USER MOD reduce.3.24.130724 H: found=0, std=0, add=705, rem=0, adj=19 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 Set 1.1: B 237 SER OG : rot -111:sc= 0.027 USER MOD Set 1.2: B 239 SER OG : rot 180:sc= -0.1 USER MOD Single : A 11 LYS NZ :NH3+ 164:sc= -0.0387 (180deg=-0.29) USER MOD Single : A 13 THR OG1 : rot -53:sc= 0.0662 USER MOD Single : A 14 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0439) 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 -35:sc= 1.14 USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0.0493 USER MOD Single : A 38 MET CE :methyl -110:sc= -1.19 (180deg=-1.61) USER MOD Single : A 39 SER OG : rot -89:sc= 1.01 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.0159 K(o=-0.016,f=-1.1) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 213 THR OG1 : rot -170:sc= -1.4! USER MOD Single : B 214 LYS NZ :NH3+ -172:sc= -0.0022 (180deg=-0.0824) USER MOD Single : B 221 TYR OH : rot 55:sc= 0.497 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 K(o=0,f=-0.68) USER MOD Single : B 236 THR OG1 : rot -90:sc= -0.162 USER MOD Single : B 238 MET CE :methyl 158:sc= -0.129 (180deg=-0.701) USER MOD Single : B 241 TYR OH : rot 30:sc= 0.141 USER MOD Single : B 248 ASN : amide:sc= -0.0177 X(o=-0.018,f=-0.51) USER MOD Single : B 249 HIS : no HD1:sc= -0.3 K(o=-0.3,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 145 N LYS A 11 4.493 13.613 -9.240 1.00 4.11 N ATOM 146 CA LYS A 11 5.396 12.453 -9.269 1.00 25.15 C ATOM 147 C LYS A 11 6.207 12.337 -7.963 1.00 43.12 C ATOM 148 O LYS A 11 7.345 11.859 -7.959 1.00 4.55 O ATOM 149 CB LYS A 11 6.343 12.562 -10.476 1.00 1.54 C ATOM 150 CG LYS A 11 7.287 13.761 -10.425 1.00 33.23 C ATOM 151 CD LYS A 11 8.147 13.857 -11.683 1.00 31.21 C ATOM 152 CE LYS A 11 9.214 14.939 -11.558 1.00 42.33 C ATOM 153 NZ LYS A 11 10.213 14.612 -10.504 1.00 31.02 N ATOM 0 HA LYS A 11 4.790 11.552 -9.363 1.00 25.15 H new ATOM 0 HB2 LYS A 11 6.936 11.650 -10.542 1.00 1.54 H new ATOM 0 HB3 LYS A 11 5.747 12.621 -11.387 1.00 1.54 H new ATOM 0 HG2 LYS A 11 6.707 14.676 -10.310 1.00 33.23 H new ATOM 0 HG3 LYS A 11 7.931 13.680 -9.549 1.00 33.23 H new ATOM 0 HD2 LYS A 11 8.625 12.895 -11.871 1.00 31.21 H new ATOM 0 HD3 LYS A 11 7.511 14.071 -12.542 1.00 31.21 H new ATOM 0 HE2 LYS A 11 9.722 15.061 -12.515 1.00 42.33 H new ATOM 0 HE3 LYS A 11 8.739 15.892 -11.326 1.00 42.33 H new ATOM 0 HZ1 LYS A 11 11.055 15.211 -10.626 1.00 31.02 H new ATOM 0 HZ2 LYS A 11 9.798 14.785 -9.566 1.00 31.02 H new ATOM 0 HZ3 LYS A 11 10.486 13.611 -10.583 1.00 31.02 H new ATOM 167 N ASP A 12 5.602 12.759 -6.853 1.00 34.41 N ATOM 168 CA ASP A 12 6.256 12.709 -5.541 1.00 35.15 C ATOM 169 C ASP A 12 6.401 11.255 -5.060 1.00 55.43 C ATOM 170 O ASP A 12 7.432 10.855 -4.514 1.00 61.42 O ATOM 171 CB ASP A 12 5.438 13.528 -4.524 1.00 52.31 C ATOM 172 CG ASP A 12 4.080 12.905 -4.207 1.00 60.11 C ATOM 173 OD1 ASP A 12 3.399 12.425 -5.142 1.00 64.32 O ATOM 174 OD2 ASP A 12 3.696 12.869 -3.021 1.00 44.32 O ATOM 0 H ASP A 12 4.656 13.141 -6.834 1.00 34.41 H new ATOM 0 HA ASP A 12 7.254 13.138 -5.629 1.00 35.15 H new ATOM 0 HB2 ASP A 12 6.010 13.626 -3.601 1.00 52.31 H new ATOM 0 HB3 ASP A 12 5.287 14.534 -4.914 1.00 52.31 H new ATOM 179 N THR A 13 5.355 10.473 -5.299 1.00 43.02 N ATOM 180 CA THR A 13 5.291 9.074 -4.869 1.00 70.24 C ATOM 181 C THR A 13 5.050 8.141 -6.062 1.00 61.21 C ATOM 182 O THR A 13 4.152 8.373 -6.873 1.00 43.55 O ATOM 183 CB THR A 13 4.159 8.862 -3.833 1.00 45.20 C ATOM 184 OG1 THR A 13 2.931 9.427 -4.316 1.00 62.24 O ATOM 185 CG2 THR A 13 4.501 9.487 -2.490 1.00 75.11 C ATOM 0 H THR A 13 4.523 10.788 -5.798 1.00 43.02 H new ATOM 0 HA THR A 13 6.251 8.836 -4.411 1.00 70.24 H new ATOM 0 HB THR A 13 4.045 7.787 -3.694 1.00 45.20 H new ATOM 0 HG1 THR A 13 3.079 10.362 -4.571 1.00 62.24 H new ATOM 0 HG21 THR A 13 3.682 9.317 -1.791 1.00 75.11 H new ATOM 0 HG22 THR A 13 5.412 9.034 -2.099 1.00 75.11 H new ATOM 0 HG23 THR A 13 4.654 10.559 -2.616 1.00 75.11 H new ATOM 193 N LYS A 14 5.846 7.079 -6.159 1.00 53.33 N ATOM 194 CA LYS A 14 5.740 6.135 -7.274 1.00 63.42 C ATOM 195 C LYS A 14 4.773 4.986 -6.941 1.00 11.12 C ATOM 196 O LYS A 14 4.797 4.441 -5.837 1.00 54.11 O ATOM 197 CB LYS A 14 7.130 5.599 -7.650 1.00 43.15 C ATOM 198 CG LYS A 14 8.101 6.705 -8.064 1.00 70.51 C ATOM 199 CD LYS A 14 7.540 7.547 -9.213 1.00 21.30 C ATOM 200 CE LYS A 14 8.408 8.765 -9.507 1.00 60.32 C ATOM 201 NZ LYS A 14 9.793 8.385 -9.886 1.00 55.05 N ATOM 0 H LYS A 14 6.572 6.849 -5.480 1.00 53.33 H new ATOM 0 HA LYS A 14 5.331 6.665 -8.134 1.00 63.42 H new ATOM 0 HB2 LYS A 14 7.546 5.056 -6.802 1.00 43.15 H new ATOM 0 HB3 LYS A 14 7.030 4.885 -8.468 1.00 43.15 H new ATOM 0 HG2 LYS A 14 8.307 7.348 -7.208 1.00 70.51 H new ATOM 0 HG3 LYS A 14 9.050 6.262 -8.366 1.00 70.51 H new ATOM 0 HD2 LYS A 14 7.464 6.932 -10.109 1.00 21.30 H new ATOM 0 HD3 LYS A 14 6.530 7.873 -8.964 1.00 21.30 H new ATOM 0 HE2 LYS A 14 7.958 9.344 -10.313 1.00 60.32 H new ATOM 0 HE3 LYS A 14 8.437 9.410 -8.629 1.00 60.32 H new ATOM 0 HZ1 LYS A 14 10.319 9.234 -10.175 1.00 55.05 H new ATOM 0 HZ2 LYS A 14 10.267 7.944 -9.072 1.00 55.05 H new ATOM 0 HZ3 LYS A 14 9.764 7.710 -10.677 1.00 55.05 H new ATOM 215 N PRO A 15 3.899 4.618 -7.898 1.00 24.11 N ATOM 216 CA PRO A 15 2.827 3.643 -7.671 1.00 23.25 C ATOM 217 C PRO A 15 3.246 2.173 -7.884 1.00 33.34 C ATOM 218 O PRO A 15 3.549 1.748 -9.005 1.00 34.50 O ATOM 219 CB PRO A 15 1.786 4.079 -8.707 1.00 42.43 C ATOM 220 CG PRO A 15 2.591 4.597 -9.857 1.00 31.14 C ATOM 221 CD PRO A 15 3.882 5.131 -9.280 1.00 14.11 C ATOM 0 HA PRO A 15 2.482 3.646 -6.637 1.00 23.25 H new ATOM 0 HB2 PRO A 15 1.154 3.244 -9.010 1.00 42.43 H new ATOM 0 HB3 PRO A 15 1.126 4.849 -8.306 1.00 42.43 H new ATOM 0 HG2 PRO A 15 2.789 3.804 -10.579 1.00 31.14 H new ATOM 0 HG3 PRO A 15 2.050 5.382 -10.386 1.00 31.14 H new ATOM 0 HD2 PRO A 15 4.746 4.781 -9.845 1.00 14.11 H new ATOM 0 HD3 PRO A 15 3.907 6.221 -9.301 1.00 14.11 H new ATOM 229 N VAL A 16 3.262 1.406 -6.797 1.00 10.30 N ATOM 230 CA VAL A 16 3.502 -0.040 -6.855 1.00 63.42 C ATOM 231 C VAL A 16 2.179 -0.811 -6.693 1.00 63.51 C ATOM 232 O VAL A 16 1.317 -0.427 -5.901 1.00 13.34 O ATOM 233 CB VAL A 16 4.511 -0.490 -5.763 1.00 33.32 C ATOM 234 CG1 VAL A 16 3.999 -0.157 -4.361 1.00 20.12 C ATOM 235 CG2 VAL A 16 4.825 -1.982 -5.893 1.00 1.15 C ATOM 0 H VAL A 16 3.110 1.763 -5.854 1.00 10.30 H new ATOM 0 HA VAL A 16 3.932 -0.265 -7.831 1.00 63.42 H new ATOM 0 HB VAL A 16 5.436 0.065 -5.916 1.00 33.32 H new ATOM 0 HG11 VAL A 16 4.728 -0.485 -3.620 1.00 20.12 H new ATOM 0 HG12 VAL A 16 3.852 0.919 -4.274 1.00 20.12 H new ATOM 0 HG13 VAL A 16 3.052 -0.668 -4.189 1.00 20.12 H new ATOM 0 HG21 VAL A 16 5.534 -2.274 -5.118 1.00 1.15 H new ATOM 0 HG22 VAL A 16 3.907 -2.558 -5.781 1.00 1.15 H new ATOM 0 HG23 VAL A 16 5.259 -2.178 -6.873 1.00 1.15 H new ATOM 245 N VAL A 17 2.008 -1.886 -7.458 1.00 12.30 N ATOM 246 CA VAL A 17 0.768 -2.669 -7.402 1.00 4.42 C ATOM 247 C VAL A 17 0.828 -3.776 -6.334 1.00 22.34 C ATOM 248 O VAL A 17 1.775 -4.567 -6.277 1.00 11.12 O ATOM 249 CB VAL A 17 0.424 -3.290 -8.782 1.00 3.51 C ATOM 250 CG1 VAL A 17 1.526 -4.235 -9.257 1.00 44.52 C ATOM 251 CG2 VAL A 17 -0.930 -4.004 -8.735 1.00 32.34 C ATOM 0 H VAL A 17 2.702 -2.235 -8.119 1.00 12.30 H new ATOM 0 HA VAL A 17 -0.021 -1.971 -7.124 1.00 4.42 H new ATOM 0 HB VAL A 17 0.354 -2.477 -9.505 1.00 3.51 H new ATOM 0 HG11 VAL A 17 1.254 -4.653 -10.226 1.00 44.52 H new ATOM 0 HG12 VAL A 17 2.462 -3.685 -9.349 1.00 44.52 H new ATOM 0 HG13 VAL A 17 1.649 -5.042 -8.535 1.00 44.52 H new ATOM 0 HG21 VAL A 17 -1.150 -4.431 -9.713 1.00 32.34 H new ATOM 0 HG22 VAL A 17 -0.896 -4.800 -7.991 1.00 32.34 H new ATOM 0 HG23 VAL A 17 -1.709 -3.290 -8.468 1.00 32.34 H new ATOM 261 N VAL A 18 -0.190 -3.805 -5.480 1.00 2.14 N ATOM 262 CA VAL A 18 -0.345 -4.851 -4.467 1.00 40.21 C ATOM 263 C VAL A 18 -1.766 -5.441 -4.519 1.00 4.22 C ATOM 264 O VAL A 18 -2.755 -4.709 -4.560 1.00 31.23 O ATOM 265 CB VAL A 18 -0.048 -4.306 -3.042 1.00 50.52 C ATOM 266 CG1 VAL A 18 -0.951 -3.120 -2.699 1.00 52.14 C ATOM 267 CG2 VAL A 18 -0.175 -5.416 -1.996 1.00 24.42 C ATOM 0 H VAL A 18 -0.932 -3.106 -5.468 1.00 2.14 H new ATOM 0 HA VAL A 18 0.377 -5.637 -4.688 1.00 40.21 H new ATOM 0 HB VAL A 18 0.981 -3.948 -3.031 1.00 50.52 H new ATOM 0 HG11 VAL A 18 -0.717 -2.763 -1.696 1.00 52.14 H new ATOM 0 HG12 VAL A 18 -0.786 -2.317 -3.418 1.00 52.14 H new ATOM 0 HG13 VAL A 18 -1.994 -3.434 -2.739 1.00 52.14 H new ATOM 0 HG21 VAL A 18 0.037 -5.010 -1.007 1.00 24.42 H new ATOM 0 HG22 VAL A 18 -1.188 -5.818 -2.013 1.00 24.42 H new ATOM 0 HG23 VAL A 18 0.535 -6.212 -2.222 1.00 24.42 H new ATOM 277 N ARG A 19 -1.866 -6.765 -4.546 1.00 21.32 N ATOM 278 CA ARG A 19 -3.166 -7.434 -4.639 1.00 51.35 C ATOM 279 C ARG A 19 -3.766 -7.740 -3.252 1.00 71.51 C ATOM 280 O ARG A 19 -3.152 -8.423 -2.429 1.00 42.50 O ATOM 281 CB ARG A 19 -3.038 -8.725 -5.462 1.00 53.14 C ATOM 282 CG ARG A 19 -2.664 -8.499 -6.925 1.00 64.33 C ATOM 283 CD ARG A 19 -2.589 -9.811 -7.707 1.00 23.21 C ATOM 284 NE ARG A 19 -3.865 -10.530 -7.709 1.00 41.04 N ATOM 285 CZ ARG A 19 -4.275 -11.309 -8.676 1.00 44.33 C ATOM 286 NH1 ARG A 19 -3.571 -11.464 -9.752 1.00 44.14 N ATOM 287 NH2 ARG A 19 -5.413 -11.912 -8.578 1.00 71.43 N ATOM 0 H ARG A 19 -1.067 -7.398 -4.505 1.00 21.32 H new ATOM 0 HA ARG A 19 -3.850 -6.750 -5.141 1.00 51.35 H new ATOM 0 HB2 ARG A 19 -2.285 -9.364 -5.000 1.00 53.14 H new ATOM 0 HB3 ARG A 19 -3.984 -9.265 -5.419 1.00 53.14 H new ATOM 0 HG2 ARG A 19 -3.399 -7.842 -7.390 1.00 64.33 H new ATOM 0 HG3 ARG A 19 -1.702 -7.990 -6.979 1.00 64.33 H new ATOM 0 HD2 ARG A 19 -2.290 -9.603 -8.734 1.00 23.21 H new ATOM 0 HD3 ARG A 19 -1.817 -10.446 -7.273 1.00 23.21 H new ATOM 0 HE ARG A 19 -4.476 -10.415 -6.900 1.00 41.04 H new ATOM 0 HH11 ARG A 19 -2.682 -10.975 -9.855 1.00 44.14 H new ATOM 0 HH12 ARG A 19 -3.906 -12.075 -10.497 1.00 44.14 H new ATOM 0 HH21 ARG A 19 -5.990 -11.780 -7.747 1.00 71.43 H new ATOM 0 HH22 ARG A 19 -5.735 -12.520 -9.331 1.00 71.43 H new ATOM 301 N LEU A 20 -4.978 -7.236 -3.013 1.00 43.43 N ATOM 302 CA LEU A 20 -5.694 -7.454 -1.745 1.00 65.21 C ATOM 303 C LEU A 20 -7.041 -8.163 -2.003 1.00 35.52 C ATOM 304 O LEU A 20 -7.555 -8.132 -3.118 1.00 14.10 O ATOM 305 CB LEU A 20 -5.922 -6.107 -1.038 1.00 62.42 C ATOM 306 CG LEU A 20 -6.455 -6.191 0.403 1.00 20.31 C ATOM 307 CD1 LEU A 20 -5.442 -6.887 1.310 1.00 52.44 C ATOM 308 CD2 LEU A 20 -6.795 -4.801 0.940 1.00 2.33 C ATOM 0 H LEU A 20 -5.493 -6.668 -3.686 1.00 43.43 H new ATOM 0 HA LEU A 20 -5.089 -8.093 -1.101 1.00 65.21 H new ATOM 0 HB2 LEU A 20 -4.979 -5.560 -1.026 1.00 62.42 H new ATOM 0 HB3 LEU A 20 -6.623 -5.520 -1.631 1.00 62.42 H new ATOM 0 HG LEU A 20 -7.371 -6.782 0.393 1.00 20.31 H new ATOM 0 HD11 LEU A 20 -5.836 -6.937 2.325 1.00 52.44 H new ATOM 0 HD12 LEU A 20 -5.258 -7.896 0.942 1.00 52.44 H new ATOM 0 HD13 LEU A 20 -4.508 -6.325 1.311 1.00 52.44 H new ATOM 0 HD21 LEU A 20 -7.170 -4.887 1.960 1.00 2.33 H new ATOM 0 HD22 LEU A 20 -5.900 -4.179 0.933 1.00 2.33 H new ATOM 0 HD23 LEU A 20 -7.558 -4.344 0.310 1.00 2.33 H new ATOM 320 N TYR A 21 -7.613 -8.798 -0.980 1.00 65.24 N ATOM 321 CA TYR A 21 -8.849 -9.584 -1.152 1.00 12.34 C ATOM 322 C TYR A 21 -10.081 -8.705 -1.444 1.00 42.23 C ATOM 323 O TYR A 21 -10.258 -7.640 -0.844 1.00 62.35 O ATOM 324 CB TYR A 21 -9.108 -10.449 0.090 1.00 74.52 C ATOM 325 CG TYR A 21 -8.190 -11.650 0.194 1.00 75.54 C ATOM 326 CD1 TYR A 21 -6.874 -11.513 0.628 1.00 34.14 C ATOM 327 CD2 TYR A 21 -8.639 -12.921 -0.147 1.00 15.35 C ATOM 328 CE1 TYR A 21 -6.034 -12.610 0.714 1.00 62.01 C ATOM 329 CE2 TYR A 21 -7.807 -14.020 -0.062 1.00 14.30 C ATOM 330 CZ TYR A 21 -6.506 -13.862 0.368 1.00 32.23 C ATOM 331 OH TYR A 21 -5.674 -14.961 0.455 1.00 23.35 O ATOM 0 H TYR A 21 -7.249 -8.788 -0.027 1.00 65.24 H new ATOM 0 HA TYR A 21 -8.695 -10.222 -2.022 1.00 12.34 H new ATOM 0 HB2 TYR A 21 -8.990 -9.834 0.982 1.00 74.52 H new ATOM 0 HB3 TYR A 21 -10.142 -10.793 0.074 1.00 74.52 H new ATOM 0 HD1 TYR A 21 -6.503 -10.536 0.902 1.00 34.14 H new ATOM 0 HD2 TYR A 21 -9.657 -13.051 -0.484 1.00 15.35 H new ATOM 0 HE1 TYR A 21 -5.015 -12.488 1.050 1.00 62.01 H new ATOM 0 HE2 TYR A 21 -8.174 -15.000 -0.331 1.00 14.30 H new ATOM 0 HH TYR A 21 -6.162 -15.764 0.176 1.00 23.35 H new ATOM 341 N PRO A 22 -10.962 -9.153 -2.375 1.00 31.42 N ATOM 342 CA PRO A 22 -12.210 -8.435 -2.704 1.00 62.24 C ATOM 343 C PRO A 22 -13.089 -8.209 -1.469 1.00 13.11 C ATOM 344 O PRO A 22 -13.788 -7.201 -1.365 1.00 41.40 O ATOM 345 CB PRO A 22 -12.912 -9.366 -3.707 1.00 5.11 C ATOM 346 CG PRO A 22 -11.818 -10.200 -4.285 1.00 71.24 C ATOM 347 CD PRO A 22 -10.815 -10.385 -3.177 1.00 43.31 C ATOM 0 HA PRO A 22 -12.015 -7.439 -3.101 1.00 62.24 H new ATOM 0 HB2 PRO A 22 -13.662 -9.984 -3.214 1.00 5.11 H new ATOM 0 HB3 PRO A 22 -13.427 -8.797 -4.481 1.00 5.11 H new ATOM 0 HG2 PRO A 22 -12.200 -11.160 -4.631 1.00 71.24 H new ATOM 0 HG3 PRO A 22 -11.364 -9.708 -5.145 1.00 71.24 H new ATOM 0 HD2 PRO A 22 -11.027 -11.277 -2.587 1.00 43.31 H new ATOM 0 HD3 PRO A 22 -9.802 -10.494 -3.565 1.00 43.31 H new ATOM 355 N ASP A 23 -13.035 -9.165 -0.539 1.00 43.33 N ATOM 356 CA ASP A 23 -13.722 -9.064 0.756 1.00 12.51 C ATOM 357 C ASP A 23 -13.483 -7.687 1.400 1.00 3.23 C ATOM 358 O ASP A 23 -14.408 -7.029 1.881 1.00 54.21 O ATOM 359 CB ASP A 23 -13.194 -10.153 1.705 1.00 33.12 C ATOM 360 CG ASP A 23 -13.236 -11.550 1.105 1.00 42.33 C ATOM 361 OD1 ASP A 23 -12.534 -11.793 0.098 1.00 42.14 O ATOM 362 OD2 ASP A 23 -13.957 -12.415 1.650 1.00 31.52 O ATOM 0 H ASP A 23 -12.514 -10.033 -0.660 1.00 43.33 H new ATOM 0 HA ASP A 23 -14.791 -9.195 0.585 1.00 12.51 H new ATOM 0 HB2 ASP A 23 -12.167 -9.916 1.983 1.00 33.12 H new ATOM 0 HB3 ASP A 23 -13.783 -10.142 2.622 1.00 33.12 H new ATOM 367 N GLU A 24 -12.224 -7.266 1.384 1.00 74.54 N ATOM 368 CA GLU A 24 -11.791 -6.029 2.033 1.00 55.30 C ATOM 369 C GLU A 24 -11.946 -4.817 1.097 1.00 70.10 C ATOM 370 O GLU A 24 -12.414 -3.755 1.508 1.00 62.34 O ATOM 371 CB GLU A 24 -10.327 -6.191 2.467 1.00 64.21 C ATOM 372 CG GLU A 24 -10.088 -7.450 3.298 1.00 34.33 C ATOM 373 CD GLU A 24 -8.615 -7.784 3.472 1.00 14.53 C ATOM 374 OE1 GLU A 24 -8.048 -8.465 2.587 1.00 42.03 O ATOM 375 OE2 GLU A 24 -8.031 -7.397 4.505 1.00 23.33 O ATOM 0 H GLU A 24 -11.470 -7.773 0.920 1.00 74.54 H new ATOM 0 HA GLU A 24 -12.421 -5.844 2.903 1.00 55.30 H new ATOM 0 HB2 GLU A 24 -9.692 -6.221 1.581 1.00 64.21 H new ATOM 0 HB3 GLU A 24 -10.026 -5.318 3.046 1.00 64.21 H new ATOM 0 HG2 GLU A 24 -10.543 -7.321 4.280 1.00 34.33 H new ATOM 0 HG3 GLU A 24 -10.591 -8.292 2.822 1.00 34.33 H new ATOM 382 N ILE A 25 -11.567 -4.991 -0.168 1.00 24.02 N ATOM 383 CA ILE A 25 -11.633 -3.907 -1.158 1.00 64.40 C ATOM 384 C ILE A 25 -13.079 -3.443 -1.415 1.00 52.11 C ATOM 385 O ILE A 25 -13.345 -2.243 -1.529 1.00 43.25 O ATOM 386 CB ILE A 25 -10.969 -4.334 -2.492 1.00 53.11 C ATOM 387 CG1 ILE A 25 -9.496 -4.694 -2.245 1.00 61.44 C ATOM 388 CG2 ILE A 25 -11.089 -3.225 -3.542 1.00 34.02 C ATOM 389 CD1 ILE A 25 -8.755 -5.137 -3.486 1.00 71.15 C ATOM 0 H ILE A 25 -11.210 -5.873 -0.536 1.00 24.02 H new ATOM 0 HA ILE A 25 -11.082 -3.065 -0.739 1.00 64.40 H new ATOM 0 HB ILE A 25 -11.488 -5.212 -2.877 1.00 53.11 H new ATOM 0 HG12 ILE A 25 -8.987 -3.829 -1.820 1.00 61.44 H new ATOM 0 HG13 ILE A 25 -9.447 -5.489 -1.501 1.00 61.44 H new ATOM 0 HG21 ILE A 25 -10.616 -3.549 -4.469 1.00 34.02 H new ATOM 0 HG22 ILE A 25 -12.142 -3.012 -3.727 1.00 34.02 H new ATOM 0 HG23 ILE A 25 -10.595 -2.324 -3.178 1.00 34.02 H new ATOM 0 HD11 ILE A 25 -7.723 -5.373 -3.228 1.00 71.15 H new ATOM 0 HD12 ILE A 25 -9.237 -6.022 -3.901 1.00 71.15 H new ATOM 0 HD13 ILE A 25 -8.770 -4.336 -4.225 1.00 71.15 H new ATOM 401 N GLU A 26 -14.015 -4.386 -1.493 1.00 52.32 N ATOM 402 CA GLU A 26 -15.433 -4.046 -1.672 1.00 55.11 C ATOM 403 C GLU A 26 -15.977 -3.303 -0.438 1.00 1.50 C ATOM 404 O GLU A 26 -16.959 -2.563 -0.524 1.00 64.32 O ATOM 405 CB GLU A 26 -16.254 -5.312 -1.969 1.00 74.32 C ATOM 406 CG GLU A 26 -17.723 -5.046 -2.295 1.00 30.32 C ATOM 407 CD GLU A 26 -18.415 -6.256 -2.907 1.00 20.25 C ATOM 408 OE1 GLU A 26 -18.858 -7.143 -2.147 1.00 21.32 O ATOM 409 OE2 GLU A 26 -18.509 -6.325 -4.153 1.00 65.21 O ATOM 0 H GLU A 26 -13.824 -5.386 -1.436 1.00 52.32 H new ATOM 0 HA GLU A 26 -15.524 -3.376 -2.527 1.00 55.11 H new ATOM 0 HB2 GLU A 26 -15.797 -5.839 -2.807 1.00 74.32 H new ATOM 0 HB3 GLU A 26 -16.200 -5.977 -1.107 1.00 74.32 H new ATOM 0 HG2 GLU A 26 -18.246 -4.755 -1.384 1.00 30.32 H new ATOM 0 HG3 GLU A 26 -17.792 -4.205 -2.985 1.00 30.32 H new ATOM 416 N ALA A 27 -15.323 -3.494 0.706 1.00 70.14 N ATOM 417 CA ALA A 27 -15.633 -2.724 1.916 1.00 65.33 C ATOM 418 C ALA A 27 -14.899 -1.369 1.917 1.00 73.33 C ATOM 419 O ALA A 27 -15.381 -0.387 2.484 1.00 52.40 O ATOM 420 CB ALA A 27 -15.270 -3.530 3.157 1.00 42.44 C ATOM 0 H ALA A 27 -14.573 -4.176 0.824 1.00 70.14 H new ATOM 0 HA ALA A 27 -16.704 -2.522 1.927 1.00 65.33 H new ATOM 0 HB1 ALA A 27 -15.504 -2.949 4.049 1.00 42.44 H new ATOM 0 HB2 ALA A 27 -15.841 -4.458 3.168 1.00 42.44 H new ATOM 0 HB3 ALA A 27 -14.205 -3.760 3.143 1.00 42.44 H new ATOM 426 N LEU A 28 -13.737 -1.321 1.262 1.00 13.44 N ATOM 427 CA LEU A 28 -12.950 -0.086 1.139 1.00 22.30 C ATOM 428 C LEU A 28 -13.753 1.015 0.425 1.00 3.14 C ATOM 429 O LEU A 28 -13.704 2.188 0.804 1.00 65.42 O ATOM 430 CB LEU A 28 -11.645 -0.370 0.379 1.00 12.13 C ATOM 431 CG LEU A 28 -10.673 0.817 0.260 1.00 45.55 C ATOM 432 CD1 LEU A 28 -10.187 1.263 1.637 1.00 2.44 C ATOM 433 CD2 LEU A 28 -9.494 0.458 -0.642 1.00 2.12 C ATOM 0 H LEU A 28 -13.315 -2.129 0.804 1.00 13.44 H new ATOM 0 HA LEU A 28 -12.711 0.269 2.142 1.00 22.30 H new ATOM 0 HB2 LEU A 28 -11.128 -1.191 0.875 1.00 12.13 H new ATOM 0 HB3 LEU A 28 -11.897 -0.712 -0.625 1.00 12.13 H new ATOM 0 HG LEU A 28 -11.208 1.651 -0.194 1.00 45.55 H new ATOM 0 HD11 LEU A 28 -9.501 2.103 1.526 1.00 2.44 H new ATOM 0 HD12 LEU A 28 -11.040 1.568 2.243 1.00 2.44 H new ATOM 0 HD13 LEU A 28 -9.672 0.436 2.126 1.00 2.44 H new ATOM 0 HD21 LEU A 28 -8.818 1.310 -0.714 1.00 2.12 H new ATOM 0 HD22 LEU A 28 -8.960 -0.394 -0.221 1.00 2.12 H new ATOM 0 HD23 LEU A 28 -9.861 0.202 -1.636 1.00 2.12 H new ATOM 445 N LYS A 29 -14.518 0.626 -0.594 1.00 63.01 N ATOM 446 CA LYS A 29 -15.380 1.569 -1.322 1.00 14.33 C ATOM 447 C LYS A 29 -16.658 1.901 -0.524 1.00 32.41 C ATOM 448 O LYS A 29 -17.628 2.433 -1.069 1.00 44.43 O ATOM 449 CB LYS A 29 -15.746 0.999 -2.701 1.00 43.41 C ATOM 450 CG LYS A 29 -16.529 -0.310 -2.649 1.00 55.22 C ATOM 451 CD LYS A 29 -16.872 -0.825 -4.046 1.00 64.21 C ATOM 452 CE LYS A 29 -15.621 -1.161 -4.850 1.00 41.12 C ATOM 453 NZ LYS A 29 -15.951 -1.611 -6.227 1.00 54.14 N ATOM 0 H LYS A 29 -14.562 -0.333 -0.937 1.00 63.01 H new ATOM 0 HA LYS A 29 -14.822 2.496 -1.455 1.00 14.33 H new ATOM 0 HB2 LYS A 29 -16.334 1.740 -3.243 1.00 43.41 H new ATOM 0 HB3 LYS A 29 -14.830 0.839 -3.270 1.00 43.41 H new ATOM 0 HG2 LYS A 29 -15.945 -1.062 -2.118 1.00 55.22 H new ATOM 0 HG3 LYS A 29 -17.448 -0.161 -2.081 1.00 55.22 H new ATOM 0 HD2 LYS A 29 -17.499 -1.713 -3.962 1.00 64.21 H new ATOM 0 HD3 LYS A 29 -17.454 -0.072 -4.578 1.00 64.21 H new ATOM 0 HE2 LYS A 29 -14.975 -0.284 -4.900 1.00 41.12 H new ATOM 0 HE3 LYS A 29 -15.059 -1.942 -4.338 1.00 41.12 H new ATOM 0 HZ1 LYS A 29 -15.073 -1.830 -6.740 1.00 54.14 H new ATOM 0 HZ2 LYS A 29 -16.546 -2.463 -6.181 1.00 54.14 H new ATOM 0 HZ3 LYS A 29 -16.465 -0.856 -6.725 1.00 54.14 H new ATOM 467 N SER A 30 -16.653 1.571 0.768 1.00 2.40 N ATOM 468 CA SER A 30 -17.762 1.900 1.680 1.00 3.31 C ATOM 469 C SER A 30 -17.268 2.756 2.858 1.00 44.32 C ATOM 470 O SER A 30 -17.964 2.908 3.865 1.00 61.23 O ATOM 471 CB SER A 30 -18.410 0.612 2.214 1.00 74.42 C ATOM 472 OG SER A 30 -19.483 0.896 3.102 1.00 4.43 O ATOM 0 H SER A 30 -15.886 1.070 1.216 1.00 2.40 H new ATOM 0 HA SER A 30 -18.502 