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 29:sc= 0.0853 USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 THR OG1 : rot -69:sc= 0.443 USER MOD Single : A 232 CYS SG : rot 72:sc= 1.24 USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 SER OG : rot 95:sc= 1.28 USER MOD Single : B 212 SER OG : rot -32:sc= 0.0289 USER MOD Single : B 217 TYR OH : rot 180:sc= 0 USER MOD Single : B 219 THR OG1 : rot -59:sc= 0.691 USER MOD Single : B 232 CYS SG : rot 180:sc= 0 USER MOD Single : B 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 234 SER OG : rot -47:sc= 1.3 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 -60:sc= 0.135 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 86.874 20.201 -0.617 1.00 0.00 N ATOM 72 CA SER A 212 85.511 19.554 -0.401 1.00 0.00 C ATOM 73 C SER A 212 85.248 18.430 -1.444 1.00 0.00 C ATOM 74 O SER A 212 84.677 17.400 -1.133 1.00 0.00 O ATOM 75 CB SER A 212 84.418 20.670 -0.474 1.00 0.00 C ATOM 76 OG SER A 212 84.666 21.618 0.558 1.00 0.00 O ATOM 0 HA SER A 212 85.481 19.079 0.580 1.00 0.00 H new ATOM 0 HB2 SER A 212 84.440 21.158 -1.449 1.00 0.00 H new ATOM 0 HB3 SER A 212 83.425 20.235 -0.357 1.00 0.00 H new ATOM 0 HG SER A 212 85.626 21.647 0.752 1.00 0.00 H new ATOM 82 N GLY A 213 85.676 18.685 -2.690 1.00 0.00 N ATOM 83 CA GLY A 213 85.520 17.711 -3.843 1.00 0.00 C ATOM 84 C GLY A 213 86.518 16.549 -3.724 1.00 0.00 C ATOM 85 O GLY A 213 86.226 15.420 -4.087 1.00 0.00 O ATOM 0 H GLY A 213 86.139 19.556 -2.952 1.00 0.00 H new ATOM 0 HA2 GLY A 213 84.502 17.320 -3.858 1.00 0.00 H new ATOM 0 HA3 GLY A 213 85.675 18.233 -4.787 1.00 0.00 H new ATOM 89 N ILE A 214 87.735 16.883 -3.234 1.00 0.00 N ATOM 90 CA ILE A 214 88.897 15.902 -3.070 1.00 0.00 C ATOM 91 C ILE A 214 88.550 14.793 -2.027 1.00 0.00 C ATOM 92 O ILE A 214 88.783 13.615 -2.288 1.00 0.00 O ATOM 93 CB ILE A 214 90.234 16.747 -2.708 1.00 0.00 C ATOM 94 CG1 ILE A 214 90.820 17.504 -4.026 1.00 0.00 C ATOM 95 CG2 ILE A 214 91.405 15.850 -2.058 1.00 0.00 C ATOM 96 CD1 ILE A 214 89.782 18.388 -4.773 1.00 0.00 C ATOM 0 H ILE A 214 87.965 17.831 -2.935 1.00 0.00 H new ATOM 0 HA ILE A 214 89.084 15.366 -4.000 1.00 0.00 H new ATOM 0 HB ILE A 214 89.922 17.476 -1.960 1.00 0.00 H new ATOM 0 HG12 ILE A 214 91.662 18.128 -3.727 1.00 0.00 H new ATOM 0 HG13 ILE A 214 91.207 16.756 -4.718 1.00 0.00 H new ATOM 0 HG21 ILE A 214 92.268 16.480 -1.841 1.00 0.00 H new ATOM 0 HG22 ILE A 214 91.046 15.397 -1.134 1.00 0.00 H new ATOM 0 HG23 ILE A 214 91.694 15.066 -2.758 1.00 0.00 H new ATOM 0 HD11 ILE A 214 90.256 18.854 -5.637 1.00 0.00 H new ATOM 0 HD12 ILE A 214 88.949 17.769 -5.106 1.00 0.00 H new ATOM 0 HD13 ILE A 214 89.412 19.162 -4.100 1.00 0.00 H new ATOM 108 N ILE A 215 88.015 15.182 -0.831 1.00 0.00 N ATOM 109 CA ILE A 215 87.665 14.166 0.272 1.00 0.00 C ATOM 110 C ILE A 215 86.526 13.203 -0.201 1.00 0.00 C ATOM 111 O ILE A 215 86.530 12.031 0.148 1.00 0.00 O ATOM 112 CB ILE A 215 87.344 14.917 1.651 1.00 0.00 C ATOM 113 CG1 ILE A 215 87.045 13.885 2.870 1.00 0.00 C ATOM 114 CG2 ILE A 215 86.129 15.930 1.478 1.00 0.00 C ATOM 115 CD1 ILE A 215 88.213 12.899 3.186 1.00 0.00 C ATOM 0 H ILE A 215 87.813 16.152 -0.588 1.00 0.00 H new ATOM 0 HA ILE A 215 88.530 13.533 0.467 1.00 0.00 H new ATOM 0 HB ILE A 215 88.241 15.478 1.914 1.00 0.00 H new ATOM 0 HG12 ILE A 215 86.819 14.460 3.768 1.00 0.00 H new ATOM 0 HG13 ILE A 215 86.153 13.306 2.629 1.00 0.00 H new ATOM 0 HG21 ILE A 215 85.931 16.427 2.428 1.00 0.00 H new ATOM 0 HG22 ILE A 215 86.382 16.676 0.724 1.00 0.00 H new ATOM 0 HG23 ILE A 215 85.241 15.382 1.163 1.00 0.00 H new ATOM 0 HD11 ILE A 215 87.926 12.248 4.012 1.00 0.00 H new ATOM 0 HD12 ILE A 215 88.427 12.294 2.305 1.00 0.00 H new ATOM 0 HD13 ILE A 215 89.103 13.465 3.462 1.00 0.00 H new ATOM 127 N ILE A 216 85.556 13.708 -1.022 1.00 0.00 N ATOM 128 CA ILE A 216 84.432 12.835 -1.596 1.00 0.00 C ATOM 129 C ILE A 216 85.042 11.862 -2.668 1.00 0.00 C ATOM 130 O ILE A 216 84.724 10.685 -2.718 1.00 0.00 O ATOM 131 CB ILE A 216 83.281 13.774 -2.229 1.00 0.00 C ATOM 132 CG1 ILE A 216 82.630 14.706 -1.073 1.00 0.00 C ATOM 133 CG2 ILE A 216 82.131 12.906 -2.953 1.00 0.00 C ATOM 134 CD1 ILE A 216 81.650 15.789 -1.620 1.00 0.00 C ATOM 0 H ILE A 216 85.511 14.686 -1.307 1.00 0.00 H new ATOM 0 HA ILE A 216 83.973 12.238 -0.808 1.00 0.00 H new ATOM 0 HB ILE A 216 83.746 14.404 -2.987 1.00 0.00 H new ATOM 0 HG12 ILE A 216 82.098 14.072 -0.364 1.00 0.00 H new ATOM 0 HG13 ILE A 216 83.431 15.198 -0.522 1.00 0.00 H new ATOM 0 HG21 ILE A 216 81.376 13.575 -3.366 1.00 0.00 H new ATOM 0 HG22 ILE A 216 82.572 12.317 -3.757 1.00 0.00 H new ATOM 0 HG23 ILE A 216 81.667 12.239 -2.226 1.00 0.00 H new ATOM 0 HD11 ILE A 216 81.254 16.374 -0.790 1.00 0.00 H new ATOM 0 HD12 ILE A 216 82.182 16.448 -2.307 1.00 0.00 H new ATOM 0 HD13 ILE A 216 80.828 15.304 -2.146 1.00 0.00 H new ATOM 146 N TYR A 217 85.853 12.459 -3.572 1.00 0.00 N ATOM 147 CA TYR A 217 86.485 11.759 -4.774 1.00 0.00 C ATOM 148 C TYR A 217 87.562 10.672 -4.435 1.00 0.00 C ATOM 149 O TYR A 217 87.636 9.670 -5.142 1.00 0.00 O ATOM 150 CB TYR A 217 87.083 12.890 -5.708 1.00 0.00 C ATOM 151 CG TYR A 217 87.728 12.323 -7.047 1.00 0.00 C ATOM 152 CD1 TYR A 217 86.891 11.730 -8.047 1.00 0.00 C ATOM 153 CD2 TYR A 217 89.143 12.385 -7.295 1.00 0.00 C ATOM 154 CE1 TYR A 217 87.456 11.222 -9.240 1.00 0.00 C ATOM 155 CE2 TYR A 217 89.677 11.868 -8.498 1.00 0.00 C ATOM 156 CZ TYR A 217 88.836 11.293 -9.456 1.00 0.00 C ATOM 157 OH TYR A 217 89.374 10.793 -10.629 1.00 0.00 O ATOM 0 H TYR A 217 86.105 13.446 -3.510 1.00 0.00 H new ATOM 0 HA TYR A 217 85.703 11.184 -5.270 1.00 0.00 H new ATOM 0 HB2 TYR A 217 86.293 13.596 -5.964 1.00 0.00 H new ATOM 0 HB3 TYR A 217 87.840 13.446 -5.155 1.00 0.00 H new ATOM 0 HD1 TYR A 217 85.824 11.671 -7.889 1.00 0.00 H new ATOM 0 HD2 TYR A 217 89.800 12.828 -6.561 1.00 0.00 H new ATOM 0 HE1 TYR A 217 86.818 10.777 -9.989 1.00 0.00 H new ATOM 0 HE2 TYR A 217 90.741 11.918 -8.678 1.00 0.00 H new ATOM 0 HH TYR A 217 90.346 10.921 -10.624 1.00 0.00 H new ATOM 167 N VAL A 218 88.436 10.884 -3.405 1.00 0.00 N ATOM 168 CA VAL A 218 89.563 9.876 -3.075 1.00 0.00 C ATOM 169 C VAL A 218 88.986 8.458 -2.773 1.00 0.00 C ATOM 170 O VAL A 218 89.582 7.448 -3.127 1.00 0.00 O ATOM 171 CB VAL A 218 90.463 10.445 -1.876 1.00 0.00 C ATOM 172 CG1 VAL A 218 89.605 10.628 -0.545 1.00 0.00 C ATOM 173 CG2 VAL A 218 91.750 9.523 -1.600 1.00 0.00 C ATOM 0 H VAL A 218 88.410 11.701 -2.795 1.00 0.00 H new ATOM 0 HA VAL A 218 90.206 9.759 -3.947 1.00 0.00 H new ATOM 0 HB VAL A 218 90.823 11.425 -2.188 1.00 0.00 H new ATOM 0 HG11 VAL A 218 90.243 11.015 0.249 1.00 0.00 H new ATOM 0 HG12 VAL A 218 88.791 11.329 -0.730 1.00 0.00 H new ATOM 0 HG13 VAL A 218 89.193 9.665 -0.242 1.00 0.00 H new ATOM 0 HG21 VAL A 218 92.331 9.945 -0.780 1.00 0.00 H new ATOM 0 HG22 VAL A 218 91.426 8.517 -1.335 1.00 0.00 H new ATOM 0 HG23 VAL A 218 92.367 9.481 -2.498 1.00 0.00 H new ATOM 183 N THR A 219 87.813 8.427 -2.100 1.00 0.00 N ATOM 184 CA THR A 219 87.095 7.140 -1.713 1.00 0.00 C ATOM 185 C THR A 219 86.586 6.394 -2.976 1.00 0.00 C ATOM 186 O THR A 219 86.791 5.200 -3.130 1.00 0.00 O ATOM 187 CB THR A 219 85.861 7.487 -0.768 1.00 0.00 C ATOM 188 OG1 THR A 219 84.860 8.157 -1.533 1.00 0.00 O ATOM 189 CG2 THR A 219 86.263 8.441 0.415 1.00 0.00 C ATOM 0 H THR A 219 87.323 9.270 -1.802 1.00 0.00 H new ATOM 0 HA THR A 219 87.797 6.493 -1.186 1.00 0.00 H new ATOM 0 HB THR A 219 85.500 6.545 -0.355 1.00 0.00 H new ATOM 0 HG1 THR A 219 85.179 9.050 -1.778 1.00 0.00 H new ATOM 0 HG21 THR A 219 85.387 8.647 1.030 1.00 0.00 H new ATOM 0 HG22 THR A 219 87.029 7.962 1.024 1.00 0.00 H new ATOM 0 HG23 THR A 219 86.652 9.376 0.012 1.00 0.00 H new ATOM 197 N VAL A 220 85.912 7.156 -3.871 1.00 0.00 N ATOM 198 CA VAL A 220 85.326 6.621 -5.174 1.00 0.00 C ATOM 199 C VAL A 220 86.474 6.232 -6.146 1.00 0.00 C ATOM 200 O VAL A 220 86.325 5.324 -6.953 1.00 0.00 O ATOM 201 CB VAL A 220 84.339 7.721 -5.808 1.00 0.00 C ATOM 202 CG1 VAL A 220 83.646 7.197 -7.163 1.00 0.00 C ATOM 203 CG2 VAL A 220 83.210 8.130 -4.741 1.00 0.00 C ATOM 0 H VAL A 220 85.748 8.153 -3.734 1.00 0.00 H new ATOM 0 HA VAL A 220 