USER MOD reduce.3.24.130724 H: found=0, std=0, add=418, rem=0, adj=11 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 Single : C 330 THR OG1 : rot -110:sc= 1.07 USER MOD Single : C 337 ASN : amide:sc= -0.0027 K(o=-0.0027,f=-1.1) USER MOD Single : C 338 ASN : amide:sc= -3.63! C(o=-3.6!,f=-6.8!) USER MOD Single : C 347 SER OG : rot 180:sc= 0 USER MOD Single : C 348 MET CE :methyl 177:sc= 0 (180deg=-0.0109) USER MOD Single : C 349 GLN : amide:sc= -1.54 K(o=-1.5,f=-0.3) USER MOD Single : C 353 LYS NZ :NH3+ -161:sc= -0.0461 (180deg=-0.475) USER MOD Single : C 358 HIS : no HE2:sc= -0.378! C(o=-0.38!,f=-12!) USER MOD Single : C 361 HIS : no HD1:sc= -2.06 K(o=-2.1,f=-1.3) USER MOD Single : C 362 ASN : amide:sc= -1.45! C(o=-1.5!,f=-7.2!) 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= -0.0179 K(o=-0.018,f=-1.8!) USER MOD Single : C 373 THR OG1 : rot 180:sc= 0.027 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 180:sc= 0 USER MOD Single : C 383 ASN : amide:sc= -0.373 X(o=-0.37,f=-0.7) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA C 327 15.397 0.612 -17.362 1.00 0.00 N ATOM 2 CA ALA C 327 16.864 0.388 -17.233 1.00 0.00 C ATOM 3 C ALA C 327 17.113 -0.789 -16.300 1.00 0.00 C ATOM 4 O ALA C 327 17.840 -0.666 -15.315 1.00 0.00 O ATOM 5 CB ALA C 327 17.524 1.646 -16.665 1.00 0.00 C ATOM 0 HA ALA C 327 17.290 0.170 -18.213 1.00 0.00 H new ATOM 0 HB1 ALA C 327 18.598 1.483 -16.570 1.00 0.00 H new ATOM 0 HB2 ALA C 327 17.343 2.486 -17.335 1.00 0.00 H new ATOM 0 HB3 ALA C 327 17.103 1.867 -15.684 1.00 0.00 H new ATOM 11 N VAL C 328 16.510 -1.933 -16.615 1.00 0.00 N ATOM 12 CA VAL C 328 16.674 -3.132 -15.792 1.00 0.00 C ATOM 13 C VAL C 328 17.611 -4.115 -16.482 1.00 0.00 C ATOM 14 O VAL C 328 17.379 -4.508 -17.626 1.00 0.00 O ATOM 15 CB VAL C 328 15.314 -3.799 -15.569 1.00 0.00 C ATOM 16 CG1 VAL C 328 15.461 -4.952 -14.566 1.00 0.00 C ATOM 17 CG2 VAL C 328 14.323 -2.762 -15.028 1.00 0.00 C ATOM 0 H VAL C 328 15.907 -2.056 -17.428 1.00 0.00 H new ATOM 0 HA VAL C 328 17.100 -2.843 -14.831 1.00 0.00 H new ATOM 0 HB VAL C 328 14.943 -4.196 -16.514 1.00 0.00 H new ATOM 0 HG11 VAL C 328 14.491 -5.424 -14.410 1.00 0.00 H new ATOM 0 HG12 VAL C 328 16.164 -5.687 -14.957 1.00 0.00 H new ATOM 0 HG13 VAL C 328 15.833 -4.564 -13.618 1.00 0.00 H new ATOM 0 HG21 VAL C 328 13.354 -3.234 -14.868 1.00 0.00 H new ATOM 0 HG22 VAL C 328 14.693 -2.364 -14.083 1.00 0.00 H new ATOM 0 HG23 VAL C 328 14.217 -1.950 -15.747 1.00 0.00 H new ATOM 27 N ALA C 329 18.668 -4.507 -15.780 1.00 0.00 N ATOM 28 CA ALA C 329 19.642 -5.448 -16.326 1.00 0.00 C ATOM 29 C ALA C 329 19.343 -6.859 -15.845 1.00 0.00 C ATOM 30 O ALA C 329 19.838 -7.834 -16.409 1.00 0.00 O ATOM 31 CB ALA C 329 21.051 -5.052 -15.880 1.00 0.00 C ATOM 0 H ALA C 329 18.873 -4.189 -14.833 1.00 0.00 H new ATOM 0 HA ALA C 329 19.579 -5.421 -17.414 1.00 0.00 H new ATOM 0 HB1 ALA C 329 21.774 -5.757 -16.290 1.00 0.00 H new ATOM 0 HB2 ALA C 329 21.278 -4.049 -16.240 1.00 0.00 H new ATOM 0 HB3 ALA C 329 21.106 -5.068 -14.791 1.00 0.00 H new ATOM 37 N THR C 330 18.536 -6.968 -14.792 1.00 0.00 N ATOM 38 CA THR C 330 18.193 -8.278 -14.247 1.00 0.00 C ATOM 39 C THR C 330 17.020 -8.897 -15.015 1.00 0.00 C ATOM 40 O THR C 330 16.121 -8.180 -15.455 1.00 0.00 O ATOM 41 CB THR C 330 17.816 -8.145 -12.767 1.00 0.00 C ATOM 42 OG1 THR C 330 16.437 -7.816 -12.659 1.00 0.00 O ATOM 43 CG2 THR C 330 18.660 -7.047 -12.117 1.00 0.00 C ATOM 0 H THR C 330 18.113 -6.177 -14.306 1.00 0.00 H new ATOM 0 HA THR C 330 19.062 -8.928 -14.349 1.00 0.00 H new ATOM 0 HB THR C 330 18.005 -9.090 -12.258 1.00 0.00 H new ATOM 0 HG1 THR C 330 16.345 -6.891 -12.348 1.00 0.00 H new ATOM 0 HG21 THR C 330 18.390 -6.955 -11.065 1.00 0.00 H new ATOM 0 HG22 THR C 330 19.716 -7.303 -12.199 1.00 0.00 H new ATOM 0 HG23 THR C 330 18.476 -6.099 -12.623 1.00 0.00 H new ATOM 51 N PRO C 331 17.001 -10.201 -15.172 1.00 0.00 N ATOM 52 CA PRO C 331 15.901 -10.913 -15.893 1.00 0.00 C ATOM 53 C PRO C 331 14.614 -10.975 -15.070 1.00 0.00 C ATOM 54 O PRO C 331 14.642 -10.857 -13.846 1.00 0.00 O ATOM 55 CB PRO C 331 16.477 -12.314 -16.125 1.00 0.00 C ATOM 56 CG PRO C 331 17.397 -12.527 -14.970 1.00 0.00 C ATOM 57 CD PRO C 331 18.022 -11.154 -14.682 1.00 0.00 C ATOM 0 HA PRO C 331 15.615 -10.405 -16.814 1.00 0.00 H new ATOM 0 HB2 PRO C 331 15.691 -13.068 -16.152 1.00 0.00 H new ATOM 0 HB3 PRO C 331 17.009 -12.374 -17.074 1.00 0.00 H new ATOM 0 HG2 PRO C 331 16.855 -12.901 -14.101 1.00 0.00 H new ATOM 0 HG3 PRO C 331 18.163 -13.264 -15.210 1.00 0.00 H new ATOM 0 HD2 PRO C 331 18.221 -11.018 -13.619 1.00 0.00 H new ATOM 0 HD3 PRO C 331 18.971 -11.028 -15.202 1.00 0.00 H new ATOM 65 N GLU C 332 13.495 -11.180 -15.754 1.00 0.00 N ATOM 66 CA GLU C 332 12.210 -11.282 -15.079 1.00 0.00 C ATOM 67 C GLU C 332 12.246 -12.417 -14.062 1.00 0.00 C ATOM 68 O GLU C 332 11.435 -12.459 -13.134 1.00 0.00 O ATOM 69 CB GLU C 332 11.103 -11.536 -16.103 1.00 0.00 C ATOM 70 CG GLU C 332 11.421 -12.804 -16.898 1.00 0.00 C ATOM 71 CD GLU C 332 10.324 -13.064 -17.926 1.00 0.00 C ATOM 72 OE1 GLU C 332 9.320 -12.373 -17.880 1.00 0.00 O ATOM 73 OE2 GLU C 332 10.508 -13.949 -18.747 1.00 0.00 O ATOM 0 H GLU C 332 13.452 -11.278 -16.768 1.00 0.00 H new ATOM 0 HA GLU C 332 12.006 -10.346 -14.559 1.00 0.00 H new ATOM 0 HB2 GLU C 332 10.143 -11.643 -15.597 1.00 0.00 H new ATOM 0 HB3 GLU C 332 11.015 -10.684 -16.777 1.00 0.00 H new ATOM 0 HG2 GLU C 332 12.383 -12.697 -17.400 1.00 0.00 H new ATOM 0 HG3 GLU C 332 11.507 -13.655 -16.222 1.00 0.00 H new ATOM 80 N GLU C 333 13.192 -13.332 -14.242 1.00 0.00 N ATOM 81 CA GLU C 333 13.335 -14.463 -13.337 1.00 0.00 C ATOM 82 C GLU C 333 13.508 -13.983 -11.904 1.00 0.00 C ATOM 83 O GLU C 333 12.910 -14.529 -10.977 1.00 0.00 O ATOM 84 CB GLU C 333 14.550 -15.303 -13.749 1.00 0.00 C ATOM 85 CG GLU C 333 14.231 -16.069 -15.034 1.00 0.00 C ATOM 86 CD GLU C 333 15.443 -16.891 -15.463 1.00 0.00 C ATOM 87 OE1 GLU C 333 16.434 -16.861 -14.754 1.00 0.00 O ATOM 88 OE2 GLU C 333 15.360 -17.538 -16.492 1.00 0.00 O ATOM 0 H GLU C 333 13.869 -13.312 -15.005 1.00 0.00 H new ATOM 0 HA GLU C 333 12.433 -15.072 -13.395 1.00 0.00 H new ATOM 0 HB2 GLU C 333 15.415 -14.658 -13.903 1.00 0.00 H