USER MOD reduce.3.24.130724 H: found=0, std=0, add=827, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 827 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 151 SER OG : rot 98:sc= 0.877 USER MOD Set 1.2: A 154 THR OG1 : rot 160:sc= -0.925! USER MOD Set 2.1: A 148 CYS SG : rot 120:sc= -0.0139 USER MOD Set 2.2: A 160 HIS : no HD1:sc= -0.0123 X(o=-0.026,f=-0.02) USER MOD Set 3.1: A 21 LYS NZ :NH3+ 180:sc= 0.777 (180deg=-0.443) USER MOD Set 3.2: A 95 GLN : amide:sc= -1.32! C(o=-0.54!,f=-9.9!) USER MOD Set 4.1: A 16 HIS : no HD1:sc= -7.66! C(o=-18!,f=-19!) USER MOD Set 4.2: A 19 HIS : no HD1:sc= -7.06! C(o=-18!,f=-31!) USER MOD Set 4.3: A 96 THR OG1 : rot -167:sc= -3.74! USER MOD Single : A 12 THR OG1 : rot 40:sc= 0.145 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -170:sc= -1.9! USER MOD Single : A 93 MET CE :methyl -124:sc= -0.0201 (180deg=-0.319) USER MOD Single : A 101 ASN : amide:sc= -2.44! C(o=-2.4!,f=-2.6!) USER MOD Single : A 102 HIS : no HD1:sc= -0.289 X(o=-0.29,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 128:sc= 2.23 (180deg=-0.248) USER MOD Single : A 107 ASN : amide:sc= -0.131 K(o=-0.13,f=-2.4!) USER MOD Single : A 115 ASN : amide:sc= 1.31 K(o=1.3,f=-11!) USER MOD Single : A 116 LYS NZ :NH3+ -125:sc= 0.385 (180deg=-0.00672) USER MOD Single : A 117 MET CE :methyl -168:sc= -8.14! (180deg=-9.18!) USER MOD Single : A 119 LYS NZ :NH3+ -151:sc= 1.27 (180deg=1.15) USER MOD Single : A 123 ASN : amide:sc= -2.34 K(o=-2.3,f=-0.89) USER MOD Single : A 128 MET CE :methyl -114:sc= -3.3 (180deg=-6.4!) USER MOD Single : A 129 GLN : amide:sc= -1.6! K(o=-1.6!,f=-0.064) USER MOD Single : A 132 MET CE :methyl -159:sc= -0.395 (180deg=-1.33) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.117 K(o=-0.12,f=-1.1) USER MOD Single : A 145 THR OG1 : rot -4:sc= 0.216 USER MOD Single : A 149 LYS NZ :NH3+ 158:sc= 0.431 (180deg=0.29) USER MOD Single : A 153 LYS NZ :NH3+ 169:sc= 0.457 (180deg=0.186) USER MOD Single : A 155 LYS NZ :NH3+ 156:sc= -0.323 (180deg=-1.06) USER MOD Single : A 164 MET CE :methyl -160:sc= -3.04! (180deg=-4.43!) USER MOD ----------------------------------------------------------------- ATOM 171 N THR A 12 -11.519 -3.600 -0.758 1.00 0.44 N ATOM 172 CA THR A 12 -11.334 -4.347 0.471 1.00 0.45 C ATOM 173 C THR A 12 -10.272 -3.700 1.352 1.00 0.41 C ATOM 174 O THR A 12 -9.124 -3.562 0.943 1.00 0.50 O ATOM 175 CB THR A 12 -10.929 -5.799 0.162 1.00 0.54 C ATOM 176 OG1 THR A 12 -11.884 -6.385 -0.734 1.00 0.61 O ATOM 177 CG2 THR A 12 -10.852 -6.623 1.435 1.00 0.64 C ATOM 0 HA THR A 12 -12.283 -4.343 1.007 1.00 0.45 H new ATOM 0 HB THR A 12 -9.943 -5.791 -0.303 1.00 0.54 H new ATOM 0 HG1 THR A 12 -12.154 -5.722 -1.403 1.00 0.61 H new ATOM 0 HG21 THR A 12 -10.564 -7.645 1.190 1.00 0.64 H new ATOM 0 HG22 THR A 12 -10.111 -6.188 2.106 1.00 0.64 H new ATOM 0 HG23 THR A 12 -11.826 -6.628 1.925 1.00 0.64 H new ATOM 185 N ILE A 13 -10.660 -3.291 2.555 1.00 0.40 N ATOM 186 CA ILE A 13 -9.711 -2.708 3.492 1.00 0.40 C ATOM 187 C ILE A 13 -8.981 -3.801 4.263 1.00 0.37 C ATOM 188 O ILE A 13 -9.599 -4.672 4.877 1.00 0.52 O ATOM 189 CB ILE A 13 -10.388 -1.738 4.491 1.00 0.52 C ATOM 190 CG1 ILE A 13 -10.904 -0.498 3.758 1.00 1.15 C ATOM 191 CG2 ILE A 13 -9.417 -1.335 5.597 1.00 1.26 C ATOM 192 CD1 ILE A 13 -11.503 0.547 4.679 1.00 1.30 C ATOM 0 H ILE A 13 -11.618 -3.352 2.901 1.00 0.40 H new ATOM 0 HA ILE A 13 -8.998 -2.134 2.899 1.00 0.40 H new ATOM 0 HB ILE A 13 -11.233 -2.252 4.949 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -10.083 -0.049 3.199 1.00 1.15 H new ATOM 0 HG13 ILE A 13 -11.656 -0.803 3.031 1.00 1.15 H new ATOM 0 HG21 ILE A 13 -9.914 -0.653 6.287 1.00 1.26 H new ATOM 0 HG22 ILE A 13 -9.091 -2.224 6.137 1.00 1.26 H new ATOM 0 HG23 ILE A 13 -8.551 -0.839 5.158 1.00 1.26 H new ATOM 0 HD11 ILE A 13 -11.847 1.397 4.090 1.00 1.30 H new ATOM 0 HD12 ILE A 13 -12.345 0.115 5.220 1.00 1.30 H new ATOM 0 HD13 ILE A 13 -10.748 0.881 5.390 1.00 1.30 H new ATOM 204 N MET A 14 -7.667 -3.753 4.200 1.00 0.26 N ATOM 205 CA MET A 14 -6.816 -4.661 4.919 1.00 0.28 C ATOM 206 C MET A 14 -5.803 -3.848 5.704 1.00 0.24 C ATOM 207 O MET A 14 -5.745 -2.627 5.562 1.00 0.29 O ATOM 208 CB MET A 14 -6.105 -5.591 3.943 1.00 0.36 C ATOM 209 CG MET A 14 -7.021 -6.594 3.257 1.00 0.49 C ATOM 210 SD MET A 14 -6.126 -7.687 2.135 1.00 0.79 S ATOM 211 CE MET A 14 -7.445 -8.732 1.539 1.00 0.69 C ATOM 0 H MET A 14 -7.158 -3.070 3.638 1.00 0.26 H new ATOM 0 HA MET A 14 -7.409 -5.271 5.601 1.00 0.28 H new ATOM 0 HB2 MET A 14 -5.609 -4.989 3.182 1.00 0.36 H new ATOM 0 HB3 MET A 14 -5.326 -6.134 4.478 1.00 0.36 H new ATOM 0 HG2 MET A 14 -7.531 -7.192 4.012 1.00 0.49 H new ATOM 0 HG3 MET A 14 -7.791 -6.058 2.701 1.00 0.49 H new ATOM 0 HE1 MET A 14 -7.043 -9.460 0.834 1.00 0.69 H new ATOM 0 HE2 MET A 14 -7.903 -9.255 2.379 1.00 0.69 H new ATOM 0 HE3 MET A 14 -8.196 -8.120 1.039 1.00 0.69 H new ATOM 221 N GLY A 15 -5.009 -4.505 6.525 1.00 0.27 N ATOM 222 CA GLY A 15 -4.024 -3.801 7.297 1.00 0.27 C ATOM 223 C GLY A 15 -3.811 -4.434 8.643 1.00 0.24 C ATOM 224 O GLY A 15 -4.435 -5.448 8.960 1.00 0.31 O ATOM 0 H GLY A 15 -5.031 -5.515 6.669 1.00 0.27 H new ATOM 0 HA2 GLY A 15 -3.081 -3.782 6.751 1.00 0.27 H new ATOM 0 HA3 GLY A 15 -4.338 -2.765 7.428 1.00 0.27 H new ATOM 228 N HIS A 16 -2.929 -3.849 9.431 1.00 0.20 N ATOM 229 CA HIS A 16 -2.627 -4.392 10.743 1.00 0.17 C ATOM 230 C HIS A 16 -3.619 -3.899 11.790 1.00 0.19 C ATOM 231 O HIS A 16 -4.315 -2.901 11.604 1.00 0.22 O ATOM 232 CB HIS A 16 -1.200 -4.032 11.167 1.00 0.17 C ATOM 233 CG HIS A 16 -0.737 -4.740 12.404 1.00 0.16 C ATOM 234 ND1 HIS A 16 -0.824 -6.105 12.535 1.00 0.16 N ATOM 235 CD2 HIS A 16 -0.222 -4.224 13.535 1.00 0.19 C ATOM 236 CE1 HIS A 16 -0.361 -6.380 13.743 1.00 0.19 C ATOM 237 NE2 HIS A 16 0.016 -5.271 14.387 1.00 0.22 N ATOM 0 H HIS A 16 -2.412 -3.004 9.189 1.00 0.20 H new ATOM 0 HA HIS A 16 -2.712 -5.476 10.673 1.00 0.17 H new ATOM 0 HB2 HIS A 16 -0.518 -4.267 10.349 1.00 0.17 H new ATOM 0 HB3 HIS A 16 -1.141 -2.956 11.332 1.00 0.17 H new ATOM 0 HD2 HIS A 16 -0.032 -3.180 13.734 1.00 0.19 H new ATOM 0 HE1 HIS A 16 -0.296 -7.375 14.157 1.00 0.19 H new ATOM 0 HE2 HIS A 16 0.405 -5.215 15.328 1.00 0.22 H new ATOM 245 N VAL A 17 -3.670 -4.630 12.884 1.00 0.20 N ATOM 246 CA VAL A 17 -4.481 -4.280 14.035 1.00 0.25 C ATOM 247 C VAL A 17 -3.835 -3.128 14.793 1.00 0.26 C ATOM 248 O VAL A 17 -2.624 -2.945 14.715 1.00 0.25 O ATOM 249 CB VAL A 17 -4.616 -5.512 14.936 1.00 0.29 C ATOM 250 CG1 VAL A 17 -3.247 -6.020 15.352 1.00 0.30 C ATOM 251 CG2 VAL A 17 -5.444 -5.243 16.162 1.00 0.36 C ATOM 0 H VAL A 17 -3.143 -5.495 13.002 1.00 0.20 H new ATOM 0 HA VAL A 17 -5.472 -3.960 13.711 1.00 0.25 H new ATOM 0 HB VAL A 17 -5.131 -6.272 14.348 1.00 0.29 H new ATOM 0 HG11 VAL A 17 -3.363 -6.895 15.991 1.00 0.30 H new ATOM 0 HG12 VAL A 17 -2.675 -6.292 14.465 1.00 0.30 H new ATOM 0 HG13 VAL A 17 -2.720 -5.238 15.899 1.00 0.30 H new ATOM 0 HG21 VAL A 17 -5.507 -6.149 16.764 1.00 0.36 H new ATOM 0 HG22 VAL A 17 -4.980 -4.449 16.748 1.00 0.36 H new ATOM 0 HG23 VAL A 17 -6.446 -4.935 15.864 1.00 0.36 H new ATOM 261 N ASP A 18 -4.653 -2.331 15.485 1.00 0.31 N ATOM 262 CA ASP A 18 -4.177 -1.145 16.212 1.00 0.36 C ATOM 263 C ASP A 18 -3.837 -0.020 15.238 1.00 0.34 C ATOM 264 O ASP A 18 -3.810 1.155 15.604 1.00 0.41 O ATOM 265 CB ASP A 18 -2.979 -1.487 17.108 1.00 0.42 C ATOM 266 CG ASP A 18 -2.352 -0.265 17.759 1.00 0.55 C ATOM 267 OD1 ASP A 18 -2.914 0.239 18.757 1.00 0.69 O ATOM 268 OD2 ASP A 18 -1.299 0.207 17.275 1.00 0.59 O ATOM 0 H ASP A 18 -5.658 -2.486 15.559 1.00 0.31 H new ATOM 0 HA ASP A 18 -4.981 -0.799 16.861 1.00 0.36 H new ATOM 0 HB2 ASP A 18 -3.301 -2.180 17.885 1.00 0.42 H new ATOM 0 HB3 ASP A 18 -2.224 -2.002 16.514 1.00 0.42 H new ATOM 273 N HIS A 19 -3.596 -0.386 13.990 1.00 0.29 N ATOM 274 CA HIS A 19 -3.452 0.593 12.932 1.00 0.32 C ATOM 275 C HIS A 19 -4.832 1.051 12.505 1.00 0.43 C ATOM 276 O HIS A 19 -4.985 2.072 11.843 1.00 0.63 O ATOM 277 CB HIS A 19 -2.702 0.018 11.730 1.00 0.29 C ATOM 278 CG HIS A 19 -1.329 -0.475 12.048 1.00 0.22 C ATOM 279 ND1 HIS A 19 -0.422 -0.737 11.058 1.00 0.27 N ATOM 280 CD2 HIS A 19 -0.764 -0.736 13.248 1.00 0.21 C ATOM 281 CE1 HIS A 19 0.670 -1.150 11.673 1.00 0.26 C ATOM 282 NE2 HIS A 19 0.508 -1.166 12.999 1.00 0.24 N ATOM 0 H HIS A 19 -3.496 -1.355 13.687 1.00 0.29 H new ATOM 0 HA HIS A 19 -2.870 1.433 13.310 1.00 0.32 H new ATOM 0 HB2 HIS A 19 -3.284 -0.803 11.311 1.00 0.29 H new ATOM 0 HB3 HIS A 19 -2.632 0.785 10.958 1.00 0.29 H new ATOM 0 HD2 HIS A 19 -1.229 -0.626 14.217 1.00 0.21 H new ATOM 0 HE1 HIS A 19 1.580 -1.439 11.168 1.00 0.26 H new ATOM 0 HE2 HIS A 19 1.202 -1.446 13.693 1.00 0.24 H new ATOM 290 N GLY A 20 -5.837 0.271 12.894 1.00 0.42 N ATOM 291 CA GLY A 20 -7.204 0.658 12.646 1.00 0.54 C ATOM 292 C GLY A 20 -7.963 -0.295 11.759 1.00 0.57 C ATOM 293 O GLY A 20 -8.422 0.097 10.691 1.00 0.79 O ATOM 0 H GLY A 20 -5.723 -0.621 13.376 1.00 0.42 H new ATOM 0 HA2 GLY A 20 -7.725 0.743 13.600 1.00 0.54 H new ATOM 0 HA3 GLY A 20 -7.213 1.648 12.189 1.00 0.54 H new ATOM 297 N LYS A 21 -8.098 -1.542 12.175 1.00 0.61 N ATOM 298 CA LYS A 21 -8.919 -2.474 11.420 1.00 0.95 C ATOM 299 C LYS A 21 -10.386 -2.033 11.406 1.00 0.89 C ATOM 300 O LYS A 21 -10.925 -1.679 10.359 1.00 1.05 O ATOM 301 CB LYS A 21 -8.793 -3.875 12.001 1.00 1.36 C ATOM 302 CG LYS A 21 -9.560 -4.922 11.206 1.00 1.79 C ATOM 303 CD LYS A 21 -9.031 -5.041 9.783 1.00 2.30 C ATOM 304 CE LYS A 21 -7.662 -5.702 9.749 1.00 2.66 C ATOM 305 NZ LYS A 21 -7.700 -7.092 10.280 1.00 3.31 N ATOM 0 H LYS A 21 -7.661 -1.927 13.012 1.00 0.61 H new ATOM 0 HA LYS A 21 -8.561 -2.484 10.390 1.00 0.95 H new ATOM 0 HB2 LYS A 21 -7.740 -4.154 12.036 1.00 1.36 H new ATOM 0 HB3 LYS A 21 -9.156 -3.870 13.029 1.00 1.36 H new ATOM 0 HG2 LYS A 21 -9.483 -5.888 11.706 1.00 1.79 H new ATOM 0 HG3 LYS A 21 -10.617 -4.659 11.181 1.00 1.79 H new ATOM 0 HD2 LYS A 21 -9.731 -5.621 9.181 1.00 2.30 H new ATOM 0 HD3 LYS A 21 -8.969 -4.050 9.333 1.00 2.30 H new ATOM 0 HE2 LYS A 21 -7.291 -5.716 8.724 1.00 2.66 H new ATOM 0 HE3 LYS A 21 -6.959 -5.110 10.334 1.00 2.66 H new ATOM 0 HZ1 LYS A 21 -6.747 -7.506 10.239 1.00 3.31 H new ATOM 0 HZ2 LYS A 21 -8.029 -7.078 11.267 1.00 3.31 H new ATOM 0 HZ3 LYS A 21 -8.351 -7.665 9.706 1.00 3.31 H new ATOM 319 N THR A 22 -11.029 -2.046 12.566 1.00 0.84 N ATOM 320 CA THR A 22 -12.434 -1.672 12.661 1.00 0.87 C ATOM 321 C THR A 22 -12.590 -0.157 12.813 1.00 0.79 C ATOM 322 O THR A 22 -13.540 0.440 12.297 1.00 0.79 O ATOM 323 CB THR A 22 -13.109 -2.381 13.850 1.00 1.02 C ATOM 324 OG1 THR A 22 -12.777 -3.777 13.848 1.00 1.21 O ATOM 325 CG2 THR A 22 -14.624 -2.226 13.786 1.00 1.18 C ATOM 0 H THR A 22 -10.601 -2.311 13.453 1.00 0.84 H new ATOM 0 HA THR A 22 -12.920 -1.985 11.737 1.00 0.87 H new ATOM 0 HB THR A 22 -12.744 -1.919 14.767 1.00 1.02 H new ATOM 0 HG1 THR A 22 -13.210 -4.217 14.609 1.00 1.21 H new ATOM 0 HG21 THR A 22 -15.078 -2.735 14.636 1.00 1.18 H new ATOM 0 HG22 THR A 22 -14.883 -1.168 13.816 1.00 1.18 H new ATOM 0 HG23 THR A 22 -14.996 -2.664 12.860 1.00 1.18 H new ATOM 333 N THR A 23 -11.637 0.463 13.502 1.00 0.75 N ATOM 334 CA THR A 23 -11.682 1.893 13.777 1.00 0.75 C ATOM 335 C THR A 23 -11.681 2.739 12.506 1.00 0.67 C ATOM 336 O THR A 23 -12.173 3.861 12.513 1.00 0.66 O ATOM 337 CB THR A 23 -10.505 2.316 14.666 1.00 0.82 C ATOM 338 OG1 THR A 23 -9.460 1.336 14.580 1.00 1.25 O ATOM 339 CG2 THR A 23 -10.950 2.486 16.110 1.00 1.17 C ATOM 0 H THR A 23 -10.817 -0.009 13.883 1.00 0.75 H new ATOM 0 HA THR A 23 -12.623 2.072 14.298 1.00 0.75 H new ATOM 0 HB THR A 23 -10.129 3.277 14.314 1.00 0.82 H new ATOM 0 HG1 THR A 23 -8.781 1.521 15.262 1.00 1.25 H new ATOM 0 HG21 THR A 23 -10.098 2.786 16.720 1.00 1.17 H new ATOM 0 HG22 THR A 23 -11.723 3.252 16.165 1.00 1.17 H new ATOM 0 HG23 THR A 23 -11.348 1.542 16.482 1.00 1.17 H new ATOM 347 N LEU A 24 -11.151 2.206 11.416 1.00 0.65 N ATOM 348 CA LEU A 24 -11.137 2.935 10.154 1.00 0.63 C ATOM 349 C LEU A 24 -12.531 3.012 9.568 1.00 0.64 C ATOM 350 O LEU A 24 -12.929 4.043 9.046 1.00 0.65 O ATOM 351 CB LEU A 24 -10.197 2.276 9.179 1.00 0.67 C ATOM 352 CG LEU A 24 -8.914 3.055 8.862 1.00 0.84 C ATOM 353 CD1 LEU A 24 -9.244 4.363 8.157 1.00 1.49 C ATOM 354 CD2 LEU A 24 -8.116 3.325 10.129 1.00 1.30 C ATOM 0 H LEU A 24 -10.728 1.279 11.378 1.00 0.65 H new ATOM 0 HA LEU A 24 -10.787 3.949 10.347 1.00 0.63 H new ATOM 0 HB2 LEU A 24 -9.919 1.299 9.575 1.00 0.67 H new ATOM 0 HB3 LEU A 24 -10.734 2.101 8.247 1.00 0.67 H new ATOM 0 HG LEU A 24 -8.304 2.444 8.197 1.00 0.84 H new ATOM 0 HD11 LEU A 24 -8.322 4.902 7.940 1.00 1.49 H new ATOM 0 HD12 LEU A 24 -9.769 4.152 7.225 1.00 1.49 H new ATOM 0 HD13 LEU A 24 -9.878 4.973 8.800 1.00 1.49 H new ATOM 0 HD21 LEU A 24 -7.211 3.878 9.878 1.00 1.30 H new ATOM 0 HD22 LEU A 24 -8.720 3.912 10.821 1.00 1.30 H new ATOM 0 HD23 LEU A 24 -7.845 2.379 10.597 1.00 1.30 H new ATOM 366 N LEU A 25 -13.283 1.925 9.685 1.00 0.68 N ATOM 367 CA LEU A 25 -14.669 1.912 9.231 1.00 0.75 C ATOM 368 C LEU A 25 -15.526 2.758 10.165 1.00 0.74 C ATOM 369 O LEU A 25 -16.652 3.120 9.831 1.00 0.82 O ATOM 370 CB LEU A 25 -15.218 0.485 9.183 1.00 0.85 C ATOM 371 CG LEU A 25 -14.502 -0.461 8.220 1.00 0.92 C ATOM 372 CD1 LEU A 25 -15.234 -1.790 8.146 1.00 1.63 C ATOM 373 CD2 LEU A 25 -14.387 0.166 6.839 1.00 1.69 C ATOM 0 H LEU A 25 -12.960 1.045 10.088 1.00 0.68 H new ATOM 0 HA LEU A 25 -14.702 2.328 8.224 1.00 0.75 H new ATOM 0 HB2 LEU A 25 -15.169 0.061 10.186 1.00 0.85 H new ATOM 0 HB3 LEU A 25 -16.272 0.528 8.907 1.00 0.85 H new ATOM 0 HG LEU A 25 -13.495 -0.641 8.596 1.00 0.92 H new ATOM 0 HD11 LEU A 25 -14.713 -2.454 7.456 1.00 1.63 H new ATOM 0 HD12 LEU A 25 -15.263 -2.245 9.136 1.00 1.63 H new ATOM 0 HD13 LEU A 25 -16.252 -1.626 7.792 1.00 1.63 H new ATOM 0 HD21 LEU A 25 -13.874 -0.523 6.168 1.00 1.69 H new ATOM 0 HD22 LEU A 25 -15.384 0.376 6.451 1.00 1.69 H new ATOM 0 HD23 LEU A 25 -13.821 1.095 6.907 1.00 1.69 H new ATOM 385 N ASP A 26 -14.970 3.079 11.326 1.00 0.71 N ATOM 386 CA ASP A 26 -15.652 3.904 12.312 1.00 0.75 C ATOM 387 C ASP A 26 -15.319 5.350 12.046 1.00 0.70 C ATOM 388 O ASP A 26 -16.175 6.238 12.087 1.00 0.76 O ATOM 389 CB ASP A 26 -15.195 3.538 13.712 1.00 0.81 C ATOM 390 CG ASP A 26 -15.936 4.298 14.795 1.00 1.01 C ATOM 391 OD1 ASP A 26 -15.533 5.439 15.113 1.00 1.23 O ATOM 392 OD2 ASP A 26 -16.937 3.769 15.326 1.00 1.13 O ATOM 0 H ASP A 26 -14.038 2.776 11.609 1.00 0.71 H new ATOM 0 HA ASP A 26 -16.727 3.740 12.238 1.00 0.75 H new ATOM 0 HB2 ASP A 26 -15.335 2.468 13.866 1.00 0.81 H new ATOM 0 HB3 ASP A 26 -14.127 3.736 13.803 1.00 0.81 H new ATOM 397 N ALA A 27 -14.054 5.564 11.751 1.00 0.63 N ATOM 398 CA ALA A 27 -13.545 6.882 11.441 1.00 0.61 C ATOM 399 C ALA A 27 -14.102 7.355 10.107 1.00 0.58 C ATOM 400 O ALA A 27 -14.505 8.513 9.952 1.00 0.62 O ATOM 401 CB ALA A 27 -12.031 6.829 11.403 1.00 0.61 C ATOM 0 H ALA A 27 -13.349 4.827 11.720 1.00 0.63 H new ATOM 0 HA ALA A 27 -13.858 7.590 12.208 1.00 0.61 H new ATOM 0 HB1 ALA A 27 -11.638 7.819 11.170 1.00 0.61 H new ATOM 0 HB2 ALA A 27 -11.654 6.508 12.374 1.00 0.61 H new ATOM 0 HB3 ALA A 27 -11.711 6.122 10.638 1.00 0.61 H new ATOM 407 N ILE A 28 -14.160 6.429 9.163 1.00 0.56 N ATOM 408 CA ILE A 28 -14.594 6.714 7.808 1.00 0.57 C ATOM 409 C ILE A 28 -16.078 7.080 7.774 1.00 0.64 C ATOM 410 O ILE A 28 -16.548 7.717 6.833 1.00 0.71 O ATOM 411 CB ILE A 28 -14.304 5.501 6.896 1.00 0.61 C ATOM 412 CG1 ILE A 28 -13.946 5.947 5.485 1.00 0.84 C ATOM 413 CG2 ILE A 28 -15.480 4.532 6.858 1.00 1.02 C ATOM 414 CD1 ILE A 28 -13.245 4.863 4.702 1.00 0.85 C ATOM 0 H ILE A 28 -13.905 5.454 9.318 1.00 0.56 H new ATOM 0 HA ILE A 28 -14.034 7.572 7.436 1.00 0.57 H new ATOM 0 HB ILE A 28 -13.448 4.978 7.323 1.00 0.61 H new ATOM 0 HG12 ILE A 28 -14.853 6.243 4.959 1.00 0.84 H new ATOM 0 HG13 ILE A 28 -13.305 6.827 5.536 1.00 0.84 H new ATOM 0 HG21 ILE A 28 -15.239 3.692 6.207 1.00 1.02 H new ATOM 0 HG22 ILE A 28 -15.681 4.165 7.864 1.00 1.02 H new ATOM 0 HG23 ILE A 28 -16.362 5.045 6.476 1.00 1.02 H new ATOM 0 HD11 ILE A 28 -13.011 5.230 3.703 1.00 0.85 H new ATOM 0 HD12 ILE A 28 -12.323 4.584 5.212 1.00 0.85 H new ATOM 0 HD13 ILE A 28 -13.895 3.991 4.625 1.00 0.85 H new ATOM 1221 N ILE A 81 -10.036 -4.034 -5.564 1.00 0.63 N ATOM 1222 CA ILE A 81 -8.986 -3.175 -5.038 1.00 0.42 C ATOM 1223 C ILE A 81 -8.759 -3.470 -3.563 1.00 0.38 C ATOM 1224 O ILE A 81 -9.713 -3.744 -2.831 1.00 0.57 O ATOM 1225 CB ILE A 81 -9.353 -1.680 -5.210 1.00 0.42 C ATOM 1226 CG1 ILE A 81 -9.709 -1.379 -6.670 1.00 0.56 C ATOM 1227 CG2 ILE A 81 -8.205 -0.790 -4.752 1.00 0.50 C ATOM 1228 CD1 ILE A 81 -10.185 0.040 -6.903 1.00 0.71 C ATOM 0 HA ILE A 81 -8.074 -3.379 -5.598 1.00 0.42 H new ATOM 0 HB ILE A 81 -10.224 -1.468 -4.589 1.00 0.42 H new ATOM 0 HG12 ILE A 81 -8.835 -1.566 -7.293 1.00 0.56 H new ATOM 0 HG13 ILE A 81 -10.486 -2.071 -6.995 1.00 0.56 H new ATOM 0 HG21 ILE A 81 -8.482 0.256 -4.881 1.00 0.50 H new ATOM 0 HG22 ILE A 81 -7.993 -0.982 -3.700 1.00 0.50 H new ATOM 0 HG23 ILE A 81 -7.317 -1.006 -5.347 1.00 0.50 H new ATOM 0 HD11 ILE A 81 -10.418 0.177 -7.959 1.00 0.71 H new ATOM 0 HD12 ILE A 81 -11.079 0.226 -6.307 1.00 0.71 H new ATOM 0 HD13 ILE A 81 -9.402 0.739 -6.611 1.00 0.71 H new ATOM 1240 N VAL A 82 -7.510 -3.430 -3.112 1.00 0.27 N ATOM 1241 CA VAL A 82 -7.234 -3.670 -1.705 1.00 0.28 C ATOM 1242 C VAL A 82 -6.545 -2.494 -1.056 1.00 0.23 C ATOM 1243 O VAL A 82 -5.475 -2.064 -1.482 1.00 0.26 O ATOM 1244 CB VAL A 82 -6.403 -4.952 -1.472 1.00 0.35 C ATOM 1245 CG1 VAL A 82 -5.776 -4.961 -0.077 1.00 1.02 C ATOM 1246 CG2 VAL A 82 -7.300 -6.158 -1.647 1.00 1.17 C ATOM 0 H VAL A 82 -6.690 -3.238 -3.688 1.00 0.27 H new ATOM 0 HA VAL A 82 -8.208 -3.809 -1.236 1.00 0.28 H new ATOM 0 HB VAL A 82 -5.592 -4.982 -2.199 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -5.198 -5.875 0.056 1.00 1.02 H new ATOM 0 HG12 VAL A 82 -5.120 -4.098 0.032 1.00 1.02 H new ATOM 0 HG13 VAL A 82 -6.563 -4.916 0.676 1.00 1.02 H new ATOM 0 HG21 VAL A 82 -6.722 -7.068 -1.484 1.00 1.17 H new ATOM 0 HG22 VAL A 82 -8.116 -6.112 -0.926 1.00 1.17 H new ATOM 0 HG23 VAL A 82 -7.709 -6.164 -2.657 1.00 1.17 H new ATOM 1256 N ILE A 83 -7.183 -1.977 -0.028 1.00 0.22 N ATOM 1257 CA ILE A 83 -6.575 -0.984 0.821 1.00 0.19 C ATOM 1258 C ILE A 83 -5.713 -1.666 1.845 1.00 0.19 C ATOM 1259 O ILE A 83 -6.088 -2.691 2.397 1.00 0.24 O ATOM 1260 CB ILE A 83 -7.620 -0.104 1.538 1.00 0.22 C ATOM 1261 CG1 ILE A 83 -8.248 0.821 0.520 1.00 0.27 C ATOM 1262 CG2 ILE A 83 -6.992 0.691 2.683 1.00 0.24 C ATOM 1263 CD1 ILE A 83 -9.107 1.912 1.125 1.00 0.37 C ATOM 0 H ILE A 83 -8.133 -2.234 0.239 1.00 0.22 H new ATOM 0 HA ILE A 83 -5.976 -0.331 0.186 1.00 0.19 H new ATOM 0 HB ILE A 83 -8.385 -0.742 1.980 1.00 0.22 H new ATOM 0 HG12 ILE A 83 -7.458 1.282 -0.073 1.00 0.27 H new ATOM 0 HG13 ILE A 83 -8.857 0.231 -0.165 1.00 0.27 H new ATOM 0 HG21 ILE A 83 -7.757 1.300 3.166 1.00 0.24 H new ATOM 0 HG22 ILE A 83 -6.563 0.003 3.411 1.00 0.24 H new ATOM 0 HG23 ILE A 83 -6.208 1.338 2.290 1.00 0.24 H new ATOM 0 HD11 