2.472 1.120 1.00 3.31 H new ATOM 0 HB2 SER A 30 -18.776 0.015 1.379 1.00 74.42 H new ATOM 0 HB3 SER A 30 -17.659 0.013 2.729 1.00 74.42 H new ATOM 0 HG SER A 30 -19.272 1.698 3.624 1.00 4.43 H new ATOM 478 N ARG A 31 -16.076 3.332 2.714 1.00 42.35 N ATOM 479 CA ARG A 31 -15.439 4.095 3.799 1.00 73.02 C ATOM 480 C ARG A 31 -14.582 5.257 3.263 1.00 33.20 C ATOM 481 O ARG A 31 -14.410 6.274 3.940 1.00 10.02 O ATOM 482 CB ARG A 31 -14.587 3.150 4.657 1.00 22.30 C ATOM 483 CG ARG A 31 -13.514 2.406 3.867 1.00 70.40 C ATOM 484 CD ARG A 31 -12.900 1.265 4.669 1.00 23.44 C ATOM 485 NE ARG A 31 -12.235 1.731 5.879 1.00 53.44 N ATOM 486 CZ ARG A 31 -12.133 1.032 6.971 1.00 2.34 C ATOM 487 NH1 ARG A 31 -12.654 -0.145 7.057 1.00 25.31 N ATOM 488 NH2 ARG A 31 -11.501 1.507 7.988 1.00 30.33 N ATOM 0 H ARG A 31 -15.526 3.288 1.856 1.00 42.35 H new ATOM 0 HA ARG A 31 -16.227 4.536 4.410 1.00 73.02 H new ATOM 0 HB2 ARG A 31 -14.109 3.725 5.450 1.00 22.30 H new ATOM 0 HB3 ARG A 31 -15.240 2.423 5.140 1.00 22.30 H new ATOM 0 HG2 ARG A 31 -13.949 2.010 2.949 1.00 70.40 H new ATOM 0 HG3 ARG A 31 -12.731 3.105 3.573 1.00 70.40 H new ATOM 0 HD2 ARG A 31 -13.680 0.553 4.938 1.00 23.44 H new ATOM 0 HD3 ARG A 31 -12.182 0.732 4.046 1.00 23.44 H new ATOM 0 HE ARG A 31 -11.824 2.664 5.869 1.00 53.44 H new ATOM 0 HH11 ARG A 31 -13.155 -0.540 6.261 1.00 25.31 H new ATOM 0 HH12 ARG A 31 -12.565 -0.680 7.921 1.00 25.31 H new ATOM 0 HH21 ARG A 31 -11.079 2.434 7.938 1.00 30.33 H new ATOM 0 HH22 ARG A 31 -11.423 0.956 8.843 1.00 30.33 H new ATOM 502 N VAL A 32 -14.041 5.105 2.052 1.00 40.50 N ATOM 503 CA VAL A 32 -13.243 6.168 1.425 1.00 44.31 C ATOM 504 C VAL A 32 -14.103 7.405 1.093 1.00 31.33 C ATOM 505 O VAL A 32 -15.266 7.279 0.701 1.00 22.51 O ATOM 506 CB VAL A 32 -12.540 5.669 0.135 1.00 25.44 C ATOM 507 CG1 VAL A 32 -11.538 4.561 0.462 1.00 33.32 C ATOM 508 CG2 VAL A 32 -13.561 5.193 -0.900 1.00 21.22 C ATOM 0 H VAL A 32 -14.139 4.262 1.486 1.00 40.50 H new ATOM 0 HA VAL A 32 -12.483 6.453 2.153 1.00 44.31 H new ATOM 0 HB VAL A 32 -11.994 6.507 -0.298 1.00 25.44 H new ATOM 0 HG11 VAL A 32 -11.055 4.224 -0.456 1.00 33.32 H new ATOM 0 HG12 VAL A 32 -10.784 4.944 1.149 1.00 33.32 H new ATOM 0 HG13 VAL A 32 -12.060 3.724 0.926 1.00 33.32 H new ATOM 0 HG21 VAL A 32 -13.040 4.849 -1.794 1.00 21.22 H new ATOM 0 HG22 VAL A 32 -14.147 4.374 -0.483 1.00 21.22 H new ATOM 0 HG23 VAL A 32 -14.225 6.017 -1.162 1.00 21.22 H new ATOM 518 N PRO A 33 -13.547 8.622 1.257 1.00 34.42 N ATOM 519 CA PRO A 33 -14.275 9.868 0.973 1.00 52.41 C ATOM 520 C PRO A 33 -14.304 10.218 -0.525 1.00 74.02 C ATOM 521 O PRO A 33 -13.335 9.987 -1.251 1.00 13.03 O ATOM 522 CB PRO A 33 -13.472 10.908 1.757 1.00 63.44 C ATOM 523 CG PRO A 33 -12.070 10.394 1.733 1.00 54.54 C ATOM 524 CD PRO A 33 -12.173 8.885 1.735 1.00 71.12 C ATOM 0 HA PRO A 33 -15.326 9.805 1.255 1.00 52.41 H new ATOM 0 HB2 PRO A 33 -13.541 11.893 1.296 1.00 63.44 H new ATOM 0 HB3 PRO A 33 -13.841 11.007 2.778 1.00 63.44 H new ATOM 0 HG2 PRO A 33 -11.541 10.747 0.847 1.00 54.54 H new ATOM 0 HG3 PRO A 33 -11.511 10.747 2.600 1.00 54.54 H new ATOM 0 HD2 PRO A 33 -11.429 8.433 1.080 1.00 71.12 H new ATOM 0 HD3 PRO A 33 -12.011 8.475 2.732 1.00 71.12 H new ATOM 532 N ALA A 34 -15.411 10.806 -0.975 1.00 0.22 N ATOM 533 CA ALA A 34 -15.579 11.195 -2.383 1.00 72.42 C ATOM 534 C ALA A 34 -14.587 12.292 -2.827 1.00 34.33 C ATOM 535 O ALA A 34 -14.589 12.707 -3.989 1.00 31.11 O ATOM 536 CB ALA A 34 -17.013 11.654 -2.618 1.00 60.20 C ATOM 0 H ALA A 34 -16.213 11.027 -0.384 1.00 0.22 H new ATOM 0 HA ALA A 34 -15.362 10.316 -2.990 1.00 72.42 H new ATOM 0 HB1 ALA A 34 -17.136 11.942 -3.662 1.00 60.20 H new ATOM 0 HB2 ALA A 34 -17.699 10.840 -2.383 1.00 60.20 H new ATOM 0 HB3 ALA A 34 -17.231 12.509 -1.978 1.00 60.20 H new ATOM 542 N ASN A 35 -13.747 12.758 -1.902 1.00 75.40 N ATOM 543 CA ASN A 35 -12.749 13.795 -2.199 1.00 22.25 C ATOM 544 C ASN A 35 -11.369 13.197 -2.539 1.00 20.25 C ATOM 545 O ASN A 35 -10.504 13.892 -3.071 1.00 12.05 O ATOM 546 CB ASN A 35 -12.612 14.749 -1.008 1.00 21.12 C ATOM 547 CG ASN A 35 -13.909 15.472 -0.691 1.00 4.34 C ATOM 548 OD1 ASN A 35 -14.720 15.736 -1.569 1.00 53.41 O ATOM 549 ND2 ASN A 35 -14.110 15.804 0.567 1.00 62.22 N ATOM 0 H ASN A 35 -13.736 12.434 -0.935 1.00 75.40 H new ATOM 0 HA ASN A 35 -13.102 14.339 -3.075 1.00 22.25 H new ATOM 0 HB2 ASN A 35 -12.289 14.187 -0.132 1.00 21.12 H new ATOM 0 HB3 ASN A 35 -11.834 15.482 -1.221 1.00 21.12 H new ATOM 0 HD21 ASN A 35 -14.962 16.296 0.835 1.00 62.22 H new ATOM 0 HD22 ASN A 35 -13.414 15.569 1.274 1.00 62.22 H new ATOM 556 N THR A 36 -11.167 11.913 -2.244 1.00 21.11 N ATOM 557 CA THR A 36 -9.851 11.272 -2.426 1.00 35.20 C ATOM 558 C THR A 36 -9.963 9.918 -3.145 1.00 41.10 C ATOM 559 O THR A 36 -10.835 9.110 -2.829 1.00 13.23 O ATOM 560 CB THR A 36 -9.141 11.059 -1.062 1.00 21.31 C ATOM 561 OG1 THR A 36 -9.022 12.308 -0.368 1.00 42.15 O ATOM 562 CG2 THR A 36 -7.753 10.452 -1.242 1.00 55.05 C ATOM 0 H THR A 36 -11.890 11.293 -1.879 1.00 21.11 H new ATOM 0 HA THR A 36 -9.262 11.949 -3.046 1.00 35.20 H new ATOM 0 HB THR A 36 -9.749 10.366 -0.480 1.00 21.31 H new ATOM 0 HG1 THR A 36 -8.575 12.163 0.492 1.00 42.15 H new ATOM 0 HG21 THR A 36 -7.286 10.317 -0.267 1.00 55.05 H new ATOM 0 HG22 THR A 36 -7.840 9.486 -1.739 1.00 55.05 H new ATOM 0 HG23 THR A 36 -7.140 11.119 -1.849 1.00 55.05 H new ATOM 570 N SER A 37 -9.072 9.670 -4.107 1.00 30.50 N ATOM 571 CA SER A 37 -9.057 8.398 -4.853 1.00 45.24 C ATOM 572 C SER A 37 -8.567 7.238 -3.972 1.00 30.44 C ATOM 573 O SER A 37 -7.925 7.452 -2.945 1.00 65.44 O ATOM 574 CB SER A 37 -8.156 8.504 -6.093 1.00 22.31 C ATOM 575 OG SER A 37 -6.785 8.610 -5.732 1.00 15.41 O ATOM 0 H SER A 37 -8.349 10.330 -4.392 1.00 30.50 H new ATOM 0 HA SER A 37 -10.082 8.196 -5.164 1.00 45.24 H new ATOM 0 HB2 SER A 37 -8.300 7.628 -6.725 1.00 22.31 H new ATOM 0 HB3 SER A 37 -8.447 9.374 -6.682 1.00 22.31 H new ATOM 0 HG SER A 37 -6.237 8.674 -6.542 1.00 15.41 H new ATOM 581 N MET A 38 -8.870 6.007 -4.385 1.00 12.23 N ATOM 582 CA MET A 38 -8.439 4.816 -3.640 1.00 32.02 C ATOM 583 C MET A 38 -6.905 4.764 -3.505 1.00 32.34 C ATOM 584 O MET A 38 -6.371 4.556 -2.414 1.00 11.31 O ATOM 585 CB MET A 38 -8.951 3.548 -4.339 1.00 51.13 C ATOM 586 CG MET A 38 -10.471 3.442 -4.399 1.00 63.32 C ATOM 587 SD MET A 38 -11.033 2.001 -5.337 1.00 4.21 S ATOM 588 CE MET A 38 -10.289 0.663 -4.401 1.00 64.14 C ATOM 0 H MET A 38 -9.409 5.805 -5.227 1.00 12.23 H new ATOM 0 HA MET A 38 -8.862 4.872 -2.637 1.00 32.02 H new ATOM 0 HB2 MET A 38 -8.555 3.520 -5.354 1.00 51.13 H new ATOM 0 HB3 MET A 38 -8.557 2.675 -3.819 1.00 51.13 H new ATOM 0 HG2 MET A 38 -10.868 3.388 -3.385 1.00 63.32 H new ATOM 0 HG3 MET A 38 -10.877 4.346 -4.852 1.00 63.32 H new ATOM 0 HE1 MET A 38 -9.489 0.210 -4.987 1.00 64.14 H new ATOM 0 HE2 MET A 38 -9.880 1.054 -3.469 1.00 64.14 H new ATOM 0 HE3 MET A 38 -11.045 -0.089 -4.178 1.00 64.14 H new ATOM 598 N SER A 39 -6.208 4.974 -4.624 1.00 41.21 N ATOM 599 CA SER A 39 -4.734 4.948 -4.654 1.00 13.24 C ATOM 600 C SER A 39 -4.119 6.014 -3.734 1.00 30.14 C ATOM 601 O SER A 39 -3.091 5.777 -3.094 1.00 20.43 O ATOM 602 CB SER A 39 -4.224 5.156 -6.090 1.00 12.23 C ATOM 603 OG SER A 39 -4.635 4.100 -6.946 1.00 14.14 O ATOM 0 H SER A 39 -6.639 5.165 -5.529 1.00 41.21 H new ATOM 0 HA SER A 39 -4.424 3.968 -4.290 1.00 13.24 H new ATOM 0 HB2 SER A 39 -4.597 6.105 -6.476 1.00 12.23 H new ATOM 0 HB3 SER A 39 -3.136 5.219 -6.085 1.00 12.23 H new ATOM 0 HG SER A 39 -3.967 3.383 -6.925 1.00 14.14 H new ATOM 609 N ALA A 40 -4.744 7.187 -3.679 1.00 63.34 N ATOM 610 CA ALA A 40 -4.266 8.281 -2.824 1.00 73.01 C ATOM 611 C ALA A 40 -4.596 8.030 -1.343 1.00 42.32 C ATOM 612 O ALA A 40 -3.778 8.289 -0.458 1.00 21.21 O ATOM 613 CB ALA A 40 -4.863 9.605 -3.289 1.00 30.30 C ATOM 0 H ALA A 40 -5.583 7.409 -4.215 1.00 63.34 H new ATOM 0 HA ALA A 40 -3.181 8.328 -2.912 1.00 73.01 H new ATOM 0 HB1 ALA A 40 -4.503 10.411 -2.649 1.00 30.30 H new ATOM 0 HB2 ALA A 40 -4.563 9.798 -4.319 1.00 30.30 H new ATOM 0 HB3 ALA A 40 -5.950 9.554 -3.231 1.00 30.30 H new ATOM 619 N TYR A 41 -5.796 7.511 -1.082 1.00 20.23 N ATOM 620 CA TYR A 41 -6.252 7.247 0.290 1.00 60.35 C ATOM 621 C TYR A 41 -5.353 6.217 0.999 1.00 20.21 C ATOM 622 O TYR A 41 -4.901 6.443 2.124 1.00 44.55 O ATOM 623 CB TYR A 41 -7.708 6.754 0.280 1.00 71.13 C ATOM 624 CG TYR A 41 -8.309 6.600 1.666 1.00 22.12 C ATOM 625 CD1 TYR A 41 -8.791 7.706 2.360 1.00 54.13 C ATOM 626 CD2 TYR A 41 -8.395 5.353 2.284 1.00 51.43 C ATOM 627 CE1 TYR A 41 -9.336 7.575 3.620 1.00 2.33 C ATOM 628 CE2 TYR A 41 -8.940 5.218 3.547 1.00 53.15 C ATOM 629 CZ TYR A 41 -9.409 6.332 4.210 1.00 24.14 C ATOM 630 OH TYR A 41 -9.955 6.206 5.466 1.00 44.13 O ATOM 0 H TYR A 41 -6.474 7.263 -1.802 1.00 20.23 H new ATOM 0 HA TYR A 41 -6.191 8.183 0.845 1.00 60.35 H new ATOM 0 HB2 TYR A 41 -8.315 7.454 -0.294 1.00 71.13 H new ATOM 0 HB3 TYR A 41 -7.754 5.795 -0.235 1.00 71.13 H new ATOM 0 HD1 TYR A 41 -8.737 8.684 1.904 1.00 54.13 H new ATOM 0 HD2 TYR A 41 -8.030 4.478 1.767 1.00 51.43 H new ATOM 0 HE1 TYR A 41 -9.705 8.445 4.143 1.00 2.33 H new ATOM 0 HE2 TYR A 41 -8.998 4.245 4.012 1.00 53.15 H new ATOM 0 HH TYR A 41 -9.933 5.265 5.739 1.00 44.13 H new ATOM 640 N ILE A 42 -5.093 5.090 0.334 1.00 74.32 N ATOM 641 CA ILE A 42 -4.232 4.040 0.895 1.00 64.25 C ATOM 642 C ILE A 42 -2.792 4.551 1.103 1.00 55.43 C ATOM 643 O ILE A 42 -2.077 4.088 1.995 1.00 21.00 O ATOM 644 CB ILE A 42 -4.215 2.781 -0.017 1.00 13.11 C ATOM 645 CG1 ILE A 42 -5.647 2.255 -0.242 1.00 4.33 C ATOM 646 CG2 ILE A 42 -3.331 1.683 0.580 1.00 75.11 C ATOM 647 CD1 ILE A 42 -6.356 1.832 1.029 1.00 64.21 C ATOM 0 H ILE A 42 -5.464 4.878 -0.592 1.00 74.32 H new ATOM 0 HA ILE A 42 -4.649 3.765 1.864 1.00 64.25 H new ATOM 0 HB ILE A 42 -3.795 3.069 -0.981 1.00 13.11 H new ATOM 0 HG12 ILE A 42 -6.235 3.031 -0.733 1.00 4.33 H new ATOM 0 HG13 ILE A 42 -5.608 