USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 593 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 175 TYR OH : rot 5:sc= 0.565 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 194 TYR OH : rot 180:sc= 0 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0 USER MOD Single : A 209 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00907) USER MOD Single : A 213 MET CE :methyl 154:sc= -0.597 (180deg=-1.84!) USER MOD Single : A 214 THR OG1 : rot -16:sc= 0.602 USER MOD Single : A 227 THR OG1 : rot 87:sc= 0.738 USER MOD Single : A 228 GLN : amide:sc= -0.0259 K(o=-0.026,f=-6.6!) USER MOD Single : A 232 LYS NZ :NH3+ -161:sc= 0.0405 (180deg=-0.266) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ -167:sc= 0.804 (180deg=0.667) USER MOD Single : A 250 TYR OH : rot 180:sc= -0.231 USER MOD Single : A 256 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 169 -7.113 13.097 0.805 1.00 2.33 N ATOM 33 CA ASP A 169 -5.712 13.304 0.402 1.00 10.11 C ATOM 34 C ASP A 169 -5.230 12.218 -0.571 1.00 51.14 C ATOM 35 O ASP A 169 -5.058 12.486 -1.762 1.00 72.14 O ATOM 36 CB ASP A 169 -4.804 13.362 1.658 1.00 73.54 C ATOM 37 CG ASP A 169 -3.349 13.730 1.332 1.00 2.52 C ATOM 38 OD1 ASP A 169 -3.063 14.939 1.158 1.00 2.13 O ATOM 39 OD2 ASP A 169 -2.492 12.827 1.210 1.00 24.22 O ATOM 0 HA ASP A 169 -5.651 14.255 -0.126 1.00 10.11 H new ATOM 0 HB2 ASP A 169 -5.209 14.092 2.359 1.00 73.54 H new ATOM 0 HB3 ASP A 169 -4.824 12.394 2.159 1.00 73.54 H new ATOM 44 N VAL A 170 -5.025 11.003 -0.044 1.00 72.44 N ATOM 45 CA VAL A 170 -4.546 9.851 -0.831 1.00 51.34 C ATOM 46 C VAL A 170 -5.715 9.136 -1.512 1.00 62.35 C ATOM 47 O VAL A 170 -6.882 9.440 -1.237 1.00 64.32 O ATOM 48 CB VAL A 170 -3.765 8.842 0.080 1.00 64.14 C ATOM 49 CG1 VAL A 170 -2.572 9.521 0.772 1.00 43.13 C ATOM 50 CG2 VAL A 170 -4.687 8.178 1.120 1.00 43.03 C ATOM 0 H VAL A 170 -5.186 10.788 0.940 1.00 72.44 H new ATOM 0 HA VAL A 170 -3.870 10.229 -1.598 1.00 51.34 H new ATOM 0 HB VAL A 170 -3.381 8.058 -0.572 1.00 64.14 H new ATOM 0 HG11 VAL A 170 -2.052 8.794 1.396 1.00 43.13 H new ATOM 0 HG12 VAL A 170 -1.887 9.909 0.018 1.00 43.13 H new ATOM 0 HG13 VAL A 170 -2.931 10.342 1.393 1.00 43.13 H new ATOM 0 HG21 VAL A 170 -4.107 7.486 1.731 1.00 43.03 H new ATOM 0 HG22 VAL A 170 -5.127 8.944 1.758 1.00 43.03 H new ATOM 0 HG23 VAL A 170 -5.480 7.633 0.608 1.00 43.03 H new ATOM 60 N ILE A 171 -5.406 8.174 -2.390 1.00 25.34 N ATOM 61 CA ILE A 171 -6.436 7.314 -3.004 1.00 72.23 C ATOM 62 C ILE A 171 -6.595 6.027 -2.164 1.00 65.13 C ATOM 63 O ILE A 171 -5.617 5.537 -1.571 1.00 13.31 O ATOM 64 CB ILE A 171 -6.125 6.995 -4.519 1.00 44.33 C ATOM 65 CG1 ILE A 171 -7.253 6.113 -5.164 1.00 15.15 C ATOM 66 CG2 ILE A 171 -4.734 6.355 -4.690 1.00 61.22 C ATOM 67 CD1 ILE A 171 -7.114 5.878 -6.656 1.00 63.22 C ATOM 0 H ILE A 171 -4.454 7.968 -2.693 1.00 25.34 H new ATOM 0 HA ILE A 171 -7.383 7.854 -3.004 1.00 72.23 H new ATOM 0 HB ILE A 171 -6.110 7.944 -5.055 1.00 44.33 H new ATOM 0 HG12 ILE A 171 -7.269 5.147 -4.660 1.00 15.15 H new ATOM 0 HG13 ILE A 171 -8.216 6.587 -4.975 1.00 15.15 H new ATOM 0 HG21 ILE A 171 -4.555 6.150 -5.745 1.00 61.22 H new ATOM 0 HG22 ILE A 171 -3.971 7.039 -4.319 1.00 61.22 H new ATOM 0 HG23 ILE A 171 -4.691 5.423 -4.127 1.00 61.22 H new ATOM 0 HD11 ILE A 171 -7.940 5.259 -7.005 1.00 63.22 H new ATOM 0 HD12 ILE A 171 -7.131 6.835 -7.178 1.00 63.22 H new ATOM 0 HD13 ILE A 171 -6.170 5.371 -6.858 1.00 63.22 H new ATOM 79 N ASP A 172 -7.842 5.525 -2.105 1.00 55.02 N ATOM 80 CA ASP A 172 -8.236 4.341 -1.330 1.00 63.23 C ATOM 81 C ASP A 172 -7.464 3.083 -1.793 1.00 44.14 C ATOM 82 O ASP A 172 -7.402 2.778 -2.994 1.00 73.53 O ATOM 83 CB ASP A 172 -9.772 4.107 -1.459 1.00 23.13 C ATOM 84 CG ASP A 172 -10.289 2.867 -0.695 1.00 2.33 C ATOM 85 OD1 ASP A 172 -10.488 2.953 0.535 1.00 1.14 O ATOM 86 OD2 ASP A 172 -10.498 1.801 -1.321 1.00 13.12 O ATOM 0 H ASP A 172 -8.622 5.945 -2.610 1.00 55.02 H new ATOM 0 HA ASP A 172 -7.986 4.522 -0.285 1.00 63.23 H new ATOM 0 HB2 ASP A 172 -10.295 4.990 -1.092 1.00 23.13 H new ATOM 0 HB3 ASP A 172 -10.025 4.002 -2.514 1.00 23.13 H new ATOM 91 N ALA A 173 -6.875 2.393 -0.818 1.00 61.21 N ATOM 92 CA ALA A 173 -6.170 1.121 -1.006 1.00 5.52 C ATOM 93 C ALA A 173 -6.240 0.311 0.288 1.00 32.30 C ATOM 94 O ALA A 173 -6.522 0.863 1.358 1.00 61.43 O ATOM 95 CB ALA A 173 -4.707 1.364 -1.403 1.00 13.22 C ATOM 0 H ALA A 173 -6.873 2.710 0.152 1.00 61.21 H new ATOM 0 HA ALA A 173 -6.649 0.564 -1.811 1.00 5.52 H new ATOM 0 HB1 ALA A 173 -4.203 0.407 -1.537 1.00 13.22 H new ATOM 0 HB2 ALA A 173 -4.672 1.927 -2.336 1.00 13.22 H new ATOM 0 HB3 ALA A 173 -4.206 1.931 -0.618 1.00 13.22 H new ATOM 101 N ASP A 174 -5.962 -0.989 0.183 1.00 11.40 N ATOM 102 CA ASP A 174 -5.855 -1.888 1.347 1.00 3.23 C ATOM 103 C ASP A 174 -4.835 -2.996 1.019 1.00 4.00 C ATOM 104 O ASP A 174 -4.291 -3.014 -0.089 1.00 23.34 O ATOM 105 CB ASP A 174 -7.259 -2.460 1.705 1.00 35.20 C ATOM 106 CG ASP A 174 -7.313 -3.031 3.129 1.00 14.42 C ATOM 107 OD1 ASP A 174 -7.434 -2.244 4.085 1.00 64.20 O ATOM 108 OD2 ASP A 174 -7.185 -4.249 3.311 1.00 41.32 O ATOM 0 H ASP A 174 -5.803 -1.455 -0.710 1.00 11.40 H new ATOM 0 HA ASP A 174 -5.501 -1.347 2.224 1.00 3.23 H new ATOM 0 HB2 ASP A 174 -8.006 -1.672 1.604 1.00 35.20 H new ATOM 0 HB3 ASP A 174 -7.522 -3.242 0.993 1.00 35.20 H new ATOM 113 N TYR A 175 -4.539 -3.887 1.981 1.00 24.12 N ATOM 114 CA TYR A 175 -3.660 -5.047 1.741 1.00 51.10 C ATOM 115 C TYR A 175 -4.130 -6.271 2.529 1.00 50.33 C ATOM 116 O TYR A 175 -5.074 -6.190 3.316 1.00 41.24 O ATOM 117 CB TYR A 175 -2.172 -4.719 2.067 1.00 64.24 C ATOM 118 CG TYR A 175 -1.788 -4.623 3.553 1.00 61.13 C ATOM 119 CD1 TYR A 175 -1.738 -3.405 4.197 1.00 72.12 C ATOM 120 CD2 TYR A 175 -1.448 -5.761 4.295 1.00 74.21 C ATOM 121 CE1 TYR A 175 -1.365 -3.320 5.512 1.00 61.34 C ATOM 122 CE2 TYR A 175 -1.085 -5.680 5.620 1.00 52.30 C ATOM 123 CZ TYR A 175 -1.039 -4.454 6.226 1.00 10.42 C ATOM 124 OH TYR A 175 -0.661 -4.356 7.550 1.00 25.31 O ATOM 0 H TYR A 175 -4.896 -3.827 2.935 1.00 24.12 H new ATOM 0 HA TYR A 175 -3.722 -5.283 0.679 1.00 51.10 H new ATOM 0 HB2 TYR A 175 -1.547 -5.483 1.604 1.00 64.24 H new ATOM 0 HB3 TYR A 175 -1.922 -3.771 1.590 1.00 64.24 H new ATOM 0 HD1 TYR A 175 -1.996 -2.506 3.657 1.00 72.12 H new ATOM 0 HD2 TYR A 175 -1.471 -6.728 3.815 1.00 74.21 H new ATOM 0 HE1 TYR A 175 -1.326 -2.355 5.995 1.00 61.34 H new ATOM 0 HE2 TYR A 175 -0.839 -6.573 6.175 1.00 52.30 H new ATOM 0 HH TYR A 175 -0.756 -3.428 7.850 1.00 25.31 H new ATOM 134 N LYS A 176 -3.423 -7.397 2.329 1.00 44.23 N ATOM 135 CA LYS A 176 -3.669 -8.658 3.038 1.00 51.53 C ATOM 136 C LYS A 176 -2.325 -9.282 3.460 1.00 4.53 C ATOM 137 O LYS A 176 -1.417 -9.366 2.633 1.00 50.15 O ATOM 138 CB LYS A 176 -4.480 -9.641 2.148 1.00 74.04 C ATOM 139 CG LYS A 176 -5.941 -9.208 1.873 1.00 71.42 C ATOM 140 CD LYS A 176 -6.777 -9.084 3.173 1.00 55.24 C ATOM 141 CE LYS A 176 -6.916 -10.421 3.917 1.00 11.31 C ATOM 142 NZ LYS A 176 -7.731 -10.296 5.148 1.00 21.22 N ATOM 0 H LYS A 176 -2.655 -7.454 1.660 1.00 44.23 H new ATOM 0 HA LYS A 176 -4.261 -8.455 3.931 1.00 51.53 H new ATOM 0 HB2 LYS A 176 -3.964 -9.757 1.195 1.00 74.04 H new ATOM 0 HB3 LYS A 176 -4.489 -10.620 2.627 1.00 74.04 H new ATOM 0 HG2 LYS A 176 -5.941 -8.251 1.352 1.00 71.42 H new ATOM 0 HG3 LYS A 176 -6.413 -9.932 1.209 1.00 71.42 H new ATOM 0 HD2 LYS A 176 -6.310 -8.353 3.832 1.00 55.24 H new ATOM 0 HD3 LYS A 176 -7.769 -8.704 2.928 1.00 55.24 H new ATOM 0 HE2 LYS A 176 -7.372 -11.157 3.255 1.00 11.31 H new ATOM 0 HE3 LYS A 176 -5.926 -10.795 4.176 1.00 11.31 H new ATOM 0 HZ1 LYS A 176 -7.797 -11.222 5.616 1.00 21.22 H new ATOM 0 HZ2 LYS A 176 -7.284 -9.613 5.793 1.00 21.22 H new ATOM 0 HZ3 LYS A 176 -8.685 -9.964 4.900 1.00 21.22 H new ATOM 156 N PRO A 177 -2.174 -9.706 4.753 1.00 44.41 N ATOM 157 CA PRO A 177 -0.921 -10.318 5.260 1.00 45.13 C ATOM 158 C PRO A 177 -0.642 -11.690 4.585 1.00 43.12 C ATOM 159 O PRO A 177 -1.180 -12.727 4.995 1.00 21.30 O ATOM 160 CB PRO A 177 -1.173 -10.438 6.791 1.00 43.40 C ATOM 161 CG PRO A 177 -2.672 -10.479 6.932 1.00 34.31 C ATOM 162 CD PRO A 177 -3.215 -9.615 5.815 1.00 65.30 C ATOM 0 HA PRO A 177 -0.031 -9.729 5.036 1.00 45.13 H new ATOM 0 HB2 PRO A 177 -0.713 -11.338 7.198 1.00 43.40 H new ATOM 0 HB3 PRO