84.742 5.721 -4.984 1.00 0.00 H new ATOM 0 HB VAL A 220 84.940 8.595 -6.059 1.00 0.00 H new ATOM 0 HG11 VAL A 220 82.988 7.971 -7.558 1.00 0.00 H new ATOM 0 HG12 VAL A 220 84.416 6.965 -7.899 1.00 0.00 H new ATOM 0 HG13 VAL A 220 83.065 6.300 -6.951 1.00 0.00 H new ATOM 0 HG21 VAL A 220 82.547 8.875 -5.180 1.00 0.00 H new ATOM 0 HG22 VAL A 220 82.632 7.247 -4.466 1.00 0.00 H new ATOM 0 HG23 VAL A 220 83.684 8.545 -3.851 1.00 0.00 H new ATOM 213 N ALA A 221 87.617 6.967 -6.058 1.00 0.00 N ATOM 214 CA ALA A 221 88.828 6.728 -6.949 1.00 0.00 C ATOM 215 C ALA A 221 89.428 5.311 -6.713 1.00 0.00 C ATOM 216 O ALA A 221 89.941 4.684 -7.632 1.00 0.00 O ATOM 217 CB ALA A 221 89.902 7.848 -6.677 1.00 0.00 C ATOM 0 H ALA A 221 87.742 7.728 -5.390 1.00 0.00 H new ATOM 0 HA ALA A 221 88.516 6.777 -7.992 1.00 0.00 H new ATOM 0 HB1 ALA A 221 90.771 7.681 -7.313 1.00 0.00 H new ATOM 0 HB2 ALA A 221 89.473 8.825 -6.899 1.00 0.00 H new ATOM 0 HB3 ALA A 221 90.206 7.814 -5.631 1.00 0.00 H new ATOM 223 N ALA A 222 89.370 4.842 -5.443 1.00 0.00 N ATOM 224 CA ALA A 222 89.920 3.486 -5.038 1.00 0.00 C ATOM 225 C ALA A 222 89.058 2.316 -5.601 1.00 0.00 C ATOM 226 O ALA A 222 89.590 1.318 -6.056 1.00 0.00 O ATOM 227 CB ALA A 222 89.991 3.432 -3.465 1.00 0.00 C ATOM 0 H ALA A 222 88.954 5.364 -4.672 1.00 0.00 H new ATOM 0 HA ALA A 222 90.916 3.362 -5.462 1.00 0.00 H new ATOM 0 HB1 ALA A 222 90.384 2.465 -3.152 1.00 0.00 H new ATOM 0 HB2 ALA A 222 90.646 4.224 -3.103 1.00 0.00 H new ATOM 0 HB3 ALA A 222 88.992 3.569 -3.051 1.00 0.00 H new ATOM 233 N VAL A 223 87.717 2.451 -5.502 1.00 0.00 N ATOM 234 CA VAL A 223 86.724 1.374 -5.943 1.00 0.00 C ATOM 235 C VAL A 223 86.759 1.144 -7.485 1.00 0.00 C ATOM 236 O VAL A 223 86.720 -0.001 -7.931 1.00 0.00 O ATOM 237 CB VAL A 223 85.254 1.777 -5.427 1.00 0.00 C ATOM 238 CG1 VAL A 223 84.148 0.677 -5.817 1.00 0.00 C ATOM 239 CG2 VAL A 223 85.266 1.989 -3.832 1.00 0.00 C ATOM 0 H VAL A 223 87.270 3.286 -5.124 1.00 0.00 H new ATOM 0 HA VAL A 223 87.009 0.422 -5.495 1.00 0.00 H new ATOM 0 HB VAL A 223 84.983 2.709 -5.924 1.00 0.00 H new ATOM 0 HG11 VAL A 223 83.173 0.994 -5.447 1.00 0.00 H new ATOM 0 HG12 VAL A 223 84.108 0.570 -6.901 1.00 0.00 H new ATOM 0 HG13 VAL A 223 84.413 -0.280 -5.368 1.00 0.00 H new ATOM 0 HG21 VAL A 223 84.266 2.261 -3.494 1.00 0.00 H new ATOM 0 HG22 VAL A 223 85.575 1.064 -3.344 1.00 0.00 H new ATOM 0 HG23 VAL A 223 85.965 2.785 -3.576 1.00 0.00 H new ATOM 249 N VAL A 224 86.797 2.238 -8.303 1.00 0.00 N ATOM 250 CA VAL A 224 86.795 2.105 -9.828 1.00 0.00 C ATOM 251 C VAL A 224 88.106 1.438 -10.324 1.00 0.00 C ATOM 252 O VAL A 224 88.108 0.751 -11.334 1.00 0.00 O ATOM 253 CB VAL A 224 86.533 3.539 -10.499 1.00 0.00 C ATOM 254 CG1 VAL A 224 87.684 4.570 -10.121 1.00 0.00 C ATOM 255 CG2 VAL A 224 86.365 3.432 -12.093 1.00 0.00 C ATOM 0 H VAL A 224 86.829 3.200 -7.965 1.00 0.00 H new ATOM 0 HA VAL A 224 85.981 1.448 -10.136 1.00 0.00 H new ATOM 0 HB VAL A 224 85.593 3.914 -10.095 1.00 0.00 H new ATOM 0 HG11 VAL A 224 87.479 5.532 -10.590 1.00 0.00 H new ATOM 0 HG12 VAL A 224 87.720 4.694 -9.039 1.00 0.00 H new ATOM 0 HG13 VAL A 224 88.643 4.191 -10.475 1.00 0.00 H new ATOM 0 HG21 VAL A 224 86.189 4.425 -12.508 1.00 0.00 H new ATOM 0 HG22 VAL A 224 87.273 3.013 -12.527 1.00 0.00 H new ATOM 0 HG23 VAL A 224 85.519 2.786 -12.327 1.00 0.00 H new ATOM 265 N LEU A 225 89.230 1.695 -9.601 1.00 0.00 N ATOM 266 CA LEU A 225 90.607 1.153 -9.975 1.00 0.00 C ATOM 267 C LEU A 225 90.660 -0.412 -9.959 1.00 0.00 C ATOM 268 O LEU A 225 91.372 -1.003 -10.763 1.00 0.00 O ATOM 269 CB LEU A 225 91.670 1.808 -8.998 1.00 0.00 C ATOM 270 CG LEU A 225 93.212 1.380 -9.258 1.00 0.00 C ATOM 271 CD1 LEU A 225 93.685 1.673 -10.743 1.00 0.00 C ATOM 272 CD2 LEU A 225 94.173 2.117 -8.211 1.00 0.00 C ATOM 0 H LEU A 225 89.231 2.268 -8.757 1.00 0.00 H new ATOM 0 HA LEU A 225 90.841 1.426 -11.004 1.00 0.00 H new ATOM 0 HB2 LEU A 225 91.593 2.892 -9.080 1.00 0.00 H new ATOM 0 HB3 LEU A 225 91.406 1.546 -7.973 1.00 0.00 H new ATOM 0 HG LEU A 225 93.274 0.301 -9.113 1.00 0.00 H new ATOM 0 HD11 LEU A 225 94.725 1.367 -10.861 1.00 0.00 H new ATOM 0 HD12 LEU A 225 93.061 1.114 -11.441 1.00 0.00 H new ATOM 0 HD13 LEU A 225 93.595 2.739 -10.950 1.00 0.00 H new ATOM 0 HD21 LEU A 225 95.206 1.822 -8.395 1.00 0.00 H new ATOM 0 HD22 LEU A 225 94.078 3.197 -8.327 1.00 0.00 H new ATOM 0 HD23 LEU A 225 93.890 1.835 -7.197 1.00 0.00 H new ATOM 284 N ILE A 226 89.915 -1.072 -9.020 1.00 0.00 N ATOM 285 CA ILE A 226 89.912 -2.606 -8.903 1.00 0.00 C ATOM 286 C ILE A 226 89.183 -3.271 -10.126 1.00 0.00 C ATOM 287 O ILE A 226 89.719 -4.163 -10.755 1.00 0.00 O ATOM 288 CB ILE A 226 89.225 -3.040 -7.514 1.00 0.00 C ATOM 289 CG1 ILE A 226 89.934 -2.298 -6.258 1.00 0.00 C ATOM 290 CG2 ILE A 226 89.244 -4.633 -7.295 1.00 0.00 C ATOM 291 CD1 ILE A 226 91.452 -2.612 -6.078 1.00 0.00 C ATOM 0 H ILE A 226 89.317 -0.601 -8.341 1.00 0.00 H new ATOM 0 HA ILE A 226 90.943 -2.959 -8.913 1.00 0.00 H new ATOM 0 HB ILE A 226 88.183 -2.726 -7.570 1.00 0.00 H new ATOM 0 HG12 ILE A 226 89.813 -1.221 -6.376 1.00 0.00 H new ATOM 0 HG13 ILE A 226 89.409 -2.580 -5.345 1.00 0.00 H new ATOM 0 HG21 ILE A 226 88.769 -4.875 -6.344 1.00 0.00 H new ATOM 0 HG22 ILE A 226 88.701 -5.118 -8.106 1.00 0.00 H new ATOM 0 HG23 ILE A 226 90.275 -4.987 -7.286 1.00 0.00 H new ATOM 0 HD11 ILE A 226 91.836 -2.070 -5.213 1.00 0.00 H new ATOM 0 HD12 ILE A 226 91.586 -3.683 -5.924 1.00 0.00 H new ATOM 0 HD13 ILE A 226 91.996 -2.303 -6.971 1.00 0.00 H new ATOM 303 N VAL A 227 87.924 -2.858 -10.385 1.00 0.00 N ATOM 304 CA VAL A 227 87.042 -3.440 -11.497 1.00 0.00 C ATOM 305 C VAL A 227 87.549 -3.132 -12.938 1.00 0.00 C ATOM 306 O VAL A 227 87.331 -3.922 -13.844 1.00 0.00 O ATOM 307 CB VAL A 227 85.524 -2.951 -11.276 1.00 0.00 C ATOM 308 CG1 VAL A 227 84.994 -3.413 -9.830 1.00 0.00 C ATOM 309 CG2 VAL A 227 85.421 -1.363 -11.412 1.00 0.00 C ATOM 0 H VAL A 227 87.465 -2.120 -9.851 1.00 0.00 H new ATOM 0 HA VAL A 227 87.094 -4.526 -11.420 1.00 0.00 H new ATOM 0 HB VAL A 227 84.901 -3.409 -12.044 1.00 0.00 H new ATOM 0 HG11 VAL A 227 83.966 -3.076 -9.694 1.00 0.00 H new ATOM 0 HG12 VAL A 227 85.031 -4.500 -9.759 1.00 0.00 H new ATOM 0 HG13 VAL A 227 85.624 -2.977 -9.055 1.00 0.00 H new ATOM 0 HG21 VAL A 227 84.388 -1.051 -11.260 1.00 0.00 H new ATOM 0 HG22 VAL A 227 86.057 -0.892 -10.662 1.00 0.00 H new ATOM 0 HG23 VAL A 227 85.748 -1.061 -12.407 1.00 0.00 H new ATOM 319 N ALA A 228 88.111 -1.918 -13.147 1.00 0.00 N ATOM 320 CA ALA A 228 88.516 -1.410 -14.531 1.00 0.00 C ATOM 321 C ALA A 228 89.535 -2.323 -15.283 1.00 0.00 C ATOM 322 O ALA A 228 89.496 -2.370 -16.508 1.00 0.00 O ATOM 323 CB ALA A 228 89.093 0.048 -14.372 1.00 0.00 C ATOM 0 H ALA A 228 88.304 -1.256 -12.395 1.00 0.00 H new ATOM 0 HA ALA A 228 87.621 -1.420 -15.153 1.00 0.00 H new ATOM 0 HB1 ALA A 228 89.389 0.431 -15.349 1.00 0.00 H new ATOM 0 HB2 ALA A 228 88.329 0.697 -13.944 1.00 0.00 H new ATOM 0 HB3 ALA A 228 89.961 0.026 -13.713 1.00 0.00 H new ATOM 329 N VAL A 229 90.451 -3.031 -14.566 1.00 0.00 N ATOM 330 CA VAL A 229 91.486 -3.939 -15.257 1.00 0.00 C ATOM 331 C VAL A 229 90.783 -5.131 -15.981 1.00 0.00 C ATOM 332 O VAL A 229 91.226 -5.569 -17.035 1.00 0.00 O ATOM 333 CB VAL A 229 92.620 -4.428 -14.224 1.00 0.00 C ATOM 334 CG1 VAL A 229 93.282 -3.158 -13.501 1.00 0.00 C ATOM 335 CG2 VAL A 229 92.040 -5.447 -13.133 1.00 0.00 C ATOM 0 H VAL A 229 90.517 -3.013 -13.548 1.00 0.00 H new ATOM 0 HA VAL A 229 91.997 -3.355 -16.023 1.00 0.00 H new ATOM 0 HB VAL A 229 93.380 -4.962 -14.794 1.00 0.00 H new ATOM 0 HG11 VAL A 229 94.049 -3.495 -12.803 1.00 0.00 H new ATOM 0 HG12 VAL A 229 93.734 -2.508 -14.250 1.00 0.00 H new ATOM 0 HG13 VAL A 229 92.514 -2.607 -12.958 1.00 0.00 H new ATOM 0 HG21 VAL A 229 92.840 -5.751 -12.457 1.00 0.00 H new ATOM 0 HG22 VAL A 229 91.249 -4.959 -12.563 1.00 0.00 H new ATOM 0 HG23 VAL A 229 91.636 -6.326 -13.635 1.00 0.00 H new ATOM 345 N PHE A 230 89.667 -5.637 -15.375 1.00 0.00 N ATOM 346 CA PHE A 230 88.859 -6.796 -15.956 1.00 0.00 C ATOM 347 C PHE A 230 88.115 -6.334 -17.248 1.00 0.00 C ATOM 348 O PHE A 230 87.982 -7.093 -18.200 1.00 0.00 O ATOM 349 CB PHE A 230 