ILE A 83 -9.521 2.532 0.330 1.00 0.37 H new ATOM 0 HD12 ILE A 83 -9.920 1.461 1.694 1.00 0.37 H new ATOM 0 HD13 ILE A 83 -8.499 2.529 1.787 1.00 0.37 H new ATOM 1275 N LEU A 84 -4.552 -1.114 2.084 1.00 0.19 N ATOM 1276 CA LEU A 84 -3.673 -1.655 3.074 1.00 0.23 C ATOM 1277 C LEU A 84 -3.349 -0.555 4.082 1.00 0.24 C ATOM 1278 O LEU A 84 -2.612 0.385 3.784 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.430 -2.248 2.396 1.00 0.39 C ATOM 1280 CG LEU A 84 -1.355 -2.818 3.325 1.00 0.31 C ATOM 1281 CD1 LEU A 84 -0.469 -1.700 3.818 1.00 0.91 C ATOM 1282 CD2 LEU A 84 -1.972 -3.577 4.498 1.00 1.01 C ATOM 0 H LEU A 84 -4.197 -0.288 1.602 1.00 0.19 H new ATOM 0 HA LEU A 84 -4.142 -2.475 3.619 1.00 0.23 H new ATOM 0 HB2 LEU A 84 -2.754 -3.041 1.722 1.00 0.39 H new ATOM 0 HB3 LEU A 84 -1.974 -1.473 1.781 1.00 0.39 H new ATOM 0 HG LEU A 84 -0.754 -3.531 2.760 1.00 0.31 H new ATOM 0 HD11 LEU A 84 0.296 -2.107 4.479 1.00 0.91 H new ATOM 0 HD12 LEU A 84 0.008 -1.212 2.968 1.00 0.91 H new ATOM 0 HD13 LEU A 84 -1.070 -0.973 4.363 1.00 0.91 H new ATOM 0 HD21 LEU A 84 -1.179 -3.967 5.136 1.00 1.01 H new ATOM 0 HD22 LEU A 84 -2.604 -2.902 5.076 1.00 1.01 H new ATOM 0 HD23 LEU A 84 -2.574 -4.404 4.120 1.00 1.01 H new ATOM 1294 N VAL A 85 -3.952 -0.656 5.250 1.00 0.21 N ATOM 1295 CA VAL A 85 -3.779 0.329 6.299 1.00 0.27 C ATOM 1296 C VAL A 85 -2.573 -0.006 7.168 1.00 0.25 C ATOM 1297 O VAL A 85 -2.575 -0.988 7.913 1.00 0.29 O ATOM 1298 CB VAL A 85 -5.042 0.413 7.179 1.00 0.34 C ATOM 1299 CG1 VAL A 85 -4.835 1.392 8.317 1.00 0.43 C ATOM 1300 CG2 VAL A 85 -6.248 0.814 6.344 1.00 0.40 C ATOM 0 H VAL A 85 -4.576 -1.424 5.499 1.00 0.21 H new ATOM 0 HA VAL A 85 -3.611 1.295 5.822 1.00 0.27 H new ATOM 0 HB VAL A 85 -5.230 -0.573 7.604 1.00 0.34 H new ATOM 0 HG11 VAL A 85 -5.737 1.437 8.927 1.00 0.43 H new ATOM 0 HG12 VAL A 85 -3.998 1.063 8.932 1.00 0.43 H new ATOM 0 HG13 VAL A 85 -4.621 2.381 7.912 1.00 0.43 H new ATOM 0 HG21 VAL A 85 -7.130 0.868 6.982 1.00 0.40 H new ATOM 0 HG22 VAL A 85 -6.068 1.788 5.890 1.00 0.40 H new ATOM 0 HG23 VAL A 85 -6.411 0.073 5.561 1.00 0.40 H new ATOM 1310 N VAL A 86 -1.532 0.802 7.042 1.00 0.22 N ATOM 1311 CA VAL A 86 -0.366 0.683 7.887 1.00 0.20 C ATOM 1312 C VAL A 86 -0.126 1.968 8.657 1.00 0.17 C ATOM 1313 O VAL A 86 0.052 3.037 8.075 1.00 0.22 O ATOM 1314 CB VAL A 86 0.901 0.340 7.085 1.00 0.23 C ATOM 1315 CG1 VAL A 86 0.994 -1.154 6.849 1.00 0.49 C ATOM 1316 CG2 VAL A 86 0.933 1.092 5.762 1.00 0.64 C ATOM 0 H VAL A 86 -1.476 1.553 6.354 1.00 0.22 H new ATOM 0 HA VAL A 86 -0.568 -0.134 8.579 1.00 0.20 H new ATOM 0 HB VAL A 86 1.765 0.653 7.672 1.00 0.23 H new ATOM 0 HG11 VAL A 86 1.897 -1.377 6.280 1.00 0.49 H new ATOM 0 HG12 VAL A 86 1.032 -1.672 7.807 1.00 0.49 H new ATOM 0 HG13 VAL A 86 0.121 -1.489 6.290 1.00 0.49 H new ATOM 0 HG21 VAL A 86 1.840 0.830 5.216 1.00 0.64 H new ATOM 0 HG22 VAL A 86 0.061 0.820 5.168 1.00 0.64 H new ATOM 0 HG23 VAL A 86 0.922 2.165 5.953 1.00 0.64 H new ATOM 1326 N ALA A 87 -0.142 1.865 9.970 1.00 0.17 N ATOM 1327 CA ALA A 87 0.193 2.990 10.816 1.00 0.18 C ATOM 1328 C ALA A 87 1.674 3.294 10.668 1.00 0.16 C ATOM 1329 O ALA A 87 2.510 2.402 10.814 1.00 0.24 O ATOM 1330 CB ALA A 87 -0.167 2.688 12.257 1.00 0.28 C ATOM 0 H ALA A 87 -0.384 1.012 10.474 1.00 0.17 H new ATOM 0 HA ALA A 87 -0.378 3.867 10.513 1.00 0.18 H new ATOM 0 HB1 ALA A 87 0.090 3.542 12.883 1.00 0.28 H new ATOM 0 HB2 ALA A 87 -1.237 2.492 12.331 1.00 0.28 H new ATOM 0 HB3 ALA A 87 0.386 1.812 12.594 1.00 0.28 H new ATOM 1336 N ALA A 88 2.003 4.545 10.378 1.00 0.12 N ATOM 1337 CA ALA A 88 3.370 4.908 10.033 1.00 0.14 C ATOM 1338 C ALA A 88 4.281 4.832 11.234 1.00 0.16 C ATOM 1339 O ALA A 88 5.500 4.906 11.107 1.00 0.22 O ATOM 1340 CB ALA A 88 3.423 6.300 9.440 1.00 0.17 C ATOM 0 H ALA A 88 1.344 5.324 10.375 1.00 0.12 H new ATOM 0 HA ALA A 88 3.718 4.190 9.290 1.00 0.14 H new ATOM 0 HB1 ALA A 88 4.454 6.550 9.190 1.00 0.17 H new ATOM 0 HB2 ALA A 88 2.812 6.335 8.538 1.00 0.17 H new ATOM 0 HB3 ALA A 88 3.041 7.019 10.165 1.00 0.17 H new ATOM 1346 N ASP A 89 3.689 4.697 12.400 1.00 0.16 N ATOM 1347 CA ASP A 89 4.478 4.627 13.622 1.00 0.21 C ATOM 1348 C ASP A 89 4.745 3.173 14.016 1.00 0.22 C ATOM 1349 O ASP A 89 5.382 2.901 15.034 1.00 0.37 O ATOM 1350 CB ASP A 89 3.781 5.375 14.765 1.00 0.30 C ATOM 1351 CG ASP A 89 2.728 4.547 15.470 1.00 0.39 C ATOM 1352 OD1 ASP A 89 1.922 3.895 14.785 1.00 0.47 O ATOM 1353 OD2 ASP A 89 2.697 4.560 16.722 1.00 0.58 O ATOM 0 H ASP A 89 2.680 4.634 12.534 1.00 0.16 H new ATOM 0 HA ASP A 89 5.436 5.110 13.431 1.00 0.21 H new ATOM 0 HB2 ASP A 89 4.529 5.693 15.491 1.00 0.30 H new ATOM 0 HB3 ASP A 89 3.317 6.278 14.369 1.00 0.30 H new ATOM 1358 N ASP A 90 4.271 2.240 13.191 1.00 0.19 N ATOM 1359 CA ASP A 90 4.439 0.815 13.471 1.00 0.23 C ATOM 1360 C ASP A 90 4.898 0.064 12.225 1.00 0.25 C ATOM 1361 O ASP A 90 5.898 -0.653 12.255 1.00 0.42 O ATOM 1362 CB ASP A 90 3.141 0.224 14.008 1.00 0.26 C ATOM 1363 CG ASP A 90 3.353 -1.098 14.716 1.00 0.36 C ATOM 1364 OD1 ASP A 90 4.388 -1.244 15.400 1.00 0.56 O ATOM 1365 OD2 ASP A 90 2.478 -1.981 14.607 1.00 0.46 O ATOM 0 H ASP A 90 3.770 2.444 12.327 1.00 0.19 H new ATOM 0 HA ASP A 90 5.212 0.705 14.232 1.00 0.23 H new ATOM 0 HB2 ASP A 90 2.682 0.932 14.698 1.00 0.26 H new ATOM 0 HB3 ASP A 90 2.442 0.083 13.184 1.00 0.26 H new ATOM 1370 N GLY A 91 4.172 0.245 11.126 1.00 0.20 N ATOM 1371 CA GLY A 91 4.590 -0.310 9.852 1.00 0.21 C ATOM 1372 C GLY A 91 3.919 -1.628 9.517 1.00 0.22 C ATOM 1373 O GLY A 91 2.853 -1.936 10.035 1.00 0.37 O ATOM 0 H GLY A 91 3.297 0.769 11.096 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.374 0.410 9.063 1.00 0.21 H new ATOM 0 HA3 GLY A 91 5.670 -0.454 9.864 1.00 0.21 H new ATOM 1377 N VAL A 92 4.536 -2.407 8.639 1.00 0.26 N ATOM 1378 CA VAL A 92 3.979 -3.696 8.249 1.00 0.26 C ATOM 1379 C VAL A 92 4.283 -4.734 9.327 1.00 0.24 C ATOM 1380 O VAL A 92 5.388 -4.791 9.878 1.00 0.28 O ATOM 1381 CB VAL A 92 4.504 -4.162 6.870 1.00 0.32 C ATOM 1382 CG1 VAL A 92 5.947 -4.629 6.953 1.00 0.96 C ATOM 1383 CG2 VAL A 92 3.613 -5.252 6.295 1.00 1.03 C ATOM 0 H VAL A 92 5.418 -2.171 8.185 1.00 0.26 H new ATOM 0 HA VAL A 92 2.899 -3.583 8.152 1.00 0.26 H new ATOM 0 HB VAL A 92 4.475 -3.305 6.197 1.00 0.32 H new ATOM 0 HG11 VAL A 92 6.283 -4.949 5.967 1.00 0.96 H new ATOM 0 HG12 VAL A 92 6.575 -3.809 7.302 1.00 0.96 H new ATOM 0 HG13 VAL A 92 6.020 -5.464 7.650 1.00 0.96 H new ATOM 0 HG21 VAL A 92 4.000 -5.565 5.325 1.00 1.03 H new ATOM 0 HG22 VAL A 92 3.599 -6.106 6.973 1.00 1.03 H new ATOM 0 HG23 VAL A 92 2.600 -4.868 6.174 1.00 1.03 H new ATOM 1393 N MET A 93 3.283 -5.533 9.630 1.00 0.22 N ATOM 1394 CA MET A 93 3.320 -6.468 10.745 1.00 0.22 C ATOM 1395 C MET A 93 2.727 -7.806 10.288 1.00 0.22 C ATOM 1396 O MET A 93 2.298 -7.910 9.138 1.00 0.23 O ATOM 1397 CB MET A 93 2.520 -5.868 11.906 1.00 0.21 C ATOM 1398 CG MET A 93 3.023 -4.506 12.351 1.00 0.23 C ATOM 1399 SD MET A 93 4.510 -4.614 13.357 1.00 0.28 S ATOM 1400 CE MET A 93 3.793 -5.190 14.889 1.00 0.27 C ATOM 0 H MET A 93 2.408 -5.556 9.105 1.00 0.22 H new ATOM 0 HA MET A 93 4.342 -6.644 11.080 1.00 0.22 H new ATOM 0 HB2 MET A 93 1.475 -5.781 11.609 1.00 0.21 H new ATOM 0 HB3 MET A 93 2.555 -6.553 12.753 1.00 0.21 H new ATOM 0 HG2 MET A 93 3.226 -3.893 11.473 1.00 0.23 H new ATOM 0 HG3 MET A 93 2.241 -4.001 12.918 1.00 0.23 H new ATOM 0 HE1 MET A 93 4.057 -4.504 15.694 1.00 0.27 H new ATOM 0 HE2 MET A 93 2.708 -5.233 14.790 1.00 0.27 H new ATOM 0 HE3 MET A 93 4.176 -6.184 15.119 1.00 0.27 H new ATOM 1410 N PRO A 94 2.699 -8.844 11.156 1.00 0.25 N ATOM 1411 CA PRO A 94 2.181 -10.179 10.805 1.00 0.30 C ATOM 1412 C PRO A 94 0.908 -10.171 9.950 1.00 0.28 C ATOM 1413 O PRO A 94 0.937 -10.598 8.790 1.00 0.31 O ATOM 1414 CB PRO A 94 1.904 -10.798 12.169 1.00 0.37 C ATOM 1415 CG PRO A 94 2.949 -10.215 13.055 1.00 0.58 C ATOM 1416 CD PRO A 94 3.209 -8.820 12.545 1.00 0.30 C ATOM 0 HA PRO A 94 2.893 -10.723 10.184 1.00 0.30 H new ATOM 0 HB2 PRO A 94 0.902 -10.553 12.521 1.00 0.37 H new ATOM 0 HB3 PRO A 94 1.973 -11.885 12.134 1.00 0.37 H new ATOM 0 HG2 PRO A 94 2.612 -10.193 14.091 1.00 0.58 H new ATOM 0 HG3 PRO A 94 3.859 -10.814 13.029 1.00 0.58 H new ATOM 0 HD2 PRO A 94 2.692 -8.073 13.147 1.00 0.30 H new ATOM 0 HD3 PRO A 94 4.271 -8.575 12.576 1.00 0.30 H new ATOM 1424 N GLN A 95 -0.202 -9.679 10.498 1.00 0.29 N ATOM 1425 CA GLN A 95 -1.474 -9.749 9.792 1.00 0.32 C ATOM 1426 C GLN A 95 -1.524 -8.738 8.651 1.00 0.31 C ATOM 1427 O GLN A 95 -2.347 -8.836 7.746 1.00 0.37 O ATOM 1428 CB GLN A 95 -2.656 -9.541 10.742 1.00 0.37 C ATOM 1429 CG GLN A 95 -2.869 -8.108 11.192 1.00 0.45 C ATOM 1430 CD GLN A 95 -4.255 -7.888 11.781 1.00 0.50 C ATOM 1431 OE1 GLN A 95 -5.202 -7.603 11.051 1.00 0.75 O ATOM 1432 NE2 GLN A 95 -4.395 -7.988 13.100 1.00 0.34 N ATOM 0 H GLN A 95 -0.244 -9.234 11.415 1.00 0.29 H new ATOM 0 HA GLN A 95 -1.555 -10.750 9.369 1.00 0.32 H new ATOM 0 HB2 GLN A 95 -3.564 -9.891 10.251 1.00 0.37 H new ATOM 0 HB3 GLN A 95 -2.509 -10.165 11.623 1.00 0.37 H new ATOM 0 HG2 GLN A 95 -2.115 -7.847 11.935 1.00 0.45 H new ATOM 0 HG3 GLN A 95 -2.726 -7.438 10.344 1.00 0.45 H new ATOM 0 HE21 GLN A 95 -3.592 -8.226 13.682 1.00 0.34 H new ATOM 0 HE22 GLN A 95 -5.306 -7.827 13.530 1.00 0.34 H new ATOM 1441 N THR A 96 -0.622 -7.774 8.704 1.00 0.26 N ATOM 1442 CA THR A 96 -0.505 -6.772 7.662 1.00 0.25 C ATOM 1443 C THR A 96 0.035 -7.418 6.402 1.00 0.25 C ATOM 1444 O THR A 96 -0.456 -7.182 5.294 1.00 0.31 O ATOM 1445 CB THR A 96 0.442 -5.653 8.096 1.00 0.25 C ATOM 