A 177 -0.748 -9.591 7.329 1.00 43.40 H new ATOM 0 HG2 PRO A 177 -3.044 -11.500 6.853 1.00 34.31 H new ATOM 0 HG3 PRO A 177 -2.984 -10.101 7.906 1.00 34.31 H new ATOM 0 HD2 PRO A 177 -4.180 -9.979 5.461 1.00 65.30 H new ATOM 0 HD3 PRO A 177 -3.363 -8.586 6.142 1.00 65.30 H new ATOM 170 N ALA A 178 0.184 -11.651 3.521 1.00 22.22 N ATOM 171 CA ALA A 178 0.518 -12.826 2.687 1.00 64.12 C ATOM 172 C ALA A 178 1.274 -13.897 3.495 1.00 64.35 C ATOM 173 O ALA A 178 1.085 -15.102 3.288 1.00 20.34 O ATOM 174 CB ALA A 178 1.338 -12.396 1.456 1.00 23.43 C ATOM 0 H ALA A 178 0.644 -10.795 3.212 1.00 22.22 H new ATOM 0 HA ALA A 178 -0.418 -13.270 2.347 1.00 64.12 H new ATOM 0 HB1 ALA A 178 1.576 -13.272 0.853 1.00 23.43 H new ATOM 0 HB2 ALA A 178 0.757 -11.692 0.860 1.00 23.43 H new ATOM 0 HB3 ALA A 178 2.262 -11.919 1.783 1.00 23.43 H new ATOM 285 N GLN A 191 4.239 3.527 14.884 1.00 34.01 N ATOM 286 CA GLN A 191 2.879 3.027 14.599 1.00 64.21 C ATOM 287 C GLN A 191 2.579 3.214 13.108 1.00 61.14 C ATOM 288 O GLN A 191 1.866 2.416 12.487 1.00 2.34 O ATOM 289 CB GLN A 191 1.818 3.756 15.464 1.00 33.04 C ATOM 290 CG GLN A 191 2.000 3.575 16.989 1.00 42.51 C ATOM 291 CD GLN A 191 0.825 4.127 17.803 1.00 21.23 C ATOM 292 OE1 GLN A 191 0.817 5.284 18.218 1.00 61.02 O ATOM 293 NE2 GLN A 191 -0.197 3.314 18.004 1.00 24.12 N ATOM 0 HA GLN A 191 2.832 1.968 14.852 1.00 64.21 H new ATOM 0 HB2 GLN A 191 1.847 4.820 15.231 1.00 33.04 H new ATOM 0 HB3 GLN A 191 0.828 3.395 15.184 1.00 33.04 H new ATOM 0 HG2 GLN A 191 2.122 2.515 17.211 1.00 42.51 H new ATOM 0 HG3 GLN A 191 2.917 4.074 17.301 1.00 42.51 H new ATOM 0 HE21 GLN A 191 -0.166 2.358 17.649 1.00 24.12 H new ATOM 0 HE22 GLN A 191 -1.017 3.642 18.514 1.00 24.12 H new ATOM 302 N ASP A 192 3.141 4.289 12.542 1.00 63.24 N ATOM 303 CA ASP A 192 3.044 4.584 11.108 1.00 10.24 C ATOM 304 C ASP A 192 4.359 4.210 10.421 1.00 24.45 C ATOM 305 O ASP A 192 5.441 4.577 10.892 1.00 30.02 O ATOM 306 CB ASP A 192 2.638 6.069 10.853 1.00 53.34 C ATOM 307 CG ASP A 192 3.399 7.093 11.713 1.00 3.31 C ATOM 308 OD1 ASP A 192 4.496 7.554 11.317 1.00 32.32 O ATOM 309 OD2 ASP A 192 2.907 7.431 12.814 1.00 24.25 O ATOM 0 H ASP A 192 3.677 4.980 13.067 1.00 63.24 H new ATOM 0 HA ASP A 192 2.249 3.979 10.672 1.00 10.24 H new ATOM 0 HB2 ASP A 192 2.803 6.302 9.801 1.00 53.34 H new ATOM 0 HB3 ASP A 192 1.570 6.178 11.040 1.00 53.34 H new ATOM 314 N LEU A 193 4.252 3.435 9.329 1.00 63.40 N ATOM 315 CA LEU A 193 5.394 3.021 8.505 1.00 34.20 C ATOM 316 C LEU A 193 5.314 3.763 7.173 1.00 34.34 C ATOM 317 O LEU A 193 4.240 3.874 6.590 1.00 24.34 O ATOM 318 CB LEU A 193 5.367 1.489 8.252 1.00 72.10 C ATOM 319 CG LEU A 193 5.418 0.569 9.505 1.00 44.01 C ATOM 320 CD1 LEU A 193 5.487 -0.912 9.087 1.00 5.13 C ATOM 321 CD2 LEU A 193 6.602 0.934 10.417 1.00 35.32 C ATOM 0 H LEU A 193 3.359 3.076 8.992 1.00 63.40 H new ATOM 0 HA LEU A 193 6.322 3.260 9.024 1.00 34.20 H new ATOM 0 HB2 LEU A 193 4.461 1.253 7.694 1.00 72.10 H new ATOM 0 HB3 LEU A 193 6.211 1.236 7.610 1.00 72.10 H new ATOM 0 HG LEU A 193 4.501 0.725 10.073 1.00 44.01 H new ATOM 0 HD11 LEU A 193 5.522 -1.540 9.977 1.00 5.13 H new ATOM 0 HD12 LEU A 193 4.605 -1.165 8.499 1.00 5.13 H new ATOM 0 HD13 LEU A 193 6.383 -1.080 8.489 1.00 5.13 H new ATOM 0 HD21 LEU A 193 6.611 0.273 11.284 1.00 35.32 H new ATOM 0 HD22 LEU A 193 7.535 0.820 9.865 1.00 35.32 H new ATOM 0 HD23 LEU A 193 6.500 1.967 10.749 1.00 35.32 H new ATOM 333 N TYR A 194 6.446 4.290 6.714 1.00 72.55 N ATOM 334 CA TYR A 194 6.554 5.024 5.442 1.00 31.14 C ATOM 335 C TYR A 194 7.559 4.294 4.553 1.00 33.12 C ATOM 336 O TYR A 194 8.717 4.105 4.945 1.00 15.12 O ATOM 337 CB TYR A 194 6.971 6.504 5.696 1.00 1.20 C ATOM 338 CG TYR A 194 5.819 7.385 6.224 1.00 0.44 C ATOM 339 CD1 TYR A 194 5.319 7.224 7.521 1.00 72.04 C ATOM 340 CD2 TYR A 194 5.220 8.358 5.418 1.00 41.05 C ATOM 341 CE1 TYR A 194 4.269 7.985 7.984 1.00 14.43 C ATOM 342 CE2 TYR A 194 4.173 9.125 5.890 1.00 3.41 C ATOM 343 CZ TYR A 194 3.700 8.933 7.171 1.00 34.15 C ATOM 344 OH TYR A 194 2.643 9.685 7.641 1.00 72.42 O ATOM 0 H TYR A 194 7.331 4.222 7.217 1.00 72.55 H new ATOM 0 HA TYR A 194 5.588 5.054 4.938 1.00 31.14 H new ATOM 0 HB2 TYR A 194 7.792 6.524 6.413 1.00 1.20 H new ATOM 0 HB3 TYR A 194 7.349 6.931 4.767 1.00 1.20 H new ATOM 0 HD1 TYR A 194 5.766 6.488 8.172 1.00 72.04 H new ATOM 0 HD2 TYR A 194 5.581 8.512 4.412 1.00 41.05 H new ATOM 0 HE1 TYR A 194 3.894 7.836 8.986 1.00 14.43 H new ATOM 0 HE2 TYR A 194 3.725 9.875 5.256 1.00 3.41 H new ATOM 0 HH TYR A 194 2.353 10.312 6.946 1.00 72.42 H new ATOM 354 N ALA A 195 7.106 3.879 3.362 1.00 24.23 N ATOM 355 CA ALA A 195 7.891 3.039 2.447 1.00 0.11 C ATOM 356 C ALA A 195 7.434 3.250 0.994 1.00 14.32 C ATOM 357 O ALA A 195 6.378 3.843 0.731 1.00 4.33 O ATOM 358 CB ALA A 195 7.775 1.555 2.864 1.00 40.03 C ATOM 0 H ALA A 195 6.181 4.118 3.005 1.00 24.23 H new ATOM 0 HA ALA A 195 8.940 3.330 2.508 1.00 0.11 H new ATOM 0 HB1 ALA A 195 8.359 0.938 2.181 1.00 40.03 H new ATOM 0 HB2 ALA A 195 8.154 1.432 3.879 1.00 40.03 H new ATOM 0 HB3 ALA A 195 6.730 1.247 2.827 1.00 40.03 H new ATOM 364 N THR A 196 8.250 2.764 0.050 1.00 62.33 N ATOM 365 CA THR A 196 7.976 2.885 -1.384 1.00 53.40 C ATOM 366 C THR A 196 7.439 1.534 -1.915 1.00 2.54 C ATOM 367 O THR A 196 7.863 0.473 -1.443 1.00 11.31 O ATOM 368 CB THR A 196 9.269 3.312 -2.149 1.00 15.15 C ATOM 369 OG1 THR A 196 9.950 4.347 -1.417 1.00 50.40 O ATOM 370 CG2 THR A 196 8.949 3.824 -3.560 1.00 32.33 C ATOM 0 H THR A 196 9.120 2.275 0.262 1.00 62.33 H new ATOM 0 HA THR A 196 7.222 3.655 -1.549 1.00 53.40 H new ATOM 0 HB THR A 196 9.905 2.431 -2.238 1.00 15.15 H new ATOM 0 HG1 THR A 196 10.761 4.610 -1.900 1.00 50.40 H new ATOM 0 HG21 THR A 196 9.873 4.112 -4.061 1.00 32.33 H new ATOM 0 HG22 THR A 196 8.457 3.036 -4.130 1.00 32.33 H new ATOM 0 HG23 THR A 196 8.289 4.689 -3.492 1.00 32.33 H new ATOM 378 N LEU A 197 6.516 1.581 -2.881 1.00 13.25 N ATOM 379 CA LEU A 197 5.792 0.396 -3.371 1.00 32.13 C ATOM 380 C LEU A 197 6.062 0.192 -4.869 1.00 13.51 C ATOM 381 O LEU A 197 5.792 1.086 -5.666 1.00 33.53 O ATOM 382 CB LEU A 197 4.272 0.591 -3.119 1.00 4.05 C ATOM 383 CG LEU A 197 3.362 -0.622 -3.472 1.00 23.33 C ATOM 384 CD1 LEU A 197 3.779 -1.865 -2.672 1.00 3.45 C ATOM 385 CD2 LEU A 197 1.876 -0.287 -3.247 1.00 72.14 C ATOM 0 H LEU A 197 6.246 2.446 -3.350 1.00 13.25 H new ATOM 0 HA LEU A 197 6.138 -0.489 -2.838 1.00 32.13 H new ATOM 0 HB2 LEU A 197 4.126 0.835 -2.067 1.00 4.05 H new ATOM 0 HB3 LEU A 197 3.936 1.453 -3.696 1.00 4.05 H new ATOM 0 HG LEU A 197 3.491 -0.844 -4.531 1.00 23.33 H new ATOM 0 HD11 LEU A 197 3.130 -2.701 -2.934 1.00 3.45 H new ATOM 0 HD12 LEU A 197 4.812 -2.120 -2.908 1.00 3.45 H new ATOM 0 HD13 LEU A 197 3.691 -1.658 -1.606 1.00 3.45 H new ATOM 0 HD21 LEU A 197 1.265 -1.153 -3.502 1.00 72.14 H new ATOM 0 HD22 LEU A 197 1.716 -0.026 -2.201 1.00 72.14 H new ATOM 0 HD23 LEU A 197 1.593 0.555 -3.879 1.00 72.14 H new ATOM 397 N ASP A 198 6.603 -0.981 -5.243 1.00 11.30 N ATOM 398 CA ASP A 198 6.792 -1.359 -6.657 1.00 13.53 C ATOM 399 C ASP A 198 5.486 -1.951 -7.204 1.00 1.11 C ATOM 400 O ASP A 198 5.021 -2.991 -6.725 1.00 1.52 O ATOM 401 CB ASP A 198 7.938 -2.389 -6.806 1.00 41.55 C ATOM 402 CG ASP A 198 9.303 -1.827 -6.395 1.00 73.23 C ATOM 403 OD1 ASP A 198 9.667 -1.925 -5.208 1.00 71.34 O ATOM 404 OD2 ASP A 198 10.022 -1.281 -7.253 1.00 75.10 O ATOM 0 H ASP A 198 6.920 -1.689 -4.581 1.00 11.30 H new ATOM 0 HA ASP A 198 7.060 -0.467 -7.224 1.00 13.53 H new ATOM 0 HB2 ASP A 198 7.713 -3.265 -6.198 1.00 41.55 H new ATOM 0 HB3 ASP A 198 7.986 -2.724 -7.842 1.00 41.55 H new ATOM 409 N VAL A 199 4.886 -1.261 -8.175 1.00 30.21 N ATOM 410 CA VAL A 199 3.662 -1.697 -8.854 1.00 53.34 C ATOM 411 C VAL A 199 3.956 -1.871 -10.353 1.00 75.33 C ATOM 412 O VAL A 199 4.219 -0.879 -11.025 1.00 71.43 O ATOM 413 CB VAL A 199 2.487 -0.666 -8.648 1.00 11.50 C ATOM 414 CG1 VAL A 199 1.209 -1.109 -9.399 1.00 63.04 C ATOM 415 CG2 VAL A 199 2.191 -0.451 -7.143 1.00 73.33 C ATOM 0 H VAL A 199 5.242 -0.369 -8.518 1.00 30.21 H new ATOM 0 HA VAL A 199 3.344 -2.646 -8.422 1.00 53.34 H new ATOM 0 HB VAL A 199 2.810 0.286 -9.070 1.00 11.50 H new ATOM 0 HG11 VAL A 199 0.419 -0.376 -9.236 1.00 63.04 H new ATOM 0 HG12 VAL A 199 1.421 -1.183 -10.466 1.00 63.04 H new