USER MOD reduce.3.24.130724 H: found=0, std=0, add=444, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 444 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot -40:sc= 1.11 USER MOD Single : B 153 SER OG : rot 180:sc= 0 USER MOD Single : B 156 SER OG : rot -40:sc= 1.03 USER MOD Single : B 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 120 N PRO A 50 2.832 22.275 -5.341 1.00 42.14 N ATOM 121 CA PRO A 50 1.853 21.184 -5.348 1.00 43.24 C ATOM 122 C PRO A 50 2.404 19.915 -5.990 1.00 34.44 C ATOM 123 O PRO A 50 1.835 18.833 -5.839 1.00 74.33 O ATOM 124 CB PRO A 50 0.699 21.747 -6.181 1.00 45.53 C ATOM 125 CG PRO A 50 1.331 22.769 -7.061 1.00 73.41 C ATOM 126 CD PRO A 50 2.462 23.360 -6.264 1.00 34.32 C ATOM 0 HA PRO A 50 1.564 20.890 -4.339 1.00 43.24 H new ATOM 0 HB2 PRO A 50 0.215 20.965 -6.766 1.00 45.53 H new ATOM 0 HB3 PRO A 50 -0.068 22.191 -5.546 1.00 45.53 H new ATOM 0 HG2 PRO A 50 1.698 22.317 -7.983 1.00 73.41 H new ATOM 0 HG3 PRO A 50 0.612 23.537 -7.346 1.00 73.41 H new ATOM 0 HD2 PRO A 50 3.297 23.646 -6.903 1.00 34.32 H new ATOM 0 HD3 PRO A 50 2.150 24.256 -5.727 1.00 34.32 H new ATOM 134 N LEU A 51 3.514 20.055 -6.707 1.00 15.21 N ATOM 135 CA LEU A 51 4.142 18.919 -7.373 1.00 32.34 C ATOM 136 C LEU A 51 4.370 17.772 -6.395 1.00 50.40 C ATOM 137 O LEU A 51 4.200 16.602 -6.740 1.00 32.52 O ATOM 138 CB LEU A 51 5.472 19.342 -8.000 1.00 34.35 C ATOM 139 CG LEU A 51 5.421 19.748 -9.473 1.00 35.45 C ATOM 140 CD1 LEU A 51 6.660 20.543 -9.852 1.00 1.43 C ATOM 141 CD2 LEU A 51 5.283 18.519 -10.361 1.00 5.55 C ATOM 0 H LEU A 51 3.997 20.943 -6.842 1.00 15.21 H new ATOM 0 HA LEU A 51 3.470 18.573 -8.159 1.00 32.34 H new ATOM 0 HB2 LEU A 51 5.871 20.179 -7.427 1.00 34.35 H new ATOM 0 HB3 LEU A 51 6.178 18.518 -7.895 1.00 34.35 H new ATOM 0 HG LEU A 51 4.547 20.382 -9.624 1.00 35.45 H new ATOM 0 HD11 LEU A 51 6.605 20.823 -10.904 1.00 1.43 H new ATOM 0 HD12 LEU A 51 6.716 21.443 -9.240 1.00 1.43 H new ATOM 0 HD13 LEU A 51 7.548 19.934 -9.684 1.00 1.43 H new ATOM 0 HD21 LEU A 51 5.248 18.827 -11.406 1.00 5.55 H new ATOM 0 HD22 LEU A 51 6.137 17.860 -10.205 1.00 5.55 H new ATOM 0 HD23 LEU A 51 4.365 17.989 -10.108 1.00 5.55 H new ATOM 153 N THR A 52 4.754 18.115 -5.169 1.00 25.40 N ATOM 154 CA THR A 52 5.006 17.114 -4.139 1.00 14.15 C ATOM 155 C THR A 52 3.821 16.165 -3.994 1.00 15.00 C ATOM 156 O THR A 52 3.989 14.994 -3.655 1.00 11.30 O ATOM 157 CB THR A 52 5.291 17.771 -2.776 1.00 25.32 C ATOM 158 OG1 THR A 52 6.279 18.797 -2.924 1.00 15.02 O ATOM 159 CG2 THR A 52 5.774 16.738 -1.768 1.00 10.13 C ATOM 0 H THR A 52 4.897 19.078 -4.865 1.00 25.40 H new ATOM 0 HA THR A 52 5.884 16.550 -4.454 1.00 14.15 H new ATOM 0 HB THR A 52 4.364 18.210 -2.408 1.00 25.32 H new ATOM 0 HG1 THR A 52 6.453 19.211 -2.053 1.00 15.02 H new ATOM 0 HG21 THR A 52 5.969 17.225 -0.813 1.00 10.13 H new ATOM 0 HG22 THR A 52 5.009 15.973 -1.636 1.00 10.13 H new ATOM 0 HG23 THR A 52 6.691 16.275 -2.133 1.00 10.13 H new ATOM 167 N SER A 53 2.623 16.678 -4.255 1.00 12.35 N ATOM 168 CA SER A 53 1.409 15.876 -4.150 1.00 53.11 C ATOM 169 C SER A 53 1.363 14.815 -5.245 1.00 33.43 C ATOM 170 O SER A 53 1.268 13.620 -4.963 1.00 60.41 O ATOM 171 CB SER A 53 0.172 16.772 -4.240 1.00 2.34 C ATOM 172 OG SER A 53 -0.994 16.073 -3.837 1.00 33.43 O ATOM 0 H SER A 53 2.467 17.645 -4.541 1.00 12.35 H new ATOM 0 HA SER A 53 1.416 15.374 -3.182 1.00 53.11 H new ATOM 0 HB2 SER A 53 0.309 17.651 -3.610 1.00 2.34 H new ATOM 0 HB3 SER A 53 0.051 17.129 -5.263 1.00 2.34 H new ATOM 0 HG SER A 53 -1.770 16.667 -3.902 1.00 33.43 H new ATOM 178 N ILE A 54 1.430 15.261 -6.496 1.00 60.23 N ATOM 179 CA ILE A 54 1.398 14.350 -7.634 1.00 11.53 C ATOM 180 C ILE A 54 2.428 13.237 -7.477 1.00 53.40 C ATOM 181 O ILE A 54 2.134 12.067 -7.722 1.00 54.13 O ATOM 182 CB ILE A 54 1.658 15.094 -8.957 1.00 34.13 C ATOM 183 CG1 ILE A 54 0.623 16.203 -9.158 1.00 4.53 C ATOM 184 CG2 ILE A 54 1.632 14.120 -10.126 1.00 2.41 C ATOM 185 CD1 ILE A 54 -0.803 15.697 -9.201 1.00 45.14 C ATOM 0 H ILE A 54 1.507 16.247 -6.747 1.00 60.23 H new ATOM 0 HA ILE A 54 0.399 13.914 -7.662 1.00 11.53 H new ATOM 0 HB ILE A 54 2.647 15.551 -8.911 1.00 34.13 H new ATOM 0 HG12 ILE A 54 0.718 16.929 -8.351 1.00 4.53 H new ATOM 0 HG13 ILE A 54 0.842 16.729 -10.087 1.00 4.53 H new ATOM 0 HG21 ILE A 54 1.817 14.661 -11.054 1.00 2.41 H new ATOM 0 HG22 ILE A 54 2.404 13.363 -9.986 1.00 2.41 H new ATOM 0 HG23 ILE A 54 0.656 13.637 -10.176 1.00 2.41 H new ATOM 0 HD11 ILE A 54 -1.483 16.537 -9.346 1.00 45.14 H new ATOM 0 HD12 ILE A 54 -0.915 14.993 -10.026 1.00 45.14 H new ATOM 0 HD13 ILE A 54 -1.040 15.196 -8.262 1.00 45.14 H new ATOM 197 N ILE A 55 3.635 13.611 -7.066 1.00 25.21 N ATOM 198 CA ILE A 55 4.709 12.644 -6.873 1.00 22.25 C ATOM 199 C ILE A 55 4.403 11.708 -5.708 1.00 20.22 C ATOM 200 O ILE A 55 4.583 10.495 -5.809 1.00 22.22 O ATOM 201 CB ILE A 55 6.056 13.342 -6.617 1.00 63.21 C ATOM 202 CG1 ILE A 55 6.352 14.352 -7.727 1.00 73.21 C ATOM 203 CG2 ILE A 55 7.175 12.315 -6.515 1.00 34.22 C ATOM 204 CD1 ILE A 55 6.530 13.718 -9.089 1.00 73.12 C ATOM 0 H ILE A 55 3.894 14.576 -6.860 1.00 25.21 H new ATOM 0 HA ILE A 55 4.780 12.064 -7.793 1.00 22.25 H new ATOM 0 HB ILE A 55 5.995 13.879 -5.670 1.00 63.21 H new ATOM 0 HG12 ILE A 55 5.538 15.075 -7.775 1.00 73.21 H new ATOM 0 HG13 ILE A 55 7.256 14.906 -7.472 1.00 73.21 H new ATOM 0 HG21 ILE A 55 8.121 12.825 -6.334 1.00 34.22 H new ATOM 0 HG22 ILE A 55 6.968 11.631 -5.692 1.00 34.22 H new ATOM 0 HG23 ILE A 55 7.238 11.752 -7.446 1.00 34.22 H new ATOM 0 HD11 ILE A 55 6.737 14.493 -9.827 1.00 73.12 H new ATOM 0 HD12 ILE A 55 7.363 13.015 -9.057 1.00 73.12 H new ATOM 0 HD13 ILE A 55 5.619 13.188 -9.366 1.00 73.12 H new ATOM 216 N SER A 56 3.940 12.281 -4.602 1.00 35.00 N ATOM 217 CA SER A 56 