USER MOD reduce.3.24.130724 H: found=0, std=0, add=705, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 707 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 11 LYS NZ :NH3+ 163:sc= -0.0342 (180deg=-0.312) USER MOD Single : A 13 THR OG1 : rot -63:sc= -2.05! USER MOD Single : A 14 LYS NZ :NH3+ 167:sc= -0.0147 (180deg=-0.201) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -23:sc= 0.214 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl 158:sc= -0.203 (180deg=-0.795) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0.929 USER MOD Single : A 48 ASN : amide:sc= -0.0533 K(o=-0.053,f=-0.82) USER MOD Single : A 49 HIS : no HE2:sc= -3.52! K(o=-3.5!,f=-1) USER MOD Single : B 213 THR OG1 : rot 180:sc= -0.539 USER MOD Single : B 214 LYS NZ :NH3+ -169:sc= -0.0277 (180deg=-0.178) USER MOD Single : B 221 TYR OH : rot 180:sc= 0 USER MOD Single : B 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 235 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 236 THR OG1 : rot 180:sc= 0 USER MOD Single : B 237 SER OG : rot 180:sc= 0.0016 USER MOD Single : B 238 MET CE :methyl 161:sc= -0.156 (180deg=-0.967) USER MOD Single : B 239 SER OG : rot 180:sc= 0 USER MOD Single : B 241 TYR OH : rot 61:sc= 0.972 USER MOD Single : B 248 ASN : amide:sc= -0.207 K(o=-0.21,f=0.75) USER MOD Single : B 249 HIS : no HE2:sc= -1.27 K(o=-1.3,f=-2.3) USER MOD ----------------------------------------------------------------- ATOM 145 N LYS A 11 5.379 14.442 -9.456 1.00 4.11 N ATOM 146 CA LYS A 11 6.266 13.294 -9.238 1.00 25.15 C ATOM 147 C LYS A 11 6.876 13.318 -7.823 1.00 43.12 C ATOM 148 O LYS A 11 7.934 13.903 -7.589 1.00 4.55 O ATOM 149 CB LYS A 11 7.378 13.251 -10.304 1.00 1.54 C ATOM 150 CG LYS A 11 8.273 14.490 -10.328 1.00 33.23 C ATOM 151 CD LYS A 11 9.432 14.341 -11.307 1.00 31.21 C ATOM 152 CE LYS A 11 10.405 15.510 -11.206 1.00 42.33 C ATOM 153 NZ LYS A 11 11.073 15.565 -9.876 1.00 31.02 N ATOM 0 HA LYS A 11 5.664 12.390 -9.329 1.00 25.15 H new ATOM 0 HB2 LYS A 11 7.999 12.372 -10.130 1.00 1.54 H new ATOM 0 HB3 LYS A 11 6.920 13.129 -11.286 1.00 1.54 H new ATOM 0 HG2 LYS A 11 7.678 15.361 -10.601 1.00 33.23 H new ATOM 0 HG3 LYS A 11 8.665 14.673 -9.328 1.00 33.23 H new ATOM 0 HD2 LYS A 11 9.960 13.409 -11.107 1.00 31.21 H new ATOM 0 HD3 LYS A 11 9.044 14.276 -12.324 1.00 31.21 H new ATOM 0 HE2 LYS A 11 11.160 15.422 -11.988 1.00 42.33 H new ATOM 0 HE3 LYS A 11 9.870 16.443 -11.382 1.00 42.33 H new ATOM 0 HZ1 LYS A 11 11.915 16.172 -9.935 1.00 31.02 H new ATOM 0 HZ2 LYS A 11 10.414 15.955 -9.172 1.00 31.02 H new ATOM 0 HZ3 LYS A 11 11.357 14.606 -9.590 1.00 31.02 H new ATOM 167 N ASP A 12 6.180 12.708 -6.871 1.00 34.41 N ATOM 168 CA ASP A 12 6.677 12.610 -5.494 1.00 35.15 C ATOM 169 C ASP A 12 6.799 11.146 -5.045 1.00 55.43 C ATOM 170 O ASP A 12 7.572 10.817 -4.146 1.00 61.42 O ATOM 171 CB ASP A 12 5.745 13.381 -4.550 1.00 52.31 C ATOM 172 CG ASP A 12 4.370 12.738 -4.397 1.00 60.11 C ATOM 173 OD1 ASP A 12 3.865 12.130 -5.368 1.00 44.32 O ATOM 174 OD2 ASP A 12 3.785 12.836 -3.299 1.00 64.32 O ATOM 0 H ASP A 12 5.270 12.273 -7.022 1.00 34.41 H new ATOM 0 HA ASP A 12 7.673 13.051 -5.458 1.00 35.15 H new ATOM 0 HB2 ASP A 12 6.214 13.455 -3.569 1.00 52.31 H new ATOM 0 HB3 ASP A 12 5.623 14.398 -4.923 1.00 52.31 H new ATOM 179 N THR A 13 6.029 10.274 -5.690 1.00 43.02 N ATOM 180 CA THR A 13 5.945 8.862 -5.306 1.00 70.24 C ATOM 181 C THR A 13 5.935 7.932 -6.532 1.00 61.21 C ATOM 182 O THR A 13 5.563 8.338 -7.634 1.00 43.55 O ATOM 183 CB THR A 13 4.674 8.606 -4.457 1.00 45.20 C ATOM 184 OG1 THR A 13 3.519 9.174 -5.097 1.00 62.24 O ATOM 185 CG2 THR A 13 4.811 9.194 -3.057 1.00 75.11 C ATOM 0 H THR A 13 5.447 10.521 -6.490 1.00 43.02 H new ATOM 0 HA THR A 13 6.834 8.638 -4.716 1.00 70.24 H new ATOM 0 HB THR A 13 4.552 7.526 -4.372 1.00 45.20 H new ATOM 0 HG1 THR A 13 3.622 10.147 -5.154 1.00 62.24 H new ATOM 0 HG21 THR A 13 3.902 8.996 -2.489 1.00 75.11 H new ATOM 0 HG22 THR A 13 5.662 8.736 -2.552 1.00 75.11 H new ATOM 0 HG23 THR A 13 4.967 10.270 -3.128 1.00 75.11 H new ATOM 193 N LYS A 14 6.364 6.684 -6.333 1.00 53.33 N ATOM 194 CA LYS A 14 6.390 5.674 -7.404 1.00 63.42 C ATOM 195 C LYS A 14 5.170 4.733 -7.326 1.00 11.12 C ATOM 196 O LYS A 14 4.727 4.377 -6.234 1.00 54.11 O ATOM 197 CB LYS A 14 7.685 4.847 -7.317 1.00 43.15 C ATOM 198 CG LYS A 14 8.957 5.642 -7.608 1.00 70.51 C ATOM 199 CD LYS A 14 9.017 6.111 -9.061 1.00 21.30 C ATOM 200 CE LYS A 14 10.299 6.881 -9.359 1.00 60.32 C ATOM 201 NZ LYS A 14 11.517 6.060 -9.119 1.00 55.05 N ATOM 0 H LYS A 14 6.702 6.342 -5.433 1.00 53.33 H new ATOM 0 HA LYS A 14 6.352 6.201 -8.357 1.00 63.42 H new ATOM 0 HB2 LYS A 14 7.760 4.415 -6.319 1.00 43.15 H new ATOM 0 HB3 LYS A 14 7.620 4.016 -8.020 1.00 43.15 H new ATOM 0 HG2 LYS A 14 9.004 6.506 -6.946 1.00 70.51 H new ATOM 0 HG3 LYS A 14 9.829 5.025 -7.390 1.00 70.51 H new ATOM 0 HD2 LYS A 14 8.950 5.248 -9.724 1.00 21.30 H new ATOM 0 HD3 LYS A 14 8.156 6.744 -9.274 1.00 21.30 H new ATOM 0 HE2 LYS A 14 10.287 7.215 -10.396 1.00 60.32 H new ATOM 0 HE3 LYS A 14 10.337 7.775 -8.736 1.00 60.32 H new ATOM 0 HZ1 LYS A 14 12.343 6.534 -9.536 1.00 55.05 H new ATOM 0 HZ2 LYS A 14 11.663 5.947 -8.096 1.00 55.05 H new ATOM 0 HZ3 LYS A 14 11.397 5.124 -9.557 1.00 55.05 H new ATOM 215 N PRO A 15 4.611 4.322 -8.483 1.00 24.11 N ATOM 216 CA PRO A 15 3.461 3.404 -8.536 1.00 23.25 C ATOM 217 C PRO A 15 3.841 1.938 -8.243 1.00 33.34 C ATOM 218 O PRO A 15 4.435 1.253 -9.082 1.00 34.50 O ATOM 219 CB PRO A 15 2.937 3.552 -9.982 1.00 42.43 C ATOM 220 CG PRO A 15 3.734 4.666 -10.592 1.00 31.14 C ATOM 221 CD PRO A 15 5.028 4.721 -9.830 1.00 14.11 C ATOM 0 HA PRO A 15 2.722 3.652 -7.774 1.00 23.25 H new ATOM 0 HB2 PRO A 15 3.067 2.626 -10.542 1.00 42.43 H new ATOM 0 HB3 PRO A 15 1.872 3.783 -9.990 1.00 42.43 H new ATOM 0 HG2 PRO A 15 3.913 4.482 -11.651 1.00 31.14 H new ATOM 0 HG3 PRO A 15 3.199 5.613 -10.519 1.00 31.14 H new ATOM 0 HD2 PRO A 15 5.773 4.042 -10.244 1.00 14.11 H new ATOM 0 HD3 PRO A 15 5.465 5.719 -9.842 1.00 14.11 H new ATOM 229 N VAL A 16 3.513 1.474 -7.042 1.00 10.30 N ATOM 230 CA VAL A 16 3.724 0.074 -6.655 1.00 63.42 C ATOM 231 C VAL A 16 2.399 -0.714 -6.698 1.00 63.51 C ATOM 232 O VAL A 16 1.350 -0.214 -6.294 1.00 13.34 O ATOM 233 CB VAL A 16 4.359 -0.027 -5.239 1.00 33.32 C ATOM 234 CG1 VAL A 16 3.483 0.661 -4.193 1.00 20.12 C ATOM 235 CG2 VAL A 16 4.623 -1.487 -4.857 1.00 1.15 C ATOM 0 H VAL A 16 3.096 2.049 -6.310 1.00 10.30 H new ATOM 0 HA VAL A 16 4.415 -0.365 -7.374 1.00 63.42 H new ATOM 0 HB VAL A 16 5.317 0.491 -5.267 1.00 33.32 H new ATOM 0 HG11 VAL A 16 3.951 0.575 -3.213 1.00 20.12 H new ATOM 0 HG12 VAL A 16 3.369 1.714 -4.449 1.00 20.12 H new ATOM 0 HG13 VAL A 16 2.503 0.185 -4.170 1.00 20.12 H new ATOM 0 HG21 VAL A 16 5.067 -1.528 -3.862 1.00 1.15 H new ATOM 0 HG22 VAL A 16 3.683 -2.039 -4.858 1.00 1.15 H new ATOM 0 HG23 VAL A 16 5.307 -1.934 -5.579 1.00 1.15 H new ATOM 245 N VAL A 17 2.450 -1.945 -7.207 1.00 12.30 N ATOM 246 CA VAL A 17 1.248 -2.783 -7.327 1.00 4.42 C ATOM 247 C VAL A 17 1.162 -3.821 -6.192 1.00 22.34 C ATOM 248 O VAL A 17 2.138 -4.506 -5.879 1.00 11.12 O ATOM 249 CB VAL A 17 1.200 -3.499 -8.704 1.00 3.51 C ATOM 250 CG1 VAL A 17 2.440 -4.367 -8.921 1.00 44.52 C ATOM 251 CG2 VAL A 17 -0.080 -4.327 -8.845 1.00 32.34 C ATOM 0 H VAL A 17 3.306 -2.387 -7.543 1.00 12.30 H new ATOM 0 HA VAL A 17 0.388 -2.118 -7.247 1.00 4.42 H new ATOM 0 HB VAL A 17 1.193 -2.731 -9.478 1.00 3.51 H new ATOM 0 HG11 VAL A 17 2.377 -4.855 -9.894 1.00 44.52 H new ATOM 0 HG12 VAL A 17 3.332 -3.742 -8.886 1.00 44.52 H new ATOM 0 HG13 VAL A 17 2.496 -5.124 -8.138 1.00 44.52 H new ATOM 0 HG21 VAL A 17 -0.090 -4.819 -9.818 1.00 32.34 H new ATOM 0 HG22 VAL A 17 -0.115 -5.080 -8.058 1.00 32.34 H new ATOM 0 HG23 VAL A 17 -0.948 -3.673 -8.760 1.00 32.34 H new ATOM 261 N VAL A 18 -0.014 -3.924 -5.578 1.00 2.14 N ATOM 262 CA VAL A 18 -0.240 -4.874 -4.483 1.00 40.21 C ATOM 263 C VAL A 18 -1.548 -5.659 -4.682 1.00 4.22 C ATOM 264 O VAL A 18 -2.538 -5.120 -5.169 1.00 31.23 O ATOM 265 CB VAL A 18 -0.277 -4.146 -3.115 1.00 50.52 C ATOM 266 CG1 VAL A 18 -1.346 -3.055 -3.104 1.00 52.14 C ATOM 267 CG2 VAL A 18 -0.504 -5.140 -1.978 1.00 24.42 C ATOM 0 H VAL A 18 -0.830 -3.361 -5.818 1.00 2.14 H new ATOM 0 HA VAL A 18 0.593 -5.576 -4.491 1.00 40.21 H new ATOM 0 HB VAL A 18 0.691 -3.669 -2.961 1.00 50.52 H new ATOM 0 HG11 VAL A 18 -1.351 -2.560 -2.133 1.00 52.14 H new ATOM 0 HG12 VAL A 18 -1.128 -2.324 -3.883 1.00 52.14 H new ATOM 0 HG13 VAL A 18 -2.323 -3.501 -3.289 1.00 52.14 H new ATOM 0 HG21 VAL A 18 -0.526 -4.607 -1.028 1.00 24.42 H new ATOM 0 HG22 VAL A 18 -1.453 -5.654 -2.128 1.00 24.42 H new ATOM 0 HG23 VAL A 18 0.306 -5.870 -1.966 1.00 24.42 H new ATOM 277 N ARG A 19 -1.543 -6.936 -4.309 1.00 21.32 N ATOM 278 CA ARG A 19 -2.744 -7.774 -4.414 1.00 51.35 C ATOM 279 C ARG A 19 -3.382 -8.008 -3.036 1.00 71.51 C ATOM 280 O ARG A 19 -2.849 -8.750 -2.211 1.00 42.50 O ATOM 281 CB ARG A 19 -2.401 -9.121 -5.069 1.00 53.14 C ATOM 282 CG ARG A 19 -1.787 -9.000 -6.461 1.00 64.33 C ATOM 283 CD ARG A 19 -1.741 -10.346 -7.178 1.00 23.21 C ATOM 284 NE ARG A 19 -3.083 -10.886 -7.409 1.00 41.04 N ATOM 285 CZ ARG A 19 -3.360 -11.850 -8.247 1.00 44.33 C ATOM 286 NH1 ARG A 19 -2.420 -12.461 -8.894 1.00 44.14 N ATOM 287 NH2 ARG A 19 -4.584 -12.222 -8.420 1.00 71.43 N ATOM 0 H ARG A 19 -0.726 -7.416 -3.932 1.00 21.32 H new ATOM 0 HA ARG A 19 -3.465 -7.246 -5.038 1.00 51.35 H new ATOM 0 HB2 ARG A 19 -1.708 -9.660 -4.424 1.00 53.14 H new ATOM 0 HB3 ARG A 19 -3.308 -9.722 -5.135 1.00 53.14 H new ATOM 0 HG2 ARG A 19 -2.366 -8.292 -7.054 1.00 64.33 H new ATOM 0 HG3 ARG A 19 -0.778 -8.597 -6.379 1.00 64.33 H new ATOM 0 HD2 ARG A 19 -1.226 -10.232 -8.132 1.00 23.21 H new ATOM 0 HD3 ARG A 19 -1.162 -11.054 -6.585 1.00 23.21 H new ATOM 0 HE ARG A 19 -3.855 -10.482 -6.879 1.00 41.04 H new ATOM 0 HH11 ARG A 19 -1.446 -12.192 -8.753 1.00 44.14 H new ATOM 0 HH12 ARG A 