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 31:sc= 1.15 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 GLN : amide:sc= -0.0605 X(o=-0.061,f=-0.4) USER MOD Single : A 194 TYR OH : rot 180:sc= 0 USER MOD Single : A 196 THR OG1 : rot 180:sc= 0.00793 USER MOD Single : A 209 LYS NZ :NH3+ -166:sc= 0.186 (180deg=0.0359) USER MOD Single : A 213 MET CE :methyl 145:sc= -0.112 (180deg=-1.82!) USER MOD Single : A 214 THR OG1 : rot -35:sc= 0.826 USER MOD Single : A 227 THR OG1 : rot 85:sc= 0.253 USER MOD Single : A 228 GLN : amide:sc= -0.0554 K(o=-0.055,f=-6.9!) USER MOD Single : A 232 LYS NZ :NH3+ 178:sc= 0.384 (180deg=0.369) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ -140:sc= 0.828 (180deg=0.103) USER MOD Single : A 250 TYR OH : rot 180:sc= 0 USER MOD Single : A 256 THR OG1 : rot 180:sc= -0.0817 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 169 -6.563 13.070 2.065 1.00 35.14 N ATOM 33 CA ASP A 169 -5.565 13.470 1.044 1.00 35.12 C ATOM 34 C ASP A 169 -5.379 12.423 -0.075 1.00 73.01 C ATOM 35 O ASP A 169 -5.481 12.745 -1.264 1.00 73.21 O ATOM 36 CB ASP A 169 -4.214 13.731 1.759 1.00 1.43 C ATOM 37 CG ASP A 169 -3.053 14.078 0.808 1.00 60.45 C ATOM 38 OD1 ASP A 169 -3.120 15.121 0.115 1.00 22.03 O ATOM 39 OD2 ASP A 169 -2.054 13.319 0.768 1.00 10.12 O ATOM 0 HA ASP A 169 -5.933 14.371 0.553 1.00 35.12 H new ATOM 0 HB2 ASP A 169 -4.343 14.548 2.469 1.00 1.43 H new ATOM 0 HB3 ASP A 169 -3.944 12.846 2.336 1.00 1.43 H new ATOM 44 N VAL A 170 -5.106 11.183 0.331 1.00 21.21 N ATOM 45 CA VAL A 170 -4.800 10.073 -0.590 1.00 21.43 C ATOM 46 C VAL A 170 -6.097 9.323 -0.993 1.00 73.13 C ATOM 47 O VAL A 170 -7.200 9.749 -0.641 1.00 1.35 O ATOM 48 CB VAL A 170 -3.798 9.077 0.098 1.00 10.32 C ATOM 49 CG1 VAL A 170 -2.549 9.814 0.626 1.00 52.11 C ATOM 50 CG2 VAL A 170 -4.475 8.282 1.230 1.00 23.35 C ATOM 0 H VAL A 170 -5.089 10.912 1.314 1.00 21.21 H new ATOM 0 HA VAL A 170 -4.344 10.482 -1.492 1.00 21.43 H new ATOM 0 HB VAL A 170 -3.478 8.367 -0.665 1.00 10.32 H new ATOM 0 HG11 VAL A 170 -1.875 9.098 1.096 1.00 52.11 H new ATOM 0 HG12 VAL A 170 -2.037 10.303 -0.203 1.00 52.11 H new ATOM 0 HG13 VAL A 170 -2.851 10.563 1.358 1.00 52.11 H new ATOM 0 HG21 VAL A 170 -3.751 7.604 1.682 1.00 23.35 H new ATOM 0 HG22 VAL A 170 -4.847 8.972 1.987 1.00 23.35 H new ATOM 0 HG23 VAL A 170 -5.307 7.706 0.823 1.00 23.35 H new ATOM 60 N ILE A 171 -5.952 8.213 -1.751 1.00 23.21 N ATOM 61 CA ILE A 171 -7.045 7.236 -1.956 1.00 34.11 C ATOM 62 C ILE A 171 -6.897 6.109 -0.896 1.00 32.02 C ATOM 63 O ILE A 171 -5.779 5.649 -0.605 1.00 71.53 O ATOM 64 CB ILE A 171 -7.061 6.642 -3.424 1.00 14.25 C ATOM 65 CG1 ILE A 171 -8.259 5.651 -3.632 1.00 52.22 C ATOM 66 CG2 ILE A 171 -5.716 5.975 -3.766 1.00 63.12 C ATOM 67 CD1 ILE A 171 -8.341 5.023 -5.019 1.00 2.02 C ATOM 0 H ILE A 171 -5.086 7.971 -2.232 1.00 23.21 H new ATOM 0 HA ILE A 171 -8.000 7.747 -1.833 1.00 34.11 H new ATOM 0 HB ILE A 171 -7.205 7.474 -4.114 1.00 14.25 H new ATOM 0 HG12 ILE A 171 -8.184 4.854 -2.892 1.00 52.22 H new ATOM 0 HG13 ILE A 171 -9.190 6.183 -3.435 1.00 52.22 H new ATOM 0 HG21 ILE A 171 -5.755 5.576 -4.780 1.00 63.12 H new ATOM 0 HG22 ILE A 171 -4.916 6.712 -3.697 1.00 63.12 H new ATOM 0 HG23 ILE A 171 -5.523 5.164 -3.064 1.00 63.12 H new ATOM 0 HD11 ILE A 171 -9.200 4.354 -5.065 1.00 2.02 H new ATOM 0 HD12 ILE A 171 -8.451 5.808 -5.768 1.00 2.02 H new ATOM 0 HD13 ILE A 171 -7.430 4.458 -5.217 1.00 2.02 H new ATOM 79 N ASP A 172 -8.033 5.702 -0.314 1.00 12.15 N ATOM 80 CA ASP A 172 -8.103 4.712 0.777 1.00 4.01 C ATOM 81 C ASP A 172 -7.864 3.293 0.219 1.00 11.24 C ATOM 82 O ASP A 172 -8.667 2.788 -0.573 1.00 44.10 O ATOM 83 CB ASP A 172 -9.493 4.829 1.456 1.00 52.54 C ATOM 84 CG ASP A 172 -9.713 3.856 2.626 1.00 32.44 C ATOM 85 OD1 ASP A 172 -9.239 4.136 3.740 1.00 23.42 O ATOM 86 OD2 ASP A 172 -10.370 2.810 2.443 1.00 33.41 O ATOM 0 H ASP A 172 -8.948 6.057 -0.591 1.00 12.15 H new ATOM 0 HA ASP A 172 -7.328 4.905 1.519 1.00 4.01 H new ATOM 0 HB2 ASP A 172 -9.622 5.849 1.819 1.00 52.54 H new ATOM 0 HB3 ASP A 172 -10.265 4.657 0.706 1.00 52.54 H new ATOM 91 N ALA A 173 -6.738 2.672 0.613 1.00 25.41 N ATOM 92 CA ALA A 173 -6.346 1.319 0.150 1.00 25.30 C ATOM 93 C ALA A 173 -6.423 0.305 1.305 1.00 10.30 C ATOM 94 O ALA A 173 -6.732 0.665 2.447 1.00 51.24 O ATOM 95 CB ALA A 173 -4.930 1.350 -0.464 1.00 70.42 C ATOM 0 H ALA A 173 -6.071 3.090 1.261 1.00 25.41 H new ATOM 0 HA ALA A 173 -7.046 1.001 -0.622 1.00 25.30 H new ATOM 0 HB1 ALA A 173 -4.657 0.349 -0.799 1.00 70.42 H new ATOM 0 HB2 ALA A 173 -4.916 2.033 -1.313 1.00 70.42 H new ATOM 0 HB3 ALA A 173 -4.216 1.689 0.286 1.00 70.42 H new ATOM 101 N ASP A 174 -6.107 -0.960 0.982 1.00 41.14 N ATOM 102 CA ASP A 174 -6.079 -2.092 1.941 1.00 50.31 C ATOM 103 C ASP A 174 -4.972 -3.083 1.533 1.00 51.15 C ATOM 104 O ASP A 174 -4.568 -3.105 0.367 1.00 53.42 O ATOM 105 CB ASP A 174 -7.461 -2.805 1.967 1.00 3.51 C ATOM 106 CG ASP A 174 -7.516 -4.066 2.866 1.00 20.14 C ATOM 107 OD1 ASP A 174 -7.454 -3.930 4.105 1.00 72.43 O ATOM 108 OD2 ASP A 174 -7.640 -5.190 2.333 1.00 0.50 O ATOM 0 H ASP A 174 -5.858 -1.236 0.032 1.00 41.14 H new ATOM 0 HA ASP A 174 -5.868 -1.713 2.941 1.00 50.31 H new ATOM 0 HB2 ASP A 174 -8.215 -2.096 2.310 1.00 3.51 H new ATOM 0 HB3 ASP A 174 -7.729 -3.088 0.949 1.00 3.51 H new ATOM 113 N TYR A 175 -4.475 -3.880 2.500 1.00 73.52 N ATOM 114 CA TYR A 175 -3.594 -5.024 2.215 1.00 63.35 C ATOM 115 C TYR A 175 -4.103 -6.274 2.944 1.00 42.13 C ATOM 116 O TYR A 175 -5.009 -6.199 3.787 1.00 31.33 O ATOM 117 CB TYR A 175 -2.092 -4.716 2.555 1.00 74.03 C ATOM 118 CG TYR A 175 -1.659 -4.720 4.044 1.00 63.42 C ATOM 119 CD1 TYR A 175 -1.289 -3.551 4.711 1.00 20.02 C ATOM 120 CD2 TYR A 175 -1.549 -5.922 4.761 1.00 62.23 C ATOM 121 CE1 TYR A 175 -0.833 -3.596 6.027 1.00 51.42 C ATOM 122 CE2 TYR A 175 -1.118 -5.962 6.064 1.00 71.14 C ATOM 123 CZ TYR A 175 -0.757 -4.808 6.692 1.00 42.30 C ATOM 124 OH TYR A 175 -0.297 -4.873 7.990 1.00 43.23 O ATOM 0 H TYR A 175 -4.673 -3.748 3.492 1.00 73.52 H new ATOM 0 HA TYR A 175 -3.625 -5.216 1.143 1.00 63.35 H new ATOM 0 HB2 TYR A 175 -1.476 -5.444 2.028 1.00 74.03 H new ATOM 0 HB3 TYR A 175 -1.852 -3.736 2.142 1.00 74.03 H new ATOM 0 HD1 TYR A 175 -1.357 -2.601 4.202 1.00 20.02 H new ATOM 0 HD2 TYR A 175 -1.813 -6.847 4.271 1.00 62.23 H new ATOM 0 HE1 TYR A 175 -0.539 -2.686 6.528 1.00 51.42 H new ATOM 0 HE2 TYR A 175 -1.065 -6.904 6.589 1.00 71.14 H new ATOM 0 HH TYR A 175 -0.527 -4.045 8.461 1.00 43.23 H new ATOM 134 N LYS A 176 -3.476 -7.416 2.627 1.00 22.02 N ATOM 135 CA LYS A 176 -3.729 -8.718 3.274 1.00 4.32 C ATOM 136 C LYS A 176 -2.372 -9.372 3.589 1.00 41.52 C ATOM 137 O LYS A 176 -1.456 -9.264 2.787 1.00 40.22 O ATOM 138 CB LYS A 176 -4.568 -9.665 2.366 1.00 31.12 C ATOM 139 CG LYS A 176 -5.990 -9.172 2.029 1.00 15.11 C ATOM 140 CD LYS A 176 -6.913 -9.126 3.268 1.00 11.22 C ATOM 141 CE LYS A 176 -8.330 -8.634 2.928 1.00 15.11 C ATOM 142 NZ LYS A 176 -9.197 -8.551 4.136 1.00 52.54 N ATOM 0 H LYS A 176 -2.763 -7.465 1.899 1.00 22.02 H new ATOM 0 HA LYS A 176 -4.303 -8.550 4.185 1.00 4.32 H new ATOM 0 HB2 LYS A 176 -4.026 -9.821 1.433 1.00 31.12 H new ATOM 0 HB3 LYS A 176 -4.645 -10.636 2.856 1.00 31.12 H new ATOM 0 HG2 LYS A 176 -5.930 -8.177 1.588 1.00 15.11 H new ATOM 0 HG3 LYS A 176 -6.429 -9.828 1.278 1.00 15.11 H new ATOM 0 HD2 LYS A 176 -6.973 -10.121 3.709 1.00 11.22 H new ATOM 0 HD3 LYS A 176 -6.474 -8.470 4.020 1.00 11.22 H new ATOM 0 HE2 LYS A 176 -8.270 -7.653 2.457 1.00 15.11 H new ATOM 0 HE3 LYS A 176 -8.784 -9.309 2.202 1.00 15.11 H new ATOM 0 HZ1 LYS A 176 -10.143 -8.215 3.862 1.00 52.54 H new ATOM 0 HZ2 LYS A 176 -9.276 -9.492 4.572 1.00 52.54 H new ATOM 0 HZ3 LYS A 176 -8.778 -7.887 4.819 1.00 52.54 H new ATOM 156 N PRO A 177 -2.222 -10.049 4.763 1.00 43.22 N ATOM 157 CA PRO A 177 -0.988 -10.799 5.106 1.00 61.41 C ATOM 158 C PRO A 177 -0.765 -11.980 4.128 1.00 74.22 C ATOM 159 O PRO A 177 -1.498 -12.977 4.179 1.00 51.25 O ATOM 160 CB PRO A 177 -1.250 -11.284 6.564 1.00 14.21 C ATOM 161 CG PRO A 177 -2.404 -10.458 7.062 1.00 3.43 C ATOM 162 CD PRO A 177 -3.236 -10.146 5.841 1.00 20.15 C ATOM 0 HA PRO A 177 -0.082 -10.198 5.029 1.00 61.41 H new ATOM 0 HB2 PRO A 177 -1.490 -12.347 6.587 1.00 14.21 H new ATOM 0 HB3 PRO A 177 -0.368 -11.143 7.189 