1446 OG1 THR A 96 0.550 -5.661 9.514 1.00 0.24 O ATOM 1447 CG2 THR A 96 -0.067 -4.301 7.638 1.00 0.28 C ATOM 0 H THR A 96 0.046 -7.665 9.467 1.00 0.26 H new ATOM 0 HA THR A 96 -1.491 -6.348 7.474 1.00 0.25 H new ATOM 0 HB THR A 96 1.417 -5.824 7.640 1.00 0.25 H new ATOM 0 HG1 THR A 96 0.982 -4.834 9.814 1.00 0.24 H new ATOM 0 HG21 THR A 96 0.626 -3.523 7.960 1.00 0.28 H new ATOM 0 HG22 THR A 96 -0.144 -4.291 6.551 1.00 0.28 H new ATOM 0 HG23 THR A 96 -1.049 -4.115 8.073 1.00 0.28 H new ATOM 1455 N VAL A 97 1.046 -8.255 6.581 1.00 0.25 N ATOM 1456 CA VAL A 97 1.628 -8.970 5.476 1.00 0.31 C ATOM 1457 C VAL A 97 0.668 -9.993 4.919 1.00 0.23 C ATOM 1458 O VAL A 97 0.595 -10.180 3.714 1.00 0.24 O ATOM 1459 CB VAL A 97 2.909 -9.705 5.852 1.00 0.48 C ATOM 1460 CG1 VAL A 97 3.535 -10.233 4.595 1.00 1.02 C ATOM 1461 CG2 VAL A 97 3.868 -8.803 6.587 1.00 1.38 C ATOM 0 H VAL A 97 1.475 -8.450 7.486 1.00 0.25 H new ATOM 0 HA VAL A 97 1.858 -8.207 4.733 1.00 0.31 H new ATOM 0 HB VAL A 97 2.669 -10.527 6.526 1.00 0.48 H new ATOM 0 HG11 VAL A 97 4.455 -10.763 4.842 1.00 1.02 H new ATOM 0 HG12 VAL A 97 2.843 -10.916 4.103 1.00 1.02 H new ATOM 0 HG13 VAL A 97 3.763 -9.403 3.926 1.00 1.02 H new ATOM 0 HG21 VAL A 97 4.770 -9.360 6.840 1.00 1.38 H new ATOM 0 HG22 VAL A 97 4.130 -7.956 5.953 1.00 1.38 H new ATOM 0 HG23 VAL A 97 3.398 -8.440 7.501 1.00 1.38 H new ATOM 1471 N GLU A 98 -0.063 -10.662 5.803 1.00 0.24 N ATOM 1472 CA GLU A 98 -1.041 -11.667 5.378 1.00 0.29 C ATOM 1473 C GLU A 98 -2.016 -11.062 4.374 1.00 0.31 C ATOM 1474 O GLU A 98 -2.540 -11.754 3.503 1.00 0.37 O ATOM 1475 CB GLU A 98 -1.815 -12.231 6.578 1.00 0.39 C ATOM 1476 CG GLU A 98 -0.971 -13.054 7.538 1.00 0.92 C ATOM 1477 CD GLU A 98 -1.794 -13.677 8.654 1.00 1.64 C ATOM 1478 OE1 GLU A 98 -2.462 -14.706 8.406 1.00 1.97 O ATOM 1479 OE2 GLU A 98 -1.777 -13.144 9.782 1.00 2.35 O ATOM 0 H GLU A 98 -0.001 -10.531 6.813 1.00 0.24 H new ATOM 0 HA GLU A 98 -0.497 -12.485 4.906 1.00 0.29 H new ATOM 0 HB2 GLU A 98 -2.265 -11.403 7.126 1.00 0.39 H new ATOM 0 HB3 GLU A 98 -2.632 -12.851 6.209 1.00 0.39 H new ATOM 0 HG2 GLU A 98 -0.462 -13.842 6.984 1.00 0.92 H new ATOM 0 HG3 GLU A 98 -0.198 -12.419 7.972 1.00 0.92 H new ATOM 1486 N ALA A 99 -2.237 -9.760 4.496 1.00 0.31 N ATOM 1487 CA ALA A 99 -3.072 -9.031 3.561 1.00 0.35 C ATOM 1488 C ALA A 99 -2.368 -8.854 2.223 1.00 0.34 C ATOM 1489 O ALA A 99 -2.970 -9.049 1.168 1.00 0.44 O ATOM 1490 CB ALA A 99 -3.455 -7.685 4.150 1.00 0.39 C ATOM 0 H ALA A 99 -1.844 -9.186 5.242 1.00 0.31 H new ATOM 0 HA ALA A 99 -3.979 -9.608 3.384 1.00 0.35 H new ATOM 0 HB1 ALA A 99 -4.082 -7.143 3.442 1.00 0.39 H new ATOM 0 HB2 ALA A 99 -4.005 -7.837 5.079 1.00 0.39 H new ATOM 0 HB3 ALA A 99 -2.554 -7.107 4.353 1.00 0.39 H new ATOM 1496 N ILE A 100 -1.076 -8.531 2.266 1.00 0.28 N ATOM 1497 CA ILE A 100 -0.306 -8.312 1.059 1.00 0.29 C ATOM 1498 C ILE A 100 -0.075 -9.637 0.355 1.00 0.29 C ATOM 1499 O ILE A 100 -0.173 -9.749 -0.868 1.00 0.34 O ATOM 1500 CB ILE A 100 1.063 -7.706 1.387 1.00 0.32 C ATOM 1501 CG1 ILE A 100 0.901 -6.346 2.073 1.00 0.35 C ATOM 1502 CG2 ILE A 100 1.880 -7.596 0.114 1.00 0.36 C ATOM 1503 CD1 ILE A 100 2.175 -5.828 2.708 1.00 0.41 C ATOM 0 H ILE A 100 -0.546 -8.417 3.130 1.00 0.28 H new ATOM 0 HA ILE A 100 -0.866 -7.627 0.423 1.00 0.29 H new ATOM 0 HB ILE A 100 1.593 -8.356 2.084 1.00 0.32 H new ATOM 0 HG12 ILE A 100 0.549 -5.619 1.341 1.00 0.35 H new ATOM 0 HG13 ILE A 100 0.130 -6.425 2.839 1.00 0.35 H new ATOM 0 HG21 ILE A 100 2.855 -7.165 0.343 1.00 0.36 H new ATOM 0 HG22 ILE A 100 2.014 -8.587 -0.319 1.00 0.36 H new ATOM 0 HG23 ILE A 100 1.359 -6.956 -0.598 1.00 0.36 H new ATOM 0 HD11 ILE A 100 1.982 -4.862 3.174 1.00 0.41 H new ATOM 0 HD12 ILE A 100 2.517 -6.534 3.465 1.00 0.41 H new ATOM 0 HD13 ILE A 100 2.943 -5.715 1.943 1.00 0.41 H new ATOM 1515 N ASN A 101 0.238 -10.630 1.160 1.00 0.29 N ATOM 1516 CA ASN A 101 0.499 -11.972 0.691 1.00 0.34 C ATOM 1517 C ASN A 101 -0.739 -12.571 0.053 1.00 0.36 C ATOM 1518 O ASN A 101 -0.643 -13.401 -0.843 1.00 0.43 O ATOM 1519 CB ASN A 101 0.994 -12.823 1.866 1.00 0.44 C ATOM 1520 CG ASN A 101 2.497 -12.805 1.995 1.00 0.53 C ATOM 1521 OD1 ASN A 101 3.219 -12.680 1.004 1.00 0.67 O ATOM 1522 ND2 ASN A 101 2.983 -12.925 3.213 1.00 0.64 N ATOM 0 H ASN A 101 0.319 -10.525 2.171 1.00 0.29 H new ATOM 0 HA ASN A 101 1.272 -11.947 -0.077 1.00 0.34 H new ATOM 0 HB2 ASN A 101 0.548 -12.456 2.790 1.00 0.44 H new ATOM 0 HB3 ASN A 101 0.655 -13.851 1.735 1.00 0.44 H new ATOM 0 HD21 ASN A 101 3.992 -12.916 3.363 1.00 0.64 H new ATOM 0 HD22 ASN A 101 2.351 -13.026 4.007 1.00 0.64 H new ATOM 1529 N HIS A 102 -1.906 -12.125 0.500 1.00 0.35 N ATOM 1530 CA HIS A 102 -3.154 -12.533 -0.114 1.00 0.43 C ATOM 1531 C HIS A 102 -3.423 -11.686 -1.356 1.00 0.37 C ATOM 1532 O HIS A 102 -4.013 -12.156 -2.330 1.00 0.41 O ATOM 1533 CB HIS A 102 -4.305 -12.398 0.883 1.00 0.61 C ATOM 1534 CG HIS A 102 -5.529 -13.146 0.465 1.00 1.18 C ATOM 1535 ND1 HIS A 102 -6.058 -14.198 1.177 1.00 2.07 N ATOM 1536 CD2 HIS A 102 -6.326 -12.981 -0.607 1.00 1.10 C ATOM 1537 CE1 HIS A 102 -7.134 -14.648 0.560 1.00 2.50 C ATOM 1538 NE2 HIS A 102 -7.318 -13.925 -0.527 1.00 1.91 N ATOM 0 H HIS A 102 -2.010 -11.482 1.285 1.00 0.35 H new ATOM 0 HA HIS A 102 -3.077 -13.579 -0.411 1.00 0.43 H new ATOM 0 HB2 HIS A 102 -3.979 -12.761 1.858 1.00 0.61 H new ATOM 0 HB3 HIS A 102 -4.553 -11.343 1.003 1.00 0.61 H new ATOM 0 HD2 HIS A 102 -6.207 -12.242 -1.386 1.00 1.10 H new ATOM 0 HE1 HIS A 102 -7.756 -15.467 0.889 1.00 2.50 H new ATOM 0 HE2 HIS A 102 -8.075 -14.048 -1.199 1.00 1.91 H new ATOM 1547 N ALA A 103 -2.984 -10.437 -1.319 1.00 0.37 N ATOM 1548 CA ALA A 103 -3.166 -9.527 -2.441 1.00 0.41 C ATOM 1549 C ALA A 103 -2.338 -9.973 -3.644 1.00 0.40 C ATOM 1550 O ALA A 103 -2.841 -10.026 -4.761 1.00 0.44 O ATOM 1551 CB ALA A 103 -2.806 -8.099 -2.046 1.00 0.47 C ATOM 0 H ALA A 103 -2.497 -10.029 -0.521 1.00 0.37 H new ATOM 0 HA ALA A 103 -4.219 -9.550 -2.723 1.00 0.41 H new ATOM 0 HB1 ALA A 103 -2.950 -7.438 -2.901 1.00 0.47 H new ATOM 0 HB2 ALA A 103 -3.447 -7.776 -1.225 1.00 0.47 H new ATOM 0 HB3 ALA A 103 -1.764 -8.061 -1.729 1.00 0.47 H new ATOM 1557 N LYS A 104 -1.073 -10.309 -3.416 1.00 0.41 N ATOM 1558 CA LYS A 104 -0.206 -10.782 -4.491 1.00 0.49 C ATOM 1559 C LYS A 104 -0.642 -12.151 -4.940 1.00 0.54 C ATOM 1560 O LYS A 104 -0.530 -12.513 -6.111 1.00 0.66 O ATOM 1561 CB LYS A 104 1.236 -10.828 -4.018 1.00 0.61 C ATOM 1562 CG LYS A 104 1.742 -9.475 -3.613 1.00 0.70 C ATOM 1563 CD LYS A 104 1.655 -8.502 -4.782 1.00 0.84 C ATOM 1564 CE LYS A 104 2.325 -7.173 -4.481 1.00 0.99 C ATOM 1565 NZ LYS A 104 3.795 -7.315 -4.327 1.00 1.66 N ATOM 0 H LYS A 104 -0.626 -10.263 -2.500 1.00 0.41 H new ATOM 0 HA LYS A 104 -0.280 -10.092 -5.331 1.00 0.49 H new ATOM 0 HB2 LYS A 104 1.318 -11.513 -3.174 1.00 0.61 H new ATOM 0 HB3 LYS A 104 1.865 -11.226 -4.814 1.00 0.61 H new ATOM 0 HG2 LYS A 104 1.158 -9.098 -2.774 1.00 0.70 H new ATOM 0 HG3 LYS A 104 2.775 -9.553 -3.273 1.00 0.70 H new ATOM 0 HD2 LYS A 104 2.121 -8.950 -5.659 1.00 0.84 H new ATOM 0 HD3 LYS A 104 0.608 -8.330 -5.030 1.00 0.84 H new ATOM 0 HE2 LYS A 104 2.111 -6.468 -5.285 1.00 0.99 H new ATOM 0 HE3 LYS A 104 1.903 -6.753 -3.568 1.00 0.99 H new ATOM 0 HZ1 LYS A 104 4.276 -6.630 -4.944 1.00 1.66 H new ATOM 0 HZ2 LYS A 104 4.059 -7.135 -3.337 1.00 1.66 H new ATOM 0 HZ3 LYS A 104 4.080 -8.279 -4.592 1.00 1.66 H new ATOM 1579 N ALA A 105 -1.128 -12.903 -3.976 1.00 0.51 N ATOM 1580 CA ALA A 105 -1.723 -14.218 -4.245 1.00 0.61 C ATOM 1581 C ALA A 105 -2.832 -14.127 -5.298 1.00 0.62 C ATOM 1582 O ALA A 105 -3.082 -15.084 -6.032 1.00 0.77 O ATOM 1583 CB ALA A 105 -2.268 -14.837 -2.967 1.00 0.65 C ATOM 0 H ALA A 105 -1.128 -12.635 -2.992 1.00 0.51 H new ATOM 0 HA ALA A 105 -0.933 -14.858 -4.637 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -2.704 -15.811 -3.191 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -1.458 -14.959 -2.248 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -3.033 -14.186 -2.545 1.00 0.65 H new ATOM 1589 N ALA A 106 -3.498 -12.976 -5.366 1.00 0.54 N ATOM 1590 CA ALA A 106 -4.545 -12.755 -6.359 1.00 0.64 C ATOM 1591 C ALA A 106 -4.026 -11.934 -7.544 1.00 0.64 C ATOM 1592 O ALA A 106 -4.391 -12.196 -8.691 1.00 0.74 O ATOM 1593 CB ALA A 106 -5.745 -12.073 -5.721 1.00 0.68 C ATOM 0 H ALA A 106 -3.331 -12.184 -4.746 1.00 0.54 H new ATOM 0 HA ALA A 106 -4.856 -13.728 -6.740 1.00 0.64 H new ATOM 0 HB1 ALA A 106 -6.517 -11.915 -6.474 1.00 0.68 H new ATOM 0 HB2 ALA A 106 -6.140 -12.702 -4.923 1.00 0.68 H new ATOM 0 HB3 ALA A 106 -5.440 -11.112 -5.307 1.00 0.68 H new ATOM 1599 N ASN A 107 -3.187 -10.938 -7.227 1.00 0.59 N ATOM 1600 CA ASN A 107 -2.543 -10.044 -8.200 1.00 0.65 C ATOM 1601 C ASN A 107 -3.450 -8.856 -8.462 1.00 0.60 C ATOM 1602 O ASN A 107 -4.109 -8.755 -9.495 1.00 0.85 O ATOM 1603 CB ASN A 107 -2.156 -10.741 -9.502 1.00 0.85 C ATOM 1604 CG ASN A 107 -1.162 -9.950 -10.325 1.00 1.04 C ATOM 1605 OD1 ASN A 107 -1.073 -8.728 -10.220 1.00 1.17 O ATOM 1606 ND2 ASN A 107 -0.415 -10.641 -11.161 1.00 1.41 N ATOM 0 H ASN A 107 -2.931 -10.726 -6.263 1.00 0.59 H new ATOM 0 HA ASN A 107 -1.603 -9.706 -7.763 1.00 0.65 H new ATOM 0 HB2 ASN A 107 -1.732 -11.719 -9.272 1.00 0.85 H new ATOM 0 HB3 ASN A 107 -3.054 -10.914 -10.095 1.00 0.85 H new ATOM 0 HD21 ASN A 107 0.267 -10.163 -11.750 1.00 1.41 H new ATOM 0 HD22 ASN A 107 -0.518 -11.654 -11.219 1.00 1.41 H new ATOM 1613 N VAL A 108 -3.473 -7.964 -7.492 1.00 0.44 N ATOM 1614 CA VAL A 108 -4.373 -6.839 -7.488 1.00 