19 -2.653 -13.211 -9.544 1.00 44.14 H new ATOM 0 HH21 ARG A 19 -5.334 -11.764 -7.903 1.00 71.43 H new ATOM 0 HH22 ARG A 19 -4.801 -12.974 -9.074 1.00 71.43 H new ATOM 301 N LEU A 20 -4.525 -7.368 -2.792 1.00 43.43 N ATOM 302 CA LEU A 20 -5.235 -7.497 -1.509 1.00 65.21 C ATOM 303 C LEU A 20 -6.537 -8.303 -1.676 1.00 35.52 C ATOM 304 O LEU A 20 -7.059 -8.433 -2.783 1.00 14.10 O ATOM 305 CB LEU A 20 -5.546 -6.104 -0.935 1.00 62.42 C ATOM 306 CG LEU A 20 -6.173 -6.092 0.472 1.00 20.31 C ATOM 307 CD1 LEU A 20 -5.224 -6.712 1.496 1.00 52.44 C ATOM 308 CD2 LEU A 20 -6.560 -4.673 0.882 1.00 2.33 C ATOM 0 H LEU A 20 -4.984 -6.753 -3.464 1.00 43.43 H new ATOM 0 HA LEU A 20 -4.589 -8.034 -0.815 1.00 65.21 H new ATOM 0 HB2 LEU A 20 -4.622 -5.527 -0.907 1.00 62.42 H new ATOM 0 HB3 LEU A 20 -6.221 -5.591 -1.619 1.00 62.42 H new ATOM 0 HG LEU A 20 -7.080 -6.696 0.442 1.00 20.31 H new ATOM 0 HD11 LEU A 20 -5.689 -6.692 2.482 1.00 52.44 H new ATOM 0 HD12 LEU A 20 -5.010 -7.744 1.216 1.00 52.44 H new ATOM 0 HD13 LEU A 20 -4.295 -6.143 1.522 1.00 52.44 H new ATOM 0 HD21 LEU A 20 -7.001 -4.690 1.879 1.00 2.33 H new ATOM 0 HD22 LEU A 20 -5.672 -4.041 0.888 1.00 2.33 H new ATOM 0 HD23 LEU A 20 -7.284 -4.274 0.172 1.00 2.33 H new ATOM 320 N TYR A 21 -7.054 -8.845 -0.575 1.00 65.24 N ATOM 321 CA TYR A 21 -8.290 -9.639 -0.604 1.00 12.34 C ATOM 322 C TYR A 21 -9.523 -8.756 -0.889 1.00 42.23 C ATOM 323 O TYR A 21 -9.639 -7.647 -0.357 1.00 62.35 O ATOM 324 CB TYR A 21 -8.466 -10.378 0.730 1.00 74.52 C ATOM 325 CG TYR A 21 -7.354 -11.374 1.037 1.00 75.54 C ATOM 326 CD1 TYR A 21 -6.121 -10.946 1.526 1.00 34.14 C ATOM 327 CD2 TYR A 21 -7.537 -12.740 0.837 1.00 15.35 C ATOM 328 CE1 TYR A 21 -5.109 -11.846 1.806 1.00 62.01 C ATOM 329 CE2 TYR A 21 -6.529 -13.645 1.116 1.00 14.30 C ATOM 330 CZ TYR A 21 -5.317 -13.193 1.599 1.00 32.23 C ATOM 331 OH TYR A 21 -4.312 -14.094 1.879 1.00 23.35 O ATOM 0 H TYR A 21 -6.639 -8.751 0.352 1.00 65.24 H new ATOM 0 HA TYR A 21 -8.207 -10.365 -1.413 1.00 12.34 H new ATOM 0 HB2 TYR A 21 -8.517 -9.646 1.536 1.00 74.52 H new ATOM 0 HB3 TYR A 21 -9.420 -10.906 0.718 1.00 74.52 H new ATOM 0 HD1 TYR A 21 -5.953 -9.892 1.689 1.00 34.14 H new ATOM 0 HD2 TYR A 21 -8.482 -13.099 0.458 1.00 15.35 H new ATOM 0 HE1 TYR A 21 -4.160 -11.495 2.185 1.00 62.01 H new ATOM 0 HE2 TYR A 21 -6.689 -14.701 0.957 1.00 14.30 H new ATOM 0 HH TYR A 21 -4.622 -15.002 1.679 1.00 23.35 H new ATOM 341 N PRO A 22 -10.472 -9.243 -1.725 1.00 31.42 N ATOM 342 CA PRO A 22 -11.676 -8.478 -2.108 1.00 62.24 C ATOM 343 C PRO A 22 -12.467 -7.962 -0.897 1.00 13.11 C ATOM 344 O PRO A 22 -12.915 -6.815 -0.880 1.00 41.40 O ATOM 345 CB PRO A 22 -12.514 -9.495 -2.900 1.00 5.11 C ATOM 346 CG PRO A 22 -11.521 -10.479 -3.416 1.00 71.24 C ATOM 347 CD PRO A 22 -10.449 -10.576 -2.360 1.00 43.31 C ATOM 0 HA PRO A 22 -11.416 -7.583 -2.673 1.00 62.24 H new ATOM 0 HB2 PRO A 22 -13.257 -9.977 -2.264 1.00 5.11 H new ATOM 0 HB3 PRO A 22 -13.056 -9.014 -3.714 1.00 5.11 H new ATOM 0 HG2 PRO A 22 -11.987 -11.449 -3.590 1.00 71.24 H new ATOM 0 HG3 PRO A 22 -11.103 -10.150 -4.368 1.00 71.24 H new ATOM 0 HD2 PRO A 22 -10.663 -11.367 -1.641 1.00 43.31 H new ATOM 0 HD3 PRO A 22 -9.475 -10.797 -2.796 1.00 43.31 H new ATOM 355 N ASP A 23 -12.627 -8.827 0.109 1.00 43.33 N ATOM 356 CA ASP A 23 -13.332 -8.484 1.350 1.00 12.51 C ATOM 357 C ASP A 23 -12.862 -7.132 1.914 1.00 3.23 C ATOM 358 O ASP A 23 -13.665 -6.233 2.168 1.00 54.21 O ATOM 359 CB ASP A 23 -13.089 -9.584 2.395 1.00 33.12 C ATOM 360 CG ASP A 23 -13.506 -10.961 1.909 1.00 42.33 C ATOM 361 OD1 ASP A 23 -12.972 -11.423 0.876 1.00 42.14 O ATOM 362 OD2 ASP A 23 -14.364 -11.594 2.559 1.00 31.52 O ATOM 0 H ASP A 23 -12.273 -9.783 0.087 1.00 43.33 H new ATOM 0 HA ASP A 23 -14.395 -8.404 1.123 1.00 12.51 H new ATOM 0 HB2 ASP A 23 -12.031 -9.602 2.658 1.00 33.12 H new ATOM 0 HB3 ASP A 23 -13.639 -9.343 3.304 1.00 33.12 H new ATOM 367 N GLU A 24 -11.550 -6.998 2.082 1.00 74.54 N ATOM 368 CA GLU A 24 -10.950 -5.793 2.669 1.00 55.30 C ATOM 369 C GLU A 24 -11.100 -4.576 1.747 1.00 70.10 C ATOM 370 O GLU A 24 -11.539 -3.508 2.179 1.00 62.34 O ATOM 371 CB GLU A 24 -9.471 -6.055 2.964 1.00 64.21 C ATOM 372 CG GLU A 24 -9.242 -7.262 3.866 1.00 34.33 C ATOM 373 CD GLU A 24 -7.773 -7.608 4.024 1.00 14.53 C ATOM 374 OE1 GLU A 24 -7.084 -6.923 4.806 1.00 23.33 O ATOM 375 OE2 GLU A 24 -7.313 -8.573 3.375 1.00 42.03 O ATOM 0 H GLU A 24 -10.872 -7.713 1.819 1.00 74.54 H new ATOM 0 HA GLU A 24 -11.477 -5.565 3.595 1.00 55.30 H new ATOM 0 HB2 GLU A 24 -8.941 -6.207 2.024 1.00 64.21 H new ATOM 0 HB3 GLU A 24 -9.039 -5.171 3.434 1.00 64.21 H new ATOM 0 HG2 GLU A 24 -9.671 -7.063 4.848 1.00 34.33 H new ATOM 0 HG3 GLU A 24 -9.771 -8.122 3.456 1.00 34.33 H new ATOM 382 N ILE A 25 -10.742 -4.744 0.474 1.00 24.02 N ATOM 383 CA ILE A 25 -10.851 -3.665 -0.516 1.00 64.40 C ATOM 384 C ILE A 25 -12.279 -3.094 -0.574 1.00 52.11 C ATOM 385 O ILE A 25 -12.481 -1.877 -0.600 1.00 43.25 O ATOM 386 CB ILE A 25 -10.447 -4.160 -1.933 1.00 53.11 C ATOM 387 CG1 ILE A 25 -9.017 -4.730 -1.917 1.00 61.44 C ATOM 388 CG2 ILE A 25 -10.563 -3.029 -2.956 1.00 34.02 C ATOM 389 CD1 ILE A 25 -8.557 -5.279 -3.254 1.00 71.15 C ATOM 0 H ILE A 25 -10.373 -5.618 0.100 1.00 24.02 H new ATOM 0 HA ILE A 25 -10.166 -2.878 -0.199 1.00 64.40 H new ATOM 0 HB ILE A 25 -11.133 -4.955 -2.226 1.00 53.11 H new ATOM 0 HG12 ILE A 25 -8.328 -3.947 -1.601 1.00 61.44 H new ATOM 0 HG13 ILE A 25 -8.961 -5.523 -1.171 1.00 61.44 H new ATOM 0 HG21 ILE A 25 -10.275 -3.398 -3.941 1.00 34.02 H new ATOM 0 HG22 ILE A 25 -11.592 -2.672 -2.989 1.00 34.02 H new ATOM 0 HG23 ILE A 25 -9.904 -2.210 -2.669 1.00 34.02 H new ATOM 0 HD11 ILE A 25 -7.541 -5.662 -3.160 1.00 71.15 H new ATOM 0 HD12 ILE A 25 -9.221 -6.086 -3.564 1.00 71.15 H new ATOM 0 HD13 ILE A 25 -8.578 -4.485 -4.000 1.00 71.15 H new ATOM 401 N GLU A 26 -13.264 -3.986 -0.577 1.00 52.32 N ATOM 402 CA GLU A 26 -14.670 -3.593 -0.692 1.00 55.11 C ATOM 403 C GLU A 26 -15.226 -3.067 0.645 1.00 1.50 C ATOM 404 O GLU A 26 -16.115 -2.214 0.667 1.00 64.32 O ATOM 405 CB GLU A 26 -15.495 -4.781 -1.200 1.00 74.32 C ATOM 406 CG GLU A 26 -16.925 -4.424 -1.587 1.00 30.32 C ATOM 407 CD GLU A 26 -17.629 -5.563 -2.303 1.00 20.25 C ATOM 408 OE1 GLU A 26 -17.273 -5.844 -3.468 1.00 65.21 O ATOM 409 OE2 GLU A 26 -18.527 -6.191 -1.708 1.00 21.32 O ATOM 0 H GLU A 26 -13.116 -4.992 -0.501 1.00 52.32 H new ATOM 0 HA GLU A 26 -14.741 -2.775 -1.409 1.00 55.11 H new ATOM 0 HB2 GLU A 26 -14.993 -5.215 -2.065 1.00 74.32 H new ATOM 0 HB3 GLU A 26 -15.520 -5.549 -0.427 1.00 74.32 H new ATOM 0 HG2 GLU A 26 -17.486 -4.159 -0.691 1.00 30.32 H new ATOM 0 HG3 GLU A 26 -16.916 -3.544 -2.230 1.00 30.32 H new ATOM 416 N ALA A 27 -14.696 -3.572 1.755 1.00 70.14 N ATOM 417 CA ALA A 27 -15.080 -3.084 3.085 1.00 65.33 C ATOM 418 C ALA A 27 -14.485 -1.693 3.364 1.00 73.33 C ATOM 419 O ALA A 27 -15.101 -0.866 4.036 1.00 52.40 O ATOM 420 CB ALA A 27 -14.647 -4.076 4.161 1.00 42.44 C ATOM 0 H ALA A 27 -14.000 -4.318 1.765 1.00 70.14 H new ATOM 0 HA ALA A 27 -16.166 -2.993 3.108 1.00 65.33 H new ATOM 0 HB1 ALA A 27 -14.939 -3.700 5.141 1.00 42.44 H new ATOM 0 HB2 ALA A 27 -15.128 -5.038 3.984 1.00 42.44 H new ATOM 0 HB3 ALA A 27 -13.565 -4.200 4.127 1.00 42.44 H new ATOM 426 N LEU A 28 -13.289 -1.438 2.834 1.00 13.44 N ATOM 427 CA LEU A 28 -12.615 -0.145 3.011 1.00 22.30 C ATOM 428 C LEU A 28 -13.337 0.982 2.255 1.00 3.14 C ATOM 429 O LEU A 28 -13.542 2.071 2.795 1.00 65.42 O ATOM 430 CB LEU A 28 -11.158 -0.239 2.542 1.00 12.13 C ATOM 431 CG LEU A 28 -10.342 1.063 2.643 1.00 45.55 C ATOM 432 CD1 LEU A 28 -10.303 1.575 4.082 1.00 2.44 C ATOM 433 CD2 LEU A 28 -8.928 0.850 2.110 1.00 2.12 C ATOM 0 H LEU A 28 -12.763 -2.110 2.276 1.00 13.44 H new ATOM 0 HA LEU A 28 -12.640 0.096 4.074 1.00 22.30 H new ATOM 0 HB2 LEU A 28 -10.655 -1.008 3.128 1.00 12.13 H new ATOM 0 HB3 LEU A 28 -11.150 -0.572 1.504 1.00 12.13 H new ATOM 0 HG LEU A 28 -10.833 1.819 2.030 1.00 45.55 H new ATOM 0 HD11 LEU A 28 -9.720 2.495 4.125 1.00 2.44 H new ATOM 0 HD12 LEU A 28 -11.318 1.772 4.426 1.00 2.44 H new ATOM 0 HD13 LEU A 28 -9.842 0.824 4.723 1.00 2.44 H new ATOM 0 HD21 LEU A 28 -8.365 1.780 2.189 1.00 2.12 H new ATOM 0 HD22 LEU A 28 -8.432 0.075 2.694 1.00 2.12 H new ATOM 0 HD23 LEU A 28 -8.975 0.542 1.065 1.00 2.12 H new ATOM 445 N LYS A 29 -13.737 0.718 1.009 1.00 63.01 N ATOM 446 CA LYS A 29 -14.436 1.724 0.196 1.00 14.33 C ATOM 447 C LYS A 29 -15.804 2.099 0.803 1.00 32.41 C ATOM 448 O LYS A 29 -16.452 3.050 0.363 1.00 44.43 O ATOM 449 CB LYS A 29 -14.606 1.231 -1.248 1.00 43.41 C ATOM 450 CG LYS A 29 -15.474 -0.015 -1.386 1.00 55.22 C ATOM 451 CD LYS A 29 -15.615 -0.454 -2.843 1.00 64.21 C ATOM 452 CE LYS A 29 -14.270 -0.816 -3.466 1.00 41.12 C ATOM 453 NZ LYS A 29 -14.403 -1.201 -4.898 1.00 54.14 N ATOM 0 H LYS A 29 -13.592 -0.176 0.541 1.00 63.01 H new ATOM 0 HA LYS A 29 -13.820 2.623 0.189 1.00 14.33 H new ATOM 0 HB2 LYS A 29 -15.043 2.032 -1.844 1.00 43.41 H new ATOM 0 HB3 LYS A 29 -13.622 1.022 -1.667 1.00 43.41 H new ATOM 0 HG2 LYS A 29 -15.039 -0.827 -0.803 1.00 55.22 H new ATOM 0 HG3 LYS A 29 -16.462 0.183 -0.969 1.00 55.22 H new ATOM 0 HD2 LYS A 29 -16.283 -1.313 -2.899 1.00 64.21 H new ATOM 0 HD3 LYS A 29 -16.077 0.347 -3.420 1.00 64.21 H new ATOM 0 HE2 LYS A 29 -13.591 0.032 -3.380 1.00 41.12 H new ATOM 0 HE3 LYS A 29 -13.823 -1.640 -2.909 1.00 41.12 H new ATOM 0 HZ1 LYS A 29 -13.466 -1.439 -5.282 1.00 54.14 H new ATOM 0 HZ2 LYS A 29 -15.030 -2.027 -4.979 1.00 54.14 H new ATOM 0 HZ3 LYS A 29 -14.806 -0.407 -5.435 1.00 54.14 H new ATOM 467 N SER A 30 -16.224 1.357 1.825 1.00 2.40 N ATOM 468 CA SER A 30 -17.475 1.641 2.542 1.00 3.31 C ATOM 469 C SER A 30 -17.379 2.928 3.383 1.00 44.32 C ATOM 470 O SER A 30 -18.393 3.456 3.840 1.00 61.23 O ATOM 471 CB SER A 30 -17.835 0.451 3.447 1.00 74.42 C ATOM 472 OG SER A 30 -18.990 0.710 4.233 1.00 4.43 O ATOM 0 H SER A 30 -15.715 0.548 2.181 1.00 2.40 H new ATOM 