1.00 14.21 H new ATOM 0 HG2 PRO A 177 -2.986 -11.005 7.804 1.00 3.43 H new ATOM 0 HG3 PRO A 177 -2.054 -9.544 7.542 1.00 3.43 H new ATOM 0 HD2 PRO A 177 -3.966 -10.930 5.639 1.00 20.15 H new ATOM 0 HD3 PRO A 177 -3.791 -9.215 5.958 1.00 20.15 H new ATOM 170 N ALA A 178 0.219 -11.827 3.213 1.00 13.13 N ATOM 171 CA ALA A 178 0.506 -12.817 2.143 1.00 22.20 C ATOM 172 C ALA A 178 0.966 -14.167 2.721 1.00 32.11 C ATOM 173 O ALA A 178 0.628 -15.233 2.190 1.00 12.40 O ATOM 174 CB ALA A 178 1.554 -12.264 1.161 1.00 30.33 C ATOM 0 H ALA A 178 0.837 -11.016 3.193 1.00 13.13 H new ATOM 0 HA ALA A 178 -0.424 -12.992 1.602 1.00 22.20 H new ATOM 0 HB1 ALA A 178 1.751 -13.003 0.385 1.00 30.33 H new ATOM 0 HB2 ALA A 178 1.177 -11.349 0.704 1.00 30.33 H new ATOM 0 HB3 ALA A 178 2.477 -12.047 1.698 1.00 30.33 H new ATOM 285 N GLN A 191 3.577 4.304 15.150 1.00 20.53 N ATOM 286 CA GLN A 191 2.381 3.786 14.455 1.00 11.03 C ATOM 287 C GLN A 191 2.578 3.869 12.931 1.00 13.24 C ATOM 288 O GLN A 191 1.955 3.122 12.161 1.00 12.22 O ATOM 289 CB GLN A 191 1.106 4.550 14.908 1.00 33.53 C ATOM 290 CG GLN A 191 0.564 4.121 16.286 1.00 0.13 C ATOM 291 CD GLN A 191 0.201 2.629 16.341 1.00 35.03 C ATOM 292 OE1 GLN A 191 -0.925 2.237 16.023 1.00 51.42 O ATOM 293 NE2 GLN A 191 1.137 1.786 16.758 1.00 51.23 N ATOM 0 HA GLN A 191 2.244 2.738 14.722 1.00 11.03 H new ATOM 0 HB2 GLN A 191 1.326 5.617 14.934 1.00 33.53 H new ATOM 0 HB3 GLN A 191 0.325 4.404 14.162 1.00 33.53 H new ATOM 0 HG2 GLN A 191 1.311 4.337 17.049 1.00 0.13 H new ATOM 0 HG3 GLN A 191 -0.318 4.715 16.526 1.00 0.13 H new ATOM 0 HE21 GLN A 191 2.060 2.135 17.015 1.00 51.23 H new ATOM 0 HE22 GLN A 191 0.933 0.789 16.821 1.00 51.23 H new ATOM 302 N ASP A 192 3.501 4.741 12.524 1.00 72.22 N ATOM 303 CA ASP A 192 3.714 5.117 11.121 1.00 73.23 C ATOM 304 C ASP A 192 4.739 4.166 10.472 1.00 74.23 C ATOM 305 O ASP A 192 5.654 3.675 11.146 1.00 55.14 O ATOM 306 CB ASP A 192 4.224 6.596 11.037 1.00 25.45 C ATOM 307 CG ASP A 192 3.634 7.503 12.141 1.00 21.21 C ATOM 308 OD1 ASP A 192 4.163 7.472 13.281 1.00 43.21 O ATOM 309 OD2 ASP A 192 2.652 8.223 11.891 1.00 35.35 O ATOM 0 H ASP A 192 4.133 5.215 13.169 1.00 72.22 H new ATOM 0 HA ASP A 192 2.769 5.038 10.583 1.00 73.23 H new ATOM 0 HB2 ASP A 192 5.311 6.604 11.111 1.00 25.45 H new ATOM 0 HB3 ASP A 192 3.968 7.008 10.061 1.00 25.45 H new ATOM 314 N LEU A 193 4.557 3.902 9.175 1.00 53.11 N ATOM 315 CA LEU A 193 5.562 3.258 8.307 1.00 41.00 C ATOM 316 C LEU A 193 5.513 3.953 6.948 1.00 70.41 C ATOM 317 O LEU A 193 4.436 4.157 6.399 1.00 44.44 O ATOM 318 CB LEU A 193 5.344 1.712 8.143 1.00 33.42 C ATOM 319 CG LEU A 193 5.991 0.801 9.230 1.00 1.45 C ATOM 320 CD1 LEU A 193 5.714 -0.693 8.948 1.00 50.11 C ATOM 321 CD2 LEU A 193 7.510 1.075 9.349 1.00 2.42 C ATOM 0 H LEU A 193 3.693 4.132 8.684 1.00 53.11 H new ATOM 0 HA LEU A 193 6.541 3.365 8.774 1.00 41.00 H new ATOM 0 HB2 LEU A 193 4.272 1.518 8.129 1.00 33.42 H new ATOM 0 HB3 LEU A 193 5.735 1.413 7.170 1.00 33.42 H new ATOM 0 HG LEU A 193 5.530 1.046 10.187 1.00 1.45 H new ATOM 0 HD11 LEU A 193 6.178 -1.302 9.724 1.00 50.11 H new ATOM 0 HD12 LEU A 193 4.638 -0.869 8.944 1.00 50.11 H new ATOM 0 HD13 LEU A 193 6.130 -0.963 7.977 1.00 50.11 H new ATOM 0 HD21 LEU A 193 7.938 0.427 10.114 1.00 2.42 H new ATOM 0 HD22 LEU A 193 7.992 0.874 8.392 1.00 2.42 H new ATOM 0 HD23 LEU A 193 7.671 2.117 9.625 1.00 2.42 H new ATOM 333 N TYR A 194 6.679 4.336 6.423 1.00 34.13 N ATOM 334 CA TYR A 194 6.793 5.007 5.120 1.00 51.42 C ATOM 335 C TYR A 194 7.663 4.153 4.202 1.00 65.54 C ATOM 336 O TYR A 194 8.767 3.749 4.590 1.00 34.15 O ATOM 337 CB TYR A 194 7.393 6.425 5.280 1.00 30.23 C ATOM 338 CG TYR A 194 6.522 7.376 6.111 1.00 63.11 C ATOM 339 CD1 TYR A 194 6.709 7.518 7.491 1.00 12.21 C ATOM 340 CD2 TYR A 194 5.502 8.121 5.515 1.00 3.32 C ATOM 341 CE1 TYR A 194 5.913 8.364 8.236 1.00 33.02 C ATOM 342 CE2 TYR A 194 4.710 8.968 6.260 1.00 31.10 C ATOM 343 CZ TYR A 194 4.919 9.085 7.617 1.00 5.40 C ATOM 344 OH TYR A 194 4.119 9.925 8.359 1.00 51.23 O ATOM 0 H TYR A 194 7.575 4.190 6.888 1.00 34.13 H new ATOM 0 HA TYR A 194 5.801 5.120 4.682 1.00 51.42 H new ATOM 0 HB2 TYR A 194 8.374 6.344 5.748 1.00 30.23 H new ATOM 0 HB3 TYR A 194 7.546 6.858 4.292 1.00 30.23 H new ATOM 0 HD1 TYR A 194 7.490 6.956 7.981 1.00 12.21 H new ATOM 0 HD2 TYR A 194 5.331 8.032 4.452 1.00 3.32 H new ATOM 0 HE1 TYR A 194 6.070 8.459 9.300 1.00 33.02 H new ATOM 0 HE2 TYR A 194 3.928 9.538 5.781 1.00 31.10 H new ATOM 0 HH TYR A 194 3.468 10.361 7.771 1.00 51.23 H new ATOM 354 N ALA A 195 7.147 3.869 3.003 1.00 1.55 N ATOM 355 CA ALA A 195 7.852 3.096 1.975 1.00 52.21 C ATOM 356 C ALA A 195 7.274 3.411 0.586 1.00 44.11 C ATOM 357 O ALA A 195 6.176 3.967 0.466 1.00 31.05 O ATOM 358 CB ALA A 195 7.757 1.587 2.285 1.00 41.43 C ATOM 0 H ALA A 195 6.217 4.173 2.715 1.00 1.55 H new ATOM 0 HA ALA A 195 8.905 3.378 1.977 1.00 52.21 H new ATOM 0 HB1 ALA A 195 8.284 1.023 1.515 1.00 41.43 H new ATOM 0 HB2 ALA A 195 8.210 1.386 3.256 1.00 41.43 H new ATOM 0 HB3 ALA A 195 6.710 1.285 2.303 1.00 41.43 H new ATOM 364 N THR A 196 8.037 3.081 -0.460 1.00 63.32 N ATOM 365 CA THR A 196 7.559 3.118 -1.847 1.00 34.44 C ATOM 366 C THR A 196 6.999 1.737 -2.221 1.00 51.32 C ATOM 367 O THR A 196 7.460 0.707 -1.702 1.00 43.10 O ATOM 368 CB THR A 196 8.701 3.543 -2.829 1.00 10.23 C ATOM 369 OG1 THR A 196 9.898 2.801 -2.539 1.00 12.03 O ATOM 370 CG2 THR A 196 8.995 5.055 -2.751 1.00 64.41 C ATOM 0 H THR A 196 9.007 2.779 -0.369 1.00 63.32 H new ATOM 0 HA THR A 196 6.769 3.864 -1.932 1.00 34.44 H new ATOM 0 HB THR A 196 8.363 3.321 -3.841 1.00 10.23 H new ATOM 0 HG1 THR A 196 10.608 3.071 -3.158 1.00 12.03 H new ATOM 0 HG21 THR A 196 9.794 5.307 -3.449 1.00 64.41 H new ATOM 0 HG22 THR A 196 8.096 5.614 -3.011 1.00 64.41 H new ATOM 0 HG23 THR A 196 9.303 5.314 -1.738 1.00 64.41 H new ATOM 378 N LEU A 197 6.002 1.733 -3.111 1.00 61.21 N ATOM 379 CA LEU A 197 5.278 0.524 -3.513 1.00 31.51 C ATOM 380 C LEU A 197 5.572 0.216 -4.983 1.00 73.24 C ATOM 381 O LEU A 197 5.200 0.989 -5.868 1.00 74.43 O ATOM 382 CB LEU A 197 3.758 0.713 -3.282 1.00 31.24 C ATOM 383 CG LEU A 197 2.873 -0.540 -3.559 1.00 53.21 C ATOM 384 CD1 LEU A 197 3.321 -1.740 -2.702 1.00 13.11 C ATOM 385 CD2 LEU A 197 1.379 -0.222 -3.351 1.00 75.23 C ATOM 0 H LEU A 197 5.672 2.578 -3.577 1.00 61.21 H new ATOM 0 HA LEU A 197 5.611 -0.318 -2.907 1.00 31.51 H new ATOM 0 HB2 LEU A 197 3.602 1.025 -2.249 1.00 31.24 H new ATOM 0 HB3 LEU A 197 3.411 1.528 -3.917 1.00 31.24 H new ATOM 0 HG LEU A 197 3.006 -0.819 -4.604 1.00 53.21 H new ATOM 0 HD11 LEU A 197 2.685 -2.599 -2.917 1.00 13.11 H new ATOM 0 HD12 LEU A 197 4.356 -1.988 -2.936 1.00 13.11 H new ATOM 0 HD13 LEU A 197 3.239 -1.484 -1.646 1.00 13.11 H new ATOM 0 HD21 LEU A 197 0.786 -1.114 -3.551 1.00 75.23 H new ATOM 0 HD22 LEU A 197 1.215 0.099 -2.322 1.00 75.23 H new ATOM 0 HD23 LEU A 197 1.078 0.574 -4.032 1.00 75.23 H new ATOM 397 N ASP A 198 6.235 -0.918 -5.227 1.00 52.21 N ATOM 398 CA ASP A 198 6.619 -1.360 -6.569 1.00 25.11 C ATOM 399 C ASP A 198 5.405 -2.005 -7.254 1.00 11.33 C ATOM 400 O ASP A 198 5.035 -3.142 -6.939 1.00 60.24 O ATOM 401 CB ASP A 198 7.809 -2.355 -6.474 1.00 64.11 C ATOM 402 CG ASP A 198 9.026 -1.732 -5.763 1.00 60.03 C ATOM 403 OD1 ASP A 198 9.116 -1.836 -4.512 1.00 25.32 O ATOM 404 OD2 ASP A 198 9.883 -1.122 -6.443 1.00 72.22 O ATOM 0 H ASP A 198 6.523 -1.561 -4.490 1.00 52.21 H new ATOM 0 HA ASP A 198 6.942 -0.508 -7.167 1.00 25.11 H new ATOM 0 HB2 ASP A 198 7.493 -3.248 -5.936 1.00 64.11 H new ATOM 0 HB3 ASP A 198 8.098 -2.672 -7.476 1.00 64.11 H new ATOM 409 N VAL A 199 4.755 -1.239 -8.138 1.00 14.53 N ATOM 410 CA VAL A 199 3.598 -1.702 -8.913 1.00 2.45 C ATOM 411 C VAL A 199 4.023 -1.848 -10.386 1.00 60.54 C ATOM 412 O VAL A 199 4.208 -0.837 -11.052 1.00 20.33 O ATOM 413 CB VAL A 199 2.382 -0.700 -8.792 1.00 25.22 C ATOM 414 CG1 VAL A 199 1.131 -1.255 -9.517 1.00 41.14 C ATOM 415 CG2 VAL A 199 2.075 -0.377 -7.310 1.00 60.23 C ATOM 0 H VAL A 199 5.019 -0.274 -8.337 1.00 14.53 H new ATOM 0 HA VAL A 199 3.267 -2.662 -8.518 1.00 2.45 H new ATOM 0 HB VAL A 199 2.663 0.232 -9.283 1.00 25.22 H new ATOM 0 HG11 VAL A 199 0.309 -0.546 -9.418 1.00 41.14 H new ATOM 0 HG12 VAL A 199 1.358 -1.403 -10.573 1.00 41.14 H new ATOM 0 HG13 VAL