 -10.379 1.00 0.00 H new ATOM 0 HB2 SER C 367 8.037 6.605 -10.151 1.00 0.00 H new ATOM 0 HB3 SER C 367 8.727 6.178 -8.598 1.00 0.00 H new ATOM 0 HG SER C 367 6.878 7.582 -8.381 1.00 0.00 H new ATOM 600 N TRP C 368 11.205 7.261 -7.705 1.00 0.00 N ATOM 601 CA TRP C 368 11.931 7.648 -6.503 1.00 0.00 C ATOM 602 C TRP C 368 13.140 8.512 -6.864 1.00 0.00 C ATOM 603 O TRP C 368 13.437 9.497 -6.190 1.00 0.00 O ATOM 604 CB TRP C 368 12.399 6.401 -5.745 1.00 0.00 C ATOM 605 CG TRP C 368 12.760 6.774 -4.342 1.00 0.00 C ATOM 606 CD1 TRP C 368 14.014 7.000 -3.888 1.00 0.00 C ATOM 607 CD2 TRP C 368 11.873 6.963 -3.201 1.00 0.00 C ATOM 608 NE1 TRP C 368 13.951 7.325 -2.545 1.00 0.00 N ATOM 609 CE2 TRP C 368 12.655 7.311 -2.075 1.00 0.00 C ATOM 610 CE3 TRP C 368 10.479 6.869 -3.038 1.00 0.00 C ATOM 611 CZ2 TRP C 368 12.078 7.555 -0.831 1.00 0.00 C ATOM 612 CZ3 TRP C 368 9.893 7.113 -1.785 1.00 0.00 C ATOM 613 CH2 TRP C 368 10.693 7.457 -0.683 1.00 0.00 C ATOM 0 H TRP C 368 11.208 6.260 -7.903 1.00 0.00 H new ATOM 0 HA TRP C 368 11.260 8.225 -5.867 1.00 0.00 H new ATOM 0 HB2 TRP C 368 11.611 5.648 -5.741 1.00 0.00 H new ATOM 0 HB3 TRP C 368 13.259 5.959 -6.248 1.00 0.00 H new ATOM 0 HD1 TRP C 368 14.917 6.937 -4.478 1.00 0.00 H new ATOM 0 HE1 TRP C 368 14.765 7.548 -1.972 1.00 0.00 H new ATOM 0 HE3 TRP C 368 9.856 6.608 -3.881 1.00 0.00 H new ATOM 0 HZ2 TRP C 368 12.698 7.818 0.013 1.00 0.00 H new ATOM 0 HZ3 TRP C 368 8.822 7.036 -1.668 1.00 0.00 H new ATOM 0 HH2 TRP C 368 10.237 7.646 0.278 1.00 0.00 H new ATOM 624 N LEU C 369 13.833 8.134 -7.935 1.00 0.00 N ATOM 625 CA LEU C 369 15.011 8.877 -8.371 1.00 0.00 C ATOM 626 C LEU C 369 14.630 10.304 -8.735 1.00 0.00 C ATOM 627 O LEU C 369 15.367 11.245 -8.441 1.00 0.00 O ATOM 628 CB LEU C 369 15.651 8.188 -9.583 1.00 0.00 C ATOM 629 CG LEU C 369 16.270 6.851 -9.156 1.00 0.00 C ATOM 630 CD1 LEU C 369 16.786 6.104 -10.393 1.00 0.00 C ATOM 631 CD2 LEU C 369 17.426 7.076 -8.150 1.00 0.00 C ATOM 0 H LEU C 369 13.602 7.325 -8.512 1.00 0.00 H new ATOM 0 HA LEU C 369 15.729 8.900 -7.552 1.00 0.00 H new ATOM 0 HB2 LEU C 369 14.901 8.021 -10.356 1.00 0.00 H new ATOM 0 HB3 LEU C 369 16.417 8.832 -10.016 1.00 0.00 H new ATOM 0 HG LEU C 369 15.503 6.252 -8.665 1.00 0.00 H new ATOM 0 HD11 LEU C 369 17.225 5.154 -10.088 1.00 0.00 H new ATOM 0 HD12 LEU C 369 15.958 5.917 -11.077 1.00 0.00 H new ATOM 0 HD13 LEU C 369 17.542 6.709 -10.894 1.00 0.00 H new ATOM 0 HD21 LEU C 369 17.850 6.114 -7.861 1.00 0.00 H new ATOM 0 HD22 LEU C 