USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 479 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 Set 1.1: A 254 THR OG1 : rot -3:sc= 1.22 USER MOD Set 1.2: A 285 HIS : no HD1:sc=-0.00127 K(o=1.2,f=0.61) USER MOD Set 2.1: A 239 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 265 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 GLN : amide:sc= -0.745 K(o=-0.75,f=0) USER MOD Single : A 245 LYS NZ :NH3+ -161:sc= -1.96! (180deg=-2.99!) USER MOD Single : A 249 ASN : amide:sc= -1.29! K(o=-1.3!,f=-0.041) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0265) USER MOD Single : A 267 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 LYS NZ :NH3+ 147:sc= 1.15 (180deg=0.843) USER MOD Single : A 270 ASN : amide:sc= -6.27! C(o=-6.3!,f=-9.4!) USER MOD Single : A 272 SER OG : rot 180:sc= 0 USER MOD Single : A 274 GLN : amide:sc= -1.25 K(o=-1.2,f=-0.3) USER MOD Single : A 279 CYS SG : rot 37:sc= -7! USER MOD Single : A 280 ASN : amide:sc= -0.51 K(o=-0.51,f=-0.0047) USER MOD Single : A 282 LYS NZ :NH3+ -167:sc= 0.808 (180deg=0.697) USER MOD Single : A 289 THR OG1 : rot -29:sc= 0.59 USER MOD Single : A 290 HIS : no HE2:sc= -3.55! C(o=-3.6!,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 237 11.247 -5.374 1.212 1.00 0.00 N ATOM 9 CA PRO A 237 9.891 -4.887 1.461 1.00 0.00 C ATOM 10 C PRO A 237 9.853 -3.430 1.921 1.00 0.00 C ATOM 11 O PRO A 237 10.592 -3.025 2.817 1.00 0.00 O ATOM 12 CB PRO A 237 9.371 -5.804 2.575 1.00 0.00 C ATOM 13 CG PRO A 237 10.355 -6.920 2.689 1.00 0.00 C ATOM 14 CD PRO A 237 11.663 -6.382 2.193 1.00 0.00 C ATOM 0 HA PRO A 237 9.292 -4.911 0.550 1.00 0.00 H new ATOM 0 HB2 PRO A 237 9.286 -5.262 3.517 1.00 0.00 H new ATOM 0 HB3 PRO A 237 8.378 -6.184 2.335 1.00 0.00 H new ATOM 0 HG2 PRO A 237 10.441 -7.259 3.722 1.00 0.00 H new ATOM 0 HG3 PRO A 237 10.039 -7.779 2.097 1.00 0.00 H new ATOM 0 HD2 PRO A 237 12.252 -5.944 2.999 1.00 0.00 H new ATOM 0 HD3 PRO A 237 12.275 -7.161 1.738 1.00 0.00 H new ATOM 22 N ILE A 238 8.985 -2.645 1.307 1.00 0.00 N ATOM 23 CA ILE A 238 8.754 -1.270 1.746 1.00 0.00 C ATOM 24 C ILE A 238 7.574 -1.244 2.692 1.00 0.00 C ATOM 25 O ILE A 238 6.586 -1.948 2.480 1.00 0.00 O ATOM 26 CB ILE A 238 8.506 -0.299 0.549 1.00 0.00 C ATOM 27 CG1 ILE A 238 7.564 0.878 0.912 1.00 0.00 C ATOM 28 CG2 ILE A 238 7.963 -1.061 -0.646 1.00 0.00 C ATOM 29 CD1 ILE A 238 6.158 0.725 0.389 1.00 0.00 C ATOM 0 H ILE A 238 8.426 -2.931 0.503 1.00 0.00 H new ATOM 0 HA ILE A 238 9.653 -0.923 2.255 1.00 0.00 H new ATOM 0 HB ILE A 238 9.471 0.138 0.293 1.00 0.00 H new ATOM 0 HG12 ILE A 238 7.528 0.979 1.997 1.00 0.00 H new ATOM 0 HG13 ILE A 238 7.988 1.803 0.520 1.00 0.00 H new ATOM 0 HG21 ILE A 238 7.795 -0.370 -1.472 1.00 0.00 H new ATOM 0 HG22 ILE A 238 8.682 -1.822 -0.949 1.00 0.00 H new ATOM 0 HG23 ILE A 238 7.021 -1.539 -0.376 1.00 0.00 H new ATOM 0 HD11 ILE A 238 5.563 1.589 0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 238 6.180 0.656 -0.699 1.00 0.00 H new ATOM 0 HD13 ILE A 238 5.713 -0.181 0.801 1.00 0.00 H new ATOM 41 N TYR A 239 7.669 -0.460 3.745 1.00 0.00 N ATOM 42 CA TYR A 239 6.528 -0.270 4.599 1.00 0.00 C ATOM 43 C TYR A 239 5.903 1.034 4.205 1.00 0.00 C ATOM 44 O TYR A 239 6.600 1.943 3.807 1.00 0.00 O ATOM 45 CB TYR A 239 6.915 -0.260 6.075 1.00 0.00 C ATOM 46 CG TYR A 239 6.734 -1.591 6.763 1.00 0.00 C ATOM 47 CD1 TYR A 239 5.598 -2.361 6.541 1.00 0.00 C ATOM 48 CD2 TYR A 239 7.692 -2.074 7.643 1.00 0.00 C ATOM 49 CE1 TYR A 239 5.427 -3.568 7.172 1.00 0.00 C ATOM 50 CE2 TYR A 239 7.524 -3.290 8.281 1.00 0.00 C ATOM 51 CZ TYR A 239 6.387 -4.029 8.040 1.00 0.00 C ATOM 52 OH TYR A 239 6.208 -5.240 8.664 1.00 0.00 O ATOM 0 H TYR A 239 8.510 0.045 4.023 1.00 0.00 H new ATOM 0 HA TYR A 239 5.828 -1.097 4.476 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.957 0.046 6.165 1.00 0.00 H new ATOM 0 HB3 TYR A 239 6.317 0.490 6.592 1.00 0.00 H new ATOM 0 HD1 TYR A 239 4.838 -2.004 5.862 1.00 0.00 H new ATOM 0 HD2 TYR A 239 8.582 -1.492 7.833 1.00 0.00 H new ATOM 0 HE1 TYR A 239 4.539 -4.154 6.986 1.00 0.00 H new ATOM 0 HE2 TYR A 239 8.278 -3.657 8.962 1.00 0.00 H new ATOM 0 HH TYR A 239 6.975 -5.425 9.245 1.00 0.00 H new ATOM 62 N ALA A 240 4.614 1.134 4.243 1.00 0.00 N ATOM 63 CA ALA A 240 4.010 2.384 3.900 1.00 0.00 C ATOM 64 C ALA A 240 2.915 2.730 4.880 1.00 0.00 C ATOM 65 O ALA A 240 1.925 2.012 5.011 1.00 0.00 O ATOM 66 CB ALA A 240 3.515 2.337 2.465 1.00 0.00 C ATOM 0 H ALA A 240 3.970 0.386 4.501 1.00 0.00 H new ATOM 0 HA ALA A 240 4.751 3.181 3.966 1.00 0.00 H new ATOM 0 HB1 ALA A 240 3.055 3.291 2.207 1.00 0.00 H new ATOM 0 HB2 ALA A 240 4.355 2.146 1.797 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.779 1.540 2.360 1.00 0.00 H new ATOM 72 N ARG A 241 3.121 3.825 5.581 1.00 0.00 N ATOM 73 CA ARG A 241 2.150 4.328 6.520 1.00 0.00 C ATOM 74 C ARG A 241 1.163 5.198 5.758 1.00 0.00 C ATOM 75 O ARG A 241 1.455 6.339 5.405 1.00 0.00 O ATOM 76 CB ARG A 241 2.863 5.111 7.631 1.00 0.00 C ATOM 77 CG ARG A 241 1.914 5.884 8.535 1.00 0.00 C ATOM 78 CD ARG A 241 1.150 4.944 9.453 1.00 0.00 C ATOM 79 NE ARG A 241 2.027 4.377 10.481 1.00 0.00 N ATOM 80 CZ ARG A 241 1.671 3.429 11.345 1.00 0.00 C ATOM 81 NH1 ARG A 241 0.431 2.961 11.365 1.00 0.00 N ATOM 82 NH2 ARG A 241 2.565 2.966 12.207 1.00 0.00 N ATOM 0 H ARG A 241 3.968 4.389 5.513 1.00 0.00 H new ATOM 0 HA ARG A 241 1.606 3.512 6.997 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.445 4.417 8.237 1.00 0.00 H new ATOM 0 HB3 ARG A 241 3.569 5.808 7.178 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.478 6.602 9.131 1.00 0.00 H new ATOM 0 HG3 ARG A 241 1.212 6.455 7.928 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.330 5.482 9.928 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.706 4.140 8.866 1.00 0.00 H new ATOM 0 HE ARG A 241 2.980 4.735 10.539 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -0.263 3.327 10.713 1.00 0.00 H new ATOM 0 HH12 ARG A 241 0.171 2.234 12.032 1.00 0.00 H new ATOM 0 HH21 ARG A 241 3.515 3.336 12.204 1.00 0.00 H new ATOM 0 HH22 ARG A 241 2.302 2.240 12.873 1.00 0.00 H new ATOM 96 N VAL A 242 0.000 4.645 5.485 1.00 0.00 N ATOM 97 CA VAL A 242 -0.960 5.318 4.640 1.00 0.00 C ATOM 98 C VAL A 242 -1.785 6.314 5.434 1.00 0.00 C ATOM 99 O VAL A 242 -2.343 5.990 6.482 1.00 0.00 O ATOM 100 CB VAL A 242 -1.880 4.328 3.901 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.545 3.364 4.865 1.00 0.00 C ATOM 102 CG2 VAL A 242 -2.925 5.087 3.109 1.00 0.00 C ATOM 0 H VAL A 242 -0.301 3.735 5.835 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.388 5.860 3.887 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.267 3.741 3.217 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.187 2.680 4.310 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -1.781 2.795 5.396 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.145 3.923 5.583 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.572 4.380 2.589 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.523 5.696 3.786 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -2.433 5.731 