A 199 0.844 -2.207 -9.071 1.00 41.14 H new ATOM 0 HG21 VAL A 199 1.234 0.314 -7.255 1.00 60.23 H new ATOM 0 HG22 VAL A 199 1.824 -1.297 -6.782 1.00 60.23 H new ATOM 0 HG23 VAL A 199 2.951 0.079 -6.848 1.00 60.23 H new ATOM 425 N PRO A 200 4.243 -3.107 -10.906 1.00 74.43 N ATOM 426 CA PRO A 200 4.548 -3.341 -12.340 1.00 62.41 C ATOM 427 C PRO A 200 3.501 -2.696 -13.267 1.00 30.43 C ATOM 428 O PRO A 200 2.301 -2.737 -12.963 1.00 54.24 O ATOM 429 CB PRO A 200 4.555 -4.885 -12.465 1.00 31.23 C ATOM 430 CG PRO A 200 4.923 -5.355 -11.087 1.00 54.25 C ATOM 431 CD PRO A 200 4.239 -4.386 -10.144 1.00 12.40 C ATOM 0 HA PRO A 200 5.493 -2.890 -12.644 1.00 62.41 H new ATOM 0 HB2 PRO A 200 3.580 -5.266 -12.770 1.00 31.23 H new ATOM 0 HB3 PRO A 200 5.277 -5.223 -13.209 1.00 31.23 H new ATOM 0 HG2 PRO A 200 4.585 -6.377 -10.916 1.00 54.25 H new ATOM 0 HG3 PRO A 200 6.004 -5.348 -10.944 1.00 54.25 H new ATOM 0 HD2 PRO A 200 3.226 -4.707 -9.902 1.00 12.40 H new ATOM 0 HD3 PRO A 200 4.778 -4.294 -9.201 1.00 12.40 H new ATOM 439 N ALA A 201 3.985 -2.103 -14.382 1.00 60.31 N ATOM 440 CA ALA A 201 3.159 -1.350 -15.355 1.00 74.23 C ATOM 441 C ALA A 201 1.861 -2.096 -15.786 1.00 24.14 C ATOM 442 O ALA A 201 0.791 -1.474 -15.749 1.00 40.42 O ATOM 443 CB ALA A 201 4.006 -0.934 -16.578 1.00 13.41 C ATOM 0 H ALA A 201 4.973 -2.134 -14.635 1.00 60.31 H new ATOM 0 HA ALA A 201 2.818 -0.452 -14.840 1.00 74.23 H new ATOM 0 HB1 ALA A 201 3.383 -0.382 -17.282 1.00 13.41 H new ATOM 0 HB2 ALA A 201 4.831 -0.301 -16.251 1.00 13.41 H new ATOM 0 HB3 ALA A 201 4.403 -1.824 -17.066 1.00 13.41 H new ATOM 449 N PRO A 202 1.902 -3.430 -16.173 1.00 2.44 N ATOM 450 CA PRO A 202 0.664 -4.201 -16.481 1.00 0.53 C ATOM 451 C PRO A 202 -0.333 -4.242 -15.293 1.00 13.22 C ATOM 452 O PRO A 202 -1.526 -3.986 -15.482 1.00 0.25 O ATOM 453 CB PRO A 202 1.189 -5.621 -16.847 1.00 73.42 C ATOM 454 CG PRO A 202 2.575 -5.681 -16.277 1.00 72.41 C ATOM 455 CD PRO A 202 3.114 -4.280 -16.401 1.00 63.14 C ATOM 0 HA PRO A 202 0.091 -3.741 -17.286 1.00 0.53 H new ATOM 0 HB2 PRO A 202 0.554 -6.398 -16.422 1.00 73.42 H new ATOM 0 HB3 PRO A 202 1.199 -5.772 -17.926 1.00 73.42 H new ATOM 0 HG2 PRO A 202 2.559 -6.006 -15.237 1.00 72.41 H new ATOM 0 HG3 PRO A 202 3.195 -6.391 -16.824 1.00 72.41 H new ATOM 0 HD2 PRO A 202 3.891 -4.080 -15.664 1.00 63.14 H new ATOM 0 HD3 PRO A 202 3.553 -4.102 -17.383 1.00 63.14 H new ATOM 463 N ILE A 203 0.193 -4.503 -14.072 1.00 5.12 N ATOM 464 CA ILE A 203 -0.619 -4.624 -12.839 1.00 5.34 C ATOM 465 C ILE A 203 -1.269 -3.269 -12.473 1.00 64.43 C ATOM 466 O ILE A 203 -2.381 -3.230 -11.938 1.00 51.21 O ATOM 467 CB ILE A 203 0.243 -5.161 -11.625 1.00 45.32 C ATOM 468 CG1 ILE A 203 0.873 -6.554 -11.972 1.00 1.32 C ATOM 469 CG2 ILE A 203 -0.593 -5.232 -10.315 1.00 1.40 C ATOM 470 CD1 ILE A 203 1.626 -7.230 -10.831 1.00 3.20 C ATOM 0 H ILE A 203 1.192 -4.635 -13.915 1.00 5.12 H new ATOM 0 HA ILE A 203 -1.408 -5.349 -13.040 1.00 5.34 H new ATOM 0 HB ILE A 203 1.053 -4.453 -11.451 1.00 45.32 H new ATOM 0 HG12 ILE A 203 0.078 -7.221 -12.306 1.00 1.32 H new ATOM 0 HG13 ILE A 203 1.556 -6.426 -12.811 1.00 1.32 H new ATOM 0 HG21 ILE A 203 0.032 -5.605 -9.504 1.00 1.40 H new ATOM 0 HG22 ILE A 203 -0.959 -4.237 -10.063 1.00 1.40 H new ATOM 0 HG23 ILE A 203 -1.439 -5.904 -10.459 1.00 1.40 H new ATOM 0 HD11 ILE A 203 2.023 -8.186 -11.173 1.00 3.20 H new ATOM 0 HD12 ILE A 203 2.448 -6.591 -10.508 1.00 3.20 H new ATOM 0 HD13 ILE A 203 0.946 -7.397 -9.995 1.00 3.20 H new ATOM 482 N ALA A 204 -0.568 -2.167 -12.795 1.00 24.31 N ATOM 483 CA ALA A 204 -1.066 -0.805 -12.560 1.00 73.12 C ATOM 484 C ALA A 204 -2.295 -0.526 -13.438 1.00 70.31 C ATOM 485 O ALA A 204 -3.347 -0.124 -12.929 1.00 1.34 O ATOM 486 CB ALA A 204 0.048 0.220 -12.821 1.00 21.14 C ATOM 0 H ALA A 204 0.357 -2.198 -13.224 1.00 24.31 H new ATOM 0 HA ALA A 204 -1.371 -0.715 -11.518 1.00 73.12 H new ATOM 0 HB1 ALA A 204 -0.334 1.225 -12.643 1.00 21.14 H new ATOM 0 HB2 ALA A 204 0.885 0.026 -12.151 1.00 21.14 H new ATOM 0 HB3 ALA A 204 0.384 0.137 -13.855 1.00 21.14 H new ATOM 492 N VAL A 205 -2.154 -0.807 -14.748 1.00 15.52 N ATOM 493 CA VAL A 205 -3.191 -0.521 -15.755 1.00 23.43 C ATOM 494 C VAL A 205 -4.471 -1.345 -15.505 1.00 23.45 C ATOM 495 O VAL A 205 -5.566 -0.782 -15.409 1.00 73.51 O ATOM 496 CB VAL A 205 -2.656 -0.782 -17.214 1.00 64.50 C ATOM 497 CG1 VAL A 205 -3.741 -0.508 -18.284 1.00 72.54 C ATOM 498 CG2 VAL A 205 -1.382 0.049 -17.487 1.00 44.42 C ATOM 0 H VAL A 205 -1.316 -1.239 -15.137 1.00 15.52 H new ATOM 0 HA VAL A 205 -3.443 0.535 -15.660 1.00 23.43 H new ATOM 0 HB VAL A 205 -2.397 -1.838 -17.284 1.00 64.50 H new ATOM 0 HG11 VAL A 205 -3.331 -0.700 -19.275 1.00 72.54 H new ATOM 0 HG12 VAL A 205 -4.595 -1.163 -18.112 1.00 72.54 H new ATOM 0 HG13 VAL A 205 -4.062 0.532 -18.219 1.00 72.54 H new ATOM 0 HG21 VAL A 205 -1.030 -0.147 -18.500 1.00 44.42 H new ATOM 0 HG22 VAL A 205 -1.610 1.110 -17.381 1.00 44.42 H new ATOM 0 HG23 VAL A 205 -0.606 -0.229 -16.773 1.00 44.42 H new ATOM 508 N VAL A 206 -4.328 -2.674 -15.387 1.00 11.35 N ATOM 509 CA VAL A 206 -5.491 -3.577 -15.224 1.00 31.20 C ATOM 510 C VAL A 206 -6.037 -3.572 -13.779 1.00 31.10 C ATOM 511 O VAL A 206 -7.226 -3.832 -13.565 1.00 34.34 O ATOM 512 CB VAL A 206 -5.169 -5.051 -15.682 1.00 42.21 C ATOM 513 CG1 VAL A 206 -4.721 -5.074 -17.165 1.00 50.01 C ATOM 514 CG2 VAL A 206 -4.129 -5.731 -14.753 1.00 73.33 C ATOM 0 H VAL A 206 -3.426 -3.151 -15.401 1.00 11.35 H new ATOM 0 HA VAL A 206 -6.269 -3.183 -15.878 1.00 31.20 H new ATOM 0 HB VAL A 206 -6.085 -5.635 -15.600 1.00 42.21 H new ATOM 0 HG11 VAL A 206 -4.503 -6.099 -17.463 1.00 50.01 H new ATOM 0 HG12 VAL A 206 -5.518 -4.675 -17.792 1.00 50.01 H new ATOM 0 HG13 VAL A 206 -3.826 -4.463 -17.284 1.00 50.01 H new ATOM 0 HG21 VAL A 206 -3.936 -6.745 -15.104 1.00 73.33 H new ATOM 0 HG22 VAL A 206 -3.201 -5.159 -14.766 1.00 73.33 H new ATOM 0 HG23 VAL A 206 -4.519 -5.767 -13.736 1.00 73.33 H new ATOM 524 N GLY A 207 -5.163 -3.258 -12.800 1.00 1.30 N ATOM 525 CA GLY A 207 -5.524 -3.310 -11.378 1.00 54.22 C ATOM 526 C GLY A 207 -5.454 -4.731 -10.817 1.00 70.32 C ATOM 527 O GLY A 207 -5.849 -5.689 -11.499 1.00 74.03 O ATOM 0 H GLY A 207 -4.201 -2.966 -12.975 1.00 1.30 H new ATOM 0 HA2 GLY A 207 -4.854 -2.664 -10.811 1.00 54.22 H new ATOM 0 HA3 GLY A 207 -6.533 -2.918 -11.246 1.00 54.22 H new ATOM 531 N GLY A 208 -4.950 -4.879 -9.580 1.00 3.45 N ATOM 532 CA GLY A 208 -4.811 -6.198 -8.960 1.00 31.12 C ATOM 533 C GLY A 208 -4.270 -6.120 -7.540 1.00 21.10 C ATOM 534 O GLY A 208 -4.861 -5.448 -6.695 1.00 23.54 O ATOM 0 H GLY A 208 -4.635 -4.104 -8.997 1.00 3.45 H new ATOM 0 HA2 GLY A 208 -5.781 -6.695 -8.949 1.00 31.12 H new ATOM 0 HA3 GLY A 208 -4.145 -6.812 -9.566 1.00 31.12 H new ATOM 538 N LYS A 209 -3.158 -6.829 -7.274 1.00 15.13 N ATOM 539 CA LYS A 209 -2.450 -6.802 -5.972 1.00 24.51 C ATOM 540 C LYS A 209 -0.936 -6.716 -6.235 1.00 4.44 C ATOM 541 O LYS A 209 -0.461 -7.155 -7.287 1.00 64.25 O ATOM 542 CB LYS A 209 -2.760 -8.086 -5.135 1.00 33.14 C ATOM 543 CG LYS A 209 -4.167 -8.122 -4.481 1.00 13.25 C ATOM 544 CD LYS A 209 -4.388 -9.368 -3.580 1.00 14.02 C ATOM 545 CE LYS A 209 -4.205 -10.707 -4.320 1.00 63.14 C ATOM 546 NZ LYS A 209 -4.439 -11.873 -3.420 1.00 72.11 N ATOM 0 H LYS A 209 -2.718 -7.443 -7.959 1.00 15.13 H new ATOM 0 HA LYS A 209 -2.790 -5.936 -5.404 1.00 24.51 H new ATOM 0 HB2 LYS A 209 -2.655 -8.957 -5.782 1.00 33.14 H new ATOM 0 HB3 LYS A 209 -2.009 -8.179 -4.350 1.00 33.14 H new ATOM 0 HG2 LYS A 209 -4.307 -7.220 -3.885 1.00 13.25 H new ATOM 0 HG3 LYS A 209 -4.925 -8.108 -5.264 1.00 13.25 H new ATOM 0 HD2 LYS A 209 -3.692 -9.328 -2.742 1.00 14.02 H new ATOM 0 HD3 LYS A 209 -5.394 -9.329 -3.161 1.00 14.02 H new ATOM 0 HE2 LYS A 209 -4.895 -10.754 -5.163 1.00 63.14 H new ATOM 0 HE3 LYS A 209 -3.197 -10.761 -4.730 1.00 63.14 H new ATOM 0 HZ1 LYS A 209 -4.082 -12.738 -3.873 1.00 72.11 H new ATOM 0 HZ2 LYS A 209 -3.940 -11.723 -2.520 1.00 72.11 H new ATOM 0 HZ3 LYS A 209 -5.458 -11.972 -3.238 1.00 72.11 H new ATOM 560 N VAL A 210 -0.181 -6.140 -5.280 1.00 41.04 N ATOM 561 CA VAL A 210 1.301 -6.140 -5.305 1.00 33.31 C ATOM 562 C VAL A 210 1.837 -6.422 -3.886 1.00 72.50 C ATOM 563 O VAL A 210 1.432 -5.776 -2.915 1.00 30.21 O ATOM 564 CB VAL A 210 1.911 -4.795 -5.871 1.00 31.54 C ATOM 