87.847 -7.314 -14.859 1.00 0.00 C ATOM 350 CG PHE A 230 88.639 -7.948 -13.634 1.00 0.00 C ATOM 351 CD1 PHE A 230 89.066 -7.138 -12.532 1.00 0.00 C ATOM 352 CD2 PHE A 230 88.965 -9.346 -13.614 1.00 0.00 C ATOM 353 CE1 PHE A 230 89.783 -7.708 -11.454 1.00 0.00 C ATOM 354 CE2 PHE A 230 89.683 -9.902 -12.528 1.00 0.00 C ATOM 355 CZ PHE A 230 90.090 -9.085 -11.452 1.00 0.00 C ATOM 0 H PHE A 230 89.296 -5.278 -14.495 1.00 0.00 H new ATOM 0 HA PHE A 230 89.522 -7.615 -16.234 1.00 0.00 H new ATOM 0 HB2 PHE A 230 87.224 -6.490 -14.511 1.00 0.00 H new ATOM 0 HB3 PHE A 230 87.179 -8.058 -15.293 1.00 0.00 H new ATOM 0 HD1 PHE A 230 88.838 -6.082 -12.524 1.00 0.00 H new ATOM 0 HD2 PHE A 230 88.660 -9.979 -14.434 1.00 0.00 H new ATOM 0 HE1 PHE A 230 90.097 -7.086 -10.629 1.00 0.00 H new ATOM 0 HE2 PHE A 230 89.920 -10.956 -12.523 1.00 0.00 H new ATOM 0 HZ PHE A 230 90.637 -9.514 -10.626 1.00 0.00 H new ATOM 365 N VAL A 231 87.635 -5.062 -17.245 1.00 0.00 N ATOM 366 CA VAL A 231 86.885 -4.440 -18.423 1.00 0.00 C ATOM 367 C VAL A 231 87.862 -4.267 -19.628 1.00 0.00 C ATOM 368 O VAL A 231 87.516 -4.570 -20.759 1.00 0.00 O ATOM 369 CB VAL A 231 86.236 -3.045 -17.959 1.00 0.00 C ATOM 370 CG1 VAL A 231 85.447 -2.319 -19.159 1.00 0.00 C ATOM 371 CG2 VAL A 231 85.240 -3.284 -16.721 1.00 0.00 C ATOM 0 H VAL A 231 87.742 -4.430 -16.452 1.00 0.00 H new ATOM 0 HA VAL A 231 86.074 -5.091 -18.750 1.00 0.00 H new ATOM 0 HB VAL A 231 87.053 -2.391 -17.654 1.00 0.00 H new ATOM 0 HG11 VAL A 231 85.024 -1.380 -18.801 1.00 0.00 H new ATOM 0 HG12 VAL A 231 86.137 -2.117 -19.979 1.00 0.00 H new ATOM 0 HG13 VAL A 231 84.645 -2.967 -19.511 1.00 0.00 H new ATOM 0 HG21 VAL A 231 84.806 -2.332 -16.414 1.00 0.00 H new ATOM 0 HG22 VAL A 231 84.444 -3.966 -17.021 1.00 0.00 H new ATOM 0 HG23 VAL A 231 85.793 -3.716 -15.887 1.00 0.00 H new ATOM 381 N CYS A 232 89.093 -3.760 -19.343 1.00 0.00 N ATOM 382 CA CYS A 232 90.166 -3.517 -20.402 1.00 0.00 C ATOM 383 C CYS A 232 90.575 -4.857 -21.093 1.00 0.00 C ATOM 384 O CYS A 232 90.748 -4.918 -22.304 1.00 0.00 O ATOM 385 CB CYS A 232 91.406 -2.837 -19.709 1.00 0.00 C ATOM 386 SG CYS A 232 90.906 -1.262 -18.952 1.00 0.00 S ATOM 0 H CYS A 232 89.386 -3.506 -18.399 1.00 0.00 H new ATOM 0 HA CYS A 232 89.776 -2.859 -21.179 1.00 0.00 H new ATOM 0 HB2 CYS A 232 91.818 -3.501 -18.949 1.00 0.00 H new ATOM 0 HB3 CYS A 232 92.194 -2.664 -20.442 1.00 0.00 H new ATOM 0 HG CYS A 232 90.186 -1.498 -17.895 1.00 0.00 H new ATOM 392 N LYS A 233 90.717 -5.923 -20.268 1.00 0.00 N ATOM 393 CA LYS A 233 91.108 -7.320 -20.741 1.00 0.00 C ATOM 394 C LYS A 233 89.961 -7.931 -21.590 1.00 0.00 C ATOM 395 O LYS A 233 90.201 -8.582 -22.596 1.00 0.00 O ATOM 396 CB LYS A 233 91.439 -8.209 -19.462 1.00 0.00 C ATOM 397 CG LYS A 233 92.044 -9.646 -19.832 1.00 0.00 C ATOM 398 CD LYS A 233 92.321 -10.559 -18.541 1.00 0.00 C ATOM 399 CE LYS A 233 93.451 -9.986 -17.592 1.00 0.00 C ATOM 400 NZ LYS A 233 93.796 -11.013 -16.561 1.00 0.00 N ATOM 0 H LYS A 233 90.570 -5.864 -19.260 1.00 0.00 H new ATOM 0 HA LYS A 233 91.992 -7.279 -21.377 1.00 0.00 H new ATOM 0 HB2 LYS A 233 92.149 -7.675 -18.830 1.00 0.00 H new ATOM 0 HB3 LYS A 233 90.530 -8.345 -18.876 1.00 0.00 H new ATOM 0 HG2 LYS A 233 91.353 -10.165 -20.496 1.00 0.00 H new ATOM 0 HG3 LYS A 233 92.975 -9.512 -20.382 1.00 0.00 H new ATOM 0 HD2 LYS A 233 91.397 -10.660 -17.972 1.00 0.00 H new ATOM 0 HD3 LYS A 233 92.605 -11.559 -18.868 1.00 0.00 H new ATOM 0 HE2 LYS A 233 94.335 -9.727 -18.175 1.00 0.00 H new ATOM 0 HE3 LYS A 233 93.108 -9.071 -17.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 94.538 -10.641 -15.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 92.950 -11.239 -15.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 94.140 -11.875 -17.031 1.00 0.00 H new ATOM 414 N SER A 234 88.706 -7.695 -21.145 1.00 0.00 N ATOM 415 CA SER A 234 87.456 -8.209 -21.847 1.00 0.00 C ATOM 416 C SER A 234 87.314 -7.552 -23.254 1.00 0.00 C ATOM 417 O SER A 234 86.928 -8.198 -24.212 1.00 0.00 O ATOM 418 CB SER A 234 86.217 -7.894 -20.945 1.00 0.00 C ATOM 419 OG SER A 234 86.352 -8.602 -19.718 1.00 0.00 O ATOM 0 H SER A 234 88.507 -7.153 -20.304 1.00 0.00 H new ATOM 0 HA SER A 234 87.526 -9.286 -21.999 1.00 0.00 H new ATOM 0 HB2 SER A 234 86.149 -6.822 -20.757 1.00 0.00 H new ATOM 0 HB3 SER A 234 85.297 -8.187 -21.451 1.00 0.00 H new ATOM 0 HG SER A 234 86.762 -8.018 -19.047 1.00 0.00 H new ATOM 425 N LEU A 235 87.629 -6.236 -23.317 1.00 0.00 N ATOM 426 CA LEU A 235 87.544 -5.387 -24.591 1.00 0.00 C ATOM 427 C LEU A 235 88.619 -5.862 -25.626 1.00 0.00 C ATOM 428 O LEU A 235 88.383 -5.878 -26.822 1.00 0.00 O ATOM 429 CB LEU A 235 87.738 -3.846 -24.182 1.00 0.00 C ATOM 430 CG LEU A 235 87.122 -2.755 -25.221 1.00 0.00 C ATOM 431 CD1 LEU A 235 87.658 -2.942 -26.695 1.00 0.00 C ATOM 432 CD2 LEU A 235 85.522 -2.701 -25.193 1.00 0.00 C ATOM 0 H LEU A 235 87.951 -5.709 -22.505 1.00 0.00 H new ATOM 0 HA LEU A 235 86.572 -5.502 -25.070 1.00 0.00 H new ATOM 0 HB2 LEU A 235 87.280 -3.688 -23.205 1.00 0.00 H new ATOM 0 HB3 LEU A 235 88.804 -3.651 -24.070 1.00 0.00 H new ATOM 0 HG LEU A 235 87.482 -1.789 -24.866 1.00 0.00 H new ATOM 0 HD11 LEU A 235 87.213 -2.187 -27.343 1.00 0.00 H new ATOM 0 HD12 LEU A 235 88.743 -2.834 -26.704 1.00 0.00 H new ATOM 0 HD13 LEU A 235 87.389 -3.934 -27.057 1.00 0.00 H new ATOM 0 HD21 LEU A 235 85.171 -1.956 -25.906 1.00 0.00 H new ATOM 0 HD22 LEU A 235 85.120 -3.678 -25.462 1.00 0.00 H new ATOM 0 HD23 LEU A 235 85.184 -2.433 -24.192 1.00 0.00 H new ATOM 444 N LEU A 236 89.819 -6.249 -25.117 1.00 0.00 N ATOM 445 CA LEU A 236 90.985 -6.716 -25.991 1.00 0.00 C ATOM 446 C LEU A 236 90.781 -8.195 -26.413 1.00 0.00 C ATOM 447 O LEU A 236 91.259 -8.603 -27.462 1.00 0.00 O ATOM 448 CB LEU A 236 92.324 -6.510 -25.161 1.00 0.00 C ATOM 449 CG LEU A 236 93.679 -7.019 -25.893 1.00 0.00 C ATOM 450 CD1 LEU A 236 93.898 -6.332 -27.304 1.00 0.00 C ATOM 451 CD2 LEU A 236 94.945 -6.787 -24.948 1.00 0.00 C ATOM 0 H LEU A 236 90.026 -6.255 -24.118 1.00 0.00 H new ATOM 0 HA LEU A 236 91.042 -6.135 -26.912 1.00 0.00 H new ATOM 0 HB2 LEU A 236 92.431 -5.450 -24.932 1.00 0.00 H new ATOM 0 HB3 LEU A 236 92.226 -7.033 -24.210 1.00 0.00 H new ATOM 0 HG LEU A 236 93.564 -8.087 -26.076 1.00 0.00 H new ATOM 0 HD11 LEU A 236 94.818 -6.707 -27.752 1.00 0.00 H new ATOM 0 HD12 LEU A 236 93.056 -6.564 -27.956 1.00 0.00 H new ATOM 0 HD13 LEU A 236 93.971 -5.252 -27.176 1.00 0.00 H new ATOM 0 HD21 LEU A 236 95.846 -7.134 -25.455 1.00 0.00 H new ATOM 0 HD22 LEU A 236 95.042 -5.725 -24.723 1.00 0.00 H new ATOM 0 HD23 LEU A 236 94.813 -7.344 -24.020 1.00 0.00 H new ATOM 652 N SER B 212 74.053 9.766 4.940 1.00 0.00 N ATOM 653 CA SER B 212 75.124 9.713 6.026 1.00 0.00 C ATOM 654 C SER B 212 75.692 8.278 6.133 1.00 0.00 C ATOM 655 O SER B 212 76.854 8.078 6.439 1.00 0.00 O ATOM 656 CB SER B 212 74.498 10.167 7.387 1.00 0.00 C ATOM 657 OG SER B 212 73.494 9.235 7.777 1.00 0.00 O ATOM 0 HA SER B 212 75.943 10.386 5.773 1.00 0.00 H new ATOM 0 HB2 SER B 212 75.271 10.229 8.153 1.00 0.00 H new ATOM 0 HB3 SER B 212 74.067 11.163 7.288 1.00 0.00 H new ATOM 0 HG SER B 212 73.064 8.864 6.978 1.00 0.00 H new ATOM 663 N GLY B 213 74.814 7.295 5.885 1.00 0.00 N ATOM 664 CA GLY B 213 75.163 5.826 5.929 1.00 0.00 C ATOM 665 C GLY B 213 75.980 5.379 4.701 1.00 0.00 C ATOM 666 O GLY B 213 76.933 4.619 4.824 1.00 0.00 O ATOM 0 H GLY B 213 73.838 7.472 5.647 1.00 0.00 H new ATOM 0 HA2 GLY B 213 75.731 5.617 6.835 1.00 0.00 H new ATOM 0 HA3 GLY B 213 74.246 5.239 5.985 1.00 0.00 H new ATOM 670 N ILE B 214 75.534 5.814 3.484 1.00 0.00 N ATOM 671 CA ILE B 214 76.178 5.396 2.153 1.00 0.00 C ATOM 672 C ILE B 214 77.655 5.896 2.039 1.00 0.00 C ATOM 673 O ILE B 214 78.504 5.198 1.499 1.00 0.00 O ATOM 674 CB ILE B 214 75.238 5.866 0.899 1.00 0.00 C ATOM 675 CG1 ILE B 214 75.244 4.789 -0.321 1.00 0.00 C ATOM 676 CG2 ILE B 214 75.595 7.328 0.339 1.00 0.00 C ATOM 677 CD1 ILE B 214 76.661 4.478 -0.881 1.00 0.00 C ATOM 0 H ILE B 214 74.742 6.447 3.374 1.00 0.00 H new ATOM 0 HA ILE B 214 76.239 4.308 2.120 1.00 0.00 H new ATOM 0 HB ILE B 214 74.232 5.914 1.316 1.00 0.00 H new ATOM 0 HG12 ILE B 214 74.789 3.861 0.025 1.00 0.00 H