2.381 1.00 0.00 H new ATOM 112 N ILE A 243 -1.855 7.527 4.909 1.00 0.00 N ATOM 113 CA ILE A 243 -2.516 8.622 5.588 1.00 0.00 C ATOM 114 C ILE A 243 -3.897 8.888 5.003 1.00 0.00 C ATOM 115 O ILE A 243 -4.575 9.830 5.412 1.00 0.00 O ATOM 116 CB ILE A 243 -1.652 9.911 5.534 1.00 0.00 C ATOM 117 CG1 ILE A 243 -1.298 10.319 4.088 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.381 9.713 6.343 1.00 0.00 C ATOM 119 CD1 ILE A 243 -2.382 11.106 3.384 1.00 0.00 C ATOM 0 H ILE A 243 -1.456 7.776 4.004 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.641 8.330 6.631 1.00 0.00 H new ATOM 0 HB ILE A 243 -2.244 10.720 5.963 1.00 0.00 H new ATOM 0 HG12 ILE A 243 -0.384 10.913 4.103 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -1.084 9.420 3.510 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.222 10.620 6.302 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.639 9.496 7.379 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.188 8.881 5.929 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -2.055 11.353 2.374 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -3.292 10.508 3.334 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -2.582 12.025 3.936 1.00 0.00 H new ATOM 131 N GLN A 244 -4.309 8.045 4.058 1.00 0.00 N ATOM 132 CA GLN A 244 -5.563 8.249 3.343 1.00 0.00 C ATOM 133 C GLN A 244 -5.805 7.122 2.350 1.00 0.00 C ATOM 134 O GLN A 244 -5.177 7.073 1.293 1.00 0.00 O ATOM 135 CB GLN A 244 -5.553 9.585 2.602 1.00 0.00 C ATOM 136 CG GLN A 244 -6.851 9.880 1.867 1.00 0.00 C ATOM 137 CD GLN A 244 -6.863 11.246 1.209 1.00 0.00 C ATOM 138 OE1 GLN A 244 -7.915 11.866 1.071 1.00 0.00 O ATOM 139 NE2 GLN A 244 -5.699 11.724 0.799 1.00 0.00 N ATOM 0 H GLN A 244 -3.791 7.214 3.771 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.367 8.256 4.079 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -5.359 10.386 3.315 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -4.731 9.589 1.887 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -7.013 9.116 1.107 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -7.682 9.814 2.569 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -4.848 11.178 0.932 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -5.653 12.639 0.350 1.00 0.00 H new ATOM 148 N LYS A 245 -6.678 6.201 2.703 1.00 0.00 N ATOM 149 CA LYS A 245 -7.061 5.136 1.793 1.00 0.00 C ATOM 150 C LYS A 245 -8.531 4.774 2.008 1.00 0.00 C ATOM 151 O LYS A 245 -9.123 5.129 3.028 1.00 0.00 O ATOM 152 CB LYS A 245 -6.133 3.924 1.963 1.00 0.00 C ATOM 153 CG LYS A 245 -5.281 3.604 0.730 1.00 0.00 C ATOM 154 CD LYS A 245 -4.012 2.853 1.128 1.00 0.00 C ATOM 155 CE LYS A 245 -3.219 2.330 -0.057 1.00 0.00 C ATOM 156 NZ LYS A 245 -2.285 1.241 0.345 1.00 0.00 N ATOM 0 H LYS A 245 -7.137 6.167 3.613 1.00 0.00 H new ATOM 0 HA LYS A 245 -6.952 5.479 0.764 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.472 4.104 2.810 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.737 3.051 2.210 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -5.860 3.003 0.028 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -5.016 4.528 0.216 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -3.377 3.516 1.716 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -4.282 2.016 1.772 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -3.905 1.959 -0.819 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -2.654 3.147 -0.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.549 1.129 -0.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -1.840 1.483 1.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -2.812 0.350 0.444 1.00 0.00 H new ATOM 170 N ARG A 246 -9.104 4.098 1.032 1.00 0.00 N ATOM 171 CA ARG A 246 -10.525 3.770 1.008 1.00 0.00 C ATOM 172 C ARG A 246 -10.724 2.322 1.480 1.00 0.00 C ATOM 173 O ARG A 246 -9.747 1.646 1.786 1.00 0.00 O ATOM 174 CB ARG A 246 -11.010 4.003 -0.439 1.00 0.00 C ATOM 175 CG ARG A 246 -12.082 3.058 -0.946 1.00 0.00 C ATOM 176 CD ARG A 246 -12.380 3.307 -2.416 1.00 0.00 C ATOM 177 NE ARG A 246 -13.284 2.304 -2.973 1.00 0.00 N ATOM 178 CZ ARG A 246 -12.948 1.471 -3.956 1.00 0.00 C ATOM 179 NH1 ARG A 246 -11.745 1.550 -4.516 1.00 0.00 N ATOM 180 NH2 ARG A 246 -13.818 0.571 -4.387 1.00 0.00 N ATOM 0 H ARG A 246 -8.593 3.754 0.219 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.109 4.394 1.684 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -11.389 5.022 -0.513 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -10.149 3.933 -1.104 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -11.757 2.027 -0.807 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -12.992 3.187 -0.360 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -12.822 4.297 -2.533 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -11.447 3.306 -2.979 1.00 0.00 H new ATOM 0 HE ARG A 246 -14.226 2.238 -2.587 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -11.077 2.250 -4.193 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -11.490 0.911 -5.269 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -14.745 0.516 -3.966 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -13.561 -0.067 -5.140 1.00 0.00 H new ATOM 194 N VAL A 247 -11.974 1.859 1.579 1.00 0.00 N ATOM 195 CA VAL A 247 -12.251 0.447 1.856 1.00 0.00 C ATOM 196 C VAL A 247 -12.635 -0.326 0.571 1.00 0.00 C ATOM 197 O VAL A 247 -13.804 -0.629 0.326 1.00 0.00 O ATOM 198 CB VAL A 247 -13.352 0.277 2.931 1.00 0.00 C ATOM 199 CG1 VAL A 247 -12.812 0.642 4.304 1.00 0.00 C ATOM 200 CG2 VAL A 247 -14.574 1.126 2.607 1.00 0.00 C ATOM 0 H VAL A 247 -12.806 2.439 1.472 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.326 0.021 2.246 1.00 0.00 H new ATOM 0 HB VAL A 247 -13.657 -0.770 2.935 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -13.598 0.517 5.049 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -11.973 -0.009 4.550 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -12.478 1.679 4.299 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -15.330 0.986 3.380 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -14.287 2.177 2.567 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -14.981 0.824 1.642 1.00 0.00 H new ATOM 210 N PRO A 248 -11.631 -0.639 -0.269 1.00 0.00 N ATOM 211 CA PRO A 248 -11.772 -1.413 -1.495 1.00 0.00 C ATOM 212 C PRO A 248 -11.576 -2.898 -1.229 1.00 0.00 C ATOM 213 O PRO A 248 -11.253 -3.295 -0.117 1.00 0.00 O ATOM 214 CB PRO A 248 -10.614 -0.881 -2.366 1.00 0.00 C ATOM 215 CG PRO A 248 -9.873 0.093 -1.500 1.00 0.00 C ATOM 216 CD PRO A 248 -10.247 -0.265 -0.107 1.00 0.00 C ATOM 0 HA PRO A 248 -12.757 -1.312 -1.951 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -9.962 -1.692 -2.690 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -10.991 -0.397 -3.267 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.796 0.015 -1.651 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -10.154 1.120 -1.732 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.643 -1.085 0.282 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -10.126 0.574 0.579 1.00 0.00 H new ATOM 224 N ASN A 249 -11.767 -3.722 -2.237 1.00 0.00 N ATOM 225 CA ASN A 249 -11.538 -5.150 -2.087 1.00 0.00 C ATOM 226 C ASN A 249 -10.621 -5.662 -3.187 1.00 0.00 C ATOM 227 O ASN A 249 -10.239 -4.918 -4.090 1.00 0.00 O ATOM 228 CB ASN A 249 -12.860 -5.934 -2.111 1.00 0.00 C ATOM 229 CG ASN A 249 -13.727 -5.714 -0.879 1.00 0.00 C ATOM 230 OD1 ASN A 249 -14.953 -5.803 -0.949 1.00 0.00 O ATOM 231 ND2 ASN A 249 -13.106 -5.428 0.255 1.00 0.00 N ATOM 0 H ASN A 249 -12.078 -3.434 -3.165 1.00 0.00 H new ATOM 0 HA ASN A 249 -11.061 -5.306 -1.119 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -13.426 -5.648 -2.998 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -12.639 -6.997 -2.203 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -13.645 -5.274 1.107 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -12.088 -5.362 0.277 1.00 0.00 H new ATOM 238 N ALA A 250 -10.263 -6.936 -3.112 1.00 0.00 N ATOM 239 CA ALA A 250 -9.490 -7.576 -4.171 1.00 0.00 C ATOM 240 C ALA A 250 -10.322 -7.679 -5.439 1.00 0.00 C ATOM 241 O ALA A 250 -9.829 -7.982 -6.519 1.00 0.00 O ATOM 242 CB ALA A 250 -9.032 -8.945 -3.726 1.00 0.00 C ATOM 0 H ALA A 250 -10.495 -7.548 -2.330 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.611 -6.968 -4.383 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -8.456 -9.413 -4.524 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -8.409 -8.849 -2.837 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -9.900 -9.562 -3.495 1.00 0.00 H new ATOM 248 N TYR A 251 -11.594 -7.406 -5.280 1.00 0.00 N ATOM 249 CA TYR A 251 -12.524 -7.368 -6.391 1.00 0.00 C ATOM 250 C TYR A 251 -12.532 -5.977 -7.010 1.00 0.00 C ATOM 251 O TYR A 251 -13.316 -5.685 -7.913 1.00 0.00 O ATOM 252 CB TYR A 251 -13.926 -7.764 -5.933 1.00 0.00 C ATOM 253 CG TYR A 251 -14.007 -9.189 -5.435 1.00 0.00 C ATOM 254 CD1 TYR A 251 -13.532 -9.525 -4.179 1.00 0.00 C ATOM 255 CD2 TYR A 251 -14.554 -10.194 -6.222 1.00 0.00 C ATOM 256 CE1 TYR A 251 -13.593 -10.824 -3.713 1.00 0.00 C ATOM 257 CE2 TYR A 251 -14.621 -11.498 -5.765 1.00 0.00 C ATOM 258 CZ TYR A 251 -14.140 -11.807 -4.509 1.00 0.00 C ATOM 259 OH TYR A 251 -14.199 -13.107 -4.052 1.00 0.00 O ATOM 0 H TYR A 251 -12.018 -7.203 -4.375 1.00 0.00 H new ATOM 0 HA TYR A 251 -12.202 -8.086 -7.145 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -14.246 -7.089 -5.139 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -14.622 -7.635 -6.762 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -13.105 -8.757 -3.551 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -14.932 -9.954 -7.205 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -13.214 -11.068 -2.731 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -15.048 -12.270 -6.388 1.00 0.00 H new ATOM 0 HH TYR A 251 -14.614 -13.675 -4.734 1.00 0.00 H new ATOM 269 N ASP A 252 -11.641 -5.122 -6.518 1.00 0.00 N ATOM 270 CA ASP A 252 -11.492 -3.775 -7.051 1.00 0.00 C ATOM 271 C ASP A 252 -10.251 -3.716 -7.910 1.00 0.00 C ATOM 272 O ASP A 252 -9.411 -2.828 -7.748 1.00 0.00 O ATOM 273 CB ASP A 252 -11.378 -2.743 -5.929 1.00 0.00 C ATOM 274 CG ASP A 252 -12.721 -2.275 -5.417 1.00 0.00 C ATOM 275 OD1 ASP A 252 -13.346 -1.415 -6.078 1.00 0.00 O ATOM 276 OD2 ASP A 252 -13.150 -2.742 -4.344 1.00 0.00 O ATOM 0 H ASP A 252 -11.009 -5.341 -5.748 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.377 -3.540 -7.643 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -10.811 -3.173 -5.104 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -10.813 -1.883 -6.290 1.00 0.00 H new ATOM 281 N LYS A 253 -10.137 -4.688 -8.817 1.00 0.00 N ATOM 282 CA LYS A 253 -8.908 -4.912 -9.567 1.00 0.00 C ATOM 283 C LYS A 253 -7.784 -5.185 -8.574 1.00 0.00 C ATOM 284 O LYS A 253 -6.621 -4.856 -8.800 1.00 0.00 O ATOM 285 CB LYS A 253 -8.583 -3.728 -10.494 1.00 0.00 C ATOM 286 CG LYS A 253 -9.593 -3.542 -11.624 1.00 0.00 C ATOM 287 CD LYS A 253 -10.889 -2.909 -11.133 1.00 0.00 C ATOM 288 CE LYS A 253 -12.046 -3.163 -12.091 1.00 0.00 C ATOM 289 NZ LYS A 253 -11.779 -2.642 -13.456 1.00 0.00 N ATOM 0 H LYS A 253 -10.890 -5.336 -9.048 1.00 0.00 H new ATOM 0 HA LYS A 253 -9.030 -5.776 -10.221 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -8.541 -2.814 -9.901 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -7.592 -3.875 -10.924 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -9.156 -2.916 -12.402 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -9.811 -4.509 -12.078 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -11.138 -3.308 -10.150 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -10.746 -1.835 -11.014 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -12.240 -4.234 -12.146 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -12.949 -2.696 -11.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -12.615 -2.794 -14.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -11.570 -1.624 -13.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -10.964 -3.142 -13.865 1.00 0.00 H new ATOM 303 N THR A 254 -8.197 -5.792 -7.459 1.00 0.00 N ATOM 304 CA THR A 254 -7.354 -6.141 -6.333 1.00 0.00 C ATOM 305 C THR A 254 -6.717 -4.907 -5.705 1.00 0.00 C ATOM 306 O THR A 254 -5.578 -4.541 -5.987 1.00 0.00 O ATOM 307 CB THR A 254 -6.295 -7.214 -6.664 1.00 0.00 C ATOM 308 OG1 THR A 254 -5.277 -6.707 -7.537 1.00 0.00 O ATOM 309 CG2 THR A 254 -6.939 -8.433 -7.305 1.00 0.00 C ATOM 0 H THR A 254 -9.171 -6.061 -7.319 1.00 0.00 H new ATOM 0 HA THR A 254 -8.018 -6.593 -5.596 1.00 0.00 H new ATOM 0 HB THR A 254 -5.832 -7.500 -5.719 1.00 0.00 H new ATOM 0 HG1 THR A 254 -5.488 -5.782 -7.784 1.00 0.00 H new ATOM 0 HG21 THR A 254 -6.172 -9.174 -7.529 1.00 0.00 H new ATOM 0 HG22 THR A 254 -7.669 -8.862 -6.619 1.00 0.00 H new ATOM 0 HG23 THR A 254 -7.438 -8.138 -8.228 1.00 0.00 H new ATOM 317 N ALA A 255 -7.490 -4.255 -4.863 1.00 0.00 N ATOM 318 CA ALA A 255 -7.012 -3.100 -4.127 1.00 0.00 C ATOM 319 C ALA A 255 -7.075 -3.361 -2.623 1.00 0.00 C ATOM 320 O ALA A 255 -7.831 -4.214 -2.160 1.00 0.00 O ATOM 321 CB ALA A 255 -7.822 -1.878 -4.508 1.00 0.00 C ATOM 0 H ALA A 255 -8.459 -4.506 -4.669 1.00 0.00 H new ATOM 0 HA ALA A 255 -5.970 -2.915 -4.387 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.459 -1.013 -3.952 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -7.719 -1.692 -5.577 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -8.872 -2.048 -4.269 1.00 0.00 H new ATOM 327 N LEU A 256 -6.257 -2.629 -1.880 1.00 0.00 N ATOM 328 CA LEU A 256 -6.125 -2.812 -0.432 1.00 0.00 C ATOM 329 C LEU A 256 -7.241 -2.115 0.322 1.00 0.00 C ATOM 330 O LEU A 256 -7.499 -0.942 0.086 1.00 0.00 O ATOM 331 CB LEU A 256 -4.789 -2.245 0.075 1.00 0.00 C ATOM 332 CG LEU A 256 -3.543 -3.067 -0.217 1.00 0.00 C ATOM 333 CD1 LEU A 256 -3.614 -4.397 0.502 1.00 0.00 C ATOM 334 CD2 LEU A 256 -3.392 -3.272 -1.697 1.00 0.00 C ATOM 0 H LEU A 256 -5.664 -1.890 -2.259 1.00 0.00 H new ATOM 0 HA LEU A 256 -6.173 -3.886 -0.251 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -4.653 -1.255 -0.360 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -4.864 -2.112 1.154 1.00 0.00 H new ATOM 0 HG LEU A 256 -2.670 -2.525 0.146 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -2.716 -4.976 0.285 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -3.685 -4.227 1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -4.492 -4.947 0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -2.497 -3.862 -1.893 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -4.265 -3.799 -2.082 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -3.305 -2.304 -2.191 1.00 0.00 H new ATOM 346 N ALA A 257 -7.878 -2.831 1.236 1.00 0.00 N ATOM 347 CA ALA A 257 -8.848 -2.234 2.139 1.00 0.00 C ATOM 348 C ALA A 257 -8.164 -1.745 3.404 1.00 0.00 C ATOM 349 O ALA A 257 -7.889 -2.518 4.328 1.00 0.00 O ATOM 350 CB ALA A 257 -9.945 -3.224 2.464 1.00 0.00 C ATOM 0 H ALA A 257 -7.739 -3.832 1.372 1.00 0.00 H new ATOM 0 HA ALA A 257 -9.302 -1.375 1.646 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.663 -2.762 3.141 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -10.451 -3.521 1.545 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -9.512 -4.104 2.940 1.00 0.00 H new ATOM 356 N LEU A 258 -7.876 -0.459 3.419 1.00 0.00 N ATOM 357 CA LEU A 258 -7.139 0.171 4.515 1.00 0.00 C ATOM 358 C LEU A 258 -7.398 1.670 4.498 1.00 0.00 C ATOM 359 O LEU A 258 -7.992 2.177 3.561 1.00 0.00 O ATOM 360 CB LEU A 258 -5.632 -0.143 4.414 1.00 0.00 C ATOM 361 CG LEU A 258 -4.863 0.494 3.254 1.00 0.00 C ATOM 362 CD1 LEU A 258 -3.475 -0.096 3.158 1.00 0.00 C ATOM 363 CD2 LEU A 258 -5.581 0.295 1.939 1.00 0.00 C ATOM 0 H LEU A 258 -8.143 0.186 2.675 1.00 0.00 H new ATOM 0 HA LEU A 258 -7.488 -0.233 5.465 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -5.159 0.168 5.345 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -5.516 -1.224 4.343 1.00 0.00 H new ATOM 0 HG LEU A 258 -4.796 1.563 3.454 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -2.940 0.366 2.329 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -2.936 0.090 4.087 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -3.547 -1.170 2.989 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -5.007 0.760 1.137 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -5.686 -0.771 1.739 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -6.569 0.753 1.991 1.00 0.00 H new ATOM 375 N GLU A 259 -6.950 2.386 5.507 1.00 0.00 N ATOM 376 CA GLU A 259 -7.420 3.750 5.691 1.00 0.00 C ATOM 377 C GLU A 259 -6.335 4.685 6.205 1.00 0.00 C ATOM 378 O GLU A 259 -5.143 4.394 6.123 1.00 0.00 O ATOM 379 CB GLU A 259 -8.599 3.760 6.661 1.00 0.00 C ATOM 380 CG GLU A 259 -8.223 3.353 8.076 1.00 0.00 C ATOM 381 CD GLU A 259 -9.395 3.424 9.026 1.00 0.00 C ATOM 382 OE1 GLU A 259 -10.317 2.592 8.900 1.00 0.00 O ATOM 383 OE2 GLU A 259 -9.409 4.323 9.895 1.00 0.00 O ATOM 0 H GLU A 259 -6.276 2.060 6.200 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.726 4.117 4.711 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -9.033 4.759 6.682 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -9.370 3.085 6.290 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -7.828 2.337 8.066 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -7.425 4.002 8.438 1.00 0.00 H new ATOM 390 N VAL A 260 -6.782 5.817 6.731 1.00 0.00 N ATOM 391 CA VAL A 260 -5.902 6.808 7.324 1.00 0.00 C ATOM 392 C VAL A 260 -5.229 6.282 8.591 1.00 0.00 C ATOM 393 O VAL A 260 -5.893 5.956 9.576 1.00 0.00 O ATOM 394 CB VAL A 260 -6.682 8.091 7.676 1.00 0.00 C ATOM 395 CG1 VAL A 260 -5.775 9.101 8.358 1.00 0.00 C ATOM 396 CG2 VAL A 260 -7.331 8.687 6.435 1.00 0.00 C ATOM 0 H VAL A 260 -7.769 6.072 6.757 1.00 0.00 H new ATOM 0 HA VAL A 260 -5.135 7.031 6.582 1.00 0.00 H new ATOM 0 HB VAL A 260 -7.476 7.827 8.374 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -6.345 9.999 8.598 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -5.375 8.669 9.276 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -4.953 9.361 7.691 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -7.876 9.591 6.708 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -6.561 8.934 5.704 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -8.022 7.963 6.003 1.00 0.00 H new ATOM 406 N GLY A 261 -3.913 6.194 8.550 1.00 0.00 N ATOM 407 CA GLY A 261 -3.151 5.879 9.735 1.00 0.00 C ATOM 408 C GLY A 261 -2.629 4.465 9.707 1.00 0.00 C ATOM 409 O GLY A 261 -1.933 4.034 10.624 1.00 0.00 O ATOM 0 H GLY A 261 -3.354 6.337 7.709 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -2.315 6.573 9.825 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.777 6.018 10.617 1.00 0.00 H new ATOM 413 N GLU A 262 -2.961 3.745 8.648 1.00 0.00 N ATOM 414 CA GLU A 262 -2.686 2.318 8.594 1.00 0.00 C ATOM 415 C GLU A 262 -1.335 2.038 7.962 1.00 0.00 C ATOM 416 O GLU A 262 -0.615 2.957 7.578 1.00 0.00 O ATOM 417 CB GLU A 262 -3.791 1.589 7.837 1.00 0.00 C ATOM 418 CG GLU A 262 -5.128 1.668 8.542 1.00 0.00 C ATOM 419 CD GLU A 262 -5.926 0.390 8.403 1.00 0.00 C ATOM 420 OE1 GLU A 262 -5.541 -0.622 9.030 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.928 0.382 7.666 1.00 0.00 O ATOM 0 H GLU A 262 -3.419 4.122 7.818 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.659 1.945 9.618 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -3.885 2.016 6.838 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.512 0.543 7.712 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -4.967 1.880 9.599 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.703 2.499 8.134 1.00 0.00 H new ATOM 428 N LEU A 263 -0.989 0.767 7.863 1.00 0.00 N ATOM 429 CA LEU A 263 0.299 0.379 7.332 1.00 0.00 C ATOM 430 C LEU A 263 0.162 -0.742 6.313 1.00 0.00 C ATOM 431 O LEU A 263 -0.822 -1.480 6.304 1.00 0.00 O ATOM 432 CB LEU A 263 1.226 -0.047 8.465 1.00 0.00 C ATOM 433 CG LEU A 263 2.614 -0.489 8.016 1.00 0.00 C ATOM 434 CD1 LEU A 263 3.418 0.698 7.527 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.347 -1.198 9.128 1.00 0.00 C ATOM 0 H LEU A 263 -1.584 -0.012 8.144 1.00 0.00 H new ATOM 0 HA LEU A 263 0.729 1.242 6.824 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.331 0.784 9.163 1.00 0.00 H new ATOM 0 HB3 LEU A 263 0.758 -0.865 9.012 1.00 0.00 H new ATOM 0 HG LEU A 263 2.491 -1.191 7.192 1.00 0.00 H new ATOM 0 HD11 LEU A 263 4.406 0.363 7.211 1.00 0.00 H new ATOM 0 HD12 LEU A 263 2.905 1.162 6.685 1.00 0.00 H new ATOM 0 HD13 LEU A 263 3.522 1.424 8.333 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.334 -1.501 8.778 1.00 0.00 H new ATOM 0 HD22 LEU A 263 3.455 -0.526 9.979 1.00 0.00 H new ATOM 0 HD23 LEU A 263 2.783 -2.080 9.431 1.00 0.00 H new ATOM 447 N VAL A 264 1.161 -0.849 5.455 1.00 0.00 N ATOM 448 CA VAL A 264 1.165 -1.825 4.380 1.00 0.00 C ATOM 449 C VAL A 264 2.597 -2.191 4.005 1.00 0.00 C ATOM 450 O VAL A 264 3.456 -1.319 3.912 1.00 0.00 O ATOM 451 CB VAL A 264 0.394 -1.297 3.137 1.00 0.00 C ATOM 452 CG1 VAL A 264 0.766 0.143 2.821 1.00 0.00 C ATOM 453 CG2 VAL A 264 0.648 -2.170 1.920 1.00 0.00 C ATOM 0 H VAL A 264 1.994 -0.261 5.484 1.00 0.00 H new ATOM 0 HA VAL A 264 0.654 -2.720 4.734 1.00 0.00 H new ATOM 0 HB VAL A 264 -0.667 -1.335 3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 