USER MOD reduce.3.24.130724 H: found=0, std=0, add=614, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 617 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 : A 212 SER OG : rot 180:sc= 0 USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 THR OG1 : rot -65:sc= 0.351 USER MOD Single : A 232 CYS SG : rot 180:sc= 0 USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 SER OG : rot -52:sc= 1.18 USER MOD Single : B 212 SER OG : rot -35:sc= 0.0244 USER MOD Single : B 217 TYR OH : rot 180:sc= 0 USER MOD Single : B 219 THR OG1 : rot -70:sc= 0.745 USER MOD Single : B 232 CYS SG : rot 75:sc= 1.21 USER MOD Single : B 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 234 SER OG : rot -35:sc= 1.01 USER MOD Single : C 212 SER OG : rot 180:sc= 0 USER MOD Single : C 217 TYR OH : rot 180:sc= 0 USER MOD Single : C 219 THR OG1 : rot -71:sc= 0.834 USER MOD Single : C 232 CYS SG : rot 180:sc= 0 USER MOD Single : C 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 212 86.564 20.097 0.599 1.00 0.00 N ATOM 72 CA SER A 212 85.289 19.300 0.839 1.00 0.00 C ATOM 73 C SER A 212 85.019 18.289 -0.306 1.00 0.00 C ATOM 74 O SER A 212 84.611 17.168 -0.071 1.00 0.00 O ATOM 75 CB SER A 212 84.087 20.282 0.988 1.00 0.00 C ATOM 76 OG SER A 212 82.904 19.543 1.275 1.00 0.00 O ATOM 0 HA SER A 212 85.412 18.725 1.757 1.00 0.00 H new ATOM 0 HB2 SER A 212 84.285 20.997 1.786 1.00 0.00 H new ATOM 0 HB3 SER A 212 83.957 20.856 0.071 1.00 0.00 H new ATOM 0 HG SER A 212 82.148 20.160 1.370 1.00 0.00 H new ATOM 82 N GLY A 213 85.247 18.742 -1.549 1.00 0.00 N ATOM 83 CA GLY A 213 85.032 17.902 -2.795 1.00 0.00 C ATOM 84 C GLY A 213 86.138 16.848 -2.954 1.00 0.00 C ATOM 85 O GLY A 213 85.902 15.759 -3.456 1.00 0.00 O ATOM 0 H GLY A 213 85.582 19.685 -1.745 1.00 0.00 H new ATOM 0 HA2 GLY A 213 84.061 17.409 -2.741 1.00 0.00 H new ATOM 0 HA3 GLY A 213 85.013 18.548 -3.673 1.00 0.00 H new ATOM 89 N ILE A 214 87.369 17.223 -2.531 1.00 0.00 N ATOM 90 CA ILE A 214 88.606 16.339 -2.626 1.00 0.00 C ATOM 91 C ILE A 214 88.461 15.068 -1.724 1.00 0.00 C ATOM 92 O ILE A 214 88.708 13.955 -2.181 1.00 0.00 O ATOM 93 CB ILE A 214 89.896 17.215 -2.243 1.00 0.00 C ATOM 94 CG1 ILE A 214 89.968 18.569 -3.141 1.00 0.00 C ATOM 95 CG2 ILE A 214 91.261 16.382 -2.385 1.00 0.00 C ATOM 96 CD1 ILE A 214 90.064 18.332 -4.682 1.00 0.00 C ATOM 0 H ILE A 214 87.555 18.135 -2.114 1.00 0.00 H new ATOM 0 HA ILE A 214 88.724 15.974 -3.646 1.00 0.00 H new ATOM 0 HB ILE A 214 89.787 17.492 -1.194 1.00 0.00 H new ATOM 0 HG12 ILE A 214 89.083 19.171 -2.935 1.00 0.00 H new ATOM 0 HG13 ILE A 214 90.832 19.153 -2.823 1.00 0.00 H new ATOM 0 HG21 ILE A 214 92.105 17.017 -2.115 1.00 0.00 H new ATOM 0 HG22 ILE A 214 91.231 15.518 -1.721 1.00 0.00 H new ATOM 0 HG23 ILE A 214 91.376 16.045 -3.415 1.00 0.00 H new ATOM 0 HD11 ILE A 214 90.107 19.292 -5.196 1.00 0.00 H new ATOM 0 HD12 ILE A 214 90.964 17.759 -4.907 1.00 0.00 H new ATOM 0 HD13 ILE A 214 89.188 17.779 -5.020 1.00 0.00 H new ATOM 108 N ILE A 215 88.073 15.252 -0.428 1.00 0.00 N ATOM 109 CA ILE A 215 87.911 14.082 0.558 1.00 0.00 C ATOM 110 C ILE A 215 86.775 13.111 0.087 1.00 0.00 C ATOM 111 O ILE A 215 86.866 11.913 0.290 1.00 0.00 O ATOM 112 CB ILE A 215 87.729 14.613 2.071 1.00 0.00 C ATOM 113 CG1 ILE A 215 86.401 15.509 2.204 1.00 0.00 C ATOM 114 CG2 ILE A 215 89.035 15.443 2.517 1.00 0.00 C ATOM 115 CD1 ILE A 215 86.113 15.997 3.658 1.00 0.00 C ATOM 0 H ILE A 215 87.865 16.166 -0.026 1.00 0.00 H new ATOM 0 HA ILE A 215 88.829 13.494 0.563 1.00 0.00 H new ATOM 0 HB ILE A 215 87.617 13.757 2.736 1.00 0.00 H new ATOM 0 HG12 ILE A 215 86.493 16.377 1.551 1.00 0.00 H new ATOM 0 HG13 ILE A 215 85.547 14.932 1.849 1.00 0.00 H new ATOM 0 HG21 ILE A 215 88.908 15.800 3.539 1.00 0.00 H new ATOM 0 HG22 ILE A 215 89.912 14.798 2.464 1.00 0.00 H new ATOM 0 HG23 ILE A 215 89.170 16.294 1.850 1.00 0.00 H new ATOM 0 HD11 ILE A 215 85.202 16.595 3.667 1.00 0.00 H new ATOM 0 HD12 ILE A 215 85.988 15.135 4.313 1.00 0.00 H new ATOM 0 HD13 ILE A 215 86.948 16.603 4.011 1.00 0.00 H new ATOM 127 N ILE A 216 85.703 13.653 -0.559 1.00 0.00 N ATOM 128 CA ILE A 216 84.552 12.804 -1.115 1.00 0.00 C ATOM 129 C ILE A 216 85.085 11.980 -2.340 1.00 0.00 C ATOM 130 O ILE A 216 84.711 10.836 -2.541 1.00 0.00 O ATOM 131 CB ILE A 216 83.324 13.770 -1.523 1.00 0.00 C ATOM 132 CG1 ILE A 216 82.721 14.497 -0.205 1.00 0.00 C ATOM 133 CG2 ILE A 216 82.152 12.974 -2.290 1.00 0.00 C ATOM 134 CD1 ILE A 216 81.738 15.662 -0.533 1.00 0.00 C ATOM 0 H ILE A 216 85.591 14.654 -0.717 1.00 0.00 H new ATOM 0 HA ILE A 216 84.184 12.104 -0.365 1.00 0.00 H new ATOM 0 HB ILE A 216 83.718 14.520 -2.209 1.00 0.00 H new ATOM 0 HG12 ILE A 216 82.204 13.756 0.404 1.00 0.00 H new ATOM 0 HG13 ILE A 216 83.544 14.885 0.395 1.00 0.00 H new ATOM 0 HG21 ILE A 216 81.348 13.665 -2.544 1.00 0.00 H new ATOM 0 HG22 ILE A 216 82.550 12.530 -3.202 1.00 0.00 H new ATOM 0 HG23 ILE A 216 81.763 12.187 -1.643 1.00 0.00 H new ATOM 0 HD11 ILE A 216 81.373 16.103 0.395 1.00 0.00 H new ATOM 0 HD12 ILE A 216 82.257 16.423 -1.116 1.00 0.00 H new ATOM 0 HD13 ILE A 216 80.895 15.276 -1.107 1.00 0.00 H new ATOM 146 N TYR A 217 85.904 12.652 -3.184 1.00 0.00 N ATOM 147 CA TYR A 217 86.461 12.075 -4.486 1.00 0.00 C ATOM 148 C TYR A 217 87.460 10.878 -4.314 1.00 0.00 C ATOM 149 O TYR A 217 87.392 9.925 -5.086 1.00 0.00 O ATOM 150 CB TYR A 217 87.139 13.261 -5.291 1.00 0.00 C ATOM 151 CG TYR A 217 87.643 12.804 -6.731 1.00 0.00 C ATOM 152 CD1 TYR A 217 86.698 12.573 -7.781 1.00 0.00 C ATOM 153 CD2 TYR A 217 89.036 12.600 -7.017 1.00 0.00 C ATOM 154 CE1 TYR A 217 87.136 12.159 -9.059 1.00 0.00 C ATOM 155 CE2 TYR A 217 89.445 12.187 -8.305 1.00 0.00 C ATOM 156 CZ TYR A 217 88.499 11.971 -9.312 1.00 0.00 C ATOM 157 OH TYR A 217 88.914 11.566 -10.569 1.00 0.00 O ATOM 0 H TYR A 217 86.212 13.608 -3.005 1.00 0.00 H new ATOM 0 HA TYR A 217 85.622 11.641 -5.029 1.00 0.00 H new ATOM 0 HB2 TYR A 217 86.425 14.077 -5.401 1.00 0.00 H new ATOM 0 HB3 TYR A 217 87.982 13.649 -4.720 1.00 0.00 H new ATOM 0 HD1 TYR A 217 85.644 12.716 -7.595 1.00 0.00 H new ATOM 0 HD2 TYR A 217 89.773 12.763 -6.245 1.00 0.00 H new ATOM 0 HE1 TYR A 217 86.415 11.987 -9.844 1.00 0.00 H new ATOM 0 HE2 TYR A 217 90.494 12.037 -8.513 1.00 0.00 H new ATOM 0 HH TYR A 217 89.890 11.483 -10.580 1.00 0.00 H new ATOM 167 N VAL A 218 88.434 10.957 -3.358 1.00 0.00 N ATOM 168 CA VAL A 218 89.504 9.857 -3.192 1.00 0.00 C ATOM 169 C VAL A 218 88.860 8.460 -2.925 1.00 0.00 C ATOM 170 O VAL A 218 89.347 7.445 -3.409 1.00 0.00 O ATOM 171 CB VAL A 218 90.557 10.284 -2.057 1.00 0.00 C ATOM 172 CG1 VAL A 218 89.844 10.470 -0.646 1.00 0.00 C ATOM 173 CG2 VAL A 218 91.775 9.241 -1.946 1.00 0.00 C ATOM 0 H VAL A 218 88.522 11.731 -2.700 1.00 0.00 H new ATOM 0 HA VAL A 218 90.052 9.755 -4.129 1.00 0.00 H new ATOM 0 HB VAL A 218 90.974 11.246 -2.357 1.00 0.00 H new ATOM 0 HG11 VAL A 218 90.584 10.759 0.100 1.00 0.00 H new ATOM 0 HG12 VAL A 218 89.083 11.247 -0.722 1.00 0.00 H new ATOM 0 HG13 VAL A 218 89.376 9.532 -0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 218 92.464 9.567 -1.167 1.00 0.00 H new ATOM 0 HG22 VAL A 218 91.387 8.253 -1.697 1.00 0.00 H new ATOM 0 HG23 VAL A 218 92.302 9.194 -2.899 1.00 0.00 H new ATOM 183 N THR A 219 87.757 8.442 -2.140 1.00 0.00 N ATOM 184 CA THR A 219 86.999 7.167 -1.779 1.00 0.00 C ATOM 185 C THR A 219 86.382 6.507 -3.039 1.00 0.00 C ATOM 186 O THR A 219 86.506 5.307 -3.251 1.00 0.00 O ATOM 187 CB THR A 219 85.845 7.508 -0.742 1.00 0.00 C ATOM 188 OG1 THR A 219 84.847 8.290 -1.396 1.00 0.00 O ATOM 189 CG2 THR A 219 86.380 8.340 0.480 1.00 0.00 C ATOM 0 H THR A 219 87.352 9.285 -1.732 1.00 0.00 H new ATOM 0 HA THR A 219 87.705 6.466 -1.334 1.00 0.00 H new ATOM 0 HB THR A 219 85.443 6.563 -0.376 1.00 0.00 H new ATOM 0 HG1 THR A 219 85.226 9.157 -1.650 1.00 0.00 H new ATOM 0 HG21 THR A 219 85.558 8.551 1.164 1.00 0.00 H new ATOM 0 HG22 THR A 219 87.148 7.768 1.001 1.00 0.00 H new ATOM 0 HG23 THR A 219 86.805 9.278 0.123 1.00 0.00 H new ATOM 197 N VAL A 220 85.695 7.339 -3.859 1.00 0.00 N ATOM 198 CA VAL A 220 85.011 6.875 -5.136 1.00 0.00 C ATOM 199 C VAL A 220 86.091 6.478 -6.181 1.00 0.00 C ATOM 200 O VAL A 220 85.989 5.446 -6.820 