0 HA SER A 30 -18.257 1.792 1.798 1.00 3.31 H new ATOM 0 HB2 SER A 30 -18.005 -0.433 2.833 1.00 74.42 H new ATOM 0 HB3 SER A 30 -16.993 0.226 4.102 1.00 74.42 H new ATOM 0 HG SER A 30 -19.114 1.678 4.323 1.00 4.43 H new ATOM 478 N ARG A 31 -16.158 3.435 3.582 1.00 42.35 N ATOM 479 CA ARG A 31 -15.940 4.634 4.409 1.00 73.02 C ATOM 480 C ARG A 31 -15.006 5.660 3.738 1.00 33.20 C ATOM 481 O ARG A 31 -14.451 6.531 4.409 1.00 10.02 O ATOM 482 CB ARG A 31 -15.374 4.217 5.777 1.00 22.30 C ATOM 483 CG ARG A 31 -14.121 3.344 5.695 1.00 70.40 C ATOM 484 CD ARG A 31 -13.686 2.854 7.073 1.00 23.44 C ATOM 485 NE ARG A 31 -12.624 1.849 6.996 1.00 53.44 N ATOM 486 CZ ARG A 31 -12.836 0.567 6.825 1.00 2.34 C ATOM 487 NH1 ARG A 31 -14.034 0.116 6.626 1.00 25.31 N ATOM 488 NH2 ARG A 31 -11.846 -0.262 6.845 1.00 30.33 N ATOM 0 H ARG A 31 -15.306 3.038 3.185 1.00 42.35 H new ATOM 0 HA ARG A 31 -16.905 5.124 4.535 1.00 73.02 H new ATOM 0 HB2 ARG A 31 -15.142 5.114 6.351 1.00 22.30 H new ATOM 0 HB3 ARG A 31 -16.144 3.677 6.328 1.00 22.30 H new ATOM 0 HG2 ARG A 31 -14.315 2.488 5.049 1.00 70.40 H new ATOM 0 HG3 ARG A 31 -13.311 3.912 5.238 1.00 70.40 H new ATOM 0 HD2 ARG A 31 -13.339 3.701 7.665 1.00 23.44 H new ATOM 0 HD3 ARG A 31 -14.545 2.432 7.594 1.00 23.44 H new ATOM 0 HE ARG A 31 -11.658 2.167 7.081 1.00 53.44 H new ATOM 0 HH11 ARG A 31 -14.824 0.761 6.601 1.00 25.31 H new ATOM 0 HH12 ARG A 31 -14.187 -0.884 6.494 1.00 25.31 H new ATOM 0 HH21 ARG A 31 -10.897 0.081 6.994 1.00 30.33 H new ATOM 0 HH22 ARG A 31 -12.013 -1.259 6.712 1.00 30.33 H new ATOM 502 N VAL A 32 -14.849 5.576 2.416 1.00 40.50 N ATOM 503 CA VAL A 32 -13.991 6.521 1.686 1.00 44.31 C ATOM 504 C VAL A 32 -14.793 7.734 1.170 1.00 31.33 C ATOM 505 O VAL A 32 -15.862 7.577 0.575 1.00 22.51 O ATOM 506 CB VAL A 32 -13.253 5.841 0.499 1.00 25.44 C ATOM 507 CG1 VAL A 32 -12.348 4.722 1.005 1.00 33.32 C ATOM 508 CG2 VAL A 32 -14.242 5.307 -0.540 1.00 21.22 C ATOM 0 H VAL A 32 -15.298 4.872 1.830 1.00 40.50 H new ATOM 0 HA VAL A 32 -13.245 6.870 2.400 1.00 44.31 H new ATOM 0 HB VAL A 32 -12.636 6.596 0.012 1.00 25.44 H new ATOM 0 HG11 VAL A 32 -11.839 4.256 0.161 1.00 33.32 H new ATOM 0 HG12 VAL A 32 -11.609 5.134 1.692 1.00 33.32 H new ATOM 0 HG13 VAL A 32 -12.949 3.975 1.524 1.00 33.32 H new ATOM 0 HG21 VAL A 32 -13.694 4.838 -1.357 1.00 21.22 H new ATOM 0 HG22 VAL A 32 -14.898 4.572 -0.074 1.00 21.22 H new ATOM 0 HG23 VAL A 32 -14.840 6.131 -0.930 1.00 21.22 H new ATOM 518 N PRO A 33 -14.290 8.964 1.402 1.00 34.42 N ATOM 519 CA PRO A 33 -14.960 10.201 0.947 1.00 52.41 C ATOM 520 C PRO A 33 -15.147 10.257 -0.581 1.00 74.02 C ATOM 521 O PRO A 33 -14.240 9.913 -1.341 1.00 13.03 O ATOM 522 CB PRO A 33 -14.008 11.317 1.417 1.00 63.44 C ATOM 523 CG PRO A 33 -13.200 10.698 2.511 1.00 54.54 C ATOM 524 CD PRO A 33 -13.045 9.251 2.135 1.00 71.12 C ATOM 0 HA PRO A 33 -15.970 10.282 1.350 1.00 52.41 H new ATOM 0 HB2 PRO A 33 -13.371 11.662 0.602 1.00 63.44 H new ATOM 0 HB3 PRO A 33 -14.562 12.184 1.777 1.00 63.44 H new ATOM 0 HG2 PRO A 33 -12.229 11.184 2.604 1.00 54.54 H new ATOM 0 HG3 PRO A 33 -13.701 10.801 3.474 1.00 54.54 H new ATOM 0 HD2 PRO A 33 -12.164 9.087 1.514 1.00 71.12 H new ATOM 0 HD3 PRO A 33 -12.938 8.615 3.014 1.00 71.12 H new ATOM 532 N ALA A 34 -16.318 10.722 -1.024 1.00 0.22 N ATOM 533 CA ALA A 34 -16.650 10.789 -2.459 1.00 72.42 C ATOM 534 C ALA A 34 -15.735 11.752 -3.237 1.00 34.33 C ATOM 535 O ALA A 34 -15.771 11.800 -4.467 1.00 31.11 O ATOM 536 CB ALA A 34 -18.112 11.190 -2.638 1.00 60.20 C ATOM 0 H ALA A 34 -17.059 11.060 -0.410 1.00 0.22 H new ATOM 0 HA ALA A 34 -16.487 9.794 -2.873 1.00 72.42 H new ATOM 0 HB1 ALA A 34 -18.349 11.237 -3.701 1.00 60.20 H new ATOM 0 HB2 ALA A 34 -18.753 10.452 -2.156 1.00 60.20 H new ATOM 0 HB3 ALA A 34 -18.279 12.167 -2.185 1.00 60.20 H new ATOM 542 N ASN A 35 -14.924 12.526 -2.517 1.00 75.40 N ATOM 543 CA ASN A 35 -13.989 13.470 -3.145 1.00 22.25 C ATOM 544 C ASN A 35 -12.555 12.911 -3.181 1.00 20.25 C ATOM 545 O ASN A 35 -11.673 13.476 -3.832 1.00 12.05 O ATOM 546 CB ASN A 35 -14.002 14.803 -2.391 1.00 21.12 C ATOM 547 CG ASN A 35 -15.394 15.398 -2.295 1.00 4.34 C ATOM 548 OD1 ASN A 35 -15.841 16.117 -3.183 1.00 53.41 O ATOM 549 ND2 ASN A 35 -16.079 15.130 -1.205 1.00 62.22 N ATOM 0 H ASN A 35 -14.893 12.521 -1.497 1.00 75.40 H new ATOM 0 HA ASN A 35 -14.318 13.625 -4.173 1.00 22.25 H new ATOM 0 HB2 ASN A 35 -13.603 14.654 -1.388 1.00 21.12 H new ATOM 0 HB3 ASN A 35 -13.342 15.509 -2.895 1.00 21.12 H new ATOM 0 HD21 ASN A 35 -17.011 15.524 -1.079 1.00 62.22 H new ATOM 0 HD22 ASN A 35 -15.678 14.528 -0.486 1.00 62.22 H new ATOM 556 N THR A 36 -12.325 11.800 -2.481 1.00 21.11 N ATOM 557 CA THR A 36 -10.982 11.212 -2.370 1.00 35.20 C ATOM 558 C THR A 36 -10.879 9.886 -3.135 1.00 41.10 C ATOM 559 O THR A 36 -11.530 8.898 -2.788 1.00 13.23 O ATOM 560 CB THR A 36 -10.589 10.978 -0.890 1.00 21.31 C ATOM 561 OG1 THR A 36 -10.635 12.218 -0.165 1.00 42.15 O ATOM 562 CG2 THR A 36 -9.191 10.377 -0.770 1.00 55.05 C ATOM 0 H THR A 36 -13.050 11.286 -1.980 1.00 21.11 H new ATOM 0 HA THR A 36 -10.292 11.929 -2.814 1.00 35.20 H new ATOM 0 HB THR A 36 -11.305 10.273 -0.467 1.00 21.31 H new ATOM 0 HG1 THR A 36 -10.387 12.060 0.770 1.00 42.15 H new ATOM 0 HG21 THR A 36 -8.949 10.226 0.282 1.00 55.05 H new ATOM 0 HG22 THR A 36 -9.161 9.419 -1.290 1.00 55.05 H new ATOM 0 HG23 THR A 36 -8.464 11.055 -1.216 1.00 55.05 H new ATOM 570 N SER A 37 -10.061 9.879 -4.184 1.00 30.50 N ATOM 571 CA SER A 37 -9.813 8.671 -4.981 1.00 45.24 C ATOM 572 C SER A 37 -9.045 7.615 -4.175 1.00 30.44 C ATOM 573 O SER A 37 -8.135 7.941 -3.411 1.00 65.44 O ATOM 574 CB SER A 37 -9.020 9.022 -6.245 1.00 22.31 C ATOM 575 OG SER A 37 -7.755 9.591 -5.925 1.00 15.41 O ATOM 0 H SER A 37 -9.552 10.702 -4.508 1.00 30.50 H new ATOM 0 HA SER A 37 -10.782 8.256 -5.259 1.00 45.24 H new ATOM 0 HB2 SER A 37 -8.875 8.124 -6.846 1.00 22.31 H new ATOM 0 HB3 SER A 37 -9.593 9.723 -6.852 1.00 22.31 H new ATOM 0 HG SER A 37 -7.273 9.802 -6.752 1.00 15.41 H new ATOM 581 N MET A 38 -9.407 6.347 -4.361 1.00 12.23 N ATOM 582 CA MET A 38 -8.767 5.244 -3.634 1.00 32.02 C ATOM 583 C MET A 38 -7.253 5.177 -3.901 1.00 32.34 C ATOM 584 O MET A 38 -6.476 4.896 -2.993 1.00 11.31 O ATOM 585 CB MET A 38 -9.426 3.907 -3.996 1.00 51.13 C ATOM 586 CG MET A 38 -10.899 3.824 -3.611 1.00 63.32 C ATOM 587 SD MET A 38 -11.614 2.196 -3.936 1.00 4.21 S ATOM 588 CE MET A 38 -10.604 1.155 -2.879 1.00 64.14 C ATOM 0 H MET A 38 -10.139 6.054 -5.008 1.00 12.23 H new ATOM 0 HA MET A 38 -8.906 5.437 -2.570 1.00 32.02 H new ATOM 0 HB2 MET A 38 -9.331 3.744 -5.070 1.00 51.13 H new ATOM 0 HB3 MET A 38 -8.885 3.100 -3.502 1.00 51.13 H new ATOM 0 HG2 MET A 38 -11.007 4.059 -2.552 1.00 63.32 H new ATOM 0 HG3 MET A 38 -11.458 4.579 -4.164 1.00 63.32 H new ATOM 0 HE1 MET A 38 -11.138 0.230 -2.661 1.00 64.14 H new ATOM 0 HE2 MET A 38 -9.667 0.922 -3.385 1.00 64.14 H new ATOM 0 HE3 MET A 38 -10.392 1.679 -1.947 1.00 64.14 H new ATOM 598 N SER A 39 -6.842 5.448 -5.144 1.00 41.21 N ATOM 599 CA SER A 39 -5.412 5.439 -5.516 1.00 13.24 C ATOM 600 C SER A 39 -4.573 6.325 -4.582 1.00 30.14 C ATOM 601 O SER A 39 -3.476 5.947 -4.168 1.00 20.43 O ATOM 602 CB SER A 39 -5.229 5.907 -6.967 1.00 12.23 C ATOM 603 OG SER A 39 -5.915 5.057 -7.874 1.00 14.14 O ATOM 0 H SER A 39 -7.473 5.676 -5.912 1.00 41.21 H new ATOM 0 HA SER A 39 -5.062 4.412 -5.417 1.00 13.24 H new ATOM 0 HB2 SER A 39 -5.598 6.927 -7.071 1.00 12.23 H new ATOM 0 HB3 SER A 39 -4.168 5.925 -7.214 1.00 12.23 H new ATOM 0 HG SER A 39 -5.782 5.380 -8.790 1.00 14.14 H new ATOM 609 N ALA A 40 -5.092 7.507 -4.261 1.00 63.34 N ATOM 610 CA ALA A 40 -4.407 8.425 -3.346 1.00 73.01 C ATOM 611 C ALA A 40 -4.775 8.136 -1.878 1.00 42.32 C ATOM 612 O ALA A 40 -3.982 8.383 -0.969 1.00 21.21 O ATOM 613 CB ALA A 40 -4.737 9.869 -3.705 1.00 30.30 C ATOM 0 H ALA A 40 -5.982 7.854 -4.618 1.00 63.34 H new ATOM 0 HA ALA A 40 -3.334 8.269 -3.454 1.00 73.01 H new ATOM 0 HB1 ALA A 40 -4.222 10.541 -3.018 1.00 30.30 H new ATOM 0 HB2 ALA A 40 -4.412 10.074 -4.725 1.00 30.30 H new ATOM 0 HB3 ALA A 40 -5.813 10.026 -3.629 1.00 30.30 H new ATOM 619 N TYR A 41 -5.976 7.598 -1.656 1.00 20.23 N ATOM 620 CA TYR A 41 -6.441 7.269 -0.306 1.00 60.35 C ATOM 621 C TYR A 41 -5.558 6.189 0.341 1.00 20.21 C ATOM 622 O TYR A 41 -5.140 6.319 1.492 1.00 44.55 O ATOM 623 CB TYR A 41 -7.900 6.795 -0.350 1.00 71.13 C ATOM 624 CG TYR A 41 -8.497 6.562 1.025 1.00 22.12 C ATOM 625 CD1 TYR A 41 -8.992 7.626 1.770 1.00 54.13 C ATOM 626 CD2 TYR A 41 -8.546 5.288 1.586 1.00 51.43 C ATOM 627 CE1 TYR A 41 -9.518 7.428 3.029 1.00 2.33 C ATOM 628 CE2 TYR A 41 -9.067 5.087 2.849 1.00 53.15 C ATOM 629 CZ TYR A 41 -9.552 6.160 3.565 1.00 24.14 C ATOM 630 OH TYR A 41 -10.057 5.965 4.828 1.00 44.13 O ATOM 0 H TYR A 41 -6.645 7.381 -2.394 1.00 20.23 H new ATOM 0 HA TYR A 41 -6.373 8.172 0.301 1.00 60.35 H new ATOM 0 HB2 TYR A 41 -8.500 7.536 -0.878 1.00 71.13 H new ATOM 0 HB3 TYR A 41 -7.957 5.871 -0.925 1.00 71.13 H new ATOM 0 HD1 TYR A 41 -8.964 8.623 1.356 1.00 54.13 H new ATOM 0 HD2 TYR A 41 -8.171 4.445 1.025 1.00 51.43 H new ATOM 0 HE1 TYR A 41 -9.902 8.265 3.593 1.00 2.33 H new ATOM 0 HE2 TYR A 41 -9.094 4.094 3.273 1.00 53.15 H new ATOM 0 HH TYR A 41 -10.010 5.013 5.056 1.00 44.13 H new ATOM 640 N ILE A 42 -5.274 5.123 -0.407 1.00 74.32 N ATOM 641 CA ILE A 42 -4.406 4.047 0.085 1.00 64.25 C ATOM 642 C ILE A 42 -3.005 4.581 0.426 1.00 55.43 C ATOM 643 O ILE A 42 -2.318 4.051 1.304 1.00 21.00 O ATOM 644 CB ILE A 42 -4.279 2.900 -0.956 1.00 13.11 C ATOM 645 CG1 ILE A 42 -5.667 2.362 -1.346 1.00 4.33 C ATOM 646 CG2 ILE A 42 -3.400 1.768 -0.420 1.00 75.11 C ATOM 647 CD1 ILE A 42 -6.458 1.782 -0.189 1.00 64.21 C ATOM 0 H ILE A 42 -5.629 4.979 -1.352 1.00 74.32 H new ATOM 0 HA ILE A 42 -4.869 3.652 0.989 1.00 64.25 H new ATOM 0 HB ILE A 42 -3.803 3.309 -1.847 1.00 13.11 H new ATOM 0 HG12 ILE A 42 -6.244 3.170 -1.797 