264 0.209 0.479 1.947 1.00 0.00 H new ATOM 0 HG12 VAL A 264 0.522 0.777 3.673 1.00 0.00 H new ATOM 0 HG13 VAL A 264 1.835 0.206 2.616 1.00 0.00 H new ATOM 0 HG21 VAL A 264 0.095 -1.775 1.067 1.00 0.00 H new ATOM 0 HG22 VAL A 264 1.714 -2.174 1.691 1.00 0.00 H new ATOM 0 HG23 VAL A 264 0.317 -3.188 2.127 1.00 0.00 H new ATOM 463 N LYS A 265 2.856 -3.473 3.816 1.00 0.00 N ATOM 464 CA LYS A 265 4.147 -3.919 3.323 1.00 0.00 C ATOM 465 C LYS A 265 4.049 -4.173 1.825 1.00 0.00 C ATOM 466 O LYS A 265 3.577 -5.221 1.388 1.00 0.00 O ATOM 467 CB LYS A 265 4.622 -5.187 4.050 1.00 0.00 C ATOM 468 CG LYS A 265 5.973 -5.691 3.555 1.00 0.00 C ATOM 469 CD LYS A 265 6.501 -6.864 4.375 1.00 0.00 C ATOM 470 CE LYS A 265 6.786 -6.459 5.812 1.00 0.00 C ATOM 471 NZ LYS A 265 7.605 -7.471 6.534 1.00 0.00 N ATOM 0 H LYS A 265 2.189 -4.224 3.997 1.00 0.00 H new ATOM 0 HA LYS A 265 4.882 -3.138 3.518 1.00 0.00 H new ATOM 0 HB2 LYS A 265 4.687 -4.983 5.119 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.878 -5.973 3.920 1.00 0.00 H new ATOM 0 HG2 LYS A 265 5.883 -5.994 2.512 1.00 0.00 H new ATOM 0 HG3 LYS A 265 6.695 -4.875 3.589 1.00 0.00 H new ATOM 0 HD2 LYS A 265 5.772 -7.675 4.363 1.00 0.00 H new ATOM 0 HD3 LYS A 265 7.413 -7.248 3.917 1.00 0.00 H new ATOM 0 HE2 LYS A 265 7.306 -5.501 5.821 1.00 0.00 H new ATOM 0 HE3 LYS A 265 5.843 -6.314 6.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 7.773 -7.150 7.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 7.099 -8.379 6.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 8.516 -7.591 6.047 1.00 0.00 H new ATOM 485 N VAL A 266 4.453 -3.190 1.041 1.00 0.00 N ATOM 486 CA VAL A 266 4.456 -3.322 -0.397 1.00 0.00 C ATOM 487 C VAL A 266 5.508 -4.325 -0.848 1.00 0.00 C ATOM 488 O VAL A 266 6.710 -4.146 -0.608 1.00 0.00 O ATOM 489 CB VAL A 266 4.676 -1.952 -1.054 1.00 0.00 C ATOM 490 CG1 VAL A 266 4.955 -2.081 -2.539 1.00 0.00 C ATOM 491 CG2 VAL A 266 3.459 -1.088 -0.816 1.00 0.00 C ATOM 0 H VAL A 266 4.784 -2.288 1.383 1.00 0.00 H new ATOM 0 HA VAL A 266 3.484 -3.701 -0.714 1.00 0.00 H new ATOM 0 HB VAL A 266 5.552 -1.487 -0.603 1.00 0.00 H new ATOM 0 HG11 VAL A 266 5.105 -1.090 -2.968 1.00 0.00 H new ATOM 0 HG12 VAL A 266 5.852 -2.682 -2.690 1.00 0.00 H new ATOM 0 HG13 VAL A 266 4.109 -2.564 -3.028 1.00 0.00 H new ATOM 0 HG21 VAL A 266 3.608 -0.113 -1.280 1.00 0.00 H new ATOM 0 HG22 VAL A 266 2.582 -1.567 -1.252 1.00 0.00 H new ATOM 0 HG23 VAL A 266 3.308 -0.960 0.256 1.00 0.00 H new ATOM 501 N THR A 267 5.029 -5.389 -1.480 1.00 0.00 N ATOM 502 CA THR A 267 5.879 -6.480 -1.911 1.00 0.00 C ATOM 503 C THR A 267 6.261 -6.341 -3.377 1.00 0.00 C ATOM 504 O THR A 267 7.235 -6.941 -3.830 1.00 0.00 O ATOM 505 CB THR A 267 5.177 -7.834 -1.694 1.00 0.00 C ATOM 506 OG1 THR A 267 3.960 -7.887 -2.454 1.00 0.00 O ATOM 507 CG2 THR A 267 4.868 -8.053 -0.221 1.00 0.00 C ATOM 0 H THR A 267 4.042 -5.515 -1.706 1.00 0.00 H new ATOM 0 HA THR A 267 6.787 -6.441 -1.309 1.00 0.00 H new ATOM 0 HB THR A 267 5.849 -8.623 -2.031 1.00 0.00 H new ATOM 0 HG1 THR A 267 3.522 -8.752 -2.311 1.00 0.00 H new ATOM 0 HG21 THR A 267 4.373 -9.015 -0.092 1.00 0.00 H new ATOM 0 HG22 THR A 267 5.796 -8.043 0.351 1.00 0.00 H new ATOM 0 HG23 THR A 267 4.214 -7.258 0.136 1.00 0.00 H new ATOM 515 N LYS A 268 5.506 -5.548 -4.128 1.00 0.00 N ATOM 516 CA LYS A 268 5.818 -5.364 -5.534 1.00 0.00 C ATOM 517 C LYS A 268 6.161 -3.918 -5.772 1.00 0.00 C ATOM 518 O LYS A 268 5.289 -3.060 -5.765 1.00 0.00 O ATOM 519 CB LYS A 268 4.654 -5.782 -6.420 1.00 0.00 C ATOM 520 CG LYS A 268 5.051 -6.024 -7.865 1.00 0.00 C ATOM 521 CD LYS A 268 5.900 -7.280 -7.994 1.00 0.00 C ATOM 522 CE LYS A 268 5.101 -8.537 -7.666 1.00 0.00 C ATOM 523 NZ LYS A 268 3.930 -8.702 -8.568 1.00 0.00 N ATOM 0 H LYS A 268 4.691 -5.033 -3.794 1.00 0.00 H new ATOM 0 HA LYS A 268 6.668 -5.996 -5.792 1.00 0.00 H new ATOM 0 HB2 LYS A 268 4.209 -6.691 -6.016 1.00 0.00 H new ATOM 0 HB3 LYS A 268 3.886 -5.009 -6.387 1.00 0.00 H new ATOM 0 HG2 LYS A 268 4.157 -6.121 -8.480 1.00 0.00 H new ATOM 0 HG3 LYS A 268 5.606 -5.165 -8.242 1.00 0.00 H new ATOM 0 HD2 LYS A 268 6.291 -7.352 -9.009 1.00 0.00 H new ATOM 0 HD3 LYS A 268 6.758 -7.209 -7.326 1.00 0.00 H new ATOM 0 HE2 LYS A 268 5.748 -9.410 -7.748 1.00 0.00 H new ATOM 0 HE3 LYS A 268 4.759 -8.490 -6.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 3.754 -9.715 -8.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 3.091 -8.270 -8.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 4.124 -8.237 -9.478 1.00 0.00 H new ATOM 537 N ILE A 269 7.430 -3.659 -5.987 1.00 0.00 N ATOM 538 CA ILE A 269 7.936 -2.305 -5.967 1.00 0.00 C ATOM 539 C ILE A 269 8.188 -1.708 -7.352 1.00 0.00 C ATOM 540 O ILE A 269 8.363 -2.420 -8.338 1.00 0.00 O ATOM 541 CB ILE A 269 9.200 -2.202 -5.080 1.00 0.00 C ATOM 542 CG1 ILE A 269 10.125 -3.415 -5.246 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.768 -2.103 -3.635 1.00 0.00 C ATOM 544 CD1 ILE A 269 10.396 -3.780 -6.678 1.00 0.00 C ATOM 0 H ILE A 269 8.134 -4.372 -6.179 1.00 0.00 H new ATOM 0 HA ILE A 269 7.141 -1.701 -5.531 1.00 0.00 H new ATOM 0 HB ILE A 269 9.758 -1.318 -5.387 1.00 0.00 H new ATOM 0 HG12 ILE A 269 11.072 -3.208 -4.748 1.00 0.00 H new ATOM 0 HG13 ILE A 269 9.679 -4.272 -4.741 1.00 0.00 H new ATOM 0 HG21 ILE A 269 9.648 -2.030 -2.996 1.00 0.00 H new ATOM 0 HG22 ILE A 269 8.147 -1.217 -3.501 1.00 0.00 H new ATOM 0 HG23 ILE A 269 8.196 -2.991 -3.364 1.00 0.00 H new ATOM 0 HD11 ILE A 269 11.057 -4.646 -6.714 1.00 0.00 H new ATOM 0 HD12 ILE A 269 9.457 -4.019 -7.176 1.00 0.00 H new ATOM 0 HD13 ILE A 269 10.871 -2.940 -7.184 1.00 0.00 H new ATOM 556 N ASN A 270 8.152 -0.384 -7.407 1.00 0.00 N ATOM 557 CA ASN A 270 8.478 0.359 -8.613 1.00 0.00 C ATOM 558 C ASN A 270 9.212 1.644 -8.231 1.00 0.00 C ATOM 559 O ASN A 270 9.447 1.883 -7.049 1.00 0.00 O ATOM 560 CB ASN A 270 7.205 0.660 -9.405 1.00 0.00 C ATOM 561 CG ASN A 270 6.404 1.808 -8.832 1.00 0.00 C ATOM 562 OD1 ASN A 270 6.468 2.930 -9.323 1.00 0.00 O ATOM 563 ND2 ASN A 270 5.671 1.549 -7.769 1.00 0.00 N ATOM 0 H ASN A 270 7.895 0.205 -6.615 1.00 0.00 H new ATOM 0 HA ASN A 270 9.131 -0.238 -9.250 1.00 0.00 H new ATOM 0 HB2 ASN A 270 7.472 0.891 -10.436 1.00 0.00 H new ATOM 0 HB3 ASN A 270 6.581 -0.233 -9.430 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.133 2.294 -7.327 1.00 0.00 H new ATOM 0 HD22 ASN A 270 5.642 0.603 -7.388 1.00 0.00 H new ATOM 570 N VAL A 271 9.564 2.468 -9.207 1.00 0.00 N ATOM 571 CA VAL A 271 10.328 3.683 -8.934 1.00 0.00 C ATOM 572 C VAL A 271 9.434 4.847 -8.472 1.00 0.00 C ATOM 573 O VAL A 271 9.820 5.630 -7.604 1.00 0.00 O ATOM 574 CB VAL A 271 11.156 4.108 -10.172 1.00 0.00 C ATOM 575 CG1 VAL A 271 10.259 4.389 -11.372 1.00 0.00 C ATOM 576 CG2 VAL A 271 12.029 5.316 -9.857 1.00 0.00 C ATOM 0 H VAL A 271 9.336 2.322 -10.190 1.00 0.00 H new ATOM 0 HA VAL A 271 11.007 3.445 -8.115 1.00 0.00 H new ATOM 0 HB VAL A 271 11.808 3.274 -10.432 1.00 0.00 H new ATOM 0 HG11 VAL A 271 10.872 4.685 -12.223 1.00 0.00 H new ATOM 0 HG12 VAL A 271 9.697 3.490 -11.625 1.00 0.00 H new ATOM 0 HG13 