new ATOM 0 HB3 GLU C 333 14.810 -16.000 -12.953 1.00 0.00 H new ATOM 0 HG2 GLU C 333 13.375 -16.724 -14.874 1.00 0.00 H new ATOM 0 HG3 GLU C 333 13.955 -15.371 -15.825 1.00 0.00 H new ATOM 95 N LEU C 334 14.326 -12.955 -11.730 1.00 0.00 N ATOM 96 CA LEU C 334 14.565 -12.408 -10.402 1.00 0.00 C ATOM 97 C LEU C 334 13.274 -11.858 -9.808 1.00 0.00 C ATOM 98 O LEU C 334 12.982 -12.069 -8.631 1.00 0.00 O ATOM 99 CB LEU C 334 15.615 -11.293 -10.473 1.00 0.00 C ATOM 100 CG LEU C 334 15.822 -10.667 -9.082 1.00 0.00 C ATOM 101 CD1 LEU C 334 16.229 -11.751 -8.070 1.00 0.00 C ATOM 102 CD2 LEU C 334 16.917 -9.597 -9.168 1.00 0.00 C ATOM 0 H LEU C 334 14.831 -12.487 -12.483 1.00 0.00 H new ATOM 0 HA LEU C 334 14.933 -13.210 -9.762 1.00 0.00 H new ATOM 0 HB2 LEU C 334 16.558 -11.695 -10.843 1.00 0.00 H new ATOM 0 HB3 LEU C 334 15.296 -10.528 -11.180 1.00 0.00 H new ATOM 0 HG LEU C 334 14.890 -10.210 -8.749 1.00 0.00 H new ATOM 0 HD11 LEU C 334 16.373 -11.298 -7.089 1.00 0.00 H new ATOM 0 HD12 LEU C 334 15.444 -12.505 -8.009 1.00 0.00 H new ATOM 0 HD13 LEU C 334 17.159 -12.220 -8.393 1.00 0.00 H new ATOM 0 HD21 LEU C 334 17.067 -9.150 -8.185 1.00 0.00 H new ATOM 0 HD22 LEU C 334 17.847 -10.055 -9.505 1.00 0.00 H new ATOM 0 HD23 LEU C 334 16.616 -8.824 -9.875 1.00 0.00 H new ATOM 114 N ALA C 335 12.509 -11.146 -10.625 1.00 0.00 N ATOM 115 CA ALA C 335 11.258 -10.566 -10.161 1.00 0.00 C ATOM 116 C ALA C 335 10.309 -11.653 -9.675 1.00 0.00 C ATOM 117 O ALA C 335 9.706 -11.533 -8.607 1.00 0.00 O ATOM 118 CB ALA C 335 10.601 -9.775 -11.294 1.00 0.00 C ATOM 0 H ALA C 335 12.731 -10.958 -11.603 1.00 0.00 H new ATOM 0 HA ALA C 335 11.475 -9.896 -9.329 1.00 0.00 H new ATOM 0 HB1 ALA C 335 9.665 -9.343 -10.941 1.00 0.00 H new ATOM 0 HB2 ALA C 335 11.270 -8.977 -11.616 1.00 0.00 H new ATOM 0 HB3 ALA C 335 10.400 -10.441 -12.133 1.00 0.00 H new ATOM 124 N VAL C 336 10.184 -12.716 -10.461 1.00 0.00 N ATOM 125 CA VAL C 336 9.302 -13.815 -10.100 1.00 0.00 C ATOM 126 C VAL C 336 9.735 -14.430 -8.772 1.00 0.00 C ATOM 127 O VAL C 336 8.909 -14.680 -7.895 1.00 0.00 O ATOM 128 CB VAL C 336 9.334 -14.885 -11.195 1.00 0.00 C ATOM 129 CG1 VAL C 336 8.528 -16.107 -10.748 1.00 0.00 C ATOM 130 CG2 VAL C 336 8.722 -14.318 -12.479 1.00 0.00 C ATOM 0 H VAL C 336 10.678 -12.838 -11.345 1.00 0.00 H new ATOM 0 HA VAL C 336 8.288 -13.430 -9.996 1.00 0.00 H new ATOM 0 HB VAL C 336 10.367 -15.180 -11.379 1.00 0.00 H new ATOM 0 HG11 VAL C 336 8.554 -16.866 -11.530 1.00 0.00 H new ATOM 0 HG12 VAL C 336 8.961 -16.514 -9.834 1.00 0.00 H new ATOM 0 HG13 VAL C 336 7.495 -15.813 -10.561 1.00 0.00 H new ATOM 0 HG21 VAL C 336 8.744 -15.079 -13.259 1.00 0.00 H new ATOM 0 HG22 VAL C 336 7.690 -14.022 -12.290 1.00 0.00 H new ATOM 0 HG23 VAL C 336 9.295 -13.449 -12.803 1.00 0.00 H new ATOM 140 N ASN C 337 11.032 -14.664 -8.635 1.00 0.00 N ATOM 141 CA ASN C 337 11.565 -15.245 -7.409 1.00 0.00 C ATOM 142 C ASN C 337 11.319 -14.310 -6.232 1.00 0.00 C ATOM 143 O ASN C 337 11.084 -14.760 -5.110 1.00 0.00 O ATOM 144 CB ASN C 337 13.064 -15.514 -7.556 1.00 0.00 C ATOM 145 CG ASN C 337 13.614 -16.120 -6.270 1.00 0.00 C ATOM 146 OD1 ASN C 337 12.898 -16.832 -5.562 1.00 0.00 O ATOM 147 ND2 ASN C 337 14.847 -15.881 -5.922 1.00 0.00 N ATOM 0 H ASN C 337 11.731 -14.463 -9.350 1.00 0.00 H new ATOM 0 HA ASN C 337 11.054 -16.190 -7.223 1.00 0.00 H new ATOM 0 HB2 ASN C 337 13.240 -16.192 -8.391 1.00 0.00 H new ATOM 0 HB3 ASN C 337 13.588 -14.586 -7.783 1.00 0.00 H new ATOM 0 HD21 ASN C 337 15.221 -16.283 -5.063 1.00 0.00 H new ATOM 0 HD22 ASN C 337 15.438 -15.292 -6.509 1.00 0.00 H new ATOM 154 N ASN C 338 11.386 -13.002 -6.494 1.00 0.00 N ATOM 155 CA ASN C 338 11.175 -11.998 -5.450 1.00 0.00 C ATOM 156 C ASN C 338 10.039 -11.058 -5.840 1.00 0.00 C ATOM 157 O ASN C 338 10.255 -9.872 -6.090 1.00 0.00 O ATOM 158 CB ASN C 338 12.464 -11.194 -5.238 1.00 0.00 C ATOM 159 CG ASN C 338 12.458 -10.546 -3.855 1.00 0.00 C ATOM 160 OD1 ASN C 338 11.421 -10.502 -3.196 1.00 0.00 O ATOM 161 ND2 ASN C 338 13.559 -10.044 -3.372 1.00 0.00 N ATOM 0 H ASN C 338 11.584 -12.615 -7.417 1.00 0.00 H new ATOM 0 HA ASN C 338 10.908 -12.505 -4.523 1.00 0.00 H new ATOM 0 HB2 ASN C 338 13.330 -11.848 -5.338 1.00 0.00 H new ATOM 0 HB3 ASN C 338 12.554 -10.427 -6.007 1.00 0.00 H new ATOM 0 HD21 ASN C 338 13.561 -9.614 -2.447 1.00 0.00 H new ATOM 0 HD22 ASN C 338 14.419 -10.081 -3.919 1.00 0.00 H new ATOM 168 N ASP C 339 8.825 -11.596 -5.889 1.00 0.00 N ATOM 169 CA ASP C 339 7.658 -10.802 -6.250 1.00 0.00 C ATOM 170 C ASP C 339 7.158 -10.021 -5.042 1.00 0.00 C ATOM 171 O ASP C 339 6.312 -10.500 -4.288 1.00 0.00 O ATOM 172 CB ASP C 339 6.544 -11.717 -6.762 1.00 0.00 C ATOM 173 CG ASP C 339 6.173 -12.742 -5.694 1.00 0.00 C ATOM 174 OD1 ASP C 339 6.841 -12.771 -4.671 1.00 0.00 O ATOM 175 OD2 ASP C 339 5.232 -13.483 -5.914 1.00 0.00 O ATOM 0 H ASP C 339 8.625 -12.575 -5.684 1.00 0.00 H new ATOM 0 HA ASP C 339 7.942 -10.101 -7.035 1.00 0.00 H new ATOM 0 HB2 ASP C 339 5.669 -11.124 -7.027 1.00 0.00 H new ATOM 0 HB3 ASP C 339 6.870 -12.227 -7.669 1.00 0.00 H new ATOM 180 N ASP C 340 7.684 -8.812 -4.868 1.00 0.00 N ATOM 181 CA ASP C 340 7.287 -7.964 -3.750 1.00 0.00 C ATOM 182 C ASP C 340 8.048 -6.643 -3.788 1.00 0.00 C ATOM 183 O ASP C 340 9.277 -6.626 -3.847 1.00 0.00 O ATOM 184 CB ASP C 340 7.566 -8.673 -2.420 1.00 0.00 C ATOM 185 CG ASP C 340 8.978 -9.244 -2.428 1.00 0.00 C ATOM 186 OD1 ASP C 340 9.741 -8.870 -3.304 1.00 0.00 O ATOM 187 OD2 ASP C 340 9.278 -10.047 -1.560 1.00 0.00 O ATOM 0 H ASP C 340 8.384 -8.399 -5.485 1.00 0.00 H new ATOM 0 HA ASP C 340 6.219 -7.765 -3.835 1.00 0.00 H new ATOM 0 HB2 ASP C 340 7.451 -7.973 -1.593 1.00 0.00 H new ATOM 0 HB3 ASP C 340 6.841 -9.472 -2.264 1.00 0.00 H new ATOM 192 N CYS C 341 7.311 -5.537 -3.750 1.00 0.00 N ATOM 193 CA CYS C 341 7.927 -4.210 -3.778 1.00 0.00 C ATOM 194 C CYS C 341 8.013 -3.630 -2.368 1.00 0.00 C ATOM 195 O CYS C 341 7.171 -3.912 -1.519 1.00 0.00 O ATOM 196 CB CYS C 341 7.102 -3.273 -4.671 1.00 0.00 C ATOM 197 SG CYS C 341 8.180 -1.994 -5.364 1.00 0.00 S ATOM 0 H CYS C 341 6.292 -5.530 -3.700 1.00 0.00 H new ATOM 0 HA CYS C 341 8.935 -4.303 -4.181 1.00 0.00 H new ATOM 0 HB2 CYS C 341 6.631 -3.840 -5.474 