565 CG1 VAL A 210 1.656 -4.650 -7.389 1.00 72.31 C ATOM 566 CG2 VAL A 210 1.379 -3.569 -5.105 1.00 15.12 C ATOM 0 H VAL A 210 -0.576 -5.662 -4.470 1.00 41.04 H new ATOM 0 HA VAL A 210 1.616 -6.928 -5.988 1.00 33.31 H new ATOM 0 HB VAL A 210 2.989 -4.842 -5.719 1.00 31.54 H new ATOM 0 HG11 VAL A 210 2.089 -3.714 -7.743 1.00 72.31 H new ATOM 0 HG12 VAL A 210 2.116 -5.485 -7.917 1.00 72.31 H new ATOM 0 HG13 VAL A 210 0.583 -4.648 -7.579 1.00 72.31 H new ATOM 0 HG21 VAL A 210 1.819 -2.662 -5.520 1.00 15.12 H new ATOM 0 HG22 VAL A 210 0.294 -3.523 -5.200 1.00 15.12 H new ATOM 0 HG23 VAL A 210 1.647 -3.653 -4.052 1.00 15.12 H new ATOM 576 N ARG A 211 2.733 -7.411 -3.780 1.00 5.40 N ATOM 577 CA ARG A 211 3.297 -7.856 -2.500 1.00 52.31 C ATOM 578 C ARG A 211 4.452 -6.942 -2.066 1.00 21.12 C ATOM 579 O ARG A 211 5.515 -6.930 -2.684 1.00 51.02 O ATOM 580 CB ARG A 211 3.721 -9.348 -2.605 1.00 33.03 C ATOM 581 CG ARG A 211 2.517 -10.305 -2.546 1.00 13.14 C ATOM 582 CD ARG A 211 2.842 -11.759 -2.915 1.00 22.13 C ATOM 583 NE ARG A 211 3.166 -11.920 -4.342 1.00 0.40 N ATOM 584 CZ ARG A 211 2.271 -12.177 -5.318 1.00 62.43 C ATOM 585 NH1 ARG A 211 0.969 -12.303 -5.057 1.00 62.42 N ATOM 586 NH2 ARG A 211 2.693 -12.320 -6.564 1.00 55.53 N ATOM 0 H ARG A 211 3.089 -7.928 -4.584 1.00 5.40 H new ATOM 0 HA ARG A 211 2.538 -7.783 -1.721 1.00 52.31 H new ATOM 0 HB2 ARG A 211 4.261 -9.505 -3.539 1.00 33.03 H new ATOM 0 HB3 ARG A 211 4.410 -9.585 -1.795 1.00 33.03 H new ATOM 0 HG2 ARG A 211 2.101 -10.283 -1.539 1.00 13.14 H new ATOM 0 HG3 ARG A 211 1.743 -9.937 -3.219 1.00 13.14 H new ATOM 0 HD2 ARG A 211 3.683 -12.104 -2.314 1.00 22.13 H new ATOM 0 HD3 ARG A 211 1.991 -12.393 -2.665 1.00 22.13 H new ATOM 0 HE ARG A 211 4.145 -11.830 -4.614 1.00 0.40 H new ATOM 0 HH11 ARG A 211 0.629 -12.205 -4.100 1.00 62.42 H new ATOM 0 HH12 ARG A 211 0.314 -12.497 -5.814 1.00 62.42 H new ATOM 0 HH21 ARG A 211 3.687 -12.236 -6.779 1.00 55.53 H new ATOM 0 HH22 ARG A 211 2.025 -12.515 -7.310 1.00 55.53 H new ATOM 600 N ALA A 212 4.195 -6.167 -0.999 1.00 31.14 N ATOM 601 CA ALA A 212 5.157 -5.238 -0.389 1.00 35.30 C ATOM 602 C ALA A 212 5.773 -5.872 0.866 1.00 74.31 C ATOM 603 O ALA A 212 5.221 -6.823 1.432 1.00 23.11 O ATOM 604 CB ALA A 212 4.448 -3.920 -0.023 1.00 5.54 C ATOM 0 H ALA A 212 3.291 -6.170 -0.527 1.00 31.14 H new ATOM 0 HA ALA A 212 5.953 -5.027 -1.103 1.00 35.30 H new ATOM 0 HB1 ALA A 212 5.165 -3.234 0.429 1.00 5.54 H new ATOM 0 HB2 ALA A 212 4.032 -3.468 -0.924 1.00 5.54 H new ATOM 0 HB3 ALA A 212 3.645 -4.123 0.685 1.00 5.54 H new ATOM 610 N MET A 213 6.917 -5.328 1.288 1.00 33.34 N ATOM 611 CA MET A 213 7.678 -5.824 2.438 1.00 44.43 C ATOM 612 C MET A 213 7.375 -4.964 3.676 1.00 44.21 C ATOM 613 O MET A 213 7.601 -3.747 3.665 1.00 62.24 O ATOM 614 CB MET A 213 9.198 -5.784 2.107 1.00 34.42 C ATOM 615 CG MET A 213 9.638 -6.576 0.851 1.00 60.20 C ATOM 616 SD MET A 213 9.895 -8.354 1.134 1.00 52.42 S ATOM 617 CE MET A 213 8.232 -9.026 1.162 1.00 70.00 C ATOM 0 H MET A 213 7.346 -4.521 0.835 1.00 33.34 H new ATOM 0 HA MET A 213 7.388 -6.853 2.652 1.00 44.43 H new ATOM 0 HB2 MET A 213 9.495 -4.743 1.979 1.00 34.42 H new ATOM 0 HB3 MET A 213 9.747 -6.169 2.966 1.00 34.42 H new ATOM 0 HG2 MET A 213 8.884 -6.450 0.074 1.00 60.20 H new ATOM 0 HG3 MET A 213 10.563 -6.144 0.470 1.00 60.20 H new ATOM 0 HE1 MET A 213 8.234 -10.021 0.717 1.00 70.00 H new ATOM 0 HE2 MET A 213 7.883 -9.090 2.193 1.00 70.00 H new ATOM 0 HE3 MET A 213 7.567 -8.376 0.593 1.00 70.00 H new ATOM 627 N THR A 214 6.841 -5.606 4.727 1.00 60.11 N ATOM 628 CA THR A 214 6.683 -4.996 6.058 1.00 51.32 C ATOM 629 C THR A 214 7.652 -5.668 7.036 1.00 43.12 C ATOM 630 O THR A 214 8.325 -6.649 6.681 1.00 40.22 O ATOM 631 CB THR A 214 5.217 -5.117 6.599 1.00 23.41 C ATOM 632 OG1 THR A 214 4.819 -6.496 6.673 1.00 35.34 O ATOM 633 CG2 THR A 214 4.228 -4.333 5.731 1.00 45.42 C ATOM 0 H THR A 214 6.505 -6.568 4.678 1.00 60.11 H new ATOM 0 HA THR A 214 6.906 -3.933 5.967 1.00 51.32 H new ATOM 0 HB THR A 214 5.202 -4.686 7.600 1.00 23.41 H new ATOM 0 HG1 THR A 214 5.224 -6.993 5.932 1.00 35.34 H new ATOM 0 HG21 THR A 214 3.222 -4.441 6.137 1.00 45.42 H new ATOM 0 HG22 THR A 214 4.506 -3.279 5.725 1.00 45.42 H new ATOM 0 HG23 THR A 214 4.251 -4.721 4.712 1.00 45.42 H new ATOM 641 N LEU A 215 7.694 -5.154 8.279 1.00 15.51 N ATOM 642 CA LEU A 215 8.662 -5.600 9.302 1.00 22.53 C ATOM 643 C LEU A 215 8.377 -7.030 9.809 1.00 60.43 C ATOM 644 O LEU A 215 9.197 -7.613 10.523 1.00 73.30 O ATOM 645 CB LEU A 215 8.680 -4.599 10.488 1.00 4.34 C ATOM 646 CG LEU A 215 8.825 -3.092 10.101 1.00 51.35 C ATOM 647 CD1 LEU A 215 8.952 -2.196 11.347 1.00 74.40 C ATOM 648 CD2 LEU A 215 9.992 -2.864 9.113 1.00 64.05 C ATOM 0 H LEU A 215 7.062 -4.422 8.603 1.00 15.51 H new ATOM 0 HA LEU A 215 9.643 -5.624 8.828 1.00 22.53 H new ATOM 0 HB2 LEU A 215 7.759 -4.722 11.057 1.00 4.34 H new ATOM 0 HB3 LEU A 215 9.503 -4.865 11.152 1.00 4.34 H new ATOM 0 HG LEU A 215 7.908 -2.803 9.587 1.00 51.35 H new ATOM 0 HD11 LEU A 215 9.051 -1.155 11.038 1.00 74.40 H new ATOM 0 HD12 LEU A 215 8.063 -2.307 11.967 1.00 74.40 H new ATOM 0 HD13 LEU A 215 9.832 -2.490 11.919 1.00 74.40 H new ATOM 0 HD21 LEU A 215 10.060 -1.804 8.868 1.00 64.05 H new ATOM 0 HD22 LEU A 215 10.926 -3.191 9.571 1.00 64.05 H new ATOM 0 HD23 LEU A 215 9.815 -3.436 8.202 1.00 64.05 H new ATOM 660 N GLU A 216 7.202 -7.586 9.439 1.00 51.35 N ATOM 661 CA GLU A 216 6.760 -8.920 9.890 1.00 11.44 C ATOM 662 C GLU A 216 6.595 -9.913 8.713 1.00 31.12 C ATOM 663 O GLU A 216 6.466 -11.119 8.952 1.00 5.35 O ATOM 664 CB GLU A 216 5.457 -8.784 10.727 1.00 21.02 C ATOM 665 CG GLU A 216 5.624 -7.898 11.987 1.00 43.10 C ATOM 666 CD GLU A 216 4.406 -7.907 12.914 1.00 21.12 C ATOM 667 OE1 GLU A 216 3.638 -6.924 12.935 1.00 1.22 O ATOM 668 OE2 GLU A 216 4.208 -8.915 13.630 1.00 23.53 O ATOM 0 H GLU A 216 6.536 -7.122 8.821 1.00 51.35 H new ATOM 0 HA GLU A 216 7.538 -9.342 10.526 1.00 11.44 H new ATOM 0 HB2 GLU A 216 4.672 -8.364 10.098 1.00 21.02 H new ATOM 0 HB3 GLU A 216 5.124 -9.776 11.031 1.00 21.02 H new ATOM 0 HG2 GLU A 216 6.496 -8.237 12.545 1.00 43.10 H new ATOM 0 HG3 GLU A 216 5.824 -6.873 11.675 1.00 43.10 H new ATOM 675 N GLY A 217 6.603 -9.415 7.452 1.00 71.34 N ATOM 676 CA GLY A 217 6.592 -10.307 6.273 1.00 63.12 C ATOM 677 C GLY A 217 5.969 -9.684 5.013 1.00 34.33 C ATOM 678 O GLY A 217 5.747 -8.468 4.969 1.00 61.55 O ATOM 0 H GLY A 217 6.617 -8.419 7.230 1.00 71.34 H new ATOM 0 HA2 GLY A 217 7.616 -10.605 6.048 1.00 63.12 H new ATOM 0 HA3 GLY A 217 6.044 -11.215 6.524 1.00 63.12 H new ATOM 682 N PRO A 218 5.719 -10.509 3.937 1.00 31.30 N ATOM 683 CA PRO A 218 5.042 -10.054 2.690 1.00 31.52 C ATOM 684 C PRO A 218 3.542 -9.756 2.908 1.00 21.32 C ATOM 685 O PRO A 218 2.856 -10.477 3.646 1.00 21.04 O ATOM 686 CB PRO A 218 5.249 -11.252 1.721 1.00 11.24 C ATOM 687 CG PRO A 218 5.374 -12.445 2.621 1.00 45.33 C ATOM 688 CD PRO A 218 6.112 -11.946 3.846 1.00 72.42 C ATOM 0 HA PRO A 218 5.449 -9.116 2.313 1.00 31.52 H new ATOM 0 HB2 PRO A 218 4.408 -11.358 1.036 1.00 11.24 H new ATOM 0 HB3 PRO A 218 6.143 -11.119 1.111 1.00 11.24 H new ATOM 0 HG2 PRO A 218 4.394 -12.842 2.887 1.00 45.33 H new ATOM 0 HG3 PRO A 218 5.922 -13.251 2.132 1.00 45.33 H new ATOM 0 HD2 PRO A 218 5.822 -12.498 4.740 1.00 72.42 H new ATOM 0 HD3 PRO A 218 7.191 -12.060 3.737 1.00 72.42 H new ATOM 696 N VAL A 219 3.037 -8.685 2.256 1.00 32.32 N ATOM 697 CA VAL A 219 1.623 -8.277 2.333 1.00 34.02 C ATOM 698 C VAL A 219 1.109 -7.866 0.931 1.00 5.14 C ATOM 699 O VAL A 219 1.764 -7.102 0.228 1.00 32.24 O ATOM 700 CB VAL A 219 1.396 -7.107 3.370 1.00 52.35 C ATOM 701 CG1 VAL A 219 1.792 -7.528 4.808 1.00 23.13 C ATOM 702 CG2 VAL A 219 2.109 -5.794 2.953 1.00 52.12 C ATOM 0 H VAL A 219 3.603 -8.080 1.661 1.00 32.32 H new ATOM 0 HA VAL A 219 1.053 -9.136 2.688 1.00 34.02 H new ATOM 0 HB VAL A 219 0.326 -6.900 3.367 1.00 52.35 H new ATOM 0 HG11 VAL A 219 1.621 -6.696 5.491 1.00 23.13 H new ATOM 0 HG12 VAL A 219 1.188 -8.381 5.117 1.00 23.13 H new ATOM 0 HG13 VAL A 219 2.846 -7.804 4.829 1.00 23.13 H new ATOM 0 HG21 VAL A 219 1.920 -5.024 3.701 1.00 52.12 H new ATOM 0 HG22 VAL A 219 3.182 -5.971 2.878 1.00 52.12 H new ATOM 0 HG23 VAL A 219 1.727 -5.464 1.987 1.00 52.12 H new ATOM 712 N GLU A 220 -0.054 -8.399 