3.611 11.499 -3.416 1.00 24.04 C ATOM 218 C SER A 56 2.510 10.487 -3.720 1.00 51.22 C ATOM 219 O SER A 56 2.567 9.340 -3.279 1.00 61.31 O ATOM 220 CB SER A 56 3.171 12.421 -2.277 1.00 65.00 C ATOM 221 OG SER A 56 1.886 12.962 -2.526 1.00 31.43 O ATOM 0 H SER A 56 3.784 13.284 -4.502 1.00 35.00 H new ATOM 0 HA SER A 56 4.505 10.956 -3.110 1.00 24.04 H new ATOM 0 HB2 SER A 56 3.160 11.866 -1.339 1.00 65.00 H new ATOM 0 HB3 SER A 56 3.893 13.229 -2.160 1.00 65.00 H new ATOM 0 HG SER A 56 1.806 13.192 -3.475 1.00 31.43 H new ATOM 227 N ALA A 57 1.508 10.922 -4.477 1.00 72.54 N ATOM 228 CA ALA A 57 0.395 10.055 -4.843 1.00 74.41 C ATOM 229 C ALA A 57 0.866 8.892 -5.709 1.00 34.31 C ATOM 230 O ALA A 57 0.524 7.738 -5.456 1.00 5.31 O ATOM 231 CB ALA A 57 -0.680 10.853 -5.567 1.00 51.34 C ATOM 0 H ALA A 57 1.444 11.870 -4.849 1.00 72.54 H new ATOM 0 HA ALA A 57 -0.028 9.643 -3.927 1.00 74.41 H new ATOM 0 HB1 ALA A 57 -1.505 10.193 -5.834 1.00 51.34 H new ATOM 0 HB2 ALA A 57 -1.046 11.646 -4.914 1.00 51.34 H new ATOM 0 HB3 ALA A 57 -0.260 11.293 -6.471 1.00 51.34 H new ATOM 237 N VAL A 58 1.652 9.205 -6.735 1.00 51.23 N ATOM 238 CA VAL A 58 2.171 8.185 -7.640 1.00 42.43 C ATOM 239 C VAL A 58 2.904 7.091 -6.871 1.00 10.30 C ATOM 240 O VAL A 58 2.733 5.903 -7.147 1.00 72.42 O ATOM 241 CB VAL A 58 3.127 8.794 -8.682 1.00 61.11 C ATOM 242 CG1 VAL A 58 3.728 7.704 -9.556 1.00 24.13 C ATOM 243 CG2 VAL A 58 2.403 9.829 -9.529 1.00 43.12 C ATOM 0 H VAL A 58 1.943 10.156 -6.960 1.00 51.23 H new ATOM 0 HA VAL A 58 1.314 7.751 -8.155 1.00 42.43 H new ATOM 0 HB VAL A 58 3.940 9.294 -8.155 1.00 61.11 H new ATOM 0 HG11 VAL A 58 4.401 8.153 -10.286 1.00 24.13 H new ATOM 0 HG12 VAL A 58 4.284 7.003 -8.933 1.00 24.13 H new ATOM 0 HG13 VAL A 58 2.930 7.173 -10.076 1.00 24.13 H new ATOM 0 HG21 VAL A 58 3.094 10.249 -10.260 1.00 43.12 H new ATOM 0 HG22 VAL A 58 1.569 9.356 -10.048 1.00 43.12 H new ATOM 0 HG23 VAL A 58 2.026 10.625 -8.887 1.00 43.12 H new ATOM 253 N VAL A 59 3.719 7.498 -5.904 1.00 54.24 N ATOM 254 CA VAL A 59 4.477 6.553 -5.094 1.00 51.24 C ATOM 255 C VAL A 59 3.549 5.626 -4.317 1.00 55.34 C ATOM 256 O VAL A 59 3.735 4.411 -4.304 1.00 53.34 O ATOM 257 CB VAL A 59 5.406 7.280 -4.103 1.00 72.33 C ATOM 258 CG1 VAL A 59 6.138 6.279 -3.224 1.00 62.02 C ATOM 259 CG2 VAL A 59 6.391 8.167 -4.850 1.00 14.53 C ATOM 0 H VAL A 59 3.871 8.477 -5.662 1.00 54.24 H new ATOM 0 HA VAL A 59 5.083 5.963 -5.782 1.00 51.24 H new ATOM 0 HB VAL A 59 4.797 7.914 -3.459 1.00 72.33 H new ATOM 0 HG11 VAL A 59 6.789 6.811 -2.531 1.00 62.02 H new ATOM 0 HG12 VAL A 59 5.413 5.690 -2.662 1.00 62.02 H new ATOM 0 HG13 VAL A 59 6.737 5.616 -3.848 1.00 62.02 H new ATOM 0 HG21 VAL A 59 7.040 8.673 -4.135 1.00 14.53 H new ATOM 0 HG22 VAL A 59 6.996 7.555 -5.519 1.00 14.53 H new ATOM 0 HG23 VAL A 59 5.844 8.909 -5.432 1.00 14.53 H new ATOM 269 N GLY A 60 2.545 6.211 -3.669 1.00 40.32 N ATOM 270 CA GLY A 60 1.601 5.424 -2.898 1.00 10.00 C ATOM 271 C GLY A 60 0.878 4.394 -3.743 1.00 74.24 C ATOM 272 O GLY A 60 0.865 3.209 -3.412 1.00 22.41 O ATOM 0 H GLY A 60 2.369 7.216 -3.665 1.00 40.32 H new ATOM 0 HA2 GLY A 60 2.129 4.920 -2.089 1.00 10.00 H new ATOM 0 HA3 GLY A 60 0.870 6.088 -2.437 1.00 10.00 H new ATOM 276 N ILE A 61 0.274 4.847 -4.836 1.00 72.54 N ATOM 277 CA ILE A 61 -0.454 3.957 -5.731 1.00 24.21 C ATOM 278 C ILE A 61 0.472 2.907 -6.336 1.00 20.42 C ATOM 279 O ILE A 61 0.046 1.796 -6.652 1.00 24.45 O ATOM 280 CB ILE A 61 -1.138 4.738 -6.869 1.00 0.33 C ATOM 281 CG1 ILE A 61 -1.999 5.866 -6.296 1.00 14.33 C ATOM 282 CG2 ILE A 61 -1.982 3.801 -7.721 1.00 50.34 C ATOM 283 CD1 ILE A 61 -3.181 5.375 -5.489 1.00 44.13 C ATOM 0 H ILE A 61 0.274 5.826 -5.123 1.00 72.54 H new ATOM 0 HA ILE A 61 -1.217 3.462 -5.131 1.00 24.21 H new ATOM 0 HB ILE A 61 -0.368 5.179 -7.502 1.00 0.33 H new ATOM 0 HG12 ILE A 61 -1.378 6.502 -5.665 1.00 14.33 H new ATOM 0 HG13 ILE A 61 -2.362 6.487 -7.115 1.00 14.33 H new ATOM 0 HG21 ILE A 61 -2.459 4.367 -8.521 1.00 50.34 H new ATOM 0 HG22 ILE A 61 -1.345 3.029 -8.153 1.00 50.34 H new ATOM 0 HG23 ILE A 61 -2.747 3.335 -7.100 1.00 50.34 H new ATOM 0 HD11 ILE A 61 -3.746 6.229 -5.114 1.00 44.13 H new ATOM 0 HD12 ILE A 61 -3.825 4.764 -6.121 1.00 44.13 H new ATOM 0 HD13 ILE A 61 -2.825 4.778 -4.649 1.00 44.13 H new ATOM 295 N LEU A 62 1.741 3.266 -6.493 1.00 51.20 N ATOM 296 CA LEU A 62 2.730 2.354 -7.058 1.00 73.24 C ATOM 297 C LEU A 62 3.046 1.223 -6.086 1.00 74.12 C ATOM 298 O LEU A 62 3.009 0.048 -6.452 1.00 22.31 O ATOM 299 CB LEU A 62 4.011 3.114 -7.409 1.00 13.31 C ATOM 300 CG LEU A 62 5.113 2.296 -8.081 1.00 23.55 C ATOM 301 CD1 LEU A 62 4.846 2.165 -9.573 1.00 63.22 C ATOM 302 CD2 LEU A 62 6.474 2.930 -7.835 1.00 22.10 C ATOM 0 H LEU A 62 2.110 4.182 -6.237 1.00 51.20 H new ATOM 0 HA LEU A 62 2.311 1.920 -7.966 1.00 73.24 H new ATOM 0 HB2 LEU A 62 3.749 3.943 -8.066 1.00 13.31 H new ATOM 0 HB3 LEU A 62 4.415 3.548 -6.494 1.00 13.31 H new ATOM 0 HG LEU A 62 5.115 1.298 -7.644 1.00 23.55 H new ATOM 0 HD11 LEU A 62 5.641 1.579 -10.035 1.00 63.22 H new ATOM 0 HD12 LEU A 62 3.890 1.665 -9.729 1.00 63.22 H new ATOM 0 HD13 LEU A 62 4.816 3.156 -10.026 1.00 63.22 H new ATOM 0 HD21 LEU A 62 7.246 2.334 -8.321 1.00 22.10 H new ATOM 0 HD22 LEU A 62 6.484 3.940 -8.244 1.00 22.10 H new ATOM 0 HD23 LEU A 62 6.668 2.971 -6.763 1.00 22.10 H new ATOM 314 N LEU A 63 3.355 1.585 -4.846 1.00 12.13 N ATOM 315 CA LEU A 63 3.674 0.599 -3.818 1.00 61.32 C ATOM 316 C LEU A 63 2.503 -0.350 -3.590 1.00 32.42 C ATOM 317 O LEU A 63 2.694 -1.545 -3.361 1.00 14.32 O ATOM 318 CB LEU A 63 4.040 1.300 -2.509 1.00 25.42 C ATOM 319 CG LEU A 63 5.054 0.576 -1.622 1.00 5.21 C ATOM 320 CD1 LEU A 63 6.431 0.583 -2.268 1.00 12.53 C ATOM 321 CD2 LEU A 63 5.107 1.216 -0.242 1.00 24.34 C ATOM 0 H LEU A 63 3.392 