1.405 -0.924 1.00 4.33 H new ATOM 0 HG21 ILE A 42 -3.337 0.814 -0.078 1.00 75.11 H new ATOM 0 HG22 ILE A 42 -2.311 2.053 0.683 1.00 75.11 H new ATOM 0 HG23 ILE A 42 -3.715 1.399 1.560 1.00 75.11 H new ATOM 0 HD11 ILE A 42 -7.357 1.475 0.786 1.00 64.21 H new ATOM 0 HD12 ILE A 42 -5.793 1.033 1.511 1.00 64.21 H new ATOM 0 HD13 ILE A 42 -6.429 2.684 1.705 1.00 64.21 H new ATOM 659 N ARG A 43 -2.386 5.528 0.291 1.00 61.44 N ATOM 660 CA ARG A 43 -1.041 6.108 0.382 1.00 24.14 C ATOM 661 C ARG A 43 -0.773 6.715 1.771 1.00 53.33 C ATOM 662 O ARG A 43 0.298 6.516 2.343 1.00 23.35 O ATOM 663 CB ARG A 43 -0.837 7.171 -0.710 1.00 41.05 C ATOM 664 CG ARG A 43 0.558 7.792 -0.704 1.00 55.50 C ATOM 665 CD ARG A 43 0.795 8.713 -1.898 1.00 73.22 C ATOM 666 NE ARG A 43 -0.028 9.923 -1.863 1.00 14.45 N ATOM 667 CZ ARG A 43 0.334 11.068 -2.387 1.00 63.30 C ATOM 668 NH1 ARG A 43 1.475 11.182 -2.996 1.00 23.01 N ATOM 669 NH2 ARG A 43 -0.454 12.085 -2.318 1.00 1.41 N ATOM 0 H ARG A 43 -2.969 5.937 -0.439 1.00 61.44 H new ATOM 0 HA ARG A 43 -0.327 5.299 0.230 1.00 24.14 H new ATOM 0 HB2 ARG A 43 -1.020 6.719 -1.685 1.00 41.05 H new ATOM 0 HB3 ARG A 43 -1.578 7.960 -0.580 1.00 41.05 H new ATOM 0 HG2 ARG A 43 0.697 8.356 0.218 1.00 55.50 H new ATOM 0 HG3 ARG A 43 1.305 6.998 -0.708 1.00 55.50 H new ATOM 0 HD2 ARG A 43 1.847 8.997 -1.927 1.00 73.22 H new ATOM 0 HD3 ARG A 43 0.587 8.166 -2.818 1.00 73.22 H new ATOM 0 HE ARG A 43 -0.937 9.872 -1.403 1.00 14.45 H new ATOM 0 HH11 ARG A 43 2.097 10.377 -3.069 1.00 23.01 H new ATOM 0 HH12 ARG A 43 1.750 12.077 -3.401 1.00 23.01 H new ATOM 0 HH21 ARG A 43 -1.359 11.998 -1.856 1.00 1.41 H new ATOM 0 HH22 ARG A 43 -0.173 12.977 -2.726 1.00 1.41 H new ATOM 683 N ARG A 44 -1.746 7.445 2.321 1.00 42.11 N ATOM 684 CA ARG A 44 -1.578 8.050 3.652 1.00 42.43 C ATOM 685 C ARG A 44 -1.500 6.960 4.737 1.00 73.52 C ATOM 686 O ARG A 44 -0.778 7.100 5.726 1.00 43.13 O ATOM 687 CB ARG A 44 -2.721 9.036 3.968 1.00 62.22 C ATOM 688 CG ARG A 44 -4.024 8.381 4.435 1.00 10.13 C ATOM 689 CD ARG A 44 -5.088 9.419 4.790 1.00 22.43 C ATOM 690 NE ARG A 44 -6.220 8.831 5.509 1.00 42.10 N ATOM 691 CZ ARG A 44 -7.348 9.454 5.736 1.00 41.40 C ATOM 692 NH1 ARG A 44 -7.562 10.637 5.247 1.00 21.23 N ATOM 693 NH2 ARG A 44 -8.276 8.887 6.441 1.00 0.23 N ATOM 0 H ARG A 44 -2.645 7.632 1.878 1.00 42.11 H new ATOM 0 HA ARG A 44 -0.642 8.608 3.646 1.00 42.43 H new ATOM 0 HB2 ARG A 44 -2.382 9.728 4.739 1.00 62.22 H new ATOM 0 HB3 ARG A 44 -2.928 9.628 3.077 1.00 62.22 H new ATOM 0 HG2 ARG A 44 -4.403 7.726 3.650 1.00 10.13 H new ATOM 0 HG3 ARG A 44 -3.824 7.754 5.304 1.00 10.13 H new ATOM 0 HD2 ARG A 44 -4.639 10.202 5.402 1.00 22.43 H new ATOM 0 HD3 ARG A 44 -5.447 9.894 3.877 1.00 22.43 H new ATOM 0 HE ARG A 44 -6.123 7.876 5.854 1.00 42.10 H new ATOM 0 HH11 ARG A 44 -6.847 11.091 4.679 1.00 21.23 H new ATOM 0 HH12 ARG A 44 -8.445 11.113 5.431 1.00 21.23 H new ATOM 0 HH21 ARG A 44 -8.128 7.952 6.821 1.00 0.23 H new ATOM 0 HH22 ARG A 44 -9.154 9.376 6.616 1.00 0.23 H new ATOM 707 N ILE A 45 -2.239 5.867 4.529 1.00 0.33 N ATOM 708 CA ILE A 45 -2.256 4.742 5.469 1.00 73.40 C ATOM 709 C ILE A 45 -0.870 4.090 5.581 1.00 34.11 C ATOM 710 O ILE A 45 -0.328 3.940 6.678 1.00 34.41 O ATOM 711 CB ILE A 45 -3.296 3.670 5.045 1.00 51.32 C ATOM 712 CG1 ILE A 45 -4.705 4.286 4.992 1.00 35.13 C ATOM 713 CG2 ILE A 45 -3.263 2.471 5.996 1.00 21.35 C ATOM 714 CD1 ILE A 45 -5.788 3.315 4.565 1.00 3.23 C ATOM 0 H ILE A 45 -2.837 5.737 3.713 1.00 0.33 H new ATOM 0 HA ILE A 45 -2.538 5.144 6.442 1.00 73.40 H new ATOM 0 HB ILE A 45 -3.036 3.314 4.048 1.00 51.32 H new ATOM 0 HG12 ILE A 45 -4.954 4.682 5.976 1.00 35.13 H new ATOM 0 HG13 ILE A 45 -4.696 5.130 4.302 1.00 35.13 H new ATOM 0 HG21 ILE A 45 -4.000 1.734 5.678 1.00 21.35 H new ATOM 0 HG22 ILE A 45 -2.270 2.021 5.980 1.00 21.35 H new ATOM 0 HG23 ILE A 45 -3.495 2.803 7.008 1.00 21.35 H new ATOM 0 HD11 ILE A 45 -6.751 3.826 4.553 1.00 3.23 H new ATOM 0 HD12 ILE A 45 -5.565 2.937 3.567 1.00 3.23 H new ATOM 0 HD13 ILE A 45 -5.828 2.483 5.268 1.00 3.23 H new ATOM 726 N ILE A 46 -0.298 3.707 4.441 1.00 14.32 N ATOM 727 CA ILE A 46 1.039 3.109 4.428 1.00 22.14 C ATOM 728 C ILE A 46 2.109 4.125 4.863 1.00 40.10 C ATOM 729 O ILE A 46 3.034 3.780 5.597 1.00 41.44 O ATOM 730 CB ILE A 46 1.412 2.524 3.038 1.00 30.31 C ATOM 731 CG1 ILE A 46 1.465 3.628 1.968 1.00 43.21 C ATOM 732 CG2 ILE A 46 0.419 1.432 2.639 1.00 63.43 C ATOM 733 CD1 ILE A 46 1.942 3.147 0.612 1.00 70.25 C ATOM 0 H ILE A 46 -0.732 3.798 3.523 1.00 14.32 H new ATOM 0 HA ILE A 46 1.012 2.287 5.144 1.00 22.14 H new ATOM 0 HB ILE A 46 2.406 2.082 3.110 1.00 30.31 H new ATOM 0 HG12 ILE A 46 0.471 4.063 1.859 1.00 43.21 H new ATOM 0 HG13 ILE A 46 2.125 4.424 2.313 1.00 43.21 H new ATOM 0 HG21 ILE A 46 0.692 1.031 1.663 1.00 63.43 H new ATOM 0 HG22 ILE A 46 0.441 0.632 3.379 1.00 63.43 H new ATOM 0 HG23 ILE A 46 -0.585 1.853 2.590 1.00 63.43 H new ATOM 0 HD11 ILE A 46 1.952 3.983 -0.088 1.00 70.25 H new ATOM 0 HD12 ILE A 46 2.949 2.739 0.704 1.00 70.25 H new ATOM 0 HD13 ILE A 46 1.269 2.373 0.243 1.00 70.25 H new ATOM 745 N LEU A 47 1.959 5.382 4.429 1.00 21.31 N ATOM 746 CA LEU A 47 2.892 6.453 4.803 1.00 43.22 C ATOM 747 C LEU A 47 3.026 6.563 6.330 1.00 22.43 C ATOM 748 O LEU A 47 4.136 6.626 6.861 1.00 61.01 O ATOM 749 CB LEU A 47 2.432 7.794 4.210 1.00 12.14 C ATOM 750 CG LEU A 47 3.361 8.991 4.483 1.00 30.24 C ATOM 751 CD1 LEU A 47 4.749 8.751 3.892 1.00 13.32 C ATOM 752 CD2 LEU A 47 2.755 10.284 3.934 1.00 71.22 C ATOM 0 H LEU A 47 1.200 5.683 3.818 1.00 21.31 H new ATOM 0 HA LEU A 47 3.872 6.204 4.395 1.00 43.22 H new ATOM 0 HB2 LEU A 47 2.325 7.677 3.132 1.00 12.14 H new ATOM 0 HB3 LEU A 47 1.443 8.026 4.605 1.00 12.14 H new ATOM 0 HG LEU A 47 3.467 9.096 5.563 1.00 30.24 H new ATOM 0 HD11 LEU A 47 5.386 9.611 4.098 1.00 13.32 H new ATOM 0 HD12 LEU A 47 5.186 7.859 4.341 1.00 13.32 H new ATOM 0 HD13 LEU A 47 4.666 8.611 2.814 1.00 13.32 H new ATOM 0 HD21 LEU A 47 3.428 11.117 4.138 1.00 71.22 H new ATOM 0 HD22 LEU A 47 2.610 10.190 2.858 1.00 71.22 H new ATOM 0 HD23 LEU A 47 1.794 10.468 4.415 1.00 71.22 H new ATOM 764 N ASN A 48 1.889 6.557 7.036 1.00 22.11 N ATOM 765 CA ASN A 48 1.888 6.582 8.506 1.00 20.44 C ATOM 766 C ASN A 48 2.687 5.405 9.095 1.00 44.14 C ATOM 767 O ASN A 48 3.248 5.509 10.188 1.00 20.32 O ATOM 768 CB ASN A 48 0.452 6.559 9.046 1.00 11.43 C ATOM 769 CG ASN A 48 -0.290 7.865 8.811 1.00 10.42 C ATOM 770 OD1 ASN A 48 0.308 8.937 8.764 1.00 71.42 O ATOM 771 ND2 ASN A 48 -1.599 7.791 8.675 1.00 63.35 N ATOM 0 H ASN A 48 0.960 6.535 6.616 1.00 22.11 H new ATOM 0 HA ASN A 48 2.372 7.508 8.815 1.00 20.44 H new ATOM 0 HB2 ASN A 48 -0.096 5.745 8.571 1.00 11.43 H new ATOM 0 HB3 ASN A 48 0.475 6.347 10.115 1.00 11.43 H new ATOM 0 HD21 ASN A 48 -2.145 8.640 8.526 1.00 63.35 H new ATOM 0 HD22 ASN A 48 -2.066 6.885 8.719 1.00 63.35 H new ATOM 778 N HIS A 49 2.733 4.287 8.364 1.00 54.10 N ATOM 779 CA HIS A 49 3.490 3.108 8.800 1.00 65.31 C ATOM 780 C HIS A 49 4.932 3.134 8.248 1.00 54.54 C ATOM 781 O HIS A 49 5.788 2.374 8.699 1.00 71.01 O ATOM 782 CB HIS A 49 2.765 1.821 8.372 1.00 23.11 C ATOM 783 CG HIS A 49 3.226 0.586 9.099 1.00 20.13 C ATOM 784 ND1 HIS A 49 2.648 0.146 10.271 1.00 44.32 N ATOM 785 CD2 HIS A 49 4.200 -0.315 8.811 1.00 41.15 C ATOM 786 CE1 HIS A 49 3.239 -0.959 10.669 1.00 61.32 C ATOM 787 NE2 HIS A 49 4.186 -1.263 9.806 1.00 75.54 N ATOM 0 H HIS A 49 2.256 4.173 7.469 1.00 54.10 H new ATOM 0 HA HIS A 49 3.552 3.127 9.888 1.00 65.31 H new ATOM 0 HB2 HIS A 49 1.695 1.948 8.536 1.00 23.11 H new ATOM 0 HB3 HIS A 49 2.909 1.675 7.301 1.00 23.11 H new ATOM 0 HD2 HIS A 49 4.863 -0.291 7.958 1.00 41.15 H new ATOM 0 HE1 HIS A 49 2.989 -1.523 11.556 1.00 61.32 H new ATOM 0 HE2 HIS A 49 4.807 -2.070 9.866 1.00 75.54 H new ATOM 796 N LEU A 50 5.192 3.996 7.265 1.00 42.00 N ATOM 797 CA LEU A 50 6.557 4.206 6.753 1.00 34.23 C ATOM 798 C LEU A 50 7.350 5.125 7.690 1.00 72.53 C ATOM 799 O LEU A 50 8.428 4.754 8.165 1.00 40.24 O ATOM 800 CB LEU A 50 6.528 4.771 5.323 1.00 15.30 C ATOM 801 CG LEU A 50 6.698 3.731 4.201 1.00 42.23 C ATOM 802 CD1 LEU A 50 8.056 3.039 4.307 1.00 20.23 C ATOM 803 CD2 LEU A 50 5.567 2.704 4.221 1.00 11.11 C ATOM 0 H LEU A 50 4.480 4.562 6.804 1.00 42.00 H new ATOM 0 HA LEU A 50 7.060 3.239 6.719 1.00 34.23 H new ATOM 0 HB2 LEU A 50 5.581 5.290 5.174 1.00 15.30 H new ATOM 0 HB3 LEU A 50 7.318 5.516 5.228 1.00 15.30 H new ATOM 0 HG LEU A 50 6.653 4.259 3.248 1.00 42.23 H new ATOM 0 HD11 LEU A 50 8.155 2.308 3.505 1.00 20.23 H new ATOM 0 HD12 LEU A 50 8.850 3.781 4.222 1.00 20.23 H new ATOM 0 HD13 LEU A 50 8.133 2.534 5.270 1.00 20.23 H new ATOM 0 HD21 LEU A 50 5.716 1.983 3.417 1.00 11.11 H new ATOM 0 HD22 LEU A 50 5.565 2.184 5.179 1.00 11.11 H new ATOM 0 HD23 LEU A 50 4.612 3.211 4.082 1.00 11.11 H new ATOM 815 N GLU A 51 6.819 6.320 7.967 1.00 31.32 N ATOM 816 CA GLU A 51 7.355 7.163 9.045 1.00 44.14 C ATOM 817 C GLU A 51 6.997 6.534 10.404 1.00 33.03 C ATOM 818 O GLU A 51 6.239 7.090 11.200 1.00 25.11 O ATOM 819 CB GLU A 51 6.841 8.614 8.940 1.00 71.43 C ATOM 820 CG GLU A 51 5.335 8.736 8.709 1.00 61.04 C ATOM 821 CD GLU A 51 4.839 10.177 8.701 1.00 1.22 C ATOM 822 OE1 GLU A 51 5.568 11.069 8.209 1.00 2.03 O ATOM 823 OE2 GLU A 51 3.715 10.428 9.197 1.00 73.30 O ATOM 0 H GLU A 51 6.027 6.724 7.467 1.00 31.32 H new ATOM 0 HA GLU A 51 8.440 7.212 8.950 1.00 44.14 H new ATOM 0 HB2 GLU A 51 7.100 9.145 9.856 1.00 71.43 H new ATOM 0 HB3 GLU A 51 7.363 9.113 8.124 1.00 71.43 H new ATOM 0 HG2 GLU A 51 5.082 8.267 7.758 1.00 61.04 H new ATOM 0 HG3 GLU A 51 4.809 8.183 9.487 1.00 61.04 H new ATOM 830 N ASP A 52 7.578 5.356 10.635 1.00 14.40 N ATOM 831 CA ASP A 52 7.217 4.461 11.739 1.00 10.24 C ATOM 832 C ASP A 52 8.015 3.153 11.590 1.00 22.02 C ATOM 833 O ASP A 52 8.668 2.679 12.524 1.00 3.30 O ATOM 834 CB ASP A 52 5.707 4.168 11.697 1.00 75.42 C ATOM 835 CG ASP A 52 5.214 3.346 12.875 