369 18.199 7.688 -8.615 1.00 0.00 H new ATOM 0 HD23 LEU C 369 17.044 7.585 -7.265 1.00 0.00 H new ATOM 643 N GLU C 370 13.478 10.458 -9.368 1.00 0.00 N ATOM 644 CA GLU C 370 13.009 11.778 -9.757 1.00 0.00 C ATOM 645 C GLU C 370 12.701 12.618 -8.522 1.00 0.00 C ATOM 646 O GLU C 370 12.970 13.819 -8.496 1.00 0.00 O ATOM 647 CB GLU C 370 11.754 11.654 -10.620 1.00 0.00 C ATOM 648 CG GLU C 370 12.125 11.034 -11.968 1.00 0.00 C ATOM 649 CD GLU C 370 10.873 10.858 -12.819 1.00 0.00 C ATOM 650 OE1 GLU C 370 9.810 11.242 -12.364 1.00 0.00 O ATOM 651 OE2 GLU C 370 10.998 10.343 -13.918 1.00 0.00 O ATOM 0 H GLU C 370 12.855 9.692 -9.622 1.00 0.00 H new ATOM 0 HA GLU C 370 13.794 12.269 -10.332 1.00 0.00 H new ATOM 0 HB2 GLU C 370 11.011 11.036 -10.115 1.00 0.00 H new ATOM 0 HB3 GLU C 370 11.304 12.635 -10.770 1.00 0.00 H new ATOM 0 HG2 GLU C 370 12.841 11.671 -12.487 1.00 0.00 H new ATOM 0 HG3 GLU C 370 12.609 10.070 -11.814 1.00 0.00 H new ATOM 658 N GLN C 371 12.138 11.979 -7.499 1.00 0.00 N ATOM 659 CA GLN C 371 11.805 12.686 -6.268 1.00 0.00 C ATOM 660 C GLN C 371 13.062 12.958 -5.445 1.00 0.00 C ATOM 661 O GLN C 371 13.312 14.088 -5.029 1.00 0.00 O ATOM 662 CB GLN C 371 10.822 11.856 -5.440 1.00 0.00 C ATOM 663 CG GLN C 371 10.417 12.637 -4.188 1.00 0.00 C ATOM 664 CD GLN C 371 9.291 11.912 -3.462 1.00 0.00 C ATOM 665 OE1 GLN C 371 8.674 11.006 -4.022 1.00 0.00 O ATOM 666 NE2 GLN C 371 8.976 12.264 -2.245 1.00 0.00 N ATOM 0 H GLN C 371 11.906 10.986 -7.498 1.00 0.00 H new ATOM 0 HA GLN C 371 11.346 13.639 -6.533 1.00 0.00 H new ATOM 0 HB2 GLN C 371 9.940 11.619 -6.034 1.00 0.00 H new ATOM 0 HB3 GLN C 371 11.279 10.908 -5.157 1.00 0.00 H new ATOM 0 HG2 GLN C 371 11.275 12.748 -3.525 1.00 0.00 H new ATOM 0 HG3 GLN C 371 10.095 13.641 -4.464 1.00 0.00 H new ATOM 0 HE21 GLN C 371 9.488 13.015 -1.783 1.00 0.00 H new ATOM 0 HE22 GLN C 371 8.218 11.788 -1.757 1.00 0.00 H new ATOM 675 N ASP C 372 13.846 11.910 -5.214 1.00 0.00 N ATOM 676 CA ASP C 372 15.075 12.043 -4.440 1.00 0.00 C ATOM 677 C ASP C 372 16.004 10.862 -4.697 1.00 0.00 C ATOM 678 O ASP C 372 15.551 9.775 -5.052 1.00 0.00 O ATOM 679 CB ASP C 372 14.750 12.091 -2.947 1.00 0.00 C ATOM 680 CG ASP C 372 15.969 12.560 -2.159 1.00 0.00 C ATOM 681 OD1 ASP C 372 16.819 13.208 -2.749 1.00 0.00 O ATOM 682 OD2 ASP C 372 16.036 12.267 -0.977 1.00 0.00 O ATOM 0 H ASP C 372 13.654 10.966 -5.549 1.00 0.00 H new ATOM 0 HA ASP C 372 15.568 12.966 -4.747 1.00 0.00 H new ATOM 0 HB2 ASP C 372 13.912 12.766 -2.771 