1.00 0.00 O ATOM 201 CB VAL A 220 84.045 8.044 -5.667 1.00 0.00 C ATOM 202 CG1 VAL A 220 83.273 7.621 -7.012 1.00 0.00 C ATOM 203 CG2 VAL A 220 82.983 8.442 -4.528 1.00 0.00 C ATOM 0 H VAL A 220 85.588 8.337 -3.677 1.00 0.00 H new ATOM 0 HA VAL A 220 84.396 5.995 -4.951 1.00 0.00 H new ATOM 0 HB VAL A 220 84.671 8.905 -5.902 1.00 0.00 H new ATOM 0 HG11 VAL A 220 82.631 8.440 -7.336 1.00 0.00 H new ATOM 0 HG12 VAL A 220 83.999 7.398 -7.794 1.00 0.00 H new ATOM 0 HG13 VAL A 220 82.664 6.737 -6.820 1.00 0.00 H new ATOM 0 HG21 VAL A 220 82.333 9.235 -4.898 1.00 0.00 H new ATOM 0 HG22 VAL A 220 82.382 7.570 -4.271 1.00 0.00 H new ATOM 0 HG23 VAL A 220 83.513 8.791 -3.642 1.00 0.00 H new ATOM 213 N ALA A 221 87.138 7.332 -6.328 1.00 0.00 N ATOM 214 CA ALA A 221 88.277 7.093 -7.314 1.00 0.00 C ATOM 215 C ALA A 221 88.968 5.717 -7.060 1.00 0.00 C ATOM 216 O ALA A 221 89.414 5.062 -7.994 1.00 0.00 O ATOM 217 CB ALA A 221 89.310 8.275 -7.204 1.00 0.00 C ATOM 0 H ALA A 221 87.236 8.193 -5.790 1.00 0.00 H new ATOM 0 HA ALA A 221 87.871 7.063 -8.325 1.00 0.00 H new ATOM 0 HB1 ALA A 221 90.127 8.111 -7.906 1.00 0.00 H new ATOM 0 HB2 ALA A 221 88.813 9.216 -7.440 1.00 0.00 H new ATOM 0 HB3 ALA A 221 89.707 8.318 -6.190 1.00 0.00 H new ATOM 223 N ALA A 222 89.052 5.314 -5.759 1.00 0.00 N ATOM 224 CA ALA A 222 89.704 4.006 -5.338 1.00 0.00 C ATOM 225 C ALA A 222 88.928 2.775 -5.903 1.00 0.00 C ATOM 226 O ALA A 222 89.529 1.828 -6.371 1.00 0.00 O ATOM 227 CB ALA A 222 89.773 3.963 -3.765 1.00 0.00 C ATOM 0 H ALA A 222 88.685 5.860 -4.980 1.00 0.00 H new ATOM 0 HA ALA A 222 90.712 3.956 -5.749 1.00 0.00 H new ATOM 0 HB1 ALA A 222 90.238 3.030 -3.447 1.00 0.00 H new ATOM 0 HB2 ALA A 222 90.363 4.805 -3.404 1.00 0.00 H new ATOM 0 HB3 ALA A 222 88.765 4.024 -3.355 1.00 0.00 H new ATOM 233 N VAL A 223 87.574 2.823 -5.835 1.00 0.00 N ATOM 234 CA VAL A 223 86.669 1.696 -6.340 1.00 0.00 C ATOM 235 C VAL A 223 86.720 1.638 -7.897 1.00 0.00 C ATOM 236 O VAL A 223 86.774 0.565 -8.484 1.00 0.00 O ATOM 237 CB VAL A 223 85.184 1.933 -5.781 1.00 0.00 C ATOM 238 CG1 VAL A 223 84.164 0.791 -6.270 1.00 0.00 C ATOM 239 CG2 VAL A 223 85.204 1.996 -4.173 1.00 0.00 C ATOM 0 H VAL A 223 87.063 3.614 -5.442 1.00 0.00 H new ATOM 0 HA VAL A 223 87.014 0.729 -5.974 1.00 0.00 H new ATOM 0 HB VAL A 223 84.832 2.883 -6.183 1.00 0.00 H new ATOM 0 HG11 VAL A 223 83.171 0.993 -5.867 1.00 0.00 H new ATOM 0 HG12 VAL A 223 84.119 0.785 -7.359 1.00 0.00 H new ATOM 0 HG13 VAL A 223 84.509 -0.181 -5.916 1.00 0.00 H new ATOM 0 HG21 VAL A 223 84.192 2.157 -3.803 1.00 0.00 H new ATOM 0 HG22 VAL A 223 85.590 1.057 -3.777 1.00 0.00 H new ATOM 0 HG23 VAL A 223 85.844 2.817 -3.849 1.00 0.00 H new ATOM 249 N VAL A 224 86.695 2.830 -8.540 1.00 0.00 N ATOM 250 CA VAL A 224 86.734 2.978 -10.059 1.00 0.00 C ATOM 251 C VAL A 224 88.097 2.465 -10.616 1.00 0.00 C ATOM 252 O VAL A 224 88.159 1.962 -11.731 1.00 0.00 O ATOM 253 CB VAL A 224 86.444 4.516 -10.414 1.00 0.00 C ATOM 254 CG1 VAL A 224 86.657 4.860 -11.966 1.00 0.00 C ATOM 255 CG2 VAL A 224 84.947 4.913 -9.970 1.00 0.00 C ATOM 0 H VAL A 224 86.648 3.722 -8.048 1.00 0.00 H new ATOM 0 HA VAL A 224 85.968 2.367 -10.537 1.00 0.00 H new ATOM 0 HB VAL A 224 87.173 5.105 -9.857 1.00 0.00 H new ATOM 0 HG11 VAL A 224 86.444 5.915 -12.137 1.00 0.00 H new ATOM 0 HG12 VAL A 224 87.688 4.647 -12.248 1.00 0.00 H new ATOM 0 HG13 VAL A 224 85.983 4.252 -12.569 1.00 0.00 H new ATOM 0 HG21 VAL A 224 84.760 5.958 -10.215 1.00 0.00 H new ATOM 0 HG22 VAL A 224 84.232 4.283 -10.498 1.00 0.00 H new ATOM 0 HG23 VAL A 224 84.835 4.767 -8.896 1.00 0.00 H new ATOM 265 N LEU A 225 89.186 2.637 -9.825 1.00 0.00 N ATOM 266 CA LEU A 225 90.594 2.218 -10.242 1.00 0.00 C ATOM 267 C LEU A 225 90.724 0.668 -10.373 1.00 0.00 C ATOM 268 O LEU A 225 91.394 0.185 -11.275 1.00 0.00 O ATOM 269 CB LEU A 225 91.614 2.814 -9.182 1.00 0.00 C ATOM 270 CG LEU A 225 93.176 2.471 -9.451 1.00 0.00 C ATOM 271 CD1 LEU A 225 93.667 2.957 -10.879 1.00 0.00 C ATOM 272 CD2 LEU A 225 94.090 3.100 -8.300 1.00 0.00 C ATOM 0 H LEU A 225 89.141 3.058 -8.897 1.00 0.00 H new ATOM 0 HA LEU A 225 90.821 2.614 -11.232 1.00 0.00 H new ATOM 0 HB2 LEU A 225 91.496 3.897 -9.159 1.00 0.00 H new ATOM 0 HB3 LEU A 225 91.343 2.443 -8.194 1.00 0.00 H new ATOM 0 HG LEU A 225 93.274 1.386 -9.434 1.00 0.00 H new ATOM 0 HD11 LEU A 225 94.719 2.703 -11.008 1.00 0.00 H new ATOM 0 HD12 LEU A 225 93.078 2.466 -11.653 1.00 0.00 H new ATOM 0 HD13 LEU A 225 93.542 4.037 -10.959 1.00 0.00 H new ATOM 0 HD21 LEU A 225 95.136 2.861 -8.494 1.00 0.00 H new ATOM 0 HD22 LEU A 225 93.962 4.182 -8.284 1.00 0.00 H new ATOM 0 HD23 LEU A 225 93.797 2.686 -7.335 1.00 0.00 H new ATOM 284 N ILE A 226 90.112 -0.093 -9.426 1.00 0.00 N ATOM 285 CA ILE A 226 90.198 -1.625 -9.403 1.00 0.00 C ATOM 286 C ILE A 226 89.396 -2.265 -10.584 1.00 0.00 C ATOM 287 O ILE A 226 89.913 -3.126 -11.271 1.00 0.00 O ATOM 288 CB ILE A 226 89.690 -2.173 -7.973 1.00 0.00 C ATOM 289 CG1 ILE A 226 90.576 -1.511 -6.786 1.00 0.00 C ATOM 290 CG2 ILE A 226 89.760 -3.786 -7.888 1.00 0.00 C ATOM 291 CD1 ILE A 226 90.031 -1.818 -5.360 1.00 0.00 C ATOM 0 H ILE A 226 89.555 0.299 -8.667 1.00 0.00 H new ATOM 0 HA ILE A 226 91.239 -1.919 -9.540 1.00 0.00 H new ATOM 0 HB ILE A 226 88.646 -1.884 -7.855 1.00 0.00 H new ATOM 0 HG12 ILE A 226 91.600 -1.876 -6.861 1.00 0.00 H new ATOM 0 HG13 ILE A 226 90.611 -0.431 -6.928 1.00 0.00 H new ATOM 0 HG21 ILE A 226 89.409 -4.114 -6.910 1.00 0.00 H new ATOM 0 HG22 ILE A 226 89.128 -4.219 -8.664 1.00 0.00 H new ATOM 0 HG23 ILE A 226 90.789 -4.114 -8.033 1.00 0.00 H new ATOM 0 HD11 ILE A 226 90.672 -1.345 -4.616 1.00 0.00 H new ATOM 0 HD12 ILE A 226 89.017 -1.429 -5.266 1.00 0.00 H new ATOM 0 HD13 ILE A 226 90.022 -2.896 -5.198 1.00 0.00 H new ATOM 303 N VAL A 227 88.102 -1.891 -10.740 1.00 0.00 N ATOM 304 CA VAL A 227 87.177 -2.510 -11.795 1.00 0.00 C ATOM 305 C VAL A 227 87.602 -2.183 -13.264 1.00 0.00 C ATOM 306 O VAL A 227 87.429 -3.009 -14.151 1.00 0.00 O ATOM 307 CB VAL A 227 85.662 -2.064 -11.484 1.00 0.00 C ATOM 308 CG1 VAL A 227 85.240 -2.519 -9.999 1.00 0.00 C ATOM 309 CG2 VAL A 227 85.499 -0.483 -11.637 1.00 0.00 C ATOM 0 H VAL A 227 87.654 -1.174 -10.169 1.00 0.00 H new ATOM 0 HA VAL A 227 87.258 -3.595 -11.724 1.00 0.00 H new ATOM 0 HB VAL A 227 85.006 -2.553 -12.204 1.00 0.00 H new ATOM 0 HG11 VAL A 227 84.213 -2.211 -9.802 1.00 0.00 H new ATOM 0 HG12 VAL A 227 85.316 -3.603 -9.915 1.00 0.00 H new ATOM 0 HG13 VAL A 227 85.905 -2.052 -9.273 1.00 0.00 H new ATOM 0 HG21 VAL A 227 84.468 -0.201 -11.423 1.00 0.00 H new ATOM 0 HG22 VAL A 227 86.166 0.021 -10.937 1.00 0.00 H new ATOM 0 HG23 VAL A 227 85.752 -0.188 -12.655 1.00 0.00 H new ATOM 319 N ALA A 228 88.096 -0.941 -13.505 1.00 0.00 N ATOM 320 CA ALA A 228 88.483 -0.447 -14.906 1.00 0.00 C ATOM 321 C ALA A 228 89.594 -1.321 -15.574 1.00 0.00 C ATOM 322 O ALA A 228 89.497 -1.675 -16.743 1.00 0.00 O ATOM 323 CB ALA A 228 88.937 1.057 -14.796 1.00 0.00 C ATOM 0 H ALA A 228 88.245 -0.248 -12.771 1.00 0.00 H new ATOM 0 HA ALA A 228 87.611 -0.534 -15.554 1.00 0.00 H new ATOM 0 HB1 ALA A 228 89.216 1.426 -15.783 1.00 0.00 H new ATOM 0 HB2 ALA A 228 88.116 1.657 -14.403 1.00 0.00 H new ATOM 0 HB3 ALA A 228 89.793 1.130 -14.126 1.00 0.00 H new ATOM 329 N VAL A 229 90.648 -1.655 -14.807 1.00 0.00 N ATOM 330 CA VAL A 229 91.798 -2.527 -15.306 1.00 0.00 C ATOM 331 C VAL A 229 91.307 -4.000 -15.426 1.00 0.00 C ATOM 332 O VAL A 229 91.774 -4.752 -16.269 1.00 0.00 O ATOM 333 CB VAL A 229 93.071 -2.356 -14.345 1.00 0.00 C ATOM 334 CG1 VAL A 229 92.711 -2.716 -12.834 1.00 0.00 C ATOM 335 CG2 VAL A 229 94.321 -3.223 -14.859 1.00 0.00 C ATOM 0 H VAL A 229 90.754 -1.350 -13.839 1.00 0.00 H new ATOM 0 HA VAL A 229 92.120 -2.213 -16.299 1.00 0.00 H new ATOM 0 HB VAL A 229 93.361 -1.306 -14.379 1.00 0.00 H new ATOM 0 HG11 VAL A 229 93.595 -2.590 -12.209 1.00 0.00 H new ATOM 0 HG12 VAL A 229 91.920 -2.055 -12.481 1.00 0.00 H new ATOM 0 HG13 VAL A 229 92.371 -3.750 -12.777 1.00 0.00 H new ATOM 0 HG21 VAL A 229 95.164 -3.082 -14.183 1.00 0.00 H new ATOM 0 HG22 VAL A 229 94.047 -4.278 -14.882 1.00 0.00 H new ATOM 0 HG23 VAL A 229 94.601 -2.899 -15.861 1.00 0.00 H new ATOM 345 N PHE A 230 90.390 -4.401 -14.505 1.00 0.00 N ATOM 346 CA PHE A 230 89.834 -5.826 -14.430 1.00 0.00 C ATOM 347 C PHE A 230 89.037 -6.223 -15.712 1.00 0.00 C ATOM 348 O PHE A 230 89.190 -7.331 -16.213 1.00 0.00 O ATOM 349 CB PHE A 230 88.907 -5.936 -13.141 1.00 0.00 C ATOM 350 CG PHE A 230 88.701 -7.433 -12.644 1.00 0.00 C ATOM 351 CD1 PHE A 230 87.808 -8.313 -13.331 1.00 0.00 C ATOM 352 CD2 PHE A 230 89.399 -7.936 -11.488 1.00 0.00 C ATOM 353 CE1 PHE A 230 87.620 -9.642 -12.878 1.00 0.00 C ATOM 354 CE2 PHE A 230 89.200 -9.260 -11.051 1.00 0.00 C ATOM 355 CZ PHE A 230 88.312 -10.112 -11.740 1.00 0.00 C ATOM 0 H PHE A 230 90.006 -3.777 -13.796 1.00 0.00 H new ATOM 0 HA PHE A 230 90.670 -6.521 -14.361 1.00 0.00 H new ATOM 0 HB2 PHE A 230 89.346 -5.349 -12.334 1.00 0.00 H new ATOM 0 HB3 PHE A 230 87.934 -5.496 -13.362 1.00 0.00 H new ATOM 0 HD1 PHE A 230 87.273 -7.962 -14.201 1.00 0.00 H new ATOM 0 HD2 PHE A 230 90.081 -7.292 -10.952 1.00 0.00 H new ATOM 0 HE1 PHE A 230 86.944 -10.299 -13.405 1.00 0.00 H new ATOM 0 HE2 PHE A 230 89.730 -9.625 -10.184 1.00 0.00 H new ATOM 0 HZ PHE A 230 88.161 -11.125 -11.397 1.00 0.00 H new ATOM 365 N VAL A 231 88.172 -5.296 -16.232 1.00 0.00 N ATOM 366 CA VAL A 231 87.331 -5.569 -17.486 1.00 0.00 C ATOM 367 C VAL A 231 88.241 -5.646 -18.746 1.00 0.00 C ATOM 368 O VAL A 231 87.936 -6.362 -19.689 1.00 0.00 O ATOM 369 CB VAL A 231 86.152 -4.484 -17.642 1.00 0.00 C ATOM 370 CG1 VAL A 231 85.097 -4.616 -16.435 1.00 0.00 C ATOM 371 CG2 VAL A 231 86.747 -3.005 -17.688 1.00 0.00 C ATOM 0 H VAL A 231 88.027 -4.371 -15.828 1.00 0.00 H new ATOM 0 HA VAL A 231 86.847 -6.539 -17.378 1.00 0.00 H new ATOM 0 HB VAL A 231 85.636 -4.681 -18.582 1.00 0.00 H new ATOM 0 HG11 VAL A 231 84.308 -3.874 -16.559 1.00 0.00 H new ATOM 0 HG12 VAL A 231 84.660 -5.615 -16.441 1.00 0.00 H new ATOM 0 HG13 VAL A 231 85.607 -4.449 -15.486 1.00 0.00 H new ATOM 0 HG21 VAL A 231 85.933 -2.288 -17.794 1.00 0.00 H new ATOM 0 HG22 VAL A 231 87.291 -2.803 -16.765 1.00 0.00 H new ATOM 0 HG23 VAL A 231 87.425 -2.912 -18.536 1.00 0.00 H new ATOM 381 N CYS A 232 89.362 -4.869 -18.742 1.00 0.00 N ATOM 382 CA CYS A 232 90.346 -4.820 -19.910 1.00 0.00 C ATOM 383 C CYS A 232 90.999 -6.216 -20.151 1.00 0.00 C ATOM 384 O CYS A 232 91.319 -6.571 -21.278 1.00 0.00 O ATOM 385 CB CYS A 232 91.437 -3.723 -19.616 1.00 0.00 C ATOM 386 SG CYS A 232 92.529 -3.461 -21.053 1.00 0.00 S ATOM 0 H CYS A 232 89.622 -4.267 -17.961 1.00 0.00 H new ATOM 0 HA CYS A 232 89.811 -4.556 -20.822 1.00 0.00 H new ATOM 0 HB2 CYS A 232 90.949 -2.785 -19.353 1.00 0.00 H new ATOM 0 HB3 CYS A 232 92.034 -4.024 -18.755 1.00 0.00 H new ATOM 0 HG CYS A 232 93.410 -2.549 -20.768 1.00 0.00 H new ATOM 392 N LYS A 233 91.186 -6.986 -19.045 1.00 0.00 N ATOM 393 CA LYS A 233 91.814 -8.378 -19.079 1.00 0.00 C ATOM 394 C LYS A 233 90.885 -9.377 -19.820 1.00 0.00 C ATOM 395 O LYS A 233 91.334 -10.156 -20.653 1.00 0.00 O ATOM 396 CB LYS A 233 92.099 -8.827 -17.582 1.00 0.00 C ATOM 397 CG LYS A 233 92.873 -10.225 -17.474 1.00 0.00 C ATOM 398 CD LYS A 233 93.307 -10.584 -15.969 1.00 0.00 C ATOM 399 CE LYS A 233 92.080 -10.826 -15.003 1.00 0.00 C ATOM 400 NZ LYS A 233 92.581 -11.347 -13.693 1.00 0.00 N ATOM 0 H LYS A 233 90.918 -6.685 -18.108 1.00 0.00 H new ATOM 0 HA LYS A 233 92.754 -8.361 -19.631 1.00 0.00 H new ATOM 0 HB2 LYS A 233 92.687 -8.055 -17.085 1.00 0.00 H new ATOM 0 HB3 LYS A 233 91.153 -8.902 -17.046 1.00 0.00 H new ATOM 0 HG2 LYS A 233 92.235 -11.019 -17.862 1.00 0.00 H new ATOM 0 HG3 LYS A 233 93.761 -10.193 -18.105 1.00 0.00 H new ATOM 0 HD2 LYS A 233 93.931 -11.477 -15.982 1.00 0.00 H new ATOM 0 HD3 LYS A 233 93.918 -9.774 -15.572 1.00 0.00 H new ATOM 0 HE2 LYS A 233 91.531 -9.896 -14.852 1.00 0.00 H new ATOM 0 HE3 LYS A 233 91.385 -11.537 -15.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 91.777 -11.508 -13.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 93.087 -12.243 -13.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 93.228 -10.653 -13.268 1.00 0.00 H new ATOM 414 N SER A 234 89.569 -9.320 -19.495 1.00 0.00 N ATOM 415 CA SER A 234 88.515 -10.217 -20.132 1.00 0.00 C ATOM 416 C SER A 234 88.402 -9.894 -21.647 1.00 0.00 C ATOM 417 O SER A 234 88.294 -10.777 -22.479 1.00 0.00 O ATOM 418 CB SER A 234 87.138 -9.988 -19.417 1.00 0.00 C ATOM 419 OG SER A 234 86.671 -8.669 -19.681 1.00 0.00 O ATOM 0 H SER A 234 89.193 -8.673 -18.802 1.00 0.00 H new ATOM 0 HA SER A 234 88.802 -11.262 -20.019 1.00 0.00 H new ATOM 0 HB2 SER A 234 86.409 -10.719 -19.768 1.00 0.00 H new ATOM 0 HB3 SER A 234 87.246 -10.137 -18.343 1.00 0.00 H new ATOM 0 HG SER A 234 87.373 -8.023 -19.457 1.00 0.00 H new ATOM 425 N LEU A 235 88.445 -8.577 -21.954 1.00 0.00 N ATOM 426 CA LEU A 235 88.355 -8.013 -23.376 1.00 0.00 C ATOM 427 C LEU A 235 89.615 -8.450 -24.198 1.00 0.00 C ATOM 428 O LEU A 235 89.545 -8.690 -25.393 1.00 0.00 O ATOM 429 CB LEU A 235 88.219 -6.407 -23.286 1.00 0.00 C ATOM 430 CG LEU A 235 87.301 -5.738 -24.440 1.00 0.00 C ATOM 431 CD1 LEU A 235 87.172 -4.164 -24.235 1.00 0.00 C ATOM 432 CD2 LEU A 235 87.845 -6.080 -25.889 1.00 0.00 C ATOM 0 H LEU A 235 88.543 -7.852 -21.243 1.00 0.00 H new ATOM 0 HA LEU A 235 87.479 -8.404 -23.893 1.00 0.00 H new ATOM 0 HB2 LEU A 235 87.803 -6.146 -22.313 1.00 0.00 H new ATOM 0 HB3 LEU A 235 89.216 -5.969 -23.335 1.00 0.00 H new ATOM 0 HG LEU A 235 86.304 -6.170 -24.353 1.00 0.00 H new ATOM 0 HD11 LEU A 235 86.550 -3.744 -25.025 1.00 0.00 H new ATOM 0 HD12 LEU A 235 86.716 -3.959 -23.267 1.00 0.00 H new ATOM 0 HD13 LEU A 235 88.162 -3.710 -24.273 1.00 0.00 H new ATOM 0 HD21 LEU A 235 87.204 -5.614 -26.638 1.00 0.00 H new ATOM 0 HD22 LEU A 235 88.861 -5.701 -25.995 1.00 0.00 H new ATOM 0 HD23 LEU A 235 87.844 -7.161 -26.032 1.00 0.00 H new ATOM 444 N LEU A 236 90.775 -8.539 -23.499 1.00 0.00 N ATOM 445 CA LEU A 236 92.115 -8.930 -24.128 1.00 0.00 C ATOM 446 C LEU A 236 92.195 -10.470 -24.294 1.00 0.00 C ATOM 447 O LEU A 236 92.968 -10.957 -25.107 1.00 0.00 O ATOM 448 CB LEU A 236 93.271 -8.375 -23.190 1.00 0.00 C ATOM 449 CG LEU A 236 94.780 -8.740 -23.660 1.00 0.00 C ATOM 450 CD1 LEU A 236 95.101 -8.223 -25.121 1.00 0.00 C ATOM 451 CD2 LEU A 236 95.843 -8.165 -22.613 1.00 0.00 C ATOM 0 H LEU A 236 90.835 -8.350 -22.498 1.00 0.00 H new ATOM 0 HA LEU A 236 92.222 -8.498 -25.123 1.00 0.00 H new ATOM 0 HB2 LEU A 236 93.179 -7.291 -23.131 1.00 0.00 H new ATOM 0 HB3 LEU A 236 93.118 -8.764 -22.183 1.00 0.00 H new ATOM 0 HG LEU A 236 94.855 -9.827 -23.686 1.00 0.00 H new ATOM 0 HD11 LEU A 236 96.123 -8.493 -25.386 1.00 0.00 H new ATOM 0 HD12 LEU A 236 94.409 -8.680 -25.829 1.00 0.00 H new ATOM 0 HD13 LEU A 236 94.992 -7.139 -25.156 1.00 0.00 H new ATOM 0 HD21 LEU A 236 96.851 -8.418 -22.942 1.00 0.00 H new ATOM 0 HD22 LEU A 236 95.743 -7.081 -22.551 1.00 0.00 H new ATOM 0 HD23 LEU A 236 95.661 -8.603 -21.632 1.00 0.00 H new ATOM 652 N SER B 212 73.463 8.799 5.632 1.00 0.00 N ATOM 653 CA SER B 212 74.872 9.195 6.077 1.00 0.00 C ATOM 654 C SER B 212 75.786 7.953 6.236 1.00 0.00 C ATOM 655 O SER B 212 76.996 8.068 6.230 1.00 0.00 O ATOM 656 CB SER B 212 74.780 9.990 7.423 1.00 0.00 C ATOM 657 OG SER B 212 74.306 9.122 8.449 1.00 0.00 O ATOM 0 HA SER B 212 75.318 9.827 5.309 1.00 0.00 H new ATOM 0 HB2 SER B 212 75.758 10.389 7.691 1.00 0.00 H new ATOM 0 HB3 SER B 212 74.108 10.841 7.311 1.00 0.00 H new ATOM 0 HG SER B 212 73.661 8.489 8.070 1.00 0.00 H new ATOM 663 N GLY B 213 75.156 6.774 6.382 1.00 0.00 N ATOM 664 CA GLY B 213 75.878 5.455 6.533 1.00 0.00 C ATOM 665 C GLY B 213 76.481 4.991 5.194 1.00 0.00 C ATOM 666 O GLY B 213 77.400 4.186 5.181 1.00 0.00 O ATOM 0 H GLY B 213 74.140 6.686 6.401 1.00 0.00 H new ATOM 0 HA2 GLY B 213 76.669 5.554 7.276 1.00 0.00 H new ATOM 0 HA3 GLY B 213 75.186 4.699 6.904 1.00 0.00 H new ATOM 670 N ILE B 214 75.912 5.486 4.050 1.00 0.00 N ATOM 671 CA ILE B 214 76.374 5.080 2.638 1.00 0.00 C ATOM 672 C ILE B 214 77.858 5.504 2.371 1.00 0.00 C ATOM 673 O ILE B 214 78.675 4.698 1.939 1.00 0.00 O ATOM 674 CB ILE B 214 75.331 5.663 1.526 1.00 0.00 C ATOM 675 CG1 ILE B 214 75.196 4.689 0.234 1.00 0.00 C ATOM 676 CG2 ILE B 214 75.663 7.166 1.053 1.00 0.00 C ATOM 677 CD1 ILE B 214 76.542 4.422 -0.492 1.00 0.00 C ATOM 0 H ILE B 214 75.144 6.157 