new ATOM 0 HG13 ILE B 214 74.620 5.168 -1.130 1.00 0.00 H new ATOM 0 HG21 ILE B 214 74.931 7.572 -0.491 1.00 0.00 H new ATOM 0 HG22 ILE B 214 75.468 8.063 1.134 1.00 0.00 H new ATOM 0 HG23 ILE B 214 76.629 7.343 -0.007 1.00 0.00 H new ATOM 0 HD11 ILE B 214 76.581 3.752 -1.691 1.00 0.00 H new ATOM 0 HD12 ILE B 214 77.112 5.395 -1.259 1.00 0.00 H new ATOM 0 HD13 ILE B 214 77.284 4.068 -0.086 1.00 0.00 H new ATOM 689 N ILE B 215 77.951 7.141 2.528 1.00 0.00 N ATOM 690 CA ILE B 215 79.366 7.730 2.434 1.00 0.00 C ATOM 691 C ILE B 215 80.354 6.963 3.369 1.00 0.00 C ATOM 692 O ILE B 215 81.507 6.786 3.017 1.00 0.00 O ATOM 693 CB ILE B 215 79.334 9.313 2.694 1.00 0.00 C ATOM 694 CG1 ILE B 215 80.787 9.984 2.425 1.00 0.00 C ATOM 695 CG2 ILE B 215 78.803 9.641 4.159 1.00 0.00 C ATOM 696 CD1 ILE B 215 80.770 11.542 2.486 1.00 0.00 C ATOM 0 H ILE B 215 77.270 7.752 2.979 1.00 0.00 H new ATOM 0 HA ILE B 215 79.746 7.592 1.422 1.00 0.00 H new ATOM 0 HB ILE B 215 78.635 9.754 1.983 1.00 0.00 H new ATOM 0 HG12 ILE B 215 81.495 9.607 3.162 1.00 0.00 H new ATOM 0 HG13 ILE B 215 81.148 9.670 1.446 1.00 0.00 H new ATOM 0 HG21 ILE B 215 78.792 10.721 4.309 1.00 0.00 H new ATOM 0 HG22 ILE B 215 77.793 9.248 4.277 1.00 0.00 H new ATOM 0 HG23 ILE B 215 79.460 9.180 4.896 1.00 0.00 H new ATOM 0 HD11 ILE B 215 81.773 11.924 2.297 1.00 0.00 H new ATOM 0 HD12 ILE B 215 80.086 11.928 1.730 1.00 0.00 H new ATOM 0 HD13 ILE B 215 80.439 11.864 3.473 1.00 0.00 H new ATOM 708 N ILE B 216 79.885 6.485 4.561 1.00 0.00 N ATOM 709 CA ILE B 216 80.763 5.665 5.520 1.00 0.00 C ATOM 710 C ILE B 216 81.025 4.263 4.882 1.00 0.00 C ATOM 711 O ILE B 216 82.096 3.693 5.027 1.00 0.00 O ATOM 712 CB ILE B 216 80.061 5.546 6.969 1.00 0.00 C ATOM 713 CG1 ILE B 216 79.865 7.024 7.603 1.00 0.00 C ATOM 714 CG2 ILE B 216 80.919 4.615 7.972 1.00 0.00 C ATOM 715 CD1 ILE B 216 79.025 7.035 8.916 1.00 0.00 C ATOM 0 H ILE B 216 78.933 6.636 4.894 1.00 0.00 H new ATOM 0 HA ILE B 216 81.720 6.164 5.674 1.00 0.00 H new ATOM 0 HB ILE B 216 79.087 5.074 6.837 1.00 0.00 H new ATOM 0 HG12 ILE B 216 80.845 7.456 7.805 1.00 0.00 H new ATOM 0 HG13 ILE B 216 79.380 7.665 6.866 1.00 0.00 H new ATOM 0 HG21 ILE B 216 80.415 4.559 8.937 1.00 0.00 H new ATOM 0 HG22 ILE B 216 81.010 3.614 7.551 1.00 0.00 H new ATOM 0 HG23 ILE B 216 81.912 5.043 8.106 1.00 0.00 H new ATOM 0 HD11 ILE B 216 78.936 8.058 9.282 1.00 0.00 H new ATOM 0 HD12 ILE B 216 78.032 6.633 8.716 1.00 0.00 H new ATOM 0 HD13 ILE B 216 79.519 6.422 9.669 1.00 0.00 H new ATOM 727 N TYR B 217 79.964 3.713 4.246 1.00 0.00 N ATOM 728 CA TYR B 217 79.962 2.319 3.631 1.00 0.00 C ATOM 729 C TYR B 217 81.057 2.095 2.540 1.00 0.00 C ATOM 730 O TYR B 217 81.736 1.076 2.561 1.00 0.00 O ATOM 731 CB TYR B 217 78.515 2.027 3.051 1.00 0.00 C ATOM 732 CG TYR B 217 78.361 0.522 2.546 1.00 0.00 C ATOM 733 CD1 TYR B 217 78.715 0.158 1.204 1.00 0.00 C ATOM 734 CD2 TYR B 217 77.885 -0.511 3.422 1.00 0.00 C ATOM 735 CE1 TYR B 217 78.587 -1.181 0.770 1.00 0.00 C ATOM 736 CE2 TYR B 217 77.767 -1.842 2.959 1.00 0.00 C ATOM 737 CZ TYR B 217 78.115 -2.167 1.644 1.00 0.00 C ATOM 738 OH TYR B 217 77.997 -3.473 1.205 1.00 0.00 O ATOM 0 H TYR B 217 79.077 4.203 4.133 1.00 0.00 H new ATOM 0 HA TYR B 217 80.214 1.614 4.423 1.00 0.00 H new ATOM 0 HB2 TYR B 217 77.770 2.228 3.820 1.00 0.00 H new ATOM 0 HB3 TYR B 217 78.312 2.708 2.225 1.00 0.00 H new ATOM 0 HD1 TYR B 217 79.081 0.911 0.522 1.00 0.00 H new ATOM 0 HD2 TYR B 217 77.616 -0.270 4.440 1.00 0.00 H new ATOM 0 HE1 TYR B 217 78.855 -1.445 -0.242 1.00 0.00 H new ATOM 0 HE2 TYR B 217 77.406 -2.612 3.625 1.00 0.00 H new ATOM 0 HH TYR B 217 77.656 -4.033 1.933 1.00 0.00 H new ATOM 748 N VAL B 218 81.177 3.024 1.555 1.00 0.00 N ATOM 749 CA VAL B 218 82.174 2.853 0.397 1.00 0.00 C ATOM 750 C VAL B 218 83.656 2.744 0.887 1.00 0.00 C ATOM 751 O VAL B 218 84.461 2.060 0.264 1.00 0.00 O ATOM 752 CB VAL B 218 81.978 4.033 -0.682 1.00 0.00 C ATOM 753 CG1 VAL B 218 80.516 3.952 -1.346 1.00 0.00 C ATOM 754 CG2 VAL B 218 82.190 5.462 -0.003 1.00 0.00 C ATOM 0 H VAL B 218 80.627 3.882 1.513 1.00 0.00 H new ATOM 0 HA VAL B 218 81.957 1.902 -0.090 1.00 0.00 H new ATOM 0 HB VAL B 218 82.728 3.904 -1.463 1.00 0.00 H new ATOM 0 HG11 VAL B 218 80.401 4.757 -2.072 1.00 0.00 H new ATOM 0 HG12 VAL B 218 80.397 2.991 -1.847 1.00 0.00 H new ATOM 0 HG13 VAL B 218 79.758 4.053 -0.570 1.00 0.00 H new ATOM 0 HG21 VAL B 218 82.053 6.244 -0.750 1.00 0.00 H new ATOM 0 HG22 VAL B 218 81.464 5.595 0.799 1.00 0.00 H new ATOM 0 HG23 VAL B 218 83.198 5.524 0.406 1.00 0.00 H new ATOM 764 N THR B 219 84.003 3.456 1.989 1.00 0.00 N ATOM 765 CA THR B 219 85.425 3.463 2.551 1.00 0.00 C ATOM 766 C THR B 219 85.808 2.102 3.189 1.00 0.00 C ATOM 767 O THR B 219 86.870 1.563 2.904 1.00 0.00 O ATOM 768 CB THR B 219 85.563 4.609 3.649 1.00 0.00 C ATOM 769 OG1 THR B 219 84.792 4.252 4.800 1.00 0.00 O ATOM 770 CG2 THR B 219 85.031 5.993 3.128 1.00 0.00 C ATOM 0 H THR B 219 83.347 4.032 2.516 1.00 0.00 H new ATOM 0 HA THR B 219 86.103 3.648 1.718 1.00 0.00 H new ATOM 0 HB THR B 219 86.622 4.706 3.887 1.00 0.00 H new ATOM 0 HG1 THR B 219 83.854 4.137 4.542 1.00 0.00 H new ATOM 0 HG21 THR B 219 85.145 6.744 3.910 1.00 0.00 H new ATOM 0 HG22 THR B 219 85.601 6.294 2.249 1.00 0.00 H new ATOM 0 HG23 THR B 219 83.978 5.902 2.863 1.00 0.00 H new ATOM 778 N VAL B 220 84.925 1.561 4.070 1.00 0.00 N ATOM 779 CA VAL B 220 85.180 0.233 4.784 1.00 0.00 C ATOM 780 C VAL B 220 85.041 -0.950 3.790 1.00 0.00 C ATOM 781 O VAL B 220 85.724 -1.961 3.916 1.00 0.00 O ATOM 782 CB VAL B 220 84.201 0.103 6.054 1.00 0.00 C ATOM 783 CG1 VAL B 220 84.509 1.270 7.116 1.00 0.00 C ATOM 784 CG2 VAL B 220 82.672 0.169 5.597 1.00 0.00 C ATOM 0 H VAL B 220 84.037 1.999 4.315 1.00 0.00 H new ATOM 0 HA VAL B 220 86.203 0.203 5.160 1.00 0.00 H new ATOM 0 HB VAL B 220 84.380 -0.863 6.527 1.00 0.00 H new ATOM 0 HG11 VAL B 220 83.840 1.170 7.970 1.00 0.00 H new ATOM 0 HG12 VAL B 220 85.542 1.191 7.454 1.00 0.00 H new ATOM 0 HG13 VAL B 220 84.354 2.241 6.645 1.00 0.00 H new ATOM 0 HG21 VAL B 220 82.027 0.079 6.471 1.00 0.00 H new ATOM 0 HG22 VAL B 220 82.481 1.121 5.101 1.00 0.00 H new ATOM 0 HG23 VAL B 220 82.463 -0.648 4.906 1.00 0.00 H new ATOM 794 N ALA B 221 84.119 -0.796 2.798 1.00 0.00 N ATOM 795 CA ALA B 221 83.849 -1.858 1.743 1.00 0.00 C ATOM 796 C ALA B 221 85.095 -2.071 0.834 1.00 0.00 C ATOM 797 O ALA B 221 85.338 -3.167 0.351 1.00 0.00 O ATOM 798 CB ALA B 221 82.591 -1.444 0.896 1.00 0.00 C ATOM 0 H ALA B 221 83.546 0.041 2.693 1.00 0.00 H new ATOM 0 HA ALA B 221 83.645 -2.808 2.237 1.00 0.00 H new ATOM 0 HB1 ALA B 221 82.396 -2.204 0.139 1.00 0.00 H new ATOM 0 HB2 ALA B 221 81.725 -1.354 1.551 1.00 0.00 H new ATOM 0 HB3 ALA B 221 82.779 -0.487 0.409 1.00 0.00 H new ATOM 804 N ALA B 222 85.847 -0.972 0.575 1.00 0.00 N ATOM 805 CA ALA B 222 87.074 -1.007 -0.322 1.00 0.00 C ATOM 806 C ALA B 222 88.219 -1.856 0.302 1.00 0.00 C ATOM 807 O ALA B 222 88.972 -2.505 -0.413 1.00 0.00 O ATOM 808 CB ALA B 222 87.539 0.477 -0.575 1.00 0.00 C ATOM 0 H ALA B 222 85.644 -0.050 0.961 1.00 0.00 H new ATOM 0 HA ALA B 222 86.819 -1.485 -1.268 1.00 0.00 H new ATOM 0 HB1 ALA B 222 88.420 0.478 -1.217 1.00 0.00 H new ATOM 0 HB2 ALA B 222 86.736 1.032 -1.060 1.00 0.00 H new ATOM 0 HB3 ALA B 222 87.784 0.949 0.377 1.00 0.00 H new ATOM 814 N VAL B 223 88.347 -1.804 1.651 1.00 0.00 N ATOM 815 CA VAL B 223 89.438 -2.552 2.413 1.00 0.00 C ATOM 816 C VAL B 223 89.185 -4.091 2.389 1.00 0.00 C ATOM 817 O VAL B 223 90.093 -4.853 2.079 1.00 0.00 O ATOM 818 CB VAL B 223 89.535 -1.973 3.909 1.00 0.00 C ATOM 819 CG1 VAL B 223 90.684 -2.701 4.766 1.00 0.00 C ATOM 820 CG2 VAL B 223 89.806 -0.389 3.870 1.00 0.00 C ATOM 0 H VAL B 223 87.725 -1.263 2.251 1.00 0.00 H new ATOM 0 HA VAL B 223 90.398 -2.392 1.923 1.00 0.00 H new ATOM 0 HB VAL B 223 88.582 -2.173 4.398 1.00 0.00 H new ATOM 0 HG11 VAL B 223 90.713 -2.277 5.770 1.00 0.00 H new ATOM 0 HG12 VAL B 223 90.470 -3.768 4.828 1.00 0.00 H new ATOM 0 HG13 VAL B 223 91.649 -2.552 4.281 1.00 0.00 H new ATOM 0 HG21 VAL B 223 89.870 -0.006 4.888 1.00 0.00 H new ATOM 0 HG22 VAL B 223 90.743 -0.193 3.349 1.00 0.00 H new ATOM 0 HG23 VAL B 223 88.989 0.107 