1.00 4.41 C ATOM 836 OD1 ASP A 52 5.317 2.102 12.827 1.00 33.14 O ATOM 837 OD2 ASP A 52 4.706 3.940 13.846 1.00 34.45 O ATOM 0 H ASP A 52 8.328 4.989 10.049 1.00 14.40 H new ATOM 0 HA ASP A 52 7.453 4.929 12.695 1.00 10.24 H new ATOM 0 HB2 ASP A 52 5.163 5.112 11.670 1.00 75.42 H new ATOM 0 HB3 ASP A 52 5.474 3.639 10.773 1.00 75.42 H new ATOM 1022 N ASP B 212 -7.241 -15.033 -5.770 1.00 74.44 N ATOM 1023 CA ASP B 212 -8.408 -14.447 -5.096 1.00 33.24 C ATOM 1024 C ASP B 212 -8.377 -12.909 -5.093 1.00 1.12 C ATOM 1025 O ASP B 212 -9.410 -12.250 -5.187 1.00 73.42 O ATOM 1026 CB ASP B 212 -8.442 -14.932 -3.641 1.00 32.31 C ATOM 1027 CG ASP B 212 -8.361 -16.442 -3.512 1.00 45.53 C ATOM 1028 OD1 ASP B 212 -7.541 -17.067 -4.214 1.00 34.15 O ATOM 1029 OD2 ASP B 212 -9.095 -17.014 -2.691 1.00 22.42 O ATOM 0 HA ASP B 212 -9.294 -14.766 -5.646 1.00 33.24 H new ATOM 0 HB2 ASP B 212 -7.612 -14.482 -3.095 1.00 32.31 H new ATOM 0 HB3 ASP B 212 -9.360 -14.582 -3.170 1.00 32.31 H new ATOM 1034 N THR B 213 -7.177 -12.361 -4.986 1.00 30.20 N ATOM 1035 CA THR B 213 -6.979 -10.934 -4.700 1.00 2.43 C ATOM 1036 C THR B 213 -7.133 -10.022 -5.931 1.00 3.11 C ATOM 1037 O THR B 213 -6.767 -10.387 -7.044 1.00 64.21 O ATOM 1038 CB THR B 213 -5.576 -10.715 -4.099 1.00 63.01 C ATOM 1039 OG1 THR B 213 -4.578 -11.223 -5.002 1.00 63.32 O ATOM 1040 CG2 THR B 213 -5.439 -11.410 -2.747 1.00 52.44 C ATOM 0 H THR B 213 -6.309 -12.885 -5.093 1.00 30.20 H new ATOM 0 HA THR B 213 -7.765 -10.658 -3.997 1.00 2.43 H new ATOM 0 HB THR B 213 -5.434 -9.645 -3.951 1.00 63.01 H new ATOM 0 HG1 THR B 213 -3.705 -11.228 -4.556 1.00 63.32 H new ATOM 0 HG21 THR B 213 -4.439 -11.237 -2.349 1.00 52.44 H new ATOM 0 HG22 THR B 213 -6.179 -11.009 -2.055 1.00 52.44 H new ATOM 0 HG23 THR B 213 -5.600 -12.481 -2.870 1.00 52.44 H new ATOM 1048 N LYS B 214 -7.674 -8.822 -5.701 1.00 21.12 N ATOM 1049 CA LYS B 214 -7.759 -7.772 -6.727 1.00 44.42 C ATOM 1050 C LYS B 214 -6.502 -6.877 -6.701 1.00 32.21 C ATOM 1051 O LYS B 214 -5.997 -6.543 -5.628 1.00 73.04 O ATOM 1052 CB LYS B 214 -9.007 -6.902 -6.493 1.00 0.12 C ATOM 1053 CG LYS B 214 -10.332 -7.576 -6.838 1.00 43.24 C ATOM 1054 CD LYS B 214 -10.501 -7.772 -8.343 1.00 35.14 C ATOM 1055 CE LYS B 214 -10.361 -6.458 -9.112 1.00 74.33 C ATOM 1056 NZ LYS B 214 -11.276 -5.398 -8.604 1.00 71.12 N ATOM 0 H LYS B 214 -8.066 -8.549 -4.800 1.00 21.12 H new ATOM 0 HA LYS B 214 -7.828 -8.257 -7.701 1.00 44.42 H new ATOM 0 HB2 LYS B 214 -9.031 -6.600 -5.446 1.00 0.12 H new ATOM 0 HB3 LYS B 214 -8.914 -5.991 -7.085 1.00 0.12 H new ATOM 0 HG2 LYS B 214 -10.387 -8.543 -6.338 1.00 43.24 H new ATOM 0 HG3 LYS B 214 -11.156 -6.972 -6.457 1.00 43.24 H new ATOM 0 HD2 LYS B 214 -9.757 -8.483 -8.702 1.00 35.14 H new ATOM 0 HD3 LYS B 214 -11.480 -8.207 -8.544 1.00 35.14 H new ATOM 0 HE2 LYS B 214 -9.331 -6.108 -9.042 1.00 74.33 H new ATOM 0 HE3 LYS B 214 -10.567 -6.635 -10.168 1.00 74.33 H new ATOM 0 HZ1 LYS B 214 -11.241 -4.576 -9.240 1.00 71.12 H new ATOM 0 HZ2 LYS B 214 -12.248 -5.767 -8.567 1.00 71.12 H new ATOM 0 HZ3 LYS B 214 -10.979 -5.111 -7.650 1.00 71.12 H new ATOM 1070 N PRO B 215 -5.982 -6.472 -7.877 1.00 52.14 N ATOM 1071 CA PRO B 215 -4.791 -5.607 -7.960 1.00 73.33 C ATOM 1072 C PRO B 215 -5.086 -4.123 -7.646 1.00 13.24 C ATOM 1073 O PRO B 215 -5.859 -3.464 -8.352 1.00 33.31 O ATOM 1074 CB PRO B 215 -4.347 -5.780 -9.417 1.00 31.25 C ATOM 1075 CG PRO B 215 -5.610 -6.064 -10.163 1.00 12.50 C ATOM 1076 CD PRO B 215 -6.496 -6.836 -9.214 1.00 4.34 C ATOM 0 HA PRO B 215 -4.036 -5.885 -7.224 1.00 73.33 H new ATOM 0 HB2 PRO B 215 -3.858 -4.881 -9.792 1.00 31.25 H new ATOM 0 HB3 PRO B 215 -3.633 -6.597 -9.520 1.00 31.25 H new ATOM 0 HG2 PRO B 215 -6.092 -5.139 -10.479 1.00 12.50 H new ATOM 0 HG3 PRO B 215 -5.408 -6.643 -11.064 1.00 12.50 H new ATOM 0 HD2 PRO B 215 -7.544 -6.558 -9.329 1.00 4.34 H new ATOM 0 HD3 PRO B 215 -6.430 -7.910 -9.389 1.00 4.34 H new ATOM 1084 N VAL B 216 -4.480 -3.608 -6.576 1.00 61.41 N ATOM 1085 CA VAL B 216 -4.591 -2.185 -6.215 1.00 61.23 C ATOM 1086 C VAL B 216 -3.223 -1.488 -6.320 1.00 15.42 C ATOM 1087 O VAL B 216 -2.242 -1.938 -5.736 1.00 3.22 O ATOM 1088 CB VAL B 216 -5.144 -2.007 -4.777 1.00 71.50 C ATOM 1089 CG1 VAL B 216 -5.250 -0.526 -4.409 1.00 51.20 C ATOM 1090 CG2 VAL B 216 -6.498 -2.699 -4.630 1.00 53.21 C ATOM 0 H VAL B 216 -3.903 -4.155 -5.937 1.00 61.41 H new ATOM 0 HA VAL B 216 -5.287 -1.728 -6.918 1.00 61.23 H new ATOM 0 HB VAL B 216 -4.443 -2.476 -4.086 1.00 71.50 H new ATOM 0 HG11 VAL B 216 -5.640 -0.430 -3.396 1.00 51.20 H new ATOM 0 HG12 VAL B 216 -4.263 -0.066 -4.463 1.00 51.20 H new ATOM 0 HG13 VAL B 216 -5.922 -0.025 -5.106 1.00 51.20 H new ATOM 0 HG21 VAL B 216 -6.868 -2.562 -3.614 1.00 53.21 H new ATOM 0 HG22 VAL B 216 -7.207 -2.266 -5.336 1.00 53.21 H new ATOM 0 HG23 VAL B 216 -6.387 -3.764 -4.835 1.00 53.21 H new ATOM 1100 N VAL B 217 -3.158 -0.388 -7.067 1.00 21.42 N ATOM 1101 CA VAL B 217 -1.891 0.320 -7.282 1.00 13.03 C ATOM 1102 C VAL B 217 -1.734 1.506 -6.311 1.00 30.43 C ATOM 1103 O VAL B 217 -2.394 2.536 -6.461 1.00 3.44 O ATOM 1104 CB VAL B 217 -1.781 0.825 -8.741 1.00 71.33 C ATOM 1105 CG1 VAL B 217 -0.398 1.408 -9.011 1.00 54.33 C ATOM 1106 CG2 VAL B 217 -2.105 -0.295 -9.732 1.00 24.02 C ATOM 0 H VAL B 217 -3.962 0.033 -7.533 1.00 21.42 H new ATOM 0 HA VAL B 217 -1.089 -0.393 -7.089 1.00 13.03 H new ATOM 0 HB VAL B 217 -2.514 1.619 -8.880 1.00 71.33 H new ATOM 0 HG11 VAL B 217 -0.345 1.756 -10.043 1.00 54.33 H new ATOM 0 HG12 VAL B 217 -0.218 2.245 -8.336 1.00 54.33 H new ATOM 0 HG13 VAL B 217 0.359 0.641 -8.848 1.00 54.33 H new ATOM 0 HG21 VAL B 217 -2.021 0.085 -10.750 1.00 24.02 H new ATOM 0 HG22 VAL B 217 -1.404 -1.118 -9.593 1.00 24.02 H new ATOM 0 HG23 VAL B 217 -3.121 -0.650 -9.560 1.00 24.02 H new ATOM 1116 N VAL B 218 -0.857 1.357 -5.318 1.00 30.22 N ATOM 1117 CA VAL B 218 -0.649 2.396 -4.297 1.00 71.41 C ATOM 1118 C VAL B 218 0.713 3.101 -4.472 1.00 4.34 C ATOM 1119 O VAL B 218 1.685 2.498 -4.918 1.00 74.32 O ATOM 1120 CB VAL B 218 -0.753 1.798 -2.867 1.00 14.50 C ATOM 1121 CG1 VAL B 218 0.340 0.755 -2.622 1.00 71.21 C ATOM 1122 CG2 VAL B 218 -0.707 2.903 -1.813 1.00 14.24 C ATOM 0 H VAL B 218 -0.276 0.527 -5.195 1.00 30.22 H new ATOM 0 HA VAL B 218 -1.437 3.137 -4.429 1.00 71.41 H new ATOM 0 HB VAL B 218 -1.715 1.292 -2.783 1.00 14.50 H new ATOM 0 HG11 VAL B 218 0.241 0.355 -1.613 1.00 71.21 H new ATOM 0 HG12 VAL B 218 0.239 -0.054 -3.345 1.00 71.21 H new ATOM 0 HG13 VAL B 218 1.319 1.221 -2.733 1.00 71.21 H new ATOM 0 HG21 VAL B 218 -0.781 2.461 -0.819 1.00 14.24 H new ATOM 0 HG22 VAL B 218 0.233 3.448 -1.898 1.00 14.24 H new ATOM 0 HG23 VAL B 218 -1.540 3.589 -1.968 1.00 14.24 H new ATOM 1132 N ARG B 219 0.775 4.387 -4.124 1.00 24.42 N ATOM 1133 CA ARG B 219 2.003 5.178 -4.299 1.00 50.51 C ATOM 1134 C ARG B 219 2.838 5.256 -3.005 1.00 73.31 C ATOM 1135 O ARG B 219 2.293 5.325 -1.906 1.00 34.02 O ATOM 1136 CB ARG B 219 1.660 6.604 -4.746 1.00 45.10 C ATOM 1137 CG ARG B 219 1.021 6.717 -6.127 1.00 72.53 C ATOM 1138 CD ARG B 219 0.781 8.180 -6.492 1.00 32.20 C ATOM 1139 NE ARG B 219 0.240 8.343 -7.839 1.00 24.01 N ATOM 1140 CZ ARG B 219 -0.700 9.191 -8.151 1.00 3.42 C ATOM 1141 NH1 ARG B 219 -1.246 9.934 -7.242 1.00 53.10 N ATOM 1142 NH2 ARG B 219 -1.094 9.300 -9.372 1.00 55.12 N ATOM 0 H ARG B 219 -0.005 4.905 -3.720 1.00 24.42 H new ATOM 0 HA ARG B 219 2.594 4.671 -5.062 1.00 50.51 H new ATOM 0 HB2 ARG B 219 0.984 7.044 -4.013 1.00 45.10 H new ATOM 0 HB3 ARG B 219 2.573 7.200 -4.736 1.00 45.10 H new ATOM 0 HG2 ARG B 219 1.668 6.253 -6.872 1.00 72.53 H new ATOM 0 HG3 ARG B 219 0.076 6.174 -6.142 1.00 72.53 H new ATOM 0 HD2 ARG B 219 0.092 8.622 -5.772 1.00 32.20 H new ATOM 0 HD3 ARG B 219 1.719 8.729 -6.413 1.00 32.20 H new ATOM 0 HE ARG B 219 0.621 7.757 -8.582 1.00 24.01 H new ATOM 0 HH11 ARG B 219 -0.941 9.859 -6.271 1.00 53.10 H new ATOM 0 HH12 ARG B 219 -1.981 10.594 -7.497 1.00 53.10 H new ATOM 0 HH21 ARG B 219 -0.671 8.722 -10.098 1.00 55.12 H new ATOM 0 HH22 ARG B 219 -1.830 9.964 -9.613 1.00 55.12 H new ATOM 1156 N LEU B 220 4.165 5.268 -3.158 1.00 24.05 N ATOM 1157 CA LEU B 220 5.089 5.465 -2.028 1.00 13.12 C ATOM 1158 C LEU B 220 6.342 6.248 -2.482 1.00 32.35 C ATOM 1159 O LEU B 220 6.688 6.241 -3.664 1.00 4.33 O ATOM 1160 CB LEU B 220 5.494 4.110 -1.424 1.00 21.52 C ATOM 1161 CG LEU B 220 6.378 4.184 -0.165 1.00 43.41 C ATOM 1162 CD1 LEU B 220 5.673 4.953 0.950 1.00 33.52 C ATOM 1163 CD2 LEU B 220 6.769 2.781 0.301 1.00 20.51 C ATOM 0 H LEU B 220 4.630 5.143 -4.057 1.00 24.05 H new ATOM 0 HA LEU B 220 4.577 6.048 -1.262 1.00 13.12 H new ATOM 0 HB2 LEU B 220 4.588 3.556 -1.179 1.00 21.52 H new ATOM 0 HB3 LEU B 220 6.023 3.536 -2.185 1.00 21.52 H new ATOM 0 HG LEU B 220 7.290 4.724 -0.419 1.00 43.41 H new ATOM 0 HD11 LEU B 220 6.317 4.992 1.829 1.00 33.52 H new ATOM 0 HD12 LEU B 220 5.458 5.967 0.613 1.00 33.52 H new ATOM 0 HD13 LEU B 220 4.740 4.450 1.206 1.00 33.52 H new ATOM 0 HD21 LEU B 220 7.393 2.854 1.191 1.00 20.51 H new ATOM 0 HD22 LEU B 220 5.870 2.211 0.534 1.00 20.51 H new ATOM 0 HD23 LEU B 220 7.323 2.276 -0.490 1.00 20.51 H new ATOM 1175 N TYR B 221 7.013 6.933 -1.549 1.00 61.51 N ATOM 1176 CA TYR B 221 8.193 7.745 -1.887 1.00 22.03 C ATOM 1177 C TYR B 221 9.412 6.876 -2.265 1.00 41.13 C ATOM 1178 O TYR B 221 9.782 5.959 -1.533 1.00 65.33 O ATOM 1179 CB TYR B 221 8.545 8.691 -0.726 1.00 72.31 C ATOM 1180 CG TYR B 221 7.576 9.851 -0.585 1.00 40.20 C ATOM 1181 CD1 TYR B 221 7.597 10.899 -1.496 1.00 13.13 C ATOM 1182 CD2 TYR B 221 6.629 9.893 0.434 1.00 20.54 C ATOM 1183 CE1 TYR B 221 6.713 11.952 -1.399 1.00 15.23 C ATOM 1184 CE2 TYR B 221 5.736 10.942 0.534 1.00 64.24 C ATOM 1185 CZ TYR B 221 5.783 11.970 -0.385 1.00 42.21 C ATOM 1186 OH TYR B 221 4.886 13.011 -0.302 1.00 15.24 O ATOM 0 H TYR B 221 6.763 6.943 -0.560 1.00 61.51 H new ATOM 0 HA TYR B 221 7.936 8.338 -2.765 1.00 22.03 H new ATOM 0 HB2 TYR B 221 8.560 8.124 0.205 