ATOM 0 HG13 VAL A 199 0.886 -2.081 -9.025 1.00 63.04 H new ATOM 0 HG21 VAL A 199 1.377 0.265 -7.031 1.00 73.33 H new ATOM 0 HG22 VAL A 199 1.905 -1.400 -6.689 1.00 73.33 H new ATOM 0 HG23 VAL A 199 3.083 -0.066 -6.648 1.00 73.33 H new ATOM 425 N PRO A 200 3.969 -3.132 -10.889 1.00 53.52 N ATOM 426 CA PRO A 200 4.063 -3.383 -12.348 1.00 3.22 C ATOM 427 C PRO A 200 2.962 -2.648 -13.137 1.00 42.45 C ATOM 428 O PRO A 200 1.821 -2.558 -12.661 1.00 44.41 O ATOM 429 CB PRO A 200 3.913 -4.926 -12.459 1.00 45.30 C ATOM 430 CG PRO A 200 4.382 -5.442 -11.129 1.00 10.34 C ATOM 431 CD PRO A 200 3.937 -4.405 -10.119 1.00 70.40 C ATOM 0 HA PRO A 200 4.995 -3.013 -12.775 1.00 3.22 H new ATOM 0 HB2 PRO A 200 2.879 -5.212 -12.654 1.00 45.30 H new ATOM 0 HB3 PRO A 200 4.514 -5.326 -13.275 1.00 45.30 H new ATOM 0 HG2 PRO A 200 3.947 -6.417 -10.910 1.00 10.34 H new ATOM 0 HG3 PRO A 200 5.465 -5.566 -11.115 1.00 10.34 H new ATOM 0 HD2 PRO A 200 2.938 -4.619 -9.738 1.00 70.40 H new ATOM 0 HD3 PRO A 200 4.605 -4.370 -9.259 1.00 70.40 H new ATOM 439 N ALA A 201 3.328 -2.124 -14.329 1.00 14.22 N ATOM 440 CA ALA A 201 2.400 -1.426 -15.248 1.00 34.15 C ATOM 441 C ALA A 201 1.071 -2.208 -15.501 1.00 74.11 C ATOM 442 O ALA A 201 0.004 -1.586 -15.389 1.00 0.55 O ATOM 443 CB ALA A 201 3.107 -1.063 -16.573 1.00 53.13 C ATOM 0 H ALA A 201 4.283 -2.174 -14.683 1.00 14.22 H new ATOM 0 HA ALA A 201 2.107 -0.503 -14.748 1.00 34.15 H new ATOM 0 HB1 ALA A 201 2.405 -0.551 -17.232 1.00 53.13 H new ATOM 0 HB2 ALA A 201 3.954 -0.409 -16.366 1.00 53.13 H new ATOM 0 HB3 ALA A 201 3.462 -1.973 -17.057 1.00 53.13 H new ATOM 449 N PRO A 202 1.095 -3.569 -15.820 1.00 53.41 N ATOM 450 CA PRO A 202 -0.149 -4.374 -15.966 1.00 72.22 C ATOM 451 C PRO A 202 -1.062 -4.297 -14.720 1.00 32.24 C ATOM 452 O PRO A 202 -2.256 -4.044 -14.853 1.00 62.30 O ATOM 453 CB PRO A 202 0.371 -5.826 -16.207 1.00 20.12 C ATOM 454 CG PRO A 202 1.810 -5.802 -15.769 1.00 10.51 C ATOM 455 CD PRO A 202 2.299 -4.417 -16.090 1.00 13.14 C ATOM 0 HA PRO A 202 -0.776 -4.006 -16.778 1.00 72.22 H new ATOM 0 HB2 PRO A 202 -0.204 -6.552 -15.632 1.00 20.12 H new ATOM 0 HB3 PRO A 202 0.282 -6.108 -17.256 1.00 20.12 H new ATOM 0 HG2 PRO A 202 1.901 -6.014 -14.704 1.00 10.51 H new ATOM 0 HG3 PRO A 202 2.394 -6.557 -16.295 1.00 10.51 H new ATOM 0 HD2 PRO A 202 3.144 -4.131 -15.463 1.00 13.14 H new ATOM 0 HD3 PRO A 202 2.628 -4.334 -17.126 1.00 13.14 H new ATOM 463 N ILE A 203 -0.456 -4.454 -13.521 1.00 44.10 N ATOM 464 CA ILE A 203 -1.180 -4.478 -12.230 1.00 33.42 C ATOM 465 C ILE A 203 -1.764 -3.089 -11.894 1.00 72.43 C ATOM 466 O ILE A 203 -2.834 -2.990 -11.286 1.00 64.14 O ATOM 467 CB ILE A 203 -0.241 -5.000 -11.065 1.00 74.50 C ATOM 468 CG1 ILE A 203 0.167 -6.490 -11.322 1.00 1.35 C ATOM 469 CG2 ILE A 203 -0.893 -4.829 -9.675 1.00 30.23 C ATOM 470 CD1 ILE A 203 0.996 -7.142 -10.221 1.00 51.42 C ATOM 0 H ILE A 203 0.553 -4.568 -13.422 1.00 44.10 H new ATOM 0 HA ILE A 203 -2.014 -5.173 -12.326 1.00 33.42 H new ATOM 0 HB ILE A 203 0.661 -4.388 -11.066 1.00 74.50 H new ATOM 0 HG12 ILE A 203 -0.740 -7.077 -11.466 1.00 1.35 H new ATOM 0 HG13 ILE A 203 0.730 -6.539 -12.254 1.00 1.35 H new ATOM 0 HG21 ILE A 203 -0.214 -5.200 -8.907 1.00 30.23 H new ATOM 0 HG22 ILE A 203 -1.100 -3.774 -9.498 1.00 30.23 H new ATOM 0 HG23 ILE A 203 -1.825 -5.393 -9.639 1.00 30.23 H new ATOM 0 HD11 ILE A 203 1.224 -8.171 -10.498 1.00 51.42 H new ATOM 0 HD12 ILE A 203 1.925 -6.587 -10.088 1.00 51.42 H new ATOM 0 HD13 ILE A 203 0.432 -7.134 -9.288 1.00 51.42 H new ATOM 482 N ALA A 204 -1.063 -2.025 -12.320 1.00 62.34 N ATOM 483 CA ALA A 204 -1.498 -0.638 -12.111 1.00 13.42 C ATOM 484 C ALA A 204 -2.790 -0.347 -12.891 1.00 23.44 C ATOM 485 O ALA A 204 -3.736 0.231 -12.347 1.00 64.51 O ATOM 486 CB ALA A 204 -0.379 0.330 -12.518 1.00 62.35 C ATOM 0 H ALA A 204 -0.177 -2.105 -12.820 1.00 62.34 H new ATOM 0 HA ALA A 204 -1.712 -0.494 -11.052 1.00 13.42 H new ATOM 0 HB1 ALA A 204 -0.710 1.356 -12.360 1.00 62.35 H new ATOM 0 HB2 ALA A 204 0.507 0.137 -11.913 1.00 62.35 H new ATOM 0 HB3 ALA A 204 -0.138 0.185 -13.571 1.00 62.35 H new ATOM 492 N VAL A 205 -2.822 -0.794 -14.159 1.00 14.22 N ATOM 493 CA VAL A 205 -3.963 -0.574 -15.062 1.00 53.54 C ATOM 494 C VAL A 205 -5.174 -1.433 -14.639 1.00 74.43 C ATOM 495 O VAL A 205 -6.274 -0.906 -14.442 1.00 52.21 O ATOM 496 CB VAL A 205 -3.563 -0.884 -16.548 1.00 13.01 C ATOM 497 CG1 VAL A 205 -4.734 -0.636 -17.531 1.00 4.24 C ATOM 498 CG2 VAL A 205 -2.322 -0.063 -16.966 1.00 65.41 C ATOM 0 H VAL A 205 -2.057 -1.318 -14.585 1.00 14.22 H new ATOM 0 HA VAL A 205 -4.249 0.476 -14.993 1.00 53.54 H new ATOM 0 HB VAL A 205 -3.315 -1.944 -16.598 1.00 13.01 H new ATOM 0 HG11 VAL A 205 -4.411 -0.864 -18.547 1.00 4.24 H new ATOM 0 HG12 VAL A 205 -5.574 -1.277 -17.265 1.00 4.24 H new ATOM 0 HG13 VAL A 205 -5.042 0.408 -17.474 1.00 4.24 H new ATOM 0 HG21 VAL A 205 -2.064 -0.295 -17.999 1.00 65.41 H new ATOM 0 HG22 VAL A 205 -2.543 1.001 -16.877 1.00 65.41 H new ATOM 0 HG23 VAL A 205 -1.483 -0.315 -16.317 1.00 65.41 H new ATOM 508 N VAL A 206 -4.954 -2.748 -14.472 1.00 63.03 N ATOM 509 CA VAL A 206 -6.045 -3.694 -14.133 1.00 11.24 C ATOM 510 C VAL A 206 -6.537 -3.512 -12.678 1.00 31.20 C ATOM 511 O VAL A 206 -7.691 -3.825 -12.371 1.00 22.15 O ATOM 512 CB VAL A 206 -5.637 -5.197 -14.377 1.00 70.51 C ATOM 513 CG1 VAL A 206 -5.125 -5.404 -15.814 1.00 60.42 C ATOM 514 CG2 VAL A 206 -4.597 -5.707 -13.351 1.00 21.34 C ATOM 0 H VAL A 206 -4.037 -3.184 -14.565 1.00 63.03 H new ATOM 0 HA VAL A 206 -6.865 -3.454 -14.809 1.00 11.24 H new ATOM 0 HB VAL A 206 -6.541 -5.790 -14.237 1.00 70.51 H new ATOM 0 HG11 VAL A 206 -4.850 -6.449 -15.955 1.00 60.42 H new ATOM 0 HG12 VAL A 206 -5.909 -5.136 -16.522 1.00 60.42 H new ATOM 0 HG13 VAL A 206 -4.252 -4.773 -15.984 1.00 60.42 H new ATOM 0 HG21 VAL A 206 -4.353 -6.747 -13.567 1.00 21.34 H new ATOM 0 HG22 VAL A 206 -3.693 -5.101 -13.417 1.00 21.34 H new ATOM 0 HG23 VAL A 206 -5.011 -5.633 -12.345 1.00 21.34 H new ATOM 524 N GLY A 207 -5.656 -2.997 -11.808 1.00 22.43 N ATOM 525 CA GLY A 207 -5.933 -2.879 -10.381 1.00 51.05 C ATOM 526 C GLY A 207 -5.866 -4.225 -9.684 1.00 62.45 C ATOM 527 O GLY A 207 -6.899 -4.812 -9.356 1.00 54.51 O ATOM 0 H GLY A 207 -4.735 -2.653 -12.080 1.00 22.43 H new ATOM 0 HA2 GLY A 207 -5.215 -2.197 -9.926 1.00 51.05 H new ATOM 0 HA3 GLY A 207 -6.922 -2.443 -10.237 1.00 51.05 H new ATOM 531 N GLY A 208 -4.641 -4.727 -9.487 1.00 1.12 N ATOM 532 CA GLY A 208 -4.404 -6.025 -8.834 1.00 22.44 C ATOM 533 C GLY A 208 -3.591 -5.875 -7.567 1.00 3.04 C ATOM 534 O GLY A 208 -3.445 -4.775 -7.064 1.00 34.44 O ATOM 0 H GLY A 208 -3.787 -4.249 -9.774 1.00 1.12 H new ATOM 0 HA2 GLY A 208 -5.360 -6.494 -8.600 1.00 22.44 H new ATOM 0 HA3 GLY A 208 -3.883 -6.689 -9.524 1.00 22.44 H new ATOM 538 N LYS A 209 -3.035 -6.977 -7.059 1.00 5.14 N ATOM 539 CA LYS A 209 -2.234 -6.973 -5.819 1.00 11.14 C ATOM 540 C LYS A 209 -0.737 -7.055 -6.151 1.00 71.23 C ATOM 541 O LYS A 209 -0.339 -7.759 -7.086 1.00 2.51 O ATOM 542 CB LYS A 209 -2.631 -8.164 -4.910 1.00 61.00 C ATOM 543 CG LYS A 209 -3.994 -8.002 -4.183 1.00 74.32 C ATOM 544 CD LYS A 209 -4.354 -9.240 -3.326 1.00 54.23 C ATOM 545 CE LYS A 209 -4.393 -10.542 -4.154 1.00 52.20 C ATOM 546 NZ LYS A 209 -4.618 -11.739 -3.307 1.00 3.31 N ATOM 0 H LYS A 209 -3.123 -7.898 -7.489 1.00 5.14 H new ATOM 0 HA LYS A 209 -2.433 -6.042 -5.289 1.00 11.14 H new ATOM 0 HB2 LYS A 209 -2.663 -9.070 -5.515 1.00 61.00 H new ATOM 0 HB3 LYS A 209 -1.851 -8.308 -4.162 1.00 61.00 H new ATOM 0 HG2 LYS A 209 -3.960 -7.119 -3.545 1.00 74.32 H new ATOM 0 HG3 LYS A 209 -4.779 -7.833 -4.920 1.00 74.32 H new ATOM 0 HD2 LYS A 209 -3.625 -9.346 -2.523 1.00 54.23 H new ATOM 0 HD3 LYS A 209 -5.325 -9.083 -2.856 1.00 54.23 H new ATOM 0 HE2 LYS A 209 -5.185 -10.473 -4.900 1.00 52.20 H new ATOM 0 HE3 LYS A 209 -3.454 -10.654 -4.696 1.00 52.20 H new ATOM 0 HZ1 LYS A 209 -4.569 -12.595 -3.896 1.00 3.31 H new ATOM 0 HZ2 LYS A 209 -3.887 -11.784 -2.569 1.00 3.31 H new ATOM 0 HZ3 LYS A 209 -5.556 -11.678 -2.862 1.00 3.31 H new ATOM 560 N VAL A 210 0.073 -6.332 -5.370 1.00 13.43 N ATOM 561 CA VAL A 210 1.553 -6.345 -5.449 1.00 64.14 C ATOM 562 C VAL A 210 2.124 -6.791 -4.095 1.00 52.43 C ATOM 563 O VAL A 210 1.536 -6.496 -3.054 1.00 54.34 O ATOM 564 CB VAL A 210 2.117 -4.924 -5.818 1.00 10.25 C ATOM 565 CG1 VAL A 210 1.716 -4.536 -7.247 1.00 65.22 C ATOM 566 CG2 VAL A 210 1.657 -3.843 -4.811 1.00 62.20 C ATOM 0 H VAL A 210 -0.281 -5.705 -4.647 1.00 13.43 H new ATOM 0 HA VAL A 210 1.853 -7.041 -6.233 1.00 64.14 H new ATOM 0 HB VAL A 210 3.204 -4.981 -5.763 1.00 10.25 H new ATOM 0 HG11 VAL A 210 2.116 -3.550 -7.482 1.00 65.22 H new ATOM 0 HG12 VAL A 210 2.117 -5.267 -7.949 1.00 65.22 H new ATOM 0 HG13 VAL A 210 0.629 -4.515 -7.327 1.00 65.22 H new ATOM 0 HG21 VAL A 210 2.068 -2.876 -5.102 1.00 62.20 H new ATOM 0 HG22 VAL A 210 0.568 -3.788 -4.808 1.00 62.20 H new ATOM 0 HG23 VAL A 210 2.010 -4.102 -3.813 1.00 62.20 H new ATOM 576 N ARG A 211 3.267 -7.496 -4.092 1.00 43.24 N ATOM 577 CA ARG A 211 3.856 -7.996 -2.838 1.00 30.42 C ATOM 578 C ARG A 211 4.835 -6.950 -2.259 1.00 62.24 C ATOM 579 O ARG A 211 5.909 -6.711 -2.816 1.00 33.31 O ATOM 580 CB ARG A 211 4.528 -9.376 -3.045 1.00 41.52 C ATOM 581 CG ARG A 211 4.692 -10.185 -1.735 1.00 21.11 C ATOM 582 CD ARG A 211 5.231 -11.604 -1.964 1.00 72.40 C ATOM 583 NE ARG A 211 4.385 -12.397 -2.879 1.00 11.11 N ATOM 584 CZ ARG A 211 4.497 -13.722 -3.081 1.00 60.32 C ATOM 585 NH1 ARG A 211 5.417 -14.446 -2.446 1.00 64.02 N ATOM 586 NH2 ARG A 211 3.706 -14.308 -3.965 1.00 70.04 N ATOM 0 H ARG A 211 3.796 -7.731 -4.932 1.00 43.24 H new ATOM 0 HA ARG A 211 3.059 -8.146 -2.109 1.00 30.42 H new ATOM 0 HB2 ARG A 211 3.935 -9.958 -3.750 1.00 41.52 H new ATOM 0 HB3 ARG A 211 5.509 -9.230 -3.498 1.00 41.52 H new ATOM 0 HG2 ARG A 211 5.367 -9.650 -1.067 1.00 21.11 H new ATOM 0 HG3 ARG A 211 3.728 -10.247 -1.230 1.00 21.11 H new ATOM 0 HD2 ARG A 211 6.240 -11.543 -2.371 1.00 72.40 H new ATOM 0 HD3 ARG A 211 5.304 -12.119 -1.006 1.00 72.40 H new ATOM 0 HE ARG A 211 3.660 -11.901 -3.398 1.00 11.11 H new ATOM 0 HH11 ARG A 211 6.056 -13.997 -1.790 1.00 64.02 H new ATOM 0 HH12 ARG A 211 5.483 -15.450 -2.616 1.00 64.02 H new ATOM 0 HH21 ARG A 211 3.023 -13.756 -4.483 1.00 70.04 H new ATOM 0 HH22 ARG A 211 3.780 -15.312 -4.129 1.00 70.04 H new ATOM 600 N ALA A 212 4.428 -6.330 -1.140 1.00 53.13 N ATOM 601 CA ALA A 212 5.156 -5.238 -0.476 1.00 71.43 C ATOM 602 C ALA A 212 5.948 -5.764 0.727 1.00 45.33 C ATOM 603 O ALA A 212 5.631 -6.822 1.281 1.00 15.42 O ATOM 604 CB ALA A 212 4.150 -4.178 -0.006 1.00 63.54 C ATOM 0 H ALA A 212 3.563 -6.580 -0.661 1.00 53.13 H new ATOM 0 HA ALA A 212 5.859 -4.800 -1.185 1.00 71.43 H new ATOM 0 HB1 ALA A 212 4.682 -3.365 0.487 1.00 63.54 H new ATOM 0 HB2 ALA A 212 3.606 -3.787 -0.865 1.00 63.54 H new ATOM 0 HB3 ALA A 212 3.447 -4.629 0.694 1.00 63.54 H new ATOM 610 N MET A 213 6.970 -4.996 1.130 1.00 10.20 N ATOM 611 CA MET A 213 7.856 -5.343 2.245 1.00 23.14 C ATOM 612 C MET A 213 7.540 -4.477 3.469 1.00 34.23 C ATOM 613 O MET A 213 7.794 -3.268 3.469 1.00 75.32 O ATOM 614 CB MET A 213 9.348 -5.179 1.814 1.00 42.34 C ATOM 615 CG MET A 213 9.821 -6.127 0.680 1.00 22.30 C ATOM 616 SD MET A 213 10.469 -7.722 1.272 1.00 63.33 S ATOM 617 CE MET A 213 9.036 -8.563 1.952 1.00 14.42 C ATOM 0 H MET A 213 7.205 -4.109 0.686 1.00 10.20 H new ATOM 0 HA MET A 213 7.690 -6.385 2.518 1.00 23.14 H new ATOM 0 HB2 MET A 213 9.505 -4.149 1.493 1.00 42.34 H new ATOM 0 HB3 MET A 213 9.981 -5.340 2.687 1.00 42.34 H new ATOM 0 HG2 MET A 213 8.986 -6.314 0.004 1.00 22.30 H new ATOM 0 HG3 MET A 213 10.595 -5.625 0.099 1.00 22.30 H new ATOM 0 HE1 MET A 213 9.191 -9.641 1.907 1.00 14.42 H new ATOM 0 HE2 MET A 213 8.894 -8.260 2.989 1.00 14.42 H new ATOM 0 HE3 MET A 213 8.151 -8.300 1.373 1.00 14.42 H new ATOM 627 N THR A 214 6.943 -5.099 4.494 1.00 60.41 N ATOM 628 CA THR A 214 6.751 -4.473 5.816 1.00 55.21 C ATOM 629 C THR A 214 7.640 -5.175 6.846 1.00 75.23 C ATOM 630 O THR A 214 8.303 -6.177 6.537 1.00 62.41 O ATOM 631 CB THR A 214 5.252 -4.537 6.279 1.00 71.33 C ATOM 632 OG1 THR A 214 4.788 -5.897 6.318 1.00 0.00 O ATOM 633 CG2 THR A 214 4.342 -3.704 5.365 1.00 74.35 C ATOM 0 H THR A 214 6.578 -6.050 4.434 1.00 60.41 H new ATOM 0 HA THR A 214 7.028 -3.422 5.735 1.00 55.21 H new ATOM 0 HB THR A 214 5.206 -4.115 7.283 1.00 71.33 H new ATOM 0 HG1 THR A 214 5.403 -6.467 5.812 1.00 0.00 H new ATOM 0 HG21 THR A 214 3.312 -3.772 5.716 1.00 74.35 H new ATOM 0 HG22 THR A 214 4.663 -2.663 5.383 1.00 74.35 H new ATOM 0 HG23 THR A 214 4.403 -4.085 4.346 1.00 74.35 H new ATOM 641 N LEU A 215 7.637 -4.644 8.076 1.00 64.02 N ATOM 642 CA LEU A 215 8.417 -5.204 9.197 1.00 21.21 C ATOM 643 C LEU A 215 7.809 -6.553 9.660 1.00 23.11 C ATOM 644 O LEU A 215 8.464 -7.352 10.330 1.00 2.21 O ATOM 645 CB LEU A 215 8.458 -4.184 10.368 1.00 31.41 C ATOM 646 CG LEU A 215 8.802 -2.708 9.979 1.00 14.45 C ATOM 647 CD1 LEU A 215 8.950 -1.822 11.218 1.00 42.44 C ATOM 648 CD2 LEU A 215 10.046 -2.616 9.073 1.00 54.02 C ATOM 0 H LEU A 215 7.096 -3.816 8.326 1.00 64.02 H new ATOM 0 HA LEU A 215 9.437 -5.393 8.863 1.00 21.21 H new ATOM 0 HB2 LEU A 215 7.488 -4.191 10.864 1.00 31.41 H new ATOM 0 HB3 LEU A 215 9.192 -4.527 11.097 1.00 31.41 H new ATOM 0 HG LEU A 215 7.959 -2.332 9.399 1.00 14.45 H new ATOM 0 HD11 LEU A 215 9.189 -0.804 10.911 1.00 42.44 H new ATOM 0 HD12 LEU A 215 8.015 -1.822 11.779 1.00 42.44 H new ATOM 0 HD13 LEU A 215 9.751 -2.208 11.848 1.00 42.44 H new ATOM 0 HD21 LEU A 215 10.243 -1.572 8.831 1.00 54.02 H new ATOM 0 HD22 LEU A 215 10.907 -3.037 9.593 1.00 54.02 H new ATOM 0 HD23 LEU A 215 9.869 -3.174 8.154 1.00 54.02 H new ATOM 660 N GLU A 216 6.544 -6.781 9.265 1.00 54.12 N ATOM 661 CA GLU A 216 5.777 -8.001 9.562 1.00 42.43 C ATOM 662 C GLU A 216 5.928 -9.038 8.430 1.00 4.04 C ATOM 663 O GLU A 216 5.358 -10.133 8.510 1.00 41.12 O ATOM 664 CB GLU A 216 4.285 -7.616 9.777 1.00 62.31 C ATOM 665 CG GLU A 216 4.096 -6.444 10.768 1.00 55.53 C ATOM 666 CD GLU A 216 2.638 -6.161 11.127 1.00 71.31 C ATOM 667 OE1 GLU A 216 2.179 -6.620 12.198 1.00 53.03 O ATOM 668 OE2 GLU A 216 1.941 -5.502 10.327 1.00 70.30 O ATOM 0 H GLU A 216 6.014 -6.104 8.716 1.00 54.12 H new ATOM 0 HA GLU A 216 6.164 -8.462 10.471 1.00 42.43 H new ATOM 0 HB2 GLU A 216 3.844 -7.347 8.817 1.00 62.31 H new ATOM 0 HB3 GLU A 216 3.741 -8.486 10.145 1.00 62.31 H new ATOM 0 HG2 GLU A 216 4.648 -6.662 11.682 1.00 55.53 H new ATOM 0 HG3 GLU A 216 4.535 -5.544 10.338 1.00 55.53 H new ATOM 675 N GLY A 217 6.701 -8.678 7.385 1.00 41.43 N ATOM 676 CA GLY A 217 7.021 -9.571 6.267 1.00 74.14 C ATOM 677 C GLY A 217 6.324 -9.183 4.967 1.00 12.11 C ATOM 678 O GLY A 217 5.893 -8.028 4.811 1.00 60.54 O ATOM 0 H GLY A 217 7.120 -7.752 7.298 1.00 41.43 H new ATOM 0 HA2 GLY A 217 8.099 -9.570 6.107 1.00 74.14 H new ATOM 0 HA3 GLY A 217 6.739 -10.590 6.532 1.00 74.14 H new ATOM 682 N PRO A 218 6.236 -10.123 3.984 1.00 63.40 N ATOM 683 CA PRO A 218 5.554 -9.872 2.698 1.00 31.53 C ATOM 684 C PRO A 218 4.012 -9.818 2.835 1.00 74.43 C ATOM 685 O PRO A 218 3.396 -10.675 3.484 1.00 53.34 O ATOM 686 CB PRO A 218 6.021 -11.051 1.810 1.00 61.02 C ATOM 687 CG PRO A 218 6.329 -12.161 2.771 1.00 0.34 C ATOM 688 CD PRO A 218 6.823 -11.496 4.044 1.00 63.10 C ATOM 0 HA PRO A 218 5.806 -8.898 2.279 1.00 31.53 H new ATOM 0 HB2 PRO A 218 5.245 -11.345 1.103 1.00 61.02 H new ATOM 0 HB3 PRO A 218 6.900 -10.780 1.224 1.00 61.02 H new ATOM 0 HG2 PRO A 218 5.442 -12.764 2.966 1.00 0.34 H new ATOM 0 HG3 PRO A 218 7.086 -12.830 2.363 1.00 0.34 H new ATOM 0 HD2 PRO A 218 6.490 -12.034 4.931 1.00 63.10 H new ATOM 0 HD3 PRO A 218 7.912 -11.464 4.081 1.00 63.10 H new ATOM 696 N VAL A 219 3.411 -8.777 2.238 1.00 64.54 N ATOM 697 CA VAL A 219 1.946 -8.566 2.203 1.00 34.32 C ATOM 698 C VAL A 219 1.509 -8.283 0.753 1.00 63.10 C ATOM 699 O VAL A 219 2.335 -7.928 -0.069 1.00 22.13 O ATOM 700 CB VAL A 219 1.502 -7.383 3.144 1.00 22.03 C ATOM 701 CG1 VAL A 219 1.868 -7.662 4.621 1.00 25.31 C ATOM 702 CG2 VAL A 219 2.083 -6.025 2.678 1.00 73.12 C ATOM 0 H VAL A 219 3.933 -8.044 1.757 1.00 64.54 H new ATOM 0 HA VAL A 219 1.461 -9.471 2.569 1.00 34.32 H new ATOM 0 HB VAL A 219 0.416 -7.317 3.075 1.00 22.03 H new ATOM 0 HG11 VAL A 219 1.546 -6.824 5.240 1.00 25.31 H new ATOM 0 HG12 VAL A 219 1.369 -8.572 4.954 1.00 25.31 H new ATOM 0 HG13 VAL A 219 2.947 -7.786 4.711 1.00 25.31 H new ATOM 0 HG21 VAL A 219 1.752 -5.237 3.354 1.00 73.12 H new ATOM 0 HG22 VAL A 219 3.172 -6.074 2.683 1.00 73.12 H new ATOM 0 HG23 VAL A 219 1.734 -5.807 1.669 1.00 73.12 H new ATOM 712 