1.00 0.00 H new ATOM 0 HB3 CYS C 341 6.301 -2.814 -4.092 1.00 0.00 H new ATOM 202 N ALA C 342 9.044 -2.828 -2.126 1.00 0.00 N ATOM 203 CA ALA C 342 9.229 -2.206 -0.817 1.00 0.00 C ATOM 204 C ALA C 342 8.687 -0.778 -0.828 1.00 0.00 C ATOM 205 O ALA C 342 8.323 -0.234 0.214 1.00 0.00 O ATOM 206 CB ALA C 342 10.717 -2.191 -0.458 1.00 0.00 C ATOM 0 H ALA C 342 9.761 -2.593 -2.813 1.00 0.00 H new ATOM 0 HA ALA C 342 8.682 -2.784 -0.072 1.00 0.00 H new ATOM 0 HB1 ALA C 342 10.851 -1.726 0.519 1.00 0.00 H new ATOM 0 HB2 ALA C 342 11.094 -3.213 -0.428 1.00 0.00 H new ATOM 0 HB3 ALA C 342 11.267 -1.623 -1.208 1.00 0.00 H new ATOM 212 N ILE C 343 8.646 -0.173 -2.016 1.00 0.00 N ATOM 213 CA ILE C 343 8.157 1.198 -2.160 1.00 0.00 C ATOM 214 C ILE C 343 6.668 1.225 -2.493 1.00 0.00 C ATOM 215 O ILE C 343 5.846 1.647 -1.678 1.00 0.00 O ATOM 216 CB ILE C 343 8.939 1.913 -3.262 1.00 0.00 C ATOM 217 CG1 ILE C 343 10.407 2.023 -2.844 1.00 0.00 C ATOM 218 CG2 ILE C 343 8.362 3.316 -3.468 1.00 0.00 C ATOM 219 CD1 ILE C 343 11.250 2.459 -4.043 1.00 0.00 C ATOM 0 H ILE C 343 8.944 -0.609 -2.889 1.00 0.00 H new ATOM 0 HA ILE C 343 8.304 1.709 -1.209 1.00 0.00 H new ATOM 0 HB ILE C 343 8.862 1.350 -4.192 1.00 0.00 H new ATOM 0 HG12 ILE C 343 10.512 2.743 -2.032 1.00 0.00 H new ATOM 0 HG13 ILE C 343 10.761 1.064 -2.467 1.00 0.00 H new ATOM 0 HG21 ILE C 343 8.919 3.827 -4.254 1.00 0.00 H new ATOM 0 HG22 ILE C 343 7.314 3.239 -3.757 1.00 0.00 H new ATOM 0 HG23 ILE C 343 8.442 3.882 -2.540 1.00 0.00 H new ATOM 0 HD11 ILE C 343 12.295 2.537 -3.744 1.00 0.00 H new ATOM 0 HD12 ILE C 343 11.155 1.723 -4.841 1.00 0.00 H new ATOM 0 HD13 ILE C 343 10.901 3.428 -4.400 1.00 0.00 H new ATOM 231 N CYS C 344 6.327 0.794 -3.706 1.00 0.00 N ATOM 232 CA CYS C 344 4.935 0.795 -4.154 1.00 0.00 C ATOM 233 C CYS C 344 4.209 -0.453 -3.671 1.00 0.00 C ATOM 234 O CYS C 344 3.036 -0.660 -3.981 1.00 0.00 O ATOM 235 CB CYS C 344 4.888 0.859 -5.686 1.00 0.00 C ATOM 236 SG CYS C 344 5.234 -0.781 -6.383 1.00 0.00 S ATOM 0 H CYS C 344 6.992 0.441 -4.394 1.00 0.00 H new ATOM 0 HA CYS C 344 4.437 1.668 -3.733 1.00 0.00 H new ATOM 0 HB2 CYS C 344 3.908 1.204 -6.014 1.00 0.00 H new ATOM 0 HB3 CYS C 344 5.619 1.581 -6.051 1.00 0.00 H new ATOM 241 N TRP C 345 4.914 -1.295 -2.925 1.00 0.00 N ATOM 242 CA TRP C 345 4.321 -2.527 -2.425 1.00 0.00 C ATOM 243 C TRP C 345 3.832 -3.394 -3.580 1.00 0.00 C ATOM 244 O TRP C 345 3.986 -3.034 -4.747 1.00 0.00 O ATOM 245 CB TRP C 345 3.153 -2.206 -1.493 1.00 0.00 C ATOM 246 CG TRP C 345 2.734 -3.450 -0.777 1.00 0.00 C ATOM 247 CD1 TRP C 345 3.464 -4.086 0.167 1.00 0.00 C ATOM 248 CD2 TRP C 345 1.506 -4.217 -0.931 1.00 0.00 C ATOM 249 NE1 TRP C 345 2.761 -5.195 0.603 1.00 0.00 N ATOM 250 CE2 TRP C 345 1.549 -5.317 -0.044 1.00 0.00 C ATOM 251 CE3 TRP C 345 0.370 -4.065 -1.747 1.00 0.00 C ATOM 252 CZ2 TRP C 345 0.500 -6.235 0.033 1.00 0.00 C ATOM 253 CZ3 TRP C 345 -0.686 -4.987 -1.673 1.00 0.00 C ATOM 254 CH2 TRP C 345 -0.622 -6.070 -0.784 1.00 0.00 C ATOM 0 H TRP C 345 5.887 -1.149 -2.656 1.00 0.00 H new ATOM 0 HA TRP C 345 5.084 -3.076 -1.872 1.00 0.00 H new ATOM 0 HB2 TRP C 345 3.446 -1.441 -0.774 1.00 0.00 H new ATOM 0 HB3 TRP C 345 2.317 -1.803 -2.065 1.00 0.00 H new ATOM 0 HD1 TRP C 345 4.436 -3.779 0.522 1.00 0.00 H new ATOM 0 HE1 TRP C 345 3.098 -5.843 1.315 1.00 0.00 H new ATOM 0 HE3 TRP C 345 0.310 -3.234 -2.434 1.00 0.00 H new ATOM 0 HZ2 TRP C 345 0.555 -7.067 0.719 1.00 0.00 H new ATOM 0 HZ3 TRP C 345 -1.553 -4.862 -2.305 1.00 0.00 H new ATOM 0 HH2 TRP C 345 -1.438 -6.775 -0.731 1.00 0.00 H new ATOM 265 N ASP C 346 3.245 -4.541 -3.246 1.00 0.00 N ATOM 266 CA ASP C 346 2.735 -5.452 -4.264 1.00 0.00 C ATOM 267 C ASP C 346 3.878 -5.991 -5.120 1.00 0.00 C ATOM 268 O ASP C 346 5.036 -5.968 -4.708 1.00 0.00 O ATOM 269 CB ASP C 346 1.716 -4.728 -5.149 1.00 0.00 C ATOM 270 CG ASP C 346 0.834 -5.742 -5.875 1.00 0.00 C ATOM 271 OD1 ASP C 346 0.172 -6.511 -5.199 1.00 0.00 O ATOM 272 OD2 ASP C 346 0.838 -5.735 -7.096 1.00 0.00 O ATOM 0 H ASP C 346 3.112 -4.859 -2.286 1.00 0.00 H new ATOM 0 HA ASP C 346 2.247 -6.291 -3.768 1.00 0.00 H new ATOM 0 HB2 ASP C 346 1.098 -4.068 -4.540 1.00 0.00 H new ATOM 0 HB3 ASP C 346 2.234 -4.100 -5.874 1.00 0.00 H new ATOM 277 N SER C 347 3.545 -6.471 -6.314 1.00 0.00 N ATOM 278 CA SER C 347 4.547 -7.013 -7.223 1.00 0.00 C ATOM 279 C SER C 347 4.115 -6.810 -8.669 1.00 0.00 C ATOM 280 O SER C 347 2.927 -6.673 -8.958 1.00 0.00 O ATOM 281 CB SER C 347 4.738 -8.502 -6.955 1.00 0.00 C ATOM 282 OG SER C 347 3.474 -9.151 -7.003 1.00 0.00 O ATOM 0 H SER C 347 2.591 -6.495 -6.674 1.00 0.00 H new ATOM 0 HA SER C 347 5.488 -6.489 -7.056 1.00 0.00 H new ATOM 0 HB2 SER C 347 5.410 -8.934 -7.696 1.00 0.00 H new ATOM 0 HB3 SER C 347 5.200 -8.652 -5.979 1.00 0.00 H new ATOM 0 HG SER C 347 3.591 -10.109 -6.833 1.00 0.00 H new ATOM 288 N MET C 348 5.086 -6.795 -9.578 1.00 0.00 N ATOM 289 CA MET C 348 4.797 -6.610 -10.999 1.00 0.00 C ATOM 290 C MET C 348 5.746 -7.451 -11.845 1.00 0.00 C ATOM 291 O MET C 348 5.677 -8.680 -11.835 1.00 0.00 O ATOM 292 CB MET C 348 4.943 -5.133 -11.381 1.00 0.00 C ATOM 293 CG MET C 348 3.899 -4.306 -10.630 1.00 0.00 C ATOM 294 SD MET C 348 4.015 -2.573 -11.142 1.00 0.00 S ATOM 295 CE MET C 348 2.950 -2.699 -12.601 1.00 0.00 C ATOM 0 H MET C 348 6.076 -6.908 -9.359 1.00 0.00 H new ATOM 0 HA MET C 348 3.772 -6.930 -11.187 1.00 0.00 H new ATOM 0 HB2 MET C 348 5.945 -4.781 -11.137 1.00 0.00 H new ATOM 0 HB3 MET C 348 4.815 -5.010 -12.456 1.00 0.00 H new ATOM 0 HG2 MET C 348 2.900 -4.690 -10.835 1.00 0.00 H new ATOM 0 HG3 MET C 348 4.058 -4.390 -9.555 1.00 0.00 H new ATOM 0 HE1 MET C 348 2.835 -1.714 -13.053 1.00 0.00 H new ATOM 0 HE2 MET C 348 3.401 -3.379 -13.323 1.00 0.00 H new ATOM 0 HE3 MET C 348 1.972 -3.080 -12.306 1.00 0.00 H new ATOM 305 N GLN C 349 6.635 -6.782 -12.584 1.00 0.00 N ATOM 306 CA GLN C 349 7.593 -7.476 -13.443 1.00 0.00 C ATOM 307 C GLN C 349 8.965 -6.815 -13.367 1.00 0.00 C ATOM 308 O GLN C 349 9.933 -7.424 -12.909 1.00 0.00 O ATOM 309 CB GLN C 349 7.098 -7.458 -14.891 1.00 0.00 C ATOM 310 CG GLN C 349 5.843 -8.326 -15.025 1.00 0.00 C ATOM 311 CD GLN C 349 6.194 -9.791 -14.792 1.00 0.00 C ATOM 312 OE1 GLN C 349 6.201 -10.256 -13.651 1.00 0.00 O ATOM 313 NE2 GLN C 349 6.493 -10.550 -15.810 1.00 0.00 N ATOM 0 H GLN C 349 6.710 -5.765 -12.604 1.00 0.00 H new ATOM 0 HA GLN C 349 7.681 -8.506 -13.097 1.00 0.00 H new ATOM 0 HB2 GLN C 349 6.877 -6.435 -15.196 1.00 0.00 H new ATOM 0 HB3 GLN C 349 7.879 -7.828 -15.556 1.00 0.00 H new ATOM 0 HG2 GLN C 349 5.090 -8.005 -14.305 1.00 0.00 H new ATOM 0 HG3 GLN C 349 5.409 -8.201 -16.017 1.00 0.00 H new ATOM 0 HE21 GLN C 349 6.487 -10.163 -16.754 1.00 0.00 H new ATOM 0 HE22 GLN C 349 6.733 -11.530 -15.662 1.00 0.00 H new ATOM 322 N ALA C 350 9.045 -5.574 -13.822 1.00 0.00 N ATOM 323 CA ALA C 350 10.311 -4.848 -13.804 1.00 0.00 C ATOM 324 C ALA C 350 10.922 -4.878 -12.404 1.00 0.00 C ATOM 325 O ALA C 350 10.230 -4.676 -11.407 1.00 0.00 O ATOM 326 CB ALA C 350 10.086 -3.399 -14.229 1.00 0.00 C ATOM 0 H ALA C 350 8.258 -5.050 -14.205 1.00 0.00 H new ATOM 0 HA ALA C 350 10.996 -5.330 -14.501 1.00 0.00 H new ATOM 0 HB1 ALA C 350 11.035 -2.864 -14.213 1.00 0.00 H new ATOM 0 HB2 ALA C 350 9.673 -3.376 -15.237 1.00 0.00 H new ATOM 0 HB3 ALA C 350 9.389 -2.922 -13.540 1.00 0.00 H new ATOM 332 N ALA C 351 12.227 -5.148 -12.337 1.00 0.00 N ATOM 333 CA ALA C 351 12.930 -5.215 -11.060 1.00 0.00 C ATOM 334 C ALA C 351 14.399 -4.865 -11.246 1.00 0.00 C ATOM 335 O ALA C 351 15.138 -5.585 -11.913 1.00 0.00 O ATOM 336 CB ALA C 351 12.804 -6.623 -10.486 1.00 0.00 C ATOM 0 H ALA C 351 12.815 -5.323 -13.152 1.00 0.00 H new ATOM 0 HA ALA C 351 12.485 -4.497 -10.371 1.00 0.00 H new ATOM 0 HB1 ALA C 351 13.329 -6.675 -9.532 1.00 0.00 H new ATOM 0 HB2 ALA C 351 11.751 -6.861 -10.335 1.00 0.00 H new ATOM 0 HB3 ALA C 351 13.242 -7.340 -11.181 1.00 0.00 H new ATOM 342 N ARG C 352 14.812 -3.758 -10.638 1.00 0.00 N ATOM 343 CA ARG C 352 16.195 -3.298 -10.725 1.00 0.00 C ATOM 344 C ARG C 352 16.832 -3.339 -9.352 1.00 0.00 C ATOM 345 O ARG C 352 16.133 -3.248 -8.349 1.00 0.00 O ATOM 346 CB ARG C 352 16.244 -1.875 -11.267 1.00 0.00 C ATOM 347 CG ARG C 352 17.680 -1.562 -11.699 1.00 0.00 C ATOM 348 CD ARG C 352 17.716 -0.216 -12.407 1.00 0.00 C ATOM 349 NE ARG C 352 19.037 0.009 -12.994 1.00 0.00 N ATOM 350 CZ ARG C 352 20.013 0.590 -12.302 1.00 0.00 C ATOM 351 NH1 ARG C 352 19.807 0.968 -11.070 1.00 0.00 N ATOM 352 NH2 ARG C 352 21.179 0.779 -12.855 1.00 0.00 N ATOM 0 H ARG C 352 14.206 -3.160 -10.077 1.00 0.00 H new ATOM 0 HA ARG C 352 16.743 -3.954 -11.402 1.00 0.00 H new ATOM 0 HB2 ARG C 352 15.564 -1.769 -12.112 1.00 0.00 H new ATOM 0 HB3 ARG C 352 15.917 -1.169 -10.504 1.00 0.00 H new ATOM 0 HG2 ARG C 352 18.337 -1.545 -10.829 1.00 0.00 H new ATOM 0 HG3 ARG C 352 18.050 -2.344 -12.363 1.00 0.00 H new ATOM 0 HD2 ARG C 352 16.954 -0.186 -13.186 1.00 0.00 H new ATOM 0 HD3 ARG C 352 17.483 0.581 -11.701 1.00 0.00 H new ATOM 0 HE ARG C 352 19.213 -0.286 -13.954 1.00 0.00 H new ATOM 0 HH11 ARG C 352 18.896 0.818 -10.636 1.00 0.00 H new ATOM 0 HH12 ARG C 352 20.557 1.413 -10.541 1.00 0.00 H new ATOM 0 HH21 ARG C 352 21.341 0.481 -13.817 1.00 0.00 H new ATOM 0 HH22 ARG C 352 21.928 1.224 -12.325 1.00 0.00 H new ATOM 366 N LYS C 353 18.157 -3.478 -9.304 1.00 0.00 N ATOM 367 CA LYS C 353 18.871 -3.542 -8.031 1.00 0.00 C ATOM 368 C LYS C 353 19.635 -2.256 -7.759 1.00 0.00 C ATOM 369 O LYS C 353 20.366 -1.763 -8.620 1.00 0.00 O ATOM 370 CB LYS C 353 19.854 -4.714 -8.065 1.00 0.00 C ATOM 371 CG LYS C 353 20.605 -4.802 -6.733 1.00 0.00 C ATOM 372 CD LYS C 353 21.461 -6.067 -6.715 1.00 0.00 C ATOM 373 CE LYS C 353 22.178 -6.176 -5.367 1.00 0.00 C ATOM 374 NZ LYS C 353 23.069 -4.998 -5.177 1.00 0.00 N ATOM 0 H LYS C 353 18.754 -3.548 -10.128 1.00 0.00 H new ATOM 0 HA LYS C 353 18.140 -3.680 -7.235 1.00 0.00 H new ATOM 0 HB2 LYS C 353 19.318 -5.644 -8.253 1.00 0.00 H new ATOM 0 HB3 LYS C 353 20.562 -4.583 -8.884 1.00 0.00 H new ATOM 0 HG2 LYS C 353 21.234 -3.922 -6.599 1.00 0.00 H new ATOM 0 HG3 LYS C 353 19.897 -4.817 -5.904 1.00 0.00 H new ATOM 0 HD2 LYS C 353 20.836 -6.945 -6.879 1.00 0.00 H new ATOM 0 HD3 LYS C 353 22.189 -6.038 -7.526 1.00 0.00 H new ATOM 0 HE2 LYS C 353 21.448 -6.227 -4.559 1.00 0.00 H new ATOM 0 HE3 LYS C 353 22.761 -7.096 -5.328 1.00 0.00 H new ATOM 0 HZ1 LYS C 353 23.779 -5.214 -4.448 1.00 0.00 H new ATOM 0 HZ2 LYS C 353 23.549 -4.777 -6.073 1.00 0.00 H new ATOM 0 HZ3 LYS C 353 22.503 -4.179 -4.877 1.00 0.00 H new ATOM 388 N LEU C 354 19.471 -1.715 -6.552 1.00 0.00 N ATOM 389 CA LEU C 354 20.157 -0.481 -6.178 1.00 0.00 C ATOM 390 C LEU C 354 21.564 -0.794 -5.664 1.00 0.00 C ATOM 391 O LEU C 354 21.846 -1.912 -5.237 1.00 0.00 O ATOM 392 CB LEU C 354 19.347 0.270 -5.090 1.00 0.00 C ATOM 393 CG LEU C 354 18.436 1.325 -5.733 1.00 0.00 C ATOM 394 CD1 LEU C 354 17.299 0.620 -6.471 1.00 0.00 C ATOM 395 CD2 LEU C 354 17.857 2.224 -4.641 1.00 0.00 C ATOM 0 H LEU C 354 18.875 -2.108 -5.824 1.00 0.00 H new ATOM 0 HA LEU C 354 20.239 0.156 -7.059 1.00 0.00 H new ATOM 0 HB2 LEU C 354 18.747 -0.439 -4.520 1.00 0.00 H new ATOM 0 HB3 LEU C 354 20.028 0.749 -4.386 1.00 0.00 H new ATOM 0 HG LEU C 354 19.008 1.931 -6.436 1.00 0.00 H new ATOM 0 HD11 LEU C 354 16.647 1.363 -6.930 1.00 0.00 H new ATOM 0 HD12 LEU C 354 17.713 -0.027 -7.244 1.00 0.00 H new ATOM 0 HD13 LEU C 354 16.724 0.020 -5.765 1.00 0.00 H new ATOM 0 HD21 LEU C 354 17.209 2.975 -5.093 1.00 0.00 H new ATOM 0 HD22 LEU C 354 17.279 1.620 -3.941 1.00 0.00 H new ATOM 0 HD23 LEU C 354 18.669 2.719 -4.108 1.00 0.00 H new ATOM 407 N PRO C 355 22.439 0.178 -5.697 1.00 0.00 N ATOM 408 CA PRO C 355 23.846 0.014 -5.219 1.00 0.00 C ATOM 409 C PRO C 355 23.908 -0.319 -3.726 1.00 0.00 C ATOM 410 O PRO C 355 24.896 -0.874 -3.246 1.00 0.00 O ATOM 411 CB PRO C 355 24.494 1.385 -5.517 1.00 0.00 C ATOM 412 CG PRO C 355 23.350 2.345 -5.620 1.00 0.00 C ATOM 413 CD PRO C 355 22.192 1.544 -6.200 1.00 0.00 C ATOM 0 HA PRO C 355 24.357 -0.814 -5.710 1.00 0.00 H new ATOM 0 HB2 PRO C 355 25.182 1.676 -4.724 1.00 0.00 H new ATOM 0 HB3 PRO C 355 25.069 1.356 -6.443 1.00 0.00 H new ATOM 0 HG2 PRO C 355 23.093 2.754 -4.643 1.00 0.00 H new ATOM 0 HG3 PRO C 355 23.603 3.189 -6.262 1.00 0.00 H new ATOM 0 HD2 PRO C 355 21.229 1.928 -5.864 1.00 0.00 H new ATOM 0 HD3 PRO C 355 22.186 1.577 -7.289 1.00 0.00 H new ATOM 421 N CYS C 356 22.845 