3.346 1.00 0.00 H new ATOM 830 N VAL B 224 87.945 -4.550 2.750 1.00 0.00 N ATOM 831 CA VAL B 224 87.615 -6.048 2.796 1.00 0.00 C ATOM 832 C VAL B 224 87.737 -6.683 1.384 1.00 0.00 C ATOM 833 O VAL B 224 88.069 -7.850 1.250 1.00 0.00 O ATOM 834 CB VAL B 224 86.175 -6.315 3.478 1.00 0.00 C ATOM 835 CG1 VAL B 224 86.094 -5.557 4.889 1.00 0.00 C ATOM 836 CG2 VAL B 224 84.965 -5.856 2.539 1.00 0.00 C ATOM 0 H VAL B 224 87.168 -3.942 3.009 1.00 0.00 H new ATOM 0 HA VAL B 224 88.350 -6.542 3.432 1.00 0.00 H new ATOM 0 HB VAL B 224 86.077 -7.390 3.629 1.00 0.00 H new ATOM 0 HG11 VAL B 224 85.121 -5.740 5.345 1.00 0.00 H new ATOM 0 HG12 VAL B 224 86.879 -5.929 5.547 1.00 0.00 H new ATOM 0 HG13 VAL B 224 86.227 -4.486 4.735 1.00 0.00 H new ATOM 0 HG21 VAL B 224 84.019 -6.056 3.041 1.00 0.00 H new ATOM 0 HG22 VAL B 224 85.048 -4.789 2.334 1.00 0.00 H new ATOM 0 HG23 VAL B 224 85.002 -6.410 1.601 1.00 0.00 H new ATOM 846 N LEU B 225 87.423 -5.870 0.333 1.00 0.00 N ATOM 847 CA LEU B 225 87.454 -6.330 -1.121 1.00 0.00 C ATOM 848 C LEU B 225 88.868 -6.846 -1.526 1.00 0.00 C ATOM 849 O LEU B 225 88.986 -7.871 -2.190 1.00 0.00 O ATOM 850 CB LEU B 225 86.969 -5.121 -2.024 1.00 0.00 C ATOM 851 CG LEU B 225 86.890 -5.438 -3.611 1.00 0.00 C ATOM 852 CD1 LEU B 225 85.922 -6.654 -3.942 1.00 0.00 C ATOM 853 CD2 LEU B 225 86.439 -4.130 -4.413 1.00 0.00 C ATOM 0 H LEU B 225 87.145 -4.895 0.447 1.00 0.00 H new ATOM 0 HA LEU B 225 86.783 -7.177 -1.264 1.00 0.00 H new ATOM 0 HB2 LEU B 225 85.983 -4.805 -1.683 1.00 0.00 H new ATOM 0 HB3 LEU B 225 87.644 -4.279 -1.870 1.00 0.00 H new ATOM 0 HG LEU B 225 87.889 -5.733 -3.931 1.00 0.00 H new ATOM 0 HD11 LEU B 225 85.906 -6.824 -5.019 1.00 0.00 H new ATOM 0 HD12 LEU B 225 86.280 -7.552 -3.438 1.00 0.00 H new ATOM 0 HD13 LEU B 225 84.915 -6.422 -3.596 1.00 0.00 H new ATOM 0 HD21 LEU B 225 86.390 -4.355 -5.478 1.00 0.00 H new ATOM 0 HD22 LEU B 225 85.457 -3.810 -4.064 1.00 0.00 H new ATOM 0 HD23 LEU B 225 87.162 -3.332 -4.244 1.00 0.00 H new ATOM 865 N ILE B 226 89.938 -6.114 -1.106 1.00 0.00 N ATOM 866 CA ILE B 226 91.382 -6.505 -1.419 1.00 0.00 C ATOM 867 C ILE B 226 91.761 -7.785 -0.605 1.00 0.00 C ATOM 868 O ILE B 226 92.345 -8.707 -1.136 1.00 0.00 O ATOM 869 CB ILE B 226 92.364 -5.271 -1.085 1.00 0.00 C ATOM 870 CG1 ILE B 226 91.902 -3.963 -1.925 1.00 0.00 C ATOM 871 CG2 ILE B 226 93.903 -5.637 -1.406 1.00 0.00 C ATOM 872 CD1 ILE B 226 92.670 -2.668 -1.526 1.00 0.00 C ATOM 0 H ILE B 226 89.852 -5.259 -0.557 1.00 0.00 H new ATOM 0 HA ILE B 226 91.488 -6.735 -2.479 1.00 0.00 H new ATOM 0 HB ILE B 226 92.295 -5.057 -0.018 1.00 0.00 H new ATOM 0 HG12 ILE B 226 92.051 -4.152 -2.988 1.00 0.00 H new ATOM 0 HG13 ILE B 226 90.834 -3.803 -1.776 1.00 0.00 H new ATOM 0 HG21 ILE B 226 94.537 -4.783 -1.169 1.00 0.00 H new ATOM 0 HG22 ILE B 226 94.207 -6.493 -0.803 1.00 0.00 H new ATOM 0 HG23 ILE B 226 94.006 -5.883 -2.463 1.00 0.00 H new ATOM 0 HD11 ILE B 226 92.311 -1.832 -2.127 1.00 0.00 H new ATOM 0 HD12 ILE B 226 92.501 -2.455 -0.470 1.00 0.00 H new ATOM 0 HD13 ILE B 226 93.737 -2.809 -1.701 1.00 0.00 H new ATOM 884 N VAL B 227 91.448 -7.766 0.711 1.00 0.00 N ATOM 885 CA VAL B 227 91.779 -8.894 1.687 1.00 0.00 C ATOM 886 C VAL B 227 90.996 -10.211 1.371 1.00 0.00 C ATOM 887 O VAL B 227 91.527 -11.291 1.576 1.00 0.00 O ATOM 888 CB VAL B 227 91.509 -8.371 3.181 1.00 0.00 C ATOM 889 CG1 VAL B 227 91.805 -9.495 4.294 1.00 0.00 C ATOM 890 CG2 VAL B 227 92.401 -7.065 3.481 1.00 0.00 C ATOM 0 H VAL B 227 90.961 -6.984 1.150 1.00 0.00 H new ATOM 0 HA VAL B 227 92.831 -9.158 1.580 1.00 0.00 H new ATOM 0 HB VAL B 227 90.450 -8.122 3.242 1.00 0.00 H new ATOM 0 HG11 VAL B 227 91.606 -9.087 5.285 1.00 0.00 H new ATOM 0 HG12 VAL B 227 91.161 -10.357 4.120 1.00 0.00 H new ATOM 0 HG13 VAL B 227 92.849 -9.803 4.231 1.00 0.00 H new ATOM 0 HG21 VAL B 227 92.210 -6.719 4.497 1.00 0.00 H new ATOM 0 HG22 VAL B 227 93.457 -7.313 3.375 1.00 0.00 H new ATOM 0 HG23 VAL B 227 92.141 -6.277 2.774 1.00 0.00 H new ATOM 900 N ALA B 228 89.710 -10.102 0.945 1.00 0.00 N ATOM 901 CA ALA B 228 88.812 -11.325 0.688 1.00 0.00 C ATOM 902 C ALA B 228 89.405 -12.286 -0.388 1.00 0.00 C ATOM 903 O ALA B 228 89.429 -13.498 -0.206 1.00 0.00 O ATOM 904 CB ALA B 228 87.376 -10.827 0.273 1.00 0.00 C ATOM 0 H ALA B 228 89.252 -9.208 0.767 1.00 0.00 H new ATOM 0 HA ALA B 228 88.751 -11.905 1.609 1.00 0.00 H new ATOM 0 HB1 ALA B 228 86.732 -11.687 0.089 1.00 0.00 H new ATOM 0 HB2 ALA B 228 86.954 -10.223 1.076 1.00 0.00 H new ATOM 0 HB3 ALA B 228 87.447 -10.226 -0.634 1.00 0.00 H new ATOM 910 N VAL B 229 89.891 -11.715 -1.504 1.00 0.00 N ATOM 911 CA VAL B 229 90.537 -12.510 -2.629 1.00 0.00 C ATOM 912 C VAL B 229 91.943 -13.001 -2.164 1.00 0.00 C ATOM 913 O VAL B 229 92.408 -14.051 -2.584 1.00 0.00 O ATOM 914 CB VAL B 229 90.580 -11.626 -3.967 1.00 0.00 C ATOM 915 CG1 VAL B 229 91.323 -10.237 -3.721 1.00 0.00 C ATOM 916 CG2 VAL B 229 91.249 -12.432 -5.186 1.00 0.00 C ATOM 0 H VAL B 229 89.861 -10.710 -1.676 1.00 0.00 H new ATOM 0 HA VAL B 229 89.949 -13.396 -2.867 1.00 0.00 H new ATOM 0 HB VAL B 229 89.549 -11.407 -4.244 1.00 0.00 H new ATOM 0 HG11 VAL B 229 91.335 -9.662 -4.647 1.00 0.00 H new ATOM 0 HG12 VAL B 229 90.796 -9.674 -2.951 1.00 0.00 H new ATOM 0 HG13 VAL B 229 92.347 -10.424 -3.397 1.00 0.00 H new ATOM 0 HG21 VAL B 229 91.261 -11.802 -6.076 1.00 0.00 H new ATOM 0 HG22 VAL B 229 92.270 -12.708 -4.923 1.00 0.00 H new ATOM 0 HG23 VAL B 229 90.670 -13.333 -5.387 1.00 0.00 H new ATOM 926 N PHE B 230 92.630 -12.174 -1.333 1.00 0.00 N ATOM 927 CA PHE B 230 94.048 -12.477 -0.830 1.00 0.00 C ATOM 928 C PHE B 230 94.101 -13.739 0.082 1.00 0.00 C ATOM 929 O PHE B 230 95.001 -14.561 -0.053 1.00 0.00 O ATOM 930 CB PHE B 230 94.598 -11.204 -0.042 1.00 0.00 C ATOM 931 CG PHE B 230 96.186 -11.124 -0.012 1.00 0.00 C ATOM 932 CD1 PHE B 230 96.940 -11.968 0.861 1.00 0.00 C ATOM 933 CD2 PHE B 230 96.901 -10.195 -0.849 1.00 0.00 C ATOM 934 CE1 PHE B 230 98.354 -11.882 0.895 1.00 0.00 C ATOM 935 CE2 PHE B 230 98.307 -10.121 -0.804 1.00 0.00 C ATOM 936 CZ PHE B 230 99.034 -10.960 0.067 1.00 0.00 C ATOM 0 H PHE B 230 92.252 -11.293 -0.985 1.00 0.00 H new ATOM 0 HA PHE B 230 94.675 -12.691 -1.695 1.00 0.00 H new ATOM 0 HB2 PHE B 230 94.204 -10.300 -0.505 1.00 0.00 H new ATOM 0 HB3 PHE B 230 94.222 -11.228 0.981 1.00 0.00 H new ATOM 0 HD1 PHE B 230 96.429 -12.675 1.498 1.00 0.00 H new ATOM 0 HD2 PHE B 230 96.353 -9.548 -1.518 1.00 0.00 H new ATOM 0 HE1 PHE B 230 98.915 -12.524 1.557 1.00 0.00 H new ATOM 0 HE2 PHE B 230 98.830 -9.420 -1.438 1.00 0.00 H new ATOM 0 HZ PHE B 230 100.112 -10.898 0.101 1.00 0.00 H new ATOM 946 N VAL B 231 93.118 -13.881 1.021 1.00 0.00 N ATOM 947 CA VAL B 231 93.063 -15.084 1.971 1.00 0.00 C ATOM 948 C VAL B 231 92.715 -16.379 1.182 1.00 0.00 C ATOM 949 O VAL B 231 93.108 -17.464 1.568 1.00 0.00 O ATOM 950 CB VAL B 231 92.062 -14.823 3.204 1.00 0.00 C ATOM 951 CG1 VAL B 231 92.580 -13.591 4.098 1.00 0.00 C ATOM 952 CG2 VAL B 231 90.577 -14.545 2.690 1.00 0.00 C ATOM 0 H VAL B 231 92.363 -13.208 1.155 1.00 0.00 H new ATOM 0 HA VAL B 231 94.051 -15.223 2.411 1.00 0.00 H new ATOM 0 HB VAL B 231 92.046 -15.723 3.819 1.00 0.00 H new ATOM 0 HG11 VAL B 231 91.891 -13.428 4.927 1.00 0.00 H new ATOM 0 HG12 VAL B 231 93.572 -13.817 4.489 1.00 0.00 H new ATOM 0 HG13 VAL B 231 92.628 -12.691 3.485 1.00 0.00 H new ATOM 0 HG21 VAL B 231 89.923 -14.372 3.544 1.00 0.00 H new ATOM 0 HG22 VAL B 231 90.573 -13.665 2.046 1.00 0.00 H new ATOM 0 HG23 VAL B 231 90.219 -15.407 2.128 1.00 0.00 H new ATOM 962 N CYS B 232 91.923 -16.233 0.085 1.00 0.00 N ATOM 963 CA CYS B 232 91.456 -17.413 -0.762 1.00 0.00 C ATOM 964 C CYS B 232 92.650 -18.239 -1.354 1.00 0.00 C ATOM 965 O CYS B 232 92.627 -19.466 -1.296 1.00 0.00 O ATOM 966 CB CYS B 232 90.512 -16.886 -1.909 1.00 0.00 C ATOM 967 SG CYS B 232 89.725 -18.262 -2.813 1.00 0.00 S ATOM 0 H CYS B 232 91.587 -15.329 -0.247 1.00 0.00 H new ATOM 0 HA CYS B 232 90.905 -18.096 -0.115 1.00 0.00 H new ATOM 0 HB2 CYS B 232 89.743 -16.243 -1.482 1.00 0.00 H new ATOM 0 HB3 CYS B 232 91.088 -16.275 -2.604 1.00 0.00 H new ATOM 0 HG CYS B 232 88.956 -17.785 -3.746 1.00 0.00 H new ATOM 973 N LYS B 233 93.688 -17.555 -1.932 1.00 0.00 N ATOM 974 CA LYS B 233 94.891 -18.281 -2.547 1.00 0.00 C ATOM 975 C LYS B 233 95.824 -18.851 -1.447 1.00 0.00 C ATOM 976 O LYS B 233 96.449 -19.884 -1.644 1.00 0.00 O ATOM 977 CB LYS B 233 95.684 -17.329 -3.556 1.00 0.00 C ATOM 978 CG LYS B 233 96.250 -16.001 -2.864 1.00 0.00 C ATOM 979 CD LYS B 233 97.128 -15.129 -3.888 1.00 0.00 C ATOM 980 CE LYS B 233 97.700 -13.817 -3.223 1.00 0.00 C ATOM 981 NZ LYS B 233 98.575 -13.106 -4.203 1.00 0.00 N ATOM 0 H LYS B 233 93.734 -16.538 -1.993 1.00 0.00 H new ATOM 0 HA LYS B 233 94.514 -19.126 -3.123 1.00 0.00 H new ATOM 0 HB2 LYS B 233 96.514 -17.885 -3.992 1.00 0.00 H new ATOM 0 HB3 LYS B 233 95.022 -17.049 -4.376 1.00 0.00 H new ATOM 0 HG2 LYS B 233 95.419 -15.401 -2.494 1.00 0.00 H new ATOM 0 HG3 LYS B 233 96.858 -16.271 -2.001 1.00 0.00 H new ATOM 0 HD2 LYS B 233 97.954 -15.734 -4.261 1.00 0.00 H new ATOM 0 HD3 LYS B 233 96.516 -14.860 -4.749 1.00 0.00 H new ATOM 0 HE2 LYS B 233 96.882 -13.168 -2.911 1.00 0.00 H new ATOM 0 HE3 LYS B 233 98.268 -14.068 -2.327 1.00 0.00 H new ATOM 0 HZ1 LYS B 233 98.953 -12.241 -3.767 1.00 0.00 H new ATOM 0 HZ2 LYS B 233 99.362 -13.727 -4.