4.053 1.00 0.00 H new ATOM 0 HA ILE B 214 76.364 3.993 2.559 1.00 0.00 H new ATOM 0 HB ILE B 214 74.371 5.693 2.041 1.00 0.00 H new ATOM 0 HG12 ILE B 214 74.770 3.737 0.551 1.00 0.00 H new ATOM 0 HG13 ILE B 214 74.495 5.133 -0.472 1.00 0.00 H new ATOM 0 HG21 ILE B 214 74.928 7.486 0.314 1.00 0.00 H new ATOM 0 HG22 ILE B 214 75.627 7.834 1.913 1.00 0.00 H new ATOM 0 HG23 ILE B 214 76.659 7.197 0.611 1.00 0.00 H new ATOM 0 HD11 ILE B 214 76.372 3.764 -1.344 1.00 0.00 H new ATOM 0 HD12 ILE B 214 76.961 5.366 -0.841 1.00 0.00 H new ATOM 0 HD13 ILE B 214 77.240 3.949 0.198 1.00 0.00 H new ATOM 689 N ILE B 215 78.186 6.805 2.627 1.00 0.00 N ATOM 690 CA ILE B 215 79.592 7.369 2.389 1.00 0.00 C ATOM 691 C ILE B 215 80.631 6.690 3.330 1.00 0.00 C ATOM 692 O ILE B 215 81.772 6.505 2.951 1.00 0.00 O ATOM 693 CB ILE B 215 79.589 8.973 2.487 1.00 0.00 C ATOM 694 CG1 ILE B 215 81.039 9.592 2.099 1.00 0.00 C ATOM 695 CG2 ILE B 215 79.121 9.454 3.929 1.00 0.00 C ATOM 696 CD1 ILE B 215 81.039 11.145 1.984 1.00 0.00 C ATOM 0 H ILE B 215 77.523 7.489 2.992 1.00 0.00 H new ATOM 0 HA ILE B 215 79.904 7.128 1.373 1.00 0.00 H new ATOM 0 HB ILE B 215 78.869 9.350 1.760 1.00 0.00 H new ATOM 0 HG12 ILE B 215 81.767 9.291 2.852 1.00 0.00 H new ATOM 0 HG13 ILE B 215 81.366 9.165 1.151 1.00 0.00 H new ATOM 0 HG21 ILE B 215 79.128 10.543 3.969 1.00 0.00 H new ATOM 0 HG22 ILE B 215 78.112 9.090 4.124 1.00 0.00 H new ATOM 0 HG23 ILE B 215 79.802 9.059 4.683 1.00 0.00 H new ATOM 0 HD11 ILE B 215 82.039 11.490 1.722 1.00 0.00 H new ATOM 0 HD12 ILE B 215 80.335 11.453 1.211 1.00 0.00 H new ATOM 0 HD13 ILE B 215 80.743 11.581 2.938 1.00 0.00 H new ATOM 708 N ILE B 216 80.214 6.326 4.573 1.00 0.00 N ATOM 709 CA ILE B 216 81.132 5.624 5.579 1.00 0.00 C ATOM 710 C ILE B 216 81.429 4.168 5.076 1.00 0.00 C ATOM 711 O ILE B 216 82.514 3.647 5.276 1.00 0.00 O ATOM 712 CB ILE B 216 80.452 5.628 7.046 1.00 0.00 C ATOM 713 CG1 ILE B 216 80.134 7.152 7.499 1.00 0.00 C ATOM 714 CG2 ILE B 216 81.393 4.898 8.134 1.00 0.00 C ATOM 715 CD1 ILE B 216 79.366 7.259 8.852 1.00 0.00 C ATOM 0 H ILE B 216 79.270 6.493 4.921 1.00 0.00 H new ATOM 0 HA ILE B 216 82.079 6.157 5.659 1.00 0.00 H new ATOM 0 HB ILE B 216 79.519 5.068 6.992 1.00 0.00 H new ATOM 0 HG12 ILE B 216 81.073 7.700 7.580 1.00 0.00 H new ATOM 0 HG13 ILE B 216 79.547 7.638 6.719 1.00 0.00 H new ATOM 0 HG21 ILE B 216 80.906 4.919 9.109 1.00 0.00 H new ATOM 0 HG22 ILE B 216 81.561 3.864 7.834 1.00 0.00 H new ATOM 0 HG23 ILE B 216 82.349 5.418 8.195 1.00 0.00 H new ATOM 0 HD11 ILE B 216 79.190 8.308 9.088 1.00 0.00 H new ATOM 0 HD12 ILE B 216 78.411 6.740 8.770 1.00 0.00 H new ATOM 0 HD13 ILE B 216 79.960 6.803 9.644 1.00 0.00 H new ATOM 727 N TYR B 217 80.392 3.521 4.490 1.00 0.00 N ATOM 728 CA TYR B 217 80.452 2.069 4.009 1.00 0.00 C ATOM 729 C TYR B 217 81.418 1.819 2.806 1.00 0.00 C ATOM 730 O TYR B 217 82.136 0.820 2.809 1.00 0.00 O ATOM 731 CB TYR B 217 78.976 1.610 3.658 1.00 0.00 C ATOM 732 CG TYR B 217 78.895 0.062 3.289 1.00 0.00 C ATOM 733 CD1 TYR B 217 78.980 -0.924 4.323 1.00 0.00 C ATOM 734 CD2 TYR B 217 78.748 -0.387 1.934 1.00 0.00 C ATOM 735 CE1 TYR B 217 78.917 -2.300 4.004 1.00 0.00 C ATOM 736 CE2 TYR B 217 78.688 -1.770 1.645 1.00 0.00 C ATOM 737 CZ TYR B 217 78.771 -2.713 2.675 1.00 0.00 C ATOM 738 OH TYR B 217 78.710 -4.062 2.378 1.00 0.00 O ATOM 0 H TYR B 217 79.487 3.963 4.327 1.00 0.00 H new ATOM 0 HA TYR B 217 80.873 1.472 4.818 1.00 0.00 H new ATOM 0 HB2 TYR B 217 78.323 1.813 4.507 1.00 0.00 H new ATOM 0 HB3 TYR B 217 78.604 2.201 2.821 1.00 0.00 H new ATOM 0 HD1 TYR B 217 79.093 -0.615 5.352 1.00 0.00 H new ATOM 0 HD2 TYR B 217 78.683 0.334 1.132 1.00 0.00 H new ATOM 0 HE1 TYR B 217 78.982 -3.037 4.791 1.00 0.00 H new ATOM 0 HE2 TYR B 217 78.577 -2.100 0.623 1.00 0.00 H new ATOM 0 HH TYR B 217 78.607 -4.180 1.411 1.00 0.00 H new ATOM 748 N VAL B 218 81.397 2.686 1.747 1.00 0.00 N ATOM 749 CA VAL B 218 82.273 2.456 0.497 1.00 0.00 C ATOM 750 C VAL B 218 83.793 2.376 0.863 1.00 0.00 C ATOM 751 O VAL B 218 84.543 1.635 0.240 1.00 0.00 O ATOM 752 CB VAL B 218 81.974 3.574 -0.623 1.00 0.00 C ATOM 753 CG1 VAL B 218 80.449 3.474 -1.127 1.00 0.00 C ATOM 754 CG2 VAL B 218 82.269 5.038 -0.060 1.00 0.00 C ATOM 0 H VAL B 218 80.817 3.524 1.708 1.00 0.00 H new ATOM 0 HA VAL B 218 82.007 1.488 0.072 1.00 0.00 H new ATOM 0 HB VAL B 218 82.637 3.389 -1.468 1.00 0.00 H new ATOM 0 HG11 VAL B 218 80.265 4.237 -1.883 1.00 0.00 H new ATOM 0 HG12 VAL B 218 80.271 2.488 -1.556 1.00 0.00 H new ATOM 0 HG13 VAL B 218 79.776 3.630 -0.284 1.00 0.00 H new ATOM 0 HG21 VAL B 218 82.059 5.775 -0.835 1.00 0.00 H new ATOM 0 HG22 VAL B 218 81.634 5.230 0.805 1.00 0.00 H new ATOM 0 HG23 VAL B 218 83.316 5.110 0.236 1.00 0.00 H new ATOM 764 N THR B 219 84.216 3.157 1.890 1.00 0.00 N ATOM 765 CA THR B 219 85.666 3.190 2.376 1.00 0.00 C ATOM 766 C THR B 219 86.089 1.818 2.964 1.00 0.00 C ATOM 767 O THR B 219 87.146 1.289 2.645 1.00 0.00 O ATOM 768 CB THR B 219 85.834 4.305 3.495 1.00 0.00 C ATOM 769 OG1 THR B 219 85.107 3.909 4.659 1.00 0.00 O ATOM 770 CG2 THR B 219 85.273 5.696 3.036 1.00 0.00 C ATOM 0 H THR B 219 83.596 3.777 2.410 1.00 0.00 H new ATOM 0 HA THR B 219 86.302 3.418 1.521 1.00 0.00 H new ATOM 0 HB THR B 219 86.901 4.406 3.695 1.00 0.00 H new ATOM 0 HG1 THR B 219 84.145 3.963 4.478 1.00 0.00 H new ATOM 0 HG21 THR B 219 85.411 6.425 3.834 1.00 0.00 H new ATOM 0 HG22 THR B 219 85.807 6.028 2.146 1.00 0.00 H new ATOM 0 HG23 THR B 219 84.211 5.603 2.809 1.00 0.00 H new ATOM 778 N VAL B 220 85.223 1.275 3.856 1.00 0.00 N ATOM 779 CA VAL B 220 85.463 -0.053 4.559 1.00 0.00 C ATOM 780 C VAL B 220 85.400 -1.206 3.525 1.00 0.00 C ATOM 781 O VAL B 220 86.181 -2.137 3.580 1.00 0.00 O ATOM 782 CB VAL B 220 84.386 -0.228 5.738 1.00 0.00 C ATOM 783 CG1 VAL B 220 84.595 -1.603 6.544 1.00 0.00 C ATOM 784 CG2 VAL B 220 84.470 1.016 6.754 1.00 0.00 C ATOM 0 H VAL B 220 84.345 1.722 4.120 1.00 0.00 H new ATOM 0 HA VAL B 220 86.455 -0.076 5.010 1.00 0.00 H new ATOM 0 HB VAL B 220 83.399 -0.259 5.276 1.00 0.00 H new ATOM 0 HG11 VAL B 220 83.846 -1.680 7.332 1.00 0.00 H new ATOM 0 HG12 VAL B 220 84.491 -2.445 5.860 1.00 0.00 H new ATOM 0 HG13 VAL B 220 85.591 -1.617 6.988 1.00 0.00 H new ATOM 0 HG21 VAL B 220 83.736 0.887 7.549 1.00 0.00 H new ATOM 0 HG22 VAL B 220 85.469 1.065 7.187 1.00 0.00 H new ATOM 0 HG23 VAL B 220 84.262 1.940 6.215 1.00 0.00 H new ATOM 794 N ALA B 221 84.430 -1.123 2.588 1.00 0.00 N ATOM 795 CA ALA B 221 84.231 -2.176 1.508 1.00 0.00 C ATOM 796 C ALA B 221 85.447 -2.231 0.528 1.00 0.00 C ATOM 797 O ALA B 221 85.766 -3.286 -0.007 1.00 0.00 O ATOM 798 CB ALA B 221 82.891 -1.880 0.742 1.00 0.00 C ATOM 0 H ALA B 221 83.765 -0.352 2.538 1.00 0.00 H new ATOM 0 HA ALA B 221 84.166 -3.157 1.978 1.00 0.00 H new ATOM 0 HB1 ALA B 221 82.742 -2.631 -0.034 1.00 0.00 H new ATOM 0 HB2 ALA B 221 82.057 -1.912 1.443 1.00 0.00 H new ATOM 0 HB3 ALA B 221 82.944 -0.892 0.285 1.00 0.00 H new ATOM 804 N ALA B 222 86.067 -1.055 0.265 1.00 0.00 N ATOM 805 CA ALA B 222 87.231 -0.935 -0.703 1.00 0.00 C ATOM 806 C ALA B 222 88.537 -1.608 -0.180 1.00 0.00 C ATOM 807 O ALA B 222 89.230 -2.277 -0.938 1.00 0.00 O ATOM 808 CB ALA B 222 87.472 0.597 -0.988 1.00 0.00 C ATOM 0 H ALA B 222 85.797 -0.171 0.696 1.00 0.00 H new ATOM 0 HA ALA B 222 86.972 -1.468 -1.618 1.00 0.00 H new ATOM 0 HB1 ALA B 222 88.305 0.711 -1.682 1.00 0.00 H new ATOM 0 HB2 ALA B 222 86.573 1.032 -1.425 1.00 0.00 H new ATOM 0 HB3 ALA B 222 87.705 1.109 -0.054 1.00 0.00 H new ATOM 814 N VAL B 223 88.904 -1.362 1.106 1.00 0.00 N ATOM 815 CA VAL B 223 90.204 -1.913 1.703 1.00 0.00 C ATOM 816 C VAL B 223 90.153 -3.455 1.910 1.00 0.00 C ATOM 817 O VAL B 223 91.162 -4.126 1.706 1.00 0.00 O ATOM 818 CB VAL B 223 90.579 -1.105 3.040 1.00 0.00 C ATOM 819 CG1 VAL B 223 89.521 -1.366 4.204 1.00 0.00 C ATOM 820 CG2 VAL B 223 92.069 -1.440 3.539 1.00 0.00 C ATOM 0 H VAL B 223 88.351 -0.803 1.755 1.00 0.00 H new ATOM 0 HA VAL B 223 91.010 -1.753 0.986 1.00 0.00 H new ATOM 0 HB VAL B 223 90.542 -0.045 2.788 1.00 0.00 H new ATOM 0 HG11 VAL B 223 89.810 -0.802 5.091 1.00 0.00 H new ATOM 0 HG12 VAL B 223 88.532 -1.045 3.876 1.00 0.00 H new ATOM 0 HG13 VAL B 223 89.497 -2.429 4.442 1.00 