0.022 -3.003 1.00 0.00 N ATOM 422 CA CYS C 356 22.793 -0.247 -1.570 1.00 0.00 C ATOM 423 C CYS C 356 22.518 -1.727 -1.306 1.00 0.00 C ATOM 424 O CYS C 356 23.135 -2.337 -0.430 1.00 0.00 O ATOM 425 CB CYS C 356 21.720 0.637 -0.909 1.00 0.00 C ATOM 426 SG CYS C 356 20.106 -0.195 -0.925 1.00 0.00 S ATOM 0 H CYS C 356 22.016 0.480 -3.381 1.00 0.00 H new ATOM 0 HA CYS C 356 23.762 -0.005 -1.132 1.00 0.00 H new ATOM 0 HB2 CYS C 356 22.009 0.862 0.118 1.00 0.00 H new ATOM 0 HB3 CYS C 356 21.650 1.588 -1.436 1.00 0.00 H new ATOM 431 N GLY C 357 21.580 -2.294 -2.065 1.00 0.00 N ATOM 432 CA GLY C 357 21.208 -3.703 -1.912 1.00 0.00 C ATOM 433 C GLY C 357 19.692 -3.847 -1.794 1.00 0.00 C ATOM 434 O GLY C 357 19.190 -4.428 -0.829 1.00 0.00 O ATOM 0 H GLY C 357 21.063 -1.800 -2.792 1.00 0.00 H new ATOM 0 HA2 GLY C 357 21.568 -4.275 -2.767 1.00 0.00 H new ATOM 0 HA3 GLY C 357 21.689 -4.118 -1.026 1.00 0.00 H new ATOM 438 N HIS C 358 18.967 -3.340 -2.788 1.00 0.00 N ATOM 439 CA HIS C 358 17.508 -3.429 -2.785 1.00 0.00 C ATOM 440 C HIS C 358 16.993 -3.590 -4.208 1.00 0.00 C ATOM 441 O HIS C 358 17.543 -3.013 -5.139 1.00 0.00 O ATOM 442 CB HIS C 358 16.915 -2.158 -2.159 1.00 0.00 C ATOM 443 CG HIS C 358 16.988 -2.253 -0.660 1.00 0.00 C ATOM 444 ND1 HIS C 358 18.012 -1.673 0.078 1.00 0.00 N ATOM 445 CD2 HIS C 358 16.179 -2.882 0.250 1.00 0.00 C ATOM 446 CE1 HIS C 358 17.790 -1.970 1.371 1.00 0.00 C ATOM 447 NE2 HIS C 358 16.686 -2.702 1.531 1.00 0.00 N ATOM 0 H HIS C 358 19.362 -2.866 -3.601 1.00 0.00 H new ATOM 0 HA HIS C 358 17.205 -4.296 -2.198 1.00 0.00 H new ATOM 0 HB2 HIS C 358 17.462 -1.281 -2.505 1.00 0.00 H new ATOM 0 HB3 HIS C 358 15.879 -2.033 -2.476 1.00 0.00 H new ATOM 0 HD1 HIS C 358 18.788 -1.124 -0.292 1.00 0.00 H new ATOM 0 HD2 HIS C 358 15.283 -3.434 0.008 1.00 0.00 H new ATOM 0 HE1 HIS C 358 18.429 -1.654 2.182 1.00 0.00 H new ATOM 455 N LEU C 359 15.928 -4.382 -4.372 1.00 0.00 N ATOM 456 CA LEU C 359 15.353 -4.613 -5.702 1.00 0.00 C ATOM 457 C LEU C 359 14.109 -3.761 -5.900 1.00 0.00 C ATOM 458 O LEU C 359 13.086 -4.007 -5.263 1.00 0.00 O ATOM 459 CB LEU C 359 14.965 -6.081 -5.832 1.00 0.00 C ATOM 460 CG LEU C 359 16.167 -6.962 -5.484 1.00 0.00 C ATOM 461 CD1 LEU C 359 15.741 -8.431 -5.513 1.00 0.00 C ATOM 462 CD2 LEU C 359 17.296 -6.732 -6.497 1.00 0.00 C ATOM 0 H LEU C 359 15.452 -4.868 -3.612 1.00 0.00 H new ATOM 0 HA LEU C 359 16.095 -4.345 -6.455 1.00 0.00 H new ATOM 0 HB2 LEU C 359 14.131 -6.307 -5.168 1.00 0.00 H new ATOM 0 HB3 LEU C 359 14.630 -6.290 -6.848 1.00 0.00 H new ATOM 0 HG LEU C 359 16.527 -6.704 -4.488 1.00 0.00 H new ATOM 0 HD11 LEU C 359 16.594 -9.062 -5.266 1.00 0.00 H new ATOM 0 HD12 LEU C 359 14.946 -8.594 -4.785 1.00 0.00 H new ATOM 0 HD13 LEU C 359 15.378 -8.685 -6.509 1.00 0.00 H new ATOM 0 HD21 LEU C 359 18.148 -7.363 -6.242 1.00 0.00 H new ATOM 0 HD22 LEU C 359 16.944 -6.984 -7.497 1.00 0.00 H new ATOM 0 HD23 LEU C 359 17.599 -5.685 -6.472 1.00 0.00 H new ATOM 474 N PHE C 360 14.204 -2.766 -6.796 1.00 0.00 N ATOM 475 CA PHE C 360 13.086 -1.843 -7.067 1.00 0.00 C ATOM 476 C PHE C 360 12.708 -1.897 -8.536 1.00 0.00 C ATOM 477 O PHE C 360 13.545 -2.069 -9.414 1.00 0.00 O ATOM 478 CB PHE C 360 13.544 -0.420 -6.709 1.00 0.00 C ATOM 479 CG PHE C 360 13.671 -0.233 -5.192 1.00 0.00 C ATOM 480 CD1 PHE C 360 13.217 -1.196 -4.262 1.00 0.00 C ATOM 481 CD2 PHE C 360 14.378 0.879 -4.712 1.00 0.00 C ATOM 482 CE1 PHE C 360 13.456 -1.023 -2.894 1.00 0.00 C ATOM 483 CE2 PHE C 360 14.605 1.045 -3.346 1.00 0.00 C ATOM 484 CZ PHE C 360 14.147 0.098 -2.439 1.00 0.00 C ATOM 0 H PHE C 360 15.042 -2.579 -7.346 1.00 0.00 H new ATOM 0 HA PHE C 360 12.217 -2.128 -6.474 1.00 0.00 H new ATOM 0 HB2 PHE C 360 14.504 -0.216 -7.183 1.00 0.00 H new ATOM 0 HB3 PHE C 360 12.832 0.303 -7.107 1.00 0.00 H new ATOM 0 HD1 PHE C 360 12.684 -2.069 -4.609 1.00 0.00 H new ATOM 0 HD2 PHE C 360 14.751 1.615 -5.408 1.00 0.00 H new ATOM 0 HE1 PHE C 360 13.104 -1.761 -2.189 1.00 0.00 H new ATOM 0 HE2 PHE C 360 15.139 1.914 -2.992 1.00 0.00 H new ATOM 0 HZ PHE C 360 14.326 0.230 -1.382 1.00 0.00 H new ATOM 494 N HIS C 361 11.416 -1.751 -8.773 1.00 0.00 N ATOM 495 CA HIS C 361 10.889 -1.790 -10.121 1.00 0.00 C ATOM 496 C HIS C 361 11.352 -0.571 -10.902 1.00 0.00 C ATOM 497 O HIS C 361 11.805 0.415 -10.324 1.00 0.00 O ATOM 498 CB HIS C 361 9.360 -1.840 -10.087 1.00 0.00 C ATOM 499 CG HIS C 361 8.911 -3.010 -9.250 1.00 0.00 C ATOM 500 ND1 HIS C 361 7.618 -3.119 -8.762 1.00 0.00 N ATOM 501 CD2 HIS C 361 9.568 -4.138 -8.822 1.00 0.00 C ATOM 502 CE1 HIS C 361 7.540 -4.279 -8.082 1.00 0.00 C ATOM 503 NE2 HIS C 361 8.700 -4.936 -8.085 1.00 0.00 N ATOM 0 H HIS C 361 10.714 -1.604 -8.047 1.00 0.00 H new ATOM 0 HA HIS C 361 11.261 -2.687 -10.616 1.00 0.00 H new ATOM 0 HB2 HIS C 361 8.965 -0.912 -9.674 1.00 0.00 H new ATOM 0 HB3 HIS C 361 8.966 -1.932 -11.099 1.00 0.00 H new ATOM 0 HD2 HIS C 361 10.603 -4.370 -9.027 1.00 0.00 H new ATOM 0 HE1 HIS C 361 6.645 -4.634 -7.593 1.00 0.00 H new ATOM 0 HE2 HIS C 361 8.906 -5.831 -7.642 1.00 0.00 H new ATOM 511 N ASN C 362 11.252 -0.657 -12.219 1.00 0.00 N ATOM 512 CA ASN C 362 11.683 0.436 -13.073 1.00 0.00 C ATOM 513 C ASN C 362 10.881 1.699 -12.783 1.00 0.00 C ATOM 514 O ASN C 362 11.448 2.779 -12.632 1.00 0.00 O ATOM 515 CB ASN C 362 11.499 0.043 -14.540 1.00 0.00 C ATOM 516 CG ASN C 362 11.913 1.199 -15.443 1.00 0.00 C ATOM 517 OD1 ASN C 362 11.062 1.867 -16.030 1.00 0.00 O ATOM 518 ND2 ASN C 362 13.180 1.476 -15.591 1.00 0.00 N ATOM 0 H ASN C 362 10.879 -1.466 -12.716 1.00 0.00 H new ATOM 0 HA ASN C 362 12.735 0.637 -12.871 1.00 0.00 H new ATOM 0 HB2 ASN C 362 12.097 -0.839 -14.767 1.00 0.00 H new ATOM 0 HB3 ASN C 362 10.458 -0.221 -14.727 1.00 0.00 H new ATOM 0 HD21 ASN C 362 13.466 2.247 -16.194 1.00 0.00 H new ATOM 0 HD22 ASN C 362 13.884 0.921 -15.104 1.00 0.00 H new ATOM 525 N SER C 363 9.562 1.560 -12.702 1.00 0.00 N ATOM 526 CA SER C 363 8.698 2.700 -12.428 1.00 0.00 C ATOM 527 C SER C 363 8.842 3.162 -10.983 1.00 0.00 C ATOM 528 O SER C 363 8.852 4.361 -10.697 1.00 0.00 O ATOM 529 CB SER C 363 7.243 2.319 -12.704 1.00 0.00 C ATOM 530 OG SER C 363 7.043 2.207 -14.104 1.00 0.00 O ATOM 0 H SER C 363 9.071 0.674 -12.822 1.00 0.00 