1.00 4.33 H new ATOM 0 HG13 ILE A 42 -5.545 1.593 -2.109 1.00 4.33 H new ATOM 0 HG21 ILE A 42 -3.328 0.978 -1.168 1.00 75.11 H new ATOM 0 HG22 ILE A 42 -2.404 2.153 -0.201 1.00 75.11 H new ATOM 0 HG23 ILE A 42 -3.841 1.365 0.492 1.00 75.11 H new ATOM 0 HD11 ILE A 42 -7.423 1.426 -0.550 1.00 64.21 H new ATOM 0 HD12 ILE A 42 -5.905 0.951 0.249 1.00 64.21 H new ATOM 0 HD13 ILE A 42 -6.615 2.552 0.567 1.00 64.21 H new ATOM 659 N ARG A 43 -2.596 5.657 -0.254 1.00 61.44 N ATOM 660 CA ARG A 43 -1.264 6.234 -0.057 1.00 24.14 C ATOM 661 C ARG A 43 -1.080 6.771 1.374 1.00 53.33 C ATOM 662 O ARG A 43 0.015 6.686 1.931 1.00 23.35 O ATOM 663 CB ARG A 43 -0.982 7.337 -1.091 1.00 41.05 C ATOM 664 CG ARG A 43 0.466 7.833 -1.069 1.00 55.50 C ATOM 665 CD ARG A 43 0.843 8.617 -2.327 1.00 73.22 C ATOM 666 NE ARG A 43 0.298 9.974 -2.348 1.00 14.45 N ATOM 667 CZ ARG A 43 0.909 10.986 -2.911 1.00 63.30 C ATOM 668 NH1 ARG A 43 2.022 10.808 -3.545 1.00 23.01 N ATOM 669 NH2 ARG A 43 0.396 12.170 -2.865 1.00 1.41 N ATOM 0 H ARG A 43 -3.167 6.144 -0.944 1.00 61.44 H new ATOM 0 HA ARG A 43 -0.540 5.432 -0.203 1.00 24.14 H new ATOM 0 HB2 ARG A 43 -1.214 6.959 -2.087 1.00 41.05 H new ATOM 0 HB3 ARG A 43 -1.650 8.178 -0.905 1.00 41.05 H new ATOM 0 HG2 ARG A 43 0.615 8.465 -0.194 1.00 55.50 H new ATOM 0 HG3 ARG A 43 1.136 6.980 -0.964 1.00 55.50 H new ATOM 0 HD2 ARG A 43 1.929 8.668 -2.403 1.00 73.22 H new ATOM 0 HD3 ARG A 43 0.487 8.076 -3.204 1.00 73.22 H new ATOM 0 HE ARG A 43 -0.604 10.141 -1.901 1.00 14.45 H new ATOM 0 HH11 ARG A 43 2.429 9.875 -3.609 1.00 23.01 H new ATOM 0 HH12 ARG A 43 2.493 11.601 -3.981 1.00 23.01 H new ATOM 0 HH21 ARG A 43 -0.492 12.323 -2.387 1.00 1.41 H new ATOM 0 HH22 ARG A 43 0.879 12.953 -3.306 1.00 1.41 H new ATOM 683 N ARG A 44 -2.146 7.310 1.977 1.00 42.11 N ATOM 684 CA ARG A 44 -2.070 7.771 3.370 1.00 42.43 C ATOM 685 C ARG A 44 -1.972 6.566 4.323 1.00 73.52 C ATOM 686 O ARG A 44 -1.273 6.611 5.333 1.00 43.13 O ATOM 687 CB ARG A 44 -3.282 8.649 3.755 1.00 62.22 C ATOM 688 CG ARG A 44 -4.572 7.871 4.019 1.00 10.13 C ATOM 689 CD ARG A 44 -5.663 8.745 4.628 1.00 22.43 C ATOM 690 NE ARG A 44 -6.826 7.950 5.031 1.00 42.10 N ATOM 691 CZ ARG A 44 -7.068 7.573 6.261 1.00 41.40 C ATOM 692 NH1 ARG A 44 -6.281 7.932 7.225 1.00 21.23 N ATOM 693 NH2 ARG A 44 -8.108 6.849 6.532 1.00 0.23 N ATOM 0 H ARG A 44 -3.056 7.437 1.533 1.00 42.11 H new ATOM 0 HA ARG A 44 -1.174 8.384 3.463 1.00 42.43 H new ATOM 0 HB2 ARG A 44 -3.030 9.223 4.647 1.00 62.22 H new ATOM 0 HB3 ARG A 44 -3.463 9.367 2.955 1.00 62.22 H new ATOM 0 HG2 ARG A 44 -4.933 7.443 3.084 1.00 10.13 H new ATOM 0 HG3 ARG A 44 -4.360 7.038 4.690 1.00 10.13 H new ATOM 0 HD2 ARG A 44 -5.265 9.275 5.494 1.00 22.43 H new ATOM 0 HD3 ARG A 44 -5.971 9.501 3.906 1.00 22.43 H new ATOM 0 HE ARG A 44 -7.489 7.673 4.307 1.00 42.10 H new ATOM 0 HH11 ARG A 44 -5.466 8.513 7.028 1.00 21.23 H new ATOM 0 HH12 ARG A 44 -6.476 7.634 8.181 1.00 21.23 H new ATOM 0 HH21 ARG A 44 -8.744 6.570 5.785 1.00 0.23 H new ATOM 0 HH22 ARG A 44 -8.291 6.558 7.492 1.00 0.23 H new ATOM 707 N ILE A 45 -2.669 5.482 3.972 1.00 0.33 N ATOM 708 CA ILE A 45 -2.697 4.266 4.792 1.00 73.40 C ATOM 709 C ILE A 45 -1.303 3.630 4.902 1.00 34.11 C ATOM 710 O ILE A 45 -0.833 3.315 6.001 1.00 34.41 O ATOM 711 CB ILE A 45 -3.693 3.230 4.207 1.00 51.32 C ATOM 712 CG1 ILE A 45 -5.118 3.810 4.200 1.00 35.13 C ATOM 713 CG2 ILE A 45 -3.646 1.921 4.996 1.00 21.35 C ATOM 714 CD1 ILE A 45 -6.165 2.875 3.626 1.00 3.23 C ATOM 0 H ILE A 45 -3.225 5.421 3.119 1.00 0.33 H new ATOM 0 HA ILE A 45 -3.025 4.558 5.790 1.00 73.40 H new ATOM 0 HB ILE A 45 -3.400 3.012 3.180 1.00 51.32 H new ATOM 0 HG12 ILE A 45 -5.398 4.069 5.221 1.00 35.13 H new ATOM 0 HG13 ILE A 45 -5.119 4.736 3.625 1.00 35.13 H new ATOM 0 HG21 ILE A 45 -4.353 1.212 4.566 1.00 21.35 H new ATOM 0 HG22 ILE A 45 -2.640 1.504 4.949 1.00 21.35 H new ATOM 0 HG23 ILE A 45 -3.911 2.113 6.036 1.00 21.35 H new ATOM 0 HD11 ILE A 45 -7.141 3.359 3.657 1.00 3.23 H new ATOM 0 HD12 ILE A 45 -5.912 2.635 2.593 1.00 3.23 H new ATOM 0 HD13 ILE A 45 -6.196 1.958 4.214 1.00 3.23 H new ATOM 726 N ILE A 46 -0.645 3.446 3.761 1.00 14.32 N ATOM 727 CA ILE A 46 0.714 2.902 3.743 1.00 22.14 C ATOM 728 C ILE A 46 1.728 3.904 4.326 1.00 40.10 C ATOM 729 O ILE A 46 2.604 3.520 5.098 1.00 41.44 O ATOM 730 CB ILE A 46 1.150 2.474 2.315 1.00 30.31 C ATOM 731 CG1 ILE A 46 1.052 3.652 1.333 1.00 43.21 C ATOM 732 CG2 ILE A 46 0.304 1.296 1.833 1.00 63.43 C ATOM 733 CD1 ILE A 46 1.432 3.304 -0.094 1.00 70.25 C ATOM 0 H ILE A 46 -1.026 3.663 2.840 1.00 14.32 H new ATOM 0 HA ILE A 46 0.701 2.012 4.373 1.00 22.14 H new ATOM 0 HB ILE A 46 2.193 2.159 2.356 1.00 30.31 H new ATOM 0 HG12 ILE A 46 0.031 4.035 1.343 1.00 43.21 H new ATOM 0 HG13 ILE A 46 1.698 4.457 1.683 1.00 43.21 H new ATOM 0 HG21 ILE A 46 0.621 1.007 0.831 1.00 63.43 H new ATOM 0 HG22 ILE A 46 0.433 0.453 2.512 1.00 63.43 H new ATOM 0 HG23 ILE A 46 -0.746 1.587 1.812 1.00 63.43 H new ATOM 0 HD11 ILE A 46 1.336 4.189 -0.722 1.00 70.25 H new ATOM 0 HD12 ILE A 46 2.463 2.951 -0.120 1.00 70.25 H new ATOM 0 HD13 ILE A 46 0.771 2.522 -0.466 1.00 70.25 H new ATOM 745 N LEU A 47 1.586 5.192 3.983 1.00 21.31 N ATOM 746 CA LEU A 47 2.487 6.238 4.493 1.00 43.22 C ATOM 747 C LEU A 47 2.534 6.244 6.030 1.00 22.43 C ATOM 748 O LEU A 47 3.609 6.157 6.628 1.00 61.01 O ATOM 749 CB LEU A 47 2.051 7.620 3.980 1.00 12.14 C ATOM 750 CG LEU A 47 2.900 8.803 4.476 1.00 30.24 C ATOM 751 CD1 LEU A 47 4.362 8.615 4.089 1.00 13.32 C ATOM 752 CD2 LEU A 47 2.360 10.122 3.925 1.00 71.22 C ATOM 0 H LEU A 47 0.858 5.535 3.356 1.00 21.31 H new ATOM 0 HA LEU A 47 3.488 6.016 4.124 1.00 43.22 H new ATOM 0 HB2 LEU A 47 2.075 7.609 2.890 1.00 12.14 H new ATOM 0 HB3 LEU A 47 1.015 7.789 4.275 1.00 12.14 H new ATOM 0 HG LEU A 47 2.837 8.837 5.564 1.00 30.24 H new ATOM 0 HD11 LEU A 47 4.946 9.462 4.449 1.00 13.32 H new ATOM 0 HD12 LEU A 47 4.742 7.697 4.537 1.00 13.32 H new ATOM 0 HD13 LEU A 47 4.446 8.551 3.004 1.00 13.32 H new ATOM 0 HD21 LEU A 47 2.974 10.946 4.287 1.00 71.22 H new ATOM 0 HD22 LEU A 47 2.388 10.100 2.836 1.00 71.22 H new ATOM 0 HD23 LEU A 47 1.332 10.262 4.258 1.00 71.22 H new ATOM 764 N ASN A 48 1.359 6.317 6.659 1.00 22.11 N ATOM 765 CA ASN A 48 1.258 6.328 8.128 1.00 20.44 C ATOM 766 C ASN A 48 1.920 5.093 8.764 1.00 44.14 C ATOM 767 O ASN A 48 2.219 5.088 9.958 1.00 20.32 O ATOM 768 CB ASN A 48 -0.212 6.400 8.564 1.00 11.43 C ATOM 769 CG ASN A 48 -0.890 7.691 8.139 1.00 10.42 C ATOM 770 OD1 ASN A 48 -0.252 8.728 8.007 1.00 71.42 O ATOM 771 ND2 ASN A 48 -2.192 7.646 7.936 1.00 63.35 N ATOM 0 H ASN A 48 0.461 6.370 6.178 1.00 22.11 H new ATOM 0 HA ASN A 48 1.790 7.213 8.476 1.00 20.44 H new ATOM 0 HB2 ASN A 48 -0.754 5.554 8.140 1.00 11.43 H new ATOM 0 HB3 ASN A 48 -0.270 6.305 9.648 1.00 11.43 H new ATOM 0 HD21 ASN A 48 -2.695 8.490 7.661 1.00 63.35 H new ATOM 0 HD22 ASN A 48 -2.696 6.767 8.054 1.00 63.35 H new ATOM 778 N HIS A 49 2.137 4.043 7.972 1.00 54.10 N ATOM 779 CA HIS A 49 2.756 2.815 8.479 1.00 65.31 C ATOM 780 C HIS A 49 4.173 2.604 7.905 1.00 54.54 C ATOM 781 O HIS A 49 4.908 1.734 8.367 1.00 71.01 O ATOM 782 CB HIS A 49 1.852 1.611 8.178 1.00 23.11 C ATOM 783 CG HIS A 49 2.221 0.370 8.936 1.00 20.13 C ATOM 784 ND1 HIS A 49 2.475 0.361 10.290 1.00 44.32 N ATOM 785 CD2 HIS A 49 2.368 -0.911 8.525 1.00 41.15 C ATOM 786 CE1 HIS A 49 2.758 -0.864 10.672 1.00 61.32 C ATOM 787 NE2 HIS A 49 2.702 -1.657 9.624 1.00 75.54 N ATOM 0 H HIS A 49 1.895 4.016 6.981 1.00 54.10 H new ATOM 0 HA HIS A 49 2.866 2.913 9.559 1.00 65.31 H new ATOM 0 HB2 HIS A 49 0.821 1.875 8.413 1.00 23.11 H new ATOM 0 HB3 HIS A 49 1.891 1.398 7.110 1.00 23.11 H new ATOM 0 HD1 HIS A 49 2.448 1.178 10.901 1.00 44.32 H new ATOM 0 HD2 HIS A 49 2.245 -1.277 7.517 1.00 41.15 H new ATOM 0 HE1 HIS A 49 2.997 -1.169 11.680 1.00 61.32 H new ATOM 796 N LEU A 50 4.555 3.403 6.908 1.00 42.00 N ATOM 797 CA LEU A 50 5.923 3.371 6.363 1.00 34.23 C ATOM 798 C LEU A 50 6.886 4.156 7.264 1.00 72.53 C ATOM 799 O LEU A 50 7.947 3.656 7.637 1.00 40.24 O ATOM 800 CB LEU A 50 5.954 3.923 4.925 1.00 15.30 C ATOM 801 CG LEU A 50 6.089 2.864 3.813 1.00 42.23 C ATOM 802 CD1 LEU A 50 7.418 2.121 3.932 1.00 20.23 C ATOM 803 CD2 LEU A 50 4.922 1.878 3.849 1.00 11.11 C ATOM 0 H LEU A 50 3.941 4.082 6.458 1.00 42.00 H new ATOM 0 HA LEU A 50 6.251 2.332 6.335 1.00 34.23 H new ATOM 0 HB2 LEU A 50 5.040 4.492 4.753 1.00 15.30 H new ATOM 0 HB3 LEU A 50 6.786 4.622 4.840 1.00 15.30 H new ATOM 0 HG LEU A 50 6.067 3.382 2.854 1.00 42.23 H new ATOM 0 HD11 LEU A 50 7.492 1.379 3.137 1.00 20.23 H new ATOM 0 HD12 LEU A 50 8.241 2.831 3.844 1.00 20.23 H new ATOM 0 HD13 LEU A 50 7.471 1.623 4.900 1.00 20.23 H new ATOM 0 HD21 LEU A 50 5.043 1.142 3.054 1.00 11.11 H new ATOM 0 HD22 LEU A 50 4.904 1.371 4.813 1.00 11.11 H new ATOM 0 HD23 LEU A 50 3.986 2.417 3.705 1.00 11.11 H new ATOM 815 N GLU A 51 6.505 5.384 7.626 1.00 31.32 N ATOM 816 CA GLU A 51 7.267 6.162 8.616 1.00 44.14 C ATOM 817 C GLU A 51 7.046 5.612 10.040 1.00 33.03 C ATOM 818 O GLU A 51 7.576 6.139 11.021 1.00 25.11 O ATOM 819 CB GLU A 51 6.905 7.658 8.538 1.00 71.43 C ATOM 820 CG GLU A 51 5.412 7.953 8.642 1.00 61.04 C ATOM 821 CD GLU A 51 5.105 9.445 8.586 1.00 1.22 C ATOM 822 OE1 GLU A 51 5.379 10.080 7.542 1.00 2.03 O ATOM 823 OE2 GLU A 51 4.608 9.998 9.591 1.00 73.30 O ATOM 0 H GLU A 51 5.683 5.860 7.255 1.00 31.32 H new ATOM 0 HA GLU A 51 8.326 6.061 8.380 1.00 44.14 H new ATOM 0 HB2 GLU A 51 7.424 8.187 9.338 1.00 71.43 H new ATOM 0 HB3 GLU A 51 7.277 8.060 7.596 1.00 71.43 H new ATOM 0 HG2 GLU A 51 4.888 7.447 7.831 1.00 61.04 H new ATOM 0 HG3 GLU A 51 5.028 7.541 9.575 1.00 61.04 H new ATOM 830 N ASP A 52 6.246 4.550 10.134 1.00 14.40 N ATOM 831 CA ASP A 52 6.073 3.789 11.376 1.00 10.24 C ATOM 832 C ASP A 52 7.030 2.575 11.392 1.00 22.02 C ATOM 833 O ASP A 52 7.765 2.355 12.357 1.00 3.30 O ATOM 834 CB ASP A 52 4.611 3.341 11.498 1.00 75.42 