1.00 0.00 H new ATOM 0 HB3 ASP C 372 14.442 11.104 -2.602 1.00 0.00 H new ATOM 687 N THR C 373 17.306 11.080 -4.509 1.00 0.00 N ATOM 688 CA THR C 373 18.302 10.025 -4.716 1.00 0.00 C ATOM 689 C THR C 373 18.797 9.512 -3.367 1.00 0.00 C ATOM 690 O THR C 373 19.954 9.694 -2.997 1.00 0.00 O ATOM 691 CB THR C 373 19.485 10.574 -5.561 1.00 0.00 C ATOM 692 OG1 THR C 373 19.485 11.993 -5.491 1.00 0.00 O ATOM 693 CG2 THR C 373 19.342 10.138 -7.024 1.00 0.00 C ATOM 0 H THR C 373 17.696 11.975 -4.214 1.00 0.00 H new ATOM 0 HA THR C 373 17.845 9.196 -5.257 1.00 0.00 H new ATOM 0 HB THR C 373 20.421 10.179 -5.166 1.00 0.00 H new ATOM 0 HG1 THR C 373 20.230 12.347 -6.021 1.00 0.00 H new ATOM 0 HG21 THR C 373 20.178 10.530 -7.604 1.00 0.00 H new ATOM 0 HG22 THR C 373 19.340 9.049 -7.081 1.00 0.00 H new ATOM 0 HG23 THR C 373 18.407 10.524 -7.429 1.00 0.00 H new ATOM 701 N SER C 374 17.908 8.857 -2.629 1.00 0.00 N ATOM 702 CA SER C 374 18.275 8.314 -1.325 1.00 0.00 C ATOM 703 C SER C 374 17.684 6.939 -1.151 1.00 0.00 C ATOM 704 O SER C 374 16.673 6.610 -1.770 1.00 0.00 O ATOM 705 CB SER C 374 17.790 9.234 -0.214 1.00 0.00 C ATOM 706 OG SER C 374 16.451 8.895 0.123 1.00 0.00 O ATOM 0 H SER C 374 16.940 8.690 -2.906 1.00 0.00 H new ATOM 0 HA SER C 374 19.361 8.242 -1.271 1.00 0.00 H new ATOM 0 HB2 SER C 374 18.433 9.138 0.661 1.00 0.00 H new ATOM 0 HB3 SER C 374 17.844 10.274 -0.537 1.00 0.00 H new ATOM 0 HG SER C 374 16.135 9.484 0.840 1.00 0.00 H new ATOM 712 N CYS C 375 18.330 6.133 -0.308 1.00 0.00 N ATOM 713 CA CYS C 375 17.860 4.776 -0.066 1.00 0.00 C ATOM 714 C CYS C 375 16.689 4.770 0.936 1.00 0.00 C ATOM 715 O CYS C 375 16.868 5.109 2.103 1.00 0.00 O ATOM 716 CB CYS C 375 18.986 3.923 0.486 1.00 0.00 C ATOM 717 SG CYS C 375 18.356 2.249 0.746 1.00 0.00 S ATOM 0 H CYS C 375 19.168 6.395 0.211 1.00 0.00 H new ATOM 0 HA CYS C 375 17.518 4.366 -1.016 1.00 0.00 H new ATOM 0 HB2 CYS C 375 19.827 3.909 -0.208 1.00 0.00 H new ATOM 0 HB3 CYS C 375 19.354 4.340 1.424 1.00 0.00 H new ATOM 722 N PRO C 376 15.504 4.389 0.523 1.00 0.00 N ATOM 723 CA PRO C 376 14.312 4.349 1.429 1.00 0.00 C ATOM 724 C PRO C 376 14.579 3.568 2.716 1.00 0.00 C ATOM 725 O PRO C 376 13.877 3.739 3.713 1.00 0.00 O ATOM 726 CB PRO C 376 13.237 3.643 0.582 1.00 0.00 C ATOM 727 CG PRO C 376 13.637 3.878 -0.832 1.00 0.00 C ATOM 728 CD PRO C 376 15.155 3.958 -0.837 1.00 0.00 C ATOM 0 HA PRO C 376 14.024 5.347 1.760 1.00 0.00 H new ATOM 0 HB2 PRO C 376 13.195 2.577 0.807 1.00 0.00 H new ATOM 