0.42 C ATOM 1615 C VAL A 108 -3.628 -5.563 -7.105 1.00 0.37 C ATOM 1616 O VAL A 108 -2.726 -5.596 -6.264 1.00 0.38 O ATOM 1617 CB VAL A 108 -5.525 -7.093 -6.489 1.00 0.49 C ATOM 1618 CG1 VAL A 108 -5.033 -7.869 -5.280 1.00 1.06 C ATOM 1619 CG2 VAL A 108 -6.129 -5.788 -6.034 1.00 1.35 C ATOM 0 H VAL A 108 -2.859 -8.004 -6.678 1.00 0.44 H new ATOM 0 HA VAL A 108 -4.785 -6.717 -8.490 1.00 0.42 H new ATOM 0 HB VAL A 108 -6.285 -7.682 -7.002 1.00 0.49 H new ATOM 0 HG11 VAL A 108 -5.862 -8.035 -4.592 1.00 1.06 H new ATOM 0 HG12 VAL A 108 -4.632 -8.830 -5.603 1.00 1.06 H new ATOM 0 HG13 VAL A 108 -4.252 -7.300 -4.776 1.00 1.06 H new ATOM 0 HG21 VAL A 108 -6.938 -5.987 -5.331 1.00 1.35 H new ATOM 0 HG22 VAL A 108 -5.364 -5.184 -5.545 1.00 1.35 H new ATOM 0 HG23 VAL A 108 -6.521 -5.249 -6.896 1.00 1.35 H new ATOM 1629 N PRO A 109 -3.976 -4.428 -7.738 1.00 0.35 N ATOM 1630 CA PRO A 109 -3.443 -3.120 -7.361 1.00 0.33 C ATOM 1631 C PRO A 109 -3.875 -2.712 -5.958 1.00 0.28 C ATOM 1632 O PRO A 109 -5.017 -2.961 -5.542 1.00 0.29 O ATOM 1633 CB PRO A 109 -4.032 -2.160 -8.394 1.00 0.37 C ATOM 1634 CG PRO A 109 -4.508 -3.026 -9.509 1.00 0.47 C ATOM 1635 CD PRO A 109 -4.894 -4.333 -8.881 1.00 0.40 C ATOM 0 HA PRO A 109 -2.353 -3.121 -7.347 1.00 0.33 H new ATOM 0 HB2 PRO A 109 -4.851 -1.580 -7.969 1.00 0.37 H new ATOM 0 HB3 PRO A 109 -3.283 -1.448 -8.741 1.00 0.37 H new ATOM 0 HG2 PRO A 109 -5.357 -2.573 -10.020 1.00 0.47 H new ATOM 0 HG3 PRO A 109 -3.726 -3.167 -10.255 1.00 0.47 H new ATOM 0 HD2 PRO A 109 -5.937 -4.337 -8.564 1.00 0.40 H new ATOM 0 HD3 PRO A 109 -4.768 -5.167 -9.572 1.00 0.40 H new ATOM 1643 N ILE A 110 -2.980 -2.069 -5.232 1.00 0.25 N ATOM 1644 CA ILE A 110 -3.234 -1.787 -3.834 1.00 0.21 C ATOM 1645 C ILE A 110 -3.498 -0.298 -3.612 1.00 0.19 C ATOM 1646 O ILE A 110 -3.083 0.556 -4.397 1.00 0.23 O ATOM 1647 CB ILE A 110 -2.041 -2.254 -2.954 1.00 0.23 C ATOM 1648 CG1 ILE A 110 -1.822 -3.771 -3.079 1.00 0.38 C ATOM 1649 CG2 ILE A 110 -2.222 -1.867 -1.490 1.00 0.21 C ATOM 1650 CD1 ILE A 110 -2.906 -4.606 -2.433 1.00 0.60 C ATOM 0 H ILE A 110 -2.082 -1.736 -5.582 1.00 0.25 H new ATOM 0 HA ILE A 110 -4.125 -2.341 -3.540 1.00 0.21 H new ATOM 0 HB ILE A 110 -1.155 -1.739 -3.326 1.00 0.23 H new ATOM 0 HG12 ILE A 110 -1.758 -4.032 -4.135 1.00 0.38 H new ATOM 0 HG13 ILE A 110 -0.863 -4.027 -2.628 1.00 0.38 H new ATOM 0 HG21 ILE A 110 -1.365 -2.214 -0.913 1.00 0.21 H new ATOM 0 HG22 ILE A 110 -2.301 -0.783 -1.407 1.00 0.21 H new ATOM 0 HG23 ILE A 110 -3.131 -2.327 -1.102 1.00 0.21 H new ATOM 0 HD11 ILE A 110 -2.678 -5.664 -2.565 1.00 0.60 H new ATOM 0 HD12 ILE A 110 -2.957 -4.376 -1.369 1.00 0.60 H new ATOM 0 HD13 ILE A 110 -3.865 -4.381 -2.899 1.00 0.60 H new ATOM 1662 N ILE A 111 -4.210 -0.023 -2.544 1.00 0.18 N ATOM 1663 CA ILE A 111 -4.451 1.318 -2.052 1.00 0.18 C ATOM 1664 C ILE A 111 -3.948 1.377 -0.626 1.00 0.16 C ATOM 1665 O ILE A 111 -4.691 1.154 0.326 1.00 0.18 O ATOM 1666 CB ILE A 111 -5.956 1.699 -2.082 1.00 0.25 C ATOM 1667 CG1 ILE A 111 -6.446 1.857 -3.515 1.00 0.32 C ATOM 1668 CG2 ILE A 111 -6.211 2.995 -1.310 1.00 0.27 C ATOM 1669 CD1 ILE A 111 -5.955 3.124 -4.161 1.00 0.37 C ATOM 0 H ILE A 111 -4.651 -0.746 -1.975 1.00 0.18 H new ATOM 0 HA ILE A 111 -3.931 2.027 -2.697 1.00 0.18 H new ATOM 0 HB ILE A 111 -6.507 0.890 -1.603 1.00 0.25 H new ATOM 0 HG12 ILE A 111 -6.115 1.002 -4.104 1.00 0.32 H new ATOM 0 HG13 ILE A 111 -7.536 1.848 -3.525 1.00 0.32 H new ATOM 0 HG21 ILE A 111 -7.273 3.238 -1.348 1.00 0.27 H new ATOM 0 HG22 ILE A 111 -5.905 2.866 -0.272 1.00 0.27 H new ATOM 0 HG23 ILE A 111 -5.637 3.805 -1.760 1.00 0.27 H new ATOM 0 HD11 ILE A 111 -6.335 3.183 -5.181 1.00 0.37 H new ATOM 0 HD12 ILE A 111 -6.308 3.983 -3.591 1.00 0.37 H new ATOM 0 HD13 ILE A 111 -4.865 3.124 -4.180 1.00 0.37 H new ATOM 1681 N VAL A 112 -2.666 1.599 -0.470 1.00 0.16 N ATOM 1682 CA VAL A 112 -2.113 1.684 0.844 1.00 0.18 C ATOM 1683 C VAL A 112 -2.523 2.978 1.470 1.00 0.20 C ATOM 1684 O VAL A 112 -2.625 4.008 0.812 1.00 0.22 O ATOM 1685 CB VAL A 112 -0.592 1.592 0.863 1.00 0.19 C ATOM 1686 CG1 VAL A 112 -0.081 1.669 2.273 1.00 0.26 C ATOM 1687 CG2 VAL A 112 -0.134 0.309 0.230 1.00 0.19 C ATOM 0 H VAL A 112 -1.999 1.722 -1.232 1.00 0.16 H new ATOM 0 HA VAL A 112 -2.498 0.831 1.403 1.00 0.18 H new ATOM 0 HB VAL A 112 -0.193 2.431 0.292 1.00 0.19 H new ATOM 0 HG11 VAL A 112 1.007 1.602 2.270 1.00 0.26 H new ATOM 0 HG12 VAL A 112 -0.385 2.616 2.719 1.00 0.26 H new ATOM 0 HG13 VAL A 112 -0.494 0.845 2.855 1.00 0.26 H new ATOM 0 HG21 VAL A 112 0.955 0.261 0.252 1.00 0.19 H new ATOM 0 HG22 VAL A 112 -0.546 -0.536 0.781 1.00 0.19 H new ATOM 0 HG23 VAL A 112 -0.478 0.270 -0.804 1.00 0.19 H new ATOM 1697 N ALA A 113 -2.743 2.903 2.734 1.00 0.21 N ATOM 1698 CA ALA A 113 -3.170 4.042 3.486 1.00 0.24 C ATOM 1699 C ALA A 113 -2.498 4.052 4.831 1.00 0.25 C ATOM 1700 O ALA A 113 -2.850 3.302 5.741 1.00 0.28 O ATOM 1701 CB ALA A 113 -4.680 4.069 3.598 1.00 0.29 C ATOM 0 H ALA A 113 -2.633 2.050 3.283 1.00 0.21 H new ATOM 0 HA ALA A 113 -2.873 4.952 2.964 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -4.987 4.942 4.173 1.00 0.29 H new ATOM 0 HB2 ALA A 113 -5.118 4.119 2.601 1.00 0.29 H new ATOM 0 HB3 ALA A 113 -5.024 3.165 4.100 1.00 0.29 H new ATOM 1707 N ILE A 114 -1.489 4.888 4.913 1.00 0.24 N ATOM 1708 CA ILE A 114 -0.756 5.087 6.124 1.00 0.27 C ATOM 1709 C ILE A 114 -1.646 5.783 7.125 1.00 0.30 C ATOM 1710 O ILE A 114 -2.379 6.684 6.770 1.00 0.50 O ATOM 1711 CB ILE A 114 0.511 5.927 5.865 1.00 0.33 C ATOM 1712 CG1 ILE A 114 1.548 5.110 5.091 1.00 0.38 C ATOM 1713 CG2 ILE A 114 1.099 6.445 7.162 1.00 0.44 C ATOM 1714 CD1 ILE A 114 1.306 5.053 3.596 1.00 0.59 C ATOM 0 H ILE A 114 -1.157 5.450 4.129 1.00 0.24 H new ATOM 0 HA ILE A 114 -0.443 4.120 6.517 1.00 0.27 H new ATOM 0 HB ILE A 114 0.226 6.788 5.260 1.00 0.33 H new ATOM 0 HG12 ILE A 114 2.536 5.534 5.272 1.00 0.38 H new ATOM 0 HG13 ILE A 114 1.560 4.094 5.485 1.00 0.38 H new ATOM 0 HG21 ILE A 114 1.991 7.034 6.948 1.00 0.44 H new ATOM 0 HG22 ILE A 114 0.365 7.071 7.670 1.00 0.44 H new ATOM 0 HG23 ILE A 114 1.364 5.604 7.803 1.00 0.44 H new ATOM 0 HD11 ILE A 114 2.086 4.455 3.124 1.00 0.59 H new ATOM 0 HD12 ILE A 114 0.334 4.600 3.402 1.00 0.59 H new ATOM 0 HD13 ILE A 114 1.325 6.063 3.186 1.00 0.59 H new ATOM 1726 N ASN A 115 -1.591 5.353 8.357 1.00 0.19 N ATOM 1727 CA ASN A 115 -2.397 5.935 9.407 1.00 0.22 C ATOM 1728 C ASN A 115 -1.463 6.419 10.460 1.00 0.20 C ATOM 1729 O ASN A 115 -0.271 6.101 10.427 1.00 0.22 O ATOM 1730 CB ASN A 115 -3.368 4.896 9.964 1.00 0.33 C ATOM 1731 CG ASN A 115 -4.324 5.504 10.957 1.00 0.84 C ATOM 1732 OD1 ASN A 115 -4.656 6.688 10.869 1.00 1.85 O ATOM 1733 ND2 ASN A 115 -4.778 4.708 11.902 1.00 0.56 N ATOM 0 H ASN A 115 -0.988 4.590 8.665 1.00 0.19 H new ATOM 0 HA ASN A 115 -2.997 6.763 9.029 1.00 0.22 H new ATOM 0 HB2 ASN A 115 -3.930 4.447 9.145 1.00 0.33 H new ATOM 0 HB3 ASN A 115 -2.807 4.093 10.443 1.00 0.33 H new ATOM 0 HD21 ASN A 115 -5.431 5.065 12.599 1.00 0.56 H new ATOM 0 HD22 ASN A 115 -4.476 3.734 11.937 1.00 0.56 H new ATOM 1740 N LYS A 116 -1.988 7.210 11.357 1.00 0.19 N ATOM 1741 CA LYS A 116 -1.224 7.717 12.450 1.00 0.20 C ATOM 1742 C LYS A 116 -0.218 8.766 11.990 1.00 0.21 C ATOM 1743 O LYS A 116 0.877 8.884 12.536 1.00 0.26 O ATOM 1744 CB LYS A 116 -0.582 6.543 13.192 1.00 0.25 C ATOM 1745 CG LYS A 116 -1.557 5.846 14.118 1.00 0.32 C ATOM 1746 CD LYS A 116 -0.872 4.864 15.052 1.00 0.40 C ATOM 1747 CE LYS A 116 -1.879 4.049 15.851 1.00 0.51 C ATOM 1748 NZ LYS A 116 -1.215 3.087 16.771 1.00 0.59 N ATOM 0 H LYS A 116 -2.960 7.518 11.345 1.00 0.19 H new ATOM 0 HA LYS A 116 -1.877 8.239 13.150 1.00 0.20 H new ATOM 0 HB2 LYS A 116 -0.196 5.826 12.468 1.00 0.25 H new ATOM 0 HB3 LYS A 116 0.270 6.903 13.769 1.00 0.25 H new ATOM 0 HG2 LYS A 116 -2.090 6.592 14.708 1.00 0.32 H new ATOM 0 HG3 LYS A 116 -2.303 5.318 13.524 1.00 0.32 H new ATOM 0 HD2 LYS A 116 -0.239 4.192 14.473 1.00 0.40 H new ATOM 0 HD3 LYS A 116 -0.219 5.407 15.736 1.00 0.40 H new ATOM 0 HE2 LYS A 116 -2.514 4.722 16.427 1.00 0.51 H new ATOM 0 HE3 LYS A 116 -2.530 3.505 15.166 1.00 0.51 H new ATOM 0 HZ1 LYS A 116 -1.570 2.127 16.585 1.00 0.59 H new ATOM 0 HZ2 LYS A 116 -0.187 3.112 16.616 1.00 0.59 H new ATOM 0 HZ3 LYS A 116 -1.423 3.349 17.756 1.00 0.59 H new ATOM 1762 N MET A 117 -0.614 9.520 10.965 1.00 0.21 N ATOM 1763 CA MET A 117 0.083 10.750 10.585 1.00 0.28 C ATOM 1764 C MET A 117 -0.239 11.846 11.583 1.00 0.29 C ATOM 1765 O MET A 117 0.386 12.906 11.600 1.00 0.37 O ATOM 1766 CB MET A 117 -0.316 11.192 9.178 1.00 0.38 C ATOM 1767 CG MET A 117 0.420 10.437 8.093 1.00 0.48 C ATOM 1768 SD MET A 117 2.114 10.990 7.908 1.00 0.77 S ATOM 1769 CE MET A 117 2.885 9.405 7.700 1.00 0.92 C ATOM 0 H MET A 117 -1.419 9.299 10.379 1.00 0.21 H new ATOM 0 HA MET A 117 1.156 10.556 10.589 1.00 0.28 H new ATOM 0 HB2 MET A 117 -1.389 11.050 9.049 1.00 0.38 H new ATOM 0 HB3 MET A 117 -0.120 12.259 9.068 1.00 0.38 H new ATOM 0 HG2 MET A 117 0.411 9.372 8.325 1.00 0.48 H new ATOM 0 HG3 MET A 117 -0.106 10.561 7.146 1.00 0.48 H new ATOM 0 HE1 MET A 117 3.967 9.513 7.781 1.00 0.92 H new ATOM 0 HE2 MET A 117 2.529 8.723 8.472 1.00 0.92 H new ATOM 0 HE3 MET A 117 2.633 9.004 6.718 1.00 0.92 H new ATOM 1779 N ASP A 118 -1.237 11.570 12.411 1.00 0.27 N ATOM 1780 CA ASP A 118 -1.572 12.445 13.533 1.00 0.34 C ATOM 1781 C ASP A 118 -0.485 12.342 14.573 1.00 0.33 C ATOM 1782 O ASP A 118 -0.338 13.205 15.443 1.00 0.47 O ATOM 1783 CB ASP A 118 -2.907 12.049 14.167 1.00 0.39 C ATOM 1784 