C ATOM 835 CG ASP A 52 4.352 2.466 12.710 1.00 4.41 C ATOM 836 OD1 ASP A 52 4.411 2.978 13.847 1.00 34.45 O ATOM 837 OD2 ASP A 52 4.068 1.267 12.530 1.00 33.14 O ATOM 0 H ASP A 52 5.698 4.191 9.352 1.00 14.40 H new ATOM 0 HA ASP A 52 6.317 4.420 12.231 1.00 10.24 H new ATOM 0 HB2 ASP A 52 3.971 4.222 11.551 1.00 75.42 H new ATOM 0 HB3 ASP A 52 4.329 2.796 10.597 1.00 75.42 H new ATOM 1022 N ASP B 212 -7.557 -15.088 -5.803 1.00 74.44 N ATOM 1023 CA ASP B 212 -8.550 -14.394 -4.983 1.00 33.24 C ATOM 1024 C ASP B 212 -8.208 -12.905 -4.804 1.00 1.12 C ATOM 1025 O ASP B 212 -9.091 -12.047 -4.781 1.00 73.42 O ATOM 1026 CB ASP B 212 -8.614 -15.069 -3.605 1.00 32.31 C ATOM 1027 CG ASP B 212 -8.835 -16.571 -3.693 1.00 45.53 C ATOM 1028 OD1 ASP B 212 -8.064 -17.255 -4.400 1.00 34.15 O ATOM 1029 OD2 ASP B 212 -9.766 -17.080 -3.037 1.00 22.42 O ATOM 0 HA ASP B 212 -9.513 -14.455 -5.491 1.00 33.24 H new ATOM 0 HB2 ASP B 212 -7.686 -14.874 -3.067 1.00 32.31 H new ATOM 0 HB3 ASP B 212 -9.420 -14.621 -3.024 1.00 32.31 H new ATOM 1034 N THR B 213 -6.917 -12.615 -4.684 1.00 30.20 N ATOM 1035 CA THR B 213 -6.441 -11.257 -4.388 1.00 2.43 C ATOM 1036 C THR B 213 -6.464 -10.340 -5.624 1.00 3.11 C ATOM 1037 O THR B 213 -6.014 -10.722 -6.707 1.00 64.21 O ATOM 1038 CB THR B 213 -5.007 -11.285 -3.813 1.00 63.01 C ATOM 1039 OG1 THR B 213 -4.101 -11.859 -4.769 1.00 63.32 O ATOM 1040 CG2 THR B 213 -4.951 -12.087 -2.515 1.00 52.44 C ATOM 0 H THR B 213 -6.172 -13.304 -4.787 1.00 30.20 H new ATOM 0 HA THR B 213 -7.131 -10.851 -3.648 1.00 2.43 H new ATOM 0 HB THR B 213 -4.712 -10.258 -3.601 1.00 63.01 H new ATOM 0 HG1 THR B 213 -3.195 -11.870 -4.395 1.00 63.32 H new ATOM 0 HG21 THR B 213 -3.930 -12.090 -2.133 1.00 52.44 H new ATOM 0 HG22 THR B 213 -5.613 -11.633 -1.778 1.00 52.44 H new ATOM 0 HG23 THR B 213 -5.270 -13.112 -2.706 1.00 52.44 H new ATOM 1048 N LYS B 214 -6.978 -9.121 -5.445 1.00 21.12 N ATOM 1049 CA LYS B 214 -7.079 -8.141 -6.536 1.00 44.42 C ATOM 1050 C LYS B 214 -5.828 -7.239 -6.604 1.00 32.21 C ATOM 1051 O LYS B 214 -5.444 -6.621 -5.608 1.00 73.04 O ATOM 1052 CB LYS B 214 -8.334 -7.271 -6.344 1.00 0.12 C ATOM 1053 CG LYS B 214 -9.639 -8.063 -6.247 1.00 43.24 C ATOM 1054 CD LYS B 214 -9.947 -8.832 -7.534 1.00 35.14 C ATOM 1055 CE LYS B 214 -10.139 -7.901 -8.729 1.00 74.33 C ATOM 1056 NZ LYS B 214 -11.225 -6.912 -8.498 1.00 71.12 N ATOM 0 H LYS B 214 -7.334 -8.785 -4.550 1.00 21.12 H new ATOM 0 HA LYS B 214 -7.152 -8.691 -7.474 1.00 44.42 H new ATOM 0 HB2 LYS B 214 -8.215 -6.677 -5.438 1.00 0.12 H new ATOM 0 HB3 LYS B 214 -8.408 -6.571 -7.177 1.00 0.12 H new ATOM 0 HG2 LYS B 214 -9.576 -8.763 -5.414 1.00 43.24 H new ATOM 0 HG3 LYS B 214 -10.460 -7.381 -6.028 1.00 43.24 H new ATOM 0 HD2 LYS B 214 -9.134 -9.527 -7.744 1.00 35.14 H new ATOM 0 HD3 LYS B 214 -10.848 -9.429 -7.392 1.00 35.14 H new ATOM 0 HE2 LYS B 214 -9.206 -7.374 -8.931 1.00 74.33 H new ATOM 0 HE3 LYS B 214 -10.370 -8.492 -9.615 1.00 74.33 H new ATOM 0 HZ1 LYS B 214 -11.448 -6.427 -9.390 1.00 71.12 H new ATOM 0 HZ2 LYS B 214 -12.073 -7.403 -8.149 1.00 71.12 H new ATOM 0 HZ3 LYS B 214 -10.914 -6.214 -7.793 1.00 71.12 H new ATOM 1070 N PRO B 215 -5.177 -7.147 -7.782 1.00 52.14 N ATOM 1071 CA PRO B 215 -3.979 -6.306 -7.965 1.00 73.33 C ATOM 1072 C PRO B 215 -4.299 -4.805 -8.124 1.00 13.24 C ATOM 1073 O PRO B 215 -4.635 -4.338 -9.215 1.00 33.31 O ATOM 1074 CB PRO B 215 -3.362 -6.876 -9.247 1.00 31.25 C ATOM 1075 CG PRO B 215 -4.532 -7.367 -10.036 1.00 12.50 C ATOM 1076 CD PRO B 215 -5.542 -7.861 -9.025 1.00 4.34 C ATOM 0 HA PRO B 215 -3.322 -6.339 -7.096 1.00 73.33 H new ATOM 0 HB2 PRO B 215 -2.806 -6.114 -9.793 1.00 31.25 H new ATOM 0 HB3 PRO B 215 -2.664 -7.684 -9.027 1.00 31.25 H new ATOM 0 HG2 PRO B 215 -4.952 -6.569 -10.648 1.00 12.50 H new ATOM 0 HG3 PRO B 215 -4.236 -8.167 -10.714 1.00 12.50 H new ATOM 0 HD2 PRO B 215 -6.562 -7.631 -9.333 1.00 4.34 H new ATOM 0 HD3 PRO B 215 -5.484 -8.942 -8.897 1.00 4.34 H new ATOM 1084 N VAL B 216 -4.204 -4.056 -7.026 1.00 61.41 N ATOM 1085 CA VAL B 216 -4.452 -2.609 -7.043 1.00 61.23 C ATOM 1086 C VAL B 216 -3.133 -1.814 -7.091 1.00 15.42 C ATOM 1087 O VAL B 216 -2.143 -2.193 -6.466 1.00 3.22 O ATOM 1088 CB VAL B 216 -5.274 -2.169 -5.802 1.00 71.50 C ATOM 1089 CG1 VAL B 216 -5.599 -0.674 -5.858 1.00 51.20 C ATOM 1090 CG2 VAL B 216 -6.550 -3.004 -5.676 1.00 53.21 C ATOM 0 H VAL B 216 -3.956 -4.426 -6.108 1.00 61.41 H new ATOM 0 HA VAL B 216 -5.025 -2.394 -7.945 1.00 61.23 H new ATOM 0 HB VAL B 216 -4.666 -2.343 -4.914 1.00 71.50 H new ATOM 0 HG11 VAL B 216 -6.175 -0.394 -4.976 1.00 51.20 H new ATOM 0 HG12 VAL B 216 -4.672 -0.101 -5.883 1.00 51.20 H new ATOM 0 HG13 VAL B 216 -6.181 -0.462 -6.755 1.00 51.20 H new ATOM 0 HG21 VAL B 216 -7.112 -2.680 -4.800 1.00 53.21 H new ATOM 0 HG22 VAL B 216 -7.161 -2.871 -6.569 1.00 53.21 H new ATOM 0 HG23 VAL B 216 -6.287 -4.056 -5.569 1.00 53.21 H new ATOM 1100 N VAL B 217 -3.123 -0.717 -7.845 1.00 21.42 N ATOM 1101 CA VAL B 217 -1.928 0.128 -7.970 1.00 13.03 C ATOM 1102 C VAL B 217 -2.002 1.354 -7.044 1.00 30.43 C ATOM 1103 O VAL B 217 -2.991 2.092 -7.051 1.00 3.44 O ATOM 1104 CB VAL B 217 -1.731 0.607 -9.430 1.00 71.33 C ATOM 1105 CG1 VAL B 217 -0.462 1.447 -9.567 1.00 54.33 C ATOM 1106 CG2 VAL B 217 -1.702 -0.587 -10.383 1.00 24.02 C ATOM 0 H VAL B 217 -3.927 -0.389 -8.380 1.00 21.42 H new ATOM 0 HA VAL B 217 -1.078 -0.487 -7.674 1.00 13.03 H new ATOM 0 HB VAL B 217 -2.577 1.240 -9.698 1.00 71.33 H new ATOM 0 HG11 VAL B 217 -0.349 1.770 -10.602 1.00 54.33 H new ATOM 0 HG12 VAL B 217 -0.533 2.321 -8.920 1.00 54.33 H new ATOM 0 HG13 VAL B 217 0.403 0.850 -9.277 1.00 54.33 H new ATOM 0 HG21 VAL B 217 -1.563 -0.234 -11.405 1.00 24.02 H new ATOM 0 HG22 VAL B 217 -0.879 -1.248 -10.113 1.00 24.02 H new ATOM 0 HG23 VAL B 217 -2.643 -1.132 -10.312 1.00 24.02 H new ATOM 1116 N VAL B 218 -0.949 1.564 -6.257 1.00 30.22 N ATOM 1117 CA VAL B 218 -0.868 2.701 -5.334 1.00 71.41 C ATOM 1118 C VAL B 218 0.538 3.333 -5.373 1.00 4.34 C ATOM 1119 O VAL B 218 1.500 2.695 -5.785 1.00 74.32 O ATOM 1120 CB VAL B 218 -1.211 2.263 -3.883 1.00 14.50 C ATOM 1121 CG1 VAL B 218 -0.221 1.212 -3.382 1.00 71.21 C ATOM 1122 CG2 VAL B 218 -1.261 3.466 -2.942 1.00 14.24 C ATOM 0 H VAL B 218 -0.130 0.956 -6.239 1.00 30.22 H new ATOM 0 HA VAL B 218 -1.598 3.444 -5.655 1.00 71.41 H new ATOM 0 HB VAL B 218 -2.203 1.811 -3.895 1.00 14.50 H new ATOM 0 HG11 VAL B 218 -0.482 0.922 -2.364 1.00 71.21 H new ATOM 0 HG12 VAL B 218 -0.260 0.337 -4.030 1.00 71.21 H new ATOM 0 HG13 VAL B 218 0.787 1.627 -3.393 1.00 71.21 H new ATOM 0 HG21 VAL B 218 -1.503 3.130 -1.934 1.00 14.24 H new ATOM 0 HG22 VAL B 218 -0.291 3.963 -2.935 1.00 14.24 H new ATOM 0 HG23 VAL B 218 -2.025 4.164 -3.285 1.00 14.24 H new ATOM 1132 N ARG B 219 0.651 4.592 -4.960 1.00 24.42 N ATOM 1133 CA ARG B 219 1.940 5.297 -4.969 1.00 50.51 C ATOM 1134 C ARG B 219 2.615 5.305 -3.584 1.00 73.31 C ATOM 1135 O ARG B 219 1.961 5.512 -2.562 1.00 34.02 O ATOM 1136 CB ARG B 219 1.745 6.738 -5.452 1.00 45.10 C ATOM 1137 CG ARG B 219 1.509 6.873 -6.952 1.00 72.53 C ATOM 1138 CD ARG B 219 1.291 8.330 -7.344 1.00 32.20 C ATOM 1139 NE ARG B 219 1.312 8.524 -8.792 1.00 24.01 N ATOM 1140 CZ ARG B 219 0.498 9.309 -9.439 1.00 3.42 C ATOM 1141 NH1 ARG B 219 -0.468 9.907 -8.825 1.00 53.10 N ATOM 1142 NH2 ARG B 219 0.645 9.480 -10.710 1.00 55.12 N ATOM 0 H ARG B 219 -0.130 5.149 -4.614 1.00 24.42 H new ATOM 0 HA ARG B 219 2.596 4.758 -5.652 1.00 50.51 H new ATOM 0 HB2 ARG B 219 0.898 7.174 -4.923 1.00 45.10 H new ATOM 0 HB3 ARG B 219 2.625 7.321 -5.181 1.00 45.10 H new ATOM 0 HG2 ARG B 219 2.364 6.471 -7.495 1.00 72.53 H new ATOM 0 HG3 ARG B 219 0.640 6.281 -7.241 1.00 72.53 H new ATOM 0 HD2 ARG B 219 0.335 8.671 -6.948 1.00 32.20 H new ATOM 0 HD3 ARG B 219 2.064 8.947 -6.886 1.00 32.20 H new ATOM 0 HE ARG B 219 2.009 8.011 -9.332 1.00 24.01 H new ATOM 0 HH11 ARG B 219 -0.600 9.767 -7.823 1.00 53.10 H new ATOM 0 HH12 ARG B 219 -1.099 10.519 -9.342 1.00 53.10 H new ATOM 0 HH21 ARG B 219 1.397 9.001 -11.205 1.00 55.12 H new ATOM 0 HH22 ARG B 219 0.009 10.094 -11.219 1.00 55.12 H new ATOM 1156 N LEU B 220 3.932 5.091 -3.564 1.00 24.05 N ATOM 1157 CA LEU B 220 4.724 5.157 -2.326 1.00 13.12 C ATOM 1158 C LEU B 220 6.054 5.899 -2.569 1.00 32.35 C ATOM 1159 O LEU B 220 6.587 5.878 -3.677 1.00 4.33 O ATOM 1160 CB LEU B 220 4.987 3.737 -1.795 1.00 21.52 C ATOM 1161 CG LEU B 220 5.719 3.656 -0.441 1.00 43.41 C ATOM 1162 CD1 LEU B 220 4.956 4.425 0.639 1.00 33.52 C ATOM 1163 CD2 LEU B 220 5.915 2.198 -0.023 1.00 20.51 C ATOM 0 H LEU B 220 4.479 4.869 -4.396 1.00 24.05 H new ATOM 0 HA LEU B 220 4.158 5.713 -1.579 1.00 13.12 H new ATOM 0 HB2 LEU B 220 4.032 3.221 -1.702 1.00 21.52 H new ATOM 0 HB3 LEU B 220 5.572 3.194 -2.537 1.00 21.52 H new ATOM 0 HG LEU B 220 6.699 4.118 -0.558 1.00 43.41 H new ATOM 0 HD11 LEU B 220 5.493 4.353 1.585 1.00 33.52 H new ATOM 0 HD12 LEU B 220 4.871 5.472 0.349 1.00 33.52 H new ATOM 0 HD13 LEU B 220 3.959 3.999 0.754 1.00 33.52 H new ATOM 0 HD21 LEU B 220 6.433 2.161 0.935 1.00 20.51 H new ATOM 0 HD22 LEU B 220 4.944 1.713 0.071 1.00 20.51 H new ATOM 0 HD23 LEU B 220 6.508 1.680 -0.777 1.00 20.51 H new ATOM 1175 N TYR B 221 6.580 6.560 -1.535 1.00 61.51 N ATOM 1176 CA TYR B 221 7.803 7.371 -1.666 1.00 22.03 C ATOM 1177 C TYR B 221 9.044 6.514 -1.982 1.00 41.13 C ATOM 1178 O TYR B 221 9.340 5.555 -1.273 1.00 65.33 O ATOM 1179 CB TYR B 221 8.036 8.181 -0.386 1.00 72.31 C ATOM 1180 CG TYR B 221 6.961 9.221 -0.129 1.00 40.20 C ATOM 1181 CD1 TYR B 221 5.790 8.891 0.548 1.00 20.54 C ATOM 1182 CD2 TYR B 221 7.113 10.532 -0.573 1.00 13.13 C ATOM 1183 CE1 TYR B 221 4.806 9.835 0.775 1.00 64.24 C ATOM 1184 CE2 TYR B 221 6.134 11.480 -0.347 1.00 15.23 C ATOM 1185 CZ TYR B 221 4.982 11.127 0.327 1.00 42.21 C ATOM 1186 OH TYR B 221 4.002 12.070 0.551 1.00 15.24 O ATOM 0 H TYR B 221 6.182 6.552 -0.596 1.00 61.51 H new ATOM 0 HA TYR B 221 7.654 8.048 -2.508 1.00 22.03 H new