VAL A 271 9.566 5.194 -11.127 1.00 0.00 H new ATOM 0 HG21 VAL A 271 12.600 5.593 -10.743 1.00 0.00 H new ATOM 0 HG22 VAL A 271 11.398 6.152 -9.555 1.00 0.00 H new ATOM 0 HG23 VAL A 271 12.715 5.068 -9.047 1.00 0.00 H new ATOM 586 N SER A 272 8.233 4.936 -9.028 1.00 0.00 N ATOM 587 CA SER A 272 7.365 6.087 -8.797 1.00 0.00 C ATOM 588 C SER A 272 6.597 5.970 -7.483 1.00 0.00 C ATOM 589 O SER A 272 6.487 6.938 -6.730 1.00 0.00 O ATOM 590 CB SER A 272 6.384 6.234 -9.958 1.00 0.00 C ATOM 591 OG SER A 272 7.058 6.109 -11.201 1.00 0.00 O ATOM 0 H SER A 272 7.836 4.225 -9.643 1.00 0.00 H new ATOM 0 HA SER A 272 7.999 6.971 -8.731 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.606 5.474 -9.882 1.00 0.00 H new ATOM 0 HB3 SER A 272 5.889 7.204 -9.902 1.00 0.00 H new ATOM 0 HG SER A 272 6.414 6.204 -11.933 1.00 0.00 H new ATOM 597 N GLY A 273 6.070 4.788 -7.206 1.00 0.00 N ATOM 598 CA GLY A 273 5.290 4.601 -6.003 1.00 0.00 C ATOM 599 C GLY A 273 3.897 4.083 -6.290 1.00 0.00 C ATOM 600 O GLY A 273 3.085 3.943 -5.383 1.00 0.00 O ATOM 0 H GLY A 273 6.168 3.958 -7.791 1.00 0.00 H new ATOM 0 HA2 GLY A 273 5.806 3.902 -5.345 1.00 0.00 H new ATOM 0 HA3 GLY A 273 5.219 5.549 -5.469 1.00 0.00 H new ATOM 604 N GLN A 274 3.602 3.829 -7.557 1.00 0.00 N ATOM 605 CA GLN A 274 2.347 3.194 -7.925 1.00 0.00 C ATOM 606 C GLN A 274 2.572 1.693 -8.014 1.00 0.00 C ATOM 607 O GLN A 274 2.853 1.150 -9.083 1.00 0.00 O ATOM 608 CB GLN A 274 1.800 3.751 -9.246 1.00 0.00 C ATOM 609 CG GLN A 274 1.327 5.197 -9.160 1.00 0.00 C ATOM 610 CD GLN A 274 2.452 6.214 -9.251 1.00 0.00 C ATOM 611 OE1 GLN A 274 2.791 6.689 -10.334 1.00 0.00 O ATOM 612 NE2 GLN A 274 3.056 6.538 -8.118 1.00 0.00 N ATOM 0 H GLN A 274 4.212 4.052 -8.343 1.00 0.00 H new ATOM 0 HA GLN A 274 1.598 3.408 -7.163 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.576 3.678 -10.008 1.00 0.00 H new ATOM 0 HB3 GLN A 274 0.969 3.127 -9.576 1.00 0.00 H new ATOM 0 HG2 GLN A 274 0.613 5.385 -9.962 1.00 0.00 H new ATOM 0 HG3 GLN A 274 0.795 5.341 -8.220 1.00 0.00 H new ATOM 0 HE21 GLN A 274 2.747 6.124 -7.239 1.00 0.00 H new ATOM 0 HE22 GLN A 274 3.830 7.202 -8.125 1.00 0.00 H new ATOM 621 N TRP A 275 2.471 1.036 -6.872 1.00 0.00 N ATOM 622 CA TRP A 275 2.905 -0.346 -6.742 1.00 0.00 C ATOM 623 C TRP A 275 1.850 -1.210 -6.077 1.00 0.00 C ATOM 624 O TRP A 275 0.772 -0.735 -5.713 1.00 0.00 O ATOM 625 CB TRP A 275 4.212 -0.425 -5.951 1.00 0.00 C ATOM 626 CG TRP A 275 4.377 0.603 -4.873 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.425 1.139 -4.056 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.611 1.204 -4.492 1.00 0.00 C ATOM 629 NE1 TRP A 275 4.000 2.053 -3.206 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.344 2.102 -3.452 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.922 1.064 -4.942 1.00 0.00 C ATOM 632 CZ2 TRP A 275 6.343 2.855 -2.854 1.00 0.00 C ATOM 633 CZ3 TRP A 275 7.910 1.811 -4.355 1.00 0.00 C ATOM 634 CH2 TRP A 275 7.620 2.697 -3.318 1.00 0.00 C ATOM 0 H TRP A 275 2.090 1.439 -6.016 1.00 0.00 H new ATOM 0 HA TRP A 275 3.067 -0.729 -7.750 1.00 0.00 H new ATOM 0 HB2 TRP A 275 4.284 -1.414 -5.499 1.00 0.00 H new ATOM 0 HB3 TRP A 275 5.045 -0.332 -6.648 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.376 0.883 -4.074 1.00 0.00 H new ATOM 0 HE1 TRP A 275 3.505 2.605 -2.506 1.00 0.00 H new ATOM 0 HE3 TRP A 275 7.156 0.377 -5.742 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 6.121 3.542 -2.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 8.928 1.712 -4.701 1.00 0.00 H new ATOM 0 HH2 TRP A 275 8.420 3.270 -2.872 1.00 0.00 H new ATOM 645 N GLU A 276 2.170 -2.488 -5.916 1.00 0.00 N ATOM 646 CA GLU A 276 1.251 -3.414 -5.291 1.00 0.00 C ATOM 647 C GLU A 276 1.556 -3.528 -3.810 1.00 0.00 C ATOM 648 O GLU A 276 2.672 -3.890 -3.416 1.00 0.00 O ATOM 649 CB GLU A 276 1.339 -4.796 -5.931 1.00 0.00 C ATOM 650 CG GLU A 276 1.187 -4.798 -7.442 1.00 0.00 C ATOM 651 CD GLU A 276 1.086 -6.203 -7.994 1.00 0.00 C ATOM 652 OE1 GLU A 276 2.023 -7.001 -7.783 1.00 0.00 O ATOM 653 OE2 GLU A 276 0.051 -6.537 -8.600 1.00 0.00 O ATOM 0 H GLU A 276 3.056 -2.900 -6.210 1.00 0.00 H new ATOM 0 HA GLU A 276 0.241 -3.029 -5.432 1.00 0.00 H new ATOM 0 HB2 GLU A 276 2.300 -5.242 -5.674 1.00 0.00 H new ATOM 0 HB3 GLU A 276 0.567 -5.433 -5.499 1.00 0.00 H new ATOM 0 HG2 GLU A 276 0.296 -4.234 -7.719 1.00 0.00 H new ATOM 0 HG3 GLU A 276 2.039 -4.290 -7.894 1.00 0.00 H new ATOM 660 N GLY A 277 0.540 -3.278 -3.007 1.00 0.00 N ATOM 661 CA GLY A 277 0.699 -3.256 -1.579 1.00 0.00 C ATOM 662 C GLY A 277 0.084 -4.480 -0.938 1.00 0.00 C ATOM 663 O GLY A 277 -0.916 -4.998 -1.426 1.00 0.00 O ATOM 0 H GLY A 277 -0.409 -3.087 -3.330 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.759 -3.206 -1.330 1.00 0.00 H new ATOM 0 HA3 GLY A 277 0.234 -2.358 -1.173 1.00 0.00 H new ATOM 667 N GLU A 278 0.688 -4.968 0.126 1.00 0.00 N ATOM 668 CA GLU A 278 0.085 -6.029 0.909 1.00 0.00 C ATOM 669 C GLU A 278 -0.026 -5.564 2.355 1.00 0.00 C ATOM 670 O GLU A 278 0.979 -5.262 2.987 1.00 0.00 O ATOM 671 CB GLU A 278 0.929 -7.304 0.787 1.00 0.00 C ATOM 672 CG GLU A 278 0.343 -8.517 1.492 1.00 0.00 C ATOM 673 CD GLU A 278 0.941 -8.756 2.863 1.00 0.00 C ATOM 674 OE1 GLU A 278 0.416 -8.208 3.853 1.00 0.00 O ATOM 675 OE2 GLU A 278 1.935 -9.506 2.956 1.00 0.00 O ATOM 0 H GLU A 278 1.594 -4.648 0.469 1.00 0.00 H new ATOM 0 HA GLU A 278 -0.914 -6.259 0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 278 1.057 -7.540 -0.269 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.922 -7.108 1.193 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -0.735 -8.387 1.590 1.00 0.00 H new ATOM 0 HG3 GLU A 278 0.502 -9.401 0.874 1.00 0.00 H new ATOM 682 N CYS A 279 -1.237 -5.484 2.883 1.00 0.00 N ATOM 683 CA CYS A 279 -1.409 -4.941 4.213 1.00 0.00 C ATOM 684 C CYS A 279 -1.831 -6.031 5.180 1.00 0.00 C ATOM 685 O CYS A 279 -2.996 -6.413 5.247 1.00 0.00 O ATOM 686 CB CYS A 279 -2.417 -3.783 4.204 1.00 0.00 C ATOM 687 SG CYS A 279 -4.097 -4.227 3.701 1.00 0.00 S ATOM 0 H CYS A 279 -2.096 -5.782 2.420 1.00 0.00 H new ATOM 0 HA CYS A 279 -0.452 -4.543 4.550 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -2.457 -3.350 5.203 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -2.048 -3.006 3.534 1.00 0.00 H new ATOM 0 HG CYS A 279 -4.387 -5.410 4.155 1.00 0.00 H new ATOM 693 N ASN A 280 -0.849 -6.536 5.911 1.00 0.00 N ATOM 694 CA ASN A 280 -1.059 -7.527 6.958 1.00 0.00 C ATOM 695 C ASN A 280 -1.927 -8.691 6.464 1.00 0.00 C ATOM 696 O ASN A 280 -2.870 -9.108 7.142 1.00 0.00 O ATOM 697 CB ASN A 280 -1.692 -6.884 8.201 1.00 0.00 C ATOM 698 CG ASN A 280 -1.012 -5.598 8.650 1.00 0.00 C ATOM 699 OD1 ASN A 280 -1.650 -4.736 9.258 1.00 0.00 O ATOM 700 ND2 ASN A 280 0.274 -5.440 8.361 1.00 0.00 N ATOM 0 H ASN A 280 0.128 -6.267 5.793 1.00 0.00 H new ATOM 0 HA ASN A 280 -0.081 -7.926 7.229 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -2.741 -6.674 7.994 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -1.666 -7.602 9.021 1.00 0.00 H new ATOM 0 HD21 ASN A 280 0.759 -4.588 8.643 1.00 0.00 H new ATOM 