1.00 72.31 H new ATOM 0 HB3 TYR B 221 9.551 9.083 -0.877 1.00 72.31 H new ATOM 0 HD1 TYR B 221 8.321 10.889 -2.297 1.00 13.13 H new ATOM 0 HD2 TYR B 221 6.592 9.093 1.158 1.00 20.54 H new ATOM 0 HE1 TYR B 221 6.750 12.759 -2.116 1.00 15.23 H new ATOM 0 HE2 TYR B 221 5.004 10.957 1.328 1.00 64.24 H new ATOM 0 HH TYR B 221 4.402 13.094 -1.150 1.00 15.24 H new ATOM 1196 N PRO B 222 10.054 7.175 -3.423 1.00 34.44 N ATOM 1197 CA PRO B 222 11.205 6.408 -3.954 1.00 24.23 C ATOM 1198 C PRO B 222 12.233 5.970 -2.892 1.00 53.53 C ATOM 1199 O PRO B 222 12.652 4.809 -2.865 1.00 43.34 O ATOM 1200 CB PRO B 222 11.838 7.400 -4.934 1.00 12.20 C ATOM 1201 CG PRO B 222 10.681 8.180 -5.463 1.00 72.01 C ATOM 1202 CD PRO B 222 9.686 8.286 -4.329 1.00 32.14 C ATOM 0 HA PRO B 222 10.880 5.464 -4.391 1.00 24.23 H new ATOM 0 HB2 PRO B 222 12.560 8.047 -4.435 1.00 12.20 H new ATOM 0 HB3 PRO B 222 12.370 6.885 -5.734 1.00 12.20 H new ATOM 0 HG2 PRO B 222 10.998 9.168 -5.796 1.00 72.01 H new ATOM 0 HG3 PRO B 222 10.237 7.681 -6.324 1.00 72.01 H new ATOM 0 HD2 PRO B 222 9.756 9.251 -3.826 1.00 32.14 H new ATOM 0 HD3 PRO B 222 8.661 8.186 -4.687 1.00 32.14 H new ATOM 1210 N ASP B 223 12.642 6.898 -2.024 1.00 11.20 N ATOM 1211 CA ASP B 223 13.631 6.592 -0.982 1.00 54.22 C ATOM 1212 C ASP B 223 13.083 5.569 0.027 1.00 64.21 C ATOM 1213 O ASP B 223 13.797 4.665 0.461 1.00 41.33 O ATOM 1214 CB ASP B 223 14.061 7.875 -0.260 1.00 70.45 C ATOM 1215 CG ASP B 223 15.139 7.620 0.783 1.00 22.54 C ATOM 1216 OD1 ASP B 223 16.268 7.255 0.400 1.00 21.40 O ATOM 1217 OD2 ASP B 223 14.863 7.775 1.996 1.00 65.52 O ATOM 0 H ASP B 223 12.308 7.862 -2.019 1.00 11.20 H new ATOM 0 HA ASP B 223 14.502 6.151 -1.467 1.00 54.22 H new ATOM 0 HB2 ASP B 223 14.430 8.594 -0.991 1.00 70.45 H new ATOM 0 HB3 ASP B 223 13.193 8.326 0.221 1.00 70.45 H new ATOM 1222 N GLU B 224 11.809 5.710 0.387 1.00 52.44 N ATOM 1223 CA GLU B 224 11.163 4.778 1.318 1.00 34.14 C ATOM 1224 C GLU B 224 10.947 3.404 0.665 1.00 64.44 C ATOM 1225 O GLU B 224 11.014 2.373 1.332 1.00 60.34 O ATOM 1226 CB GLU B 224 9.830 5.354 1.808 1.00 14.20 C ATOM 1227 CG GLU B 224 9.975 6.713 2.484 1.00 71.15 C ATOM 1228 CD GLU B 224 8.679 7.211 3.100 1.00 42.14 C ATOM 1229 OE1 GLU B 224 7.806 7.690 2.350 1.00 43.23 O ATOM 1230 OE2 GLU B 224 8.540 7.141 4.337 1.00 42.32 O ATOM 0 H GLU B 224 11.202 6.458 0.051 1.00 52.44 H new ATOM 0 HA GLU B 224 11.823 4.643 2.175 1.00 34.14 H new ATOM 0 HB2 GLU B 224 9.149 5.447 0.962 1.00 14.20 H new ATOM 0 HB3 GLU B 224 9.375 4.654 2.508 1.00 14.20 H new ATOM 0 HG2 GLU B 224 10.738 6.647 3.260 1.00 71.15 H new ATOM 0 HG3 GLU B 224 10.326 7.441 1.753 1.00 71.15 H new ATOM 1237 N ILE B 225 10.695 3.396 -0.644 1.00 23.04 N ATOM 1238 CA ILE B 225 10.631 2.147 -1.414 1.00 23.24 C ATOM 1239 C ILE B 225 11.992 1.432 -1.385 1.00 22.00 C ATOM 1240 O ILE B 225 12.072 0.200 -1.334 1.00 54.24 O ATOM 1241 CB ILE B 225 10.226 2.413 -2.891 1.00 72.31 C ATOM 1242 CG1 ILE B 225 8.862 3.125 -2.954 1.00 43.20 C ATOM 1243 CG2 ILE B 225 10.192 1.108 -3.691 1.00 64.10 C ATOM 1244 CD1 ILE B 225 8.413 3.481 -4.359 1.00 3.12 C ATOM 0 H ILE B 225 10.532 4.238 -1.196 1.00 23.04 H new ATOM 0 HA ILE B 225 9.872 1.515 -0.952 1.00 23.24 H new ATOM 0 HB ILE B 225 10.977 3.064 -3.339 1.00 72.31 H new ATOM 0 HG12 ILE B 225 8.109 2.485 -2.495 1.00 43.20 H new ATOM 0 HG13 ILE B 225 8.912 4.036 -2.358 1.00 43.20 H new ATOM 0 HG21 ILE B 225 9.906 1.320 -4.721 1.00 64.10 H new ATOM 0 HG22 ILE B 225 11.179 0.646 -3.676 1.00 64.10 H new ATOM 0 HG23 ILE B 225 9.466 0.427 -3.246 1.00 64.10 H new ATOM 0 HD11 ILE B 225 7.444 3.979 -4.316 1.00 3.12 H new ATOM 0 HD12 ILE B 225 9.144 4.148 -4.817 1.00 3.12 H new ATOM 0 HD13 ILE B 225 8.328 2.572 -4.955 1.00 3.12 H new ATOM 1256 N GLU B 226 13.063 2.224 -1.411 1.00 3.11 N ATOM 1257 CA GLU B 226 14.428 1.698 -1.330 1.00 1.22 C ATOM 1258 C GLU B 226 14.743 1.190 0.089 1.00 42.21 C ATOM 1259 O GLU B 226 15.323 0.115 0.262 1.00 64.30 O ATOM 1260 CB GLU B 226 15.419 2.787 -1.754 1.00 31.13 C ATOM 1261 CG GLU B 226 16.872 2.330 -1.793 1.00 14.31 C ATOM 1262 CD GLU B 226 17.784 3.367 -2.428 1.00 12.32 C ATOM 1263 OE1 GLU B 226 18.273 4.262 -1.707 1.00 43.44 O ATOM 1264 OE2 GLU B 226 17.997 3.298 -3.657 1.00 30.13 O ATOM 0 H GLU B 226 13.012 3.240 -1.488 1.00 3.11 H new ATOM 0 HA GLU B 226 14.520 0.849 -2.007 1.00 1.22 H new ATOM 0 HB2 GLU B 226 15.139 3.153 -2.742 1.00 31.13 H new ATOM 0 HB3 GLU B 226 15.333 3.628 -1.066 1.00 31.13 H new ATOM 0 HG2 GLU B 226 17.213 2.122 -0.779 1.00 14.31 H new ATOM 0 HG3 GLU B 226 16.942 1.396 -2.351 1.00 14.31 H new ATOM 1271 N ALA B 227 14.354 1.962 1.100 1.00 31.32 N ATOM 1272 CA ALA B 227 14.461 1.519 2.494 1.00 22.14 C ATOM 1273 C ALA B 227 13.624 0.249 2.726 1.00 34.44 C ATOM 1274 O ALA B 227 14.008 -0.642 3.489 1.00 60.41 O ATOM 1275 CB ALA B 227 14.020 2.634 3.439 1.00 65.44 C ATOM 0 H ALA B 227 13.962 2.897 0.984 1.00 31.32 H new ATOM 0 HA ALA B 227 15.504 1.281 2.702 1.00 22.14 H new ATOM 0 HB1 ALA B 227 14.104 2.292 4.470 1.00 65.44 H new ATOM 0 HB2 ALA B 227 14.656 3.507 3.293 1.00 65.44 H new ATOM 0 HB3 ALA B 227 12.984 2.901 3.229 1.00 65.44 H new ATOM 1281 N LEU B 228 12.483 0.179 2.041 1.00 40.51 N ATOM 1282 CA LEU B 228 11.593 -0.985 2.095 1.00 45.13 C ATOM 1283 C LEU B 228 12.294 -2.256 1.584 1.00 3.01 C ATOM 1284 O LEU B 228 12.405 -3.245 2.309 1.00 14.14 O ATOM 1285 CB LEU B 228 10.331 -0.715 1.262 1.00 14.40 C ATOM 1286 CG LEU B 228 9.297 -1.854 1.229 1.00 1.23 C ATOM 1287 CD1 LEU B 228 8.703 -2.088 2.617 1.00 4.44 C ATOM 1288 CD2 LEU B 228 8.201 -1.553 0.206 1.00 61.00 C ATOM 0 H LEU B 228 12.148 0.926 1.433 1.00 40.51 H new ATOM 0 HA LEU B 228 11.318 -1.149 3.137 1.00 45.13 H new ATOM 0 HB2 LEU B 228 9.846 0.180 1.651 1.00 14.40 H new ATOM 0 HB3 LEU B 228 10.634 -0.494 0.238 1.00 14.40 H new ATOM 0 HG LEU B 228 9.803 -2.770 0.924 1.00 1.23 H new ATOM 0 HD11 LEU B 228 7.975 -2.898 2.569 1.00 4.44 H new ATOM 0 HD12 LEU B 228 9.498 -2.356 3.313 1.00 4.44 H new ATOM 0 HD13 LEU B 228 8.212 -1.178 2.961 1.00 4.44 H new ATOM 0 HD21 LEU B 228 7.478 -2.369 0.196 1.00 61.00 H new ATOM 0 HD22 LEU B 228 7.697 -0.625 0.475 1.00 61.00 H new ATOM 0 HD23 LEU B 228 8.646 -1.450 -0.784 1.00 61.00 H new ATOM 1300 N LYS B 229 12.781 -2.219 0.337 1.00 51.11 N ATOM 1301 CA LYS B 229 13.449 -3.384 -0.270 1.00 23.21 C ATOM 1302 C LYS B 229 14.656 -3.849 0.565 1.00 74.15 C ATOM 1303 O LYS B 229 15.122 -4.979 0.429 1.00 4.03 O ATOM 1304 CB LYS B 229 13.898 -3.069 -1.708 1.00 65.34 C ATOM 1305 CG LYS B 229 15.004 -2.019 -1.794 1.00 13.11 C ATOM 1306 CD LYS B 229 15.478 -1.784 -3.227 1.00 74.44 C ATOM 1307 CE LYS B 229 14.370 -1.242 -4.125 1.00 21.04 C ATOM 1308 NZ LYS B 229 14.872 -0.925 -5.486 1.00 23.42 N ATOM 0 H LYS B 229 12.727 -1.401 -0.271 1.00 51.11 H new ATOM 0 HA LYS B 229 12.721 -4.195 -0.293 1.00 23.21 H new ATOM 0 HB2 LYS B 229 14.246 -3.988 -2.179 1.00 65.34 H new ATOM 0 HB3 LYS B 229 13.037 -2.723 -2.280 1.00 65.34 H new ATOM 0 HG2 LYS B 229 14.642 -1.080 -1.376 1.00 13.11 H new ATOM 0 HG3 LYS B 229 15.849 -2.335 -1.183 1.00 13.11 H new ATOM 0 HD2 LYS B 229 16.312 -1.082 -3.220 1.00 74.44 H new ATOM 0 HD3 LYS B 229 15.852 -2.720 -3.641 1.00 74.44 H new ATOM 0 HE2 LYS B 229 13.567 -1.976 -4.195 1.00 21.04 H new ATOM 0 HE3 LYS B 229 13.944 -0.345 -3.676 1.00 21.04 H new ATOM 0 HZ1 LYS B 229 14.091 -0.559 -6.068 1.00 23.42 H new ATOM 0 HZ2 LYS B 229 15.621 -0.207 -5.421 1.00 23.42 H new ATOM 0 HZ3 LYS B 229 15.256 -1.787 -5.924 1.00 23.42 H new ATOM 1322 N SER B 230 15.163 -2.963 1.421 1.00 41.13 N ATOM 1323 CA SER B 230 16.277 -3.298 2.317 1.00 34.24 C ATOM 1324 C SER B 230 15.827 -4.191 3.485 1.00 44.30 C ATOM 1325 O SER B 230 16.584 -5.047 3.947 1.00 10.23 O ATOM 1326 CB SER B 230 16.924 -2.017 2.869 1.00 62.43 C ATOM 1327 OG SER B 230 18.011 -2.310 3.742 1.00 51.10 O ATOM 0 H SER B 230 14.822 -2.006 1.516 1.00 41.13 H new ATOM 0 HA SER B 230 17.007 -3.854 1.729 1.00 34.24 H new ATOM 0 HB2 SER B 230 17.277 -1.402 2.041 1.00 62.43 H new ATOM 0 HB3 SER B 230 16.175 -1.432 3.404 1.00 62.43 H new ATOM 0 HG SER B 230 18.399 -1.473 4.073 1.00 51.10 H new ATOM 1333 N ARG B 231 14.595 -3.995 3.961 1.00 70.14 N ATOM 1334 CA ARG B 231 14.095 -4.730 5.135 1.00 71.40 C ATOM 1335 C ARG B 231 13.171 -5.906 4.762 1.00 53.11 C ATOM 1336 O ARG B 231 12.657 -6.590 5.647 1.00 25.11 O ATOM 1337 CB ARG B 231 13.355 -3.783 6.094 1.00 33.40 C ATOM 1338 CG ARG B 231 12.111 -3.127 5.494 1.00 51.25 C ATOM 1339 CD ARG B 231 11.280 -2.416 6.557 1.00 54.32 C ATOM 1340 NE ARG B 231 10.726 -3.356 7.532 1.00 21.42 N ATOM 1341 CZ ARG B 231 10.272 -3.016 8.711 1.00 11.13 C ATOM 1342 NH1 ARG B 231 10.348 -1.793 9.123 1.00 54.10 N ATOM 1343 NH2 ARG B 231 9.757 -3.912 9.487 1.00 10.51 N ATOM 0 H ARG B 231 13.926 -3.339 3.558 1.00 70.14 H new ATOM 0 HA ARG B 231 14.973 -5.147 5.627 1.00 71.40 H new ATOM 0 HB2 ARG B 231 13.064 -4.341 6.984 1.00 33.40 H new ATOM 0 HB3 ARG B 231 14.043 -3.002 6.418 1.00 33.40 H new ATOM 0 HG2 ARG B 231 12.410 -2.412 4.728 1.00 51.25 H new ATOM 0 HG3 ARG B 231 11.501 -3.885 5.002 1.00 51.25 H new ATOM 0 HD2 ARG B 231 11.900 -1.682 7.072 1.00 54.32 H new ATOM 0 HD3 ARG B 231 10.468 -1.869 6.078 1.00 54.32 H new ATOM 0 HE ARG B 231 10.691 -4.343 7.275 1.00 21.42 H new ATOM 0 HH11 ARG B 231 10.766 -1.079 8.526 1.00 54.10 H new ATOM 0 HH12 ARG B 231 9.990 -1.542 10.045 1.00 54.10 H new ATOM 0 HH21 ARG B 231 9.705 -4.883 9.180 1.00 10.51 H new ATOM 0 HH22 ARG B 231 9.403 -3.648 10.406 1.00 10.51 H new ATOM 1357 N VAL B 232 12.945 -6.135 3.467 1.00 73.30 N ATOM 1358 CA VAL B 232 12.116 -7.271 3.032 1.00 30.43 C ATOM 1359 C VAL B 232 12.900 -8.596 3.109 1.00 12.52 C ATOM 1360 O VAL B 232 14.037 -8.683 2.638 1.00 54.01 O ATOM 1361 CB VAL B 232 11.557 -7.078 1.595 1.00 1.01 C ATOM 1362 CG1 VAL B 232 10.656 -5.846 1.531 1.00 50.55 C ATOM 1363 CG2 VAL B 232 12.684 -6.984 0.566 1.00 62.15 C ATOM 0 H VAL B 232 13.315 -5.562 2.709 1.00 