ATOM 0 HB2 TYR B 221 8.083 7.499 0.463 1.00 72.31 H new ATOM 0 HB3 TYR B 221 9.004 8.678 -0.450 1.00 72.31 H new ATOM 0 HD1 TYR B 221 5.648 7.881 0.902 1.00 20.54 H new ATOM 0 HD2 TYR B 221 8.011 10.812 -1.103 1.00 13.13 H new ATOM 0 HE1 TYR B 221 3.903 9.562 1.301 1.00 64.24 H new ATOM 0 HE2 TYR B 221 6.269 12.493 -0.696 1.00 15.23 H new ATOM 0 HH TYR B 221 4.283 12.930 0.173 1.00 15.24 H new ATOM 1196 N PRO B 222 9.795 6.869 -3.049 1.00 34.44 N ATOM 1197 CA PRO B 222 10.970 6.095 -3.511 1.00 24.23 C ATOM 1198 C PRO B 222 11.955 5.702 -2.392 1.00 53.53 C ATOM 1199 O PRO B 222 12.333 4.533 -2.271 1.00 43.34 O ATOM 1200 CB PRO B 222 11.641 7.048 -4.501 1.00 12.20 C ATOM 1201 CG PRO B 222 10.523 7.872 -5.043 1.00 72.01 C ATOM 1202 CD PRO B 222 9.552 8.053 -3.903 1.00 32.14 C ATOM 0 HA PRO B 222 10.664 5.137 -3.931 1.00 24.23 H new ATOM 0 HB2 PRO B 222 12.389 7.669 -4.009 1.00 12.20 H new ATOM 0 HB3 PRO B 222 12.152 6.502 -5.294 1.00 12.20 H new ATOM 0 HG2 PRO B 222 10.886 8.835 -5.403 1.00 72.01 H new ATOM 0 HG3 PRO B 222 10.046 7.375 -5.888 1.00 72.01 H new ATOM 0 HD2 PRO B 222 9.736 8.982 -3.363 1.00 32.14 H new ATOM 0 HD3 PRO B 222 8.521 8.088 -4.256 1.00 32.14 H new ATOM 1210 N ASP B 223 12.369 6.671 -1.574 1.00 11.20 N ATOM 1211 CA ASP B 223 13.336 6.411 -0.501 1.00 54.22 C ATOM 1212 C ASP B 223 12.747 5.464 0.561 1.00 64.21 C ATOM 1213 O ASP B 223 13.445 4.601 1.097 1.00 41.33 O ATOM 1214 CB ASP B 223 13.782 7.730 0.142 1.00 70.45 C ATOM 1215 CG ASP B 223 12.630 8.458 0.805 1.00 22.54 C ATOM 1216 OD1 ASP B 223 11.705 8.885 0.083 1.00 21.40 O ATOM 1217 OD2 ASP B 223 12.632 8.580 2.048 1.00 65.52 O ATOM 0 H ASP B 223 12.053 7.639 -1.632 1.00 11.20 H new ATOM 0 HA ASP B 223 14.206 5.922 -0.939 1.00 54.22 H new ATOM 0 HB2 ASP B 223 14.557 7.529 0.882 1.00 70.45 H new ATOM 0 HB3 ASP B 223 14.226 8.372 -0.619 1.00 70.45 H new ATOM 1222 N GLU B 224 11.456 5.625 0.856 1.00 52.44 N ATOM 1223 CA GLU B 224 10.764 4.730 1.791 1.00 34.14 C ATOM 1224 C GLU B 224 10.514 3.348 1.160 1.00 64.44 C ATOM 1225 O GLU B 224 10.400 2.347 1.865 1.00 60.34 O ATOM 1226 CB GLU B 224 9.457 5.374 2.277 1.00 14.20 C ATOM 1227 CG GLU B 224 9.692 6.619 3.130 1.00 71.15 C ATOM 1228 CD GLU B 224 8.411 7.267 3.638 1.00 42.14 C ATOM 1229 OE1 GLU B 224 7.890 6.830 4.683 1.00 42.32 O ATOM 1230 OE2 GLU B 224 7.946 8.244 3.016 1.00 43.23 O ATOM 0 H GLU B 224 10.869 6.362 0.465 1.00 52.44 H new ATOM 0 HA GLU B 224 11.407 4.574 2.657 1.00 34.14 H new ATOM 0 HB2 GLU B 224 8.846 5.640 1.415 1.00 14.20 H new ATOM 0 HB3 GLU B 224 8.891 4.644 2.856 1.00 14.20 H new ATOM 0 HG2 GLU B 224 10.316 6.351 3.983 1.00 71.15 H new ATOM 0 HG3 GLU B 224 10.250 7.349 2.544 1.00 71.15 H new ATOM 1237 N ILE B 225 10.450 3.295 -0.172 1.00 23.04 N ATOM 1238 CA ILE B 225 10.436 2.015 -0.894 1.00 23.24 C ATOM 1239 C ILE B 225 11.809 1.331 -0.772 1.00 22.00 C ATOM 1240 O ILE B 225 11.911 0.104 -0.693 1.00 54.24 O ATOM 1241 CB ILE B 225 10.083 2.202 -2.396 1.00 72.31 C ATOM 1242 CG1 ILE B 225 8.658 2.760 -2.551 1.00 43.20 C ATOM 1243 CG2 ILE B 225 10.233 0.885 -3.161 1.00 64.10 C ATOM 1244 CD1 ILE B 225 8.239 2.988 -3.990 1.00 3.12 C ATOM 0 H ILE B 225 10.407 4.118 -0.773 1.00 23.04 H new ATOM 0 HA ILE B 225 9.665 1.391 -0.442 1.00 23.24 H new ATOM 0 HB ILE B 225 10.783 2.921 -2.822 1.00 72.31 H new ATOM 0 HG12 ILE B 225 7.956 2.070 -2.084 1.00 43.20 H new ATOM 0 HG13 ILE B 225 8.587 3.703 -2.009 1.00 43.20 H new ATOM 0 HG21 ILE B 225 9.980 1.042 -4.210 1.00 64.10 H new ATOM 0 HG22 ILE B 225 11.262 0.535 -3.084 1.00 64.10 H new ATOM 0 HG23 ILE B 225 9.563 0.138 -2.735 1.00 64.10 H new ATOM 0 HD11 ILE B 225 7.223 3.382 -4.015 1.00 3.12 H new ATOM 0 HD12 ILE B 225 8.917 3.702 -4.457 1.00 3.12 H new ATOM 0 HD13 ILE B 225 8.276 2.044 -4.534 1.00 3.12 H new ATOM 1256 N GLU B 226 12.861 2.145 -0.747 1.00 3.11 N ATOM 1257 CA GLU B 226 14.225 1.656 -0.534 1.00 1.22 C ATOM 1258 C GLU B 226 14.389 1.121 0.899 1.00 42.21 C ATOM 1259 O GLU B 226 14.992 0.070 1.119 1.00 64.30 O ATOM 1260 CB GLU B 226 15.232 2.782 -0.811 1.00 31.13 C ATOM 1261 CG GLU B 226 16.693 2.351 -0.763 1.00 14.31 C ATOM 1262 CD GLU B 226 17.639 3.485 -1.126 1.00 12.32 C ATOM 1263 OE1 GLU B 226 17.860 3.718 -2.335 1.00 30.13 O ATOM 1264 OE2 GLU B 226 18.162 4.155 -0.208 1.00 43.44 O ATOM 0 H GLU B 226 12.796 3.155 -0.873 1.00 3.11 H new ATOM 0 HA GLU B 226 14.418 0.835 -1.225 1.00 1.22 H new ATOM 0 HB2 GLU B 226 15.023 3.205 -1.794 1.00 31.13 H new ATOM 0 HB3 GLU B 226 15.077 3.578 -0.082 1.00 31.13 H new ATOM 0 HG2 GLU B 226 16.930 1.988 0.237 1.00 14.31 H new ATOM 0 HG3 GLU B 226 16.847 1.518 -1.449 1.00 14.31 H new ATOM 1271 N ALA B 227 13.839 1.852 1.872 1.00 31.32 N ATOM 1272 CA ALA B 227 13.795 1.385 3.264 1.00 22.14 C ATOM 1273 C ALA B 227 12.909 0.136 3.394 1.00 34.44 C ATOM 1274 O ALA B 227 13.204 -0.782 4.162 1.00 60.41 O ATOM 1275 CB ALA B 227 13.286 2.496 4.175 1.00 65.44 C ATOM 0 H ALA B 227 13.418 2.769 1.724 1.00 31.32 H new ATOM 0 HA ALA B 227 14.806 1.116 3.569 1.00 22.14 H new ATOM 0 HB1 ALA B 227 13.258 2.138 5.204 1.00 65.44 H new ATOM 0 HB2 ALA B 227 13.953 3.356 4.108 1.00 65.44 H new ATOM 0 HB3 ALA B 227 12.283 2.790 3.865 1.00 65.44 H new ATOM 1281 N LEU B 228 11.825 0.114 2.624 1.00 40.51 N ATOM 1282 CA LEU B 228 10.919 -1.037 2.565 1.00 45.13 C ATOM 1283 C LEU B 228 11.674 -2.317 2.173 1.00 3.01 C ATOM 1284 O LEU B 228 11.705 -3.289 2.927 1.00 14.14 O ATOM 1285 CB LEU B 228 9.804 -0.761 1.548 1.00 14.40 C ATOM 1286 CG LEU B 228 8.744 -1.864 1.411 1.00 1.23 C ATOM 1287 CD1 LEU B 228 7.903 -1.966 2.680 1.00 4.44 C ATOM 1288 CD2 LEU B 228 7.864 -1.612 0.190 1.00 61.00 C ATOM 0 H LEU B 228 11.547 0.890 2.023 1.00 40.51 H new ATOM 0 HA LEU B 228 10.488 -1.186 3.555 1.00 45.13 H new ATOM 0 HB2 LEU B 228 9.304 0.166 1.827 1.00 14.40 H new ATOM 0 HB3 LEU B 228 10.260 -0.596 0.572 1.00 14.40 H new ATOM 0 HG LEU B 228 9.255 -2.817 1.270 1.00 1.23 H new ATOM 0 HD11 LEU B 228 7.159 -2.753 2.561 1.00 4.44 H new ATOM 0 HD12 LEU B 228 8.548 -2.202 3.526 1.00 4.44 H new ATOM 0 HD13 LEU B 228 7.400 -1.016 2.861 1.00 4.44 H new ATOM 0 HD21 LEU B 228 7.119 -2.403 0.109 1.00 61.00 H new ATOM 0 HD22 LEU B 228 7.362 -0.650 0.296 1.00 61.00 H new ATOM 0 HD23 LEU B 228 8.482 -1.602 -0.708 1.00 61.00 H new ATOM 1300 N LYS B 229 12.305 -2.299 0.996 1.00 51.11 N ATOM 1301 CA LYS B 229 13.037 -3.469 0.484 1.00 23.21 C ATOM 1302 C LYS B 229 14.237 -3.837 1.379 1.00 74.15 C ATOM 1303 O LYS B 229 14.840 -4.900 1.220 1.00 4.03 O ATOM 1304 CB LYS B 229 13.511 -3.224 -0.957 1.00 65.34 C ATOM 1305 CG LYS B 229 14.529 -2.092 -1.095 1.00 13.11 C ATOM 1306 CD LYS B 229 14.996 -1.916 -2.538 1.00 74.44 C ATOM 1307 CE LYS B 229 13.851 -1.519 -3.466 1.00 21.04 C ATOM 1308 NZ LYS B 229 14.280 -1.476 -4.887 1.00 23.42 N ATOM 0 H LYS B 229 12.326 -1.489 0.377 1.00 51.11 H new ATOM 0 HA LYS B 229 12.344 -4.310 0.495 1.00 23.21 H new ATOM 0 HB2 LYS B 229 13.951 -4.143 -1.345 1.00 65.34 H new ATOM 0 HB3 LYS B 229 12.645 -2.998 -1.579 1.00 65.34 H new ATOM 0 HG2 LYS B 229 14.086 -1.161 -0.741 1.00 13.11 H new ATOM 0 HG3 LYS B 229 15.389 -2.298 -0.458 1.00 13.11 H new ATOM 0 HD2 LYS B 229 15.775 -1.154 -2.577 1.00 74.44 H new ATOM 0 HD3 LYS B 229 15.442 -2.846 -2.890 1.00 74.44 H new ATOM 0 HE2 LYS B 229 13.031 -2.229 -3.356 1.00 21.04 H new ATOM 0 HE3 LYS B 229 13.468 -0.542 -3.173 1.00 21.04 H new ATOM 0 HZ1 LYS B 229 13.474 -1.203 -5.485 1.00 23.42 H new ATOM 0 HZ2 LYS B 229 15.045 -0.780 -4.998 1.00 23.42 H new ATOM 0 HZ3 LYS B 229 14.622 -2.415 -5.175 1.00 23.42 H new ATOM 1322 N SER B 230 14.586 -2.950 2.306 1.00 41.13 N ATOM 1323 CA SER B 230 15.644 -3.225 3.284 1.00 34.24 C ATOM 1324 C SER B 230 15.154 -4.189 4.375 1.00 44.30 C ATOM 1325 O SER B 230 15.894 -5.076 4.814 1.00 10.23 O ATOM 1326 CB SER B 230 16.136 -1.918 3.930 1.00 62.43 C ATOM 1327 OG SER B 230 17.146 -2.164 4.897 1.00 51.10 O ATOM 0 H SER B 230 14.153 -2.032 2.404 1.00 41.13 H new ATOM 0 HA SER B 230 16.471 -3.695 2.752 1.00 34.24 H new ATOM 0 HB2 SER B 230 16.524 -1.253 3.158 1.00 62.43 H new ATOM 0 HB3 SER B 230 15.297 -1.405 4.401 1.00 62.43 H new ATOM 0 HG SER B 230 17.439 -1.314 5.288 1.00 51.10 H new ATOM 1333 N ARG B 231 13.895 -4.029 4.792 1.00 70.14 N ATOM 1334 CA ARG B 231 13.326 -4.840 5.881 1.00 71.40 C ATOM 1335 C ARG B 231 12.488 -6.028 5.361 1.00 53.11 C ATOM 1336 O ARG B 231 11.704 -6.616 6.110 1.00 25.11 O ATOM 1337 CB ARG B 231 12.466 -3.960 6.808 1.00 33.40 C ATOM 1338 CG ARG B 231 11.227 -3.360 6.145 1.00 51.25 C ATOM 1339 CD ARG B 231 10.407 -2.528 7.132 1.00 54.32 C ATOM 1340 NE ARG B 231 9.912 -3.330 8.256 1.00 21.42 N ATOM 1341 CZ ARG B 231 9.956 -2.947 9.508 1.00 11.13 C ATOM 1342 NH1 ARG B 231 10.462 -1.803 9.828 1.00 54.10 N ATOM 1343 NH2 ARG B 231 9.481 -3.708 10.437 1.00 10.51 N ATOM 0 H ARG B 231 13.248 -3.347 4.395 1.00 70.14 H new ATOM 0 HA ARG B 231 14.166 -5.254 6.439 1.00 71.40 H new ATOM 0 HB2 ARG B 231 12.151 -4.556 7.664 1.00 33.40 H new ATOM 0 HB3 ARG B 231 13.084 -3.149 7.194 1.00 33.40 H new ATOM 0 HG2 ARG B 231 11.530 -2.735 5.305 1.00 51.25 H new ATOM 0 HG3 ARG B 231 10.607 -4.160 5.740 1.00 51.25 H new ATOM 0 HD2 ARG B 231 11.020 -1.711 7.513 1.00 54.32 H new ATOM 0 HD3 ARG B 231 9.563 -2.077 6.611 1.00 54.32 H new ATOM 0 HE ARG B 231 9.508 -4.244 8.050 1.00 21.42 H new ATOM 0 HH11 ARG B 231 10.832 -1.188 9.103 1.00 54.10 H new ATOM 0 HH12 ARG B 231 10.492 -1.514 10.806 1.00 54.10 H new ATOM 0 HH21 ARG B 231 9.070 -4.610 10.197 1.00 10.51 H new ATOM 0 HH22 ARG B 231 9.517 -3.407 11.411 1.00 10.51 H new ATOM 1357 N VAL B 232 12.654 -6.385 4.085 1.00 73.30 N ATOM 1358 CA VAL B 232 11.938 -7.534 3.510 1.00 30.43 C ATOM 1359 C VAL B 232 12.773 -8.827 3.597 1.00 12.52 C ATOM 1360 O VAL B 232 14.007 -8.791 3.536 1.00 54.01 O ATOM 1361 CB VAL B 232 11.541 -7.294 2.027 1.00 1.01 C ATOM 1362 CG1 VAL B 232 10.672 -6.048 1.890 1.00 50.55 C ATOM 1363 CG2 VAL B 232 12.775 -7.204 1.130 1.00 62.15 C ATOM 0 H VAL B 232 