0.521 1.00 32.01 N ATOM 713 CA GLU A 220 -0.647 -8.133 -0.802 1.00 15.52 C ATOM 714 C GLU A 220 -1.536 -6.874 -0.743 1.00 42.11 C ATOM 715 O GLU A 220 -2.627 -6.916 -0.166 1.00 2.45 O ATOM 716 CB GLU A 220 -1.483 -9.354 -1.265 1.00 71.34 C ATOM 717 CG GLU A 220 -0.804 -10.719 -1.049 1.00 61.14 C ATOM 718 CD GLU A 220 -1.456 -11.860 -1.840 1.00 43.15 C ATOM 719 OE1 GLU A 220 -1.048 -12.084 -3.000 1.00 43.15 O ATOM 720 OE2 GLU A 220 -2.389 -12.513 -1.323 1.00 22.35 O ATOM 0 H GLU A 220 -0.611 -9.028 1.099 1.00 32.01 H new ATOM 0 HA GLU A 220 0.156 -7.962 -1.519 1.00 15.52 H new ATOM 0 HB2 GLU A 220 -2.434 -9.349 -0.733 1.00 71.34 H new ATOM 0 HB3 GLU A 220 -1.710 -9.240 -2.325 1.00 71.34 H new ATOM 0 HG2 GLU A 220 0.245 -10.643 -1.335 1.00 61.14 H new ATOM 0 HG3 GLU A 220 -0.828 -10.964 0.013 1.00 61.14 H new ATOM 727 N VAL A 221 -1.070 -5.779 -1.361 1.00 40.31 N ATOM 728 CA VAL A 221 -1.754 -4.471 -1.338 1.00 53.55 C ATOM 729 C VAL A 221 -2.641 -4.326 -2.593 1.00 64.13 C ATOM 730 O VAL A 221 -2.143 -4.440 -3.718 1.00 50.25 O ATOM 731 CB VAL A 221 -0.711 -3.284 -1.277 1.00 71.43 C ATOM 732 CG1 VAL A 221 -1.424 -1.912 -1.158 1.00 14.32 C ATOM 733 CG2 VAL A 221 0.299 -3.497 -0.122 1.00 73.24 C ATOM 0 H VAL A 221 -0.201 -5.773 -1.896 1.00 40.31 H new ATOM 0 HA VAL A 221 -2.375 -4.424 -0.443 1.00 53.55 H new ATOM 0 HB VAL A 221 -0.153 -3.280 -2.213 1.00 71.43 H new ATOM 0 HG11 VAL A 221 -0.679 -1.117 -1.118 1.00 14.32 H new ATOM 0 HG12 VAL A 221 -2.070 -1.761 -2.023 1.00 14.32 H new ATOM 0 HG13 VAL A 221 -2.025 -1.892 -0.249 1.00 14.32 H new ATOM 0 HG21 VAL A 221 1.006 -2.668 -0.100 1.00 73.24 H new ATOM 0 HG22 VAL A 221 -0.237 -3.542 0.826 1.00 73.24 H new ATOM 0 HG23 VAL A 221 0.839 -4.431 -0.278 1.00 73.24 H new ATOM 743 N ALA A 222 -3.949 -4.089 -2.375 1.00 62.14 N ATOM 744 CA ALA A 222 -4.959 -3.977 -3.441 1.00 33.22 C ATOM 745 C ALA A 222 -4.749 -2.700 -4.287 1.00 73.51 C ATOM 746 O ALA A 222 -4.979 -1.579 -3.815 1.00 71.20 O ATOM 747 CB ALA A 222 -6.365 -4.009 -2.815 1.00 63.44 C ATOM 0 H ALA A 222 -4.337 -3.969 -1.440 1.00 62.14 H new ATOM 0 HA ALA A 222 -4.852 -4.824 -4.119 1.00 33.22 H new ATOM 0 HB1 ALA A 222 -7.115 -3.926 -3.601 1.00 63.44 H new ATOM 0 HB2 ALA A 222 -6.503 -4.948 -2.279 1.00 63.44 H new ATOM 0 HB3 ALA A 222 -6.473 -3.175 -2.121 1.00 63.44 H new ATOM 753 N VAL A 223 -4.257 -2.908 -5.521 1.00 50.31 N ATOM 754 CA VAL A 223 -4.046 -1.850 -6.530 1.00 71.12 C ATOM 755 C VAL A 223 -5.353 -1.613 -7.334 1.00 22.15 C ATOM 756 O VAL A 223 -5.854 -2.560 -7.956 1.00 22.23 O ATOM 757 CB VAL A 223 -2.881 -2.257 -7.525 1.00 45.42 C ATOM 758 CG1 VAL A 223 -2.635 -1.176 -8.604 1.00 11.11 C ATOM 759 CG2 VAL A 223 -1.581 -2.573 -6.760 1.00 54.01 C ATOM 0 H VAL A 223 -3.989 -3.834 -5.853 1.00 50.31 H new ATOM 0 HA VAL A 223 -3.767 -0.932 -6.013 1.00 71.12 H new ATOM 0 HB VAL A 223 -3.204 -3.162 -8.040 1.00 45.42 H new ATOM 0 HG11 VAL A 223 -1.829 -1.497 -9.263 1.00 11.11 H new ATOM 0 HG12 VAL A 223 -3.544 -1.030 -9.187 1.00 11.11 H new ATOM 0 HG13 VAL A 223 -2.358 -0.238 -8.123 1.00 11.11 H new ATOM 0 HG21 VAL A 223 -0.800 -2.849 -7.468 1.00 54.01 H new ATOM 0 HG22 VAL A 223 -1.267 -1.694 -6.198 1.00 54.01 H new ATOM 0 HG23 VAL A 223 -1.756 -3.400 -6.072 1.00 54.01 H new ATOM 769 N PRO A 224 -5.930 -0.360 -7.333 1.00 0.11 N ATOM 770 CA PRO A 224 -7.120 -0.012 -8.171 1.00 44.30 C ATOM 771 C PRO A 224 -6.823 -0.111 -9.705 1.00 65.42 C ATOM 772 O PRO A 224 -5.660 -0.217 -10.103 1.00 63.42 O ATOM 773 CB PRO A 224 -7.454 1.450 -7.729 1.00 65.02 C ATOM 774 CG PRO A 224 -6.184 1.991 -7.139 1.00 34.43 C ATOM 775 CD PRO A 224 -5.488 0.803 -6.503 1.00 31.42 C ATOM 0 HA PRO A 224 -7.951 -0.701 -8.023 1.00 44.30 H new ATOM 0 HB2 PRO A 224 -7.780 2.052 -8.577 1.00 65.02 H new ATOM 0 HB3 PRO A 224 -8.263 1.464 -6.999 1.00 65.02 H new ATOM 0 HG2 PRO A 224 -5.558 2.446 -7.907 1.00 34.43 H new ATOM 0 HG3 PRO A 224 -6.394 2.764 -6.399 1.00 34.43 H new ATOM 0 HD2 PRO A 224 -4.404 0.918 -6.522 1.00 31.42 H new ATOM 0 HD3 PRO A 224 -5.778 0.682 -5.459 1.00 31.42 H new ATOM 783 N PRO A 225 -7.873 -0.142 -10.594 1.00 12.13 N ATOM 784 CA PRO A 225 -7.677 -0.099 -12.069 1.00 25.14 C ATOM 785 C PRO A 225 -7.094 1.252 -12.541 1.00 62.53 C ATOM 786 O PRO A 225 -7.623 2.317 -12.181 1.00 72.30 O ATOM 787 CB PRO A 225 -9.111 -0.336 -12.635 1.00 2.51 C ATOM 788 CG PRO A 225 -9.886 -0.925 -11.490 1.00 51.33 C ATOM 789 CD PRO A 225 -9.312 -0.272 -10.256 1.00 20.52 C ATOM 0 HA PRO A 225 -6.956 -0.841 -12.414 1.00 25.14 H new ATOM 0 HB2 PRO A 225 -9.560 0.596 -12.978 1.00 2.51 H new ATOM 0 HB3 PRO A 225 -9.092 -1.013 -13.489 1.00 2.51 H new ATOM 0 HG2 PRO A 225 -10.952 -0.719 -11.587 1.00 51.33 H new ATOM 0 HG3 PRO A 225 -9.773 -2.009 -11.452 1.00 51.33 H new ATOM 0 HD2 PRO A 225 -9.771 0.697 -10.060 1.00 20.52 H new ATOM 0 HD3 PRO A 225 -9.465 -0.883 -9.366 1.00 20.52 H new ATOM 797 N ARG A 226 -5.996 1.174 -13.328 1.00 65.23 N ATOM 798 CA ARG A 226 -5.297 2.333 -13.911 1.00 41.35 C ATOM 799 C ARG A 226 -4.722 3.239 -12.806 1.00 51.11 C ATOM 800 O ARG A 226 -5.227 4.332 -12.535 1.00 14.51 O ATOM 801 CB ARG A 226 -6.219 3.092 -14.910 1.00 23.12 C ATOM 802 CG ARG A 226 -6.615 2.258 -16.156 1.00 21.33 C ATOM 803 CD ARG A 226 -7.755 2.898 -16.969 1.00 11.45 C ATOM 804 NE ARG A 226 -9.020 2.923 -16.200 1.00 71.43 N ATOM 805 CZ ARG A 226 -9.968 1.967 -16.238 1.00 61.22 C ATOM 806 NH1 ARG A 226 -9.822 0.894 -17.004 1.00 22.12 N ATOM 807 NH2 ARG A 226 -11.053 2.083 -15.485 1.00 72.30 N ATOM 0 H ARG A 226 -5.566 0.284 -13.578 1.00 65.23 H new ATOM 0 HA ARG A 226 -4.445 1.977 -14.490 1.00 41.35 H new ATOM 0 HB2 ARG A 226 -7.125 3.402 -14.389 1.00 23.12 H new ATOM 0 HB3 ARG A 226 -5.713 4.000 -15.238 1.00 23.12 H new ATOM 0 HG2 ARG A 226 -5.742 2.136 -16.798 1.00 21.33 H new ATOM 0 HG3 ARG A 226 -6.918 1.261 -15.838 1.00 21.33 H new ATOM 0 HD2 ARG A 226 -7.478 3.914 -17.249 1.00 11.45 H new ATOM 0 HD3 ARG A 226 -7.901 2.341 -17.894 1.00 11.45 H new ATOM 0 HE ARG A 226 -9.186 3.727 -15.594 1.00 71.43 H new ATOM 0 HH11 ARG A 226 -8.983 0.785 -17.574 1.00 22.12 H new ATOM 0 HH12 ARG A 226 -10.548 0.178 -17.023 1.00 22.12 H new ATOM 0 HH21 ARG A 226 -11.168 2.895 -14.879 1.00 72.30 H new ATOM 0 HH22 ARG A 226 -11.772 1.360 -15.512 1.00 72.30 H new ATOM 821 N THR A 227 -3.682 2.721 -12.138 1.00 41.24 N ATOM 822 CA THR A 227 -2.998 3.395 -11.031 1.00 13.25 C ATOM 823 C THR A 227 -1.689 4.008 -11.540 1.00 12.02 C ATOM 824 O THR A 227 -0.784 3.281 -11.955 1.00 41.52 O ATOM 825 CB THR A 227 -2.717 2.379 -9.884 1.00 63.11 C ATOM 826 OG1 THR A 227 -3.944 1.769 -9.491 1.00 1.30 O ATOM 827 CG2 THR A 227 -2.081 3.030 -8.654 1.00 53.41 C ATOM 0 H THR A 227 -3.287 1.806 -12.357 1.00 41.24 H new ATOM 0 HA THR A 227 -3.632 4.190 -10.639 1.00 13.25 H new ATOM 0 HB THR A 227 -2.011 1.645 -10.272 1.00 63.11 H new ATOM 0 HG1 THR A 227 -4.137 1.012 -10.083 1.00 1.30 H new ATOM 0 HG21 THR A 227 -1.909 2.272 -7.889 1.00 53.41 H new ATOM 0 HG22 THR A 227 -1.131 3.485 -8.934 1.00 53.41 H new ATOM 0 HG23 THR A 227 -2.749 3.797 -8.262 1.00 53.41 H new ATOM 835 N GLN A 228 -1.607 5.346 -11.516 1.00 53.30 N ATOM 836 CA GLN A 228 -0.464 6.098 -12.073 1.00 25.43 C ATOM 837 C GLN A 228 0.685 6.209 -11.055 1.00 53.43 C ATOM 838 O GLN A 228 0.458 6.165 -9.842 1.00 24.33 O ATOM 839 CB GLN A 228 -0.914 7.513 -12.539 1.00 35.45 C ATOM 840 CG GLN A 228 -1.992 7.500 -13.659 1.00 62.14 C ATOM 841 CD GLN A 228 -3.431 7.310 -13.168 1.00 53.24 C ATOM 842 OE1 GLN A 228 -3.793 7.749 -12.079 1.00 34.30 O ATOM 843 NE2 GLN A 228 -4.271 6.659 -13.969 1.00 20.31 N ATOM 0 H GLN A 228 -2.329 5.941 -11.111 1.00 53.30 H new ATOM 0 HA GLN A 228 -0.094 5.546 -12.937 1.00 25.43 H new ATOM 0 HB2 GLN A 228 -1.304 8.059 -11.680 1.00 35.45 H new ATOM 0 HB3 GLN A 228 -0.042 8.061 -12.896 1.00 35.45 H new ATOM 0 HG2 GLN A 228 -1.933 8.438 -14.211 1.00 62.14 H new ATOM 0 HG3 GLN A 228 -1.755 6.701 -14.362 1.00 62.14 H new ATOM 0 HE21 GLN A 228 -3.946 6.304 -14.868 1.00 20.31 H new ATOM 0 HE22 GLN A 228 -5.240 6.515 -13.684 1.00 20.31 H new ATOM 852 N ALA A 229 1.918 6.343 -11.581 1.00 3.41 N ATOM 853 CA ALA A 229 3.120 6.584 -10.769 1.00 64.13 C ATOM 854 C ALA A 229 3.090 8.025 -10.264 1.00 21.13 C ATOM 855 O ALA A 229 2.917 8.962 -11.051 1.00 1.24 O ATOM 856 CB ALA A 229 4.391 6.333 -11.587 1.00 44.30 C ATOM 0 