2.553 -4.527 1.00 12.13 H new ATOM 0 HA LEU A 63 4.528 0.015 -4.162 1.00 61.32 H new ATOM 0 HB2 LEU A 63 4.435 2.288 -2.747 1.00 25.42 H new ATOM 0 HB3 LEU A 63 3.127 1.452 -1.934 1.00 25.42 H new ATOM 0 HG LEU A 63 4.734 -0.460 -1.509 1.00 5.21 H new ATOM 0 HD11 LEU A 63 7.139 0.063 -1.622 1.00 12.53 H new ATOM 0 HD12 LEU A 63 6.383 0.079 -3.233 1.00 12.53 H new ATOM 0 HD13 LEU A 63 6.760 1.612 -2.413 1.00 12.53 H new ATOM 0 HD21 LEU A 63 5.833 0.688 0.376 1.00 24.34 H new ATOM 0 HD22 LEU A 63 5.402 2.261 -0.337 1.00 24.34 H new ATOM 0 HD23 LEU A 63 4.123 1.157 0.224 1.00 24.34 H new ATOM 333 N VAL A 64 1.289 0.188 -3.658 1.00 42.13 N ATOM 334 CA VAL A 64 0.086 -0.611 -3.463 1.00 43.15 C ATOM 335 C VAL A 64 -0.040 -1.686 -4.535 1.00 72.41 C ATOM 336 O VAL A 64 -0.102 -2.878 -4.232 1.00 54.13 O ATOM 337 CB VAL A 64 -1.179 0.266 -3.479 1.00 15.54 C ATOM 338 CG1 VAL A 64 -2.425 -0.589 -3.306 1.00 31.11 C ATOM 339 CG2 VAL A 64 -1.102 1.334 -2.399 1.00 55.14 C ATOM 0 H VAL A 64 1.113 1.175 -3.847 1.00 42.13 H new ATOM 0 HA VAL A 64 0.177 -1.086 -2.486 1.00 43.15 H new ATOM 0 HB VAL A 64 -1.241 0.764 -4.447 1.00 15.54 H new ATOM 0 HG11 VAL A 64 -3.309 0.049 -3.320 1.00 31.11 H new ATOM 0 HG12 VAL A 64 -2.486 -1.312 -4.120 1.00 31.11 H new ATOM 0 HG13 VAL A 64 -2.374 -1.118 -2.354 1.00 31.11 H new ATOM 0 HG21 VAL A 64 -2.005 1.944 -2.426 1.00 55.14 H new ATOM 0 HG22 VAL A 64 -1.014 0.858 -1.422 1.00 55.14 H new ATOM 0 HG23 VAL A 64 -0.232 1.966 -2.574 1.00 55.14 H new ATOM 349 N VAL A 65 -0.076 -1.257 -5.793 1.00 31.45 N ATOM 350 CA VAL A 65 -0.193 -2.183 -6.913 1.00 61.40 C ATOM 351 C VAL A 65 0.860 -3.283 -6.831 1.00 44.55 C ATOM 352 O VAL A 65 0.548 -4.467 -6.955 1.00 22.02 O ATOM 353 CB VAL A 65 -0.051 -1.454 -8.262 1.00 33.05 C ATOM 354 CG1 VAL A 65 -0.145 -2.440 -9.417 1.00 44.23 C ATOM 355 CG2 VAL A 65 -1.108 -0.366 -8.393 1.00 65.43 C ATOM 0 H VAL A 65 -0.026 -0.274 -6.062 1.00 31.45 H new ATOM 0 HA VAL A 65 -1.186 -2.628 -6.851 1.00 61.40 H new ATOM 0 HB VAL A 65 0.931 -0.983 -8.298 1.00 33.05 H new ATOM 0 HG11 VAL A 65 -0.042 -1.905 -10.361 1.00 44.23 H new ATOM 0 HG12 VAL A 65 0.651 -3.179 -9.330 1.00 44.23 H new ATOM 0 HG13 VAL A 65 -1.112 -2.943 -9.388 1.00 44.23 H new ATOM 0 HG21 VAL A 65 -0.993 0.139 -9.352 1.00 65.43 H new ATOM 0 HG22 VAL A 65 -2.100 -0.814 -8.335 1.00 65.43 H new ATOM 0 HG23 VAL A 65 -0.988 0.357 -7.586 1.00 65.43 H new ATOM 365 N VAL A 66 2.109 -2.883 -6.617 1.00 43.11 N ATOM 366 CA VAL A 66 3.210 -3.834 -6.514 1.00 72.11 C ATOM 367 C VAL A 66 2.939 -4.873 -5.432 1.00 63.33 C ATOM 368 O VAL A 66 3.251 -6.053 -5.597 1.00 71.21 O ATOM 369 CB VAL A 66 4.541 -3.122 -6.206 1.00 2.35 C ATOM 370 CG1 VAL A 66 5.669 -4.133 -6.077 1.00 43.45 C ATOM 371 CG2 VAL A 66 4.855 -2.093 -7.281 1.00 63.33 C ATOM 0 H VAL A 66 2.384 -1.907 -6.511 1.00 43.11 H new ATOM 0 HA VAL A 66 3.289 -4.332 -7.480 1.00 72.11 H new ATOM 0 HB VAL A 66 4.443 -2.600 -5.254 1.00 2.35 H new ATOM 0 HG11 VAL A 66 6.601 -3.612 -5.859 1.00 43.45 H new ATOM 0 HG12 VAL A 66 5.444 -4.828 -5.268 1.00 43.45 H new ATOM 0 HG13 VAL A 66 5.771 -4.685 -7.011 1.00 43.45 H new ATOM 0 HG21 VAL A 66 5.798 -1.599 -7.048 1.00 63.33 H new ATOM 0 HG22 VAL A 66 4.935 -2.590 -8.248 1.00 63.33 H new ATOM 0 HG23 VAL A 66 4.057 -1.351 -7.319 1.00 63.33 H new ATOM 381 N LEU A 67 2.356 -4.427 -4.325 1.00 63.41 N ATOM 382 CA LEU A 67 2.043 -5.319 -3.214 1.00 1.45 C ATOM 383 C LEU A 67 1.011 -6.364 -3.629 1.00 65.52 C ATOM 384 O LEU A 67 1.199 -7.559 -3.406 1.00 63.20 O ATOM 385 CB LEU A 67 1.519 -4.517 -2.021 1.00 73.34 C ATOM 386 CG LEU A 67 1.637 -5.191 -0.654 1.00 61.31 C ATOM 387 CD1 LEU A 67 2.388 -4.297 0.320 1.00 41.25 C ATOM 388 CD2 LEU A 67 0.258 -5.536 -0.110 1.00 72.55 C ATOM 0 H LEU A 67 2.091 -3.454 -4.173 1.00 63.41 H new ATOM 0 HA LEU A 67 2.960 -5.833 -2.925 1.00 1.45 H new ATOM 0 HB2 LEU A 67 2.055 -3.568 -1.983 1.00 73.34 H new ATOM 0 HB3 LEU A 67 0.469 -4.283 -2.199 1.00 73.34 H new ATOM 0 HG LEU A 67 2.201 -6.116 -0.774 1.00 61.31 H new ATOM 0 HD11 LEU A 67 2.462 -4.794 1.287 1.00 41.25 H new ATOM 0 HD12 LEU A 67 3.389 -4.100 -0.064 1.00 41.25 H new ATOM 0 HD13 LEU A 67 1.852 -3.355 0.436 1.00 41.25 H new ATOM 0 HD21 LEU A 67 0.360 -6.015 0.864 1.00 72.55 H new ATOM 0 HD22 LEU A 67 -0.331 -4.624 -0.006 1.00 72.55 H new ATOM 0 HD23 LEU A 67 -0.245 -6.216 -0.798 1.00 72.55 H new ATOM 400 N GLY A 68 -0.078 -5.904 -4.236 1.00 1.43 N ATOM 401 CA GLY A 68 -1.122 -6.812 -4.674 1.00 75.41 C ATOM 402 C GLY A 68 -0.599 -7.895 -5.598 1.00 41.53 C ATOM 403 O GLY A 68 -0.939 -9.068 -5.445 1.00 10.43 O ATOM 0 H GLY A 68 -0.256 -4.919 -4.432 1.00 1.43 H new ATOM 0 HA2 GLY A 68 -1.586 -7.275 -3.803 1.00 75.41 H new ATOM 0 HA3 GLY A 68 -1.900 -6.246 -5.186 1.00 75.41 H new ATOM 407 N VAL A 69 0.231 -7.501 -6.558 1.00 32.04 N ATOM 408 CA VAL A 69 0.802 -8.448 -7.509 1.00 74.14 C ATOM 409 C VAL A 69 1.607 -9.527 -6.795 1.00 13.14 C ATOM 410 O VAL A 69 1.434 -10.719 -7.053 1.00 54.01 O ATOM 411 CB VAL A 69 1.710 -7.736 -8.531 1.00 64.20 C ATOM 412 CG1 VAL A 69 2.343 -8.747 -9.476 1.00 52.53 C ATOM 413 CG2 VAL A 69 0.924 -6.690 -9.305 1.00 50.31 C ATOM 0 H VAL A 69 0.523 -6.534 -6.698 1.00 32.04 H new ATOM 0 HA VAL A 69 -0.033 -8.912 -8.035 1.00 74.14 H new ATOM 0 HB VAL A 69 2.509 -7.229 -7.990 1.00 64.20 H new ATOM 0 HG11 VAL A 69 2.981 -8.227 -10.191 1.00 52.53 H new ATOM 0 HG12 VAL A 69 2.942 -9.455 -8.903 1.00 52.53 H new ATOM 0 HG13 VAL A 69 1.560 -9.284 -10.012 1.00 52.53 H new ATOM 0 HG21 VAL A 69 1.581 -6.198 -10.022 1.00 50.31 H new ATOM 0 HG22 VAL A 69 0.103 -7.171 -9.837 1.00 50.31 H new ATOM 0 HG23 VAL A 69 0.523 -5.950 -8.612 1.00 50.31 H new ATOM 423 N VAL A 70 2.488 -9.103 -5.895 1.00 3.44 N ATOM 424 CA VAL A 70 3.319 -10.034 -5.141 1.00 43.45 C ATOM 425 C VAL A 70 2.463 -11.017 -4.349 1.00 65.13 C ATOM 426 O VAL A 70 2.625 -12.231 -4.467 1.00 22.24 O ATOM 427 CB VAL A 70 4.257 -9.291 -4.171 1.00 54.23 C ATOM 428 CG1 VAL A 70 5.175 -10.271 -3.458 1.00 32.32 C ATOM 429 CG2 VAL A 70 5.063 -8.236 -4.914 1.00 32.40 C ATOM 0 H VAL A 70 2.645 -8.121 -5.670 1.00 3.44 H new ATOM 0 HA VAL A 70 3.919 -10.582 -5.867 1.00 43.45 H new ATOM 0 HB VAL A 70 3.649 -8.789 -3.419 1.00 54.23 H new ATOM 0 HG11 VAL A 70 5.830 -9.727 -2.777 1.00 32.32 H new ATOM 0 HG12 VAL A 70 4.576 -10.985 -2.892 1.00 32.32 H new ATOM 0 HG13 VAL A 70 5.778 -10.805 -4.192 1.00 32.32 H new ATOM 0 HG21 VAL A 70 5.720 -7.721 -4.214 1.00 32.40 H new ATOM 0 HG22 VAL A 70 5.662 -8.715 -5.689 1.00 32.40 H new ATOM 0 HG23 VAL A 70 4.385 -7.516 -5.372 1.00 32.40 H new ATOM 439 N PHE A 71 1.553 -10.483 -3.541 1.00 20.04 N ATOM 440 CA PHE A 71 0.672 -11.314 -2.728 1.00 34.14 C ATOM 441 C PHE A 71 -0.028 -12.366 -3.585 1.00 73.42 C ATOM 442 O PHE A 71 0.027 -13.559 -3.291 1.00 62.13 O ATOM 443 CB PHE A 71 -0.369 -10.446 -2.017 1.00 41.33 C ATOM 444 CG PHE A 71 -0.990 -11.113 -0.824 1.00 44.31 C ATOM 445 CD1 PHE A 71 -0.197 -11.685 0.158 1.00 45.02 C ATOM 446 CD2 PHE A 71 -2.368 -11.167 -0.682 1.00 31.51 C ATOM 447 CE1 PHE A 71 -0.766 -12.300 1.257 1.00 0.14 C ATOM 448 CE2 PHE A 71 -2.942 -11.781 0.414 1.00 51.40 C ATOM 449 CZ PHE A 71 -2.141 -12.347 1.386 1.00 70.44 C ATOM 0 H PHE A 71 1.406 -9.480 -3.432 1.00 20.04 H new ATOM 0 HA PHE A 71 1.281 -11.824 -1.982 1.00 34.14 H new ATOM 0 HB2 PHE A 71 0.101 -9.515 -1.699 1.00 41.33 H new ATOM 0 HB3 PHE A 71 -1.154 -10.181 -2.725 1.00 41.33 H new ATOM 0 HD1 PHE A 71 0.878 -11.650 0.063 1.00 45.02 H new ATOM 0 HD2 PHE A 71 -3.000 -10.724 -1.437 1.00 31.51 H new ATOM 0 HE1 PHE A 71 -0.137 -12.743 2.014 1.00 0.14 H new ATOM 0 HE2 PHE A 71 -4.017 -11.818 0.511 1.00 51.40 H new ATOM 0 HZ PHE A 71 -2.588 -12.825 2.245 1.00 70.44 H new ATOM 459 N GLY A 72 -0.686 -11.913 -4.649 1.00 43.45 N ATOM 460 CA GLY A 72 -1.386 -12.826 -5.532 1.00 51.11 C ATOM 461 C GLY A 72 -0.506 -13.967 -6.002 1.00 14.14 C ATOM 462 O GLY A 72 -0.823 -15.136 -5.780 1.00 31.13 O ATOM 0 H GLY A 72 -0.746 -10.930 -4.914 1.00 43.45 H new ATOM 0 HA2 GLY A 72 -2.256 -13.231 -5.015 1.00 51.11 H new ATOM 0 HA3 GLY A 72 -1.757 -12.277 -6.398 1.00 51.11 H new ATOM 466 N ILE A 73 0.600 -13.628 -6.655 1.00 61.01 N ATOM 467 CA ILE A 73 1.527 -14.634 -7.158 1.00 35.12 C ATOM 468 C ILE A 73 2.034 -15.528 -6.032 1.00 74.32 C ATOM 469 O ILE A 73 2.170 -16.740 -6.199 1.00 34.53 O ATOM 470 CB ILE A 73 2.732 -13.986 -7.866 1.00 55.12 C ATOM 471 CG1 ILE A 73 2.258 -13.111 -9.028 1.00 54.22 C ATOM 472 CG2 ILE A 73 3.695 -15.054 -8.359 1.00 23.31 C ATOM 473 CD1 ILE A 73 1.577 -13.888 -10.131 1.00 14.54 C ATOM 0 H ILE A 73 0.876 -12.665 -6.848 1.00 61.01 H new ATOM 0 HA ILE A 73 0.975 -15.239 -7.878 1.00 35.12 H new ATOM 0 HB ILE A 73 3.258 -13.354 -7.150 1.00 55.12 H new ATOM 0 HG12 ILE A 73 1.569 -12.357 -8.647 1.00 54.22 H new ATOM 0 HG13 ILE A 73 3.114 -12.579 -9.444 1.00 54.22 H new ATOM 0 HG21 ILE A 73 4.541 -14.580 -8.857 1.00 23.31 H new ATOM 0 HG22 ILE A 73 4.054 -15.639 -7.512 1.00 23.31 H new ATOM 0 HG23 ILE A 73 3.182 -15.710 -9.062 1.00 23.31 H new ATOM 0 HD11 ILE A 73 1.268 -13.203 -10.921 1.00 14.54 H new ATOM 0 HD12 ILE A 73 2.270 -14.624 -10.539 1.00 14.54 H new ATOM 0 HD13 ILE A 73 0.701 -14.398 -9.730 1.00 14.54 H new ATOM 834 N PRO B 150 14.552 17.825 -2.119 1.00 64.41 N ATOM 835 CA PRO B 150 14.445 16.418 -1.722 1.00 24.21 C ATOM 836 C PRO B 150 13.249 16.161 -0.812 1.00 70.12 C ATOM 837 O PRO B 150 12.861 15.014 -0.589 1.00 14.32 O ATOM 838 CB PRO B 150 15.754 16.160 -0.970 1.00 34.42 C ATOM 839 CG PRO B 150 16.170 17.498 -0.466 1.00 73.41 C ATOM 840 CD PRO B 150 15.709 18.492 -1.496 1.00 20.11 C ATOM 0 HA PRO B 150 14.294 15.764 -2.581 1.00 24.21 H new ATOM 0 HB2 PRO B 150 15.608 15.456 -0.151 1.00 34.42 H new ATOM 0 HB3 PRO B 150 16.511 15.732 -1.627 1.00 34.42 H new ATOM 0 HG2 PRO B 150 15.721 17.706 0.505 1.00 73.41 H new ATOM 0 HG3 PRO B 150 17.251 17.546 -0.334 1.00 73.41 H new ATOM 0 HD2 PRO B 150 15.428 19.442 -1.041 1.00 20.11 H new ATOM 0 HD3 PRO B 150 16.490 18.707 -2.225 1.00 20.11 H new ATOM 848 N LEU B 151 12.669 17.236 -0.290 1.00 14.22 N ATOM 849 CA LEU B 151 11.514 17.128 0.596 1.00 30.42 C ATOM 850 C LEU B 151 10.422 16.269 -0.035 1.00 41.23 C ATOM 851 O LEU B 151 9.756 15.491 0.649 1.00 34.34 O ATOM 852 CB LEU B 151 10.964 18.517 0.921 1.00 32.14 C ATOM 853 CG LEU B 151 11.472 19.155 2.214 1.00 75.13 C ATOM 854 CD1 LEU B 151 11.215 20.655 2.206 1.00 72.41 C ATOM 855 CD2 LEU B 151 10.815 18.507 3.423 1.00 2.53 C ATOM 0 H LEU B 151 12.979 18.192 -0.464 1.00 14.22 H new ATOM 0 HA LEU B 151 11.839 16.648 1.519 1.00 30.42 H new ATOM 0 HB2 LEU B 151 11.203 19.183 0.092 1.00 32.14 H new ATOM 0 HB3 LEU B 151 9.877 18.452 0.974 1.00 32.14 H new ATOM 0 HG LEU B 151 12.548 18.991 2.279 1.00 75.13 H new ATOM 0 HD11 LEU B 151 11.583 21.092 3.134 1.00 72.41 H new ATOM 0 HD12 LEU B 151 11.733 21.108 1.361 1.00 72.41 H new ATOM 0 HD13 LEU B 151 10.145 20.840 2.117 1.00 72.41 H new ATOM 0 HD21 LEU B 151 11.189 18.974 4.334 1.00 2.53 H new ATOM 0 HD22 LEU B 151 9.735 18.639 3.364 1.00 2.53 H new ATOM 0 HD23 LEU B 151 11.050 17.443 3.438 1.00 2.53 H new ATOM 867 N THR B 152 10.244 16.415 -1.344 1.00 64.13 N ATOM 868 CA THR B 152 9.234 15.654 -2.068 1.00 3.03 C ATOM 869 C THR B 152 9.366 14.161 -1.787 1.00 54.21 C ATOM 870 O THR B 152 8.377 13.428 -1.797 1.00 35.14 O ATOM 871 CB THR B 152 9.333 15.889 -3.586 1.00 33.21 C ATOM 872 OG1 THR B 152 9.394 17.293 -3.861 1.00 70.14 O ATOM 873 CG2 THR B 152 8.142 15.278 -4.308 1.00 34.14 C ATOM 0 H THR B 152 10.787 17.054 -1.925 1.00 64.13 H new ATOM 0 HA THR B 152 8.263 16.004 -1.717 1.00 3.03 H new ATOM 0 HB THR B 152 10.242 