0 HB3 PRO C 376 12.246 4.050 0.784 1.00 0.00 H new ATOM 0 HG2 PRO C 376 13.288 3.070 -1.475 1.00 0.00 H new ATOM 0 HG3 PRO C 376 13.198 4.800 -1.213 1.00 0.00 H new ATOM 0 HD2 PRO C 376 15.603 2.993 -1.075 1.00 0.00 H new ATOM 0 HD3 PRO C 376 15.513 4.668 -1.583 1.00 0.00 H new ATOM 736 N THR C 377 15.594 2.710 2.685 1.00 0.00 N ATOM 737 CA THR C 377 15.949 1.893 3.852 1.00 0.00 C ATOM 738 C THR C 377 17.271 2.345 4.454 1.00 0.00 C ATOM 739 O THR C 377 17.314 2.822 5.587 1.00 0.00 O ATOM 740 CB THR C 377 16.047 0.426 3.438 1.00 0.00 C ATOM 741 OG1 THR C 377 14.766 -0.030 3.012 1.00 0.00 O ATOM 742 CG2 THR C 377 16.519 -0.411 4.627 1.00 0.00 C ATOM 0 H THR C 377 16.187 2.559 1.869 1.00 0.00 H new ATOM 0 HA THR C 377 15.171 2.013 4.606 1.00 0.00 H new ATOM 0 HB THR C 377 16.761 0.325 2.620 1.00 0.00 H new ATOM 0 HG1 THR C 377 14.826 -0.971 2.744 1.00 0.00 H new ATOM 0 HG21 THR C 377 16.589 -1.458 4.330 1.00 0.00 H new ATOM 0 HG22 THR C 377 17.498 -0.060 4.953 1.00 0.00 H new ATOM 0 HG23 THR C 377 15.807 -0.313 5.447 1.00 0.00 H new ATOM 750 N CYS C 378 18.345 2.175 3.696 1.00 0.00 N ATOM 751 CA CYS C 378 19.664 2.552 4.170 1.00 0.00 C ATOM 752 C CYS C 378 19.745 4.054 4.411 1.00 0.00 C ATOM 753 O CYS C 378 20.624 4.519 5.136 1.00 0.00 O ATOM 754 CB CYS C 378 20.741 2.142 3.162 1.00 0.00 C ATOM 755 SG CYS C 378 20.550 0.394 2.742 1.00 0.00 S ATOM 0 H CYS C 378 18.327 1.780 2.756 1.00 0.00 H new ATOM 0 HA CYS C 378 19.837 2.030 5.111 1.00 0.00 H new ATOM 0 HB2 CYS C 378 20.662 2.753 2.263 1.00 0.00 H new ATOM 0 HB3 CYS C 378 21.731 2.319 3.581 1.00 0.00 H new ATOM 760 N ARG C 379 18.833 4.804 3.789 1.00 0.00 N ATOM 761 CA ARG C 379 18.815 6.259 3.935 1.00 0.00 C ATOM 762 C ARG C 379 20.119 6.868 3.445 1.00 0.00 C ATOM 763 O ARG C 379 20.452 8.001 3.790 1.00 0.00 O ATOM 764 CB ARG C 379 18.586 6.639 5.401 1.00 0.00 C ATOM 765 CG ARG C 379 17.179 6.222 5.821 1.00 0.00 C ATOM 766 CD ARG C 379 16.976 6.550 7.301 1.00 0.00 C ATOM 767 NE ARG C 379 17.812 5.685 8.129 1.00 0.00 N ATOM 768 CZ ARG C 379 17.865 5.842 9.447 1.00 0.00 C ATOM 769 NH1 ARG C 379 17.167 6.782 10.022 1.00 0.00 N ATOM 770 NH2 ARG C 379 18.618 5.056 10.169 1.00 0.00 N ATOM 0 H ARG C 379 18.102 4.430 3.183 1.00 0.00 H new ATOM 0 HA ARG C 379 17.999 6.651 3.329 1.00 0.00 H new ATOM 0 HB2 ARG C 379 19.326 6.150 6.034 1.00 0.00 H new ATOM 0 HB3 ARG C 379 18.713 7.713 5.533 1.00 0.00 H new ATOM 0 HG2 ARG C 379 16.437 6.743 5.216 1.00 0.00 H new ATOM 0 HG3 ARG C 379 17.037 5.155 5.650 1.00 