13.272 -5.902 3.433 1.00 73.30 H new ATOM 0 HA VAL B 232 11.032 -7.648 4.105 1.00 30.43 H new ATOM 0 HB VAL B 232 10.955 -8.152 1.697 1.00 1.01 H new ATOM 0 HG11 VAL B 232 10.408 -5.902 0.843 1.00 50.55 H new ATOM 0 HG12 VAL B 232 9.764 -6.171 2.480 1.00 50.55 H new ATOM 0 HG13 VAL B 232 11.223 -5.179 2.250 1.00 50.55 H new ATOM 0 HG21 VAL B 232 12.464 -7.036 0.099 1.00 62.15 H new ATOM 0 HG22 VAL B 232 13.404 -6.377 1.459 1.00 62.15 H new ATOM 0 HG23 VAL B 232 13.338 -8.135 1.192 1.00 62.15 H new ATOM 1373 N PRO B 233 12.110 -9.988 3.760 1.00 51.21 N ATOM 1374 CA PRO B 233 12.780 -11.295 3.734 1.00 74.32 C ATOM 1375 C PRO B 233 13.022 -11.806 2.300 1.00 22.33 C ATOM 1376 O PRO B 233 12.619 -11.173 1.326 1.00 22.51 O ATOM 1377 CB PRO B 233 11.788 -12.194 4.478 1.00 3.31 C ATOM 1378 CG PRO B 233 10.452 -11.611 4.168 1.00 64.42 C ATOM 1379 CD PRO B 233 10.659 -10.121 4.003 1.00 22.31 C ATOM 0 HA PRO B 233 13.773 -11.265 4.182 1.00 74.32 H new ATOM 0 HB2 PRO B 233 11.858 -13.228 4.140 1.00 3.31 H new ATOM 0 HB3 PRO B 233 11.981 -12.196 5.551 1.00 3.31 H new ATOM 0 HG2 PRO B 233 10.040 -12.048 3.258 1.00 64.42 H new ATOM 0 HG3 PRO B 233 9.743 -11.817 4.970 1.00 64.42 H new ATOM 0 HD2 PRO B 233 10.077 -9.727 3.170 1.00 22.31 H new ATOM 0 HD3 PRO B 233 10.351 -9.574 4.894 1.00 22.31 H new ATOM 1387 N ALA B 234 13.680 -12.956 2.178 1.00 41.12 N ATOM 1388 CA ALA B 234 13.997 -13.534 0.863 1.00 65.01 C ATOM 1389 C ALA B 234 12.748 -14.081 0.143 1.00 44.21 C ATOM 1390 O ALA B 234 12.694 -14.109 -1.088 1.00 43.14 O ATOM 1391 CB ALA B 234 15.046 -14.629 1.012 1.00 31.35 C ATOM 0 H ALA B 234 14.006 -13.510 2.970 1.00 41.12 H new ATOM 0 HA ALA B 234 14.395 -12.730 0.243 1.00 65.01 H new ATOM 0 HB1 ALA B 234 15.274 -15.050 0.033 1.00 31.35 H new ATOM 0 HB2 ALA B 234 15.953 -14.207 1.445 1.00 31.35 H new ATOM 0 HB3 ALA B 234 14.663 -15.414 1.664 1.00 31.35 H new ATOM 1397 N ASN B 235 11.752 -14.521 0.912 1.00 43.13 N ATOM 1398 CA ASN B 235 10.510 -15.061 0.339 1.00 64.41 C ATOM 1399 C ASN B 235 9.513 -13.945 -0.011 1.00 51.02 C ATOM 1400 O ASN B 235 9.197 -13.717 -1.183 1.00 23.24 O ATOM 1401 CB ASN B 235 9.851 -16.048 1.311 1.00 23.13 C ATOM 1402 CG ASN B 235 10.772 -17.189 1.693 1.00 72.32 C ATOM 1403 OD1 ASN B 235 10.815 -18.219 1.031 1.00 33.43 O ATOM 1404 ND2 ASN B 235 11.506 -17.024 2.773 1.00 34.44 N ATOM 0 H ASN B 235 11.777 -14.516 1.932 1.00 43.13 H new ATOM 0 HA ASN B 235 10.780 -15.581 -0.580 1.00 64.41 H new ATOM 0 HB2 ASN B 235 9.544 -15.516 2.212 1.00 23.13 H new ATOM 0 HB3 ASN B 235 8.947 -16.452 0.856 1.00 23.13 H new ATOM 0 HD21 ASN B 235 12.134 -17.766 3.081 1.00 34.44 H new ATOM 0 HD22 ASN B 235 11.447 -16.154 3.302 1.00 34.44 H new ATOM 1411 N THR B 236 9.019 -13.252 1.014 1.00 20.34 N ATOM 1412 CA THR B 236 8.016 -12.194 0.831 1.00 41.13 C ATOM 1413 C THR B 236 8.608 -10.955 0.137 1.00 52.35 C ATOM 1414 O THR B 236 9.246 -10.119 0.775 1.00 14.15 O ATOM 1415 CB THR B 236 7.401 -11.769 2.190 1.00 72.34 C ATOM 1416 OG1 THR B 236 6.859 -12.913 2.870 1.00 43.12 O ATOM 1417 CG2 THR B 236 6.306 -10.727 2.004 1.00 1.44 C ATOM 0 H THR B 236 9.296 -13.402 1.984 1.00 20.34 H new ATOM 0 HA THR B 236 7.237 -12.611 0.193 1.00 41.13 H new ATOM 0 HB THR B 236 8.199 -11.329 2.789 1.00 72.34 H new ATOM 0 HG1 THR B 236 6.475 -12.633 3.727 1.00 43.12 H new ATOM 0 HG21 THR B 236 5.897 -10.452 2.976 1.00 1.44 H new ATOM 0 HG22 THR B 236 6.723 -9.843 1.522 1.00 1.44 H new ATOM 0 HG23 THR B 236 5.513 -11.140 1.380 1.00 1.44 H new ATOM 1425 N SER B 237 8.395 -10.854 -1.175 1.00 14.00 N ATOM 1426 CA SER B 237 8.871 -9.700 -1.959 1.00 13.02 C ATOM 1427 C SER B 237 7.997 -8.454 -1.734 1.00 23.22 C ATOM 1428 O SER B 237 7.033 -8.488 -0.970 1.00 61.32 O ATOM 1429 CB SER B 237 8.900 -10.045 -3.455 1.00 3.20 C ATOM 1430 OG SER B 237 9.350 -8.942 -4.232 1.00 1.32 O ATOM 0 H SER B 237 7.896 -11.555 -1.723 1.00 14.00 H new ATOM 0 HA SER B 237 9.880 -9.471 -1.616 1.00 13.02 H new ATOM 0 HB2 SER B 237 9.555 -10.900 -3.620 1.00 3.20 H new ATOM 0 HB3 SER B 237 7.903 -10.340 -3.782 1.00 3.20 H new ATOM 0 HG SER B 237 9.360 -9.192 -5.180 1.00 1.32 H new ATOM 1436 N MET B 238 8.330 -7.364 -2.429 1.00 1.03 N ATOM 1437 CA MET B 238 7.647 -6.067 -2.265 1.00 21.14 C ATOM 1438 C MET B 238 6.112 -6.187 -2.327 1.00 33.13 C ATOM 1439 O MET B 238 5.413 -5.815 -1.383 1.00 30.14 O ATOM 1440 CB MET B 238 8.120 -5.086 -3.345 1.00 3.33 C ATOM 1441 CG MET B 238 9.599 -4.733 -3.263 1.00 54.14 C ATOM 1442 SD MET B 238 10.132 -3.674 -4.627 1.00 71.11 S ATOM 1443 CE MET B 238 8.982 -2.305 -4.468 1.00 11.12 C ATOM 0 H MET B 238 9.079 -7.350 -3.122 1.00 1.03 H new ATOM 0 HA MET B 238 7.908 -5.699 -1.273 1.00 21.14 H new ATOM 0 HB2 MET B 238 7.914 -5.516 -4.325 1.00 3.33 H new ATOM 0 HB3 MET B 238 7.535 -4.170 -3.269 1.00 3.33 H new ATOM 0 HG2 MET B 238 9.798 -4.229 -2.317 1.00 54.14 H new ATOM 0 HG3 MET B 238 10.189 -5.649 -3.266 1.00 54.14 H new ATOM 0 HE1 MET B 238 9.376 -1.436 -4.995 1.00 11.12 H new ATOM 0 HE2 MET B 238 8.021 -2.585 -4.898 1.00 11.12 H new ATOM 0 HE3 MET B 238 8.850 -2.061 -3.414 1.00 11.12 H new ATOM 1453 N SER B 239 5.597 -6.707 -3.440 1.00 70.11 N ATOM 1454 CA SER B 239 4.142 -6.819 -3.652 1.00 1.11 C ATOM 1455 C SER B 239 3.458 -7.650 -2.553 1.00 24.53 C ATOM 1456 O SER B 239 2.357 -7.321 -2.107 1.00 63.53 O ATOM 1457 CB SER B 239 3.851 -7.430 -5.030 1.00 24.21 C ATOM 1458 OG SER B 239 4.525 -8.668 -5.203 1.00 13.53 O ATOM 0 H SER B 239 6.161 -7.060 -4.214 1.00 70.11 H new ATOM 0 HA SER B 239 3.730 -5.811 -3.606 1.00 1.11 H new ATOM 0 HB2 SER B 239 2.777 -7.580 -5.143 1.00 24.21 H new ATOM 0 HB3 SER B 239 4.160 -6.734 -5.810 1.00 24.21 H new ATOM 0 HG SER B 239 4.318 -9.032 -6.089 1.00 13.53 H new ATOM 1464 N ALA B 240 4.117 -8.722 -2.118 1.00 33.31 N ATOM 1465 CA ALA B 240 3.592 -9.572 -1.041 1.00 35.31 C ATOM 1466 C ALA B 240 3.777 -8.915 0.337 1.00 60.22 C ATOM 1467 O ALA B 240 3.009 -9.166 1.269 1.00 2.32 O ATOM 1468 CB ALA B 240 4.269 -10.940 -1.078 1.00 42.14 C ATOM 0 H ALA B 240 5.016 -9.026 -2.492 1.00 33.31 H new ATOM 0 HA ALA B 240 2.522 -9.700 -1.202 1.00 35.31 H new ATOM 0 HB1 ALA B 240 3.874 -11.563 -0.276 1.00 42.14 H new ATOM 0 HB2 ALA B 240 4.073 -11.417 -2.038 1.00 42.14 H new ATOM 0 HB3 ALA B 240 5.344 -10.818 -0.946 1.00 42.14 H new ATOM 1474 N TYR B 241 4.799 -8.074 0.458 1.00 74.22 N ATOM 1475 CA TYR B 241 5.091 -7.377 1.714 1.00 31.44 C ATOM 1476 C TYR B 241 4.027 -6.303 1.981 1.00 32.23 C ATOM 1477 O TYR B 241 3.420 -6.264 3.054 1.00 52.30 O ATOM 1478 CB TYR B 241 6.494 -6.748 1.650 1.00 31.02 C ATOM 1479 CG TYR B 241 7.144 -6.524 3.006 1.00 63.14 C ATOM 1480 CD1 TYR B 241 7.778 -7.570 3.668 1.00 51.02 C ATOM 1481 CD2 TYR B 241 7.144 -5.274 3.614 1.00 2.35 C ATOM 1482 CE1 TYR B 241 8.388 -7.378 4.894 1.00 53.34 C ATOM 1483 CE2 TYR B 241 7.757 -5.074 4.838 1.00 4.35 C ATOM 1484 CZ TYR B 241 8.377 -6.129 5.474 1.00 14.11 C ATOM 1485 OH TYR B 241 8.997 -5.935 6.692 1.00 14.52 O ATOM 0 H TYR B 241 5.444 -7.855 -0.301 1.00 74.22 H new ATOM 0 HA TYR B 241 5.069 -8.094 2.535 1.00 31.44 H new ATOM 0 HB2 TYR B 241 7.140 -7.391 1.053 1.00 31.02 H new ATOM 0 HB3 TYR B 241 6.427 -5.792 1.130 1.00 31.02 H new ATOM 0 HD1 TYR B 241 7.794 -8.551 3.216 1.00 51.02 H new ATOM 0 HD2 TYR B 241 6.657 -4.445 3.122 1.00 2.35 H new ATOM 0 HE1 TYR B 241 8.871 -8.204 5.395 1.00 53.34 H new ATOM 0 HE2 TYR B 241 7.750 -4.095 5.294 1.00 4.35 H new ATOM 0 HH TYR B 241 9.951 -6.144 6.610 1.00 14.52 H new ATOM 1495 N ILE B 242 3.792 -5.449 0.984 1.00 42.22 N ATOM 1496 CA ILE B 242 2.733 -4.437 1.060 1.00 14.53 C ATOM 1497 C ILE B 242 1.372 -5.092 1.353 1.00 23.44 C ATOM 1498 O ILE B 242 0.555 -4.546 2.098 1.00 11.35 O ATOM 1499 CB ILE B 242 2.637 -3.619 -0.257 1.00 41.24 C ATOM 1500 CG1 ILE B 242 3.959 -2.888 -0.543 1.00 30.01 C ATOM 1501 CG2 ILE B 242 1.481 -2.620 -0.193 1.00 53.42 C ATOM 1502 CD1 ILE B 242 4.302 -1.817 0.475 1.00 34.33 C ATOM 0 H ILE B 242 4.321 -5.437 0.112 1.00 42.22 H new ATOM 0 HA ILE B 242 2.991 -3.760 1.875 1.00 14.53 H new ATOM 0 HB ILE B 242 2.445 -4.317 -1.072 1.00 41.24 H new ATOM 0 HG12 ILE B 242 4.767 -3.618 -0.574 1.00 30.01 H new ATOM 0 HG13 ILE B 242 3.904 -2.432 -1.531 1.00 30.01 H new ATOM 0 HG21 ILE B 242 1.433 -2.059 -1.126 1.00 53.42 H new ATOM 0 HG22 ILE B 242 0.544 -3.157 -0.044 1.00 53.42 H new ATOM 0 HG23 ILE B 242 1.641 -1.932 0.637 1.00 53.42 H new ATOM 0 HD11 ILE B 242 5.248 -1.347 0.204 1.00 34.33 H new ATOM 0 HD12 ILE B 242 3.514 -1.064 0.490 1.00 34.33 H new ATOM 0 HD13 ILE B 242 4.391 -2.269 1.463 1.00 34.33 H new ATOM 1514 N ARG B 243 1.152 -6.278 0.776 1.00 55.10 N ATOM 1515 CA ARG B 243 -0.082 -7.040 1.000 1.00 52.44 C ATOM 1516 C ARG B 243 -0.392 -7.194 2.499 1.00 5.15 C ATOM 1517 O ARG B 243 -1.511 -6.936 2.933 1.00 12.32 O ATOM 1518 CB ARG B 243 0.010 -8.427 0.337 1.00 63.41 C ATOM 1519 CG ARG B 243 -1.231 -9.295 0.551 1.00 51.32 C ATOM 1520 CD ARG B 243 -1.133 -10.638 -0.172 1.00 45.42 C ATOM 1521 NE ARG B 243 -0.012 -11.453 0.299 1.00 51.23 N ATOM 1522 CZ ARG B 243 0.208 -12.689 -0.073 1.00 70.23 C ATOM 1523 NH1 ARG B 243 -0.592 -13.286 -0.899 1.00 10.41 N ATOM 1524 NH2 ARG B 243 1.232 -13.324 0.389 1.00 12.24 N ATOM 0 H ARG B 243 1.815 -6.733 0.148 1.00 55.10 H new ATOM 0 HA ARG B 243 -0.897 -6.479 0.544 1.00 52.44 H new ATOM 0 HB2 ARG B 243 0.172 -8.298 -0.733 1.00 63.41 H new ATOM 0 HB3 ARG B 243 0.881 -8.951 0.731 1.00 63.41 H new ATOM 0 HG2 ARG B 243 -1.370 -9.469 1.618 1.00 51.32 H new ATOM 0 HG3 ARG B 243 -2.112 -8.759 0.198 1.00 51.32 H new ATOM 0 HD2 ARG B 243 -2.062 -11.190 -0.032 1.00 45.42 H new ATOM 0 HD3 ARG B 243 -1.025 -10.463 -1.242 1.00 45.42 H new ATOM 0 HE ARG B 243 0.640 -11.031 0.960 1.00 51.23 H new ATOM 0 HH11 ARG B 243 -1.405 -12.793 -1.268 1.00 10.41 H new ATOM 0 HH12 ARG B 243 -0.409 -14.249 -1.180 1.00 10.41 H new ATOM 0 HH21 ARG B 243 1.866 -12.863 1.041 1.00 12.24 H new ATOM 0 HH22 ARG B 243 1.407 -14.287 0.102 1.00 12.24 H new ATOM 1538 N ARG B 