15.408 -3.947 1.00 33.21 H new ATOM 0 HG1 THR B 152 9.459 17.434 -4.829 1.00 70.14 H new ATOM 0 HG21 THR B 152 8.235 15.457 -5.379 1.00 34.14 H new ATOM 0 HG22 THR B 152 8.115 14.205 -4.121 1.00 34.14 H new ATOM 0 HG23 THR B 152 7.222 15.734 -3.942 1.00 34.14 H new ATOM 881 N SER B 153 10.593 13.717 -1.536 1.00 5.54 N ATOM 882 CA SER B 153 10.855 12.310 -1.255 1.00 11.45 C ATOM 883 C SER B 153 10.269 11.907 0.095 1.00 54.21 C ATOM 884 O SER B 153 9.453 10.989 0.182 1.00 34.41 O ATOM 885 CB SER B 153 12.359 12.035 -1.275 1.00 44.14 C ATOM 886 OG SER B 153 12.623 10.643 -1.312 1.00 12.44 O ATOM 0 H SER B 153 11.422 14.311 -1.521 1.00 5.54 H new ATOM 0 HA SER B 153 10.375 11.715 -2.031 1.00 11.45 H new ATOM 0 HB2 SER B 153 12.808 12.517 -2.143 1.00 44.14 H new ATOM 0 HB3 SER B 153 12.824 12.473 -0.392 1.00 44.14 H new ATOM 0 HG SER B 153 13.592 10.494 -1.326 1.00 12.44 H new ATOM 892 N ILE B 154 10.693 12.600 1.146 1.00 52.33 N ATOM 893 CA ILE B 154 10.211 12.317 2.492 1.00 12.30 C ATOM 894 C ILE B 154 8.687 12.285 2.535 1.00 70.02 C ATOM 895 O ILE B 154 8.092 11.392 3.140 1.00 51.03 O ATOM 896 CB ILE B 154 10.720 13.361 3.503 1.00 43.53 C ATOM 897 CG1 ILE B 154 12.250 13.400 3.504 1.00 32.01 C ATOM 898 CG2 ILE B 154 10.193 13.050 4.897 1.00 15.24 C ATOM 899 CD1 ILE B 154 12.888 12.077 3.866 1.00 55.12 C ATOM 0 H ILE B 154 11.369 13.362 1.091 1.00 52.33 H new ATOM 0 HA ILE B 154 10.600 11.337 2.767 1.00 12.30 H new ATOM 0 HB ILE B 154 10.350 14.342 3.206 1.00 43.53 H new ATOM 0 HG12 ILE B 154 12.598 13.704 2.517 1.00 32.01 H new ATOM 0 HG13 ILE B 154 12.586 14.161 4.209 1.00 32.01 H new ATOM 0 HG21 ILE B 154 10.562 13.797 5.600 1.00 15.24 H new ATOM 0 HG22 ILE B 154 9.103 13.068 4.886 1.00 15.24 H new ATOM 0 HG23 ILE B 154 10.536 12.062 5.204 1.00 15.24 H new ATOM 0 HD11 ILE B 154 13.973 12.179 3.847 1.00 55.12 H new ATOM 0 HD12 ILE B 154 12.569 11.781 4.865 1.00 55.12 H new ATOM 0 HD13 ILE B 154 12.582 11.317 3.147 1.00 55.12 H new ATOM 911 N ILE B 155 8.062 13.263 1.889 1.00 43.21 N ATOM 912 CA ILE B 155 6.607 13.345 1.851 1.00 24.14 C ATOM 913 C ILE B 155 6.012 12.191 1.050 1.00 54.53 C ATOM 914 O ILE B 155 5.041 11.565 1.472 1.00 1.25 O ATOM 915 CB ILE B 155 6.133 14.677 1.241 1.00 22.43 C ATOM 916 CG1 ILE B 155 6.781 15.857 1.970 1.00 24.54 C ATOM 917 CG2 ILE B 155 4.616 14.779 1.301 1.00 65.41 C ATOM 918 CD1 ILE B 155 6.377 15.963 3.423 1.00 42.51 C ATOM 0 H ILE B 155 8.540 14.010 1.385 1.00 43.21 H new ATOM 0 HA ILE B 155 6.261 13.285 2.883 1.00 24.14 H new ATOM 0 HB ILE B 155 6.438 14.708 0.195 1.00 22.43 H new ATOM 0 HG12 ILE B 155 7.865 15.761 1.909 1.00 24.54 H new ATOM 0 HG13 ILE B 155 6.513 16.781 1.458 1.00 24.54 H new ATOM 0 HG21 ILE B 155 4.298 15.726 0.866 1.00 65.41 H new ATOM 0 HG22 ILE B 155 4.174 13.955 0.741 1.00 65.41 H new ATOM 0 HG23 ILE B 155 4.289 14.729 2.339 1.00 65.41 H new ATOM 0 HD11 ILE B 155 6.873 16.821 3.877 1.00 42.51 H new ATOM 0 HD12 ILE B 155 5.297 16.091 3.492 1.00 42.51 H new ATOM 0 HD13 ILE B 155 6.669 15.054 3.949 1.00 42.51 H new ATOM 930 N SER B 156 6.603 11.916 -0.108 1.00 72.43 N ATOM 931 CA SER B 156 6.131 10.839 -0.970 1.00 34.31 C ATOM 932 C SER B 156 6.217 9.494 -0.256 1.00 2.12 C ATOM 933 O SER B 156 5.311 8.668 -0.355 1.00 20.13 O ATOM 934 CB SER B 156 6.948 10.796 -2.263 1.00 63.40 C ATOM 935 OG SER B 156 8.257 10.306 -2.023 1.00 33.15 O ATOM 0 H SER B 156 7.410 12.424 -0.471 1.00 72.43 H new ATOM 0 HA SER B 156 5.087 11.035 -1.215 1.00 34.31 H new ATOM 0 HB2 SER B 156 6.446 10.161 -2.993 1.00 63.40 H new ATOM 0 HB3 SER B 156 7.004 11.795 -2.695 1.00 63.40 H new ATOM 0 HG SER B 156 8.592 10.669 -1.177 1.00 33.15 H new ATOM 941 N ALA B 157 7.313 9.283 0.464 1.00 61.33 N ATOM 942 CA ALA B 157 7.519 8.040 1.197 1.00 11.12 C ATOM 943 C ALA B 157 6.474 7.872 2.295 1.00 24.45 C ATOM 944 O ALA B 157 5.861 6.812 2.426 1.00 53.31 O ATOM 945 CB ALA B 157 8.919 8.000 1.788 1.00 65.14 C ATOM 0 H ALA B 157 8.073 9.957 0.556 1.00 61.33 H new ATOM 0 HA ALA B 157 7.410 7.212 0.497 1.00 11.12 H new ATOM 0 HB1 ALA B 157 9.058 7.066 2.332 1.00 65.14 H new ATOM 0 HB2 ALA B 157 9.654 8.065 0.986 1.00 65.14 H new ATOM 0 HB3 ALA B 157 9.050 8.840 2.470 1.00 65.14 H new ATOM 951 N VAL B 158 6.276 8.923 3.084 1.00 60.45 N ATOM 952 CA VAL B 158 5.305 8.892 4.171 1.00 30.21 C ATOM 953 C VAL B 158 3.926 8.487 3.664 1.00 43.10 C ATOM 954 O VAL B 158 3.235 7.681 4.289 1.00 21.25 O ATOM 955 CB VAL B 158 5.201 10.260 4.870 1.00 74.02 C ATOM 956 CG1 VAL B 158 4.120 10.234 5.939 1.00 1.00 C ATOM 957 CG2 VAL B 158 6.543 10.657 5.467 1.00 60.43 C ATOM 0 H VAL B 158 6.776 9.807 2.991 1.00 60.45 H new ATOM 0 HA VAL B 158 5.657 8.151 4.889 1.00 30.21 H new ATOM 0 HB VAL B 158 4.924 11.007 4.126 1.00 74.02 H new ATOM 0 HG11 VAL B 158 4.062 11.210 6.422 1.00 1.00 H new ATOM 0 HG12 VAL B 158 3.160 9.998 5.480 1.00 1.00 H new ATOM 0 HG13 VAL B 158 4.362 9.475 6.683 1.00 1.00 H new ATOM 0 HG21 VAL B 158 6.451 11.626 5.957 1.00 60.43 H new ATOM 0 HG22 VAL B 158 6.852 9.909 6.197 1.00 60.43 H new ATOM 0 HG23 VAL B 158 7.289 10.720 4.675 1.00 60.43 H new ATOM 967 N VAL B 159 3.530 9.050 2.527 1.00 3.23 N ATOM 968 CA VAL B 159 2.232 8.745 1.935 1.00 74.44 C ATOM 969 C VAL B 159 2.125 7.267 1.577 1.00 70.14 C ATOM 970 O VAL B 159 1.134 6.611 1.894 1.00 72.35 O ATOM 971 CB VAL B 159 1.982 9.588 0.669 1.00 44.41 C ATOM 972 CG1 VAL B 159 0.655 9.209 0.029 1.00 4.33 C ATOM 973 CG2 VAL B 159 2.018 11.072 1.003 1.00 32.21 C ATOM 0 H VAL B 159 4.089 9.719 1.997 1.00 3.23 H new ATOM 0 HA VAL B 159 1.477 8.990 2.682 1.00 74.44 H new ATOM 0 HB VAL B 159 2.776 9.381 -0.048 1.00 44.41 H new ATOM 0 HG11 VAL B 159 0.495 9.814 -0.863 1.00 4.33 H new ATOM 0 HG12 VAL B 159 0.672 8.154 -0.246 1.00 4.33 H new ATOM 0 HG13 VAL B 159 -0.154 9.386 0.737 1.00 4.33 H new