H new ATOM 0 HA SER C 363 8.995 3.521 -13.081 1.00 0.00 H new ATOM 0 HB2 SER C 363 7.004 1.375 -12.215 1.00 0.00 H new ATOM 0 HB3 SER C 363 6.573 3.072 -12.289 1.00 0.00 H new ATOM 0 HG SER C 363 6.111 1.961 -14.283 1.00 0.00 H new ATOM 536 N CYS C 364 8.951 2.203 -10.067 1.00 0.00 N ATOM 537 CA CYS C 364 9.089 2.531 -8.654 1.00 0.00 C ATOM 538 C CYS C 364 10.397 3.261 -8.403 1.00 0.00 C ATOM 539 O CYS C 364 10.432 4.291 -7.726 1.00 0.00 O ATOM 540 CB CYS C 364 9.049 1.255 -7.815 1.00 0.00 C ATOM 541 SG CYS C 364 7.432 0.468 -8.013 1.00 0.00 S ATOM 0 H CYS C 364 8.946 1.205 -10.276 1.00 0.00 H new ATOM 0 HA CYS C 364 8.261 3.180 -8.368 1.00 0.00 H new ATOM 0 HB2 CYS C 364 9.840 0.574 -8.129 1.00 0.00 H new ATOM 0 HB3 CYS C 364 9.227 1.489 -6.766 1.00 0.00 H new ATOM 546 N LEU C 365 11.477 2.729 -8.961 1.00 0.00 N ATOM 547 CA LEU C 365 12.777 3.353 -8.782 1.00 0.00 C ATOM 548 C LEU C 365 12.820 4.710 -9.475 1.00 0.00 C ATOM 549 O LEU C 365 13.018 5.739 -8.830 1.00 0.00 O ATOM 550 CB LEU C 365 13.873 2.436 -9.351 1.00 0.00 C ATOM 551 CG LEU C 365 15.227 3.162 -9.331 1.00 0.00 C ATOM 552 CD1 LEU C 365 15.597 3.570 -7.895 1.00 0.00 C ATOM 553 CD2 LEU C 365 16.303 2.246 -9.919 1.00 0.00 C ATOM 0 H LEU C 365 11.479 1.883 -9.531 1.00 0.00 H new ATOM 0 HA LEU C 365 12.950 3.505 -7.717 1.00 0.00 H new ATOM 0 HB2 LEU C 365 13.933 1.520 -8.764 1.00 0.00 H new ATOM 0 HB3 LEU C 365 13.622 2.145 -10.371 1.00 0.00 H new ATOM 0 HG LEU C 365 15.157 4.067 -9.934 1.00 0.00 H new ATOM 0 HD11 LEU C 365 16.559 4.083 -7.899 1.00 0.00 H new ATOM 0 HD12 LEU C 365 14.832 4.237 -7.498 1.00 0.00 H new ATOM 0 HD13 LEU C 365 15.663 2.680 -7.269 1.00 0.00 H new ATOM 0 HD21 LEU C 365 17.265 2.759 -9.906 1.00 0.00 H new ATOM 0 HD22 LEU C 365 16.370 1.335 -9.325 1.00 0.00 H new ATOM 0 HD23 LEU C 365 16.042 1.991 -10.946 1.00 0.00 H new ATOM 565 N ARG C 366 12.636 4.702 -10.791 1.00 0.00 N ATOM 566 CA ARG C 366 12.671 5.935 -11.570 1.00 0.00 C ATOM 567 C ARG C 366 11.916 7.039 -10.843 1.00 0.00 C ATOM 568 O ARG C 366 12.432 8.141 -10.662 1.00 0.00 O ATOM 569 CB ARG C 366 12.052 5.685 -12.949 1.00 0.00 C ATOM 570 CG ARG C 366 13.065 4.955 -13.840 1.00 0.00 C ATOM 571 CD ARG C 366 12.366 4.480 -15.118 1.00 0.00 C ATOM 572 NE ARG C 366 11.897 5.622 -15.895 1.00 0.00 N ATOM 573 CZ ARG C 366 11.113 5.460 -16.958 1.00 0.00 C ATOM 574 NH1 ARG C 366 10.746 4.261 -17.320 1.00 0.00 N ATOM 575 NH2 ARG C 366 10.709 6.500 -17.637 1.00 0.00 N ATOM 0 H ARG C 366 12.462 3.859 -11.339 1.00 0.00 H new ATOM 0 HA ARG C 366 13.706 6.252 -11.695 1.00 0.00 H new ATOM 0 HB2 ARG C 366 11.144 5.090 -12.849 1.00 0.00 H new ATOM 0 HB3 ARG C 366 11.764 6.631 -13.407 1.00 0.00 H new ATOM 0 HG2 ARG C 366 13.892 5.620 -14.090 1.00 0.00 H new ATOM 0 HG3 ARG C 366 13.489 4.105 -13.306 1.00 0.00 H new ATOM 0 HD2 ARG C 366 13.054 3.883 -15.716 1.00 0.00 H new ATOM 0 HD3 ARG C 366 11.525 3.836 -14.862 1.00 0.00 H new ATOM 0 HE ARG C 366 12.175 6.563 -15.618 1.00 0.00 H new ATOM 0 HH11 ARG C 366 11.060 3.449 -16.788 1.00 0.00 H new ATOM 0 HH12 ARG C 366 10.145 4.136 -18.135 1.00 0.00 H new ATOM 0 HH21 ARG C 366 10.994 7.437 -17.353 1.00 0.00 H new ATOM 0 HH22 ARG C 366 10.108 6.375 -18.452 1.00 0.00 H new ATOM 589 N SER C 367 10.705 6.728 -10.418 1.00 0.00 N ATOM 590 CA SER C 367 9.899 7.701 -9.700 1.00 0.00 C ATOM 591 C SER C 367 10.649 8.172 -8.456 1.00 0.00 C ATOM 592 O SER C 367 10.602 9.351 -8.104 1.00 0.00 O ATOM 593 CB SER C 367 8.564 7.080 -9.297 1.00 0.00 C ATOM 594 OG SER C 367 7.766 8.061 -8.651 1.00 0.00 O ATOM 0 H SER C 367 10.261 5.820 -10.555 1.00 0.00 H new ATOM 0 HA SER C 367 9.709 8.555 -10.350 1.00 0.00 H new ATOM 0 HB2 SER C 367 8.048 6.697 -10.177 1.00 0.00 H new ATOM 0 HB3 SER C 367 8.730 6.233 -8.631 1.00 0.00 H new ATOM 0 HG SER C 367 6.907 7.666 -8.392 1.00 0.00 H new ATOM 600 N TRP C 368 11.336 7.246 -7.799 1.00 0.00 N ATOM 601 CA TRP C 368 12.094 7.585 -6.600 1.00 0.00 C ATOM 602 C TRP C 368 13.267 8.506 -6.939 1.00 0.00 C ATOM 603 O TRP C 368 13.532 9.480 -6.233 1.00 0.00 O ATOM 604 CB TRP C 368 12.619 6.304 -5.930 1.00 0.00 C ATOM 605 CG TRP C 368 12.882 6.567 -4.478 1.00 0.00 C ATOM 606 CD1 TRP C 368 14.105 6.741 -3.925 1.00 0.00 C ATOM 607 CD2 TRP C 368 11.920 6.695 -3.394 1.00 0.00 C ATOM 608 NE1 TRP C 368 13.952 6.970 -2.570 1.00 0.00 N ATOM 609 CE2 TRP C 368 12.623 6.947 -2.195 1.00 0.00 C ATOM 610 CE3 TRP C 368 10.516 6.616 -3.337 1.00 0.00 C ATOM 611 CZ2 TRP C 368 11.961 7.116 -0.980 1.00 0.00 C ATOM 612 CZ3 TRP C 368 9.845 6.784 -2.114 1.00 0.00 C ATOM 613 CH2 TRP C 368 10.566 7.032 -0.938 1.00 0.00 C ATOM 0 H TRP C 368 11.385 6.264 -8.072 1.00 0.00 H new ATOM 0 HA TRP C 368 11.429 8.108 -5.913 1.00 0.00 H new ATOM 0 HB2 TRP C 368 11.891 5.500 -6.038 1.00 0.00 H new ATOM 0 HB3 TRP C 368 13.534 5.973 -6.422 1.00 0.00 H new ATOM 0 HD1 TRP C 368 15.045 6.707 -4.455 1.00 0.00 H new ATOM 0 HE1 TRP C 368 14.726 7.136 -1.926 1.00 0.00 H new ATOM 0 HE3 TRP C 368 9.952 6.425 -4.238 1.00 0.00 H new ATOM 0 HZ2 TRP C 368 12.522 7.310 -0.078 1.00 0.00 H new ATOM 0 HZ3 TRP C 368 8.767 6.722 -2.080 1.00 0.00 H new ATOM 0 HH2 TRP C 368 10.045 7.158 -0.001 1.00 0.00 H new ATOM 624 N LEU C 369 13.969 8.180 -8.015 1.00 0.00 N ATOM 625 CA LEU C 369 15.122 8.971 -8.444 1.00 0.00 C ATOM 626 C LEU C 369 14.682 10.383 -8.819 1.00 0.00 C ATOM 627 O LEU C 369 15.413 11.353 -8.605 1.00 0.00 O ATOM 628 CB LEU C 369 15.819 8.301 -9.637 1.00 0.00 C ATOM 629 CG LEU C 369 16.111 6.820 -9.326 1.00 0.00 C ATOM 630 CD1 LEU C 369 16.973 6.229 -10.443 1.00 0.00 C ATOM 631 CD2 LEU C 369 16.834 6.689 -7.975 1.00 0.00 C ATOM 0 H LEU C 369 13.764 7.376 -8.608 1.00 0.00 H new ATOM 0 HA LEU C 369 15.829 9.030 -7.616 1.00 0.00 H new ATOM 0 HB2 LEU C 369 15.189 8.376 -10.523 1.00 0.00 H new ATOM 0 HB3 LEU C 369 16.749 8.822 -9.862 1.00 0.00 H new ATOM 0 HG LEU C 369 15.169 6.274 -9.266 1.00 0.00 H new ATOM 0 HD11 LEU C 369 17.181 5.181 -10.226 1.00 0.00 H new ATOM 0 HD12 LEU C 369 16.441 6.304 -11.392 1.00 0.00 H new ATOM 0 HD13 LEU C 369 17.911 6.780 -10.508 1.00 0.00 H new ATOM 0 HD21 LEU C 369 17.033 5.637 -7.769 1.00 0.00 H new ATOM 0 HD22 LEU C 369 17.776 7.236 -8.012 1.00 0.00 H new ATOM 0 HD23 LEU C 369 16.206 7.100 -7.185 