0.00 H new ATOM 0 HG21 VAL B 223 92.285 -0.874 4.445 1.00 0.00 H new ATOM 0 HG22 VAL B 223 92.151 -2.506 3.749 1.00 0.00 H new ATOM 0 HG23 VAL B 223 92.783 -1.167 2.762 1.00 0.00 H new ATOM 830 N VAL B 224 88.978 -4.022 2.340 1.00 0.00 N ATOM 831 CA VAL B 224 88.852 -5.532 2.584 1.00 0.00 C ATOM 832 C VAL B 224 88.970 -6.314 1.243 1.00 0.00 C ATOM 833 O VAL B 224 89.437 -7.441 1.219 1.00 0.00 O ATOM 834 CB VAL B 224 87.479 -5.877 3.356 1.00 0.00 C ATOM 835 CG1 VAL B 224 87.444 -5.147 4.785 1.00 0.00 C ATOM 836 CG2 VAL B 224 86.215 -5.436 2.486 1.00 0.00 C ATOM 0 H VAL B 224 88.125 -3.493 2.524 1.00 0.00 H new ATOM 0 HA VAL B 224 89.674 -5.849 3.226 1.00 0.00 H new ATOM 0 HB VAL B 224 87.436 -6.955 3.508 1.00 0.00 H new ATOM 0 HG11 VAL B 224 86.511 -5.389 5.295 1.00 0.00 H new ATOM 0 HG12 VAL B 224 88.286 -5.487 5.388 1.00 0.00 H new ATOM 0 HG13 VAL B 224 87.511 -4.068 4.644 1.00 0.00 H new ATOM 0 HG21 VAL B 224 85.299 -5.678 3.026 1.00 0.00 H new ATOM 0 HG22 VAL B 224 86.256 -4.362 2.304 1.00 0.00 H new ATOM 0 HG23 VAL B 224 86.226 -5.966 1.534 1.00 0.00 H new ATOM 846 N LEU B 225 88.482 -5.688 0.133 1.00 0.00 N ATOM 847 CA LEU B 225 88.471 -6.331 -1.250 1.00 0.00 C ATOM 848 C LEU B 225 89.888 -6.818 -1.696 1.00 0.00 C ATOM 849 O LEU B 225 89.995 -7.816 -2.400 1.00 0.00 O ATOM 850 CB LEU B 225 87.845 -5.294 -2.276 1.00 0.00 C ATOM 851 CG LEU B 225 87.718 -5.821 -3.806 1.00 0.00 C ATOM 852 CD1 LEU B 225 86.869 -7.156 -3.920 1.00 0.00 C ATOM 853 CD2 LEU B 225 87.096 -4.679 -4.738 1.00 0.00 C ATOM 0 H LEU B 225 88.090 -4.746 0.150 1.00 0.00 H new ATOM 0 HA LEU B 225 87.858 -7.232 -1.221 1.00 0.00 H new ATOM 0 HB2 LEU B 225 86.853 -5.013 -1.923 1.00 0.00 H new ATOM 0 HB3 LEU B 225 88.454 -4.390 -2.270 1.00 0.00 H new ATOM 0 HG LEU B 225 88.726 -6.055 -4.149 1.00 0.00 H new ATOM 0 HD11 LEU B 225 86.815 -7.465 -4.964 1.00 0.00 H new ATOM 0 HD12 LEU B 225 87.345 -7.941 -3.333 1.00 0.00 H new ATOM 0 HD13 LEU B 225 85.862 -6.980 -3.541 1.00 0.00 H new ATOM 0 HD21 LEU B 225 87.017 -5.047 -5.761 1.00 0.00 H new ATOM 0 HD22 LEU B 225 86.105 -4.410 -4.372 1.00 0.00 H new ATOM 0 HD23 LEU B 225 87.741 -3.801 -4.717 1.00 0.00 H new ATOM 865 N ILE B 226 90.966 -6.076 -1.305 1.00 0.00 N ATOM 866 CA ILE B 226 92.398 -6.440 -1.719 1.00 0.00 C ATOM 867 C ILE B 226 92.878 -7.767 -1.020 1.00 0.00 C ATOM 868 O ILE B 226 93.311 -8.691 -1.680 1.00 0.00 O ATOM 869 CB ILE B 226 93.375 -5.221 -1.343 1.00 0.00 C ATOM 870 CG1 ILE B 226 92.824 -3.817 -1.939 1.00 0.00 C ATOM 871 CG2 ILE B 226 94.881 -5.485 -1.837 1.00 0.00 C ATOM 872 CD1 ILE B 226 92.713 -3.767 -3.493 1.00 0.00 C ATOM 0 H ILE B 226 90.898 -5.243 -0.721 1.00 0.00 H new ATOM 0 HA ILE B 226 92.421 -6.614 -2.795 1.00 0.00 H new ATOM 0 HB ILE B 226 93.388 -5.153 -0.255 1.00 0.00 H new ATOM 0 HG12 ILE B 226 91.841 -3.617 -1.512 1.00 0.00 H new ATOM 0 HG13 ILE B 226 93.484 -3.014 -1.610 1.00 0.00 H new ATOM 0 HG21 ILE B 226 95.508 -4.637 -1.563 1.00 0.00 H new ATOM 0 HG22 ILE B 226 95.266 -6.389 -1.364 1.00 0.00 H new ATOM 0 HG23 ILE B 226 94.892 -5.609 -2.920 1.00 0.00 H new ATOM 0 HD11 ILE B 226 92.336 -2.791 -3.800 1.00 0.00 H new ATOM 0 HD12 ILE B 226 93.696 -3.931 -3.933 1.00 0.00 H new ATOM 0 HD13 ILE B 226 92.028 -4.544 -3.834 1.00 0.00 H new ATOM 884 N VAL B 227 92.820 -7.799 0.329 1.00 0.00 N ATOM 885 CA VAL B 227 93.274 -8.988 1.187 1.00 0.00 C ATOM 886 C VAL B 227 92.377 -10.246 1.011 1.00 0.00 C ATOM 887 O VAL B 227 92.851 -11.369 1.137 1.00 0.00 O ATOM 888 CB VAL B 227 93.407 -8.525 2.720 1.00 0.00 C ATOM 889 CG1 VAL B 227 94.467 -7.320 2.848 1.00 0.00 C ATOM 890 CG2 VAL B 227 91.990 -8.063 3.292 1.00 0.00 C ATOM 0 H VAL B 227 92.463 -7.019 0.882 1.00 0.00 H new ATOM 0 HA VAL B 227 94.257 -9.304 0.836 1.00 0.00 H new ATOM 0 HB VAL B 227 93.760 -9.374 3.305 1.00 0.00 H new ATOM 0 HG11 VAL B 227 94.548 -7.016 3.892 1.00 0.00 H new ATOM 0 HG12 VAL B 227 95.441 -7.653 2.491 1.00 0.00 H new ATOM 0 HG13 VAL B 227 94.130 -6.474 2.248 1.00 0.00 H new ATOM 0 HG21 VAL B 227 92.101 -7.753 4.331 1.00 0.00 H new ATOM 0 HG22 VAL B 227 91.615 -7.227 2.702 1.00 0.00 H new ATOM 0 HG23 VAL B 227 91.286 -8.893 3.234 1.00 0.00 H new ATOM 900 N ALA B 228 91.056 -10.021 0.834 1.00 0.00 N ATOM 901 CA ALA B 228 90.013 -11.136 0.774 1.00 0.00 C ATOM 902 C ALA B 228 90.286 -12.192 -0.346 1.00 0.00 C ATOM 903 O ALA B 228 89.923 -13.350 -0.177 1.00 0.00 O ATOM 904 CB ALA B 228 88.592 -10.480 0.582 1.00 0.00 C ATOM 0 H ALA B 228 90.661 -9.087 0.728 1.00 0.00 H new ATOM 0 HA ALA B 228 90.065 -11.688 1.712 1.00 0.00 H new ATOM 0 HB1 ALA B 228 87.834 -11.262 0.537 1.00 0.00 H new ATOM 0 HB2 ALA B 228 88.381 -9.817 1.421 1.00 0.00 H new ATOM 0 HB3 ALA B 228 88.578 -9.907 -0.345 1.00 0.00 H new ATOM 910 N VAL B 229 90.908 -11.794 -1.491 1.00 0.00 N ATOM 911 CA VAL B 229 91.201 -12.778 -2.641 1.00 0.00 C ATOM 912 C VAL B 229 92.088 -13.962 -2.140 1.00 0.00 C ATOM 913 O VAL B 229 91.914 -15.100 -2.557 1.00 0.00 O ATOM 914 CB VAL B 229 91.855 -12.022 -3.907 1.00 0.00 C ATOM 915 CG1 VAL B 229 90.962 -10.753 -4.305 1.00 0.00 C ATOM 916 CG2 VAL B 229 93.372 -11.572 -3.631 1.00 0.00 C ATOM 0 H VAL B 229 91.218 -10.838 -1.667 1.00 0.00 H new ATOM 0 HA VAL B 229 90.255 -13.199 -2.981 1.00 0.00 H new ATOM 0 HB VAL B 229 91.877 -12.729 -4.736 1.00 0.00 H new ATOM 0 HG11 VAL B 229 91.409 -10.247 -5.161 1.00 0.00 H new ATOM 0 HG12 VAL B 229 89.956 -11.083 -4.564 1.00 0.00 H new ATOM 0 HG13 VAL B 229 90.912 -10.064 -3.462 1.00 0.00 H new ATOM 0 HG21 VAL B 229 93.768 -11.068 -4.512 1.00 0.00 H new ATOM 0 HG22 VAL B 229 93.401 -10.891 -2.780 1.00 0.00 H new ATOM 0 HG23 VAL B 229 93.978 -12.451 -3.413 1.00 0.00 H new ATOM 926 N PHE B 230 93.049 -13.643 -1.220 1.00 0.00 N ATOM 927 CA PHE B 230 93.997 -14.675 -0.616 1.00 0.00 C ATOM 928 C PHE B 230 93.218 -15.606 0.364 1.00 0.00 C ATOM 929 O PHE B 230 93.509 -16.791 0.463 1.00 0.00 O ATOM 930 CB PHE B 230 95.180 -13.923 0.118 1.00 0.00 C ATOM 931 CG PHE B 230 96.081 -13.148 -0.941 1.00 0.00 C ATOM 932 CD1 PHE B 230 97.121 -13.838 -1.648 1.00 0.00 C ATOM 933 CD2 PHE B 230 95.870 -11.761 -1.229 1.00 0.00 C ATOM 934 CE1 PHE B 230 97.915 -13.158 -2.602 1.00 0.00 C ATOM 935 CE2 PHE B 230 96.674 -11.094 -2.185 1.00 0.00 C ATOM 936 CZ PHE B 230 97.693 -11.792 -2.868 1.00 0.00 C ATOM 0 H PHE B 230 93.199 -12.695 -0.874 1.00 0.00 H new ATOM 0 HA PHE B 230 94.418 -15.302 -1.402 1.00 0.00 H new ATOM 0 HB2 PHE B 230 94.777 -13.220 0.847 1.00 0.00 H new ATOM 0 HB3 PHE B 230 95.789 -14.639 0.669 1.00 0.00 H new ATOM 0 HD1 PHE B 230 97.300 -14.885 -1.451 1.00 0.00 H new ATOM 0 HD2 PHE B 230 95.091 -11.219 -0.713 1.00 0.00 H new ATOM 0 HE1 PHE B 230 98.695 -13.688 -3.129 1.00 0.00 H new ATOM 0 HE2 PHE B 230 96.507 -10.047 -2.392 1.00 0.00 H new ATOM 0 HZ PHE B 230 98.304 -11.278 -3.596 1.00 0.00 H new ATOM 946 N VAL B 231 92.221 -15.026 1.086 1.00 0.00 N ATOM 947 CA VAL B 231 91.355 -15.790 2.092 1.00 0.00 C ATOM 948 C VAL B 231 90.454 -16.803 1.323 1.00 0.00 C ATOM 949 O VAL B 231 90.203 -17.904 1.792 1.00 0.00 O ATOM 950 CB VAL B 231 90.491 -14.754 2.968 1.00 0.00 C ATOM 951 CG1 VAL B 231 89.622 -15.505 4.093 1.00 0.00 C ATOM 952 CG2 VAL B 231 91.461 -13.673 3.656 1.00 0.00 C ATOM 0 H VAL B 231 91.980 -14.038 1.007 1.00 0.00 H new ATOM 0 HA VAL B 231 91.982 -16.353 2.783 1.00 0.00 H new ATOM 0 HB VAL B 231 89.799 -14.248 2.295 1.00 0.00 H new ATOM 0 HG11 VAL B 231 89.053 -14.771 4.663 1.00 0.00 H new ATOM 0 HG12 VAL B 231 88.936 -16.205 3.616 1.00 0.00 H new ATOM 0 HG13 VAL B 231 90.287 -16.049 4.764 1.00 0.00 H new ATOM 0 HG21 VAL B 231 90.867 -12.976 4.247 1.00 0.00 H new ATOM 0 HG22 VAL B 231 92.173 -14.184 4.304 1.00 0.00 H new ATOM 0 HG23 VAL B 231 92.001 -13.126 2.884 1.00 0.00 H new ATOM 962 N CYS B 232 89.977 -16.380 0.123 1.00 0.00 N ATOM 963 CA CYS B 232 89.086 -17.228 -0.772 1.00 0.00 C ATOM 964 C CYS B 232 89.883 -18.453 -1.321 1.00 0.00 C ATOM 965 O CYS B 232 89.374 -19.557 -1.388 1.00 0.00 O ATOM 966 CB CYS B 232 88.556 -16.324 -1.947 1.00 0.00 C ATOM 967 SG CYS B 232 87.584 -14.940 -1.279 1.00 0.00 S ATOM 0 H CYS B 232 90.184 -15.459 -0.264 1.00 0.00 H new ATOM 0 HA CYS B 232 88.240 -17.615 -0.204 1.00 0.00 H new ATOM 0 HB2 CYS B 232 89.395 -15.942 -2.529 1.00 0.00 H new ATOM 0 HB3 