0 HD22 ASN A 280 0.777 -6.170 7.857 1.00 0.00 H new ATOM 707 N GLY A 281 -1.623 -9.199 5.273 1.00 0.00 N ATOM 708 CA GLY A 281 -2.323 -10.366 4.764 1.00 0.00 C ATOM 709 C GLY A 281 -3.173 -10.097 3.531 1.00 0.00 C ATOM 710 O GLY A 281 -3.568 -11.036 2.838 1.00 0.00 O ATOM 0 H GLY A 281 -0.906 -8.824 4.652 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -1.592 -11.139 4.526 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -2.962 -10.764 5.552 1.00 0.00 H new ATOM 714 N LYS A 282 -3.477 -8.836 3.254 1.00 0.00 N ATOM 715 CA LYS A 282 -4.306 -8.497 2.096 1.00 0.00 C ATOM 716 C LYS A 282 -3.435 -8.033 0.940 1.00 0.00 C ATOM 717 O LYS A 282 -2.543 -7.218 1.127 1.00 0.00 O ATOM 718 CB LYS A 282 -5.337 -7.415 2.442 1.00 0.00 C ATOM 719 CG LYS A 282 -6.298 -7.809 3.555 1.00 0.00 C ATOM 720 CD LYS A 282 -5.661 -7.663 4.924 1.00 0.00 C ATOM 721 CE LYS A 282 -6.443 -8.410 5.989 1.00 0.00 C ATOM 722 NZ LYS A 282 -5.723 -8.434 7.290 1.00 0.00 N ATOM 0 H LYS A 282 -3.168 -8.036 3.806 1.00 0.00 H new ATOM 0 HA LYS A 282 -4.846 -9.397 1.800 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -4.811 -6.507 2.735 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -5.912 -7.176 1.547 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.192 -7.187 3.501 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -6.618 -8.841 3.411 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -4.639 -8.040 4.892 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -5.604 -6.607 5.188 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -7.417 -7.939 6.122 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -6.626 -9.432 5.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -6.171 -9.128 7.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -4.730 -8.700 7.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -5.764 -7.491 7.727 1.00 0.00 H new ATOM 736 N ARG A 283 -3.703 -8.547 -0.251 1.00 0.00 N ATOM 737 CA ARG A 283 -2.875 -8.280 -1.411 1.00 0.00 C ATOM 738 C ARG A 283 -3.627 -7.449 -2.454 1.00 0.00 C ATOM 739 O ARG A 283 -4.785 -7.729 -2.768 1.00 0.00 O ATOM 740 CB ARG A 283 -2.452 -9.613 -2.021 1.00 0.00 C ATOM 741 CG ARG A 283 -0.955 -9.856 -2.013 1.00 0.00 C ATOM 742 CD ARG A 283 -0.223 -8.858 -2.889 1.00 0.00 C ATOM 743 NE ARG A 283 -0.711 -8.884 -4.269 1.00 0.00 N ATOM 744 CZ ARG A 283 -0.052 -8.376 -5.308 1.00 0.00 C ATOM 745 NH1 ARG A 283 1.185 -7.911 -5.168 1.00 0.00 N ATOM 746 NH2 ARG A 283 -0.631 -8.347 -6.500 1.00 0.00 N ATOM 0 H ARG A 283 -4.498 -9.158 -0.437 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.002 -7.707 -1.098 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -2.942 -10.420 -1.477 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.810 -9.659 -3.049 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -0.580 -9.788 -0.992 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -0.748 -10.868 -2.362 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -0.346 -7.856 -2.479 1.00 0.00 H new ATOM 0 HD3 ARG A 283 0.844 -9.078 -2.877 1.00 0.00 H new ATOM 0 HE ARG A 283 -1.616 -9.320 -4.446 1.00 0.00 H new ATOM 0 HH11 ARG A 283 1.641 -7.941 -4.256 1.00 0.00 H new ATOM 0 HH12 ARG A 283 1.679 -7.524 -5.973 1.00 0.00 H new ATOM 0 HH21 ARG A 283 -1.576 -8.713 -6.617 1.00 0.00 H new ATOM 0 HH22 ARG A 283 -0.132 -7.959 -7.300 1.00 0.00 H new ATOM 760 N GLY A 284 -2.961 -6.430 -2.982 1.00 0.00 N ATOM 761 CA GLY A 284 -3.532 -5.627 -4.050 1.00 0.00 C ATOM 762 C GLY A 284 -2.550 -4.586 -4.547 1.00 0.00 C ATOM 763 O GLY A 284 -1.348 -4.824 -4.528 1.00 0.00 O ATOM 0 H GLY A 284 -2.028 -6.142 -2.688 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -3.827 -6.274 -4.876 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -4.436 -5.134 -3.693 1.00 0.00 H new ATOM 767 N HIS A 285 -3.044 -3.420 -4.959 1.00 0.00 N ATOM 768 CA HIS A 285 -2.169 -2.359 -5.468 1.00 0.00 C ATOM 769 C HIS A 285 -2.742 -0.979 -5.161 1.00 0.00 C ATOM 770 O HIS A 285 -3.959 -0.820 -5.072 1.00 0.00 O ATOM 771 CB HIS A 285 -1.920 -2.509 -6.976 1.00 0.00 C ATOM 772 CG HIS A 285 -3.122 -2.279 -7.843 1.00 0.00 C ATOM 773 ND1 HIS A 285 -3.431 -1.054 -8.389 1.00 0.00 N ATOM 774 CD2 HIS A 285 -4.079 -3.130 -8.275 1.00 0.00 C ATOM 775 CE1 HIS A 285 -4.526 -1.159 -9.112 1.00 0.00 C ATOM 776 NE2 HIS A 285 -4.941 -2.409 -9.065 1.00 0.00 N ATOM 0 H HIS A 285 -4.036 -3.184 -4.952 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.212 -2.458 -4.956 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -1.138 -1.809 -7.271 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.539 -3.512 -7.168 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -4.152 -4.182 -8.042 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -5.004 -0.356 -9.653 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -5.766 -2.780 -9.537 1.00 0.00 H new ATOM 785 N PHE A 286 -1.858 0.011 -5.017 1.00 0.00 N ATOM 786 CA PHE A 286 -2.253 1.380 -4.675 1.00 0.00 C ATOM 787 C PHE A 286 -1.105 2.363 -4.945 1.00 0.00 C ATOM 788 O PHE A 286 0.068 1.981 -4.919 1.00 0.00 O ATOM 789 CB PHE A 286 -2.683 1.460 -3.205 1.00 0.00 C ATOM 790 CG PHE A 286 -4.180 1.468 -3.010 1.00 0.00 C ATOM 791 CD1 PHE A 286 -4.933 2.589 -3.332 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.831 0.360 -2.499 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.302 2.601 -3.150 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.201 0.369 -2.314 1.00 0.00 C ATOM 795 CZ PHE A 286 -6.937 1.488 -2.641 1.00 0.00 C ATOM 0 H PHE A 286 -0.852 -0.112 -5.134 1.00 0.00 H new ATOM 0 HA PHE A 286 -3.098 1.657 -5.305 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.260 0.613 -2.665 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.263 2.363 -2.761 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -4.441 3.464 -3.730 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.263 -0.522 -2.242 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -6.874 3.481 -3.406 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.696 -0.503 -1.912 1.00 0.00 H new ATOM 0 HZ PHE A 286 -8.008 1.493 -2.499 1.00 0.00 H new ATOM 805 N PRO A 287 -1.431 3.648 -5.207 1.00 0.00 N ATOM 806 CA PRO A 287 -0.447 4.658 -5.585 1.00 0.00 C ATOM 807 C PRO A 287 0.147 5.425 -4.399 1.00 0.00 C ATOM 808 O PRO A 287 -0.306 5.304 -3.253 1.00 0.00 O ATOM 809 CB PRO A 287 -1.272 5.589 -6.469 1.00 0.00 C ATOM 810 CG PRO A 287 -2.654 5.538 -5.901 1.00 0.00 C ATOM 811 CD PRO A 287 -2.791 4.216 -5.181 1.00 0.00 C ATOM 0 HA PRO A 287 0.426 4.216 -6.064 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -0.875 6.604 -6.451 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -1.260 5.260 -7.508 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -2.819 6.369 -5.215 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -3.399 5.625 -6.692 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -3.146 4.354 -4.160 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.505 3.562 -5.681 1.00 0.00 H new ATOM 819 N PHE A 288 1.142 6.247 -4.720 1.00 0.00 N ATOM 820 CA PHE A 288 1.992 6.929 -3.746 1.00 0.00 C ATOM 821 C PHE A 288 1.340 8.212 -3.216 1.00 0.00 C