244 0.599 -7.602 3.294 1.00 10.44 N ATOM 1539 CA ARG B 244 0.376 -7.782 4.733 1.00 10.41 C ATOM 1540 C ARG B 244 0.536 -6.459 5.507 1.00 42.42 C ATOM 1541 O ARG B 244 0.072 -6.336 6.638 1.00 65.33 O ATOM 1542 CB ARG B 244 1.286 -8.870 5.318 1.00 21.23 C ATOM 1543 CG ARG B 244 2.763 -8.500 5.402 1.00 11.44 C ATOM 1544 CD ARG B 244 3.507 -9.465 6.319 1.00 22.32 C ATOM 1545 NE ARG B 244 2.889 -9.516 7.645 1.00 11.40 N ATOM 1546 CZ ARG B 244 2.785 -10.593 8.378 1.00 12.11 C ATOM 1547 NH1 ARG B 244 3.282 -11.722 7.977 1.00 25.34 N ATOM 1548 NH2 ARG B 244 2.175 -10.536 9.520 1.00 42.52 N ATOM 0 H ARG B 244 1.546 -7.811 2.976 1.00 10.44 H new ATOM 0 HA ARG B 244 -0.656 -8.113 4.851 1.00 10.41 H new ATOM 0 HB2 ARG B 244 0.932 -9.119 6.318 1.00 21.23 H new ATOM 0 HB3 ARG B 244 1.187 -9.770 4.711 1.00 21.23 H new ATOM 0 HG2 ARG B 244 3.206 -8.522 4.406 1.00 11.44 H new ATOM 0 HG3 ARG B 244 2.868 -7.481 5.775 1.00 11.44 H new ATOM 0 HD2 ARG B 244 3.510 -10.462 5.877 1.00 22.32 H new ATOM 0 HD3 ARG B 244 4.548 -9.154 6.411 1.00 22.32 H new ATOM 0 HE ARG B 244 2.512 -8.648 8.025 1.00 11.40 H new ATOM 0 HH11 ARG B 244 3.762 -11.778 7.079 1.00 25.34 H new ATOM 0 HH12 ARG B 244 3.193 -12.554 8.560 1.00 25.34 H new ATOM 0 HH21 ARG B 244 1.779 -9.653 9.843 1.00 42.52 H new ATOM 0 HH22 ARG B 244 2.091 -11.374 10.096 1.00 42.52 H new ATOM 1562 N ILE B 245 1.195 -5.472 4.899 1.00 22.25 N ATOM 1563 CA ILE B 245 1.264 -4.125 5.484 1.00 35.02 C ATOM 1564 C ILE B 245 -0.142 -3.511 5.601 1.00 25.43 C ATOM 1565 O ILE B 245 -0.468 -2.851 6.590 1.00 62.11 O ATOM 1566 CB ILE B 245 2.181 -3.185 4.653 1.00 73.01 C ATOM 1567 CG1 ILE B 245 3.656 -3.591 4.822 1.00 53.33 C ATOM 1568 CG2 ILE B 245 1.970 -1.718 5.033 1.00 32.44 C ATOM 1569 CD1 ILE B 245 4.628 -2.704 4.069 1.00 0.10 C ATOM 0 H ILE B 245 1.685 -5.574 4.010 1.00 22.25 H new ATOM 0 HA ILE B 245 1.695 -4.227 6.480 1.00 35.02 H new ATOM 0 HB ILE B 245 1.910 -3.291 3.603 1.00 73.01 H new ATOM 0 HG12 ILE B 245 3.909 -3.572 5.882 1.00 53.33 H new ATOM 0 HG13 ILE B 245 3.781 -4.619 4.483 1.00 53.33 H new ATOM 0 HG21 ILE B 245 2.627 -1.089 4.433 1.00 32.44 H new ATOM 0 HG22 ILE B 245 0.932 -1.440 4.848 1.00 32.44 H new ATOM 0 HG23 ILE B 245 2.200 -1.579 6.089 1.00 32.44 H new ATOM 0 HD11 ILE B 245 5.646 -3.054 4.238 1.00 0.10 H new ATOM 0 HD12 ILE B 245 4.404 -2.741 3.003 1.00 0.10 H new ATOM 0 HD13 ILE B 245 4.534 -1.678 4.424 1.00 0.10 H new ATOM 1581 N ILE B 246 -0.971 -3.740 4.583 1.00 22.32 N ATOM 1582 CA ILE B 246 -2.365 -3.293 4.610 1.00 73.12 C ATOM 1583 C ILE B 246 -3.288 -4.340 5.267 1.00 51.03 C ATOM 1584 O ILE B 246 -4.224 -3.982 5.986 1.00 61.00 O ATOM 1585 CB ILE B 246 -2.874 -2.936 3.189 1.00 34.13 C ATOM 1586 CG1 ILE B 246 -2.629 -4.098 2.211 1.00 50.43 C ATOM 1587 CG2 ILE B 246 -2.202 -1.656 2.690 1.00 31.32 C ATOM 1588 CD1 ILE B 246 -2.974 -3.775 0.770 1.00 42.45 C ATOM 0 H ILE B 246 -0.703 -4.231 3.730 1.00 22.32 H new ATOM 0 HA ILE B 246 -2.396 -2.390 5.219 1.00 73.12 H new ATOM 0 HB ILE B 246 -3.949 -2.764 3.242 1.00 34.13 H new ATOM 0 HG12 ILE B 246 -1.580 -4.391 2.266 1.00 50.43 H new ATOM 0 HG13 ILE B 246 -3.217 -4.958 2.531 1.00 50.43 H new ATOM 0 HG21 ILE B 246 -2.569 -1.418 1.692 1.00 31.32 H new ATOM 0 HG22 ILE B 246 -2.435 -0.835 3.368 1.00 31.32 H new ATOM 0 HG23 ILE B 246 -1.122 -1.802 2.655 1.00 31.32 H new ATOM 0 HD11 ILE B 246 -2.773 -4.645 0.144 1.00 42.45 H new ATOM 0 HD12 ILE B 246 -4.029 -3.512 0.699 1.00 42.45 H new ATOM 0 HD13 ILE B 246 -2.367 -2.936 0.430 1.00 42.45 H new ATOM 1600 N LEU B 247 -3.017 -5.631 5.030 1.00 31.32 N ATOM 1601 CA LEU B 247 -3.750 -6.723 5.700 1.00 30.12 C ATOM 1602 C LEU B 247 -3.757 -6.523 7.225 1.00 25.31 C ATOM 1603 O LEU B 247 -4.815 -6.495 7.862 1.00 22.21 O ATOM 1604 CB LEU B 247 -3.112 -8.080 5.353 1.00 51.52 C ATOM 1605 CG LEU B 247 -3.687 -9.303 6.091 1.00 33.31 C ATOM 1606 CD1 LEU B 247 -5.155 -9.526 5.734 1.00 71.21 C ATOM 1607 CD2 LEU B 247 -2.858 -10.551 5.786 1.00 13.12 C ATOM 0 H LEU B 247 -2.297 -5.948 4.381 1.00 31.32 H new ATOM 0 HA LEU B 247 -4.781 -6.710 5.345 1.00 30.12 H new ATOM 0 HB2 LEU B 247 -3.217 -8.245 4.281 1.00 51.52 H new ATOM 0 HB3 LEU B 247 -2.044 -8.022 5.564 1.00 51.52 H new ATOM 0 HG LEU B 247 -3.633 -9.106 7.162 1.00 33.31 H new ATOM 0 HD11 LEU B 247 -5.532 -10.397 6.271 1.00 71.21 H new ATOM 0 HD12 LEU B 247 -5.735 -8.647 6.015 1.00 71.21 H new ATOM 0 HD13 LEU B 247 -5.247 -9.694 4.661 1.00 71.21 H new ATOM 0 HD21 LEU B 247 -3.279 -11.406 6.316 1.00 13.12 H new ATOM 0 HD22 LEU B 247 -2.874 -10.745 4.714 1.00 13.12 H new ATOM 0 HD23 LEU B 247 -1.830 -10.393 6.111 1.00 13.12 H new ATOM 1619 N ASN B 248 -2.565 -6.351 7.798 1.00 13.22 N ATOM 1620 CA ASN B 248 -2.410 -6.077 9.233 1.00 63.52 C ATOM 1621 C ASN B 248 -2.677 -4.591 9.550 1.00 23.33 C ATOM 1622 O ASN B 248 -2.016 -3.989 10.404 1.00 63.10 O ATOM 1623 CB ASN B 248 -1.001 -6.474 9.691 1.00 72.03 C ATOM 1624 CG ASN B 248 -0.706 -7.944 9.448 1.00 42.43 C ATOM 1625 OD1 ASN B 248 -0.178 -8.326 8.409 1.00 61.13 O ATOM 1626 ND2 ASN B 248 -1.043 -8.784 10.403 1.00 73.42 N ATOM 0 H ASN B 248 -1.683 -6.397 7.287 1.00 13.22 H new ATOM 0 HA ASN B 248 -3.145 -6.672 9.776 1.00 63.52 H new ATOM 0 HB2 ASN B 248 -0.266 -5.867 9.163 1.00 72.03 H new ATOM 0 HB3 ASN B 248 -0.892 -6.255 10.753 1.00 72.03 H new ATOM 0 HD21 ASN B 248 -0.866 -9.782 10.290 1.00 73.42 H new ATOM 0 HD22 ASN B 248 -1.481 -8.437 11.256 1.00 73.42 H new ATOM 1633 N HIS B 249 -3.654 -4.011 8.856 1.00 43.02 N ATOM 1634 CA HIS B 249 -4.075 -2.628 9.091 1.00 51.23 C ATOM 1635 C HIS B 249 -5.595 -2.492 8.898 1.00 72.32 C ATOM 1636 O HIS B 249 -6.269 -1.805 9.661 1.00 32.10 O ATOM 1637 CB HIS B 249 -3.326 -1.679 8.145 1.00 32.32 C ATOM 1638 CG HIS B 249 -3.520 -0.226 8.459 1.00 51.12 C ATOM 1639 ND1 HIS B 249 -2.649 0.484 9.252 1.00 61.22 N ATOM 1640 CD2 HIS B 249 -4.472 0.656 8.072 1.00 72.13 C ATOM 1641 CE1 HIS B 249 -3.051 1.734 9.339 1.00 42.05 C ATOM 1642 NE2 HIS B 249 -4.155 1.869 8.634 1.00 44.52 N ATOM 0 H HIS B 249 -4.176 -4.483 8.117 1.00 43.02 H new ATOM 0 HA HIS B 249 -3.833 -2.357 10.119 1.00 51.23 H new ATOM 0 HB2 HIS B 249 -2.261 -1.909 8.184 1.00 32.32 H new ATOM 0 HB3 HIS B 249 -3.656 -1.866 7.123 1.00 32.32 H new ATOM 0 HD1 HIS B 249 -1.819 0.100 9.703 1.00 61.22 H new ATOM 0 HD2 HIS B 249 -5.322 0.445 7.440 1.00 72.13 H new ATOM 0 HE1 HIS B 249 -2.558 2.518 9.895 1.00 42.05 H new ATOM 1651 N LEU B 250 -6.128 -3.156 7.870 1.00 40.21 N ATOM 1652 CA LEU B 250 -7.575 -3.159 7.612 1.00 2.24 C ATOM 1653 C LEU B 250 -8.337 -3.962 8.679 1.00 3.30 C ATOM 1654 O LEU B 250 -9.505 -3.686 8.961 1.00 12.24 O ATOM 1655 CB LEU B 250 -7.878 -3.715 6.209 1.00 60.30 C ATOM 1656 CG LEU B 250 -7.790 -2.699 5.053 1.00 64.44 C ATOM 1657 CD1 LEU B 250 -8.817 -1.585 5.242 1.00 31.31 C ATOM 1658 CD2 LEU B 250 -6.383 -2.118 4.928 1.00 43.41 C ATOM 0 H LEU B 250 -5.582 -3.699 7.201 1.00 40.21 H new ATOM 0 HA LEU B 250 -7.917 -2.125 7.661 1.00 2.24 H new ATOM 0 HB2 LEU B 250 -7.185 -4.531 6.004 1.00 60.30 H new ATOM 0 HB3 LEU B 250 -8.881 -4.143 6.217 1.00 60.30 H new ATOM 0 HG LEU B 250 -8.014 -3.227 4.126 1.00 64.44 H new ATOM 0 HD11 LEU B 250 -8.741 -0.876 4.417 1.00 31.31 H new ATOM 0 HD12 LEU B 250 -9.819 -2.013 5.261 1.00 31.31 H new ATOM 0 HD13 LEU B 250 -8.625 -1.069 6.183 1.00 31.31 H new ATOM 0 HD21 LEU B 250 -6.356 -1.405 4.104 1.00 43.41 H new ATOM 0 HD22 LEU B 250 -6.115 -1.611 5.855 1.00 43.41 H new ATOM 0 HD23 LEU B 250 -5.673 -2.922 4.736 1.00 43.41 H new ATOM 1670 N GLU B 251 -7.682 -4.964 9.266 1.00 71.25 N ATOM 1671 CA GLU B 251 -8.279 -5.708 10.383 1.00 40.43 C ATOM 1672 C GLU B 251 -8.319 -4.839 11.652 1.00 41.54 C ATOM 1673 O GLU B 251 -9.093 -5.096 12.572 1.00 51.12 O ATOM 1674 CB GLU B 251 -7.512 -7.014 10.653 1.00 33.51 C ATOM 1675 CG GLU B 251 -6.085 -6.816 11.159 1.00 42.11 C ATOM 1676 CD GLU B 251 -5.418 -8.122 11.570 1.00 73.40 C ATOM 1677 OE1 GLU B 251 -6.090 -8.961 12.214 1.00 41.14 O ATOM 1678 OE2 GLU B 251 -4.221 -8.314 11.265 1.00 32.21 O ATOM 0 H GLU B 251 -6.751 -5.279 8.994 1.00 71.25 H new ATOM 0 HA GLU B 251 -9.301 -5.966 10.104 1.00 40.43 H new ATOM 0 HB2 GLU B 251 -8.066 -7.601 11.386 1.00 33.51 H new ATOM 0 HB3 GLU B 251 -7.480 -7.599 9.734 1.00 33.51 H new ATOM 0 HG2 GLU B 251 -5.491 -6.340 10.379 1.00 42.11 H new ATOM 0 HG3 GLU B 251 -6.097 -6.136 12.011 1.00 42.11 H new ATOM 1685 N ASP B 252 -7.467 -3.814 11.683 1.00 34.34 N ATOM 1686 CA ASP B 252 -7.431 -2.840 12.777 1.00 41.21 C ATOM 1687 C ASP B 252 -8.441 -1.704 12.543 1.00 62.35 C ATOM 1688 O ASP B 252 -9.073 -1.213 13.483 1.00 13.42 O ATOM 1689 CB ASP B 252 -6.019 -2.260 12.900 1.00 63.25 C ATOM 1690 CG ASP B 252 -4.967 -3.343 13.054 1.00 0.21 C ATOM 1691 OD1 ASP B 252 -4.673 -4.039 12.064 1.00 63.32 O ATOM 1692 OD2 ASP B 252 -4.422 -3.505 14.163 1.00 64.42 O ATOM 0 H ASP B 252 -6.781 -3.634 10.950 1.00 34.34 H new ATOM 0 HA ASP B 252 -7.703 -3.351 13.701 1.00 41.21 H new ATOM 0 HB2 ASP B 252 -5.796 -1.661 12.017 1.00 63.25 H new ATOM 0 HB3 ASP B 252 -5.977 -1.590 13.758 1.00 63.25 H new ATOM 1697 N GLU B 253 -8.573 -1.284 11.282 1.00 34.31 N ATOM 1698 CA GLU B 253 -9.527 -0.230 10.894 1.00 2.50 C ATOM 1699 C GLU B 253 -10.218 -0.549 9.544 1.00 74.24 C ATOM 1700 O GLU B 253 -9.715 -0.127 8.476 1.00 38.74 O ATOM 1701 CB GLU B 253 -8.821 1.146 10.850 1.00 21.12 C ATOM 1702 CG GLU B 253 -7.502 1.160 10.075 1.00 63.31 C ATOM 1703 CD GLU B 253 -6.952 2.565 9.862 1.00 63.53 C ATOM 1704 OE1 GLU B 253 -7.498 3.297 9.008 1.00 10.22 O ATOM 1705 OE2 GLU B 253 -5.961 2.936 10.528 1.00 23.12 O ATOM 1706 OXT GLU B 253 -11.271 -1.228 9.561 1.00 38.74 O ATOM 0 H GLU B 253 -8.029 -1.658 10.504 1.00 34.31 H new ATOM 0 HA GLU B 253 -10.310 -0.192 11.651 1.00 2.50 H new ATOM 0 HB2 GLU B 253 -9.498 1.873 10.402 1.00 21.12 H new ATOM 0 HB3 GLU B 253 -8.631 1.475 11.872 1.00 21.12 H new ATOM 0 HG2 GLU B 253 -6.764 0.565 10.613 1.00 63.31 H new ATOM 0 HG3 GLU B 253 -7.651 0.683 9.106 1.00 63.31 H new