CYS B 232 87.941 -16.917 -2.624 1.00 0.00 H new ATOM 0 HG CYS B 232 88.385 -14.057 -0.761 1.00 0.00 H new ATOM 973 N LYS B 233 91.151 -18.196 -1.721 1.00 0.00 N ATOM 974 CA LYS B 233 92.090 -19.250 -2.296 1.00 0.00 C ATOM 975 C LYS B 233 92.558 -20.226 -1.185 1.00 0.00 C ATOM 976 O LYS B 233 92.720 -21.412 -1.425 1.00 0.00 O ATOM 977 CB LYS B 233 93.315 -18.495 -2.975 1.00 0.00 C ATOM 978 CG LYS B 233 94.335 -19.482 -3.719 1.00 0.00 C ATOM 979 CD LYS B 233 95.475 -18.702 -4.537 1.00 0.00 C ATOM 980 CE LYS B 233 96.438 -17.852 -3.614 1.00 0.00 C ATOM 981 NZ LYS B 233 97.587 -17.353 -4.430 1.00 0.00 N ATOM 0 H LYS B 233 91.571 -17.268 -1.665 1.00 0.00 H new ATOM 0 HA LYS B 233 91.578 -19.853 -3.046 1.00 0.00 H new ATOM 0 HB2 LYS B 233 92.933 -17.770 -3.694 1.00 0.00 H new ATOM 0 HB3 LYS B 233 93.855 -17.934 -2.212 1.00 0.00 H new ATOM 0 HG2 LYS B 233 94.805 -20.133 -2.982 1.00 0.00 H new ATOM 0 HG3 LYS B 233 93.779 -20.123 -4.403 1.00 0.00 H new ATOM 0 HD2 LYS B 233 96.067 -19.424 -5.100 1.00 0.00 H new ATOM 0 HD3 LYS B 233 95.003 -18.041 -5.264 1.00 0.00 H new ATOM 0 HE2 LYS B 233 95.896 -17.014 -3.177 1.00 0.00 H new ATOM 0 HE3 LYS B 233 96.801 -18.462 -2.787 1.00 0.00 H new ATOM 0 HZ1 LYS B 233 98.224 -16.793 -3.827 1.00 0.00 H new ATOM 0 HZ2 LYS B 233 98.108 -18.161 -4.827 1.00 0.00 H new ATOM 0 HZ3 LYS B 233 97.230 -16.757 -5.204 1.00 0.00 H new ATOM 995 N SER B 234 92.784 -19.690 0.036 1.00 0.00 N ATOM 996 CA SER B 234 93.273 -20.510 1.227 1.00 0.00 C ATOM 997 C SER B 234 92.234 -21.585 1.644 1.00 0.00 C ATOM 998 O SER B 234 92.579 -22.513 2.353 1.00 0.00 O ATOM 999 CB SER B 234 93.568 -19.546 2.429 1.00 0.00 C ATOM 1000 OG SER B 234 92.351 -18.973 2.891 1.00 0.00 O ATOM 0 H SER B 234 92.644 -18.702 0.247 1.00 0.00 H new ATOM 0 HA SER B 234 94.185 -21.032 0.937 1.00 0.00 H new ATOM 0 HB2 SER B 234 94.054 -20.094 3.237 1.00 0.00 H new ATOM 0 HB3 SER B 234 94.256 -18.760 2.118 1.00 0.00 H new ATOM 0 HG SER B 234 91.752 -18.820 2.131 1.00 0.00 H new ATOM 1006 N LEU B 235 90.959 -21.422 1.194 1.00 0.00 N ATOM 1007 CA LEU B 235 89.819 -22.386 1.523 1.00 0.00 C ATOM 1008 C LEU B 235 89.836 -23.601 0.543 1.00 0.00 C ATOM 1009 O LEU B 235 89.540 -24.721 0.935 1.00 0.00 O ATOM 1010 CB LEU B 235 88.456 -21.579 1.428 1.00 0.00 C ATOM 1011 CG LEU B 235 87.122 -22.438 1.765 1.00 0.00 C ATOM 1012 CD1 LEU B 235 87.149 -23.050 3.232 1.00 0.00 C ATOM 1013 CD2 LEU B 235 85.816 -21.543 1.552 1.00 0.00 C ATOM 0 H LEU B 235 90.674 -20.641 0.603 1.00 0.00 H new ATOM 0 HA LEU B 235 89.933 -22.788 2.530 1.00 0.00 H new ATOM 0 HB2 LEU B 235 88.506 -20.731 2.111 1.00 0.00 H new ATOM 0 HB3 LEU B 235 88.362 -21.172 0.421 1.00 0.00 H new ATOM 0 HG LEU B 235 87.096 -23.278 1.071 1.00 0.00 H new ATOM 0 HD11 LEU B 235 86.234 -23.615 3.407 1.00 0.00 H new ATOM 0 HD12 LEU B 235 88.009 -23.711 3.335 1.00 0.00 H new ATOM 0 HD13 LEU B 235 87.222 -22.243 3.961 1.00 0.00 H new ATOM 0 HD21 LEU B 235 84.929 -22.133 1.782 1.00 0.00 H new ATOM 0 HD22 LEU B 235 85.857 -20.677 2.212 1.00 0.00 H new ATOM 0 HD23 LEU B 235 85.770 -21.207 0.516 1.00 0.00 H new ATOM 1025 N LEU B 236 90.170 -23.335 -0.752 1.00 0.00 N ATOM 1026 CA LEU B 236 90.215 -24.402 -1.864 1.00 0.00 C ATOM 1027 C LEU B 236 91.613 -25.092 -1.889 1.00 0.00 C ATOM 1028 O LEU B 236 91.738 -26.191 -2.405 1.00 0.00 O ATOM 1029 CB LEU B 236 89.881 -23.724 -3.278 1.00 0.00 C ATOM 1030 CG LEU B 236 88.296 -23.504 -3.549 1.00 0.00 C ATOM 1031 CD1 LEU B 236 87.619 -22.603 -2.438 1.00 0.00 C ATOM 1032 CD2 LEU B 236 88.052 -22.890 -5.004 1.00 0.00 C ATOM 0 H LEU B 236 90.416 -22.400 -1.078 1.00 0.00 H new ATOM 0 HA LEU B 236 89.465 -25.167 -1.663 1.00 0.00 H new ATOM 0 HB2 LEU B 236 90.386 -22.760 -3.335 1.00 0.00 H new ATOM 0 HB3 LEU B 236 90.292 -24.346 -4.073 1.00 0.00 H new ATOM 0 HG LEU B 236 87.821 -24.484 -3.499 1.00 0.00 H new ATOM 0 HD11 LEU B 236 86.559 -22.484 -2.662 1.00 0.00 H new ATOM 0 HD12 LEU B 236 87.733 -23.079 -1.464 1.00 0.00 H new ATOM 0 HD13 LEU B 236 88.098 -21.624 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU B 236 86.983 -22.750 -5.165 1.00 0.00 H new ATOM 0 HD22 LEU B 236 88.560 -21.929 -5.083 1.00 0.00 H new ATOM 0 HD23 LEU B 236 88.447 -23.572 -5.757 1.00 0.00 H new ATOM 1214 N LEU C 211 86.441 8.920 16.721 1.00 0.00 N ATOM 1215 CA LEU C 211 86.603 8.086 15.449 1.00 0.00 C ATOM 1216 C LEU C 211 86.801 8.999 14.230 1.00 0.00 C ATOM 1217 O LEU C 211 86.974 8.501 13.131 1.00 0.00 O ATOM 1218 CB LEU C 211 85.314 7.152 15.257 1.00 0.00 C ATOM 1219 CG LEU C 211 85.272 5.847 16.231 1.00 0.00 C ATOM 1220 CD1 LEU C 211 86.198 4.656 15.721 1.00 0.00 C ATOM 1221 CD2 LEU C 211 85.617 6.226 17.731 1.00 0.00 C ATOM 0 HA LEU C 211 87.487 7.455 15.542 1.00 0.00 H new ATOM 0 HB2 LEU C 211 84.419 7.749 15.433 1.00 0.00 H new ATOM 0 HB3 LEU C 211 85.275 6.817 14.220 1.00 0.00 H new ATOM 0 HG LEU C 211 84.245 5.483 16.196 1.00 0.00 H new ATOM 0 HD11 LEU C 211 86.126 3.817 16.413 1.00 0.00 H new ATOM 0 HD12 LEU C 211 85.871 4.339 14.731 1.00 0.00 H new ATOM 0 HD13 LEU C 211 87.232 4.996 15.670 1.00 0.00 H new ATOM 0 HD21 LEU C 211 85.579 5.330 18.351 1.00 0.00 H new ATOM 0 HD22 LEU C 211 86.617 6.657 17.777 1.00 0.00 H new ATOM 0 HD23 LEU C 211 84.892 6.952 18.099 1.00 0.00 H new ATOM 1233 N SER C 212 86.764 10.339 14.443 1.00 0.00 N ATOM 1234 CA SER C 212 86.938 11.352 13.326 1.00 0.00 C ATOM 1235 C SER C 212 88.379 11.321 12.780 1.00 0.00 C ATOM 1236 O SER C 212 88.601 11.697 11.653 1.00 0.00 O ATOM 1237 CB SER C 212 86.585 12.788 13.840 1.00 0.00 C ATOM 1238 OG SER C 212 87.523 13.180 14.839 1.00 0.00 O ATOM 0 H SER C 212 86.618 10.758 15.362 1.00 0.00 H new ATOM 0 HA SER C 212 86.259 11.090 12.515 1.00 0.00 H new ATOM 0 HB2 SER C 212 86.602 13.497 13.012 1.00 0.00 H new ATOM 0 HB3 SER C 212 85.575 12.801 14.249 1.00 0.00 H new ATOM 0 HG SER C 212 87.303 14.080 15.159 1.00 0.00 H new ATOM 1244 N GLY C 213 89.344 10.891 13.616 1.00 0.00 N ATOM 1245 CA GLY C 213 90.803 10.802 13.205 1.00 0.00 C ATOM 1246 C GLY C 213 91.120 9.594 12.294 1.00 0.00 C ATOM 1247 O GLY C 213 91.762 9.744 11.259 1.00 0.00 O ATOM 0 H GLY C 213 89.166 10.597 14.576 1.00 0.00 H new ATOM 0 HA2 GLY C 213 91.082 11.719 12.687 1.00 0.00 H new ATOM 0 HA3 GLY C 213 91.421 10.742 14.101 1.00 0.00 H new ATOM 1251 N ILE C 214 90.702 8.364 12.728 1.00 0.00 N ATOM 1252 CA ILE C 214 91.001 7.069 11.960 1.00 0.00 C ATOM 1253 C ILE C 214 90.265 7.002 10.599 1.00 0.00 C ATOM 1254 O ILE C 214 90.820 6.515 9.621 1.00 0.00 O ATOM 1255 CB ILE C 214 90.696 5.780 12.874 1.00 0.00 C ATOM 1256 CG1 ILE C 214 91.309 4.429 12.212 1.00 0.00 C ATOM 1257 CG2 ILE C 214 89.130 5.622 13.150 1.00 0.00 C ATOM 1258 CD1 ILE C 214 91.198 3.179 13.133 1.00 0.00 C ATOM 0 H ILE C 214 90.167 8.223 13.585 1.00 0.00 H new ATOM 0 HA ILE C 214 92.065 7.070 11.725 1.00 0.00 H new ATOM 0 HB ILE C 214 91.190 5.935 13.833 1.00 0.00 H new ATOM 0 HG12 ILE C 214 90.791 4.226 11.274 1.00 0.00 H new ATOM 0 HG13 ILE C 214 92.358 4.598 11.967 1.00 0.00 H new ATOM 0 HG21 ILE C 214 88.957 4.742 13.770 1.00 0.00 H new ATOM 0 HG22 ILE C 214 88.760 6.508 13.666 1.00 0.00 H new ATOM 0 HG23 ILE C 214 88.603 5.508 12.203 1.00 0.00 H new ATOM 0 HD11 ILE C 214 91.627 2.314 12.626 1.00 0.00 H new ATOM 0 HD12 ILE C 214 91.740 3.362 14.061 1.00 0.00 H new ATOM 0 HD13 ILE C 214 90.149 2.984 13.358 1.00 0.00 H new ATOM 1270 N ILE C 215 88.971 7.447 10.559 1.00 0.00 N ATOM 1271 CA ILE C 215 88.131 7.371 9.265 1.00 0.00 C ATOM 1272 C ILE C 215 88.849 8.071 8.062 1.00 0.00 C ATOM 1273 O ILE C 215 88.680 7.651 6.934 1.00 0.00 O ATOM 1274 CB ILE C 215 86.650 7.929 9.512 1.00 0.00 C ATOM 1275 CG1 ILE C 215 85.681 7.740 8.222 1.00 0.00 C ATOM 1276 CG2 ILE C 215 86.699 9.461 9.941 1.00 0.00 C ATOM 1277 CD1 ILE C 215 85.490 6.261 7.768 1.00 0.00 C ATOM 0 H ILE C 215 88.481 7.850 11.358 1.00 0.00 H new ATOM 0 HA ILE C 215 88.034 6.322 8.987 1.00 0.00 H new ATOM 0 HB ILE C 215 86.223 7.336 10.321 1.00 0.00 H new ATOM 0 HG12 ILE C 215 84.704 8.165 8.452 1.00 0.00 H new ATOM 0 HG13 ILE C 215 86.090 8.312 7.389 1.00 0.00 H new ATOM 0 HG21 ILE C 215 85.685 9.825 10.105 1.00 0.00 H new ATOM 0 HG22 ILE C 215 87.275 9.563 10.861 1.00 0.00 H new ATOM 0 HG23 ILE C 215 87.171 10.045 9.151 1.00 0.00 H new