1.00 0.00 H new ATOM 643 N GLU C 370 13.483 10.489 -9.368 1.00 0.00 N ATOM 644 CA GLU C 370 12.941 11.785 -9.753 1.00 0.00 C ATOM 645 C GLU C 370 12.543 12.586 -8.515 1.00 0.00 C ATOM 646 O GLU C 370 12.622 13.814 -8.507 1.00 0.00 O ATOM 647 CB GLU C 370 11.730 11.592 -10.685 1.00 0.00 C ATOM 648 CG GLU C 370 12.199 11.555 -12.143 1.00 0.00 C ATOM 649 CD GLU C 370 13.174 10.402 -12.348 1.00 0.00 C ATOM 650 OE1 GLU C 370 14.360 10.615 -12.160 1.00 0.00 O ATOM 651 OE2 GLU C 370 12.719 9.319 -12.682 1.00 0.00 O ATOM 0 H GLU C 370 12.868 9.698 -9.557 1.00 0.00 H new ATOM 0 HA GLU C 370 13.709 12.344 -10.288 1.00 0.00 H new ATOM 0 HB2 GLU C 370 11.212 10.666 -10.436 1.00 0.00 H new ATOM 0 HB3 GLU C 370 11.017 12.404 -10.543 1.00 0.00 H new ATOM 0 HG2 GLU C 370 11.342 11.440 -12.806 1.00 0.00 H new ATOM 0 HG3 GLU C 370 12.679 12.498 -12.403 1.00 0.00 H new ATOM 658 N GLN C 371 12.099 11.886 -7.474 1.00 0.00 N ATOM 659 CA GLN C 371 11.681 12.549 -6.241 1.00 0.00 C ATOM 660 C GLN C 371 12.870 12.786 -5.318 1.00 0.00 C ATOM 661 O GLN C 371 13.156 13.921 -4.934 1.00 0.00 O ATOM 662 CB GLN C 371 10.637 11.694 -5.525 1.00 0.00 C ATOM 663 CG GLN C 371 10.185 12.404 -4.247 1.00 0.00 C ATOM 664 CD GLN C 371 9.006 11.664 -3.627 1.00 0.00 C ATOM 665 OE1 GLN C 371 8.351 10.864 -4.297 1.00 0.00 O ATOM 666 NE2 GLN C 371 8.695 11.881 -2.378 1.00 0.00 N ATOM 0 H GLN C 371 12.020 10.869 -7.458 1.00 0.00 H new ATOM 0 HA GLN C 371 11.249 13.516 -6.501 1.00 0.00 H new ATOM 0 HB2 GLN C 371 9.782 11.521 -6.179 1.00 0.00 H new ATOM 0 HB3 GLN C 371 11.056 10.717 -5.282 1.00 0.00 H new ATOM 0 HG2 GLN C 371 11.010 12.450 -3.536 1.00 0.00 H new ATOM 0 HG3 GLN C 371 9.901 13.432 -4.473 1.00 0.00 H new ATOM 0 HE21 GLN C 371 9.238 12.544 -1.825 1.00 0.00 H new ATOM 0 HE22 GLN C 371 7.909 11.388 -1.955 1.00 0.00 H new ATOM 675 N ASP C 372 13.557 11.706 -4.961 1.00 0.00 N ATOM 676 CA ASP C 372 14.714 11.799 -4.075 1.00 0.00 C ATOM 677 C ASP C 372 15.720 10.696 -4.387 1.00 0.00 C ATOM 678 O ASP C 372 15.342 9.560 -4.672 1.00 0.00 O ATOM 679 CB ASP C 372 14.265 11.673 -2.619 1.00 0.00 C ATOM 680 CG ASP C 372 15.377 12.139 -1.688 1.00 0.00 C ATOM 681 OD1 ASP C 372 16.466 12.396 -2.178 1.00 0.00 O ATOM 682 OD2 ASP C 372 15.126 12.236 -0.498 1.00 0.00 O ATOM 0 H ASP C 372 13.335 10.759 -5.269 1.00 0.00 H new ATOM 0 HA ASP C 372 15.189 12.767 -4.232 1.00 0.00 H new ATOM 0 HB2 ASP C 372 13.368 12.269 -2.454 1.00 0.00 H new ATOM 0 HB3 ASP C 372 14.005 10.638 -2.398 1.00 0.00 H new ATOM 687 N THR C 373 17.005 11.038 -4.324 1.00 0.00 N ATOM 688 CA THR C 373 18.071 10.074 -4.590 1.00 0.00 C ATOM 689 C THR C 373 18.611 9.517 -3.278 1.00 0.00 C ATOM 690 O THR C 373 19.814 9.570 -3.021 1.00 0.00 O ATOM 691 CB THR C 373 19.205 10.748 -5.367 1.00 0.00 C ATOM 692 OG1 THR C 373 19.481 12.018 -4.792 1.00 0.00 O ATOM 693 CG2 THR C 373 18.792 10.925 -6.830 1.00 0.00 C ATOM 0 H THR C 373 17.334 11.975 -4.091 1.00 0.00 H new ATOM 0 HA THR C 373 17.664 9.257 -5.186 1.00 0.00 H new ATOM 0 HB THR C 373 20.098 10.125 -5.319 1.00 0.00 H new ATOM 0 HG1 THR C 373 20.208 12.450 -5.287 1.00 0.00 H new ATOM 0 HG21 THR C 373 19.601 11.405 -7.381 1.00 0.00 H new ATOM 0 HG22 THR C 373 18.582 9.950 -7.269 1.00 0.00 H new ATOM 0 HG23 THR C 373 17.898 11.547 -6.883 1.00 0.00 H new ATOM 701 N SER C 374 17.718 8.970 -2.457 1.00 0.00 N ATOM 702 CA SER C 374 18.116 8.394 -1.171 1.00 0.00 C ATOM 703 C SER C 374 17.550 6.996 -1.021 1.00 0.00 C ATOM 704 O SER C 374 16.546 6.651 -1.640 1.00 0.00 O ATOM 705 CB SER C 374 17.631 9.272 -0.021 1.00 0.00 C ATOM 706 OG SER C 374 16.297 8.912 0.321 1.00 0.00 O ATOM 0 H SER C 374 16.719 8.912 -2.656 1.00 0.00 H new ATOM 0 HA SER C 374 19.204 8.342 -1.142 1.00 0.00 H new ATOM 0 HB2 SER C 374 18.284 9.152 0.843 1.00 0.00 H new ATOM 0 HB3 SER C 374 17.673 10.323 -0.309 1.00 0.00 H new ATOM 0 HG SER C 374 15.986 9.475 1.061 1.00 0.00 H new ATOM 712 N CYS C 375 18.208 6.185 -0.201 1.00 0.00 N ATOM 713 CA CYS C 375 17.763 4.820 0.009 1.00 0.00 C ATOM 714 C CYS C 375 16.524 4.778 0.924 1.00 0.00 C ATOM 715 O CYS C 375 16.607 5.155 2.086 1.00 0.00 O ATOM 716 CB CYS C 375 18.873 3.998 0.639 1.00 0.00 C ATOM 717 SG CYS C 375 18.323 2.278 0.762 1.00 0.00 S ATOM 0 H CYS C 375 19.043 6.449 0.323 1.00 0.00 H new ATOM 0 HA CYS C 375 17.500 4.402 -0.963 1.00 0.00 H new ATOM 0 HB2 CYS C 375 19.779 4.063 0.037 1.00 0.00 H new ATOM 0 HB3 CYS C 375 19.118 4.388 1.627 1.00 0.00 H new ATOM 722 N PRO C 376 15.392 4.324 0.444 1.00 0.00 N ATOM 723 CA PRO C 376 14.143 4.249 1.267 1.00 0.00 C ATOM 724 C PRO C 376 14.353 3.526 2.600 1.00 0.00 C ATOM 725 O PRO C 376 13.683 3.822 3.589 1.00 0.00 O ATOM 726 CB PRO C 376 13.166 3.461 0.378 1.00 0.00 C ATOM 727 CG PRO C 376 13.659 3.654 -1.018 1.00 0.00 C ATOM 728 CD PRO C 376 15.170 3.835 -0.921 1.00 0.00 C ATOM 0 HA PRO C 376 13.786 5.242 1.540 1.00 0.00 H new ATOM 0 HB2 PRO C 376 13.153 2.405 0.648 1.00 0.00 H new ATOM 0 HB3 PRO C 376 12.147 3.831 0.490 1.00 0.00 H new ATOM 0 HG2 PRO C 376 13.410 2.794 -1.640 1.00 0.00 H new ATOM 0 HG3 PRO C 376 13.192 4.525 -1.477 1.00 0.00 H new ATOM 0 HD2 PRO C 376 15.695 2.896 -1.097 1.00 0.00 H new ATOM 0 HD3 PRO C 376 15.533 4.547 -1.662 1.00 0.00 H new ATOM 736 N THR C 377 15.279 2.569 2.614 1.00 0.00 N ATOM 737 CA THR C 377 15.560 1.792 3.823 1.00 0.00 C ATOM 738 C THR C 377 16.865 2.232 4.465 1.00 0.00 C ATOM 739 O THR C 377 16.885 2.685 5.611 1.00 0.00 O ATOM 740 CB THR C 377 15.633 0.301 3.469 1.00 0.00 C ATOM 741 OG1 THR C 377 14.342 -0.155 3.091 1.00 0.00 O ATOM 742 CG2 THR C 377 16.120 -0.496 4.681 1.00 0.00 C ATOM 0 H THR C 377 15.846 2.313 1.806 1.00 0.00 H new ATOM 0 HA THR C 377 14.755 1.963 4.537 1.00 0.00 H new ATOM 0 HB THR C 377 16.330 0.159 2.643 1.00 0.00 H new ATOM 0 HG1 THR C 377 14.385 -1.107 2.862 1.00 0.00 H new ATOM 0 HG21 THR C 377 16.170 -1.554 4.424 1.00 0.00 H new ATOM 0 HG22 THR C 377 17.110 -0.146 4.973 1.00 0.00 H new ATOM 0 HG23 THR C 377 15.427 -0.356 5.511 1.00 0.00 H new ATOM 750 N CYS C 378 17.960 2.074 3.735 1.00 0.00 N ATOM 751 CA CYS C 378 19.267 2.434 4.266 1.00 0.00 C ATOM 752 C CYS C 378 19.350 3.930 4.542 1.00 0.00 C ATOM 753 O CYS C 378 20.202 4.371 5.311 1.00 0.00 O ATOM 754 CB CYS C 378 