ATOM 822 O PHE A 288 1.677 8.689 -2.134 1.00 0.00 O ATOM 823 CB PHE A 288 3.303 7.278 -4.463 1.00 0.00 C ATOM 824 CG PHE A 288 4.493 7.536 -3.584 1.00 0.00 C ATOM 825 CD1 PHE A 288 4.737 8.794 -3.063 1.00 0.00 C ATOM 826 CD2 PHE A 288 5.393 6.521 -3.322 1.00 0.00 C ATOM 827 CE1 PHE A 288 5.855 9.033 -2.286 1.00 0.00 C ATOM 828 CE2 PHE A 288 6.515 6.749 -2.555 1.00 0.00 C ATOM 829 CZ PHE A 288 6.747 8.009 -2.033 1.00 0.00 C ATOM 0 H PHE A 288 1.386 6.463 -5.686 1.00 0.00 H new ATOM 0 HA PHE A 288 2.158 6.278 -2.887 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.550 6.462 -5.142 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.133 8.163 -5.077 1.00 0.00 H new ATOM 0 HD1 PHE A 288 4.046 9.599 -3.266 1.00 0.00 H new ATOM 0 HD2 PHE A 288 5.215 5.535 -3.724 1.00 0.00 H new ATOM 0 HE1 PHE A 288 6.031 10.017 -1.878 1.00 0.00 H new ATOM 0 HE2 PHE A 288 7.211 5.946 -2.362 1.00 0.00 H new ATOM 0 HZ PHE A 288 7.624 8.192 -1.429 1.00 0.00 H new ATOM 839 N THR A 289 0.384 8.736 -3.974 1.00 0.00 N ATOM 840 CA THR A 289 -0.151 10.079 -3.750 1.00 0.00 C ATOM 841 C THR A 289 -0.971 10.220 -2.453 1.00 0.00 C ATOM 842 O THR A 289 -1.503 11.295 -2.174 1.00 0.00 O ATOM 843 CB THR A 289 -1.014 10.517 -4.959 1.00 0.00 C ATOM 844 OG1 THR A 289 -1.335 11.915 -4.871 1.00 0.00 O ATOM 845 CG2 THR A 289 -2.300 9.702 -5.042 1.00 0.00 C ATOM 0 H THR A 289 -0.043 8.246 -4.760 1.00 0.00 H new ATOM 0 HA THR A 289 0.716 10.730 -3.640 1.00 0.00 H new ATOM 0 HB THR A 289 -0.430 10.339 -5.862 1.00 0.00 H new ATOM 0 HG1 THR A 289 -1.371 12.184 -3.929 1.00 0.00 H new ATOM 0 HG21 THR A 289 -2.885 10.032 -5.900 1.00 0.00 H new ATOM 0 HG22 THR A 289 -2.055 8.646 -5.154 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.881 9.845 -4.131 1.00 0.00 H new ATOM 853 N HIS A 290 -1.085 9.157 -1.661 1.00 0.00 N ATOM 854 CA HIS A 290 -1.826 9.230 -0.404 1.00 0.00 C ATOM 855 C HIS A 290 -1.226 8.316 0.657 1.00 0.00 C ATOM 856 O HIS A 290 -1.940 7.760 1.494 1.00 0.00 O ATOM 857 CB HIS A 290 -3.307 8.909 -0.638 1.00 0.00 C ATOM 858 CG HIS A 290 -3.594 7.600 -1.312 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.660 7.424 -2.160 1.00 0.00 N ATOM 860 CD2 HIS A 290 -2.962 6.404 -1.258 1.00 0.00 C ATOM 861 CE1 HIS A 290 -4.678 6.186 -2.598 1.00 0.00 C ATOM 862 NE2 HIS A 290 -3.654 5.537 -2.070 1.00 0.00 N ATOM 0 H HIS A 290 -0.679 8.244 -1.864 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.749 10.250 -0.028 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.818 8.920 0.325 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.742 9.708 -1.239 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -5.336 8.146 -2.412 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -2.077 6.174 -0.683 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -5.407 5.768 -3.276 1.00 0.00 H new ATOM 871 N VAL A 291 0.090 8.167 0.625 1.00 0.00 N ATOM 872 CA VAL A 291 0.784 7.355 1.612 1.00 0.00 C ATOM 873 C VAL A 291 2.095 8.015 2.029 1.00 0.00 C ATOM 874 O VAL A 291 2.701 8.762 1.259 1.00 0.00 O ATOM 875 CB VAL A 291 1.088 5.926 1.091 1.00 0.00 C ATOM 876 CG1 VAL A 291 -0.189 5.158 0.793 1.00 0.00 C ATOM 877 CG2 VAL A 291 1.977 5.980 -0.139 1.00 0.00 C ATOM 0 H VAL A 291 0.697 8.597 -0.073 1.00 0.00 H new ATOM 0 HA VAL A 291 0.116 7.275 2.469 1.00 0.00 H new ATOM 0 HB VAL A 291 1.619 5.394 1.880 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.062 4.161 0.430 1.00 0.00 H new ATOM 0 HG12 VAL A 291 -0.784 5.074 1.703 1.00 0.00 H new ATOM 0 HG13 VAL A 291 -0.763 5.687 0.032 1.00 0.00 H new ATOM 0 HG21 VAL A 291 2.178 4.967 -0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 291 1.475 6.542 -0.926 1.00 0.00 H new ATOM 0 HG23 VAL A 291 2.918 6.470 0.113 1.00 0.00 H new ATOM 887 N ARG A 292 2.517 7.741 3.250 1.00 0.00 N ATOM 888 CA ARG A 292 3.813 8.173 3.738 1.00 0.00 C ATOM 889 C ARG A 292 4.584 6.934 4.163 1.00 0.00 C ATOM 890 O ARG A 292 4.280 6.320 5.177 1.00 0.00 O ATOM 891 CB ARG A 292 3.653 9.142 4.914 1.00 0.00 C ATOM 892 CG ARG A 292 4.963 9.757 5.374 1.00 0.00 C ATOM 893 CD ARG A 292 5.607 10.561 4.262 1.00 0.00 C ATOM 894 NE ARG A 292 6.951 11.006 4.612 1.00 0.00 N ATOM 895 CZ ARG A 292 7.965 11.041 3.753 1.00 0.00 C ATOM 896 NH1 ARG A 292 7.790 10.665 2.488 1.00 0.00 N ATOM 897 NH2 ARG A 292 9.161 11.444 4.158 1.00 0.00 N ATOM 0 H ARG A 292 1.971 7.213 3.931 1.00 0.00 H new ATOM 0 HA ARG A 292 4.354 8.703 2.954 1.00 0.00 H new ATOM 0 HB2 ARG A 292 2.967 9.939 4.627 1.00 0.00 H new ATOM 0 HB3 ARG A 292 3.195 8.614 5.750 1.00 0.00 H new ATOM 0 HG2 ARG A 292 4.784 10.400 6.236 1.00 0.00 H new ATOM 0 HG3 ARG A 292 5.644 8.970 5.700 1.00 0.00 H new ATOM 0 HD2 ARG A 292 5.651 9.956 3.357 1.00 0.00 H new ATOM 0 HD3 ARG A 292 4.986 11.428 4.036 1.00 0.00 H new ATOM 0 HE ARG A 292 7.123 11.308 5.571 1.00 0.00 H new ATOM 0 HH11 ARG A 292 6.873 10.348 2.172 1.00 0.00 H new ATOM 0 HH12 ARG A 292 8.572 10.694 1.834 1.00 0.00 H new ATOM 0 HH21 ARG A 292 9.303 11.727 5.128 1.00 0.00 H new ATOM 0 HH22 ARG A 292 9.940 11.471 3.500 1.00 0.00 H new ATOM 911 N LEU A 293 5.588 6.574 3.396 1.00 0.00 N ATOM 912 CA LEU A 293 6.158 5.250 3.496 1.00 0.00 C ATOM 913 C LEU A 293 7.361 5.179 4.417 1.00 0.00 C ATOM 914 O LEU A 293 8.205 6.075 4.455 1.00 0.00 O ATOM 915 CB LEU A 293 6.519 4.665 2.118 1.00 0.00 C ATOM 916 CG LEU A 293 6.635 5.619 0.919 1.00 0.00 C ATOM 917 CD1 LEU A 293 5.294 6.247 0.564 1.00 0.00 C ATOM 918 CD2 LEU A 293 7.693 6.690 1.159 1.00 0.00 C ATOM 0 H LEU A 293 6.025 7.177 2.699 1.00 0.00 H new ATOM 0 HA LEU A 293 5.370 4.641 3.940 1.00 0.00 H new ATOM 0 HB2 LEU A 293 7.471 4.144 2.219 1.00 0.00 H new ATOM 0 HB3 LEU A 293 5.769 3.913 1.871 1.00 0.00 H new ATOM 0 HG LEU A 293 6.953 5.020 0.065 1.00 0.00 H new ATOM 0 HD11 LEU A 293 5.419 6.915 -0.288 1.00 0.00 H new ATOM 0 HD12 LEU A 293 4.581 5.463 0.309 1.00 0.00 H new ATOM 0 HD13 LEU A 293 4.920 6.814 1.417 1.00 0.00 H new ATOM 0 HD21 LEU A 293 7.749 7.347 0.291 1.00 0.00 H new ATOM 0 HD22 LEU A 293 7.426 7.274 2.040 1.00 0.00 H new ATOM 0 HD23 LEU A 293 8.661 6.216 1.318 1.00 0.00 H new ATOM 930 N LEU A 294 7.393 4.096 5.176 1.00 0.00 N ATOM 931 CA LEU A 294 8.559 3.697 5.913 1.00 0.00 C ATOM 932 C LEU A 294 9.507 3.017 4.926 1.00 0.00 C ATOM 933 O LEU A 294 9.089 2.575 3.851 1.00 0.00 O ATOM 934 CB LEU A 294 8.176 2.735 7.043 1.00 0.00 C ATOM 935 CG LEU A 294 6.849 3.015 7.755 1.00 0.00 C ATOM 936 CD1 LEU A 294 6.684 2.104 8.961 1.00 0.00 C ATOM 937 CD2 LEU A 294 6.767 4.469 8.162 1.00 0.00 C ATOM 0 H LEU A 294 6.597 3.469 5.292 1.00 0.00 H new ATOM 0 HA LEU A 294 9.039 4.561 6.372 1.00 0.00 H new ATOM 0 HB2 LEU A 294 8.138 1.725 6.634 1.00 0.00 H new ATOM 0 HB3 LEU A 294 8.972 2.748 7.787 1.00 0.00 H new ATOM 0 HG LEU A 294 6.033 2.807 7.062 1.00 0.00 H new ATOM 0 HD11 LEU A 294 5.735 2.319 9.452 1.00 0.00 H new ATOM 0 HD12 LEU A 294 6.696 1.064 8.636 1.00 0.00 H new ATOM 0 HD13 LEU A 294 7.502 2.275 9.661 1.00 0.00 H new ATOM 0 HD21 LEU A 294 5.819 4.653 8.667 1.00 0.00 H new ATOM 0 HD22 LEU A 294 7.589 4.705 8.838 1.00 0.00 H new ATOM 0 HD23 LEU A 294 6.834 5.099 7.275 1.00 0.00 H new