H ALA A 229 2.106 6.287 -12.582 1.00 3.41 H new ATOM 0 HA ALA A 229 3.128 5.895 -9.924 1.00 64.13 H new ATOM 0 HB1 ALA A 229 5.267 6.518 -10.965 1.00 44.30 H new ATOM 0 HB2 ALA A 229 4.403 5.299 -11.933 1.00 44.30 H new ATOM 0 HB3 ALA A 229 4.409 7.003 -12.447 1.00 44.30 H new ATOM 862 N GLY A 230 3.252 8.193 -8.952 1.00 54.43 N ATOM 863 CA GLY A 230 3.063 9.485 -8.304 1.00 55.14 C ATOM 864 C GLY A 230 1.822 9.495 -7.435 1.00 4.32 C ATOM 865 O GLY A 230 1.624 10.430 -6.656 1.00 23.04 O ATOM 0 H GLY A 230 3.516 7.442 -8.315 1.00 54.43 H new ATOM 0 HA2 GLY A 230 3.936 9.719 -7.695 1.00 55.14 H new ATOM 0 HA3 GLY A 230 2.984 10.265 -9.061 1.00 55.14 H new ATOM 869 N ARG A 231 0.964 8.449 -7.574 1.00 45.33 N ATOM 870 CA ARG A 231 -0.141 8.221 -6.636 1.00 3.12 C ATOM 871 C ARG A 231 0.408 7.849 -5.254 1.00 43.02 C ATOM 872 O ARG A 231 1.535 7.359 -5.120 1.00 35.44 O ATOM 873 CB ARG A 231 -1.120 7.109 -7.112 1.00 14.51 C ATOM 874 CG ARG A 231 -2.097 7.520 -8.230 1.00 20.22 C ATOM 875 CD ARG A 231 -3.228 6.497 -8.382 1.00 50.51 C ATOM 876 NE ARG A 231 -4.192 6.867 -9.420 1.00 60.23 N ATOM 877 CZ ARG A 231 -5.258 6.131 -9.764 1.00 52.01 C ATOM 878 NH1 ARG A 231 -5.521 4.971 -9.158 1.00 42.20 N ATOM 879 NH2 ARG A 231 -6.051 6.571 -10.721 1.00 23.33 N ATOM 0 H ARG A 231 1.025 7.761 -8.325 1.00 45.33 H new ATOM 0 HA ARG A 231 -0.702 9.154 -6.585 1.00 3.12 H new ATOM 0 HB2 ARG A 231 -0.534 6.258 -7.460 1.00 14.51 H new ATOM 0 HB3 ARG A 231 -1.700 6.768 -6.254 1.00 14.51 H new ATOM 0 HG2 ARG A 231 -2.518 8.500 -8.007 1.00 20.22 H new ATOM 0 HG3 ARG A 231 -1.557 7.612 -9.173 1.00 20.22 H new ATOM 0 HD2 ARG A 231 -2.801 5.523 -8.620 1.00 50.51 H new ATOM 0 HD3 ARG A 231 -3.748 6.393 -7.430 1.00 50.51 H new ATOM 0 HE ARG A 231 -4.042 7.746 -9.916 1.00 60.23 H new ATOM 0 HH11 ARG A 231 -4.906 4.631 -8.419 1.00 42.20 H new ATOM 0 HH12 ARG A 231 -6.337 4.425 -9.434 1.00 42.20 H new ATOM 0 HH21 ARG A 231 -5.848 7.457 -11.185 1.00 23.33 H new ATOM 0 HH22 ARG A 231 -6.867 6.026 -10.998 1.00 23.33 H new ATOM 893 N LYS A 232 -0.413 8.086 -4.244 1.00 43.53 N ATOM 894 CA LYS A 232 -0.058 7.878 -2.846 1.00 72.13 C ATOM 895 C LYS A 232 -1.176 7.094 -2.148 1.00 24.32 C ATOM 896 O LYS A 232 -2.369 7.359 -2.362 1.00 65.14 O ATOM 897 CB LYS A 232 0.229 9.257 -2.185 1.00 3.21 C ATOM 898 CG LYS A 232 -0.767 10.376 -2.565 1.00 74.44 C ATOM 899 CD LYS A 232 -0.382 11.758 -1.992 1.00 13.45 C ATOM 900 CE LYS A 232 -1.338 12.866 -2.448 1.00 21.44 C ATOM 901 NZ LYS A 232 -0.980 14.179 -1.854 1.00 13.23 N ATOM 0 H LYS A 232 -1.363 8.435 -4.373 1.00 43.53 H new ATOM 0 HA LYS A 232 0.850 7.282 -2.755 1.00 72.13 H new ATOM 0 HB2 LYS A 232 0.220 9.134 -1.102 1.00 3.21 H new ATOM 0 HB3 LYS A 232 1.234 9.575 -2.462 1.00 3.21 H new ATOM 0 HG2 LYS A 232 -0.828 10.445 -3.651 1.00 74.44 H new ATOM 0 HG3 LYS A 232 -1.760 10.106 -2.207 1.00 74.44 H new ATOM 0 HD2 LYS A 232 -0.380 11.709 -0.903 1.00 13.45 H new ATOM 0 HD3 LYS A 232 0.633 12.007 -2.302 1.00 13.45 H new ATOM 0 HE2 LYS A 232 -1.317 12.940 -3.535 1.00 21.44 H new ATOM 0 HE3 LYS A 232 -2.358 12.605 -2.166 1.00 21.44 H new ATOM 0 HZ1 LYS A 232 -1.628 14.910 -2.212 1.00 13.23 H new ATOM 0 HZ2 LYS A 232 -1.058 14.124 -0.818 1.00 13.23 H new ATOM 0 HZ3 LYS A 232 -0.004 14.424 -2.116 1.00 13.23 H new ATOM 915 N LEU A 233 -0.773 6.092 -1.360 1.00 45.15 N ATOM 916 CA LEU A 233 -1.676 5.275 -0.544 1.00 35.41 C ATOM 917 C LEU A 233 -1.332 5.512 0.926 1.00 50.11 C ATOM 918 O LEU A 233 -0.161 5.585 1.276 1.00 40.20 O ATOM 919 CB LEU A 233 -1.506 3.759 -0.864 1.00 41.42 C ATOM 920 CG LEU A 233 -1.689 3.329 -2.349 1.00 32.41 C ATOM 921 CD1 LEU A 233 -1.423 1.820 -2.521 1.00 62.30 C ATOM 922 CD2 LEU A 233 -3.083 3.715 -2.885 1.00 51.10 C ATOM 0 H LEU A 233 0.206 5.822 -1.270 1.00 45.15 H new ATOM 0 HA LEU A 233 -2.706 5.557 -0.761 1.00 35.41 H new ATOM 0 HB2 LEU A 233 -0.510 3.454 -0.542 1.00 41.42 H new ATOM 0 HB3 LEU A 233 -2.221 3.202 -0.259 1.00 41.42 H new ATOM 0 HG LEU A 233 -0.953 3.871 -2.943 1.00 32.41 H new ATOM 0 HD11 LEU A 233 -1.557 1.544 -3.567 1.00 62.30 H new ATOM 0 HD12 LEU A 233 -0.402 1.593 -2.214 1.00 62.30 H new ATOM 0 HD13 LEU A 233 -2.122 1.255 -1.904 1.00 62.30 H new ATOM 0 HD21 LEU A 233 -3.174 3.399 -3.924 1.00 51.10 H new ATOM 0 HD22 LEU A 233 -3.851 3.224 -2.288 1.00 51.10 H new ATOM 0 HD23 LEU A 233 -3.211 4.796 -2.822 1.00 51.10 H new ATOM 934 N ARG A 234 -2.349 5.661 1.758 1.00 23.45 N ATOM 935 CA ARG A 234 -2.216 5.613 3.214 1.00 34.14 C ATOM 936 C ARG A 234 -3.076 4.467 3.715 1.00 5.21 C ATOM 937 O ARG A 234 -4.283 4.432 3.454 1.00 60.10 O ATOM 938 CB ARG A 234 -2.632 6.963 3.849 1.00 42.23 C ATOM 939 CG ARG A 234 -2.585 7.003 5.387 1.00 31.52 C ATOM 940 CD ARG A 234 -2.712 8.425 5.956 1.00 0.54 C ATOM 941 NE ARG A 234 -1.501 9.214 5.682 1.00 4.24 N ATOM 942 CZ ARG A 234 -1.436 10.322 4.930 1.00 33.13 C ATOM 943 NH1 ARG A 234 -2.514 10.824 4.346 1.00 23.32 N ATOM 944 NH2 ARG A 234 -0.268 10.911 4.755 1.00 75.50 N ATOM 0 H ARG A 234 -3.306 5.821 1.442 1.00 23.45 H new ATOM 0 HA ARG A 234 -1.178 5.445 3.500 1.00 34.14 H new ATOM 0 HB2 ARG A 234 -1.980 7.746 3.461 1.00 42.23 H new ATOM 0 HB3 ARG A 234 -3.645 7.202 3.526 1.00 42.23 H new ATOM 0 HG2 ARG A 234 -3.390 6.385 5.786 1.00 31.52 H new ATOM 0 HG3 ARG A 234 -1.647 6.564 5.728 1.00 31.52 H new ATOM 0 HD2 ARG A 234 -3.579 8.919 5.518 1.00 0.54 H new ATOM 0 HD3 ARG A 234 -2.883 8.376 7.031 1.00 0.54 H new ATOM 0 HE ARG A 234 -0.631 8.888 6.103 1.00 4.24 H new ATOM 0 HH11 ARG A 234 -3.418 10.366 4.464 1.00 23.32 H new ATOM 0 HH12 ARG A 234 -2.440 11.668 3.778 1.00 23.32 H new ATOM 0 HH21 ARG A 234 0.569 10.522 5.189 1.00 75.50 H new ATOM 0 HH22 ARG A 234 -0.203 11.755 4.186 1.00 75.50 H new ATOM 958 N LEU A 235 -2.435 3.509 4.384 1.00 51.32 N ATOM 959 CA LEU A 235 -3.091 2.309 4.891 1.00 12.53 C ATOM 960 C LEU A 235 -3.330 2.479 6.404 1.00 61.10 C ATOM 961 O LEU A 235 -2.583 1.933 7.224 1.00 22.01 O ATOM 962 CB LEU A 235 -2.172 1.085 4.581 1.00 24.31 C ATOM 963 CG LEU A 235 -1.888 0.790 3.071 1.00 0.31 C ATOM 964 CD1 LEU A 235 -0.693 -0.158 2.890 1.00 4.34 C ATOM 965 CD2 LEU A 235 -3.123 0.217 2.379 1.00 32.13 C ATOM 0 H LEU A 235 -1.437 3.547 4.590 1.00 51.32 H new ATOM 0 HA LEU A 235 -4.058 2.146 4.414 1.00 12.53 H new ATOM 0 HB2 LEU A 235 -1.217 1.239 5.084 1.00 24.31 H new ATOM 0 HB3 LEU A 235 -2.625 0.198 5.023 1.00 24.31 H new ATOM 0 HG LEU A 235 -1.637 1.742 2.604 1.00 0.31 H new ATOM 0 HD11 LEU A 235 -0.529 -0.338 1.828 1.00 4.34 H new ATOM 0 HD12 LEU A 235 0.199 0.294 3.324 1.00 4.34 H new ATOM 0 HD13 LEU A 235 -0.900 -1.104 3.390 1.00 4.34 H new ATOM 0 HD21 LEU A 235 -2.895 0.022 1.331 1.00 32.13 H new ATOM 0 HD22 LEU A 235 -3.414 -0.714 2.866 1.00 32.13 H new ATOM 0 HD23 LEU A 235 -3.942 0.933 2.445 1.00 32.13 H new ATOM 977 N LYS A 236 -4.385 3.244 6.762 1.00 25.25 N ATOM 978 CA LYS A 236 -4.788 3.447 8.169 1.00 12.30 C ATOM 979 C LYS A 236 -5.499 2.204 8.688 1.00 4.42 C ATOM 980 O LYS A 236 -6.260 1.561 7.952 1.00 32.11 O ATOM 981 CB LYS A 236 -5.723 4.671 8.354 1.00 11.13 C ATOM 982 CG LYS A 236 -5.039 6.041 8.218 1.00 45.11 C ATOM 983 CD LYS A 236 -5.958 7.192 8.694 1.00 74.12 C ATOM 984 CE LYS A 236 -5.274 8.561 8.648 1.00 43.45 C ATOM 985 NZ LYS A 236 -6.139 9.643 9.196 1.00 71.21 N ATOM 0 H LYS A 236 -4.976 3.734 6.090 1.00 25.25 H new ATOM 0 HA LYS A 236 -3.875 3.636 8.733 1.00 12.30 H new ATOM 0 HB2 LYS A 236 -6.526 4.609 7.620 1.00 11.13 H new ATOM 0 HB3 LYS A 236 -6.186 4.610 9.339 1.00 11.13 H new ATOM 0 HG2 LYS A 236 -4.118 6.047 8.801 1.00 45.11 H new ATOM 0 HG3 LYS A 236 -4.759 6.206 7.178 1.00 45.11 H new ATOM 0 HD2 LYS A 236 -6.852 7.217 8.071 1.00 74.12 H new ATOM 0 HD3 LYS A 236 -6.286 6.990 9.714 1.00 74.12 H new ATOM 0 HE2 LYS A 236 -4.344 8.520 9.215 1.00 43.45 H new ATOM 0 HE3 LYS A 236 -5.008 8.798 7.618 1.00 43.45 H new ATOM 0 HZ1 LYS A 236 -5.634 10.551 9.144 1.00 71.21 H new ATOM 0 HZ2 LYS A 236 -7.016 9.702 8.639 1.00 71.21 H new ATOM 0 HZ3 LYS A 236 -6.372 9.433 10.187 1.00 71.21 H new ATOM 999 N GLY A 237 -5.268 1.897 9.976 1.00 2.10 N ATOM 1000 CA GLY A 237 -5.775 0.674 10.583 1.00 63.11 C ATOM 1001 C GLY A 237 -5.100 -0.571 10.026 1.00 44.45 C ATOM 1002 O GLY A 237 -5.603 -1.684 10.196 1.00 5.42 O ATOM 0 H GLY A 237 -4.731 2.487 10.611 1.00 2.10 H new ATOM 0 HA2 GLY A 237 -5.622 0.716 