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 233 98.020 -12.855 -5.046 1.00 0.00 H new ATOM 995 N SER B 234 95.914 -18.153 -0.288 1.00 0.00 N ATOM 996 CA SER B 234 96.818 -18.584 0.869 1.00 0.00 C ATOM 997 C SER B 234 96.377 -19.957 1.442 1.00 0.00 C ATOM 998 O SER B 234 97.182 -20.668 2.026 1.00 0.00 O ATOM 999 CB SER B 234 96.792 -17.484 1.989 1.00 0.00 C ATOM 1000 OG SER B 234 95.513 -17.458 2.611 1.00 0.00 O ATOM 0 H SER B 234 95.390 -17.297 -0.106 1.00 0.00 H new ATOM 0 HA SER B 234 97.836 -18.695 0.496 1.00 0.00 H new ATOM 0 HB2 SER B 234 97.563 -17.690 2.731 1.00 0.00 H new ATOM 0 HB3 SER B 234 97.017 -16.508 1.558 1.00 0.00 H new ATOM 0 HG SER B 234 94.815 -17.468 1.924 1.00 0.00 H new ATOM 1006 N LEU B 235 95.081 -20.309 1.239 1.00 0.00 N ATOM 1007 CA LEU B 235 94.473 -21.628 1.711 1.00 0.00 C ATOM 1008 C LEU B 235 94.657 -22.722 0.612 1.00 0.00 C ATOM 1009 O LEU B 235 94.616 -23.904 0.922 1.00 0.00 O ATOM 1010 CB LEU B 235 92.929 -21.397 2.034 1.00 0.00 C ATOM 1011 CG LEU B 235 92.667 -20.379 3.273 1.00 0.00 C ATOM 1012 CD1 LEU B 235 91.159 -19.858 3.281 1.00 0.00 C ATOM 1013 CD2 LEU B 235 93.022 -21.044 4.682 1.00 0.00 C ATOM 0 H LEU B 235 94.416 -19.709 0.751 1.00 0.00 H new ATOM 0 HA LEU B 235 94.977 -21.971 2.614 1.00 0.00 H new ATOM 0 HB2 LEU B 235 92.435 -21.007 1.144 1.00 0.00 H new ATOM 0 HB3 LEU B 235 92.466 -22.358 2.260 1.00 0.00 H new ATOM 0 HG LEU B 235 93.334 -19.529 3.126 1.00 0.00 H new ATOM 0 HD11 LEU B 235 91.013 -19.179 4.121 1.00 0.00 H new ATOM 0 HD12 LEU B 235 90.951 -19.333 2.349 1.00 0.00 H new ATOM 0 HD13 LEU B 235 90.481 -20.706 3.379 1.00 0.00 H new ATOM 0 HD21 LEU B 235 92.832 -20.327 5.481 1.00 0.00 H new ATOM 0 HD22 LEU B 235 92.403 -21.929 4.833 1.00 0.00 H new ATOM 0 HD23 LEU B 235 94.074 -21.330 4.695 1.00 0.00 H new ATOM 1025 N LEU B 236 94.834 -22.305 -0.679 1.00 0.00 N ATOM 1026 CA LEU B 236 95.000 -23.286 -1.847 1.00 0.00 C ATOM 1027 C LEU B 236 96.462 -23.798 -1.898 1.00 0.00 C ATOM 1028 O LEU B 236 96.707 -24.911 -2.346 1.00 0.00 O ATOM 1029 CB LEU B 236 94.596 -22.537 -3.187 1.00 0.00 C ATOM 1030 CG LEU B 236 94.764 -23.405 -4.547 1.00 0.00 C ATOM 1031 CD1 LEU B 236 93.948 -24.761 -4.509 1.00 0.00 C ATOM 1032 CD2 LEU B 236 94.345 -22.530 -5.818 1.00 0.00 C ATOM 0 H LEU B 236 94.868 -21.323 -0.954 1.00 0.00 H new ATOM 0 HA LEU B 236 94.354 -24.155 -1.718 1.00 0.00 H new ATOM 0 HB2 LEU B 236 93.557 -22.218 -3.106 1.00 0.00 H new ATOM 0 HB3 LEU B 236 95.201 -21.634 -3.275 1.00 0.00 H new ATOM 0 HG LEU B 236 95.817 -23.675 -4.628 1.00 0.00 H new ATOM 0 HD11 LEU B 236 94.097 -25.301 -5.444 1.00 0.00 H new ATOM 0 HD12 LEU B 236 94.297 -25.373 -3.677 1.00 0.00 H new ATOM 0 HD13 LEU B 236 92.888 -24.544 -4.380 1.00 0.00 H new ATOM 0 HD21 LEU B 236 94.463 -23.125 -6.724 1.00 0.00 H new ATOM 0 HD22 LEU B 236 93.305 -22.220 -5.720 1.00 0.00 H new ATOM 0 HD23 LEU B 236 94.982 -21.647 -5.878 1.00 0.00 H new ATOM 1214 N LEU C 211 87.512 10.508 17.072 1.00 0.00 N ATOM 1215 CA LEU C 211 87.218 9.695 15.817 1.00 0.00 C ATOM 1216 C LEU C 211 87.495 10.533 14.542 1.00 0.00 C ATOM 1217 O LEU C 211 87.279 10.052 13.445 1.00 0.00 O ATOM 1218 CB LEU C 211 85.705 9.208 15.870 1.00 0.00 C ATOM 1219 CG LEU C 211 85.385 8.239 17.131 1.00 0.00 C ATOM 1220 CD1 LEU C 211 83.818 7.985 17.266 1.00 0.00 C ATOM 1221 CD2 LEU C 211 86.163 6.844 17.025 1.00 0.00 C ATOM 0 HA LEU C 211 87.875 8.826 15.778 1.00 0.00 H new ATOM 0 HB2 LEU C 211 85.052 10.079 15.916 1.00 0.00 H new ATOM 0 HB3 LEU C 211 85.468 8.680 14.946 1.00 0.00 H new ATOM 0 HG LEU C 211 85.739 8.750 18.026 1.00 0.00 H new ATOM 0 HD11 LEU C 211 83.627 7.333 18.118 1.00 0.00 H new ATOM 0 HD12 LEU C 211 83.307 8.936 17.415 1.00 0.00 H new ATOM 0 HD13 LEU C 211 83.446 7.512 16.357 1.00 0.00 H new ATOM 0 HD21 LEU C 211 85.921 6.226 17.889 1.00 0.00 H new ATOM 0 HD22 LEU C 211 85.862 6.328 16.113 1.00 0.00 H new ATOM 0 HD23 LEU C 211 87.237 7.027 17.000 1.00 0.00 H new ATOM 1233 N SER C 212 87.966 11.788 14.712 1.00 0.00 N ATOM 1234 CA SER C 212 88.291 12.720 13.554 1.00 0.00 C ATOM 1235 C SER C 212 89.555 12.237 12.803 1.00 0.00 C ATOM 1236 O SER C 212 89.702 12.463 11.617 1.00 0.00 O ATOM 1237 CB SER C 212 88.498 14.169 14.110 1.00 0.00 C ATOM 1238 OG SER C 212 89.651 14.191 14.948 1.00 0.00 O ATOM 0 H SER C 212 88.137 12.200 15.629 1.00 0.00 H new ATOM 0 HA SER C 212 87.464 12.719 12.844 1.00 0.00 H new ATOM 0 HB2 SER C 212 88.619 14.873 13.287 1.00 0.00 H new ATOM 0 HB3 SER C 212 87.619 14.484 14.673 1.00 0.00 H new ATOM 0 HG SER C 212 89.785 15.097 15.297 1.00 0.00 H new ATOM 1244 N GLY C 213 90.467 11.598 13.552 1.00 0.00 N ATOM 1245 CA GLY C 213 91.777 11.065 13.005 1.00 0.00 C ATOM 1246 C GLY C 213 91.607 9.787 12.165 1.00 0.00 C ATOM 1247 O GLY C 213 92.162 9.670 11.078 1.00 0.00 O ATOM 0 H GLY C 213 90.342 11.424 14.549 1.00 0.00 H new ATOM 0 HA2 GLY C 213 92.248 11.834 12.393 1.00 0.00 H new ATOM 0 HA3 GLY C 213 92.453 10.860 13.835 1.00 0.00 H new ATOM 1251 N ILE C 214 90.876 8.787 12.729 1.00 0.00 N ATOM 1252 CA ILE C 214 90.669 7.417 12.068 1.00 0.00 C ATOM 1253 C ILE C 214 89.886 7.536 10.722 1.00 0.00 C ATOM 1254 O ILE C 214 90.221 6.866 9.752 1.00 0.00 O ATOM 1255 CB ILE C 214 89.980 6.403 13.129 1.00 0.00 C ATOM 1256 CG1 ILE C 214 90.296 4.840 12.806 1.00 0.00 C ATOM 1257 CG2 ILE C 214 88.404 6.632 13.283 1.00 0.00 C ATOM 1258 CD1 ILE C 214 89.795 4.341 11.417 1.00 0.00 C ATOM 0 H ILE C 214 90.413 8.878 13.633 1.00 0.00 H new ATOM 0 HA ILE C 214 91.637 6.997 11.795 1.00 0.00 H new ATOM 0 HB ILE C 214 90.443 6.646 14.086 1.00 0.00 H new ATOM 0 HG12 ILE C 214 91.373 4.683 12.865 1.00 0.00 H new ATOM 0 HG13 ILE C 214 89.841 4.225 13.582 1.00 0.00 H new ATOM 0 HG21 ILE C 214 88.002 5.923 14.007 1.00 0.00 H new ATOM 0 HG22 ILE C 214 88.216 7.649 13.628 1.00 0.00 H new ATOM 0 HG23 ILE C 214 87.918 6.481 12.319 1.00 0.00 H new ATOM 0 HD11 ILE C 214 90.052 3.289 11.294 1.00 0.00 H new ATOM 0 HD12 ILE C 214 88.713 4.460 11.356 1.00 0.00 H new ATOM 0 HD13 ILE C 214 90.269 4.925 10.628 1.00 0.00 H new ATOM 1270 N ILE C 215 88.813 8.390 10.677 1.00 0.00 N ATOM 1271 CA ILE C 215 87.958 8.547 9.409 1.00 0.00 C ATOM 1272 C ILE C 215 88.793 9.119 8.213 1.00 0.00 C ATOM 1273 O ILE C 215 88.576 8.731 7.073 1.00 0.00 O ATOM 1274 CB ILE C 215 86.639 9.406 9.732 1.00 0.00 C ATOM 1275 CG1 ILE C 215 85.616 9.413 8.474 1.00 0.00 C ATOM 1276 CG2 ILE C 215 87.022 10.887 10.175 1.00 0.00 C ATOM 1277 CD1 ILE C 215 84.245 10.081 8.794 1.00 0.00 C ATOM 0 H ILE C 215 88.512 8.968 11.462 1.00 0.00 H new ATOM 0 HA ILE C 215 87.626 7.561 9.084 1.00 0.00 H new ATOM 0 HB ILE C 215 86.125 8.929 10.566 1.00 0.00 H new ATOM 0 HG12 ILE C 215 86.081 9.938 7.640 1.00 0.00 H new ATOM 0 HG13 ILE C 215 85.445 8.387 8.149 1.00 0.00 H new ATOM 0 HG21 ILE C 215 86.113 11.449 10.388 1.00 0.00 H new ATOM 0 HG22 ILE C 215 87.644 10.850 11.069 1.00 0.00 H new ATOM 0 HG23 ILE C 215 87.571 11.377 9.371 1.00 0.00 H new ATOM 0 HD11 ILE C 215 83.610 10.051 7.908 1.00 0.00 H new ATOM 0 HD12 ILE C 215 