ATOM 0 HG21 VAL B 159 1.840 11.653 0.098 1.00 32.21 H new ATOM 0 HG22 VAL B 159 1.245 11.298 1.738 1.00 32.21 H new ATOM 0 HG23 VAL B 159 2.995 11.329 1.413 1.00 32.21 H new ATOM 983 N GLY B 160 3.154 6.748 0.913 1.00 72.12 N ATOM 984 CA GLY B 160 3.156 5.350 0.524 1.00 35.34 C ATOM 985 C GLY B 160 3.048 4.416 1.712 1.00 2.31 C ATOM 986 O GLY B 160 2.177 3.546 1.749 1.00 54.34 O ATOM 0 H GLY B 160 3.986 7.271 0.638 1.00 72.12 H new ATOM 0 HA2 GLY B 160 2.325 5.165 -0.156 1.00 35.34 H new ATOM 0 HA3 GLY B 160 4.072 5.130 -0.024 1.00 35.34 H new ATOM 990 N ILE B 161 3.934 4.595 2.685 1.00 62.43 N ATOM 991 CA ILE B 161 3.935 3.761 3.880 1.00 5.11 C ATOM 992 C ILE B 161 2.639 3.927 4.667 1.00 64.12 C ATOM 993 O ILE B 161 2.204 3.013 5.369 1.00 33.55 O ATOM 994 CB ILE B 161 5.125 4.093 4.798 1.00 61.42 C ATOM 995 CG1 ILE B 161 6.436 4.040 4.010 1.00 34.43 C ATOM 996 CG2 ILE B 161 5.171 3.131 5.976 1.00 44.23 C ATOM 997 CD1 ILE B 161 6.789 2.654 3.518 1.00 21.43 C ATOM 0 H ILE B 161 4.661 5.310 2.669 1.00 62.43 H new ATOM 0 HA ILE B 161 4.024 2.728 3.543 1.00 5.11 H new ATOM 0 HB ILE B 161 4.995 5.104 5.184 1.00 61.42 H new ATOM 0 HG12 ILE B 161 6.364 4.713 3.155 1.00 34.43 H new ATOM 0 HG13 ILE B 161 7.245 4.410 4.640 1.00 34.43 H new ATOM 0 HG21 ILE B 161 6.018 3.379 6.616 1.00 44.23 H new ATOM 0 HG22 ILE B 161 4.247 3.213 6.549 1.00 44.23 H new ATOM 0 HG23 ILE B 161 5.281 2.111 5.608 1.00 44.23 H new ATOM 0 HD11 ILE B 161 7.729 2.692 2.968 1.00 21.43 H new ATOM 0 HD12 ILE B 161 6.893 1.981 4.369 1.00 21.43 H new ATOM 0 HD13 ILE B 161 5.999 2.289 2.861 1.00 21.43 H new ATOM 1009 N LEU B 162 2.026 5.099 4.546 1.00 33.40 N ATOM 1010 CA LEU B 162 0.777 5.385 5.244 1.00 71.12 C ATOM 1011 C LEU B 162 -0.374 4.576 4.655 1.00 42.42 C ATOM 1012 O LEU B 162 -1.110 3.906 5.380 1.00 24.01 O ATOM 1013 CB LEU B 162 0.458 6.879 5.166 1.00 43.53 C ATOM 1014 CG LEU B 162 -0.789 7.339 5.922 1.00 32.23 C ATOM 1015 CD1 LEU B 162 -0.478 7.537 7.397 1.00 24.23 C ATOM 1016 CD2 LEU B 162 -1.338 8.622 5.314 1.00 74.43 C ATOM 0 H LEU B 162 2.373 5.867 3.971 1.00 33.40 H new ATOM 0 HA LEU B 162 0.899 5.099 6.289 1.00 71.12 H new ATOM 0 HB2 LEU B 162 1.315 7.434 5.548 1.00 43.53 H new ATOM 0 HB3 LEU B 162 0.344 7.151 4.117 1.00 43.53 H new ATOM 0 HG LEU B 162 -1.550 6.563 5.834 1.00 32.23 H new ATOM 0 HD11 LEU B 162 -1.378 7.864 7.918 1.00 24.23 H new ATOM 0 HD12 LEU B 162 -0.133 6.596 7.826 1.00 24.23 H new ATOM 0 HD13 LEU B 162 0.300 8.293 7.507 1.00 24.23 H new ATOM 0 HD21 LEU B 162 -2.225 8.935 5.864 1.00 74.43 H new ATOM 0 HD22 LEU B 162 -0.581 9.404 5.371 1.00 74.43 H new ATOM 0 HD23 LEU B 162 -1.601 8.447 4.271 1.00 74.43 H new ATOM 1028 N LEU B 163 -0.523 4.642 3.337 1.00 11.02 N ATOM 1029 CA LEU B 163 -1.583 3.913 2.650 1.00 54.42 C ATOM 1030 C LEU B 163 -1.447 2.412 2.876 1.00 11.04 C ATOM 1031 O LEU B 163 -2.443 1.703 3.026 1.00 44.23 O ATOM 1032 CB LEU B 163 -1.552 4.220 1.151 1.00 43.14 C ATOM 1033 CG LEU B 163 -2.900 4.188 0.431 1.00 32.24 C ATOM 1034 CD1 LEU B 163 -3.771 5.354 0.876 1.00 24.45 C ATOM 1035 CD2 LEU B 163 -2.699 4.215 -1.077 1.00 53.23 C ATOM 0 H LEU B 163 0.077 5.193 2.723 1.00 11.02 H new ATOM 0 HA LEU B 163 -2.539 4.238 3.061 1.00 54.42 H new ATOM 0 HB2 LEU B 163 -1.112 5.207 1.012 1.00 43.14 H new ATOM 0 HB3 LEU B 163 -0.888 3.504 0.668 1.00 43.14 H new ATOM 0 HG LEU B 163 -3.409 3.261 0.693 1.00 32.24 H new ATOM 0 HD11 LEU B 163 -4.726 5.315 0.353 1.00 24.45 H new ATOM 0 HD12 LEU B 163 -3.943 5.291 1.951 1.00 24.45 H new ATOM 0 HD13 LEU B 163 -3.268 6.293 0.644 1.00 24.45 H new ATOM 0 HD21 LEU B 163 -3.669 4.192 -1.574 1.00 53.23 H new ATOM 0 HD22 LEU B 163 -2.170 5.126 -1.357 1.00 53.23 H new ATOM 0 HD23 LEU B 163 -2.114 3.347 -1.382 1.00 53.23 H new ATOM 1047 N VAL B 164 -0.208 1.932 2.901 1.00 41.21 N ATOM 1048 CA VAL B 164 0.059 0.514 3.113 1.00 71.23 C ATOM 1049 C VAL B 164 -0.437 0.060 4.481 1.00 23.42 C ATOM 1050 O VAL B 164 -1.258 -0.851 4.585 1.00 51.44 O ATOM 1051 CB VAL B 164 1.563 0.202 2.994 1.00 13.13 C ATOM 1052 CG1 VAL B 164 1.824 -1.275 3.247 1.00 54.23 C ATOM 1053 CG2 VAL B 164 2.086 0.618 1.627 1.00 55.43 C ATOM 0 H VAL B 164 0.627 2.504 2.777 1.00 41.21 H new ATOM 0 HA VAL B 164 -0.479 -0.029 2.336 1.00 71.23 H new ATOM 0 HB VAL B 164 2.097 0.775 3.752 1.00 13.13 H new ATOM 0 HG11 VAL B 164 2.892 -1.476 3.159 1.00 54.23 H new ATOM 0 HG12 VAL B 164 1.487 -1.537 4.250 1.00 54.23 H new ATOM 0 HG13 VAL B 164 1.281 -1.871 2.514 1.00 54.23 H new ATOM 0 HG21 VAL B 164 3.150 0.391 1.560 1.00 55.43 H new ATOM 0 HG22 VAL B 164 1.549 0.073 0.851 1.00 55.43 H new ATOM 0 HG23 VAL B 164 1.935 1.689 1.490 1.00 55.43 H new ATOM 1063 N VAL B 165 0.069 0.701 5.530 1.00 44.21 N ATOM 1064 CA VAL B 165 -0.323 0.365 6.893 1.00 5.02 C ATOM 1065 C VAL B 165 -1.840 0.358 7.043 1.00 23.03 C ATOM 1066 O VAL B 165 -2.418 -0.586 7.584 1.00 73.13 O ATOM 1067 CB VAL B 165 0.277 1.353 7.911 1.00 61.41 C ATOM 1068 CG1 VAL B 165 -0.168 1.004 9.322 1.00 24.14 C ATOM 1069 CG2 VAL B 165 1.796 1.364 7.809 1.00 4.15 C ATOM 0 H VAL B 165 0.751 1.456 5.461 1.00 44.21 H new ATOM 0 HA VAL B 165 0.065 -0.633 7.095 1.00 5.02 H new ATOM 0 HB VAL B 165 -0.088 2.353 7.679 1.00 61.41 H new ATOM 0 HG11 VAL B 165 0.266 1.713 10.026 1.00 24.14 H new ATOM 0 HG12 VAL B 165 -1.255 1.052 9.383 1.00 24.14 H new ATOM 0 HG13 VAL B 165 0.165 -0.004 9.570 1.00 24.14 H new ATOM 0 HG21 VAL B 165 2.204 2.067 8.535 1.00 4.15 H new ATOM 0 HG22 VAL B 165 2.182 0.365 8.014 1.00 4.15 H new ATOM 0 HG23 VAL B 165 2.091 1.667 6.804 1.00 4.15 H new ATOM 1079 N VAL B 166 -2.481 1.417 6.560 1.00 11.25 N ATOM 1080 CA VAL B 166 -3.933 1.533 6.638 1.00 71.01 C ATOM 1081 C VAL B 166 -4.616 0.332 5.995 1.00 4.13 C ATOM 1082 O VAL B 166 -5.621 -0.171 6.501 1.00 54.34 O ATOM 1083 CB VAL B 166 -4.431 2.820 5.953 