N GLU A 220 0.222 -8.462 0.440 1.00 51.32 N ATOM 713 CA GLU A 220 -0.336 -8.195 -0.906 1.00 40.40 C ATOM 714 C GLU A 220 -1.233 -6.951 -0.873 1.00 52.33 C ATOM 715 O GLU A 220 -2.349 -7.013 -0.360 1.00 1.33 O ATOM 716 CB GLU A 220 -1.165 -9.404 -1.390 1.00 52.13 C ATOM 717 CG GLU A 220 -0.376 -10.713 -1.529 1.00 22.11 C ATOM 718 CD GLU A 220 -1.240 -11.867 -2.051 1.00 73.20 C ATOM 719 OE1 GLU A 220 -1.273 -12.099 -3.285 1.00 32.21 O ATOM 720 OE2 GLU A 220 -1.895 -12.540 -1.232 1.00 62.02 O ATOM 0 H GLU A 220 -0.471 -8.797 1.109 1.00 51.32 H new ATOM 0 HA GLU A 220 0.493 -8.025 -1.592 1.00 40.40 H new ATOM 0 HB2 GLU A 220 -1.988 -9.565 -0.693 1.00 52.13 H new ATOM 0 HB3 GLU A 220 -1.608 -9.159 -2.355 1.00 52.13 H new ATOM 0 HG2 GLU A 220 0.464 -10.557 -2.206 1.00 22.11 H new ATOM 0 HG3 GLU A 220 0.042 -10.986 -0.560 1.00 22.11 H new ATOM 727 N VAL A 221 -0.767 -5.844 -1.466 1.00 34.13 N ATOM 728 CA VAL A 221 -1.477 -4.559 -1.449 1.00 2.41 C ATOM 729 C VAL A 221 -2.361 -4.444 -2.695 1.00 23.10 C ATOM 730 O VAL A 221 -1.858 -4.445 -3.822 1.00 52.31 O ATOM 731 CB VAL A 221 -0.472 -3.347 -1.399 1.00 33.41 C ATOM 732 CG1 VAL A 221 -1.210 -1.982 -1.397 1.00 21.33 C ATOM 733 CG2 VAL A 221 0.460 -3.449 -0.172 1.00 44.33 C ATOM 0 H VAL A 221 0.117 -5.815 -1.973 1.00 34.13 H new ATOM 0 HA VAL A 221 -2.094 -4.524 -0.551 1.00 2.41 H new ATOM 0 HB VAL A 221 0.132 -3.399 -2.305 1.00 33.41 H new ATOM 0 HG11 VAL A 221 -0.480 -1.174 -1.362 1.00 21.33 H new ATOM 0 HG12 VAL A 221 -1.809 -1.891 -2.303 1.00 21.33 H new ATOM 0 HG13 VAL A 221 -1.861 -1.921 -0.525 1.00 21.33 H new ATOM 0 HG21 VAL A 221 1.143 -2.600 -0.162 1.00 44.33 H new ATOM 0 HG22 VAL A 221 -0.137 -3.445 0.740 1.00 44.33 H new ATOM 0 HG23 VAL A 221 1.033 -4.375 -0.226 1.00 44.33 H new ATOM 743 N ALA A 222 -3.681 -4.381 -2.462 1.00 35.24 N ATOM 744 CA ALA A 222 -4.674 -4.151 -3.507 1.00 31.32 C ATOM 745 C ALA A 222 -4.508 -2.726 -4.076 1.00 52.11 C ATOM 746 O ALA A 222 -4.903 -1.733 -3.448 1.00 3.31 O ATOM 747 CB ALA A 222 -6.085 -4.371 -2.936 1.00 14.01 C ATOM 0 H ALA A 222 -4.086 -4.490 -1.532 1.00 35.24 H new ATOM 0 HA ALA A 222 -4.527 -4.858 -4.323 1.00 31.32 H new ATOM 0 HB1 ALA A 222 -6.825 -4.199 -3.718 1.00 14.01 H new ATOM 0 HB2 ALA A 222 -6.174 -5.394 -2.571 1.00 14.01 H new ATOM 0 HB3 ALA A 222 -6.257 -3.676 -2.114 1.00 14.01 H new ATOM 753 N VAL A 223 -3.854 -2.662 -5.233 1.00 2.31 N ATOM 754 CA VAL A 223 -3.639 -1.439 -6.008 1.00 42.11 C ATOM 755 C VAL A 223 -4.958 -1.049 -6.712 1.00 53.30 C ATOM 756 O VAL A 223 -5.602 -1.925 -7.305 1.00 34.34 O ATOM 757 CB VAL A 223 -2.508 -1.664 -7.081 1.00 23.44 C ATOM 758 CG1 VAL A 223 -2.209 -0.392 -7.906 1.00 24.25 C ATOM 759 CG2 VAL A 223 -1.224 -2.205 -6.415 1.00 22.45 C ATOM 0 H VAL A 223 -3.445 -3.486 -5.673 1.00 2.31 H new ATOM 0 HA VAL A 223 -3.327 -0.638 -5.338 1.00 42.11 H new ATOM 0 HB VAL A 223 -2.880 -2.411 -7.783 1.00 23.44 H new ATOM 0 HG11 VAL A 223 -1.422 -0.604 -8.630 1.00 24.25 H new ATOM 0 HG12 VAL A 223 -3.111 -0.079 -8.432 1.00 24.25 H new ATOM 0 HG13 VAL A 223 -1.883 0.406 -7.239 1.00 24.25 H new ATOM 0 HG21 VAL A 223 -0.455 -2.353 -7.174 1.00 22.45 H new ATOM 0 HG22 VAL A 223 -0.869 -1.489 -5.674 1.00 22.45 H new ATOM 0 HG23 VAL A 223 -1.440 -3.155 -5.927 1.00 22.45 H new ATOM 769 N PRO A 224 -5.410 0.241 -6.618 1.00 31.14 N ATOM 770 CA PRO A 224 -6.594 0.728 -7.381 1.00 14.24 C ATOM 771 C PRO A 224 -6.411 0.599 -8.930 1.00 25.51 C ATOM 772 O PRO A 224 -5.275 0.577 -9.419 1.00 30.02 O ATOM 773 CB PRO A 224 -6.726 2.215 -6.935 1.00 45.32 C ATOM 774 CG PRO A 224 -5.389 2.579 -6.338 1.00 2.42 C ATOM 775 CD PRO A 224 -4.852 1.307 -5.729 1.00 73.43 C ATOM 0 HA PRO A 224 -7.487 0.139 -7.174 1.00 14.24 H new ATOM 0 HB2 PRO A 224 -6.966 2.858 -7.782 1.00 45.32 H new ATOM 0 HB3 PRO A 224 -7.527 2.336 -6.206 1.00 45.32 H new ATOM 0 HG2 PRO A 224 -4.712 2.964 -7.100 1.00 2.42 H new ATOM 0 HG3 PRO A 224 -5.496 3.359 -5.584 1.00 2.42 H new ATOM 0 HD2 PRO A 224 -3.762 1.294 -5.720 1.00 73.43 H new ATOM 0 HD3 PRO A 224 -5.181 1.184 -4.697 1.00 73.43 H new ATOM 783 N PRO A 225 -7.521 0.451 -9.721 1.00 1.51 N ATOM 784 CA PRO A 225 -7.444 0.417 -11.207 1.00 72.33 C ATOM 785 C PRO A 225 -6.972 1.757 -11.815 1.00 40.34 C ATOM 786 O PRO A 225 -7.247 2.831 -11.259 1.00 12.42 O ATOM 787 CB PRO A 225 -8.901 0.071 -11.643 1.00 31.55 C ATOM 788 CG PRO A 225 -9.541 -0.509 -10.409 1.00 21.35 C ATOM 789 CD PRO A 225 -8.917 0.246 -9.256 1.00 41.25 C ATOM 0 HA PRO A 225 -6.708 -0.306 -11.559 1.00 72.33 H new ATOM 0 HB2 PRO A 225 -9.433 0.958 -11.985 1.00 31.55 H new ATOM 0 HB3 PRO A 225 -8.909 -0.643 -12.466 1.00 31.55 H new ATOM 0 HG2 PRO A 225 -10.623 -0.379 -10.427 1.00 21.35 H new ATOM 0 HG3 PRO A 225 -9.350 -1.579 -10.330 1.00 21.35 H new ATOM 0 HD2 PRO A 225 -9.425 1.192 -9.069 1.00 41.25 H new ATOM 0 HD3 PRO A 225 -8.956 -0.326 -8.329 1.00 41.25 H new ATOM 797 N ARG A 226 -6.226 1.654 -12.942 1.00 71.34 N ATOM 798 CA ARG A 226 -5.762 2.796 -13.760 1.00 5.23 C ATOM 799 C ARG A 226 -4.766 3.693 -12.997 1.00 30.50 C ATOM 800 O ARG A 226 -4.592 4.857 -13.356 1.00 24.25 O ATOM 801 CB ARG A 226 -6.969 3.618 -14.314 1.00 75.04 C ATOM 802 CG ARG A 226 -7.933 2.805 -15.202 1.00 21.22 C ATOM 803 CD ARG A 226 -9.104 3.644 -15.733 1.00 60.33 C ATOM 804 NE ARG A 226 -8.656 4.760 -16.587 1.00 33.51 N ATOM 805 CZ ARG A 226 -9.397 5.341 -17.542 1.00 1.31 C ATOM 806 NH1 ARG A 226 -10.637 4.926 -17.788 1.00 43.32 N ATOM 807 NH2 ARG A 226 -8.889 6.337 -18.254 1.00 11.35 N ATOM 0 H ARG A 226 -5.925 0.753 -13.314 1.00 71.34 H new ATOM 0 HA ARG A 226 -5.221 2.383 -14.611 1.00 5.23 H new ATOM 0 HB2 ARG A 226 -7.528 4.032 -13.475 1.00 75.04 H new ATOM 0 HB3 ARG A 226 -6.587 4.461 -14.889 1.00 75.04 H new ATOM 0 HG2 ARG A 226 -7.380 2.388 -16.044 1.00 21.22 H new ATOM 0 HG3 ARG A 226 -8.325 1.964 -14.630 1.00 21.22 H new ATOM 0 HD2 ARG A 226 -9.778 3.003 -16.302 1.00 60.33 H new ATOM 0 HD3 ARG A 226 -9.674 4.040 -14.892 1.00 60.33 H new ATOM 0 HE ARG A 226 -7.712 5.117 -16.440 1.00 33.51 H new ATOM 0 HH11 ARG A 226 -11.034 4.158 -17.247 1.00 43.32 H new ATOM 0 HH12 ARG A 226 -11.190 5.376 -18.517 1.00 43.32 H new ATOM 0 HH21 ARG A 226 -7.938 6.659 -18.075 1.00 11.35 H new ATOM 0 HH22 ARG A 226 -9.449 6.782 -18.981 1.00 11.35 H new ATOM 821 N THR A 227 -4.100 3.113 -11.978 1.00 4.33 N ATOM 822 CA THR A 227 -3.100 3.794 -11.136 1.00 33.23 C ATOM 823 C THR A 227 -1.965 4.432 -11.969 1.00 14.50 C ATOM 824 O THR A 227 -1.519 3.861 -12.965 1.00 72.41 O ATOM 825 CB THR A 227 -2.526 2.784 -10.075 1.00 21.24 C ATOM 826 OG1 THR A 227 -3.493 2.597 -9.044 1.00 23.32 O ATOM 827 CG2 THR A 227 -1.200 3.217 -9.434 1.00 32.13 C ATOM 0 H THR A 227 -4.246 2.139 -11.714 1.00 4.33 H new ATOM 0 HA THR A 227 -3.599 4.614 -10.619 1.00 33.23 H new ATOM 0 HB THR A 227 -2.317 1.862 -10.617 1.00 21.24 H new ATOM 0 HG1 THR A 227 -4.111 1.882 -9.301 1.00 23.32 H new ATOM 0 HG21 THR A 227 -0.879 2.462 -8.716 1.00 32.13 H new ATOM 0 HG22 THR A 227 -0.441 3.328 -10.208 1.00 32.13 H new ATOM 0 HG23 THR A 227 -1.337 4.169 -8.922 1.00 32.13 H new ATOM 835 N GLN A 228 -1.556 5.655 -11.561 1.00 32.51 N ATOM 836 CA GLN A 228 -0.422 6.386 -12.161 1.00 63.54 C ATOM 837 C GLN A 228 0.808 6.287 -11.241 1.00 31.51 C ATOM 838 O GLN A 228 0.685 6.005 -10.042 1.00 14.31 O ATOM 839 CB GLN A 228 -0.762 7.890 -12.403 1.00 1.12 C ATOM 840 CG GLN A 228 -2.050 8.173 -13.211 1.00 53.24 C ATOM 841 CD GLN A 228 -3.327 8.182 -12.366 1.00 10.04 C ATOM 842 OE1 GLN A 228 -3.958 7.159 -12.143 1.00 23.04 O ATOM 843 NE2 GLN A 228 -3.717 9.347 -11.885 1.00 45.13 N ATOM 0 H GLN A 228 -2.008 6.164 -10.801 1.00 32.51 H new ATOM 0 HA GLN A 228 -0.210 5.926 -13.126 1.00 63.54 H new ATOM 0 HB2 GLN A 228 -0.849 8.383 -11.435 1.00 1.12 H new ATOM 0 HB3 GLN A 228 0.078 8.353 -12.922 1.00 1.12 H new ATOM 0 HG2 GLN A 228 -1.950 9.137 -13.709 1.00 53.24 H new ATOM 0 HG3 GLN A 228 -2.149 7.420 -13.992 1.00 53.24 H new ATOM 0 HE21 GLN A 228 -3.175 10.188 -12.084 1.00 45.13 H new ATOM 0 HE22 GLN A 228 -4.560 9.407 -11.314 1.00 45.13 H new ATOM 852 N ALA A 229 1.998 6.494 -11.825 1.00 44.25 N ATOM 853 CA ALA A 229 3.253 6.597 -11.065 1.00 62.43 C ATOM 854 C ALA A 229 3.290 7.954 -10.348 1.00 62.31 C ATOM 855 O ALA A 229 3.014 8.990 -10.965 1.00 15.11 O ATOM 856 CB ALA A 229 4.457 6.427 -12.002 1.00 72.13 C ATOM 0 H ALA