0.00 H new ATOM 0 HD2 ARG C 379 17.225 7.595 7.487 1.00 0.00 H new ATOM 0 HD3 ARG C 379 15.928 6.420 7.569 1.00 0.00 H new ATOM 0 HE ARG C 379 18.364 4.949 7.688 1.00 0.00 H new ATOM 0 HH11 ARG C 379 16.580 7.398 9.460 1.00 0.00 H new ATOM 0 HH12 ARG C 379 17.209 6.901 11.034 1.00 0.00 H new ATOM 0 HH21 ARG C 379 19.166 4.321 9.721 1.00 0.00 H new ATOM 0 HH22 ARG C 379 18.658 5.177 11.181 1.00 0.00 H new ATOM 784 N MET C 380 20.853 6.112 2.632 1.00 0.00 N ATOM 785 CA MET C 380 22.122 6.585 2.084 1.00 0.00 C ATOM 786 C MET C 380 21.984 6.937 0.606 1.00 0.00 C ATOM 787 O MET C 380 21.342 6.215 -0.157 1.00 0.00 O ATOM 788 CB MET C 380 23.197 5.509 2.259 1.00 0.00 C ATOM 789 CG MET C 380 24.546 6.051 1.778 1.00 0.00 C ATOM 790 SD MET C 380 25.837 4.819 2.085 1.00 0.00 S ATOM 791 CE MET C 380 27.211 5.748 1.361 1.00 0.00 C ATOM 0 H MET C 380 20.592 5.171 2.338 1.00 0.00 H new ATOM 0 HA MET C 380 22.413 7.485 2.626 1.00 0.00 H new ATOM 0 HB2 MET C 380 23.264 5.214 3.306 1.00 0.00 H new ATOM 0 HB3 MET C 380 22.929 4.617 1.693 1.00 0.00 H new ATOM 0 HG2 MET C 380 24.497 6.285 0.715 1.00 0.00 H new ATOM 0 HG3 MET C 380 24.783 6.979 2.298 1.00 0.00 H new ATOM 0 HE1 MET C 380 28.128 5.164 1.442 1.00 0.00 H new ATOM 0 HE2 MET C 380 27.001 5.949 0.310 1.00 0.00 H new ATOM 0 HE3 MET C 380 27.333 6.691 1.893 1.00 0.00 H new ATOM 801 N SER C 381 22.598 8.045 0.213 1.00 0.00 N ATOM 802 CA SER C 381 22.553 8.483 -1.177 1.00 0.00 C ATOM 803 C SER C 381 23.197 7.437 -2.076 1.00 0.00 C ATOM 804 O SER C 381 24.053 6.673 -1.632 1.00 0.00 O ATOM 805 CB SER C 381 23.295 9.808 -1.335 1.00 0.00 C ATOM 806 OG SER C 381 24.672 9.609 -1.045 1.00 0.00 O ATOM 0 H SER C 381 23.131 8.655 0.833 1.00 0.00 H new ATOM 0 HA SER C 381 21.510 8.616 -1.465 1.00 0.00 H new ATOM 0 HB2 SER C 381 23.176 10.187 -2.350 1.00 0.00 H new ATOM 0 HB3 SER C 381 22.874 10.557 -0.664 1.00 0.00 H new ATOM 0 HG SER C 381 25.071 10.456 -0.755 1.00 0.00 H new ATOM 812 N LEU C 382 22.780 7.405 -3.339 1.00 0.00 N ATOM 813 CA LEU C 382 23.319 6.444 -4.308 1.00 0.00 C ATOM 814 C LEU C 382 23.931 7.174 -5.497 1.00 0.00 C ATOM 815 O LEU C 382 23.347 8.118 -6.027 1.00 0.00 O ATOM 816 CB LEU C 382 22.202 5.519 -4.806 1.00 0.00 C ATOM 817 CG LEU C 382 20.891 6.333 -5.004 1.00 0.00 C ATOM 818 CD1 LEU C 382 20.111 5.778 -6.199 1.00 0.00 C ATOM 819 CD2 LEU C 382 20.023 6.235 -3.738 1.00 0.00 C ATOM 0 H LEU C 382 22.071 8.032 -3.719 1.00 0.00 H new ATOM 0 HA LEU C 382 24.091 5.854 -3.814 1.00 0.00 H new ATOM 0 HB2 