73.30 H new ATOM 0 HA VAL B 232 11.271 -7.314 3.719 1.00 30.43 H new ATOM 0 HB VAL B 232 10.959 -7.955 1.348 1.00 1.01 H new ATOM 0 HG11 VAL B 232 10.274 -5.727 0.517 1.00 50.55 H new ATOM 0 HG12 VAL B 232 9.821 -5.969 2.221 1.00 50.55 H new ATOM 0 HG13 VAL B 232 11.229 -4.961 1.809 1.00 50.55 H new ATOM 0 HG21 VAL B 232 12.258 -6.849 -0.428 1.00 62.15 H new ATOM 0 HG22 VAL B 232 13.325 -6.135 0.805 1.00 62.15 H new ATOM 0 HG23 VAL B 232 13.274 -7.901 0.587 1.00 62.15 H new ATOM 1373 N PRO B 233 12.312 -9.640 3.734 1.00 51.21 N ATOM 1374 CA PRO B 233 12.964 -10.954 3.864 1.00 74.32 C ATOM 1375 C PRO B 233 13.060 -11.718 2.527 1.00 22.33 C ATOM 1376 O PRO B 233 12.227 -11.549 1.635 1.00 22.51 O ATOM 1377 CB PRO B 233 12.072 -11.695 4.871 1.00 3.31 C ATOM 1378 CG PRO B 233 10.731 -11.055 4.739 1.00 64.42 C ATOM 1379 CD PRO B 233 10.984 -9.614 4.375 1.00 22.31 C ATOM 0 HA PRO B 233 14.001 -10.862 4.187 1.00 74.32 H new ATOM 0 HB2 PRO B 233 12.025 -12.761 4.648 1.00 3.31 H new ATOM 0 HB3 PRO B 233 12.458 -11.599 5.886 1.00 3.31 H new ATOM 0 HG2 PRO B 233 10.137 -11.551 3.972 1.00 64.42 H new ATOM 0 HG3 PRO B 233 10.172 -11.128 5.672 1.00 64.42 H new ATOM 0 HD2 PRO B 233 10.220 -9.233 3.697 1.00 22.31 H new ATOM 0 HD3 PRO B 233 10.978 -8.972 5.256 1.00 22.31 H new ATOM 1387 N ALA B 234 14.078 -12.575 2.421 1.00 41.12 N ATOM 1388 CA ALA B 234 14.427 -13.269 1.166 1.00 65.01 C ATOM 1389 C ALA B 234 13.225 -13.911 0.445 1.00 44.21 C ATOM 1390 O ALA B 234 13.041 -13.713 -0.759 1.00 43.14 O ATOM 1391 CB ALA B 234 15.489 -14.330 1.444 1.00 31.35 C ATOM 0 H ALA B 234 14.689 -12.812 3.202 1.00 41.12 H new ATOM 0 HA ALA B 234 14.810 -12.503 0.491 1.00 65.01 H new ATOM 0 HB1 ALA B 234 15.745 -14.841 0.516 1.00 31.35 H new ATOM 0 HB2 ALA B 234 16.380 -13.854 1.854 1.00 31.35 H new ATOM 0 HB3 ALA B 234 15.102 -15.053 2.161 1.00 31.35 H new ATOM 1397 N ASN B 235 12.414 -14.679 1.171 1.00 43.13 N ATOM 1398 CA ASN B 235 11.317 -15.442 0.551 1.00 64.41 C ATOM 1399 C ASN B 235 10.068 -14.585 0.298 1.00 51.02 C ATOM 1400 O ASN B 235 9.241 -14.922 -0.549 1.00 23.24 O ATOM 1401 CB ASN B 235 10.945 -16.649 1.422 1.00 23.13 C ATOM 1402 CG ASN B 235 12.096 -17.618 1.596 1.00 72.32 C ATOM 1403 OD1 ASN B 235 12.971 -17.726 0.744 1.00 33.43 O ATOM 1404 ND2 ASN B 235 12.100 -18.342 2.695 1.00 34.44 N ATOM 0 H ASN B 235 12.490 -14.793 2.182 1.00 43.13 H new ATOM 0 HA ASN B 235 11.683 -15.782 -0.418 1.00 64.41 H new ATOM 0 HB2 ASN B 235 10.618 -16.299 2.401 1.00 23.13 H new ATOM 0 HB3 ASN B 235 10.100 -17.171 0.972 1.00 23.13 H new ATOM 0 HD21 ASN B 235 12.846 -19.018 2.858 1.00 34.44 H new ATOM 0 HD22 ASN B 235 11.357 -18.227 3.384 1.00 34.44 H new ATOM 1411 N THR B 236 9.922 -13.482 1.028 1.00 20.34 N ATOM 1412 CA THR B 236 8.722 -12.638 0.906 1.00 41.13 C ATOM 1413 C THR B 236 8.860 -11.607 -0.223 1.00 52.35 C ATOM 1414 O THR B 236 9.738 -10.741 -0.188 1.00 14.15 O ATOM 1415 CB THR B 236 8.405 -11.887 2.223 1.00 72.34 C ATOM 1416 OG1 THR B 236 8.210 -12.818 3.303 1.00 43.12 O ATOM 1417 CG2 THR B 236 7.157 -11.016 2.082 1.00 1.44 C ATOM 0 H THR B 236 10.608 -13.149 1.705 1.00 20.34 H new ATOM 0 HA THR B 236 7.903 -13.320 0.675 1.00 41.13 H new ATOM 0 HB THR B 236 9.258 -11.245 2.442 1.00 72.34 H new ATOM 0 HG1 THR B 236 7.263 -13.066 3.354 1.00 43.12 H new ATOM 0 HG21 THR B 236 6.963 -10.503 3.024 1.00 1.44 H new ATOM 0 HG22 THR B 236 7.314 -10.280 1.294 1.00 1.44 H new ATOM 0 HG23 THR B 236 6.303 -11.643 1.828 1.00 1.44 H new ATOM 1425 N SER B 237 7.992 -11.712 -1.229 1.00 14.00 N ATOM 1426 CA SER B 237 7.924 -10.721 -2.313 1.00 13.02 C ATOM 1427 C SER B 237 7.503 -9.347 -1.768 1.00 23.22 C ATOM 1428 O SER B 237 6.728 -9.267 -0.813 1.00 61.32 O ATOM 1429 CB SER B 237 6.929 -11.187 -3.386 1.00 3.20 C ATOM 1430 OG SER B 237 6.795 -10.234 -4.431 1.00 1.32 O ATOM 0 H SER B 237 7.322 -12.475 -1.319 1.00 14.00 H new ATOM 0 HA SER B 237 8.915 -10.627 -2.758 1.00 13.02 H new ATOM 0 HB2 SER B 237 7.262 -12.138 -3.802 1.00 3.20 H new ATOM 0 HB3 SER B 237 5.956 -11.363 -2.927 1.00 3.20 H new ATOM 0 HG SER B 237 5.903 -9.831 -4.394 1.00 1.32 H new ATOM 1436 N MET B 238 8.006 -8.268 -2.374 1.00 1.03 N ATOM 1437 CA MET B 238 7.712 -6.907 -1.898 1.00 21.14 C ATOM 1438 C MET B 238 6.198 -6.651 -1.820 1.00 33.13 C ATOM 1439 O MET B 238 5.707 -6.063 -0.854 1.00 30.14 O ATOM 1440 CB MET B 238 8.377 -5.856 -2.801 1.00 3.33 C ATOM 1441 CG MET B 238 9.901 -5.909 -2.790 1.00 54.14 C ATOM 1442 SD MET B 238 10.650 -4.565 -3.738 1.00 71.11 S ATOM 1443 CE MET B 238 10.116 -3.134 -2.796 1.00 11.12 C ATOM 0 H MET B 238 8.616 -8.306 -3.191 1.00 1.03 H new ATOM 0 HA MET B 238 8.124 -6.820 -0.893 1.00 21.14 H new ATOM 0 HB2 MET B 238 8.026 -5.995 -3.823 1.00 3.33 H new ATOM 0 HB3 MET B 238 8.055 -4.864 -2.485 1.00 3.33 H new ATOM 0 HG2 MET B 238 10.255 -5.863 -1.760 1.00 54.14 H new ATOM 0 HG3 MET B 238 10.231 -6.864 -3.198 1.00 54.14 H new ATOM 0 HE1 MET B 238 10.784 -2.296 -2.997 1.00 11.12 H new ATOM 0 HE2 MET B 238 9.100 -2.866 -3.086 1.00 11.12 H new ATOM 0 HE3 MET B 238 10.139 -3.369 -1.732 1.00 11.12 H new ATOM 1453 N SER B 239 5.465 -7.111 -2.833 1.00 70.11 N ATOM 1454 CA SER B 239 3.999 -6.997 -2.849 1.00 1.11 C ATOM 1455 C SER B 239 3.378 -7.726 -1.650 1.00 24.53 C ATOM 1456 O SER B 239 2.555 -7.168 -0.922 1.00 63.53 O ATOM 1457 CB SER B 239 3.429 -7.575 -4.150 1.00 24.21 C ATOM 1458 OG SER B 239 3.769 -8.948 -4.290 1.00 13.53 O ATOM 0 H SER B 239 5.858 -7.567 -3.656 1.00 70.11 H new ATOM 0 HA SER B 239 3.748 -5.938 -2.785 1.00 1.11 H new ATOM 0 HB2 SER B 239 2.345 -7.463 -4.158 1.00 24.21 H new ATOM 0 HB3 SER B 239 3.814 -7.013 -5.001 1.00 24.21 H new ATOM 0 HG SER B 239 3.393 -9.294 -5.126 1.00 13.53 H new ATOM 1464 N ALA B 240 3.789 -8.979 -1.451 1.00 33.31 N ATOM 1465 CA ALA B 240 3.333 -9.779 -0.308 1.00 35.31 C ATOM 1466 C ALA B 240 3.695 -9.114 1.031 1.00 60.22 C ATOM 1467 O ALA B 240 2.940 -9.199 2.002 1.00 2.32 O ATOM 1468 CB ALA B 240 3.927 -11.183 -0.381 1.00 42.14 C ATOM 0 H ALA B 240 4.439 -9.465 -2.068 1.00 33.31 H new ATOM 0 HA ALA B 240 2.246 -9.846 -0.359 1.00 35.31 H new ATOM 0 HB1 ALA B 240 3.583 -11.769 0.471 1.00 42.14 H new ATOM 0 HB2 ALA B 240 3.608 -11.665 -1.305 1.00 42.14 H new ATOM 0 HB3 ALA B 240 5.015 -11.119 -0.362 1.00 42.14 H new ATOM 1474 N TYR B 241 4.850 -8.447 1.075 1.00 74.22 N ATOM 1475 CA TYR B 241 5.296 -7.756 2.287 1.00 31.44 C ATOM 1476 C TYR B 241 4.368 -6.578 2.623 1.00 32.23 C ATOM 1477 O TYR B 241 3.995 -6.379 3.776 1.00 52.30 O ATOM 1478 CB TYR B 241 6.746 -7.270 2.136 1.00 31.02 C ATOM 1479 CG TYR B 241 7.355 -6.773 3.437 1.00 63.14 C ATOM 1480 CD1 TYR B 241 7.810 -7.673 4.398 1.00 51.02 C ATOM 1481 CD2 TYR B 241 7.469 -5.414 3.715 1.00 2.35 C ATOM 1482 CE1 TYR B 241 8.356 -7.234 5.589 1.00 53.34 C ATOM 1483 CE2 TYR B 241 8.015 -4.970 4.906 1.00 4.35 C ATOM 1484 CZ TYR B 241 8.457 -5.884 5.839 1.00 14.11 C ATOM 1485 OH TYR B 241 8.997 -5.445 7.029 1.00 14.52 O ATOM 0 H TYR B 241 5.493 -8.371 0.287 1.00 74.22 H new ATOM 0 HA TYR B 241 5.255 -8.468 3.111 1.00 31.44 H new ATOM 0 HB2 TYR B 241 7.356 -8.085 1.746 1.00 31.02 H new ATOM 0 HB3 TYR B 241 6.777 -6.468 1.399 1.00 31.02 H new ATOM 0 HD1 TYR B 241 7.735 -8.734 4.209 1.00 51.02 H new ATOM 0 HD2 TYR B 241 7.125 -4.693 2.988 1.00 2.35 H new ATOM 0 HE1 TYR B 241 8.703 -7.948 6.322 1.00 53.34 H new ATOM 0 HE2 TYR B 241 8.095 -3.911 5.104 1.00 4.35 H new ATOM 0 HH TYR B 241 9.657 -6.096 7.349 1.00 14.52 H new ATOM 1495 N ILE B 242 3.995 -5.806 1.605 1.00 42.22 N ATOM 1496 CA ILE B 242 3.033 -4.712 1.783 1.00 14.53 C ATOM 1497 C ILE B 242 1.649 -5.252 2.183 1.00 23.44 C ATOM 1498 O ILE B 242 0.992 -4.708 3.075 1.00 11.35 O ATOM 1499 CB ILE B 242 2.905 -3.855 0.493 1.00 41.24 C ATOM 1500 CG1 ILE B 242 4.252 -3.188 0.157 1.00 30.01 C ATOM 1501 CG2 ILE B 242 1.800 -2.804 0.639 1.00 53.42 C ATOM 1502 CD1 ILE B 242 4.765 -2.253 1.238 1.00 34.33 C ATOM 0 H ILE B 242 4.340 -5.914 0.651 1.00 42.22 H new ATOM 0 HA ILE B 242 3.412 -4.079 2.586 1.00 14.53 H new ATOM 0 HB ILE B 242 2.631 -4.515 -0.330 1.00 41.24 H new ATOM 0 HG12 ILE B 242 4.996 -3.965 -0.020 1.00 30.01 H new ATOM 0 HG13 ILE B 242 4.147 -2.629 -0.773 1.00 30.01 H new ATOM 0 HG21 ILE B 242 1.732 -2.218 -0.278 1.00 53.42 H new ATOM 0 HG22 ILE B 242 0.848 -3.301 0.824 1.00 53.42 H new ATOM 0 HG23 ILE B 242 2.033 -2.144 1.475 1.00 53.42 H new ATOM 0 HD11 ILE B 242 5.717 -1.824 0.926 1.00 34.33 H new ATOM 0 HD12 ILE B 242 4.042 -1.453 1.401 1.00 34.33 H new ATOM 0 HD13 ILE B 242 4.905 -2.810 2.165 1.00 34.33 H new ATOM 1514 N ARG B 243 1.224 -6.335 1.531 1.00 55.10 N ATOM 1515 CA ARG B 243 -0.082 -6.950 1.803 1.00 52.44 C ATOM 1516 C ARG B 243 -0.210 -7.398 3.270 1.00 5.15 C ATOM 1517 O ARG B 243 -1.200 -7.097 3.935 1.00 12.32 O ATOM 1518 CB ARG B 243 -0.313 -8.152 0.872 1.00 63.41 C ATOM 1519 CG ARG B 243 -1.729 -8.719 0.940 1.00 51.32 C ATOM 1520 CD ARG B 243 -1.867 -10.018 0.151 1.00 45.42 C ATOM 1521 NE ARG B 243 -1.105 -11.111 0.756 1.00 51.23 N ATOM 1522 CZ ARG B 243 -1.303 -12.376 0.498 1.00 70.23 C ATOM 1523 NH1 ARG B 243 -2.187 -12.744 -0.374 1.00 10.41 N ATOM 1524 NH2 ARG B 243 -0.610 -13.276 1.111 1.00 12.24 N ATOM 0 H ARG B 243 1.765 -6.808 0.808 1.00 55.10 H new ATOM 0 HA ARG B 243 -0.842 -6.192 1.615 1.00 52.44 H new ATOM 0 HB2 ARG B 243 -0.101 -7.851 -0.154 1.00 63.41 H new ATOM 0 HB3 ARG B 243 0.397 -8.939 1.127 1.00 63.41 H new ATOM 0 HG2 ARG B 243 -1.998 -8.898 1.981 1.00 51.32 H new ATOM 0 HG3 ARG B 243 -2.433 -7.983 0.551 1.00 51.32 H new ATOM 0 HD2 ARG B 243 -2.919 -10.298 0.094 1.00 45.42 H new ATOM 0 HD3 ARG B 243 -1.524 -9.859 -0.871 1.00 45.42 H new ATOM 0 HE ARG B 243 -0.372 -10.869 1.422 1.00 51.23 H new ATOM 0 HH11 ARG B 243 -2.738 -12.043 -0.869 1.00 10.41 H new ATOM 0 HH12 ARG B 243 -2.332 -13.735 -0.566 1.00 10.41 H new ATOM 0 HH21 ARG B 243 0.092 -12.999 1.797 1.00 12.24 H new ATOM 0 HH22 ARG B 243 -0.765 -14.264 0.909 1.00 12.24 H new ATOM 1538 N ARG B 244 0.799 -8.116 