A 229 2.117 6.594 -12.833 1.00 44.25 H new ATOM 0 HA ALA A 229 3.304 5.803 -10.320 1.00 62.43 H new ATOM 0 HB1 ALA A 229 5.380 6.505 -11.427 1.00 72.13 H new ATOM 0 HB2 ALA A 229 4.410 5.449 -12.481 1.00 72.13 H new ATOM 0 HB3 ALA A 229 4.438 7.206 -12.764 1.00 72.13 H new ATOM 862 N GLY A 230 3.605 7.940 -9.052 1.00 51.23 N ATOM 863 CA GLY A 230 3.524 9.139 -8.216 1.00 14.03 C ATOM 864 C GLY A 230 2.261 9.173 -7.375 1.00 31.32 C ATOM 865 O GLY A 230 2.026 10.170 -6.677 1.00 71.14 O ATOM 0 H GLY A 230 3.920 7.106 -8.556 1.00 51.23 H new ATOM 0 HA2 GLY A 230 4.395 9.182 -7.561 1.00 14.03 H new ATOM 0 HA3 GLY A 230 3.559 10.024 -8.851 1.00 14.03 H new ATOM 869 N ARG A 231 1.422 8.107 -7.464 1.00 71.40 N ATOM 870 CA ARG A 231 0.250 7.954 -6.589 1.00 73.03 C ATOM 871 C ARG A 231 0.694 7.672 -5.147 1.00 64.43 C ATOM 872 O ARG A 231 1.818 7.222 -4.894 1.00 45.34 O ATOM 873 CB ARG A 231 -0.731 6.839 -7.077 1.00 31.45 C ATOM 874 CG ARG A 231 -1.724 7.278 -8.187 1.00 44.11 C ATOM 875 CD ARG A 231 -2.959 6.356 -8.251 1.00 61.23 C ATOM 876 NE ARG A 231 -3.952 6.769 -9.254 1.00 24.21 N ATOM 877 CZ ARG A 231 -4.965 7.631 -9.045 1.00 53.03 C ATOM 878 NH1 ARG A 231 -5.131 8.224 -7.862 1.00 2.11 N ATOM 879 NH2 ARG A 231 -5.831 7.860 -10.023 1.00 53.51 N ATOM 0 H ARG A 231 1.543 7.348 -8.134 1.00 71.40 H new ATOM 0 HA ARG A 231 -0.295 8.897 -6.627 1.00 73.03 H new ATOM 0 HB2 ARG A 231 -0.145 5.997 -7.447 1.00 31.45 H new ATOM 0 HB3 ARG A 231 -1.302 6.479 -6.221 1.00 31.45 H new ATOM 0 HG2 ARG A 231 -2.045 8.303 -8.002 1.00 44.11 H new ATOM 0 HG3 ARG A 231 -1.216 7.272 -9.151 1.00 44.11 H new ATOM 0 HD2 ARG A 231 -2.632 5.340 -8.473 1.00 61.23 H new ATOM 0 HD3 ARG A 231 -3.434 6.331 -7.270 1.00 61.23 H new ATOM 0 HE ARG A 231 -3.866 6.368 -10.188 1.00 24.21 H new ATOM 0 HH11 ARG A 231 -4.485 8.027 -7.098 1.00 2.11 H new ATOM 0 HH12 ARG A 231 -5.904 8.874 -7.722 1.00 2.11 H new ATOM 0 HH21 ARG A 231 -5.725 7.386 -10.920 1.00 53.51 H new ATOM 0 HH22 ARG A 231 -6.603 8.511 -9.878 1.00 53.51 H new ATOM 893 N LYS A 232 -0.217 7.938 -4.219 1.00 54.51 N ATOM 894 CA LYS A 232 0.033 7.836 -2.780 1.00 63.13 C ATOM 895 C LYS A 232 -1.090 7.028 -2.115 1.00 24.33 C ATOM 896 O LYS A 232 -2.275 7.244 -2.403 1.00 23.43 O ATOM 897 CB LYS A 232 0.155 9.262 -2.185 1.00 72.14 C ATOM 898 CG LYS A 232 -0.980 10.236 -2.580 1.00 20.43 C ATOM 899 CD LYS A 232 -0.808 11.636 -1.949 1.00 73.12 C ATOM 900 CE LYS A 232 -1.881 12.632 -2.402 1.00 0.25 C ATOM 901 NZ LYS A 232 -1.777 13.920 -1.673 1.00 23.10 N ATOM 0 H LYS A 232 -1.166 8.236 -4.445 1.00 54.51 H new ATOM 0 HA LYS A 232 0.969 7.310 -2.592 1.00 63.13 H new ATOM 0 HB2 LYS A 232 0.184 9.184 -1.098 1.00 72.14 H new ATOM 0 HB3 LYS A 232 1.107 9.690 -2.500 1.00 72.14 H new ATOM 0 HG2 LYS A 232 -1.010 10.332 -3.665 1.00 20.43 H new ATOM 0 HG3 LYS A 232 -1.937 9.817 -2.270 1.00 20.43 H new ATOM 0 HD2 LYS A 232 -0.839 11.546 -0.863 1.00 73.12 H new ATOM 0 HD3 LYS A 232 0.176 12.027 -2.208 1.00 73.12 H new ATOM 0 HE2 LYS A 232 -1.783 12.811 -3.473 1.00 0.25 H new ATOM 0 HE3 LYS A 232 -2.869 12.201 -2.240 1.00 0.25 H new ATOM 0 HZ1 LYS A 232 -2.675 14.438 -1.754 1.00 23.10 H new ATOM 0 HZ2 LYS A 232 -1.573 13.736 -0.670 1.00 23.10 H new ATOM 0 HZ3 LYS A 232 -1.010 14.490 -2.083 1.00 23.10 H new ATOM 915 N LEU A 233 -0.702 6.067 -1.261 1.00 30.42 N ATOM 916 CA LEU A 233 -1.637 5.206 -0.514 1.00 53.24 C ATOM 917 C LEU A 233 -1.366 5.391 0.985 1.00 65.41 C ATOM 918 O LEU A 233 -0.222 5.277 1.405 1.00 15.22 O ATOM 919 CB LEU A 233 -1.418 3.707 -0.903 1.00 25.03 C ATOM 920 CG LEU A 233 -1.362 3.373 -2.431 1.00 33.32 C ATOM 921 CD1 LEU A 233 -1.083 1.875 -2.664 1.00 21.41 C ATOM 922 CD2 LEU A 233 -2.645 3.819 -3.160 1.00 54.34 C ATOM 0 H LEU A 233 0.278 5.863 -1.067 1.00 30.42 H new ATOM 0 HA LEU A 233 -2.664 5.480 -0.753 1.00 53.24 H new ATOM 0 HB2 LEU A 233 -0.486 3.371 -0.448 1.00 25.03 H new ATOM 0 HB3 LEU A 233 -2.221 3.120 -0.457 1.00 25.03 H new ATOM 0 HG LEU A 233 -0.533 3.939 -2.856 1.00 33.32 H new ATOM 0 HD11 LEU A 233 -1.050 1.673 -3.735 1.00 21.41 H new ATOM 0 HD12 LEU A 233 -0.126 1.609 -2.215 1.00 21.41 H new ATOM 0 HD13 LEU A 233 -1.875 1.282 -2.207 1.00 21.41 H new ATOM 0 HD21 LEU A 233 -2.567 3.570 -4.218 1.00 54.34 H new ATOM 0 HD22 LEU A 233 -3.505 3.307 -2.729 1.00 54.34 H new ATOM 0 HD23 LEU A 233 -2.771 4.896 -3.049 1.00 54.34 H new ATOM 934 N ARG A 234 -2.401 5.700 1.778 1.00 12.50 N ATOM 935 CA ARG A 234 -2.314 5.706 3.254 1.00 30.45 C ATOM 936 C ARG A 234 -3.273 4.635 3.784 1.00 0.53 C ATOM 937 O ARG A 234 -4.498 4.813 3.778 1.00 63.53 O ATOM 938 CB ARG A 234 -2.641 7.105 3.838 1.00 42.25 C ATOM 939 CG ARG A 234 -2.569 7.201 5.380 1.00 3.40 C ATOM 940 CD ARG A 234 -2.908 8.610 5.903 1.00 51.11 C ATOM 941 NE ARG A 234 -2.923 8.647 7.375 1.00 13.33 N ATOM 942 CZ ARG A 234 -2.444 9.634 8.147 1.00 71.24 C ATOM 943 NH1 ARG A 234 -1.889 10.713 7.604 1.00 54.20 N ATOM 944 NH2 ARG A 234 -2.499 9.526 9.467 1.00 33.43 N ATOM 0 H ARG A 234 -3.322 5.953 1.420 1.00 12.50 H new ATOM 0 HA ARG A 234 -1.295 5.480 3.568 1.00 30.45 H new ATOM 0 HB2 ARG A 234 -1.950 7.831 3.411 1.00 42.25 H new ATOM 0 HB3 ARG A 234 -3.643 7.391 3.517 1.00 42.25 H new ATOM 0 HG2 ARG A 234 -3.259 6.479 5.818 1.00 3.40 H new ATOM 0 HG3 ARG A 234 -1.568 6.926 5.711 1.00 3.40 H new ATOM 0 HD2 ARG A 234 -2.176 9.325 5.527 1.00 51.11 H new ATOM 0 HD3 ARG A 234 -3.881 8.918 5.520 1.00 51.11 H new ATOM 0 HE ARG A 234 -3.337 7.846 7.853 1.00 13.33 H new ATOM 0 HH11 ARG A 234 -1.824 10.797 6.590 1.00 54.20 H new ATOM 0 HH12 ARG A 234 -1.528 11.457 8.202 1.00 54.20 H new ATOM 0 HH21 ARG A 234 -2.905 8.693 9.894 1.00 33.43 H new ATOM 0 HH22 ARG A 234 -2.135 10.275 10.056 1.00 33.43 H new ATOM 958 N LEU A 235 -2.691 3.508 4.180 1.00 2.10 N ATOM 959 CA LEU A 235 -3.419 2.332 4.649 1.00 75.24 C ATOM 960 C LEU A 235 -3.759 2.506 6.145 1.00 53.41 C ATOM 961 O LEU A 235 -2.983 2.105 7.026 1.00 3.02 O ATOM 962 CB LEU A 235 -2.544 1.073 4.374 1.00 34.31 C ATOM 963 CG LEU A 235 -2.025 0.938 2.893 1.00 25.40 C ATOM 964 CD1 LEU A 235 -0.862 -0.043 2.778 1.00 52.03 C ATOM 965 CD2 LEU A 235 -3.142 0.545 1.923 1.00 41.22 C ATOM 0 H LEU A 235 -1.679 3.383 4.184 1.00 2.10 H new ATOM 0 HA LEU A 235 -4.364 2.209 4.119 1.00 75.24 H new ATOM 0 HB2 LEU A 235 -1.685 1.092 5.045 1.00 34.31 H new ATOM 0 HB3 LEU A 235 -3.123 0.184 4.623 1.00 34.31 H new ATOM 0 HG LEU A 235 -1.664 1.927 2.612 1.00 25.40 H new ATOM 0 HD11 LEU A 235 -0.538 -0.103 1.739 1.00 52.03 H new ATOM 0 HD12 LEU A 235 -0.033 0.301 3.397 1.00 52.03 H new ATOM 0 HD13 LEU A 235 -1.183 -1.029 3.116 1.00 52.03 H new ATOM 0 HD21 LEU A 235 -2.736 0.464 0.915 1.00 41.22 H new ATOM 0 HD22 LEU A 235 -3.563 -0.415 2.223 1.00 41.22 H new ATOM 0 HD23 LEU A 235 -3.923 1.305 1.940 1.00 41.22 H new ATOM 977 N LYS A 236 -4.887 3.206 6.400 1.00 51.34 N ATOM 978 CA LYS A 236 -5.366 3.513 7.761 1.00 23.32 C ATOM 979 C LYS A 236 -5.891 2.251 8.452 1.00 0.05 C ATOM 980 O LYS A 236 -6.597 1.449 7.823 1.00 31.13 O ATOM 981 CB LYS A 236 -6.479 4.593 7.733 1.00 62.44 C ATOM 982 CG LYS A 236 -6.000 6.000 7.319 1.00 33.13 C ATOM 983 CD LYS A 236 -7.103 7.069 7.520 1.00 73.40 C ATOM 984 CE LYS A 236 -6.589 8.505 7.335 1.00 63.32 C ATOM 985 NZ LYS A 236 -7.656 9.513 7.558 1.00 51.54 N ATOM 0 H LYS A 236 -5.490 3.574 5.664 1.00 51.34 H new ATOM 0 HA LYS A 236 -4.518 3.900 8.325 1.00 23.32 H new ATOM 0 HB2 LYS A 236 -7.260 4.272 7.044 1.00 62.44 H new ATOM 0 HB3 LYS A 236 -6.932 4.655 8.722 1.00 62.44 H new ATOM 0 HG2 LYS A 236 -5.121 6.271 7.904 1.00 33.13 H new ATOM 0 HG3 LYS A 236 -5.694 5.986 6.273 1.00 33.13 H new ATOM 0 HD2 LYS A 236 -7.912 6.885 6.814 1.00 73.40 H new ATOM 0 HD3 LYS A 236 -7.523 6.966 8.520 1.00 73.40 H new ATOM 0 HE2 LYS A 236 -5.768 8.688 8.028 1.00 63.32 H new ATOM 0 HE3 LYS A 236 -6.188 8.619 6.328 1.00 63.32 H new ATOM 0 HZ1 LYS A 236 -7.266 10.467 7.423 1.00 51.54 H new ATOM 0 HZ2 LYS A 236 -8.429 9.356 6.880 1.00 51.54 H new ATOM 0 HZ3 LYS A 236 -8.022 9.423 8.527 1.00 51.54 H new ATOM 999 N GLY A 237 -5.532 2.089 9.745 1.00 61.54 N ATOM 1000 CA GLY A 237 -5.912 0.901 10.520 1.00 2.13 C ATOM 1001 C GLY A 237 -5.231 -0.365 10.020 1.00 13.14 C ATOM 1002 O GLY A 237 -5.656 -1.481 10.353 1.00 24.24 O ATOM 0 H GLY A 237 -4.980 2.769 10.268 1.00 61.54 H new ATOM 0 HA2 GLY A 237 -5.656 1.058 11.568 