20.375 2.030 3.290 1.00 0.00 C ATOM 755 SG CYS C 378 20.117 0.322 2.749 1.00 0.00 S ATOM 0 H CYS C 378 17.971 1.704 2.785 1.00 0.00 H new ATOM 0 HA CYS C 378 19.403 1.896 5.204 1.00 0.00 H new ATOM 0 HB2 CYS C 378 20.376 2.698 2.429 1.00 0.00 H new ATOM 0 HB3 CYS C 378 21.349 2.127 3.770 1.00 0.00 H new ATOM 760 N ARG C 379 18.473 4.704 3.900 1.00 0.00 N ATOM 761 CA ARG C 379 18.467 6.154 4.079 1.00 0.00 C ATOM 762 C ARG C 379 19.804 6.759 3.682 1.00 0.00 C ATOM 763 O ARG C 379 20.132 7.880 4.074 1.00 0.00 O ATOM 764 CB ARG C 379 18.156 6.498 5.538 1.00 0.00 C ATOM 765 CG ARG C 379 16.758 5.977 5.907 1.00 0.00 C ATOM 766 CD ARG C 379 15.688 6.996 5.497 1.00 0.00 C ATOM 767 NE ARG C 379 14.360 6.474 5.794 1.00 0.00 N ATOM 768 CZ ARG C 379 13.799 6.652 6.985 1.00 0.00 C ATOM 769 NH1 ARG C 379 14.442 7.295 7.921 1.00 0.00 N ATOM 770 NH2 ARG C 379 12.607 6.182 7.219 1.00 0.00 N ATOM 0 H ARG C 379 17.764 4.353 3.257 1.00 0.00 H new ATOM 0 HA ARG C 379 17.695 6.573 3.433 1.00 0.00 H new ATOM 0 HB2 ARG C 379 18.905 6.054 6.194 1.00 0.00 H new ATOM 0 HB3 ARG C 379 18.203 7.577 5.685 1.00 0.00 H new ATOM 0 HG2 ARG C 379 16.574 5.025 5.409 1.00 0.00 H new ATOM 0 HG3 ARG C 379 16.702 5.792 6.980 1.00 0.00 H new ATOM 0 HD2 ARG C 379 15.846 7.934 6.029 1.00 0.00 H new ATOM 0 HD3 ARG C 379 15.772 7.215 4.432 1.00 0.00 H new ATOM 0 HE ARG C 379 13.851 5.962 5.073 1.00 0.00 H new ATOM 0 HH11 ARG C 379 15.376 7.661 7.738 1.00 0.00 H new ATOM 0 HH12 ARG C 379 14.010 7.431 8.835 1.00 0.00 H new ATOM 0 HH21 ARG C 379 12.105 5.678 6.488 1.00 0.00 H new ATOM 0 HH22 ARG C 379 12.175 6.318 8.133 1.00 0.00 H new ATOM 784 N MET C 380 20.574 6.016 2.894 1.00 0.00 N ATOM 785 CA MET C 380 21.878 6.485 2.434 1.00 0.00 C ATOM 786 C MET C 380 21.809 6.912 0.972 1.00 0.00 C ATOM 787 O MET C 380 21.218 6.224 0.137 1.00 0.00 O ATOM 788 CB MET C 380 22.917 5.373 2.592 1.00 0.00 C ATOM 789 CG MET C 380 24.317 5.942 2.352 1.00 0.00 C ATOM 790 SD MET C 380 24.756 7.066 3.703 1.00 0.00 S ATOM 791 CE MET C 380 25.528 5.835 4.779 1.00 0.00 C ATOM 0 H MET C 380 20.319 5.087 2.560 1.00 0.00 H new ATOM 0 HA MET C 380 22.168 7.344 3.039 1.00 0.00 H new ATOM 0 HB2 MET C 380 22.855 4.942 3.591 1.00 0.00 H new ATOM 0 HB3 MET C 380 22.714 4.569 1.885 1.00 0.00 H new ATOM 0 HG2 MET C 380 25.044 5.132 2.289 1.00 0.00 H new ATOM 0 HG3 MET C 380 24.347 6.472 1.400 1.00 0.00 H new ATOM 0 HE1 MET C 380 25.879 6.318 5.691 1.00 0.00 H new ATOM 0 HE2 MET C 380 24.799 5.066 5.033 1.00 0.00 H new ATOM 0 HE3 MET C 380 26.372 5.378 4.262 1.00 0.00 H new ATOM 801 N SER C 381 22.423 8.051 0.672 1.00 0.00 N ATOM 802 CA SER C 381 22.441 8.565 -0.691 1.00 0.00 C ATOM 803 C SER C 381 23.276 7.660 -1.588 1.00 0.00 C ATOM 804 O SER C 381 24.362 7.220 -1.208 1.00 0.00 O ATOM 805 CB SER C 381 23.015 9.981 -0.708 1.00 0.00 C ATOM 806 OG SER C 381 22.394 10.754 0.310 1.00 0.00 O ATOM 0 H SER C 381 22.913 8.633 1.351 1.00 0.00 H new ATOM 0 HA SER C 381 21.418 8.588 -1.068 1.00 0.00 H new ATOM 0 HB2 SER C 381 24.093 9.950 -0.550 1.00 0.00 H new ATOM 0 HB3 SER C 381 22.849 10.441 -1.682 1.00 0.00 H new ATOM 0 HG SER C 381 22.762 11.662 0.302 1.00 0.00 H new ATOM 812 N LEU C 382 22.761 7.390 -2.783 1.00 0.00 N ATOM 813 CA LEU C 382 23.461 6.536 -3.740 1.00 0.00 C ATOM 814 C LEU C 382 24.495 7.363 -4.503 1.00 0.00 C ATOM 815 O LEU C 382 24.165 8.375 -5.117 1.00 0.00 O ATOM 816 CB LEU C 382 22.457 5.915 -4.736 1.00 0.00 C ATOM 817 CG LEU C 382 21.252 6.866 -4.933 1.00 0.00 C ATOM 818 CD1 LEU C 382 20.709 6.747 -6.361 1.00 0.00 C ATOM 819 CD2 LEU C 382 20.135 6.508 -3.943 1.00 0.00 C ATOM 0 H LEU C 382 21.865 7.748 -3.113 1.00 0.00 H new ATOM 0 HA LEU C 382 23.962 5.734 -3.198 1.00 0.00 H new ATOM 0 HB2 LEU C 382 22.947 5.732 -5.692 1.00 0.00 H new ATOM 0 HB3 LEU C 382 22.113 4.950 -4.364 1.00 0.00 H new ATOM 0 HG LEU C 382 21.587 7.888 -4.757 1.00 0.00 H new ATOM 0 HD11 LEU C 382 19.862 7.421 -6.485 1.00 0.00 H new ATOM 0 HD12 LEU C 382 21.492 7.013 -7.071 1.00 0.00 H new ATOM 0 HD13 LEU C 382 20.387 5.722 -6.543 1.00 0.00 H new ATOM 0 HD21 LEU C 382 19.291 7.182 -4.088 1.00 0.00 H new ATOM 0 HD22 LEU C 382 19.813 5.481 -4.114 1.00 0.00 H new ATOM 0 HD23 LEU C 382 20.507 6.607 -2.923 1.00 0.00 H new ATOM 831 N ASN C 383 25.746 6.914 -4.462 1.00 0.00 N ATOM 832 CA ASN C 383 26.824 7.610 -5.153 1.00 0.00 C ATOM 833 C ASN C 383 26.969 7.087 -6.579 1.00 0.00 C ATOM 834 O ASN C 383 27.946 7.389 -7.264 1.00 0.00 O ATOM 835 CB ASN C 383 28.135 7.413 -4.396 1.00 0.00 C ATOM 836 CG ASN C 383 29.193 8.366 -4.936 1.00 0.00 C ATOM 837 OD1 ASN C 383 28.945 9.566 -5.052 1.00 0.00 O ATOM 838 ND2 ASN C 383 30.363 7.902 -5.276 1.00 0.00 N ATOM 0 H ASN C 383 26.036 6.075 -3.960 1.00 0.00 H new ATOM 0 HA ASN C 383 26.584 8.673 -5.193 1.00 0.00 H new ATOM 0 HB2 ASN C 383 27.981 7.592 -3.332 1.00 0.00 H new ATOM 0 HB3 ASN C 383 28.474 6.382 -4.500 1.00 0.00 H new ATOM 0 HD21 ASN C 383 31.076 8.534 -5.639 1.00 0.00 H new ATOM 0 HD22 ASN C 383 30.565 6.907 -5.178 1.00 0.00 H new ATOM 845 N ILE C 384 25.991 6.306 -7.014 1.00 0.00 N ATOM 846 CA ILE C 384 26.019 5.747 -8.361 1.00 0.00 C ATOM 847 C ILE C 384 24.638 5.245 -8.769 1.00 0.00 C ATOM 848 O ILE C 384 24.341 5.284 -9.952 1.00 0.00 O ATOM 849 CB ILE C 384 27.032 4.599 -8.428 1.00 0.00 C ATOM 850 CG1 ILE C 384 27.219 4.154 -9.887 1.00 0.00 C ATOM 851 CG2 ILE C 384 26.524 3.420 -7.594 1.00 0.00 C ATOM 852 CD1 ILE C 384 27.877 5.269 -10.718 1.00 0.00 C ATOM 0 H ILE C 384 25.174 6.046 -6.461 1.00 0.00 H new ATOM 0 HA ILE C 384 26.318 6.534 -9.054 1.00 0.00 H new ATOM 0 HB ILE C 384 27.988 4.940 -8.032 1.00 0.00 H new ATOM 0 HG12 ILE C 384 27.836 3.256 -9.922 1.00 0.00 H new ATOM 0 HG13 ILE C 384 26.253 3.894 -10.319 1.00 0.00 H new ATOM 0 HG21 ILE C 384 27.244 2.603 -7.642 1.00 0.00 H new ATOM 0 HG22 ILE C 384 26.400 3.734 -6.558 1.00 0.00 H new ATOM 0 HG23 ILE C 384 25.566 3.082 -7.988 1.00 0.00 H new ATOM 0 HD11 ILE C 384 28.000 4.932 -11.747 1.00 0.00 H new ATOM 0 HD12 ILE C 384 27.245 6.157 -10.700 1.00 0.00 H new ATOM 0 HD13 ILE C 384 28.853 5.509 -10.296 1.00 0.00 H new TER 864 ILE C 384 HETATM 865 ZN ZN C 900 7.214 -1.665 -7.326 1.00 0.00 ZN HETATM 866 ZN ZN C 901 18.750 0.130 0.830 1.00 0.00 ZN