1.00 21.24 C ATOM 1084 CG1 VAL B 166 -5.948 2.909 6.023 1.00 34.20 C ATOM 1085 CG2 VAL B 166 -3.787 4.043 6.587 1.00 51.51 C ATOM 0 H VAL B 166 -2.018 2.207 6.111 1.00 11.25 H new ATOM 0 HA VAL B 166 -4.191 1.570 7.696 1.00 71.01 H new ATOM 0 HB VAL B 166 -4.141 2.788 4.903 1.00 21.24 H new ATOM 0 HG11 VAL B 166 -6.282 3.824 5.534 1.00 34.20 H new ATOM 0 HG12 VAL B 166 -6.387 2.048 5.519 1.00 34.20 H new ATOM 0 HG13 VAL B 166 -6.264 2.919 7.066 1.00 34.20 H new ATOM 0 HG21 VAL B 166 -4.150 4.943 6.091 1.00 51.51 H new ATOM 0 HG22 VAL B 166 -4.045 4.083 7.645 1.00 51.51 H new ATOM 0 HG23 VAL B 166 -2.704 3.981 6.480 1.00 51.51 H new ATOM 1095 N LEU B 167 -4.065 -0.127 4.877 1.00 72.53 N ATOM 1096 CA LEU B 167 -4.620 -1.272 4.163 1.00 21.13 C ATOM 1097 C LEU B 167 -4.537 -2.536 5.013 1.00 63.15 C ATOM 1098 O LEU B 167 -5.523 -3.253 5.176 1.00 51.32 O ATOM 1099 CB LEU B 167 -3.879 -1.482 2.841 1.00 42.21 C ATOM 1100 CG LEU B 167 -4.633 -2.268 1.768 1.00 74.21 C ATOM 1101 CD1 LEU B 167 -4.705 -1.469 0.475 1.00 34.02 C ATOM 1102 CD2 LEU B 167 -3.968 -3.616 1.527 1.00 54.35 C ATOM 0 H LEU B 167 -3.234 0.276 4.445 1.00 72.53 H new ATOM 0 HA LEU B 167 -5.670 -1.065 3.955 1.00 21.13 H new ATOM 0 HB2 LEU B 167 -3.620 -0.505 2.433 1.00 42.21 H new ATOM 0 HB3 LEU B 167 -2.942 -1.998 3.050 1.00 42.21 H new ATOM 0 HG LEU B 167 -5.649 -2.445 2.121 1.00 74.21 H new ATOM 0 HD11 LEU B 167 -5.245 -2.043 -0.278 1.00 34.02 H new ATOM 0 HD12 LEU B 167 -5.226 -0.529 0.657 1.00 34.02 H new ATOM 0 HD13 LEU B 167 -3.696 -1.262 0.119 1.00 34.02 H new ATOM 0 HD21 LEU B 167 -4.518 -4.161 0.760 1.00 54.35 H new ATOM 0 HD22 LEU B 167 -2.941 -3.461 1.196 1.00 54.35 H new ATOM 0 HD23 LEU B 167 -3.968 -4.192 2.452 1.00 54.35 H new ATOM 1114 N GLY B 168 -3.351 -2.803 5.553 1.00 70.34 N ATOM 1115 CA GLY B 168 -3.161 -3.979 6.382 1.00 13.14 C ATOM 1116 C GLY B 168 -4.129 -4.031 7.547 1.00 14.22 C ATOM 1117 O GLY B 168 -4.708 -5.078 7.837 1.00 70.10 O ATOM 0 H GLY B 168 -2.519 -2.226 5.431 1.00 70.34 H new ATOM 0 HA2 GLY B 168 -3.284 -4.874 5.771 1.00 13.14 H new ATOM 0 HA3 GLY B 168 -2.139 -3.990 6.762 1.00 13.14 H new ATOM 1121 N VAL B 169 -4.306 -2.897 8.217 1.00 1.53 N ATOM 1122 CA VAL B 169 -5.211 -2.816 9.358 1.00 3.03 C ATOM 1123 C VAL B 169 -6.634 -3.189 8.958 1.00 43.44 C ATOM 1124 O VAL B 169 -7.283 -4.001 9.617 1.00 3.04 O ATOM 1125 CB VAL B 169 -5.215 -1.405 9.973 1.00 55.33 C ATOM 1126 CG1 VAL B 169 -6.208 -1.325 11.123 1.00 35.53 C ATOM 1127 CG2 VAL B 169 -3.818 -1.022 10.438 1.00 21.50 C ATOM 0 H VAL B 169 -3.835 -2.021 7.990 1.00 1.53 H new ATOM 0 HA VAL B 169 -4.848 -3.526 10.101 1.00 3.03 H new ATOM 0 HB VAL B 169 -5.526 -0.696 9.206 1.00 55.33 H new ATOM 0 HG11 VAL B 169 -6.196 -0.320 11.545 1.00 35.53 H new ATOM 0 HG12 VAL B 169 -7.209 -1.553 10.756 1.00 35.53 H new ATOM 0 HG13 VAL B 169 -5.931 -2.045 11.893 1.00 35.53 H new ATOM 0 HG21 VAL B 169 -3.840 -0.021 10.870 1.00 21.50 H new ATOM 0 HG22 VAL B 169 -3.477 -1.734 11.189 1.00 21.50 H new ATOM 0 HG23 VAL B 169 -3.135 -1.035 9.588 1.00 21.50 H new ATOM 1137 N VAL B 170 -7.114 -2.591 7.873 1.00 54.34 N ATOM 1138 CA VAL B 170 -8.460 -2.860 7.384 1.00 31.15 C ATOM 1139 C VAL B 170 -8.652 -4.344 7.090 1.00 71.31 C ATOM 1140 O VAL B 170 -9.582 -4.972 7.595 1.00 31.14 O ATOM 1141 CB VAL B 170 -8.766 -2.053 6.108 1.00 55.21 C ATOM 1142 CG1 VAL B 170 -10.202 -2.280 5.663 1.00 2.14 C ATOM 1143 CG2 VAL B 170 -8.499 -0.573 6.338 1.00 42.45 C ATOM 0 H VAL B 170 -6.590 -1.916 7.316 1.00 54.34 H new ATOM 0 HA VAL B 170 -9.149 -2.556 8.172 1.00 31.15 H new ATOM 0 HB VAL B 170 -8.106 -2.400 5.313 1.00 55.21 H new ATOM 0 HG11 VAL B 170 -10.399 -1.702 4.760 1.00 2.14 H new ATOM 0 HG12 VAL B 170 -10.356 -3.339 5.456 1.00 2.14 H new ATOM 0 HG13 VAL B 170 -10.882 -1.962 6.453 1.00 2.14 H new ATOM 0 HG21 VAL B 170 -8.720 -0.017 5.427 1.00 42.45 H new ATOM 0 HG22 VAL B 170 -9.133 -0.210 7.147 1.00 42.45 H new ATOM 0 HG23 VAL B 170 -7.452 -0.429 6.605 1.00 42.45 H new ATOM 1153 N PHE B 171 -7.763 -4.898 6.272 1.00 33.34 N ATOM 1154 CA PHE B 171 -7.834 -6.309 5.910 1.00 11.15 C ATOM 1155 C PHE B 171 -7.910 -7.187 7.156 1.00 22.12 C ATOM 1156 O PHE B 171 -8.811 -8.012 7.294 1.00 11.32 O ATOM 1157 CB PHE B 171 -6.619 -6.703 5.067 1.00 1.11 C ATOM 1158 CG PHE B 171 -6.837 -7.940 4.243 1.00 50.12 C ATOM 1159 CD1 PHE B 171 -7.952 -8.059 3.430 1.00 74.42 C ATOM 1160 CD2 PHE B 171 -5.925 -8.983 4.281 1.00 1.34 C ATOM 1161 CE1 PHE B 171 -8.155 -9.197 2.671 1.00 14.51 C ATOM 1162 CE2 PHE B 171 -6.123 -10.123 3.524 1.00 10.31 C ATOM 1163 CZ PHE B 171 -7.239 -10.229 2.717 1.00 63.12 C ATOM 0 H PHE B 171 -6.986 -4.392 5.848 1.00 33.34 H new ATOM 0 HA PHE B 171 -8.740 -6.463 5.323 1.00 11.15 H new ATOM 0 HB2 PHE B 171 -6.362 -5.876 4.405 1.00 1.11 H new ATOM 0 HB3 PHE B 171 -5.765 -6.861 5.726 1.00 1.11 H new ATOM 0 HD1 PHE B 171 -8.671 -7.254 3.388 1.00 74.42 H new ATOM 0 HD2 PHE B 171 -5.050 -8.904 4.909 1.00 1.34 H new ATOM 0 HE1 PHE B 171 -9.030 -9.278 2.043 1.00 14.51 H new ATOM 0 HE2 PHE B 171 -5.406 -10.930 3.564 1.00 10.31 H new ATOM 0 HZ PHE B 171 -7.395 -11.117 2.123 1.00 63.12 H new ATOM 1173 N GLY B 172 -6.953 -7.003 8.061 1.00 51.03 N ATOM 1174 CA GLY B 172 -6.928 -7.785 9.284 1.00 14.31 C ATOM 1175 C GLY B 172 -8.250 -7.745 10.024 1.00 30.33 C ATOM 1176 O GLY B 172 -8.869 -8.784 10.258 1.00 51.34 O ATOM 0 H GLY B 172 -6.195 -6.327 7.969 1.00 51.03 H new ATOM 0 HA2 GLY B 172 -6.680 -8.819 9.045 1.00 14.31 H new ATOM 0 HA3 GLY B 172 -6.139 -7.410 9.936 1.00 14.31 H new ATOM 1180 N ILE B 173 -8.684 -6.545 10.395 1.00 22.51 N ATOM 1181 CA ILE B 173 -9.940 -6.375 11.113 1.00 22.05 C ATOM 1182 C ILE B 173 -11.106 -6.966 10.328 1.00 4.44 C ATOM 1183 O ILE B 173 -12.005 -7.584 10.901 1.00 1.55 O ATOM 1184 CB ILE B 173 -10.229 -4.890 11.400 1.00 