CG ASP A 118 -2.893 10.652 14.749 1.00 0.55 C ATOM 1785 OD1 ASP A 118 -2.783 9.682 13.965 1.00 0.67 O ATOM 1786 OD2 ASP A 118 -3.033 10.511 15.982 1.00 0.76 O ATOM 0 H ASP A 118 -1.832 10.746 12.329 1.00 0.27 H new ATOM 0 HA ASP A 118 -1.658 13.466 13.162 1.00 0.34 H new ATOM 0 HB2 ASP A 118 -3.155 12.762 14.953 1.00 0.39 H new ATOM 0 HB3 ASP A 118 -3.694 12.116 13.416 1.00 0.39 H new ATOM 1791 N LYS A 119 0.265 11.264 14.482 1.00 0.23 N ATOM 1792 CA LYS A 119 1.356 11.015 15.392 1.00 0.26 C ATOM 1793 C LYS A 119 2.666 11.500 14.796 1.00 0.28 C ATOM 1794 O LYS A 119 2.984 11.207 13.648 1.00 0.26 O ATOM 1795 CB LYS A 119 1.447 9.525 15.706 1.00 0.29 C ATOM 1796 CG LYS A 119 0.200 8.973 16.370 1.00 0.36 C ATOM 1797 CD LYS A 119 0.422 7.568 16.902 1.00 0.72 C ATOM 1798 CE LYS A 119 1.475 7.538 18.000 1.00 0.87 C ATOM 1799 NZ LYS A 119 1.664 6.169 18.545 1.00 1.17 N ATOM 0 H LYS A 119 0.134 10.539 13.776 1.00 0.23 H new ATOM 0 HA LYS A 119 1.169 11.563 16.316 1.00 0.26 H new ATOM 0 HB2 LYS A 119 1.631 8.977 14.782 1.00 0.29 H new ATOM 0 HB3 LYS A 119 2.304 9.350 16.356 1.00 0.29 H new ATOM 0 HG2 LYS A 119 -0.097 9.629 17.188 1.00 0.36 H new ATOM 0 HG3 LYS A 119 -0.621 8.965 15.653 1.00 0.36 H new ATOM 0 HD2 LYS A 119 -0.518 7.173 17.289 1.00 0.72 H new ATOM 0 HD3 LYS A 119 0.730 6.915 16.085 1.00 0.72 H new ATOM 0 HE2 LYS A 119 2.422 7.906 17.606 1.00 0.87 H new ATOM 0 HE3 LYS A 119 1.181 8.212 18.804 1.00 0.87 H new ATOM 0 HZ1 LYS A 119 1.967 6.229 19.538 1.00 1.17 H new ATOM 0 HZ2 LYS A 119 0.767 5.646 18.488 1.00 1.17 H new ATOM 0 HZ3 LYS A 119 2.391 5.672 17.991 1.00 1.17 H new ATOM 1813 N PRO A 120 3.449 12.254 15.583 1.00 0.38 N ATOM 1814 CA PRO A 120 4.773 12.737 15.166 1.00 0.45 C ATOM 1815 C PRO A 120 5.745 11.586 14.927 1.00 0.40 C ATOM 1816 O PRO A 120 6.795 11.755 14.313 1.00 0.45 O ATOM 1817 CB PRO A 120 5.244 13.586 16.347 1.00 0.57 C ATOM 1818 CG PRO A 120 4.418 13.141 17.505 1.00 0.58 C ATOM 1819 CD PRO A 120 3.098 12.713 16.936 1.00 0.48 C ATOM 0 HA PRO A 120 4.727 13.288 14.227 1.00 0.45 H new ATOM 0 HB2 PRO A 120 6.306 13.436 16.541 1.00 0.57 H new ATOM 0 HB3 PRO A 120 5.103 14.649 16.149 1.00 0.57 H new ATOM 0 HG2 PRO A 120 4.899 12.318 18.034 1.00 0.58 H new ATOM 0 HG3 PRO A 120 4.288 13.949 18.224 1.00 0.58 H new ATOM 0 HD2 PRO A 120 2.644 11.917 17.526 1.00 0.48 H new ATOM 0 HD3 PRO A 120 2.385 13.537 16.910 1.00 0.48 H new ATOM 1827 N GLU A 121 5.373 10.413 15.423 1.00 0.35 N ATOM 1828 CA GLU A 121 6.170 9.206 15.253 1.00 0.37 C ATOM 1829 C GLU A 121 5.889 8.572 13.893 1.00 0.30 C ATOM 1830 O GLU A 121 6.324 7.452 13.613 1.00 0.37 O ATOM 1831 CB GLU A 121 5.855 8.222 16.375 1.00 0.48 C ATOM 1832 CG GLU A 121 5.993 8.838 17.751 1.00 0.62 C ATOM 1833 CD GLU A 121 5.732 7.849 18.863 1.00 1.04 C ATOM 1834 OE1 GLU A 121 6.662 7.105 19.228 1.00 1.40 O ATOM 1835 OE2 GLU A 121 4.598 7.822 19.377 1.00 1.45 O ATOM 0 H GLU A 121 4.513 10.272 15.953 1.00 0.35 H new ATOM 0 HA GLU A 121 7.227 9.467 15.296 1.00 0.37 H new ATOM 0 HB2 GLU A 121 4.839 7.848 16.250 1.00 0.48 H new ATOM 0 HB3 GLU A 121 6.522 7.364 16.297 1.00 0.48 H new ATOM 0 HG2 GLU A 121 6.997 9.246 17.862 1.00 0.62 H new ATOM 0 HG3 GLU A 121 5.298 9.672 17.842 1.00 0.62 H new ATOM 1842 N ALA A 122 5.132 9.292 13.079 1.00 0.24 N ATOM 1843 CA ALA A 122 4.863 8.904 11.704 1.00 0.22 C ATOM 1844 C ALA A 122 6.161 8.719 10.935 1.00 0.21 C ATOM 1845 O ALA A 122 6.928 9.669 10.751 1.00 0.26 O ATOM 1846 CB ALA A 122 3.990 9.952 11.030 1.00 0.27 C ATOM 0 H ALA A 122 4.685 10.166 13.356 1.00 0.24 H new ATOM 0 HA ALA A 122 4.332 7.952 11.708 1.00 0.22 H new ATOM 0 HB1 ALA A 122 3.793 9.654 10.000 1.00 0.27 H new ATOM 0 HB2 ALA A 122 3.047 10.041 11.569 1.00 0.27 H new ATOM 0 HB3 ALA A 122 4.504 10.913 11.037 1.00 0.27 H new ATOM 1852 N ASN A 123 6.411 7.491 10.503 1.00 0.21 N ATOM 1853 CA ASN A 123 7.545 7.197 9.645 1.00 0.23 C ATOM 1854 C ASN A 123 6.995 6.611 8.368 1.00 0.23 C ATOM 1855 O ASN A 123 7.080 5.407 8.123 1.00 0.25 O ATOM 1856 CB ASN A 123 8.498 6.196 10.297 1.00 0.26 C ATOM 1857 CG ASN A 123 9.938 6.479 10.025 1.00 0.42 C ATOM 1858 OD1 ASN A 123 10.812 6.142 10.822 1.00 0.95 O ATOM 1859 ND2 ASN A 123 10.210 7.095 8.912 1.00 0.52 N ATOM 0 H ASN A 123 5.839 6.679 10.736 1.00 0.21 H new ATOM 0 HA ASN A 123 8.111 8.110 9.459 1.00 0.23 H new ATOM 0 HB2 ASN A 123 8.333 6.198 11.374 1.00 0.26 H new ATOM 0 HB3 ASN A 123 8.259 5.194 9.940 1.00 0.26 H new ATOM 0 HD21 ASN A 123 11.177 7.315 8.674 1.00 0.52 H new ATOM 0 HD22 ASN A 123 9.456 7.358 8.277 1.00 0.52 H new ATOM 1866 N PRO A 124 6.437 7.476 7.534 1.00 0.25 N ATOM 1867 CA PRO A 124 5.659 7.071 6.373 1.00 0.32 C ATOM 1868 C PRO A 124 6.451 6.278 5.375 1.00 0.33 C ATOM 1869 O PRO A 124 6.168 5.114 5.139 1.00 0.35 O ATOM 1870 CB PRO A 124 5.225 8.389 5.760 1.00 0.40 C ATOM 1871 CG PRO A 124 6.171 9.407 6.290 1.00 0.32 C ATOM 1872 CD PRO A 124 6.518 8.938 7.664 1.00 0.27 C ATOM 0 HA PRO A 124 4.837 6.416 6.660 1.00 0.32 H new ATOM 0 HB2 PRO A 124 5.264 8.347 4.672 1.00 0.40 H new ATOM 0 HB3 PRO A 124 4.197 8.629 6.033 1.00 0.40 H new ATOM 0 HG2 PRO A 124 7.060 9.483 5.663 1.00 0.32 H new ATOM 0 HG3 PRO A 124 5.713 10.396 6.315 1.00 0.32 H new ATOM 0 HD2 PRO A 124 7.514 9.264 7.964 1.00 0.27 H new ATOM 0 HD3 PRO A 124 5.820 9.318 8.410 1.00 0.27 H new ATOM 1880 N ASP A 125 7.450 6.914 4.812 1.00 0.37 N ATOM 1881 CA ASP A 125 8.269 6.305 3.783 1.00 0.44 C ATOM 1882 C ASP A 125 9.025 5.108 4.336 1.00 0.34 C ATOM 1883 O ASP A 125 9.522 4.276 3.584 1.00 0.33 O ATOM 1884 CB ASP A 125 9.241 7.330 3.220 1.00 0.61 C ATOM 1885 CG ASP A 125 8.561 8.648 2.918 1.00 0.99 C ATOM 1886 OD1 ASP A 125 7.952 8.759 1.832 1.00 1.13 O ATOM 1887 OD2 ASP A 125 8.664 9.591 3.735 1.00 1.44 O ATOM 0 H ASP A 125 7.721 7.868 5.052 1.00 0.37 H new ATOM 0 HA ASP A 125 7.618 5.956 2.982 1.00 0.44 H new ATOM 0 HB2 ASP A 125 10.049 7.494 3.933 1.00 0.61 H new ATOM 0 HB3 ASP A 125 9.694 6.938 2.309 1.00 0.61 H new ATOM 1892 N ARG A 126 9.081 5.005 5.657 1.00 0.31 N ATOM 1893 CA ARG A 126 9.727 3.860 6.286 1.00 0.31 C ATOM 1894 C ARG A 126 8.823 2.657 6.135 1.00 0.27 C ATOM 1895 O ARG A 126 9.215 1.636 5.576 1.00 0.30 O ATOM 1896 CB ARG A 126 10.011 4.150 7.763 1.00 0.35 C ATOM 1897 CG ARG A 126 10.705 3.032 8.549 1.00 0.51 C ATOM 1898 CD ARG A 126 9.729 1.970 9.050 1.00 1.24 C ATOM 1899 NE ARG A 126 10.235 1.266 10.230 1.00 1.92 N ATOM 1900 CZ ARG A 126 9.466 0.561 11.069 1.00 2.94 C ATOM 1901 NH1 ARG A 126 8.204 0.284 10.752 1.00 3.49 N ATOM 1902 NH2 ARG A 126 9.968 0.099 12.209 1.00 3.79 N ATOM 0 H ARG A 126 8.693 5.689 6.306 1.00 0.31 H new ATOM 0 HA ARG A 126 10.683 3.659 5.802 1.00 0.31 H new ATOM 0 HB2 ARG A 126 10.628 5.046 7.824 1.00 0.35 H new ATOM 0 HB3 ARG A 126 9.066 4.380 8.255 1.00 0.35 H new ATOM 0 HG2 ARG A 126 11.455 2.560 7.915 1.00 0.51 H new ATOM 0 HG3 ARG A 126 11.233 3.465 9.399 1.00 0.51 H new ATOM 0 HD2 ARG A 126 8.775 2.440 9.291 1.00 1.24 H new ATOM 0 HD3 ARG A 126 9.538 1.250 8.254 1.00 1.24 H new ATOM 0 HE ARG A 126 11.235 1.316 10.425 1.00 1.92 H new ATOM 0 HH11 ARG A 126 7.818 0.609 9.866 1.00 3.49 H new ATOM 0 HH12 ARG A 126 7.623 -0.254 11.395 1.00 3.49 H new ATOM 0 HH21 ARG A 126 10.943 0.281 12.448 1.00 3.79 H new ATOM 0 HH22 ARG A 126 9.379 -0.438 12.845 1.00 3.79 H new ATOM 1916 N VAL A 127 7.600 2.814 6.607 1.00 0.25 N ATOM 1917 CA VAL A 127 6.602 1.748 6.564 1.00 0.28 C ATOM 1918 C VAL A 127 6.140 1.509 5.125 1.00 0.28 C ATOM 1919 O VAL A 127 5.736 0.410 4.740 1.00 0.33 O ATOM 1920 CB VAL A 127 5.416 2.079 7.508 1.00 0.36 C ATOM 1921 CG1 VAL A 127 5.974 2.482 8.854 1.00 0.59 C ATOM 1922 CG2 VAL A 127 4.498 3.181 6.974 1.00 0.44 C ATOM 0 H VAL A 127 7.266 3.679 7.031 1.00 0.25 H new ATOM 0 HA VAL A 127 7.053 0.822 6.920 1.00 0.28 H new ATOM 0 HB VAL A 127 4.798 1.184 7.586 1.00 0.36 H new ATOM 0 HG11 VAL A 127 5.154 2.719 9.532 1.00 0.59 H new ATOM 0 HG12 VAL A 127 6.560 1.660 9.266 1.00 0.59 H new ATOM 0 HG13 VAL A 127 6.612 3.358 8.736 1.00 0.59 H new ATOM 0 HG21 VAL A 127 3.692 3.359 7.685 1.00 0.44 H new ATOM 0 HG22 VAL A 127 5.071 4.098 6.838 1.00 0.44 H new ATOM 0 HG23 VAL A 127 4.076 2.872 6.018 1.00 0.44 H new ATOM 1932 N MET A 128 6.272 2.556 4.340 1.00 0.27 N ATOM 1933 CA MET A 128 5.993 2.547 2.913 1.00 0.31 C ATOM 1934 C MET A 128 6.990 1.652 2.174 1.00 0.26 C ATOM 1935 O MET A 128 6.624 0.870 1.293 1.00 0.35 O ATOM 1936 CB MET A 128 6.090 3.998 2.448 1.00 0.52 C ATOM 1937 CG MET A 128 5.777 4.269 1.002 1.00 0.81 C ATOM 1938 SD MET A 128 5.799 6.048 0.675 1.00 0.67 S ATOM 1939 CE MET A 128 4.614 6.206 -0.655 1.00 0.46 C ATOM 0 H MET A 128 6.585 3.464 4.683 1.00 0.27 H new ATOM 0 HA MET A 128 5.004 2.142 2.702 1.00 0.31 H new ATOM 0 HB2 MET A 128 5.415 4.597 3.060 1.00 0.52 H new ATOM 0 HB3 MET A 128 7.101 4.352 2.649 1.00 0.52 H new ATOM 0 HG2 MET A 128 6.505 3.767 0.365 1.00 0.81 H new ATOM 0 HG3 MET A 128 4.799 3.859 0.752 1.00 0.81 H new ATOM 0 HE1 MET A 128 5.126 6.527 -1.562 1.00 0.46 H new ATOM 0 HE2 MET A 128 4.134 5.243 -0.831 1.00 0.46 H new ATOM 0 HE3 MET A 128 3.859 6.944 -0.384 1.00 0.46 H new ATOM 1949 N GLN A 129 8.254 1.764 2.558 1.00 0.24 N ATOM 1950 CA GLN A 129 9.317 0.944 1.971 1.00 0.27 C ATOM 1951 C GLN A 129 9.240 -0.514 2.422 1.00 0.30 C ATOM 1952 O GLN A 129 9.722 -1.405 1.725 1.00 0.33 O ATOM 1953 CB GLN A 129 10.694 1.514 2.306 1.00 0.32 C ATOM 1954 CG GLN A 129 11.118 2.654 1.396 1.00 0.42 C ATOM 1955 CD GLN A 129 12.380 3.348 1.875 1.00 0.54 C ATOM 1956 OE1 GLN A 129 13.149 3.880 1.076 1.00 1.17 O ATOM 1957 NE2 GLN A 129 12.610 3.334 3.180 