11.661 1.00 63.11 H new ATOM 0 HA3 GLY A 237 -6.850 0.607 10.416 1.00 63.11 H new ATOM 1006 N LYS A 238 -3.926 -0.364 9.385 1.00 54.44 N ATOM 1007 CA LYS A 238 -3.165 -1.413 8.685 1.00 70.24 C ATOM 1008 C LYS A 238 -1.686 -1.407 9.133 1.00 63.42 C ATOM 1009 O LYS A 238 -1.051 -2.451 9.133 1.00 33.52 O ATOM 1010 CB LYS A 238 -3.217 -1.204 7.138 1.00 3.15 C ATOM 1011 CG LYS A 238 -4.612 -1.028 6.465 1.00 13.43 C ATOM 1012 CD LYS A 238 -5.353 -2.348 6.125 1.00 63.22 C ATOM 1013 CE LYS A 238 -5.986 -3.026 7.340 1.00 14.10 C ATOM 1014 NZ LYS A 238 -6.813 -4.195 6.960 1.00 54.03 N ATOM 0 H LYS A 238 -3.478 0.552 9.342 1.00 54.44 H new ATOM 0 HA LYS A 238 -3.623 -2.369 8.938 1.00 70.24 H new ATOM 0 HB2 LYS A 238 -2.619 -0.324 6.901 1.00 3.15 H new ATOM 0 HB3 LYS A 238 -2.727 -2.058 6.670 1.00 3.15 H new ATOM 0 HG2 LYS A 238 -5.244 -0.435 7.126 1.00 13.43 H new ATOM 0 HG3 LYS A 238 -4.485 -0.455 5.547 1.00 13.43 H new ATOM 0 HD2 LYS A 238 -6.130 -2.139 5.390 1.00 63.22 H new ATOM 0 HD3 LYS A 238 -4.651 -3.039 5.659 1.00 63.22 H new ATOM 0 HE2 LYS A 238 -5.201 -3.346 8.026 1.00 14.10 H new ATOM 0 HE3 LYS A 238 -6.603 -2.305 7.876 1.00 14.10 H new ATOM 0 HZ1 LYS A 238 -7.676 -4.213 7.540 1.00 54.03 H new ATOM 0 HZ2 LYS A 238 -7.072 -4.125 5.955 1.00 54.03 H new ATOM 0 HZ3 LYS A 238 -6.272 -5.069 7.117 1.00 54.03 H new ATOM 1028 N GLY A 239 -1.158 -0.211 9.506 1.00 54.54 N ATOM 1029 CA GLY A 239 0.287 -0.014 9.779 1.00 35.33 C ATOM 1030 C GLY A 239 0.815 -0.756 11.015 1.00 64.41 C ATOM 1031 O GLY A 239 0.663 -1.977 11.119 1.00 23.21 O ATOM 0 H GLY A 239 -1.717 0.634 9.624 1.00 54.54 H new ATOM 0 HA2 GLY A 239 0.855 -0.339 8.907 1.00 35.33 H new ATOM 0 HA3 GLY A 239 0.477 1.052 9.904 1.00 35.33 H new ATOM 1035 N PHE A 240 1.460 -0.026 11.949 1.00 31.31 N ATOM 1036 CA PHE A 240 1.970 -0.627 13.204 1.00 22.03 C ATOM 1037 C PHE A 240 0.785 -1.067 14.097 1.00 55.22 C ATOM 1038 O PHE A 240 -0.186 -0.312 14.212 1.00 35.24 O ATOM 1039 CB PHE A 240 2.890 0.361 13.983 1.00 63.23 C ATOM 1040 CG PHE A 240 4.383 0.059 13.925 1.00 64.31 C ATOM 1041 CD1 PHE A 240 5.121 0.306 12.775 1.00 14.01 C ATOM 1042 CD2 PHE A 240 5.049 -0.453 15.034 1.00 11.42 C ATOM 1043 CE1 PHE A 240 6.478 0.053 12.742 1.00 33.42 C ATOM 1044 CE2 PHE A 240 6.402 -0.707 14.995 1.00 41.25 C ATOM 1045 CZ PHE A 240 7.118 -0.453 13.855 1.00 22.24 C ATOM 0 H PHE A 240 1.640 0.974 11.861 1.00 31.31 H new ATOM 0 HA PHE A 240 2.569 -1.498 12.939 1.00 22.03 H new ATOM 0 HB2 PHE A 240 2.726 1.366 13.593 1.00 63.23 H new ATOM 0 HB3 PHE A 240 2.580 0.370 15.028 1.00 63.23 H new ATOM 0 HD1 PHE A 240 4.629 0.700 11.898 1.00 14.01 H new ATOM 0 HD2 PHE A 240 4.496 -0.654 15.940 1.00 11.42 H new ATOM 0 HE1 PHE A 240 7.041 0.252 11.842 1.00 33.42 H new ATOM 0 HE2 PHE A 240 6.900 -1.108 15.866 1.00 41.25 H new ATOM 0 HZ PHE A 240 8.180 -0.648 13.827 1.00 22.24 H new ATOM 1055 N PRO A 241 0.846 -2.303 14.703 1.00 3.44 N ATOM 1056 CA PRO A 241 -0.171 -2.819 15.657 1.00 63.12 C ATOM 1057 C PRO A 241 -0.670 -1.788 16.700 1.00 11.20 C ATOM 1058 O PRO A 241 0.112 -1.010 17.257 1.00 74.42 O ATOM 1059 CB PRO A 241 0.568 -3.981 16.340 1.00 15.30 C ATOM 1060 CG PRO A 241 1.431 -4.537 15.252 1.00 73.52 C ATOM 1061 CD PRO A 241 1.897 -3.336 14.447 1.00 34.41 C ATOM 0 HA PRO A 241 -1.088 -3.098 15.139 1.00 63.12 H new ATOM 0 HB2 PRO A 241 1.162 -3.636 17.186 1.00 15.30 H new ATOM 0 HB3 PRO A 241 -0.127 -4.729 16.722 1.00 15.30 H new ATOM 0 HG2 PRO A 241 2.278 -5.085 15.665 1.00 73.52 H new ATOM 0 HG3 PRO A 241 0.874 -5.235 14.628 1.00 73.52 H new ATOM 0 HD2 PRO A 241 2.880 -2.995 14.771 1.00 34.41 H new ATOM 0 HD3 PRO A 241 1.975 -3.572 13.386 1.00 34.41 H new ATOM 1069 N GLY A 242 -1.987 -1.818 16.933 1.00 74.44 N ATOM 1070 CA GLY A 242 -2.665 -0.925 17.864 1.00 61.23 C ATOM 1071 C GLY A 242 -4.059 -1.479 18.169 1.00 12.23 C ATOM 1072 O GLY A 242 -4.881 -1.536 17.248 1.00 71.23 O ATOM 0 H GLY A 242 -2.616 -2.475 16.471 1.00 74.44 H new ATOM 0 HA2 GLY A 242 -2.088 -0.833 18.784 1.00 61.23 H new ATOM 0 HA3 GLY A 242 -2.743 0.074 17.436 1.00 61.23 H new ATOM 1076 N PRO A 243 -4.358 -1.933 19.436 1.00 54.40 N ATOM 1077 CA PRO A 243 -5.639 -2.621 19.778 1.00 72.11 C ATOM 1078 C PRO A 243 -6.892 -1.745 19.524 1.00 65.43 C ATOM 1079 O PRO A 243 -7.918 -2.242 19.036 1.00 53.42 O ATOM 1080 CB PRO A 243 -5.473 -2.976 21.284 1.00 64.35 C ATOM 1081 CG PRO A 243 -4.394 -2.060 21.786 1.00 14.43 C ATOM 1082 CD PRO A 243 -3.462 -1.828 20.620 1.00 65.41 C ATOM 0 HA PRO A 243 -5.810 -3.494 19.149 1.00 72.11 H new ATOM 0 HB2 PRO A 243 -6.404 -2.824 21.830 1.00 64.35 H new ATOM 0 HB3 PRO A 243 -5.194 -4.022 21.414 1.00 64.35 H new ATOM 0 HG2 PRO A 243 -4.816 -1.119 22.140 1.00 14.43 H new ATOM 0 HG3 PRO A 243 -3.863 -2.508 22.626 1.00 14.43 H new ATOM 0 HD2 PRO A 243 -2.984 -0.850 20.676 1.00 65.41 H new ATOM 0 HD3 PRO A 243 -2.665 -2.571 20.588 1.00 65.41 H new ATOM 1090 N ALA A 244 -6.795 -0.443 19.855 1.00 61.42 N ATOM 1091 CA ALA A 244 -7.878 0.536 19.608 1.00 1.42 C ATOM 1092 C ALA A 244 -7.913 0.950 18.126 1.00 13.15 C ATOM 1093 O ALA A 244 -8.958 1.373 17.615 1.00 44.24 O ATOM 1094 CB ALA A 244 -7.706 1.767 20.514 1.00 32.34 C ATOM 0 H ALA A 244 -5.970 -0.039 20.299 1.00 61.42 H new ATOM 0 HA ALA A 244 -8.830 0.063 19.848 1.00 1.42 H new ATOM 0 HB1 ALA A 244 -8.510 2.477 20.320 1.00 32.34 H new ATOM 0 HB2 ALA A 244 -7.739 1.457 21.559 1.00 32.34 H new ATOM 0 HB3 ALA A 244 -6.746 2.240 20.306 1.00 32.34 H new ATOM 1100 N GLY A 245 -6.762 0.831 17.454 1.00 52.32 N ATOM 1101 CA GLY A 245 -6.633 1.166 16.040 1.00 23.20 C ATOM 1102 C GLY A 245 -5.176 1.187 15.617 1.00 71.31 C ATOM 1103 O GLY A 245 -4.360 1.845 16.271 1.00 65.30 O ATOM 0 H GLY A 245 -5.896 0.499 17.880 1.00 52.32 H new ATOM 0 HA2 GLY A 245 -7.179 0.439 15.439 1.00 23.20 H new ATOM 0 HA3 GLY A 245 -7.084 2.140 15.851 1.00 23.20 H new ATOM 1107 N ARG A 246 -4.847 0.442 14.548 1.00 53.15 N ATOM 1108 CA ARG A 246 -3.480 0.383 13.997 1.00 73.33 C ATOM 1109 C ARG A 246 -3.121 1.729 13.343 1.00 4.41 C ATOM 1110 O ARG A 246 -4.012 2.518 12.993 1.00 72.03 O ATOM 1111 CB ARG A 246 -3.363 -0.766 12.948 1.00 35.22 C ATOM 1112 CG ARG A 246 -2.984 -2.139 13.522 1.00 41.44 C ATOM 1113 CD ARG A 246 -2.691 -3.189 12.435 1.00 64.01 C ATOM 1114 NE ARG A 246 -3.882 -3.540 11.639 1.00 34.44 N ATOM 1115 CZ ARG A 246 -3.942 -4.545 10.744 1.00 70.11 C ATOM 1116 NH1 ARG A 246 -2.878 -5.320 10.506 1.00 44.10 N ATOM 1117 NH2 ARG A 246 -5.084 -4.774 10.102 1.00 0.43 N ATOM 0 H ARG A 246 -5.518 -0.135 14.042 1.00 53.15 H new ATOM 0 HA ARG A 246 -2.784 0.182 14.812 1.00 73.33 H new ATOM 0 HB2 ARG A 246 -4.316 -0.858 12.426 1.00 35.22 H new ATOM 0 HB3 ARG A 246 -2.618 -0.483 12.204 1.00 35.22 H new ATOM 0 HG2 ARG A 246 -2.106 -2.030 14.159 1.00 41.44 H new ATOM 0 HG3 ARG A 246 -3.795 -2.498 14.156 1.00 41.44 H new ATOM 0 HD2 ARG A 246 -1.915 -2.809 11.770 1.00 64.01 H new ATOM 0 HD3 ARG A 246 -2.296 -4.090 12.904 1.00 64.01 H new ATOM 0 HE ARG A 246 -4.723 -2.980 11.776 1.00 34.44 H new ATOM 0 HH11 ARG A 246 -2.004 -5.154 11.006 1.00 44.10 H new ATOM 0 HH12 ARG A 246 -2.940 -6.077 9.825 1.00 44.10 H new ATOM 0 HH21 ARG A 246 -5.900 -4.192 10.290 1.00 0.43 H new ATOM 0 HH22 ARG A 246 -5.144 -5.532 9.422 1.00 0.43 H new ATOM 1131 N GLY A 247 -1.815 1.976 13.184 1.00 73.44 N ATOM 1132 CA GLY A 247 -1.317 3.169 12.496 1.00 11.52 C ATOM 1133 C GLY A 247 -1.493 3.099 10.987 1.00 75.14 C ATOM 1134 O GLY A 247 -2.360 2.364 10.488 1.00 3.33 O ATOM 0 H GLY A 247 -1.080 1.358 13.527 1.00 73.44 H new ATOM 0 HA2 GLY A 247 -1.839 4.047 12.877 1.00 11.52 H new ATOM 0 HA3 GLY A 247 -0.260 3.301 12.728 1.00 11.52 H new ATOM 1138 N ASP A 248 -0.677 3.860 10.237 1.00 24.10 N ATOM 1139 CA ASP A 248 -0.757 3.871 8.771 1.00 4.30 C ATOM 1140 C ASP A 248 0.570 3.489 8.123 1.00 25.42 C ATOM 1141 O ASP A 248 1.644 3.906 8.573 1.00 33.23 O ATOM 1142 CB ASP A 248 -1.295 5.220 8.210 1.00 45.54 C ATOM 1143 CG ASP A 248 -0.319 6.415 8.266 1.00 70.25 C ATOM 1144 OD1 ASP A 248 -0.363 7.185 9.246 1.00 12.41 O ATOM 1145 OD2 ASP A 248 0.461 6.613 7.300 1.00 21.42 O ATOM 0 H ASP A 248 0.042 4.472 10.623 1.00 24.10 H new ATOM 0 HA ASP A 248 -1.485 3.106 8.503 1.00 4.30 H new ATOM 0 HB2 ASP A 248 -1.591 5.067 7.172 1.00 45.54 H new ATOM 0 HB3 ASP A 248 -2.196 5.487 8.762 1.00 45.54 H new ATOM 1150 N LEU A 249 