83.759 9.542 9.607 1.00 0.00 H new ATOM 0 HD13 ILE C 215 84.406 11.118 9.090 1.00 0.00 H new ATOM 1289 N ILE C 216 89.773 10.031 8.491 1.00 0.00 N ATOM 1290 CA ILE C 216 90.689 10.611 7.400 1.00 0.00 C ATOM 1291 C ILE C 216 91.663 9.491 6.906 1.00 0.00 C ATOM 1292 O ILE C 216 91.963 9.382 5.728 1.00 0.00 O ATOM 1293 CB ILE C 216 91.485 11.893 7.974 1.00 0.00 C ATOM 1294 CG1 ILE C 216 90.433 13.045 8.413 1.00 0.00 C ATOM 1295 CG2 ILE C 216 92.534 12.478 6.899 1.00 0.00 C ATOM 1296 CD1 ILE C 216 91.091 14.239 9.168 1.00 0.00 C ATOM 0 H ILE C 216 89.964 10.387 9.428 1.00 0.00 H new ATOM 0 HA ILE C 216 90.098 10.951 6.549 1.00 0.00 H new ATOM 0 HB ILE C 216 92.054 11.569 8.845 1.00 0.00 H new ATOM 0 HG12 ILE C 216 89.929 13.423 7.523 1.00 0.00 H new ATOM 0 HG13 ILE C 216 89.667 12.602 9.049 1.00 0.00 H new ATOM 0 HG21 ILE C 216 93.049 13.340 7.324 1.00 0.00 H new ATOM 0 HG22 ILE C 216 93.263 11.708 6.646 1.00 0.00 H new ATOM 0 HG23 ILE C 216 92.001 12.782 5.998 1.00 0.00 H new ATOM 0 HD11 ILE C 216 90.326 14.970 9.430 1.00 0.00 H new ATOM 0 HD12 ILE C 216 91.571 13.875 10.076 1.00 0.00 H new ATOM 0 HD13 ILE C 216 91.837 14.708 8.527 1.00 0.00 H new ATOM 1308 N TYR C 217 92.216 8.741 7.885 1.00 0.00 N ATOM 1309 CA TYR C 217 93.275 7.667 7.651 1.00 0.00 C ATOM 1310 C TYR C 217 92.790 6.416 6.848 1.00 0.00 C ATOM 1311 O TYR C 217 93.535 5.912 6.015 1.00 0.00 O ATOM 1312 CB TYR C 217 93.848 7.233 9.065 1.00 0.00 C ATOM 1313 CG TYR C 217 95.101 6.254 8.936 1.00 0.00 C ATOM 1314 CD1 TYR C 217 94.929 4.829 8.930 1.00 0.00 C ATOM 1315 CD2 TYR C 217 96.430 6.776 8.807 1.00 0.00 C ATOM 1316 CE1 TYR C 217 96.049 3.976 8.804 1.00 0.00 C ATOM 1317 CE2 TYR C 217 97.531 5.898 8.683 1.00 0.00 C ATOM 1318 CZ TYR C 217 97.336 4.512 8.683 1.00 0.00 C ATOM 1319 OH TYR C 217 98.422 3.665 8.561 1.00 0.00 O ATOM 0 H TYR C 217 91.959 8.843 8.867 1.00 0.00 H new ATOM 0 HA TYR C 217 94.043 8.109 7.016 1.00 0.00 H new ATOM 0 HB2 TYR C 217 94.140 8.122 9.624 1.00 0.00 H new ATOM 0 HB3 TYR C 217 93.062 6.740 9.637 1.00 0.00 H new ATOM 0 HD1 TYR C 217 93.939 4.407 9.022 1.00 0.00 H new ATOM 0 HD2 TYR C 217 96.591 7.844 8.805 1.00 0.00 H new ATOM 0 HE1 TYR C 217 95.911 2.905 8.801 1.00 0.00 H new ATOM 0 HE2 TYR C 217 98.529 6.299 8.588 1.00 0.00 H new ATOM 0 HH TYR C 217 99.243 4.195 8.485 1.00 0.00 H new ATOM 1329 N VAL C 218 91.575 5.867 7.151 1.00 0.00 N ATOM 1330 CA VAL C 218 91.075 4.578 6.469 1.00 0.00 C ATOM 1331 C VAL C 218 91.021 4.722 4.914 1.00 0.00 C ATOM 1332 O VAL C 218 91.338 3.785 4.190 1.00 0.00 O ATOM 1333 CB VAL C 218 89.667 4.142 7.101 1.00 0.00 C ATOM 1334 CG1 VAL C 218 88.558 5.261 6.868 1.00 0.00 C ATOM 1335 CG2 VAL C 218 89.173 2.721 6.535 1.00 0.00 C ATOM 0 H VAL C 218 90.927 6.261 7.833 1.00 0.00 H new ATOM 0 HA VAL C 218 91.791 3.779 6.662 1.00 0.00 H new ATOM 0 HB VAL C 218 89.818 4.033 8.175 1.00 0.00 H new ATOM 0 HG11 VAL C 218 87.615 4.936 7.308 1.00 0.00 H new ATOM 0 HG12 VAL C 218 88.876 6.192 7.338 1.00 0.00 H new ATOM 0 HG13 VAL C 218 88.423 5.422 5.798 1.00 0.00 H new ATOM 0 HG21 VAL C 218 88.216 2.462 6.988 1.00 0.00 H new ATOM 0 HG22 VAL C 218 89.058 2.780 5.453 1.00 0.00 H new ATOM 0 HG23 VAL C 218 89.909 1.956 6.780 1.00 0.00 H new ATOM 1345 N THR C 219 90.609 5.918 4.429 1.00 0.00 N ATOM 1346 CA THR C 219 90.500 6.228 2.938 1.00 0.00 C ATOM 1347 C THR C 219 91.899 6.229 2.266 1.00 0.00 C ATOM 1348 O THR C 219 92.094 5.631 1.220 1.00 0.00 O ATOM 1349 CB THR C 219 89.805 7.644 2.732 1.00 0.00 C ATOM 1350 OG1 THR C 219 90.695 8.668 3.175 1.00 0.00 O ATOM 1351 CG2 THR C 219 88.477 7.782 3.561 1.00 0.00 C ATOM 0 H THR C 219 90.342 6.699 5.028 1.00 0.00 H new ATOM 0 HA THR C 219 89.895 5.451 2.470 1.00 0.00 H new ATOM 0 HB THR C 219 89.569 7.737 1.672 1.00 0.00 H new ATOM 0 HG1 THR C 219 90.893 8.540 4.126 1.00 0.00 H new ATOM 0 HG21 THR C 219 88.040 8.765 3.387 1.00 0.00 H new ATOM 0 HG22 THR C 219 87.772 7.011 3.249 1.00 0.00 H new ATOM 0 HG23 THR C 219 88.697 7.665 4.622 1.00 0.00 H new ATOM 1359 N VAL C 220 92.861 6.938 2.906 1.00 0.00 N ATOM 1360 CA VAL C 220 94.291 7.071 2.397 1.00 0.00 C ATOM 1361 C VAL C 220 95.026 5.708 2.538 1.00 0.00 C ATOM 1362 O VAL C 220 95.886 5.383 1.730 1.00 0.00 O ATOM 1363 CB VAL C 220 95.025 8.248 3.206 1.00 0.00 C ATOM 1364 CG1 VAL C 220 96.543 8.460 2.722 1.00 0.00 C ATOM 1365 CG2 VAL C 220 94.204 9.622 3.044 1.00 0.00 C ATOM 0 H VAL C 220 92.693 7.436 3.780 1.00 0.00 H new ATOM 0 HA VAL C 220 94.301 7.334 1.339 1.00 0.00 H new ATOM 0 HB VAL C 220 95.052 7.955 4.255 1.00 0.00 H new ATOM 0 HG11 VAL C 220 96.999 9.266 3.297 1.00 0.00 H new ATOM 0 HG12 VAL C 220 97.106 7.540 2.877 1.00 0.00 H new ATOM 0 HG13 VAL C 220 96.555 8.718 1.663 1.00 0.00 H new ATOM 0 HG21 VAL C 220 94.709 10.415 3.596 1.00 0.00 H new ATOM 0 HG22 VAL C 220 94.150 9.892 1.989 1.00 0.00 H new ATOM 0 HG23 VAL C 220 93.196 9.492 3.437 1.00 0.00 H new ATOM 1375 N ALA C 221 94.678 4.933 3.598 1.00 0.00 N ATOM 1376 CA ALA C 221 95.323 3.581 3.887 1.00 0.00 C ATOM 1377 C ALA C 221 95.075 2.569 2.727 1.00 0.00 C ATOM 1378 O ALA C 221 95.913 1.721 2.449 1.00 0.00 O ATOM 1379 CB ALA C 221 94.775 3.018 5.252 1.00 0.00 C ATOM 0 H ALA C 221 93.962 5.200 4.274 1.00 0.00 H new ATOM 0 HA ALA C 221 96.401 3.721 3.964 1.00 0.00 H new ATOM 0 HB1 ALA C 221 95.236 2.052 5.458 1.00 0.00 H new ATOM 0 HB2 ALA C 221 95.016 3.714 6.056 1.00 0.00 H new ATOM 0 HB3 ALA C 221 93.694 2.898 5.188 1.00 0.00 H new ATOM 1385 N ALA C 222 93.883 2.657 2.084 1.00 0.00 N ATOM 1386 CA ALA C 222 93.496 1.727 0.944 1.00 0.00 C ATOM 1387 C ALA C 222 94.328 2.020 -0.341 1.00 0.00 C ATOM 1388 O ALA C 222 94.714 1.108 -1.054 1.00 0.00 O ATOM 1389 CB ALA C 222 91.954 1.888 0.676 1.00 0.00 C ATOM 0 H ALA C 222 93.168 3.346 2.317 1.00 0.00 H new ATOM 0 HA ALA C 222 93.715 0.697 1.224 1.00 0.00 H new ATOM 0 HB1 ALA C 222 91.656 1.229 -0.139 1.00 0.00 H new ATOM 0 HB2 ALA C 222 91.399 1.626 1.577 1.00 0.00 H new ATOM 0 HB3 ALA C 222 91.738 2.921 0.405 1.00 0.00 H new ATOM 1395 N VAL C 223 94.547 3.324 -0.635 1.00 0.00 N ATOM 1396 CA VAL C 223 95.296 3.789 -1.883 1.00 0.00 C ATOM 1397 C VAL C 223 96.808 3.397 -1.837 1.00 0.00 C ATOM 1398 O VAL C 223 97.345 2.947 -2.843 1.00 0.00 O ATOM 1399 CB VAL C 223 95.082 5.371 -2.063 1.00 0.00 C ATOM 1400 CG1 VAL C 223 95.818 5.940 -3.374 1.00 0.00 C ATOM 1401 CG2 VAL C 223 93.512 5.712 -2.132 1.00 0.00 C ATOM 0 H VAL C 223 94.226 4.090 -0.042 1.00 0.00 H new ATOM 0 HA VAL C 223 94.887 3.279 -2.755 1.00 0.00 H new ATOM 0 HB VAL C 223 95.529 5.857 -1.196 1.00 0.00 H new ATOM 0 HG11 VAL C 223 95.644 7.013 -3.452 1.00 0.00 H new ATOM 0 HG12 VAL C 223 96.889 5.750 -3.301 1.00 0.00 H new ATOM 0 HG13 VAL C 223 95.421 5.443 -4.259 1.00 0.00 H new ATOM 0 HG21 VAL C 223 93.378 6.787 -2.254 1.00 0.00 H new ATOM 0 HG22 VAL C 223 93.064 5.192 -2.979 1.00 0.00 H new ATOM 0 HG23 VAL C 223 93.029 5.389 -1.210 1.00 0.00 H new ATOM 1411 N VAL C 224 97.503 3.604 -0.678 1.00 0.00 N ATOM 1412 CA VAL C 224 98.998 3.282 -0.568 1.00 0.00 C ATOM 1413 C VAL C 224 99.248 1.752 -0.716 1.00 0.00 C ATOM 1414 O VAL C 224 100.277 1.340 -1.225 1.00 0.00 O ATOM 1415 CB VAL C 224 99.595 3.864 0.810 1.00 0.00 C ATOM 1416 CG1 VAL C 224 99.392 5.455 0.875 1.00 0.00 C ATOM 1417 CG2 VAL C 224 98.894 3.174 2.068 1.00 0.00 C ATOM 0 H VAL C 224 97.088 3.978 0.176 1.00 0.00 H new ATOM 0 HA VAL C 224 99.526 3.771 -1.387 1.00 0.00 H new ATOM 0 HB VAL C 224 100.661 3.639 0.841 1.00 0.00 H new ATOM 0 HG11 VAL C 224 99.800 5.836 1.811 1.00 0.00 H new ATOM 0 HG12 VAL C 224 99.909 5.922 0.037 1.00 0.00 H new ATOM 0 HG13 VAL C 224 98.329 5.689 0.821 1.00 0.00 H new ATOM 0 HG21 VAL C 224 99.313 3.583 2.988 1.00 0.00 H new ATOM 0 HG22 VAL C 224 97.822 3.369 2.040 1.00 0.00 H new ATOM 0 HG23 VAL C 224 99.068 2.098 2.037 1.00 0.00 H new ATOM 1427 N LEU C 225 98.276 0.924 -0.235 1.00 0.00 N ATOM 1428 CA LEU C 225 98.379 -0.601 -0.276 1.00 0.00 C ATOM 1429 C LEU C 225 98.518 -1.126 -1.739 1.00 0.00 C ATOM 1430 O LEU C 225 99.300 -2.033 -2.002 1.00 0.00 O ATOM 1431 CB LEU C 225 97.104 -1.198 0.451 1.00 0.00 C ATOM 1432 CG LEU C 225 97.063 -2.816 0.550 1.00 0.00 C ATOM 1433 CD1 LEU C 225 98.313 -3.408 1.331 1.00 0.00 C ATOM 1434 CD2 LEU C 225 95.697 -3.298 1.228 1.00 0.00 C ATOM 0 H LEU C 225 97.412 1.265 0.186 1.00 0.00 H new ATOM 0 HA LEU C 225 99.280 -0.928 0.244 1.00 0.00 H new ATOM 0 HB2 LEU C 225 97.054 -0.786 1.459 1.00 0.00 H new ATOM 0 HB3 LEU C 225 96.212 -0.859 -0.076 1.00 0.00 H new ATOM 0 HG LEU C 225 97.113 -3.202 -0.468 1.00 0.00 H new ATOM 0 HD11 LEU C 225 98.237 -4.495 1.369 1.00 0.00 H new ATOM 0 HD12 LEU C 225 99.231 -3.126 0.815 1.00 0.00 H new ATOM 0 HD13 LEU C 225 98.330 -3.010 2.346 1.00 0.00 H new ATOM 0 HD21 LEU C 225 95.684 -4.386 1.287 1.00 0.00 H new ATOM 0 HD22 LEU C 225 95.621 -2.879 2.231 1.00 0.00 H new ATOM 0 HD23 LEU C 225 94.853 -2.958 0.628 1.00 0.00 H new ATOM 1446 N ILE C 226 97.728 -0.538 -2.675 1.00 0.00 N ATOM 1447 CA ILE C 226 97.740 -0.949 -4.148 1.00 0.00 C ATOM 1448 C ILE C 226 99.086 -0.502 -4.806 1.00 0.00 C ATOM 1449 O ILE C 226 99.719 -1.254 -5.507 1.00 0.00 O ATOM 1450 CB ILE C 226 96.468 -0.307 -4.901 1.00 0.00 C ATOM 1451 CG1 ILE C 226 95.101 -0.713 -4.125 1.00 0.00 C ATOM 1452 CG2 ILE C 226 96.401 -0.779 -6.440 1.00 0.00 C ATOM 1453 CD1 ILE C 226 93.838 0.016 -4.675 1.00 0.00 C ATOM 0 H ILE C 226 97.074 0.216 -2.463 1.00 0.00 H new ATOM 0 HA ILE C 226 97.667 -2.033 -4.233 1.00 0.00 H new ATOM 0 HB ILE C 226 96.577 0.778 -4.889 1.00 0.00 H new ATOM 0 HG12 ILE C 226 94.953 -1.790 -4.204 1.00 0.00 H new ATOM 0 HG13 ILE C 226 95.211 -0.483 -3.065 1.00 0.00 H new ATOM 0 HG21 ILE C 226 95.532 -0.329 -6.921 1.00 0.00 H new ATOM 0 HG22 ILE C 226 97.307 -0.462 -6.957 1.00 0.00 H new ATOM 0 HG23 ILE C 226 96.319 -1.865 -6.484 1.00 0.00 H new ATOM 0 HD11 ILE C 226 92.960 -0.301 -4.112 1.00 0.00 H new ATOM 0 HD12 ILE C 226 93.966 1.093 -4.571 1.00 0.00 H new ATOM 0 HD13 ILE C 226 93.703 -0.234 -5.727 1.00 0.00 H new ATOM 1465 N VAL C 227 99.446 0.771 -4.579 1.00 0.00 N ATOM 1466 CA VAL C 227 100.692 1.443 -5.150 1.00 0.00 C ATOM 1467 C VAL C 227 102.020 0.841 -4.596 1.00 0.00 C ATOM 1468 O VAL C 227 103.015 0.815 -5.307 1.00 0.00 O ATOM 1469 CB VAL C 227 100.566 3.021 -4.875 1.00 0.00 C ATOM 1470 CG1 VAL C 227 101.853 3.844 -5.375 1.00 0.00 C ATOM 1471 CG2 VAL C 227 99.246 3.600 -5.591 1.00 0.00 C ATOM 0 H VAL C 227 98.894 1.396 -3.991 1.00 0.00 H new ATOM 0 HA VAL C 227 100.744 1.257 -6.223 1.00 0.00 H new ATOM 0 HB VAL C 227 100.497 3.150 -3.795 1.00 0.00 H new ATOM 0 HG11 VAL C 227 101.712 4.904 -5.163 1.00 0.00 H new ATOM 0 HG12 VAL C 227 102.740 3.485 -4.853 1.00 0.00 H new ATOM 0 HG13 VAL C 227 101.981 3.702 -6.448 1.00 0.00 H new ATOM 0 HG21 VAL C 227 99.168 4.670 -5.400 1.00 0.00 H new ATOM 0 HG22 VAL C 227 99.309 3.427 -6.665 1.00 0.00 H new ATOM 0 HG23 VAL C 227 98.365 3.095 -5.194 1.00 0.00 H new ATOM 1481 N ALA C 228 102.050 0.457 -3.300 1.00 0.00 N ATOM 1482 CA ALA C 228 103.328 -0.032 -2.610 1.00 0.00 C ATOM 1483 C ALA C 228 103.986 -1.270 -3.303 1.00 0.00 C ATOM 1484 O ALA C 228 105.203 -1.403 -3.251 1.00 0.00 O ATOM 1485 CB ALA C 228 102.998 -0.354 -1.102 1.00 0.00 C ATOM 0 H ALA C 228 101.230 0.465 -2.693 1.00 0.00 H new ATOM 0 HA ALA C 228 104.064 0.768 -2.684 1.00 0.00 H new ATOM 0 HB1 ALA C 228 103.900 -0.703 -0.599 1.00 0.00 H new ATOM 0 HB2 ALA C 228 102.633 0.547 -0.609 1.00 0.00 H new ATOM 0 HB3 ALA C 228 102.233 -1.129 -1.054 1.00 0.00 H new ATOM 1491 N VAL C 229 103.187 -2.174 -3.931 1.00 0.00 N ATOM 1492 CA VAL C 229 103.763 -3.422 -4.623 1.00 0.00 C ATOM 1493 C VAL C 229 104.531 -3.015 -5.917 1.00 0.00 C ATOM 1494 O VAL C 229 105.555 -3.603 -6.248 1.00 0.00 O ATOM 1495 CB VAL C 229 102.621 -4.531 -4.890 1.00 0.00 C ATOM 1496 CG1 VAL C 229 101.756 -4.753 -3.557 1.00 0.00 C ATOM 1497 CG2 VAL C 229 101.657 -4.152 -6.118 1.00 0.00 C ATOM 0 H VAL C 229 102.172 -2.093 -3.988 1.00 0.00 H new ATOM 0 HA VAL C 229 104.484 -3.893 -3.955 1.00 0.00 H new ATOM 0 HB VAL C 229 103.130 -5.456 -5.163 1.00 0.00 H new ATOM 0 HG11 VAL C 229 100.987 -5.502 -3.743 1.00 0.00 H new ATOM 0 HG12 VAL C 229 102.408 -5.094 -2.753 1.00 0.00 H new ATOM 0 HG13 VAL C 229 101.285 -3.813 -3.268 1.00 0.00 H new ATOM 0 HG21 VAL C 229 100.910 -4.935 -6.249 1.00 0.00 H new ATOM 0 HG22 VAL C 229 101.158 -3.205 -5.910 1.00 0.00 H new ATOM 0 HG23 VAL C 229 102.248 -4.058 -7.029 1.00 0.00 H new ATOM 1507 N PHE C 230 104.001 -1.983 -6.643 1.00 0.00 N ATOM 1508 CA PHE C 230 104.636 -1.460 -7.933 1.00 0.00 C ATOM 1509 C PHE C 230 105.963 -0.706 -7.604 1.00 0.00 C ATOM 1510 O PHE C 230 106.963 -0.876 -8.294 1.00 0.00 O ATOM 1511 CB PHE C 230 103.605 -0.522 -8.682 1.00 0.00 C ATOM 1512 CG PHE C 230 102.402 -1.380 -9.273 1.00 0.00 C ATOM 1513 CD1 PHE C 230 101.104 -1.389 -8.671 1.00 0.00 C ATOM 1514 CD2 PHE C 230 102.615 -2.183 -10.441 1.00 0.00 C ATOM 1515 CE1 PHE C 230 100.061 -2.171 -9.222 1.00 0.00 C ATOM 1516 CE2 PHE C 230 101.563 -2.959 -10.982 1.00 0.00 C ATOM 1517 CZ PHE C 230 100.291 -2.953 -10.374 1.00 0.00 C ATOM 0 H PHE C 230 103.148 -1.491 -6.376 1.00 0.00 H new ATOM 0 HA PHE C 230 104.882 -2.293 -8.592 1.00 0.00 H new ATOM 0 HB2 PHE C 230 103.220 0.229 -7.993 1.00 0.00 H new ATOM 0 HB3 PHE C 230 104.109 0.013 -9.487 1.00 0.00 H new ATOM 0 HD1 PHE C 230 100.919 -0.794 -7.789 1.00 0.00 H new ATOM 0 HD2 PHE C 230 103.587 -2.196 -10.912 1.00 0.00 H new ATOM 0 HE1 PHE C 230 99.085 -2.169 -8.759 1.00 0.00 H new ATOM 0 HE2 PHE C 230 101.735 -3.558 -11.864 1.00 0.00 H new ATOM 0 HZ PHE C 230 99.491 -3.548 -10.790 1.00 0.00 H new ATOM 1527 N VAL C 231 105.952 0.121 -6.521 1.00 0.00 N ATOM 1528 CA VAL C 231 107.189 0.909 -6.063 1.00 0.00 C ATOM 1529 C VAL C 231 108.283 -0.092 -5.570 1.00 0.00 C ATOM 1530 O VAL C 231 109.466 0.140 -5.757 1.00 0.00 O ATOM 1531 CB VAL C 231 106.759 1.964 -4.936 1.00 0.00 C ATOM 1532 CG1 VAL C 231 108.019 2.754 -4.324 1.00 0.00 C ATOM 1533 CG2 VAL C 231 105.707 3.018 -5.546 1.00 0.00 C ATOM 0 H VAL C 231 105.127 0.275 -5.941 1.00 0.00 H new ATOM 0 HA VAL C 231 107.617 1.477 -6.889 1.00 0.00 H new ATOM 0 HB VAL C 231 106.299 1.400 -4.125 1.00 0.00 H new ATOM 0 HG11 VAL C 231 107.674 3.456 -3.565 1.00 0.00 H new ATOM 0 HG12 VAL C 231 108.710 2.042 -3.873 1.00 0.00 H new ATOM 0 HG13 VAL C 231 108.528 3.299 -5.119 1.00 0.00 H new ATOM 0 HG21 VAL C 231 105.419 3.732 -4.775 1.00 0.00 H new ATOM 0 HG22 VAL C 231 106.166 3.550 -6.379 1.00 0.00 H new ATOM 0 HG23 VAL C 231 104.822 2.487 -5.898 1.00 0.00 H new ATOM 1543 N CYS C 232 107.846 -1.210 -4.936 1.00 0.00 N ATOM 1544 CA CYS C 232 108.782 -2.294 -4.403 1.00 0.00 C ATOM 1545 C CYS C 232 109.489 -3.028 -5.584 1.00 0.00 C ATOM 1546 O CYS C 232 110.652 -3.381 -5.507 1.00 0.00 O ATOM 1547 CB CYS C 232 107.936 -3.295 -3.534 1.00 0.00 C ATOM 1548 SG CYS C 232 108.987 -4.561 -2.748 1.00 0.00 S ATOM 0 H CYS C 232 106.859 -1.406 -4.770 1.00 0.00 H new ATOM 0 HA CYS C 232 109.562 -1.849 -3.784 1.00 0.00 H new ATOM 0 HB2 CYS C 232 107.395 -2.743 -2.765 1.00 0.00 H new ATOM 0 HB3 CYS C 232 107.189 -3.781 -4.162 1.00 0.00 H new ATOM 0 HG CYS C 232 108.246 -5.362 -2.041 1.00 0.00 H new ATOM 1554 N LYS C 233 108.714 -3.251 -6.665 1.00 0.00 N ATOM 1555 CA LYS C 233 109.170 -3.968 -7.938 1.00 0.00 C ATOM 1556 C LYS C 233 110.288 -3.190 -8.669 1.00 0.00 C ATOM 1557 O LYS C 233 111.072 -3.776 -9.405 1.00 0.00 O ATOM 1558 CB LYS C 233 107.889 -4.217 -8.850 1.00 0.00 C ATOM 1559 CG LYS C 233 108.143 -5.272 -10.025 1.00 0.00 C ATOM 1560 CD LYS C 233 106.822 -5.525 -10.897 1.00 0.00 C ATOM 1561 CE LYS C 233 107.036 -6.617 -12.013 1.00 0.00 C ATOM 1562 NZ LYS C 233 105.762 -6.786 -12.772 1.00 0.00 N ATOM 0 H LYS C 233 107.741 -2.947 -6.709 1.00 0.00 H new ATOM 0 HA LYS C 233 109.617 -4.929 -7.686 1.00 0.00 H new ATOM 0 HB2 LYS C 233 107.070 -4.571 -8.224 1.00 0.00 H new ATOM 0 HB3 LYS C 233 107.572 -3.269 -9.285 1.00 0.00 H new ATOM 0 HG2 LYS C 233 108.941 -4.909 -10.672 1.00 0.00 H new ATOM 0 HG3 LYS C 233 108.483 -6.216 -9.598 1.00 0.00 H new ATOM 0 HD2 LYS C 233 106.010 -5.836 -10.239 1.00 0.00 H new ATOM 0 HD3 LYS C 233 106.513 -4.589 -11.363 1.00 0.00 H new ATOM 0 HE2 LYS C 233 107.839 -6.316 -12.686 1.00 0.00 H new ATOM 0 HE3 LYS C 233 107.335 -7.563 -11.562 1.00 0.00 H new ATOM 0 HZ1 LYS C 233 105.892 -7.505 -13.512 1.00 0.00 H new ATOM 0 HZ2 LYS C 233 105.009 -7.089 -12.122 1.00 0.00 H new ATOM 0 HZ3 LYS C 233 105.497 -5.881 -13.211 1.00 0.00 H new