1.00 1.31 N ATOM 0 H GLN A 129 8.574 2.415 3.275 1.00 0.24 H new ATOM 0 HA GLN A 129 9.169 0.969 0.891 1.00 0.27 H new ATOM 0 HB2 GLN A 129 10.691 1.866 3.338 1.00 0.32 H new ATOM 0 HB3 GLN A 129 11.434 0.716 2.243 1.00 0.32 H new ATOM 0 HG2 GLN A 129 11.280 2.269 0.389 1.00 0.42 H new ATOM 0 HG3 GLN A 129 10.310 3.382 1.332 1.00 0.42 H new ATOM 0 HE21 GLN A 129 11.947 2.882 3.810 1.00 1.31 H new ATOM 0 HE22 GLN A 129 13.450 3.775 3.555 1.00 1.31 H new ATOM 1966 N GLU A 130 8.643 -0.768 3.582 1.00 0.37 N ATOM 1967 CA GLU A 130 8.453 -2.144 4.031 1.00 0.43 C ATOM 1968 C GLU A 130 7.491 -2.842 3.093 1.00 0.36 C ATOM 1969 O GLU A 130 7.598 -4.042 2.829 1.00 0.35 O ATOM 1970 CB GLU A 130 7.901 -2.196 5.448 1.00 0.61 C ATOM 1971 CG GLU A 130 8.527 -1.180 6.368 1.00 0.63 C ATOM 1972 CD GLU A 130 8.113 -1.367 7.810 1.00 1.04 C ATOM 1973 OE1 GLU A 130 8.720 -2.207 8.504 1.00 1.64 O ATOM 1974 OE2 GLU A 130 7.176 -0.670 8.253 1.00 1.63 O ATOM 0 H GLU A 130 8.288 -0.054 4.219 1.00 0.37 H new ATOM 0 HA GLU A 130 9.422 -2.643 4.026 1.00 0.43 H new ATOM 0 HB2 GLU A 130 6.824 -2.033 5.417 1.00 0.61 H new ATOM 0 HB3 GLU A 130 8.061 -3.194 5.857 1.00 0.61 H new ATOM 0 HG2 GLU A 130 9.612 -1.248 6.294 1.00 0.63 H new ATOM 0 HG3 GLU A 130 8.248 -0.178 6.041 1.00 0.63 H new ATOM 1981 N LEU A 131 6.549 -2.071 2.585 1.00 0.36 N ATOM 1982 CA LEU A 131 5.619 -2.584 1.603 1.00 0.37 C ATOM 1983 C LEU A 131 6.353 -2.933 0.326 1.00 0.29 C ATOM 1984 O LEU A 131 6.050 -3.939 -0.312 1.00 0.32 O ATOM 1985 CB LEU A 131 4.522 -1.569 1.324 1.00 0.49 C ATOM 1986 CG LEU A 131 3.270 -1.696 2.195 1.00 0.71 C ATOM 1987 CD1 LEU A 131 3.611 -1.916 3.655 1.00 1.36 C ATOM 1988 CD2 LEU A 131 2.436 -0.452 2.070 1.00 1.18 C ATOM 0 H LEU A 131 6.409 -1.092 2.836 1.00 0.36 H new ATOM 0 HA LEU A 131 5.156 -3.487 2.000 1.00 0.37 H new ATOM 0 HB2 LEU A 131 4.935 -0.569 1.455 1.00 0.49 H new ATOM 0 HB3 LEU A 131 4.227 -1.657 0.279 1.00 0.49 H new ATOM 0 HG LEU A 131 2.716 -2.565 1.842 1.00 0.71 H new ATOM 0 HD11 LEU A 131 2.692 -2.000 4.235 1.00 1.36 H new ATOM 0 HD12 LEU A 131 4.191 -2.833 3.759 1.00 1.36 H new ATOM 0 HD13 LEU A 131 4.196 -1.073 4.023 1.00 1.36 H new ATOM 0 HD21 LEU A 131 1.546 -0.547 2.692 1.00 1.18 H new ATOM 0 HD22 LEU A 131 3.017 0.410 2.397 1.00 1.18 H new ATOM 0 HD23 LEU A 131 2.139 -0.316 1.030 1.00 1.18 H new ATOM 2000 N MET A 132 7.347 -2.125 -0.040 1.00 0.25 N ATOM 2001 CA MET A 132 8.096 -2.400 -1.256 1.00 0.26 C ATOM 2002 C MET A 132 9.055 -3.572 -1.049 1.00 0.30 C ATOM 2003 O MET A 132 9.597 -4.113 -2.010 1.00 0.37 O ATOM 2004 CB MET A 132 8.851 -1.169 -1.779 1.00 0.32 C ATOM 2005 CG MET A 132 10.232 -0.966 -1.176 1.00 0.88 C ATOM 2006 SD MET A 132 11.085 0.465 -1.864 1.00 1.60 S ATOM 2007 CE MET A 132 10.925 0.140 -3.620 1.00 1.61 C ATOM 0 H MET A 132 7.644 -1.296 0.475 1.00 0.25 H new ATOM 0 HA MET A 132 7.366 -2.671 -2.019 1.00 0.26 H new ATOM 0 HB2 MET A 132 8.951 -1.254 -2.861 1.00 0.32 H new ATOM 0 HB3 MET A 132 8.250 -0.281 -1.583 1.00 0.32 H new ATOM 0 HG2 MET A 132 10.139 -0.845 -0.097 1.00 0.88 H new ATOM 0 HG3 MET A 132 10.833 -1.859 -1.346 1.00 0.88 H new ATOM 0 HE1 MET A 132 11.689 0.696 -4.164 1.00 1.61 H new ATOM 0 HE2 MET A 132 11.051 -0.927 -3.806 1.00 1.61 H new ATOM 0 HE3 MET A 132 9.938 0.453 -3.959 1.00 1.61 H new ATOM 2017 N GLU A 133 9.236 -3.975 0.208 1.00 0.32 N ATOM 2018 CA GLU A 133 9.964 -5.193 0.518 1.00 0.40 C ATOM 2019 C GLU A 133 9.129 -6.367 0.062 1.00 0.38 C ATOM 2020 O GLU A 133 9.638 -7.382 -0.411 1.00 0.45 O ATOM 2021 CB GLU A 133 10.225 -5.291 2.015 1.00 0.54 C ATOM 2022 CG GLU A 133 11.277 -4.323 2.511 1.00 0.79 C ATOM 2023 CD GLU A 133 12.675 -4.775 2.151 1.00 1.07 C ATOM 2024 OE1 GLU A 133 13.114 -5.823 2.674 1.00 1.53 O ATOM 2025 OE2 GLU A 133 13.335 -4.101 1.336 1.00 1.67 O ATOM 0 H GLU A 133 8.887 -3.472 1.024 1.00 0.32 H new ATOM 0 HA GLU A 133 10.927 -5.190 0.007 1.00 0.40 H new ATOM 0 HB2 GLU A 133 9.293 -5.108 2.551 1.00 0.54 H new ATOM 0 HB3 GLU A 133 10.536 -6.308 2.255 1.00 0.54 H new ATOM 0 HG2 GLU A 133 11.093 -3.337 2.084 1.00 0.79 H new ATOM 0 HG3 GLU A 133 11.196 -4.222 3.593 1.00 0.79 H new ATOM 2032 N TYR A 134 7.824 -6.197 0.199 1.00 0.35 N ATOM 2033 CA TYR A 134 6.868 -7.143 -0.331 1.00 0.40 C ATOM 2034 C TYR A 134 6.471 -6.737 -1.747 1.00 0.41 C ATOM 2035 O TYR A 134 5.405 -7.099 -2.244 1.00 0.50 O ATOM 2036 CB TYR A 134 5.666 -7.213 0.597 1.00 0.46 C ATOM 2037 CG TYR A 134 6.052 -7.630 2.000 1.00 0.55 C ATOM 2038 CD1 TYR A 134 6.730 -8.822 2.219 1.00 0.98 C ATOM 2039 CD2 TYR A 134 5.783 -6.816 3.092 1.00 0.88 C ATOM 2040 CE1 TYR A 134 7.123 -9.193 3.489 1.00 1.08 C ATOM 2041 CE2 TYR A 134 6.184 -7.177 4.365 1.00 0.95 C ATOM 2042 CZ TYR A 134 6.850 -8.368 4.557 1.00 0.80 C ATOM 2043 OH TYR A 134 7.257 -8.730 5.822 1.00 0.95 O ATOM 0 H TYR A 134 7.403 -5.401 0.679 1.00 0.35 H new ATOM 0 HA TYR A 134 7.311 -8.137 -0.387 1.00 0.40 H new ATOM 0 HB2 TYR A 134 5.177 -6.239 0.630 1.00 0.46 H new ATOM 0 HB3 TYR A 134 4.940 -7.920 0.196 1.00 0.46 H new ATOM 0 HD1 TYR A 134 6.953 -9.468 1.383 1.00 0.98 H new ATOM 0 HD2 TYR A 134 5.253 -5.887 2.945 1.00 0.88 H new ATOM 0 HE1 TYR A 134 7.643 -10.127 3.644 1.00 1.08 H new ATOM 0 HE2 TYR A 134 5.976 -6.529 5.204 1.00 0.95 H new ATOM 0 HH TYR A 134 6.988 -8.039 6.463 1.00 0.95 H new ATOM 2053 N ASN A 135 7.371 -5.970 -2.373 1.00 0.36 N ATOM 2054 CA ASN A 135 7.241 -5.504 -3.748 1.00 0.43 C ATOM 2055 C ASN A 135 5.927 -4.759 -3.976 1.00 0.48 C ATOM 2056 O ASN A 135 5.169 -5.059 -4.896 1.00 0.64 O ATOM 2057 CB ASN A 135 7.403 -6.677 -4.723 1.00 0.58 C ATOM 2058 CG ASN A 135 7.532 -6.249 -6.167 1.00 0.71 C ATOM 2059 OD1 ASN A 135 7.915 -5.116 -6.470 1.00 0.89 O ATOM 2060 ND2 ASN A 135 7.249 -7.169 -7.069 1.00 1.10 N ATOM 0 H ASN A 135 8.229 -5.651 -1.922 1.00 0.36 H new ATOM 0 HA ASN A 135 8.040 -4.787 -3.938 1.00 0.43 H new ATOM 0 HB2 ASN A 135 8.285 -7.252 -4.443 1.00 0.58 H new ATOM 0 HB3 ASN A 135 6.545 -7.342 -4.625 1.00 0.58 H new ATOM 0 HD21 ASN A 135 7.344 -6.956 -8.062 1.00 1.10 H new ATOM 0 HD22 ASN A 135 6.935 -8.093 -6.773 1.00 1.10 H new ATOM 2067 N LEU A 136 5.651 -3.810 -3.098 1.00 0.44 N ATOM 2068 CA LEU A 136 4.555 -2.889 -3.286 1.00 0.54 C ATOM 2069 C LEU A 136 5.101 -1.513 -3.576 1.00 0.41 C ATOM 2070 O LEU A 136 5.688 -0.872 -2.704 1.00 0.47 O ATOM 2071 CB LEU A 136 3.691 -2.849 -2.049 1.00 0.78 C ATOM 2072 CG LEU A 136 2.913 -4.120 -1.770 1.00 0.64 C ATOM 2073 CD1 LEU A 136 2.451 -4.135 -0.328 1.00 1.36 C ATOM 2074 CD2 LEU A 136 1.732 -4.225 -2.719 1.00 1.17 C ATOM 0 H LEU A 136 6.181 -3.661 -2.239 1.00 0.44 H new ATOM 0 HA LEU A 136 3.946 -3.223 -4.126 1.00 0.54 H new ATOM 0 HB2 LEU A 136 4.324 -2.632 -1.189 1.00 0.78 H new ATOM 0 HB3 LEU A 136 2.986 -2.023 -2.143 1.00 0.78 H new ATOM 0 HG LEU A 136 3.560 -4.982 -1.933 1.00 0.64 H new ATOM 0 HD11 LEU A 136 1.893 -5.051 -0.134 1.00 1.36 H new ATOM 0 HD12 LEU A 136 3.317 -4.092 0.332 1.00 1.36 H new ATOM 0 HD13 LEU A 136 1.810 -3.273 -0.142 1.00 1.36 H new ATOM 0 HD21 LEU A 136 1.179 -5.141 -2.511 1.00 1.17 H new ATOM 0 HD22 LEU A 136 1.076 -3.366 -2.580 1.00 1.17 H new ATOM 0 HD23 LEU A 136 2.092 -4.244 -3.748 1.00 1.17 H new ATOM 2086 N VAL A 137 4.922 -1.062 -4.795 1.00 0.31 N ATOM 2087 CA VAL A 137 5.531 0.178 -5.215 1.00 0.27 C ATOM 2088 C VAL A 137 4.509 1.282 -5.394 1.00 0.29 C ATOM 2089 O VAL A 137 3.618 1.208 -6.244 1.00 0.33 O ATOM 2090 CB VAL A 137 6.359 0.000 -6.489 1.00 0.29 C ATOM 2091 CG1 VAL A 137 6.851 1.351 -6.998 1.00 0.43 C ATOM 2092 CG2 VAL A 137 7.517 -0.936 -6.200 1.00 0.41 C ATOM 0 H VAL A 137 4.364 -1.531 -5.509 1.00 0.31 H new ATOM 0 HA VAL A 137 6.206 0.477 -4.413 1.00 0.27 H new ATOM 0 HB VAL A 137 5.740 -0.437 -7.272 1.00 0.29 H new ATOM 0 HG11 VAL A 137 7.438 1.206 -7.905 1.00 0.43 H new ATOM 0 HG12 VAL A 137 5.996 1.990 -7.218 1.00 0.43 H new ATOM 0 HG13 VAL A 137 7.471 1.823 -6.236 1.00 0.43 H new ATOM 0 HG21 VAL A 137 8.112 -1.068 -7.103 1.00 0.41 H new ATOM 0 HG22 VAL A 137 8.141 -0.511 -5.413 1.00 0.41 H new ATOM 0 HG23 VAL A 137 7.131 -1.902 -5.875 1.00 0.41 H new ATOM 2102 N PRO A 138 4.632 2.294 -4.532 1.00 0.34 N ATOM 2103 CA PRO A 138 3.859 3.517 -4.570 1.00 0.43 C ATOM 2104 C PRO A 138 3.723 4.094 -5.956 1.00 0.43 C ATOM 2105 O PRO A 138 4.585 3.925 -6.824 1.00 0.45 O ATOM 2106 CB PRO A 138 4.682 4.469 -3.717 1.00 0.53 C ATOM 2107 CG PRO A 138 5.366 3.605 -2.733 1.00 0.54 C ATOM 2108 CD PRO A 138 5.545 2.276 -3.394 1.00 0.39 C ATOM 0 HA PRO A 138 2.839 3.347 -4.226 1.00 0.43 H new ATOM 0 HB2 PRO A 138 5.400 5.022 -4.323 1.00 0.53 H new ATOM 0 HB3 PRO A 138 4.048 5.205 -3.223 1.00 0.53 H new ATOM 0 HG2 PRO A 138 6.328 4.029 -2.446 1.00 0.54 H new ATOM 0 HG3 PRO A 138 4.775 3.510 -1.822 1.00 0.54 H new ATOM 0 HD2 PRO A 138 6.576 2.132 -3.717 1.00 0.39 H new ATOM 0 HD3 PRO A 138 5.308 1.460 -2.711 1.00 0.39 H new ATOM 2116 N GLU A 139 2.651 4.809 -6.127 1.00 0.48 N ATOM 2117 CA GLU A 139 2.374 5.479 -7.387 1.00 0.56 C ATOM 2118 C GLU A 139 3.248 6.717 -7.513 1.00 0.56 C ATOM 2119 O GLU A 139 3.465 7.229 -8.609 1.00 0.64 O ATOM 2120 CB GLU A 139 0.891 5.824 -7.509 1.00 0.71 C ATOM 2121 CG GLU A 139 0.311 6.501 -6.285 1.00 1.35 C ATOM 2122 CD GLU A 139 0.251 8.013 -6.407 1.00 2.40 C ATOM 2123 OE1 GLU A 139 1.231 8.693 -6.045 1.00 3.08 O ATOM 2124 OE2 GLU A 139 -0.783 8.534 -6.868 1.00 2.78 O ATOM 0 H GLU A 139 1.941 4.951 -5.409 1.00 0.48 H new ATOM 0 HA GLU A 139 2.614 4.804 -8.208 1.00 0.56 H new ATOM 0 HB2 GLU A 139 0.750 6.475 -8.372 1.00 0.71 H new ATOM 0 HB3 GLU A 139 0.331 4.909 -7.705 1.00 0.71 H new ATOM 0 HG2 