0.474 2.639 7.092 1.00 31.15 N ATOM 1151 CA LEU A 249 1.569 2.333 6.170 1.00 2.15 C ATOM 1152 C LEU A 249 1.332 3.153 4.894 1.00 42.10 C ATOM 1153 O LEU A 249 0.443 2.849 4.092 1.00 31.45 O ATOM 1154 CB LEU A 249 1.625 0.802 5.896 1.00 51.44 C ATOM 1155 CG LEU A 249 2.586 0.295 4.758 1.00 20.14 C ATOM 1156 CD1 LEU A 249 4.053 0.725 4.969 1.00 73.12 C ATOM 1157 CD2 LEU A 249 2.469 -1.237 4.590 1.00 74.30 C ATOM 0 H LEU A 249 -0.386 2.136 6.874 1.00 31.15 H new ATOM 0 HA LEU A 249 2.537 2.602 6.592 1.00 2.15 H new ATOM 0 HB2 LEU A 249 1.913 0.306 6.823 1.00 51.44 H new ATOM 0 HB3 LEU A 249 0.616 0.468 5.656 1.00 51.44 H new ATOM 0 HG LEU A 249 2.261 0.775 3.835 1.00 20.14 H new ATOM 0 HD11 LEU A 249 4.665 0.345 4.151 1.00 73.12 H new ATOM 0 HD12 LEU A 249 4.114 1.813 4.992 1.00 73.12 H new ATOM 0 HD13 LEU A 249 4.418 0.322 5.913 1.00 73.12 H new ATOM 0 HD21 LEU A 249 3.141 -1.569 3.799 1.00 74.30 H new ATOM 0 HD22 LEU A 249 2.740 -1.727 5.525 1.00 74.30 H new ATOM 0 HD23 LEU A 249 1.443 -1.497 4.328 1.00 74.30 H new ATOM 1169 N TYR A 250 2.106 4.217 4.730 1.00 65.12 N ATOM 1170 CA TYR A 250 2.003 5.140 3.604 1.00 52.40 C ATOM 1171 C TYR A 250 2.907 4.639 2.459 1.00 23.12 C ATOM 1172 O TYR A 250 4.142 4.677 2.568 1.00 72.43 O ATOM 1173 CB TYR A 250 2.378 6.567 4.083 1.00 14.22 C ATOM 1174 CG TYR A 250 2.256 7.667 3.018 1.00 13.11 C ATOM 1175 CD1 TYR A 250 1.012 8.206 2.671 1.00 62.24 C ATOM 1176 CD2 TYR A 250 3.384 8.167 2.360 1.00 72.01 C ATOM 1177 CE1 TYR A 250 0.904 9.197 1.715 1.00 15.55 C ATOM 1178 CE2 TYR A 250 3.277 9.156 1.408 1.00 50.34 C ATOM 1179 CZ TYR A 250 2.040 9.666 1.090 1.00 15.32 C ATOM 1180 OH TYR A 250 1.945 10.653 0.136 1.00 25.02 O ATOM 0 H TYR A 250 2.841 4.470 5.391 1.00 65.12 H new ATOM 0 HA TYR A 250 0.984 5.182 3.221 1.00 52.40 H new ATOM 0 HB2 TYR A 250 1.741 6.829 4.928 1.00 14.22 H new ATOM 0 HB3 TYR A 250 3.404 6.552 4.451 1.00 14.22 H new ATOM 0 HD1 TYR A 250 0.121 7.841 3.159 1.00 62.24 H new ATOM 0 HD2 TYR A 250 4.358 7.770 2.603 1.00 72.01 H new ATOM 0 HE1 TYR A 250 -0.064 9.602 1.459 1.00 15.55 H new ATOM 0 HE2 TYR A 250 4.161 9.530 0.913 1.00 50.34 H new ATOM 0 HH TYR A 250 2.839 10.868 -0.203 1.00 25.02 H new ATOM 1190 N LEU A 251 2.276 4.125 1.386 1.00 42.23 N ATOM 1191 CA LEU A 251 2.959 3.520 0.229 1.00 34.44 C ATOM 1192 C LEU A 251 2.806 4.418 -1.013 1.00 73.41 C ATOM 1193 O LEU A 251 1.705 4.558 -1.556 1.00 2.34 O ATOM 1194 CB LEU A 251 2.386 2.100 -0.044 1.00 33.51 C ATOM 1195 CG LEU A 251 2.802 0.991 0.965 1.00 21.23 C ATOM 1196 CD1 LEU A 251 2.102 -0.339 0.643 1.00 34.21 C ATOM 1197 CD2 LEU A 251 4.335 0.815 1.001 1.00 65.10 C ATOM 0 H LEU A 251 1.260 4.119 1.298 1.00 42.23 H new ATOM 0 HA LEU A 251 4.022 3.428 0.453 1.00 34.44 H new ATOM 0 HB2 LEU A 251 1.298 2.165 -0.054 1.00 33.51 H new ATOM 0 HB3 LEU A 251 2.696 1.790 -1.042 1.00 33.51 H new ATOM 0 HG LEU A 251 2.481 1.308 1.957 1.00 21.23 H new ATOM 0 HD11 LEU A 251 2.411 -1.096 1.364 1.00 34.21 H new ATOM 0 HD12 LEU A 251 1.022 -0.204 0.698 1.00 34.21 H new ATOM 0 HD13 LEU A 251 2.376 -0.661 -0.362 1.00 34.21 H new ATOM 0 HD21 LEU A 251 4.595 0.033 1.715 1.00 65.10 H new ATOM 0 HD22 LEU A 251 4.692 0.535 0.010 1.00 65.10 H new ATOM 0 HD23 LEU A 251 4.802 1.752 1.303 1.00 65.10 H new ATOM 1209 N GLU A 252 3.917 5.029 -1.449 1.00 61.13 N ATOM 1210 CA GLU A 252 3.953 5.867 -2.665 1.00 3.05 C ATOM 1211 C GLU A 252 4.055 4.969 -3.911 1.00 74.54 C ATOM 1212 O GLU A 252 5.092 4.329 -4.124 1.00 55.22 O ATOM 1213 CB GLU A 252 5.160 6.842 -2.594 1.00 3.22 C ATOM 1214 CG GLU A 252 5.107 7.829 -1.409 1.00 74.54 C ATOM 1215 CD GLU A 252 6.390 8.664 -1.265 1.00 55.14 C ATOM 1216 OE1 GLU A 252 6.576 9.632 -2.033 1.00 70.42 O ATOM 1217 OE2 GLU A 252 7.227 8.348 -0.389 1.00 51.14 O ATOM 0 H GLU A 252 4.816 4.959 -0.973 1.00 61.13 H new ATOM 0 HA GLU A 252 3.036 6.453 -2.732 1.00 3.05 H new ATOM 0 HB2 GLU A 252 6.079 6.260 -2.527 1.00 3.22 H new ATOM 0 HB3 GLU A 252 5.209 7.410 -3.523 1.00 3.22 H new ATOM 0 HG2 GLU A 252 4.257 8.499 -1.539 1.00 74.54 H new ATOM 0 HG3 GLU A 252 4.937 7.273 -0.487 1.00 74.54 H new ATOM 1224 N VAL A 253 2.965 4.914 -4.706 1.00 71.01 N ATOM 1225 CA VAL A 253 2.894 4.096 -5.933 1.00 63.30 C ATOM 1226 C VAL A 253 3.986 4.513 -6.940 1.00 44.11 C ATOM 1227 O VAL A 253 3.963 5.620 -7.493 1.00 14.42 O ATOM 1228 CB VAL A 253 1.485 4.181 -6.631 1.00 31.20 C ATOM 1229 CG1 VAL A 253 1.467 3.368 -7.955 1.00 23.33 C ATOM 1230 CG2 VAL A 253 0.360 3.732 -5.665 1.00 3.14 C ATOM 0 H VAL A 253 2.110 5.436 -4.514 1.00 71.01 H new ATOM 0 HA VAL A 253 3.057 3.064 -5.622 1.00 63.30 H new ATOM 0 HB VAL A 253 1.296 5.223 -6.889 1.00 31.20 H new ATOM 0 HG11 VAL A 253 0.482 3.444 -8.416 1.00 23.33 H new ATOM 0 HG12 VAL A 253 2.218 3.766 -8.637 1.00 23.33 H new ATOM 0 HG13 VAL A 253 1.688 2.322 -7.743 1.00 23.33 H new ATOM 0 HG21 VAL A 253 -0.603 3.800 -6.171 1.00 3.14 H new ATOM 0 HG22 VAL A 253 0.536 2.702 -5.356 1.00 3.14 H new ATOM 0 HG23 VAL A 253 0.355 4.378 -4.787 1.00 3.14 H new ATOM 1240 N ARG A 254 4.953 3.617 -7.121 1.00 33.50 N ATOM 1241 CA ARG A 254 6.023 3.725 -8.111 1.00 25.22 C ATOM 1242 C ARG A 254 5.847 2.607 -9.137 1.00 44.12 C ATOM 1243 O ARG A 254 5.986 1.426 -8.794 1.00 34.40 O ATOM 1244 CB ARG A 254 7.400 3.610 -7.407 1.00 31.44 C ATOM 1245 CG ARG A 254 7.674 4.731 -6.391 1.00 20.21 C ATOM 1246 CD ARG A 254 7.620 6.119 -7.036 1.00 74.53 C ATOM 1247 NE ARG A 254 8.584 6.234 -8.146 1.00 62.02 N ATOM 1248 CZ ARG A 254 8.572 7.176 -9.097 1.00 12.32 C ATOM 1249 NH1 ARG A 254 7.645 8.130 -9.106 1.00 35.54 N ATOM 1250 NH2 ARG A 254 9.505 7.158 -10.043 1.00 51.31 N ATOM 0 H ARG A 254 5.016 2.765 -6.563 1.00 33.50 H new ATOM 0 HA ARG A 254 5.978 4.690 -8.615 1.00 25.22 H new ATOM 0 HB2 ARG A 254 7.457 2.648 -6.897 1.00 31.44 H new ATOM 0 HB3 ARG A 254 8.186 3.618 -8.163 1.00 31.44 H new ATOM 0 HG2 ARG A 254 6.941 4.677 -5.586 1.00 20.21 H new ATOM 0 HG3 ARG A 254 8.655 4.579 -5.940 1.00 20.21 H new ATOM 0 HD2 ARG A 254 6.613 6.311 -7.405 1.00 74.53 H new ATOM 0 HD3 ARG A 254 7.835 6.879 -6.285 1.00 74.53 H new ATOM 0 HE ARG A 254 9.325 5.534 -8.193 1.00 62.02 H new ATOM 0 HH11 ARG A 254 6.928 8.152 -8.381 1.00 35.54 H new ATOM 0 HH12 ARG A 254 7.651 8.840 -9.838 1.00 35.54 H new ATOM 0 HH21 ARG A 254 10.221 6.431 -10.040 1.00 51.31 H new ATOM 0 HH22 ARG A 254 9.505 7.871 -10.773 1.00 51.31 H new ATOM 1264 N ILE A 255 5.522 2.980 -10.387 1.00 50.21 N ATOM 1265 CA ILE A 255 5.355 2.018 -11.480 1.00 61.54 C ATOM 1266 C ILE A 255 6.742 1.538 -11.951 1.00 10.40 C ATOM 1267 O ILE A 255 7.615 2.355 -12.267 1.00 32.54 O ATOM 1268 CB ILE A 255 4.535 2.616 -12.688 1.00 13.22 C ATOM 1269 CG1 ILE A 255 3.052 2.889 -12.274 1.00 73.21 C ATOM 1270 CG2 ILE A 255 4.597 1.701 -13.938 1.00 73.42 C ATOM 1271 CD1 ILE A 255 2.172 3.445 -13.384 1.00 10.31 C ATOM 0 H ILE A 255 5.370 3.950 -10.662 1.00 50.21 H new ATOM 0 HA ILE A 255 4.779 1.174 -11.101 1.00 61.54 H new ATOM 0 HB ILE A 255 4.999 3.565 -12.956 1.00 13.22 H new ATOM 0 HG12 ILE A 255 2.613 1.959 -11.913 1.00 73.21 H new ATOM 0 HG13 ILE A 255 3.046 3.590 -11.439 1.00 73.21 H new ATOM 0 HG21 ILE A 255 4.020 2.150 -14.746 1.00 73.42 H new ATOM 0 HG22 ILE A 255 5.634 1.586 -14.253 1.00 73.42 H new ATOM 0 HG23 ILE A 255 4.181 0.723 -13.694 1.00 73.42 H new ATOM 0 HD11 ILE A 255 1.163 3.602 -13.004 1.00 10.31 H new ATOM 0 HD12 ILE A 255 2.581 4.394 -13.732 1.00 10.31 H new ATOM 0 HD13 ILE A 255 2.141 2.738 -14.213 1.00 10.31 H new ATOM 1283 N THR A 256 6.927 0.207 -11.970 1.00 70.45 N ATOM 1284 CA THR A 256 8.175 -0.445 -12.378 1.00 71.44 C ATOM 1285 C THR A 256 8.003 -0.984 -13.818 1.00 30.34 C ATOM 1286 O THR A 256 7.098 -1.814 -14.041 1.00 70.42 O ATOM 1287 CB THR A 256 8.559 -1.586 -11.363 1.00 54.33 C ATOM 1288 OG1 THR A 256 7.483 -2.524 -11.217 1.00 73.43 O ATOM 1289 CG2 THR A 256 8.893 -1.017 -9.975 1.00 72.53 C ATOM 1290 OXT THR A 256 8.738 -0.553 -14.730 1.00 37.89 O ATOM 0 H THR A 256 6.199 -0.453 -11.697 1.00 70.45 H new ATOM 0 HA THR A 256 8.996 0.272 -12.369 1.00 71.44 H new ATOM 0 HB THR A 256 9.438 -2.085 -11.771 1.00 54.33 H new ATOM 0 HG1 THR A 256 7.744 -3.225 -10.584 1.00 73.43 H new ATOM 0 HG21 THR A 256 9.153 -1.833 -9.300 1.00 72.53 H new ATOM 0 HG22 THR A 256 9.736 -0.330 -10.056 1.00 72.53 H new ATOM 0 HG23 THR A 256 8.027 -0.484 -9.582 1.00 72.53 H new