LEU C 382 22.496 5.052 -5.746 1.00 0.00 H new ATOM 0 HB3 LEU C 382 22.037 4.715 -4.089 1.00 0.00 H new ATOM 0 HG LEU C 382 21.145 7.376 -5.191 1.00 0.00 H new ATOM 0 HD11 LEU C 382 19.194 6.352 -6.333 1.00 0.00 H new ATOM 0 HD12 LEU C 382 20.721 5.854 -7.099 1.00 0.00 H new ATOM 0 HD13 LEU C 382 19.862 4.733 -6.017 1.00 0.00 H new ATOM 0 HD21 LEU C 382 19.106 6.806 -3.881 1.00 0.00 H new ATOM 0 HD22 LEU C 382 19.774 5.191 -3.547 1.00 0.00 H new ATOM 0 HD23 LEU C 382 20.573 6.638 -2.888 1.00 0.00 H new ATOM 831 N ASN C 383 25.106 6.722 -5.912 1.00 0.00 N ATOM 832 CA ASN C 383 25.789 7.330 -7.043 1.00 0.00 C ATOM 833 C ASN C 383 25.940 8.832 -6.838 1.00 0.00 C ATOM 834 O ASN C 383 25.660 9.620 -7.742 1.00 0.00 O ATOM 835 CB ASN C 383 25.011 7.061 -8.330 1.00 0.00 C ATOM 836 CG ASN C 383 25.825 7.513 -9.537 1.00 0.00 C ATOM 837 OD1 ASN C 383 26.796 8.257 -9.388 1.00 0.00 O ATOM 838 ND2 ASN C 383 25.490 7.105 -10.730 1.00 0.00 N ATOM 0 H ASN C 383 25.603 5.941 -5.485 1.00 0.00 H new ATOM 0 HA ASN C 383 26.782 6.888 -7.122 1.00 0.00 H new ATOM 0 HB2 ASN C 383 24.784 5.998 -8.412 1.00 0.00 H new ATOM 0 HB3 ASN C 383 24.058 7.589 -8.305 1.00 0.00 H new ATOM 0 HD21 ASN C 383 26.032 7.402 -11.541 1.00 0.00 H new ATOM 0 HD22 ASN C 383 24.686 6.489 -10.851 1.00 0.00 H new ATOM 845 N ILE C 384 26.381 9.225 -5.649 1.00 0.00 N ATOM 846 CA ILE C 384 26.569 10.640 -5.342 1.00 0.00 C ATOM 847 C ILE C 384 27.210 11.370 -6.518 1.00 0.00 C ATOM 848 O ILE C 384 27.756 10.699 -7.380 1.00 0.00 O ATOM 849 CB ILE C 384 27.453 10.788 -4.102 1.00 0.00 C ATOM 850 CG1 ILE C 384 28.754 10.012 -4.307 1.00 0.00 C ATOM 851 CG2 ILE C 384 26.718 10.240 -2.879 1.00 0.00 C ATOM 852 CD1 ILE C 384 29.702 10.280 -3.136 1.00 0.00 C ATOM 0 H ILE C 384 26.614 8.590 -4.886 1.00 0.00 H new ATOM 0 HA ILE C 384 25.592 11.083 -5.150 1.00 0.00 H new ATOM 0 HB ILE C 384 27.680 11.842 -3.944 1.00 0.00 H new ATOM 0 HG12 ILE C 384 28.545 8.945 -4.382 1.00 0.00 H new ATOM 0 HG13 ILE C 384 29.224 10.311 -5.244 1.00 0.00 H new ATOM 0 HG21 ILE C 384 27.350 10.346 -1.997 1.00 0.00 H new ATOM 0 HG22 ILE C 384 25.792 10.796 -2.732 1.00 0.00 H new ATOM 0 HG23 ILE C 384 26.487 9.186 -3.035 1.00 0.00 H new ATOM 0 HD11 ILE C 384 30.629 9.726 -3.284 1.00 0.00 H new ATOM 0 HD12 ILE C 384 29.921 11.346 -3.082 1.00 0.00 H new ATOM 0 HD13 ILE C 384 29.232 9.959 -2.206 1.00 0.00 H new TER 864 ILE C 384 HETATM 865 ZN ZN C 900 7.010 -1.722 -7.752 1.00 0.00 ZN HETATM 866 ZN ZN C 901 19.201 0.220 0.810 1.00 0.00 ZN