1.00 2.13 H new ATOM 0 HA3 GLY A 237 -6.993 0.771 10.472 1.00 2.13 H new ATOM 1006 N LYS A 238 -4.169 -0.181 9.225 1.00 34.44 N ATOM 1007 CA LYS A 238 -3.433 -1.259 8.559 1.00 51.03 C ATOM 1008 C LYS A 238 -1.922 -0.968 8.607 1.00 73.33 C ATOM 1009 O LYS A 238 -1.161 -1.481 7.808 1.00 74.34 O ATOM 1010 CB LYS A 238 -3.951 -1.430 7.084 1.00 21.14 C ATOM 1011 CG LYS A 238 -5.370 -2.038 6.958 1.00 14.45 C ATOM 1012 CD LYS A 238 -5.415 -3.511 7.430 1.00 2.14 C ATOM 1013 CE LYS A 238 -6.842 -4.088 7.503 1.00 13.24 C ATOM 1014 NZ LYS A 238 -7.529 -4.136 6.184 1.00 72.13 N ATOM 0 H LYS A 238 -3.790 0.744 9.023 1.00 34.44 H new ATOM 0 HA LYS A 238 -3.606 -2.200 9.081 1.00 51.03 H new ATOM 0 HB2 LYS A 238 -3.945 -0.455 6.597 1.00 21.14 H new ATOM 0 HB3 LYS A 238 -3.251 -2.063 6.539 1.00 21.14 H new ATOM 0 HG2 LYS A 238 -6.071 -1.447 7.548 1.00 14.45 H new ATOM 0 HG3 LYS A 238 -5.698 -1.980 5.920 1.00 14.45 H new ATOM 0 HD2 LYS A 238 -4.819 -4.121 6.751 1.00 2.14 H new ATOM 0 HD3 LYS A 238 -4.951 -3.584 8.414 1.00 2.14 H new ATOM 0 HE2 LYS A 238 -6.798 -5.095 7.918 1.00 13.24 H new ATOM 0 HE3 LYS A 238 -7.435 -3.485 8.191 1.00 13.24 H new ATOM 0 HZ1 LYS A 238 -8.542 -4.321 6.327 1.00 72.13 H new ATOM 0 HZ2 LYS A 238 -7.409 -3.225 5.697 1.00 72.13 H new ATOM 0 HZ3 LYS A 238 -7.117 -4.895 5.605 1.00 72.13 H new ATOM 1028 N GLY A 239 -1.487 -0.157 9.574 1.00 13.21 N ATOM 1029 CA GLY A 239 -0.056 0.054 9.827 1.00 54.00 C ATOM 1030 C GLY A 239 0.497 -0.951 10.816 1.00 13.15 C ATOM 1031 O GLY A 239 0.340 -2.156 10.619 1.00 43.32 O ATOM 0 H GLY A 239 -2.104 0.365 10.196 1.00 13.21 H new ATOM 0 HA2 GLY A 239 0.493 -0.020 8.888 1.00 54.00 H new ATOM 0 HA3 GLY A 239 0.100 1.063 10.209 1.00 54.00 H new ATOM 1035 N PHE A 240 1.156 -0.459 11.869 1.00 50.35 N ATOM 1036 CA PHE A 240 1.690 -1.298 12.960 1.00 1.22 C ATOM 1037 C PHE A 240 0.567 -1.664 13.959 1.00 0.35 C ATOM 1038 O PHE A 240 -0.348 -0.849 14.139 1.00 41.23 O ATOM 1039 CB PHE A 240 2.877 -0.560 13.672 1.00 32.13 C ATOM 1040 CG PHE A 240 4.119 -1.421 13.827 1.00 53.13 C ATOM 1041 CD1 PHE A 240 4.735 -1.977 12.706 1.00 14.05 C ATOM 1042 CD2 PHE A 240 4.653 -1.702 15.084 1.00 42.03 C ATOM 1043 CE1 PHE A 240 5.847 -2.777 12.840 1.00 3.55 C ATOM 1044 CE2 PHE A 240 5.763 -2.497 15.209 1.00 42.01 C ATOM 1045 CZ PHE A 240 6.358 -3.036 14.090 1.00 71.43 C ATOM 0 H PHE A 240 1.338 0.537 11.995 1.00 50.35 H new ATOM 0 HA PHE A 240 2.074 -2.228 12.542 1.00 1.22 H new ATOM 0 HB2 PHE A 240 3.133 0.334 13.103 1.00 32.13 H new ATOM 0 HB3 PHE A 240 2.549 -0.228 14.657 1.00 32.13 H new ATOM 0 HD1 PHE A 240 4.335 -1.778 11.723 1.00 14.05 H new ATOM 0 HD2 PHE A 240 4.188 -1.290 15.967 1.00 42.03 H new ATOM 0 HE1 PHE A 240 6.317 -3.201 11.965 1.00 3.55 H new ATOM 0 HE2 PHE A 240 6.172 -2.701 16.188 1.00 42.01 H new ATOM 0 HZ PHE A 240 7.230 -3.665 14.195 1.00 71.43 H new ATOM 1055 N PRO A 241 0.614 -2.898 14.602 1.00 2.42 N ATOM 1056 CA PRO A 241 -0.403 -3.358 15.594 1.00 50.34 C ATOM 1057 C PRO A 241 -0.780 -2.299 16.664 1.00 5.32 C ATOM 1058 O PRO A 241 0.085 -1.554 17.133 1.00 25.11 O ATOM 1059 CB PRO A 241 0.262 -4.602 16.234 1.00 34.34 C ATOM 1060 CG PRO A 241 1.128 -5.160 15.148 1.00 61.52 C ATOM 1061 CD PRO A 241 1.648 -3.962 14.373 1.00 32.33 C ATOM 0 HA PRO A 241 -1.358 -3.564 15.111 1.00 50.34 H new ATOM 0 HB2 PRO A 241 0.849 -4.332 17.111 1.00 34.34 H new ATOM 0 HB3 PRO A 241 -0.483 -5.327 16.560 1.00 34.34 H new ATOM 0 HG2 PRO A 241 1.950 -5.742 15.564 1.00 61.52 H new ATOM 0 HG3 PRO A 241 0.560 -5.828 14.500 1.00 61.52 H new ATOM 0 HD2 PRO A 241 2.628 -3.649 14.734 1.00 32.33 H new ATOM 0 HD3 PRO A 241 1.757 -4.190 13.313 1.00 32.33 H new ATOM 1069 N GLY A 242 -2.082 -2.236 17.015 1.00 5.02 N ATOM 1070 CA GLY A 242 -2.601 -1.279 17.998 1.00 61.15 C ATOM 1071 C GLY A 242 -3.922 -1.765 18.612 1.00 61.13 C ATOM 1072 O GLY A 242 -4.823 -2.142 17.852 1.00 50.33 O ATOM 0 H GLY A 242 -2.797 -2.849 16.622 1.00 5.02 H new ATOM 0 HA2 GLY A 242 -1.864 -1.131 18.787 1.00 61.15 H new ATOM 0 HA3 GLY A 242 -2.755 -0.312 17.520 1.00 61.15 H new ATOM 1076 N PRO A 243 -4.066 -1.785 19.982 1.00 63.12 N ATOM 1077 CA PRO A 243 -5.300 -2.274 20.666 1.00 20.44 C ATOM 1078 C PRO A 243 -6.568 -1.447 20.338 1.00 25.23 C ATOM 1079 O PRO A 243 -7.637 -2.019 20.075 1.00 31.21 O ATOM 1080 CB PRO A 243 -4.942 -2.188 22.178 1.00 75.44 C ATOM 1081 CG PRO A 243 -3.800 -1.214 22.255 1.00 41.12 C ATOM 1082 CD PRO A 243 -3.023 -1.392 20.969 1.00 73.42 C ATOM 0 HA PRO A 243 -5.561 -3.279 20.335 1.00 20.44 H new ATOM 0 HB2 PRO A 243 -5.793 -1.845 22.766 1.00 75.44 H new ATOM 0 HB3 PRO A 243 -4.656 -3.163 22.571 1.00 75.44 H new ATOM 0 HG2 PRO A 243 -4.164 -0.191 22.354 1.00 41.12 H new ATOM 0 HG3 PRO A 243 -3.172 -1.415 23.123 1.00 41.12 H new ATOM 0 HD2 PRO A 243 -2.519 -0.472 20.675 1.00 73.42 H new ATOM 0 HD3 PRO A 243 -2.255 -2.159 21.067 1.00 73.42 H new ATOM 1090 N ALA A 244 -6.446 -0.110 20.372 1.00 12.32 N ATOM 1091 CA ALA A 244 -7.558 0.808 20.034 1.00 2.11 C ATOM 1092 C ALA A 244 -7.728 0.907 18.513 1.00 22.15 C ATOM 1093 O ALA A 244 -8.836 1.134 18.005 1.00 4.43 O ATOM 1094 CB ALA A 244 -7.305 2.197 20.639 1.00 2.34 C ATOM 0 H ALA A 244 -5.583 0.367 20.632 1.00 12.32 H new ATOM 0 HA ALA A 244 -8.480 0.408 20.457 1.00 2.11 H new ATOM 0 HB1 ALA A 244 -8.130 2.861 20.383 1.00 2.34 H new ATOM 0 HB2 ALA A 244 -7.230 2.113 21.723 1.00 2.34 H new ATOM 0 HB3 ALA A 244 -6.375 2.603 20.241 1.00 2.34 H new ATOM 1100 N GLY A 245 -6.616 0.703 17.804 1.00 32.24 N ATOM 1101 CA GLY A 245 -6.592 0.693 16.346 1.00 75.02 C ATOM 1102 C GLY A 245 -5.162 0.695 15.828 1.00 72.34 C ATOM 1103 O GLY A 245 -4.276 1.292 16.455 1.00 70.31 O ATOM 0 H GLY A 245 -5.704 0.540 18.230 1.00 32.24 H new ATOM 0 HA2 GLY A 245 -7.116 -0.188 15.975 1.00 75.02 H new ATOM 0 HA3 GLY A 245 -7.123 1.565 15.963 1.00 75.02 H new ATOM 1107 N ARG A 246 -4.924 0.018 14.694 1.00 23.40 N ATOM 1108 CA ARG A 246 -3.603 -0.032 14.044 1.00 1.40 C ATOM 1109 C ARG A 246 -3.238 1.341 13.448 1.00 75.34 C ATOM 1110 O ARG A 246 -4.126 2.146 13.137 1.00 42.35 O ATOM 1111 CB ARG A 246 -3.590 -1.136 12.938 1.00 14.24 C ATOM 1112 CG ARG A 246 -3.166 -2.537 13.418 1.00 51.24 C ATOM 1113 CD ARG A 246 -3.073 -3.559 12.264 1.00 3.43 C ATOM 1114 NE ARG A 246 -2.354 -4.790 12.645 1.00 61.14 N ATOM 1115 CZ ARG A 246 -1.250 -5.255 12.033 1.00 34.30 C ATOM 1116 NH1 ARG A 246 -0.716 -4.612 11.003 1.00 33.21 N ATOM 1117 NH2 ARG A 246 -0.666 -6.341 12.478 1.00 64.14 N ATOM 0 H ARG A 246 -5.643 -0.511 14.200 1.00 23.40 H new ATOM 0 HA ARG A 246 -2.854 -0.283 14.795 1.00 1.40 H new ATOM 0 HB2 ARG A 246 -4.587 -1.204 12.503 1.00 14.24 H new ATOM 0 HB3 ARG A 246 -2.915 -0.822 12.141 1.00 14.24 H new ATOM 0 HG2 ARG A 246 -2.199 -2.469 13.916 1.00 51.24 H new ATOM 0 HG3 ARG A 246 -3.881 -2.895 14.158 1.00 51.24 H new ATOM 0 HD2 ARG A 246 -4.079 -3.819 11.933 1.00 3.43 H new ATOM 0 HD3 ARG A 246 -2.568 -3.097 11.416 1.00 3.43 H new ATOM 0 HE ARG A 246 -2.721 -5.328 13.430 1.00 61.14 H new ATOM 0 HH11 ARG A 246 -1.143 -3.750 10.663 1.00 33.21 H new ATOM 0 HH12 ARG A 246 0.121 -4.979 10.551 1.00 33.21 H new ATOM 0 HH21 ARG A 246 -1.049 -6.831 13.286 1.00 64.14 H new ATOM 0 HH22 ARG A 246 0.171 -6.696 12.016 1.00 64.14 H new ATOM 1131 N GLY A 247 -1.923 1.584 13.282 1.00 65.11 N ATOM 1132 CA GLY A 247 -1.420 2.832 12.703 1.00 11.35 C ATOM 1133 C GLY A 247 -1.649 2.932 11.197 1.00 1.42 C ATOM 1134 O GLY A 247 -2.570 2.306 10.646 1.00 64.02 O ATOM 0 H GLY A 247 -1.191 0.924 13.545 1.00 65.11 H new ATOM 0 HA2 GLY A 247 -1.906 3.675 13.195 1.00 11.35 H new ATOM 0 HA3 GLY A 247 -0.353 2.916 12.908 1.00 11.35 H new ATOM 1138 N ASP A 248 -0.825 3.742 10.535 1.00 20.45 N ATOM 1139 CA ASP A 248 -0.890 3.957 9.076 1.00 34.42 C ATOM 1140 C ASP A 248 0.280 3.258 8.379 1.00 10.01 C ATOM 1141 O ASP A 248 1.347 3.098 8.964 1.00 61.24 O ATOM 1142 CB ASP A 248 -0.861 5.473 8.765 1.00 43.52 C ATOM 1143 CG ASP A 248 -2.008 6.227 9.446 1.00 15.43 C ATOM 1144 OD1 ASP A 248 -1.788 6.884 10.491 1.00 43.32 O ATOM 1145 OD2 ASP A 248 -3.146 6.147 8.955 1.00 33.13 O ATOM 0 H ASP A 248 -0.085 4.275 10.992 1.00 20.45 H new ATOM 0 HA ASP A 248 -1.822 3.532 8.702 1.00 34.42 H new ATOM 0 HB2 ASP A 248 0.091 5.891 9.093 1.00 43.52 H new ATOM 0 HB3 ASP A 248 -0.920 5.622 7.687 1.00 43.52 H new ATOM 1150 N LEU A 249 0.059 2.803 