3.769 1.00 10.44 N ATOM 1539 CA ARG B 244 0.774 -8.635 5.145 1.00 10.41 C ATOM 1540 C ARG B 244 0.775 -7.499 6.189 1.00 42.42 C ATOM 1541 O ARG B 244 0.414 -7.711 7.348 1.00 65.33 O ATOM 1542 CB ARG B 244 1.956 -9.592 5.377 1.00 21.23 C ATOM 1543 CG ARG B 244 3.330 -8.927 5.352 1.00 11.44 C ATOM 1544 CD ARG B 244 4.461 -9.953 5.252 1.00 22.32 C ATOM 1545 NE ARG B 244 4.444 -10.930 6.342 1.00 11.40 N ATOM 1546 CZ ARG B 244 5.272 -11.942 6.440 1.00 12.11 C ATOM 1547 NH1 ARG B 244 6.190 -12.144 5.543 1.00 25.34 N ATOM 1548 NH2 ARG B 244 5.172 -12.759 7.438 1.00 42.52 N ATOM 0 H ARG B 244 1.642 -8.352 3.246 1.00 10.44 H new ATOM 0 HA ARG B 244 -0.157 -9.188 5.273 1.00 10.41 H new ATOM 0 HB2 ARG B 244 1.823 -10.085 6.340 1.00 21.23 H new ATOM 0 HB3 ARG B 244 1.930 -10.371 4.615 1.00 21.23 H new ATOM 0 HG2 ARG B 244 3.386 -8.242 4.506 1.00 11.44 H new ATOM 0 HG3 ARG B 244 3.461 -8.330 6.255 1.00 11.44 H new ATOM 0 HD2 ARG B 244 4.385 -10.478 4.300 1.00 22.32 H new ATOM 0 HD3 ARG B 244 5.418 -9.432 5.253 1.00 22.32 H new ATOM 0 HE ARG B 244 3.742 -10.816 7.073 1.00 11.40 H new ATOM 0 HH11 ARG B 244 6.274 -11.511 4.748 1.00 25.34 H new ATOM 0 HH12 ARG B 244 6.826 -12.936 5.634 1.00 25.34 H new ATOM 0 HH21 ARG B 244 4.451 -12.615 8.145 1.00 42.52 H new ATOM 0 HH22 ARG B 244 5.814 -13.547 7.518 1.00 42.52 H new ATOM 1562 N ILE B 245 1.180 -6.298 5.769 1.00 22.25 N ATOM 1563 CA ILE B 245 1.140 -5.112 6.636 1.00 35.02 C ATOM 1564 C ILE B 245 -0.241 -4.432 6.596 1.00 25.43 C ATOM 1565 O ILE B 245 -0.897 -4.275 7.629 1.00 62.11 O ATOM 1566 CB ILE B 245 2.227 -4.080 6.230 1.00 73.01 C ATOM 1567 CG1 ILE B 245 3.631 -4.692 6.385 1.00 53.33 C ATOM 1568 CG2 ILE B 245 2.097 -2.802 7.060 1.00 32.44 C ATOM 1569 CD1 ILE B 245 4.754 -3.764 5.966 1.00 0.10 C ATOM 0 H ILE B 245 1.541 -6.118 4.832 1.00 22.25 H new ATOM 0 HA ILE B 245 1.336 -5.458 7.651 1.00 35.02 H new ATOM 0 HB ILE B 245 2.080 -3.818 5.182 1.00 73.01 H new ATOM 0 HG12 ILE B 245 3.779 -4.979 7.426 1.00 53.33 H new ATOM 0 HG13 ILE B 245 3.686 -5.605 5.792 1.00 53.33 H new ATOM 0 HG21 ILE B 245 2.868 -2.093 6.759 1.00 32.44 H new ATOM 0 HG22 ILE B 245 1.114 -2.360 6.896 1.00 32.44 H new ATOM 0 HG23 ILE B 245 2.216 -3.041 8.117 1.00 32.44 H new ATOM 0 HD11 ILE B 245 5.712 -4.266 6.104 1.00 0.10 H new ATOM 0 HD12 ILE B 245 4.633 -3.497 4.916 1.00 0.10 H new ATOM 0 HD13 ILE B 245 4.726 -2.861 6.576 1.00 0.10 H new ATOM 1581 N ILE B 246 -0.678 -4.032 5.397 1.00 22.32 N ATOM 1582 CA ILE B 246 -1.970 -3.345 5.230 1.00 73.12 C ATOM 1583 C ILE B 246 -3.140 -4.206 5.730 1.00 51.03 C ATOM 1584 O ILE B 246 -4.141 -3.679 6.227 1.00 61.00 O ATOM 1585 CB ILE B 246 -2.227 -2.939 3.754 1.00 34.13 C ATOM 1586 CG1 ILE B 246 -2.295 -4.179 2.844 1.00 50.43 C ATOM 1587 CG2 ILE B 246 -1.146 -1.973 3.272 1.00 31.32 C ATOM 1588 CD1 ILE B 246 -2.574 -3.859 1.388 1.00 42.45 C ATOM 0 H ILE B 246 -0.161 -4.170 4.529 1.00 22.32 H new ATOM 0 HA ILE B 246 -1.911 -2.440 5.835 1.00 73.12 H new ATOM 0 HB ILE B 246 -3.191 -2.433 3.702 1.00 34.13 H new ATOM 0 HG12 ILE B 246 -1.351 -4.720 2.912 1.00 50.43 H new ATOM 0 HG13 ILE B 246 -3.073 -4.847 3.214 1.00 50.43 H new ATOM 0 HG21 ILE B 246 -1.340 -1.698 2.235 1.00 31.32 H new ATOM 0 HG22 ILE B 246 -1.155 -1.077 3.893 1.00 31.32 H new ATOM 0 HG23 ILE B 246 -0.170 -2.454 3.343 1.00 31.32 H new ATOM 0 HD11 ILE B 246 -2.607 -4.784 0.812 1.00 42.45 H new ATOM 0 HD12 ILE B 246 -3.532 -3.346 1.305 1.00 42.45 H new ATOM 0 HD13 ILE B 246 -1.784 -3.217 0.999 1.00 42.45 H new ATOM 1600 N LEU B 247 -2.990 -5.526 5.606 1.00 31.32 N ATOM 1601 CA LEU B 247 -3.984 -6.497 6.089 1.00 30.12 C ATOM 1602 C LEU B 247 -4.465 -6.153 7.508 1.00 25.31 C ATOM 1603 O LEU B 247 -5.664 -6.182 7.804 1.00 22.21 O ATOM 1604 CB LEU B 247 -3.357 -7.901 6.083 1.00 51.52 C ATOM 1605 CG LEU B 247 -4.294 -9.057 6.472 1.00 33.31 C ATOM 1606 CD1 LEU B 247 -5.391 -9.240 5.429 1.00 71.21 C ATOM 1607 CD2 LEU B 247 -3.500 -10.352 6.664 1.00 13.12 C ATOM 0 H LEU B 247 -2.176 -5.956 5.168 1.00 31.32 H new ATOM 0 HA LEU B 247 -4.849 -6.464 5.426 1.00 30.12 H new ATOM 0 HB2 LEU B 247 -2.964 -8.098 5.086 1.00 51.52 H new ATOM 0 HB3 LEU B 247 -2.508 -7.902 6.766 1.00 51.52 H new ATOM 0 HG LEU B 247 -4.771 -8.807 7.420 1.00 33.31 H new ATOM 0 HD11 LEU B 247 -6.041 -10.063 5.725 1.00 71.21 H new ATOM 0 HD12 LEU B 247 -5.977 -8.324 5.353 1.00 71.21 H new ATOM 0 HD13 LEU B 247 -4.940 -9.464 4.462 1.00 71.21 H new ATOM 0 HD21 LEU B 247 -4.180 -11.158 6.939 1.00 13.12 H new ATOM 0 HD22 LEU B 247 -2.991 -10.608 5.735 1.00 13.12 H new ATOM 0 HD23 LEU B 247 -2.763 -10.213 7.455 1.00 13.12 H new ATOM 1619 N ASN B 248 -3.515 -5.799 8.371 1.00 13.22 N ATOM 1620 CA ASN B 248 -3.809 -5.470 9.768 1.00 63.52 C ATOM 1621 C ASN B 248 -4.740 -4.253 9.884 1.00 23.33 C ATOM 1622 O ASN B 248 -5.573 -4.185 10.786 1.00 63.10 O ATOM 1623 CB ASN B 248 -2.507 -5.197 10.532 1.00 72.03 C ATOM 1624 CG ASN B 248 -1.517 -6.343 10.427 1.00 42.43 C ATOM 1625 OD1 ASN B 248 -1.895 -7.496 10.257 1.00 61.13 O ATOM 1626 ND2 ASN B 248 -0.240 -6.036 10.537 1.00 73.42 N ATOM 0 H ASN B 248 -2.527 -5.732 8.127 1.00 13.22 H new ATOM 0 HA ASN B 248 -4.320 -6.328 10.205 1.00 63.52 H new ATOM 0 HB2 ASN B 248 -2.047 -4.288 10.145 1.00 72.03 H new ATOM 0 HB3 ASN B 248 -2.737 -5.016 11.582 1.00 72.03 H new ATOM 0 HD21 ASN B 248 0.467 -6.769 10.481 1.00 73.42 H new ATOM 0 HD22 ASN B 248 0.041 -5.066 10.678 1.00 73.42 H new ATOM 1633 N HIS B 249 -4.601 -3.302 8.961 1.00 43.02 N ATOM 1634 CA HIS B 249 -5.380 -2.058 9.000 1.00 51.23 C ATOM 1635 C HIS B 249 -6.851 -2.289 8.620 1.00 72.32 C ATOM 1636 O HIS B 249 -7.752 -1.710 9.227 1.00 32.10 O ATOM 1637 CB HIS B 249 -4.753 -1.012 8.069 1.00 32.32 C ATOM 1638 CG HIS B 249 -5.439 0.325 8.105 1.00 51.12 C ATOM 1639 ND1 HIS B 249 -5.094 1.319 8.989 1.00 61.22 N ATOM 1640 CD2 HIS B 249 -6.450 0.831 7.355 1.00 72.13 C ATOM 1641 CE1 HIS B 249 -5.853 2.374 8.784 1.00 42.05 C ATOM 1642 NE2 HIS B 249 -6.686 2.108 7.800 1.00 44.52 N ATOM 0 H HIS B 249 -3.955 -3.367 8.174 1.00 43.02 H new ATOM 0 HA HIS B 249 -5.359 -1.690 10.026 1.00 51.23 H new ATOM 0 HB2 HIS B 249 -3.706 -0.879 8.341 1.00 32.32 H new ATOM 0 HB3 HIS B 249 -4.772 -1.392 7.047 1.00 32.32 H new ATOM 0 HD2 HIS B 249 -6.972 0.324 6.557 1.00 72.13 H new ATOM 0 HE1 HIS B 249 -5.801 3.303 9.332 1.00 42.05 H new ATOM 0 HE2 HIS B 249 -7.391 2.746 7.429 1.00 44.52 H new ATOM 1651 N LEU B 250 -7.088 -3.127 7.609 1.00 40.21 N ATOM 1652 CA LEU B 250 -8.457 -3.426 7.156 1.00 2.24 C ATOM 1653 C LEU B 250 -9.289 -4.078 8.271 1.00 3.30 C ATOM 1654 O LEU B 250 -10.477 -3.787 8.429 1.00 12.24 O ATOM 1655 CB LEU B 250 -8.442 -4.335 5.914 1.00 60.30 C ATOM 1656 CG LEU B 250 -8.100 -3.648 4.577 1.00 64.44 C ATOM 1657 CD1 LEU B 250 -9.096 -2.535 4.268 1.00 31.31 C ATOM 1658 CD2 LEU B 250 -6.670 -3.116 4.578 1.00 43.41 C ATOM 0 H LEU B 250 -6.357 -3.611 7.088 1.00 40.21 H new ATOM 0 HA LEU B 250 -8.922 -2.477 6.891 1.00 2.24 H new ATOM 0 HB2 LEU B 250 -7.722 -5.135 6.083 1.00 60.30 H new ATOM 0 HB3 LEU B 250 -9.422 -4.803 5.819 1.00 60.30 H new ATOM 0 HG LEU B 250 -8.174 -4.397 3.789 1.00 64.44 H new ATOM 0 HD11 LEU B 250 -8.834 -2.065 3.320 1.00 31.31 H new ATOM 0 HD12 LEU B 250 -10.100 -2.954 4.200 1.00 31.31 H new ATOM 0 HD13 LEU B 250 -9.067 -1.790 5.063 1.00 31.31 H new ATOM 0 HD21 LEU B 250 -6.459 -2.637 3.622 1.00 43.41 H new ATOM 0 HD22 LEU B 250 -6.553 -2.389 5.381 1.00 43.41 H new ATOM 0 HD23 LEU B 250 -5.975 -3.941 4.732 1.00 43.41 H new ATOM 1670 N GLU B 251 -8.657 -4.965 9.038 1.00 71.25 N ATOM 1671 CA GLU B 251 -9.325 -5.632 10.161 1.00 40.43 C ATOM 1672 C GLU B 251 -9.267 -4.780 11.443 1.00 41.54 C ATOM 1673 O GLU B 251 -10.094 -4.948 12.343 1.00 51.12 O ATOM 1674 CB GLU B 251 -8.691 -7.007 10.408 1.00 33.51 C ATOM 1675 CG GLU B 251 -7.215 -6.950 10.784 1.00 42.11 C ATOM 1676 CD GLU B 251 -6.613 -8.327 10.992 1.00 73.40 C ATOM 1677 OE1 GLU B 251 -6.908 -8.957 12.031 1.00 41.14 O ATOM 1678 OE2 GLU B 251 -5.867 -8.798 10.109 1.00 32.21 O ATOM 0 H GLU B 251 -7.684 -5.240 8.905 1.00 71.25 H new ATOM 0 HA GLU B 251 -10.375 -5.761 9.897 1.00 40.43 H new ATOM 0 HB2 GLU B 251 -9.239 -7.511 11.204 1.00 33.51 H new ATOM 0 HB3 GLU B 251 -8.804 -7.614 9.510 1.00 33.51 H new ATOM 0 HG2 GLU B 251 -6.664 -6.431 10.000 1.00 42.11 H new ATOM 0 HG3 GLU B 251 -7.098 -6.365 11.696 1.00 42.11 H new ATOM 1685 N ASP B 252 -8.289 -3.874 11.519 1.00 34.34 N ATOM 1686 CA ASP B 252 -8.140 -2.973 12.673 1.00 41.21 C ATOM 1687 C ASP B 252 -9.360 -2.058 12.830 1.00 62.35 C ATOM 1688 O ASP B 252 -9.976 -1.999 13.895 1.00 13.42 O ATOM 1689 CB ASP B 252 -6.868 -2.134 12.517 1.00 63.25 C ATOM 1690 CG ASP B 252 -6.655 -1.165 13.665 1.00 0.21 C ATOM 1691 OD1 ASP B 252 -6.404 -1.628 14.797 1.00 63.32 O ATOM 1692 OD2 ASP B 252 -6.723 0.063 13.436 1.00 64.42 O ATOM 0 H ASP B 252 -7.584 -3.742 10.794 1.00 34.34 H new ATOM 0 HA ASP B 252 -8.064 -3.584 13.572 1.00 41.21 H new ATOM 0 HB2 ASP B 252 -6.007 -2.799 12.445 1.00 63.25 H new ATOM 0 HB3 ASP B 252 -6.919 -1.576 11.582 1.00 63.25 H new ATOM 1697 N GLU B 253 -9.697 -1.342 11.763 1.00 34.31 N ATOM 1698 CA GLU B 253 -10.877 -0.467 11.751 1.00 2.50 C ATOM 1699 C GLU B 253 -11.968 -1.015 10.807 1.00 74.24 C ATOM 1700 O GLU B 253 -12.013 -0.613 9.626 1.00 38.74 O ATOM 1701 CB GLU B 253 -10.474 0.977 11.376 1.00 21.12 C ATOM 1702 CG GLU B 253 -9.426 1.075 10.268 1.00 63.31 C ATOM 1703 CD GLU B 253 -9.082 2.514 9.901 1.00 63.53 C ATOM 1704 OE1 GLU B 253 -8.650 3.275 10.793 1.00 23.12 O ATOM 1705 OE2 GLU B 253 -9.215 2.889 8.714 1.00 10.22 O ATOM 1706 OXT GLU B 253 -12.773 -1.866 11.252 1.00 38.74 O ATOM 0 H GLU B 253 -9.171 -1.347 10.889 1.00 34.31 H new ATOM 0 HA GLU B 253 -11.301 -0.448 12.755 1.00 2.50 H new ATOM 0 HB2 GLU B 253 -11.366 1.520 11.064 1.00 21.12 H new ATOM 0 HB3 GLU B 253 -10.091 1.477 12.266 1.00 21.12 H new ATOM 0 HG2 GLU B 253 -8.519 0.560 10.586 1.00 63.31 H new ATOM 0 HG3 GLU B 253 -9.792 0.557 9.382 1.00 63.31 H new