23.44 C ATOM 1185 CG1 ILE B 173 -9.096 -4.277 12.223 1.00 65.03 C ATOM 1186 CG2 ILE B 173 -11.559 -4.739 12.124 1.00 30.33 C ATOM 1187 CD1 ILE B 173 -8.953 -4.885 13.602 1.00 40.45 C ATOM 0 H ILE B 173 -8.183 -5.676 10.210 1.00 22.51 H new ATOM 0 HA ILE B 173 -9.836 -6.905 12.060 1.00 22.05 H new ATOM 0 HB ILE B 173 -10.292 -4.358 10.451 1.00 23.44 H new ATOM 0 HG12 ILE B 173 -8.158 -4.399 11.682 1.00 65.03 H new ATOM 0 HG13 ILE B 173 -9.269 -3.206 12.323 1.00 65.03 H new ATOM 0 HG21 ILE B 173 -11.749 -3.684 12.320 1.00 30.33 H new ATOM 0 HG22 ILE B 173 -12.359 -5.143 11.503 1.00 30.33 H new ATOM 0 HG23 ILE B 173 -11.523 -5.282 13.068 1.00 30.33 H new ATOM 0 HD11 ILE B 173 -8.130 -4.402 14.129 1.00 40.45 H new ATOM 0 HD12 ILE B 173 -9.877 -4.740 14.161 1.00 40.45 H new ATOM 0 HD13 ILE B 173 -8.748 -5.952 13.510 1.00 40.45 H new ATOM 1199 N LEU B 174 -11.085 -6.775 9.014 1.00 61.40 N ATOM 1200 CA LEU B 174 -12.140 -7.291 8.148 1.00 44.25 C ATOM 1201 C LEU B 174 -12.253 -8.807 8.272 1.00 14.42 C ATOM 1202 O LEU B 174 -13.294 -9.331 8.670 1.00 32.50 O ATOM 1203 CB LEU B 174 -11.867 -6.906 6.693 1.00 12.30 C ATOM 1204 CG LEU B 174 -12.298 -5.498 6.279 1.00 14.32 C ATOM 1205 CD1 LEU B 174 -11.923 -5.229 4.831 1.00 11.22 C ATOM 1206 CD2 LEU B 174 -13.795 -5.317 6.487 1.00 33.24 C ATOM 0 H LEU B 174 -10.349 -6.266 8.524 1.00 61.40 H new ATOM 0 HA LEU B 174 -13.084 -6.847 8.464 1.00 44.25 H new ATOM 0 HB2 LEU B 174 -10.798 -7.007 6.506 1.00 12.30 H new ATOM 0 HB3 LEU B 174 -12.373 -7.624 6.047 1.00 12.30 H new ATOM 0 HG LEU B 174 -11.774 -4.778 6.908 1.00 14.32 H new ATOM 0 HD11 LEU B 174 -12.238 -4.223 4.555 1.00 11.22 H new ATOM 0 HD12 LEU B 174 -10.843 -5.317 4.712 1.00 11.22 H new ATOM 0 HD13 LEU B 174 -12.419 -5.954 4.186 1.00 11.22 H new ATOM 0 HD21 LEU B 174 -14.085 -4.310 6.188 1.00 33.24 H new ATOM 0 HD22 LEU B 174 -14.337 -6.045 5.883 1.00 33.24 H new ATOM 0 HD23 LEU B 174 -14.037 -5.466 7.539 1.00 33.24 H new ATOM 1218 N ILE B 175 -11.176 -9.505 7.930 1.00 24.21 N ATOM 1219 CA ILE B 175 -11.154 -10.961 8.006 1.00 23.11 C ATOM 1220 C ILE B 175 -11.578 -11.446 9.389 1.00 63.25 C ATOM 1221 O ILE B 175 -12.287 -12.443 9.520 1.00 31.22 O ATOM 1222 CB ILE B 175 -9.756 -11.520 7.685 1.00 62.31 C ATOM 1223 CG1 ILE B 175 -9.315 -11.078 6.287 1.00 4.02 C ATOM 1224 CG2 ILE B 175 -9.755 -13.038 7.791 1.00 72.23 C ATOM 1225 CD1 ILE B 175 -7.866 -11.390 5.984 1.00 2.13 C ATOM 0 H ILE B 175 -10.307 -9.087 7.598 1.00 24.21 H new ATOM 0 HA ILE B 175 -11.862 -11.327 7.262 1.00 23.11 H new ATOM 0 HB ILE B 175 -9.047 -11.124 8.412 1.00 62.31 H new ATOM 0 HG12 ILE B 175 -9.946 -11.566 5.544 1.00 4.02 H new ATOM 0 HG13 ILE B 175 -9.476 -10.005 6.186 1.00 4.02 H new ATOM 0 HG21 ILE B 175 -8.760 -13.418 7.561 1.00 72.23 H new ATOM 0 HG22 ILE B 175 -10.031 -13.332 8.804 1.00 72.23 H new ATOM 0 HG23 ILE B 175 -10.474 -13.453 7.084 1.00 72.23 H new ATOM 0 HD11 ILE B 175 -7.623 -11.049 4.977 1.00 2.13 H new ATOM 0 HD12 ILE B 175 -7.226 -10.880 6.704 1.00 2.13 H new ATOM 0 HD13 ILE B 175 -7.704 -12.466 6.052 1.00 2.13 H new ATOM 1237 N LYS B 176 -11.138 -10.731 10.420 1.00 2.12 N ATOM 1238 CA LYS B 176 -11.474 -11.085 11.794 1.00 63.55 C ATOM 1239 C LYS B 176 -12.978 -11.006 12.025 1.00 54.32 C ATOM 1240 O LYS B 176 -13.578 -11.918 12.594 1.00 21.32 O ATOM 1241 CB LYS B 176 -10.746 -10.160 12.773 1.00 22.51 C ATOM 1242 CG LYS B 176 -9.601 -10.832 13.509 1.00 64.21 C ATOM 1243 CD LYS B 176 -8.625 -9.813 14.073 1.00 41.31 C ATOM 1244 CE LYS B 176 -7.732 -10.427 15.141 1.00 74.23 C ATOM 1245 NZ LYS B 176 -6.333 -9.925 15.049 1.00 41.43 N ATOM 0 H LYS B 176 -10.548 -9.904 10.330 1.00 2.12 H new ATOM 0 HA LYS B 176 -11.153 -12.112 11.967 1.00 63.55 H new ATOM 0 HB2 LYS B 176 -10.360 -9.299 12.227 1.00 22.51 H new ATOM 0 HB3 LYS B 176 -11.462 -9.781 13.502 1.00 22.51 H new ATOM 0 HG2 LYS B 176 -9.998 -11.444 14.319 1.00 64.21 H new ATOM 0 HG3 LYS B 176 -9.075 -11.503 12.830 1.00 64.21 H new ATOM 0 HD2 LYS B 176 -8.009 -9.414 13.268 1.00 41.31 H new ATOM 0 HD3 LYS B 176 -9.178 -8.975 14.497 1.00 41.31 H new ATOM 0 HE2 LYS B 176 -8.136 -10.199 16.127 1.00 74.23 H new ATOM 0 HE3 LYS B 176 -7.736 -11.512 15.038 1.00 74.23 H new ATOM 0 HZ1 LYS B 176 -5.756 -10.367 15.793 1.00 41.43 H new ATOM 0 HZ2 LYS B 176 -5.939 -10.165 14.117 1.00 41.43 H new ATOM 0 HZ3 LYS B 176 -6.326 -8.892 15.172 1.00 41.43 H new ATOM 1259 N ARG B 177 -13.583 -9.908 11.580 1.00 25.32 N ATOM 1260 CA ARG B 177 -15.018 -9.710 11.739 1.00 13.34 C ATOM 1261 C ARG B 177 -15.802 -10.763 10.961 1.00 21.42 C ATOM 1262 O ARG B 177 -16.736 -11.369 11.485 1.00 1.05 O ATOM 1263 CB ARG B 177 -15.417 -8.310 11.267 1.00 31.44 C ATOM 1264 CG ARG B 177 -15.362 -7.259 12.363 1.00 70.52 C ATOM 1265 CD ARG B 177 -15.545 -5.859 11.801 1.00 53.34 C ATOM 1266 NE ARG B 177 -16.787 -5.732 11.042 1.00 42.25 N ATOM 1267 CZ ARG B 177 -17.980 -5.580 11.605 1.00 40.42 C ATOM 1268 NH1 ARG B 177 -18.092 -5.534 12.926 1.00 1.25 N ATOM 1269 NH2 ARG B 177 -19.064 -5.471 10.847 1.00 5.41 N ATOM 0 H ARG B 177 -13.101 -9.143 11.107 1.00 25.32 H new ATOM 0 HA ARG B 177 -15.258 -9.811 12.797 1.00 13.34 H new ATOM 0 HB2 ARG B 177 -14.758 -8.009 10.453 1.00 31.44 H new ATOM 0 HB3 ARG B 177 -16.428 -8.347 10.861 1.00 31.44 H new ATOM 0 HG2 ARG B 177 -16.138 -7.460 13.101 1.00 70.52 H new ATOM 0 HG3 ARG B 177 -14.405 -7.322 12.881 1.00 70.52 H new ATOM 0 HD2 ARG B 177 -15.544 -5.137 12.618 1.00 53.34 H new ATOM 0 HD3 ARG B 177 -14.700 -5.613 11.158 1.00 53.34 H new ATOM 0 HE ARG B 177 -16.735 -5.762 10.024 1.00 42.25 H new ATOM 0 HH11 ARG B 177 -17.261 -5.615 13.511 1.00 1.25 H new ATOM 0 HH12 ARG B 177 -19.009 -5.417 13.356 1.00 1.25 H new ATOM 0 HH21 ARG B 177 -18.981 -5.504 9.831 1.00 5.41 H new ATOM 0 HH22 ARG B 177 -19.980 -5.354 11.281 1.00 5.41 H new