ATOM 0 HD11 ILE C 215 84.829 6.229 6.902 1.00 0.00 H new ATOM 0 HD12 ILE C 215 86.457 5.834 7.503 1.00 0.00 H new ATOM 0 HD13 ILE C 215 85.050 5.685 8.582 1.00 0.00 H new ATOM 1289 N ILE C 216 89.627 9.166 8.315 1.00 0.00 N ATOM 1290 CA ILE C 216 90.369 9.915 7.194 1.00 0.00 C ATOM 1291 C ILE C 216 91.520 9.005 6.633 1.00 0.00 C ATOM 1292 O ILE C 216 91.789 8.979 5.441 1.00 0.00 O ATOM 1293 CB ILE C 216 90.972 11.301 7.751 1.00 0.00 C ATOM 1294 CG1 ILE C 216 89.863 12.142 8.567 1.00 0.00 C ATOM 1295 CG2 ILE C 216 91.606 12.193 6.578 1.00 0.00 C ATOM 1296 CD1 ILE C 216 88.630 12.592 7.741 1.00 0.00 C ATOM 0 H ILE C 216 89.769 9.558 9.246 1.00 0.00 H new ATOM 0 HA ILE C 216 89.669 10.145 6.391 1.00 0.00 H new ATOM 0 HB ILE C 216 91.775 11.040 8.440 1.00 0.00 H new ATOM 0 HG12 ILE C 216 89.517 11.537 9.405 1.00 0.00 H new ATOM 0 HG13 ILE C 216 90.340 13.027 8.988 1.00 0.00 H new ATOM 0 HG21 ILE C 216 92.001 13.118 6.997 1.00 0.00 H new ATOM 0 HG22 ILE C 216 92.412 11.640 6.096 1.00 0.00 H new ATOM 0 HG23 ILE C 216 90.836 12.427 5.843 1.00 0.00 H new ATOM 0 HD11 ILE C 216 87.946 13.149 8.382 1.00 0.00 H new ATOM 0 HD12 ILE C 216 88.956 13.228 6.918 1.00 0.00 H new ATOM 0 HD13 ILE C 216 88.120 11.715 7.342 1.00 0.00 H new ATOM 1308 N TYR C 217 92.226 8.334 7.572 1.00 0.00 N ATOM 1309 CA TYR C 217 93.441 7.460 7.278 1.00 0.00 C ATOM 1310 C TYR C 217 93.139 6.190 6.413 1.00 0.00 C ATOM 1311 O TYR C 217 93.928 5.868 5.527 1.00 0.00 O ATOM 1312 CB TYR C 217 94.098 7.059 8.666 1.00 0.00 C ATOM 1313 CG TYR C 217 95.473 6.281 8.483 1.00 0.00 C ATOM 1314 CD1 TYR C 217 96.629 6.980 8.010 1.00 0.00 C ATOM 1315 CD2 TYR C 217 95.599 4.876 8.771 1.00 0.00 C ATOM 1316 CE1 TYR C 217 97.855 6.298 7.836 1.00 0.00 C ATOM 1317 CE2 TYR C 217 96.839 4.222 8.587 1.00 0.00 C ATOM 1318 CZ TYR C 217 97.952 4.933 8.124 1.00 0.00 C ATOM 1319 OH TYR C 217 99.160 4.280 7.950 1.00 0.00 O ATOM 0 H TYR C 217 91.989 8.367 8.563 1.00 0.00 H new ATOM 0 HA TYR C 217 94.127 8.045 6.665 1.00 0.00 H new ATOM 0 HB2 TYR C 217 94.268 7.958 9.258 1.00 0.00 H new ATOM 0 HB3 TYR C 217 93.403 6.435 9.227 1.00 0.00 H new ATOM 0 HD1 TYR C 217 96.564 8.034 7.785 1.00 0.00 H new ATOM 0 HD2 TYR C 217 94.745 4.320 9.128 1.00 0.00 H new ATOM 0 HE1 TYR C 217 98.722 6.834 7.479 1.00 0.00 H new ATOM 0 HE2 TYR C 217 96.928 3.168 8.805 1.00 0.00 H new ATOM 0 HH TYR C 217 99.060 3.336 8.195 1.00 0.00 H new ATOM 1329 N VAL C 218 92.041 5.427 6.710 1.00 0.00 N ATOM 1330 CA VAL C 218 91.733 4.121 5.946 1.00 0.00 C ATOM 1331 C VAL C 218 91.587 4.364 4.408 1.00 0.00 C ATOM 1332 O VAL C 218 91.975 3.525 3.603 1.00 0.00 O ATOM 1333 CB VAL C 218 90.450 3.377 6.576 1.00 0.00 C ATOM 1334 CG1 VAL C 218 90.717 3.020 8.120 1.00 0.00 C ATOM 1335 CG2 VAL C 218 89.137 4.278 6.440 1.00 0.00 C ATOM 0 H VAL C 218 91.365 5.660 7.438 1.00 0.00 H new ATOM 0 HA VAL C 218 92.586 3.454 6.067 1.00 0.00 H new ATOM 0 HB VAL C 218 90.288 2.454 6.019 1.00 0.00 H new ATOM 0 HG11 VAL C 218 89.843 2.518 8.534 1.00 0.00 H new ATOM 0 HG12 VAL C 218 91.583 2.363 8.197 1.00 0.00 H new ATOM 0 HG13 VAL C 218 90.907 3.937 8.678 1.00 0.00 H new ATOM 0 HG21 VAL C 218 88.287 3.751 6.873 1.00 0.00 H new ATOM 0 HG22 VAL C 218 89.286 5.220 6.967 1.00 0.00 H new ATOM 0 HG23 VAL C 218 88.941 4.478 5.387 1.00 0.00 H new ATOM 1345 N THR C 219 91.021 5.540 4.030 1.00 0.00 N ATOM 1346 CA THR C 219 90.809 5.945 2.570 1.00 0.00 C ATOM 1347 C THR C 219 92.166 6.074 1.836 1.00 0.00 C ATOM 1348 O THR C 219 92.348 5.557 0.741 1.00 0.00 O ATOM 1349 CB THR C 219 90.041 7.340 2.497 1.00 0.00 C ATOM 1350 OG1 THR C 219 90.900 8.370 2.982 1.00 0.00 O ATOM 1351 CG2 THR C 219 88.750 7.354 3.385 1.00 0.00 C ATOM 0 H THR C 219 90.696 6.239 4.698 1.00 0.00 H new ATOM 0 HA THR C 219 90.214 5.171 2.085 1.00 0.00 H new ATOM 0 HB THR C 219 89.757 7.497 1.457 1.00 0.00 H new ATOM 0 HG1 THR C 219 91.002 8.281 3.953 1.00 0.00 H new ATOM 0 HG21 THR C 219 88.262 8.325 3.302 1.00 0.00 H new ATOM 0 HG22 THR C 219 88.067 6.575 3.047 1.00 0.00 H new ATOM 0 HG23 THR C 219 89.022 7.172 4.425 1.00 0.00 H new ATOM 1359 N VAL C 220 93.109 6.798 2.487 1.00 0.00 N ATOM 1360 CA VAL C 220 94.501 7.052 1.935 1.00 0.00 C ATOM 1361 C VAL C 220 95.294 5.714 1.901 1.00 0.00 C ATOM 1362 O VAL C 220 95.894 5.369 0.897 1.00 0.00 O ATOM 1363 CB VAL C 220 95.227 8.168 2.836 1.00 0.00 C ATOM 1364 CG1 VAL C 220 96.695 8.519 2.287 1.00 0.00 C ATOM 1365 CG2 VAL C 220 94.331 9.501 2.894 1.00 0.00 C ATOM 0 H VAL C 220 92.949 7.226 3.399 1.00 0.00 H new ATOM 0 HA VAL C 220 94.450 7.429 0.914 1.00 0.00 H new ATOM 0 HB VAL C 220 95.337 7.758 3.840 1.00 0.00 H new ATOM 0 HG11 VAL C 220 97.150 9.277 2.924 1.00 0.00 H new ATOM 0 HG12 VAL C 220 97.311 7.620 2.296 1.00 0.00 H new ATOM 0 HG13 VAL C 220 96.621 8.899 1.268 1.00 0.00 H new ATOM 0 HG21 VAL C 220 94.832 10.250 3.507 1.00 0.00 H new ATOM 0 HG22 VAL C 220 94.193 9.891 1.885 1.00 0.00 H new ATOM 0 HG23 VAL C 220 93.359 9.268 3.329 1.00 0.00 H new ATOM 1375 N ALA C 221 95.272 4.971 3.039 1.00 0.00 N ATOM 1376 CA ALA C 221 96.009 3.645 3.178 1.00 0.00 C ATOM 1377 C ALA C 221 95.645 2.653 2.027 1.00 0.00 C ATOM 1378 O ALA C 221 96.493 1.908 1.561 1.00 0.00 O ATOM 1379 CB ALA C 221 95.679 3.018 4.584 1.00 0.00 C ATOM 0 H ALA C 221 94.762 5.248 3.878 1.00 0.00 H new ATOM 0 HA ALA C 221 97.080 3.833 3.103 1.00 0.00 H new ATOM 0 HB1 ALA C 221 96.203 2.068 4.691 1.00 0.00 H new ATOM 0 HB2 ALA C 221 96.000 3.700 5.371 1.00 0.00 H new ATOM 0 HB3 ALA C 221 94.605 2.851 4.665 1.00 0.00 H new ATOM 1385 N ALA C 222 94.350 2.670 1.596 1.00 0.00 N ATOM 1386 CA ALA C 222 93.830 1.761 0.490 1.00 0.00 C ATOM 1387 C ALA C 222 94.534 2.048 -0.873 1.00 0.00 C ATOM 1388 O ALA C 222 94.922 1.128 -1.584 1.00 0.00 O ATOM 1389 CB ALA C 222 92.272 1.967 0.380 1.00 0.00 C ATOM 0 H ALA C 222 93.640 3.292 1.984 1.00 0.00 H new ATOM 0 HA ALA C 222 94.054 0.723 0.737 1.00 0.00 H new ATOM 0 HB1 ALA C 222 91.875 1.326 -0.407 1.00 0.00 H new ATOM 0 HB2 ALA C 222 91.803 1.709 1.330 1.00 0.00 H new ATOM 0 HB3 ALA C 222 92.059 3.009 0.141 1.00 0.00 H new ATOM 1395 N VAL C 223 94.673 3.354 -1.214 1.00 0.00 N ATOM 1396 CA VAL C 223 95.326 3.818 -2.515 1.00 0.00 C ATOM 1397 C VAL C 223 96.855 3.534 -2.461 1.00 0.00 C ATOM 1398 O VAL C 223 97.444 3.089 -3.437 1.00 0.00 O ATOM 1399 CB VAL C 223 94.993 5.372 -2.744 1.00 0.00 C ATOM 1400 CG1 VAL C 223 95.631 5.929 -4.111 1.00 0.00 C ATOM 1401 CG2 VAL C 223 93.401 5.601 -2.749 1.00 0.00 C ATOM 0 H VAL C 223 94.350 4.120 -0.624 1.00 0.00 H new ATOM 0 HA VAL C 223 94.928 3.266 -3.367 1.00 0.00 H new ATOM 0 HB VAL C 223 95.440 5.928 -1.920 1.00 0.00 H new ATOM 0 HG11 VAL C 223 95.381 6.984 -4.226 1.00 0.00 H new ATOM 0 HG12 VAL C 223 96.714 5.814 -4.080 1.00 0.00 H new ATOM 0 HG13 VAL C 223 95.230 5.367 -4.955 1.00 0.00 H new ATOM 0 HG21 VAL C 223 93.186 6.658 -2.905 1.00 0.00 H new ATOM 0 HG22 VAL C 223 92.952 5.017 -3.552 1.00 0.00 H new ATOM 0 HG23 VAL C 223 92.985 5.283 -1.793 1.00 0.00 H new ATOM 1411 N VAL C 224 97.480 3.796 -1.283 1.00 0.00 N ATOM 1412 CA VAL C 224 98.973 3.564 -1.052 1.00 0.00 C ATOM 1413 C VAL C 224 99.291 2.044 -1.191 1.00 0.00 C ATOM 1414 O VAL C 224 100.361 1.681 -1.642 1.00 0.00 O ATOM 1415 CB VAL C 224 99.358 4.161 0.387 1.00 0.00 C ATOM 1416 CG1 VAL C 224 100.844 3.778 0.858 1.00 0.00 C ATOM 1417 CG2 VAL C 224 99.187 5.764 0.380 1.00 0.00 C ATOM 0 H VAL C 224 96.994 4.168 -0.467 1.00 0.00 H new ATOM 0 HA VAL C 224 99.579 4.077 -1.799 1.00 0.00 H new ATOM 0 HB VAL C 224 98.674 3.708 1.104 1.00 0.00 H new ATOM 0 HG11 VAL C 224 101.039 4.213 1.838 1.00 0.00 H new ATOM 0 HG12 VAL C 224 100.939 2.694 0.917 1.00 0.00 H new ATOM 0 HG13 VAL C 224 101.565 4.166 0.139 1.00 0.00 H new ATOM 0 HG21 VAL C 224 99.450 6.162 1.360 1.00 0.00 H new ATOM 0 HG22 VAL C 224 99.843 6.197 -0.375 1.00 0.00 H new ATOM 0 HG23 VAL C 224 98.152 6.019 0.151 1.00 0.00 H new ATOM 1427 N LEU C 225 98.327 1.169 -0.799 1.00 0.00 N ATOM 1428 CA LEU C 225 98.500 -0.358 -0.876 1.00 0.00 C ATOM 1429 C LEU C 225 98.844 -0.788 -2.344 1.00 0.00 C ATOM 1430 O LEU C 225 99.759 -1.562 -2.589 1.00 0.00 O ATOM 1431 CB LEU C 225 97.147 -1.059 -0.359 1.00 0.00 C ATOM 1432 CG LEU C 225 97.313 -2.576 0.214 1.00 0.00 C ATOM 1433 CD1 LEU C 225 98.151 -3.507 -0.754 1.00 0.00 C ATOM 1434 CD2 LEU C 225 97.909 -2.611 1.697 1.00 0.00 C ATOM 0 H LEU C 225 97.424 1.462 -0.427 1.00 0.00 H new ATOM 0 HA LEU C 225 99.326 -0.676 -0.240 1.00 0.00 H new ATOM 0 HB2 LEU C 225 96.715 -0.439 0.426 1.00 0.00 H new ATOM 0 HB3 LEU C 225 96.431 -1.077 -1.181 1.00 0.00 H new ATOM 0 HG LEU C 225 96.302 -2.981 0.259 1.00 0.00 H new ATOM 0 HD11 LEU C 225 98.229 -4.505 -0.322 1.00 0.00 H new ATOM 0 HD12 LEU C 225 97.652 -3.569 -1.721 1.00 0.00 H new ATOM 0 HD13 LEU C 225 99.149 -3.090 -0.886 1.00 0.00 H new ATOM 0 HD21 LEU C 225 97.998 -3.645 2.029 1.00 0.00 H new ATOM 0 HD22 LEU C 225 98.892 -2.141 1.705 1.00 0.00 H new ATOM 0 HD23 LEU C 225 97.243 -2.070 2.370 1.00 0.00 H new ATOM 1446 N ILE C 226 98.061 -0.243 -3.306 1.00 0.00 N ATOM 1447 CA ILE C 226 98.217 -0.539 -4.794 1.00 0.00 C ATOM 1448 C ILE C 226 99.559 0.068 -5.335 1.00 0.00 C ATOM 1449 O ILE C 226 100.325 -0.606 -5.986 1.00 0.00 O ATOM 1450 CB ILE C 226 96.924 0.041 -5.566 1.00 0.00 C ATOM 1451 CG1 ILE C 226 95.570 -0.597 -4.931 1.00 0.00 C ATOM 1452 CG2 ILE C 226 97.001 -0.257 -7.147 1.00 0.00 C ATOM 1453 CD1 ILE C 226 94.260 0.026 -5.499 1.00 0.00 C ATOM 0 H ILE C 226 97.305 0.410 -3.100 1.00 0.00 H new ATOM 0 HA ILE C 226 98.272 -1.614 -4.968 1.00 0.00 H new ATOM 0 HB ILE C 226 96.905 1.123 -5.436 1.00 0.00 H new ATOM 0 HG12 ILE C 226 95.562 -1.671 -5.118 1.00 0.00 H new ATOM 0 HG13 ILE C 226 95.587 -0.462 -3.850 1.00 0.00 H new ATOM 0 HG21 ILE C 226 96.115 0.147 -7.637 1.00 0.00 H new ATOM 0 HG22 ILE C 226 97.892 0.214 -7.563 1.00 0.00 H new ATOM 0 HG23 ILE C 226 97.048 -1.333 -7.312 1.00 0.00 H new ATOM 0 HD11 ILE C 226 93.398 -0.448 -5.030 1.00 0.00 H new ATOM 0 HD12 ILE C 226 94.245 1.095 -5.289 1.00 0.00 H new ATOM 0 HD13 ILE C 226 94.219 -0.132 -6.577 1.00 0.00 H new ATOM 1465 N VAL C 227 99.770 1.370 -5.077 1.00 0.00 N ATOM 1466 CA VAL C 227 100.986 2.170 -5.550 1.00 0.00 C ATOM 1467 C VAL C 227 102.325 1.698 -4.904 1.00 0.00 C ATOM 1468 O VAL C 227 103.371 1.819 -5.533 1.00 0.00 O ATOM 1469 CB VAL C 227 100.701 3.731 -5.301 1.00 0.00 C ATOM 1470 CG1 VAL C 227 101.933 4.664 -5.750 1.00 0.00 C ATOM 1471 CG2 VAL C 227 99.371 4.179 -6.086 1.00 0.00 C ATOM 0 H VAL C 227 99.115 1.930 -4.532 1.00 0.00 H new ATOM 0 HA VAL C 227 101.124 1.992 -6.617 1.00 0.00 H new ATOM 0 HB VAL C 227 100.566 3.863 -4.227 1.00 0.00 H new ATOM 0 HG11 VAL C 227 101.687 5.709 -5.560 1.00 0.00 H new ATOM 0 HG12 VAL C 227 102.822 4.391 -5.181 1.00 0.00 H new ATOM 0 HG13 VAL C 227 102.126 4.525 -6.814 1.00 0.00 H new ATOM 0 HG21 VAL C 227 99.185 5.239 -5.912 1.00 0.00 H new ATOM 0 HG22 VAL C 227 99.503 4.005 -7.154 1.00 0.00 H new ATOM 0 HG23 VAL C 227 98.522 3.598 -5.725 1.00 0.00 H new ATOM 1481 N ALA C 228 102.302 1.283 -3.612 1.00 0.00 N ATOM 1482 CA ALA C 228 103.579 0.936 -2.837 1.00 0.00 C ATOM 1483 C ALA C 228 104.434 -0.190 -3.504 1.00 0.00 C ATOM 1484 O ALA C 228 105.658 -0.119 -3.462 1.00 0.00 O ATOM 1485 CB ALA C 228 103.191 0.523 -1.363 1.00 0.00 C ATOM 0 H ALA C 228 101.445 1.173 -3.070 1.00 0.00 H new ATOM 0 HA ALA C 228 104.206 1.828 -2.839 1.00 0.00 H new ATOM 0 HB1 ALA C 228 104.094 0.275 -0.805 1.00 0.00 H new ATOM 0 HB2 ALA C 228 102.680 1.353 -0.875 1.00 0.00 H new ATOM 0 HB3 ALA C 228 102.531 -0.344 -1.390 1.00 0.00 H new ATOM 1491 N VAL C 229 103.792 -1.229 -4.090 1.00 0.00 N ATOM 1492 CA VAL C 229 104.554 -2.380 -4.754 1.00 0.00 C ATOM 1493 C VAL C 229 105.208 -1.939 -6.102 1.00 0.00 C ATOM 1494 O VAL C 229 106.299 -2.396 -6.431 1.00 0.00 O ATOM 1495 CB VAL C 229 103.608 -3.674 -4.916 1.00 0.00 C ATOM 1496 CG1 VAL C 229 102.970 -4.066 -3.494 1.00 0.00 C ATOM 1497 CG2 VAL C 229 102.447 -3.438 -5.993 1.00 0.00 C ATOM 0 H VAL C 229 102.777 -1.319 -4.131 1.00 0.00 H new ATOM 0 HA VAL C 229 105.377 -2.665 -4.099 1.00 0.00 H new ATOM 0 HB VAL C 229 104.228 -4.494 -5.279 1.00 0.00 H new ATOM 0 HG11 VAL C 229 102.331 -4.942 -3.611 1.00 0.00 H new ATOM 0 HG12 VAL C 229 103.768 -4.291 -2.787 1.00 0.00 H new ATOM 0 HG13 VAL C 229 102.377 -3.232 -3.119 1.00 0.00 H new ATOM 0 HG21 VAL C 229 101.834 -4.336 -6.070 1.00 0.00 H new ATOM 0 HG22 VAL C 229 101.825 -2.599 -5.680 1.00 0.00 H new ATOM 0 HG23 VAL C 229 102.891 -3.218 -6.964 1.00 0.00 H new ATOM 1507 N PHE C 230 104.503 -1.074 -6.906 1.00 0.00 N ATOM 1508 CA PHE C 230 105.038 -0.618 -8.269 1.00 0.00 C ATOM 1509 C PHE C 230 106.276 0.323 -8.117 1.00 0.00 C ATOM 1510 O PHE C 230 107.241 0.185 -8.867 1.00 0.00 O ATOM 1511 CB PHE C 230 103.892 0.098 -9.113 1.00 0.00 C ATOM 1512 CG PHE C 230 102.731 -0.915 -9.523 1.00 0.00 C ATOM 1513 CD1 PHE C 230 103.004 -1.992 -10.431 1.00 0.00 C ATOM 1514 CD2 PHE C 230 101.396 -0.787 -9.013 1.00 0.00 C ATOM 1515 CE1 PHE C 230 101.982 -2.901 -10.800 1.00 0.00 C ATOM 1516 CE2 PHE C 230 100.386 -1.703 -9.395 1.00 0.00 C ATOM 1517 CZ PHE C 230 100.679 -2.756 -10.283 1.00 0.00 C ATOM 0 H PHE C 230 103.594 -0.682 -6.659 1.00 0.00 H new ATOM 0 HA PHE C 230 105.363 -1.508 -8.807 1.00 0.00 H new ATOM 0 HB2 PHE C 230 103.470 0.916 -8.530 1.00 0.00 H new ATOM 0 HB3 PHE C 230 104.324 0.537 -10.012 1.00 0.00 H new ATOM 0 HD1 PHE C 230 103.998 -2.111 -10.837 1.00 0.00 H new ATOM 0 HD2 PHE C 230 101.159 0.016 -8.331 1.00 0.00 H new ATOM 0 HE1 PHE C 230 102.203 -3.710 -11.481 1.00 0.00 H new ATOM 0 HE2 PHE C 230 99.386 -1.593 -9.003 1.00 0.00 H new ATOM 0 HZ PHE C 230 99.905 -3.453 -10.568 1.00 0.00 H new ATOM 1527 N VAL C 231 106.243 1.292 -7.150 1.00 0.00 N ATOM 1528 CA VAL C 231 107.418 2.263 -6.944 1.00 0.00 C ATOM 1529 C VAL C 231 108.654 1.498 -6.384 1.00 0.00 C ATOM 1530 O VAL C 231 109.785 1.853 -6.662 1.00 0.00 O ATOM 1531 CB VAL C 231 106.970 3.486 -6.004 1.00 0.00 C ATOM 1532 CG1 VAL C 231 105.737 4.270 -6.671 1.00 0.00 C ATOM 1533 CG2 VAL C 231 106.569 2.966 -4.548 1.00 0.00 C ATOM 0 H VAL C 231 105.459 1.437 -6.514 1.00 0.00 H new ATOM 0 HA VAL C 231 107.713 2.690 -7.903 1.00 0.00 H new ATOM 0 HB VAL C 231 107.814 4.169 -5.903 1.00 0.00 H new ATOM 0 HG11 VAL C 231 105.440 5.097 -6.026 1.00 0.00 H new ATOM 0 HG12 VAL C 231 106.036 4.658 -7.645 1.00 0.00 H new ATOM 0 HG13 VAL C 231 104.896 3.587 -6.795 1.00 0.00 H new ATOM 0 HG21 VAL C 231 106.269 3.812 -3.929 1.00 0.00 H new ATOM 0 HG22 VAL C 231 105.740 2.263 -4.628 1.00 0.00 H new ATOM 0 HG23 VAL C 231 107.424 2.468 -4.091 1.00 0.00 H new ATOM 1543 N CYS C 232 108.386 0.437 -5.573 1.00 0.00 N ATOM 1544 CA CYS C 232 109.467 -0.427 -4.934 1.00 0.00 C ATOM 1545 C CYS C 232 110.234 -1.237 -6.020 1.00 0.00 C ATOM 1546 O CYS C 232 111.440 -1.426 -5.940 1.00 0.00 O ATOM 1547 CB CYS C 232 108.777 -1.385 -3.892 1.00 0.00 C ATOM 1548 SG CYS C 232 110.004 -2.371 -2.969 1.00 0.00 S ATOM 0 H CYS C 232 107.438 0.145 -5.335 1.00 0.00 H new ATOM 0 HA CYS C 232 110.199 0.201 -4.425 1.00 0.00 H new ATOM 0 HB2 CYS C 232 108.183 -0.796 -3.193 1.00 0.00 H new ATOM 0 HB3 CYS C 232 108.089 -2.053 -4.411 1.00 0.00 H new ATOM 0 HG CYS C 232 109.391 -3.143 -2.122 1.00 0.00 H new ATOM 1554 N LYS C 233 109.466 -1.727 -7.019 1.00 0.00 N ATOM 1555 CA LYS C 233 109.992 -2.571 -8.172 1.00 0.00 C ATOM 1556 C LYS C 233 110.911 -1.748 -9.106 1.00 0.00 C ATOM 1557 O LYS C 233 111.777 -2.307 -9.754 1.00 0.00 O ATOM 1558 CB LYS C 233 108.735 -3.174 -8.943 1.00 0.00 C ATOM 1559 CG LYS C 233 109.137 -4.191 -10.114 1.00 0.00 C ATOM 1560 CD LYS C 233 107.868 -4.925 -10.768 1.00 0.00 C ATOM 1561 CE LYS C 233 106.884 -3.935 -11.512 1.00 0.00 C ATOM 1562 NZ LYS C 233 105.865 -4.728 -12.266 1.00 0.00 N ATOM 0 H LYS C 233 108.461 -1.562 -7.070 1.00 0.00 H new ATOM 0 HA LYS C 233 110.612 -3.383 -7.793 1.00 0.00 H new ATOM 0 HB2 LYS C 233 108.092 -3.689 -8.229 1.00 0.00 H new ATOM 0 HB3 LYS C 233 108.151 -2.357 -9.366 1.00 0.00 H new ATOM 0 HG2 LYS C 233 109.676 -3.648 -10.890 1.00 0.00 H new ATOM 0 HG3 LYS C 233 109.820 -4.942 -9.717 1.00 0.00 H new ATOM 0 HD2 LYS C 233 108.217 -5.678 -11.475 1.00 0.00 H new ATOM 0 HD3 LYS C 233 107.320 -5.452 -9.987 1.00 0.00 H new ATOM 0 HE2 LYS C 233 106.393 -3.281 -10.791 1.00 0.00 H new ATOM 0 HE3 LYS C 233 107.442 -3.294 -12.195 1.00 0.00 H new ATOM 0 HZ1 LYS C 233 105.215 -4.081 -12.757 1.00 0.00 H new ATOM 0 HZ2 LYS C 233 106.343 -5.334 -12.963 1.00 0.00 H new ATOM 0 HZ3 LYS C 233 105.327 -5.321 -11.603 1.00 0.00 H new