7.148 1.00 30.22 N ATOM 1151 CA LEU A 249 1.138 2.311 6.267 1.00 71.42 C ATOM 1152 C LEU A 249 1.060 3.095 4.955 1.00 33.44 C ATOM 1153 O LEU A 249 0.170 2.882 4.138 1.00 32.21 O ATOM 1154 CB LEU A 249 1.013 0.775 6.045 1.00 74.14 C ATOM 1155 CG LEU A 249 2.014 0.114 5.027 1.00 55.44 C ATOM 1156 CD1 LEU A 249 3.482 0.349 5.414 1.00 20.33 C ATOM 1157 CD2 LEU A 249 1.713 -1.390 4.875 1.00 23.52 C ATOM 0 H LEU A 249 -0.868 2.761 6.725 1.00 30.22 H new ATOM 0 HA LEU A 249 2.114 2.471 6.724 1.00 71.42 H new ATOM 0 HB2 LEU A 249 1.137 0.283 7.010 1.00 74.14 H new ATOM 0 HB3 LEU A 249 -0.002 0.563 5.707 1.00 74.14 H new ATOM 0 HG LEU A 249 1.865 0.599 4.062 1.00 55.44 H new ATOM 0 HD11 LEU A 249 4.132 -0.127 4.680 1.00 20.33 H new ATOM 0 HD12 LEU A 249 3.685 1.420 5.438 1.00 20.33 H new ATOM 0 HD13 LEU A 249 3.672 -0.079 6.398 1.00 20.33 H new ATOM 0 HD21 LEU A 249 2.415 -1.832 4.167 1.00 23.52 H new ATOM 0 HD22 LEU A 249 1.816 -1.881 5.843 1.00 23.52 H new ATOM 0 HD23 LEU A 249 0.695 -1.522 4.507 1.00 23.52 H new ATOM 1169 N TYR A 250 1.990 4.026 4.782 1.00 42.31 N ATOM 1170 CA TYR A 250 2.012 4.948 3.647 1.00 73.11 C ATOM 1171 C TYR A 250 2.963 4.411 2.568 1.00 44.31 C ATOM 1172 O TYR A 250 4.184 4.386 2.763 1.00 43.44 O ATOM 1173 CB TYR A 250 2.428 6.360 4.130 1.00 65.14 C ATOM 1174 CG TYR A 250 2.230 7.476 3.087 1.00 71.52 C ATOM 1175 CD1 TYR A 250 0.959 8.007 2.847 1.00 52.15 C ATOM 1176 CD2 TYR A 250 3.300 7.998 2.351 1.00 51.32 C ATOM 1177 CE1 TYR A 250 0.765 9.005 1.917 1.00 33.45 C ATOM 1178 CE2 TYR A 250 3.107 9.000 1.417 1.00 34.44 C ATOM 1179 CZ TYR A 250 1.843 9.499 1.204 1.00 3.41 C ATOM 1180 OH TYR A 250 1.653 10.504 0.281 1.00 71.10 O ATOM 0 H TYR A 250 2.762 4.166 5.434 1.00 42.31 H new ATOM 0 HA TYR A 250 1.017 5.026 3.208 1.00 73.11 H new ATOM 0 HB2 TYR A 250 1.854 6.608 5.023 1.00 65.14 H new ATOM 0 HB3 TYR A 250 3.478 6.335 4.422 1.00 65.14 H new ATOM 0 HD1 TYR A 250 0.113 7.628 3.401 1.00 52.15 H new ATOM 0 HD2 TYR A 250 4.295 7.611 2.515 1.00 51.32 H new ATOM 0 HE1 TYR A 250 -0.225 9.400 1.745 1.00 33.45 H new ATOM 0 HE2 TYR A 250 3.945 9.389 0.858 1.00 34.44 H new ATOM 0 HH TYR A 250 2.511 10.737 -0.131 1.00 71.10 H new ATOM 1190 N LEU A 251 2.386 3.950 1.451 1.00 52.23 N ATOM 1191 CA LEU A 251 3.123 3.365 0.325 1.00 71.22 C ATOM 1192 C LEU A 251 3.013 4.282 -0.907 1.00 64.31 C ATOM 1193 O LEU A 251 1.910 4.523 -1.416 1.00 43.14 O ATOM 1194 CB LEU A 251 2.577 1.945 0.024 1.00 4.04 C ATOM 1195 CG LEU A 251 2.947 0.855 1.077 1.00 62.54 C ATOM 1196 CD1 LEU A 251 2.288 -0.484 0.742 1.00 23.24 C ATOM 1197 CD2 LEU A 251 4.476 0.690 1.208 1.00 11.30 C ATOM 0 H LEU A 251 1.377 3.974 1.302 1.00 52.23 H new ATOM 0 HA LEU A 251 4.178 3.275 0.584 1.00 71.22 H new ATOM 0 HB2 LEU A 251 1.491 1.999 -0.053 1.00 4.04 H new ATOM 0 HB3 LEU A 251 2.950 1.628 -0.950 1.00 4.04 H new ATOM 0 HG LEU A 251 2.563 1.193 2.040 1.00 62.54 H new ATOM 0 HD11 LEU A 251 2.564 -1.224 1.493 1.00 23.24 H new ATOM 0 HD12 LEU A 251 1.205 -0.364 0.732 1.00 23.24 H new ATOM 0 HD13 LEU A 251 2.625 -0.820 -0.239 1.00 23.24 H new ATOM 0 HD21 LEU A 251 4.697 -0.077 1.950 1.00 11.30 H new ATOM 0 HD22 LEU A 251 4.894 0.395 0.245 1.00 11.30 H new ATOM 0 HD23 LEU A 251 4.918 1.636 1.521 1.00 11.30 H new ATOM 1209 N GLU A 252 4.167 4.815 -1.348 1.00 15.22 N ATOM 1210 CA GLU A 252 4.268 5.668 -2.550 1.00 50.32 C ATOM 1211 C GLU A 252 4.452 4.794 -3.810 1.00 60.01 C ATOM 1212 O GLU A 252 5.485 4.127 -3.964 1.00 34.35 O ATOM 1213 CB GLU A 252 5.452 6.661 -2.404 1.00 22.14 C ATOM 1214 CG GLU A 252 5.327 7.622 -1.199 1.00 33.43 C ATOM 1215 CD GLU A 252 6.499 8.611 -1.092 1.00 12.25 C ATOM 1216 OE1 GLU A 252 6.451 9.678 -1.740 1.00 45.42 O ATOM 1217 OE2 GLU A 252 7.479 8.318 -0.381 1.00 73.34 O ATOM 0 H GLU A 252 5.061 4.666 -0.880 1.00 15.22 H new ATOM 0 HA GLU A 252 3.345 6.239 -2.654 1.00 50.32 H new ATOM 0 HB2 GLU A 252 6.378 6.094 -2.308 1.00 22.14 H new ATOM 0 HB3 GLU A 252 5.533 7.250 -3.318 1.00 22.14 H new ATOM 0 HG2 GLU A 252 4.395 8.180 -1.283 1.00 33.43 H new ATOM 0 HG3 GLU A 252 5.267 7.038 -0.281 1.00 33.43 H new ATOM 1224 N VAL A 253 3.443 4.805 -4.697 1.00 43.02 N ATOM 1225 CA VAL A 253 3.420 3.987 -5.923 1.00 33.02 C ATOM 1226 C VAL A 253 4.530 4.403 -6.932 1.00 11.03 C ATOM 1227 O VAL A 253 4.630 5.566 -7.340 1.00 23.23 O ATOM 1228 CB VAL A 253 2.021 4.057 -6.642 1.00 60.23 C ATOM 1229 CG1 VAL A 253 2.034 3.273 -7.979 1.00 62.32 C ATOM 1230 CG2 VAL A 253 0.891 3.548 -5.712 1.00 62.10 C ATOM 0 H VAL A 253 2.613 5.387 -4.583 1.00 43.02 H new ATOM 0 HA VAL A 253 3.609 2.963 -5.600 1.00 33.02 H new ATOM 0 HB VAL A 253 1.821 5.103 -6.873 1.00 60.23 H new ATOM 0 HG11 VAL A 253 1.053 3.341 -8.450 1.00 62.32 H new ATOM 0 HG12 VAL A 253 2.786 3.699 -8.643 1.00 62.32 H new ATOM 0 HG13 VAL A 253 2.272 2.227 -7.785 1.00 62.32 H new ATOM 0 HG21 VAL A 253 -0.064 3.607 -6.234 1.00 62.10 H new ATOM 0 HG22 VAL A 253 1.088 2.513 -5.433 1.00 62.10 H new ATOM 0 HG23 VAL A 253 0.853 4.165 -4.814 1.00 62.10 H new ATOM 1240 N ARG A 254 5.341 3.406 -7.315 1.00 53.24 N ATOM 1241 CA ARG A 254 6.329 3.481 -8.399 1.00 3.40 C ATOM 1242 C ARG A 254 5.942 2.450 -9.460 1.00 74.15 C ATOM 1243 O ARG A 254 6.067 1.246 -9.213 1.00 64.04 O ATOM 1244 CB ARG A 254 7.751 3.153 -7.853 1.00 74.25 C ATOM 1245 CG ARG A 254 8.355 4.216 -6.924 1.00 24.32 C ATOM 1246 CD ARG A 254 8.651 5.535 -7.642 1.00 2.12 C ATOM 1247 NE ARG A 254 9.685 5.366 -8.679 1.00 0.44 N ATOM 1248 CZ ARG A 254 9.771 6.065 -9.823 1.00 64.01 C ATOM 1249 NH1 ARG A 254 8.870 7.003 -10.125 1.00 52.21 N ATOM 1250 NH2 ARG A 254 10.761 5.810 -10.666 1.00 43.41 N ATOM 0 H ARG A 254 5.326 2.493 -6.861 1.00 53.24 H new ATOM 0 HA ARG A 254 6.343 4.485 -8.823 1.00 3.40 H new ATOM 0 HB2 ARG A 254 7.707 2.206 -7.315 1.00 74.25 H new ATOM 0 HB3 ARG A 254 8.423 3.008 -8.699 1.00 74.25 H new ATOM 0 HG2 ARG A 254 7.668 4.403 -6.099 1.00 24.32 H new ATOM 0 HG3 ARG A 254 9.277 3.830 -6.489 1.00 24.32 H new ATOM 0 HD2 ARG A 254 7.737 5.916 -8.097 1.00 2.12 H new ATOM 0 HD3 ARG A 254 8.980 6.279 -6.917 1.00 2.12 H new ATOM 0 HE ARG A 254 10.398 4.656 -8.513 1.00 0.44 H new ATOM 0 HH11 ARG A 254 8.102 7.198 -9.483 1.00 52.21 H new ATOM 0 HH12 ARG A 254 8.950 7.525 -10.998 1.00 52.21 H new ATOM 0 HH21 ARG A 254 11.448 5.089 -10.443 1.00 43.41 H new ATOM 0 HH22 ARG A 254 10.836 6.334 -11.538 1.00 43.41 H new ATOM 1264 N ILE A 255 5.447 2.913 -10.623 1.00 55.22 N ATOM 1265 CA ILE A 255 5.100 2.005 -11.726 1.00 32.22 C ATOM 1266 C ILE A 255 6.381 1.545 -12.441 1.00 2.25 C ATOM 1267 O ILE A 255 7.149 2.372 -12.950 1.00 70.32 O ATOM 1268 CB ILE A 255 4.082 2.636 -12.747 1.00 12.14 C ATOM 1269 CG1 ILE A 255 2.702 2.848 -12.050 1.00 61.45 C ATOM 1270 CG2 ILE A 255 3.932 1.770 -14.031 1.00 45.41 C ATOM 1271 CD1 ILE A 255 1.602 3.333 -12.965 1.00 31.51 C ATOM 0 H ILE A 255 5.281 3.900 -10.820 1.00 55.22 H new ATOM 0 HA ILE A 255 4.594 1.143 -11.291 1.00 32.22 H new ATOM 0 HB ILE A 255 4.475 3.602 -13.065 1.00 12.14 H new ATOM 0 HG12 ILE A 255 2.391 1.907 -11.597 1.00 61.45 H new ATOM 0 HG13 ILE A 255 2.826 3.567 -11.240 1.00 61.45 H new ATOM 0 HG21 ILE A 255 3.220 2.243 -14.708 1.00 45.41 H new ATOM 0 HG22 ILE A 255 4.899 1.682 -14.526 1.00 45.41 H new ATOM 0 HG23 ILE A 255 3.571 0.778 -13.760 1.00 45.41 H new ATOM 0 HD11 ILE A 255 0.681 3.452 -12.395 1.00 31.51 H new ATOM 0 HD12 ILE A 255 1.886 4.291 -13.400 1.00 31.51 H new ATOM 0 HD13 ILE A 255 1.444 2.606 -13.762 1.00 31.51 H new ATOM 1283 N THR A 256 6.606 0.226 -12.423 1.00 42.44 N ATOM 1284 CA THR A 256 7.750 -0.427 -13.060 1.00 72.35 C ATOM 1285 C THR A 256 7.301 -1.006 -14.427 1.00 74.12 C ATOM 1286 O THR A 256 6.455 -1.922 -14.446 1.00 31.34 O ATOM 1287 CB THR A 256 8.318 -1.546 -12.111 1.00 53.10 C ATOM 1288 OG1 THR A 256 7.266 -2.434 -11.705 1.00 35.45 O ATOM 1289 CG2 THR A 256 8.965 -0.959 -10.845 1.00 35.12 C ATOM 1290 OXT THR A 256 7.774 -0.531 -15.482 1.00 38.20 O ATOM 0 H THR A 256 5.982 -0.430 -11.954 1.00 42.44 H new ATOM 0 HA THR A 256 8.550 0.292 -13.237 1.00 72.35 H new ATOM 0 HB THR A 256 9.079 -2.082 -12.679 1.00 53.10 H new ATOM 0 HG1 THR A 256 7.632 -3.127 -11.116 1.00 35.45 H new ATOM 0 HG21 THR A 256 9.343 -1.769 -10.221 1.00 35.12 H new ATOM 0 HG22 THR A 256 9.789 -0.304 -11.128 1.00 35.12 H new ATOM 0 HG23 THR A 256 8.222 -0.388 -10.288 1.00 35.12 H new