GLU A 139 -0.694 6.118 -6.108 1.00 1.35 H new ATOM 0 HG3 GLU A 139 0.911 6.237 -5.414 1.00 1.35 H new ATOM 2131 N GLU A 140 3.749 7.183 -6.376 1.00 0.54 N ATOM 2132 CA GLU A 140 4.739 8.247 -6.353 1.00 0.60 C ATOM 2133 C GLU A 140 6.091 7.735 -6.840 1.00 0.56 C ATOM 2134 O GLU A 140 6.933 8.514 -7.278 1.00 0.65 O ATOM 2135 CB GLU A 140 4.884 8.842 -4.941 1.00 0.67 C ATOM 2136 CG GLU A 140 4.793 7.826 -3.822 1.00 0.63 C ATOM 2137 CD GLU A 140 3.375 7.608 -3.344 1.00 1.12 C ATOM 2138 OE1 GLU A 140 2.694 6.717 -3.900 1.00 1.57 O ATOM 2139 OE2 GLU A 140 2.934 8.331 -2.428 1.00 1.27 O ATOM 0 H GLU A 140 3.483 6.837 -5.454 1.00 0.54 H new ATOM 0 HA GLU A 140 4.394 9.033 -7.025 1.00 0.60 H new ATOM 0 HB2 GLU A 140 5.843 9.355 -4.873 1.00 0.67 H new ATOM 0 HB3 GLU A 140 4.109 9.595 -4.796 1.00 0.67 H new ATOM 0 HG2 GLU A 140 5.206 6.877 -4.164 1.00 0.63 H new ATOM 0 HG3 GLU A 140 5.407 8.158 -2.985 1.00 0.63 H new ATOM 2146 N TRP A 141 6.300 6.421 -6.762 1.00 0.47 N ATOM 2147 CA TRP A 141 7.566 5.837 -7.159 1.00 0.49 C ATOM 2148 C TRP A 141 7.448 5.185 -8.531 1.00 0.51 C ATOM 2149 O TRP A 141 8.445 4.816 -9.145 1.00 0.66 O ATOM 2150 CB TRP A 141 8.030 4.832 -6.121 1.00 0.45 C ATOM 2151 CG TRP A 141 8.148 5.401 -4.735 1.00 0.46 C ATOM 2152 CD1 TRP A 141 7.990 6.705 -4.354 1.00 0.54 C ATOM 2153 CD2 TRP A 141 8.452 4.676 -3.546 1.00 0.44 C ATOM 2154 NE1 TRP A 141 8.139 6.824 -2.995 1.00 0.55 N ATOM 2155 CE2 TRP A 141 8.433 5.592 -2.476 1.00 0.49 C ATOM 2156 CE3 TRP A 141 8.728 3.339 -3.281 1.00 0.45 C ATOM 2157 CZ2 TRP A 141 8.675 5.207 -1.164 1.00 0.52 C ATOM 2158 CZ3 TRP A 141 8.972 2.954 -1.979 1.00 0.50 C ATOM 2159 CH2 TRP A 141 8.942 3.886 -0.933 1.00 0.52 C ATOM 0 H TRP A 141 5.608 5.750 -6.428 1.00 0.47 H new ATOM 0 HA TRP A 141 8.310 6.630 -7.225 1.00 0.49 H new ATOM 0 HB2 TRP A 141 7.332 3.995 -6.102 1.00 0.45 H new ATOM 0 HB3 TRP A 141 8.998 4.433 -6.423 1.00 0.45 H new ATOM 0 HD1 TRP A 141 7.778 7.523 -5.026 1.00 0.54 H new ATOM 0 HE1 TRP A 141 8.046 7.688 -2.460 1.00 0.55 H new ATOM 0 HE3 TRP A 141 8.751 2.614 -4.081 1.00 0.45 H new ATOM 0 HZ2 TRP A 141 8.653 5.924 -0.357 1.00 0.52 H new ATOM 0 HZ3 TRP A 141 9.189 1.919 -1.763 1.00 0.50 H new ATOM 0 HH2 TRP A 141 9.134 3.554 0.077 1.00 0.52 H new ATOM 2170 N GLY A 142 6.217 5.034 -9.000 1.00 0.45 N ATOM 2171 CA GLY A 142 5.997 4.581 -10.357 1.00 0.50 C ATOM 2172 C GLY A 142 5.580 3.127 -10.468 1.00 0.45 C ATOM 2173 O GLY A 142 5.752 2.517 -11.522 1.00 0.53 O ATOM 0 H GLY A 142 5.368 5.217 -8.465 1.00 0.45 H new ATOM 0 HA2 GLY A 142 5.229 5.204 -10.816 1.00 0.50 H new ATOM 0 HA3 GLY A 142 6.912 4.730 -10.930 1.00 0.50 H new ATOM 2177 N GLY A 143 5.036 2.555 -9.401 1.00 0.39 N ATOM 2178 CA GLY A 143 4.517 1.210 -9.498 1.00 0.41 C ATOM 2179 C GLY A 143 3.030 1.214 -9.759 1.00 0.45 C ATOM 2180 O GLY A 143 2.565 1.820 -10.726 1.00 0.60 O ATOM 0 H GLY A 143 4.947 2.993 -8.484 1.00 0.39 H new ATOM 0 HA2 GLY A 143 5.028 0.678 -10.300 1.00 0.41 H new ATOM 0 HA3 GLY A 143 4.725 0.670 -8.574 1.00 0.41 H new ATOM 2184 N ASP A 144 2.287 0.564 -8.882 1.00 0.40 N ATOM 2185 CA ASP A 144 0.833 0.534 -8.985 1.00 0.45 C ATOM 2186 C ASP A 144 0.188 0.221 -7.639 1.00 0.33 C ATOM 2187 O ASP A 144 -0.512 -0.786 -7.417 1.00 0.35 O ATOM 2188 CB ASP A 144 0.359 -0.441 -10.075 1.00 0.64 C ATOM 2189 CG ASP A 144 0.975 -1.826 -9.970 1.00 1.33 C ATOM 2190 OD1 ASP A 144 2.043 -2.045 -10.589 1.00 1.91 O ATOM 2191 OD2 ASP A 144 0.391 -2.704 -9.308 1.00 1.91 O ATOM 0 H ASP A 144 2.664 0.048 -8.087 1.00 0.40 H new ATOM 0 HA ASP A 144 0.509 1.531 -9.282 1.00 0.45 H new ATOM 0 HB2 ASP A 144 -0.726 -0.531 -10.022 1.00 0.64 H new ATOM 0 HB3 ASP A 144 0.596 -0.021 -11.053 1.00 0.64 H new ATOM 2196 N THR A 145 0.410 1.138 -6.742 1.00 0.26 N ATOM 2197 CA THR A 145 -0.218 1.120 -5.459 1.00 0.24 C ATOM 2198 C THR A 145 -0.415 2.547 -4.998 1.00 0.27 C ATOM 2199 O THR A 145 0.555 3.264 -4.758 1.00 0.37 O ATOM 2200 CB THR A 145 0.620 0.350 -4.431 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.788 -1.013 -4.849 1.00 0.30 O ATOM 2202 CG2 THR A 145 -0.048 0.396 -3.075 1.00 0.30 C ATOM 0 H THR A 145 1.040 1.927 -6.886 1.00 0.26 H new ATOM 0 HA THR A 145 -1.178 0.611 -5.545 1.00 0.24 H new ATOM 0 HB THR A 145 1.601 0.820 -4.358 1.00 0.25 H new ATOM 0 HG1 THR A 145 0.270 -1.171 -5.666 1.00 0.30 H new ATOM 0 HG21 THR A 145 0.556 -0.154 -2.353 1.00 0.30 H new ATOM 0 HG22 THR A 145 -0.145 1.433 -2.752 1.00 0.30 H new ATOM 0 HG23 THR A 145 -1.037 -0.057 -3.141 1.00 0.30 H new ATOM 2210 N ILE A 146 -1.661 2.972 -4.922 1.00 0.26 N ATOM 2211 CA ILE A 146 -1.959 4.310 -4.496 1.00 0.28 C ATOM 2212 C ILE A 146 -1.736 4.424 -3.006 1.00 0.23 C ATOM 2213 O ILE A 146 -2.573 4.023 -2.197 1.00 0.24 O ATOM 2214 CB ILE A 146 -3.392 4.721 -4.848 1.00 0.36 C ATOM 2215 CG1 ILE A 146 -3.624 4.600 -6.358 1.00 0.53 C ATOM 2216 CG2 ILE A 146 -3.653 6.134 -4.377 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -2.670 5.434 -7.178 1.00 0.63 C ATOM 0 H ILE A 146 -2.477 2.405 -5.151 1.00 0.26 H new ATOM 0 HA ILE A 146 -1.290 4.988 -5.026 1.00 0.28 H new ATOM 0 HB ILE A 146 -4.088 4.052 -4.342 1.00 0.36 H new ATOM 0 HG12 ILE A 146 -3.526 3.555 -6.651 1.00 0.53 H new ATOM 0 HG13 ILE A 146 -4.647 4.900 -6.587 1.00 0.53 H new ATOM 0 HG21 ILE A 146 -4.674 6.419 -4.631 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -3.519 6.188 -3.297 1.00 0.34 H new ATOM 0 HG23 ILE A 146 -2.954 6.815 -4.864 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -2.889 5.302 -8.237 1.00 0.63 H new ATOM 0 HD12 ILE A 146 -2.784 6.485 -6.912 1.00 0.63 H new ATOM 0 HD13 ILE A 146 -1.646 5.118 -6.977 1.00 0.63 H new ATOM 2229 N PHE A 147 -0.572 4.917 -2.665 1.00 0.25 N ATOM 2230 CA PHE A 147 -0.208 5.146 -1.286 1.00 0.30 C ATOM 2231 C PHE A 147 -0.790 6.458 -0.791 1.00 0.32 C ATOM 2232 O PHE A 147 -0.512 7.519 -1.341 1.00 0.50 O ATOM 2233 CB PHE A 147 1.304 5.190 -1.141 1.00 0.41 C ATOM 2234 CG PHE A 147 1.952 3.850 -0.971 1.00 0.33 C ATOM 2235 CD1 PHE A 147 1.999 2.955 -2.017 1.00 0.32 C ATOM 2236 CD2 PHE A 147 2.526 3.494 0.237 1.00 0.37 C ATOM 2237 CE1 PHE A 147 2.607 1.727 -1.870 1.00 0.33 C ATOM 2238 CE2 PHE A 147 3.137 2.267 0.390 1.00 0.36 C ATOM 2239 CZ PHE A 147 3.181 1.383 -0.666 1.00 0.33 C ATOM 0 H PHE A 147 0.153 5.172 -3.336 1.00 0.25 H new ATOM 0 HA PHE A 147 -0.610 4.326 -0.691 1.00 0.30 H new ATOM 0 HB2 PHE A 147 1.727 5.675 -2.021 1.00 0.41 H new ATOM 0 HB3 PHE A 147 1.556 5.813 -0.283 1.00 0.41 H new ATOM 0 HD1 PHE A 147 1.554 3.219 -2.965 1.00 0.32 H new ATOM 0 HD2 PHE A 147 2.495 4.184 1.068 1.00 0.37 H new ATOM 0 HE1 PHE A 147 2.633 1.035 -2.698 1.00 0.33 H new ATOM 0 HE2 PHE A 147 3.581 1.999 1.337 1.00 0.36 H new ATOM 0 HZ PHE A 147 3.664 0.424 -0.550 1.00 0.33 H new ATOM 2249 N CYS A 148 -1.616 6.377 0.225 1.00 0.26 N ATOM 2250 CA CYS A 148 -2.104 7.556 0.901 1.00 0.27 C ATOM 2251 C CYS A 148 -1.575 7.608 2.332 1.00 0.31 C ATOM 2252 O CYS A 148 -1.935 6.790 3.166 1.00 0.53 O ATOM 2253 CB CYS A 148 -3.624 7.564 0.906 1.00 0.30 C ATOM 2254 SG CYS A 148 -4.366 7.672 -0.742 1.00 0.68 S ATOM 0 H CYS A 148 -1.967 5.498 0.605 1.00 0.26 H new ATOM 0 HA CYS A 148 -1.747 8.436 0.366 1.00 0.27 H new ATOM 0 HB2 CYS A 148 -3.980 6.657 1.395 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -3.971 8.406 1.505 1.00 0.30 H new ATOM 0 HG CYS A 148 -5.107 6.625 -0.954 1.00 0.68 H new ATOM 2260 N LYS A 149 -0.712 8.571 2.604 1.00 0.29 N ATOM 2261 CA LYS A 149 -0.124 8.734 3.933 1.00 0.28 C ATOM 2262 C LYS A 149 -1.002 9.645 4.780 1.00 0.28 C ATOM 2263 O LYS A 149 -0.848 10.868 4.773 1.00 0.40 O ATOM 2264 CB LYS A 149 1.308 9.271 3.812 1.00 0.36 C ATOM 2265 CG LYS A 149 1.511 10.149 2.591 1.00 0.56 C ATOM 2266 CD LYS A 149 2.959 10.587 2.421 1.00 0.89 C ATOM 2267 CE LYS A 149 3.890 9.415 2.135 1.00 1.01 C ATOM 2268 NZ LYS A 149 5.272 9.872 1.809 1.00 1.44 N ATOM 0 H LYS A 149 -0.398 9.259 1.920 1.00 0.29 H new ATOM 0 HA LYS A 149 -0.072 7.766 4.432 1.00 0.28 H new ATOM 0 HB2 LYS A 149 1.553 9.842 4.708 1.00 0.36 H new ATOM 0 HB3 LYS A 149 2.002 8.432 3.769 1.00 0.36 H new ATOM 0 HG2 LYS A 149 1.192 9.607 1.701 1.00 0.56 H new ATOM 0 HG3 LYS A 149 0.875 11.031 2.672 1.00 0.56 H new ATOM 0 HD2 LYS A 149 3.025 11.307 1.605 1.00 0.89 H new ATOM 0 HD3 LYS A 149 3.290 11.098 3.325 1.00 0.89 H new ATOM 0 HE2 LYS A 149 3.920 8.755 3.002 1.00 1.01 H new ATOM 0 HE3 LYS A 149 3.495 8.831 1.304 1.00 1.01 H new ATOM 0 HZ1 LYS A 149 5.944 9.098 1.985 1.00 1.44 H new ATOM 0 HZ2 LYS A 149 5.319 10.150 0.808 1.00 1.44 H new ATOM 0 HZ3 LYS A 149 5.518 10.687 2.407 1.00 1.44 H new ATOM 2282 N LEU A 150 -1.926 9.031 5.509 1.00 0.21 N ATOM 2283 CA LEU A 150 -2.979 9.751 6.189 1.00 0.22 C ATOM 2284 C LEU A 150 -2.984 9.491 7.696 1.00 0.19 C ATOM 2285 O LEU A 150 -2.079 8.890 8.265 1.00 0.17 O ATOM 2286 CB LEU A 150 -4.327 9.326 5.602 1.00 0.25 C ATOM 2287 CG LEU A 150 -4.704 7.859 5.752 1.00 0.26 C ATOM 2288 CD1 LEU A 150 -5.659 7.646 6.914 1.00 0.79 C ATOM 2289 CD2 LEU A 150 -5.303 7.331 4.458 1.00 0.84 C ATOM 0 H LEU A 150 -1.961 8.020 5.641 1.00 0.21 H new ATOM 0 HA LEU A 150 -2.804 10.817 6.041 1.00 0.22 H new ATOM 0 HB2 LEU A 150 -5.107 9.928 6.069 1.00 0.25 H new ATOM 0 HB3 LEU A 150 -4.329 9.571 4.540 1.00 0.25 H new ATOM 0 HG LEU A 150 -3.794 7.300 5.969 1.00 0.26 H new ATOM 0 HD11 LEU A 150 -5.907 6.587 6.992 1.00 0.79 H new ATOM 0 HD12 LEU A 150 -5.186 7.977 7.839 1.00 0.79 H new ATOM 0 HD13 LEU A 150 -6.570 8.221 6.746 1.00 0.79 H new ATOM 0 HD21 LEU A 150 -5.567 6.281 4.581 1.00 0.84 H new ATOM 0 HD22 LEU A 150 -6.197 7.904 4.211 1.00 0.84 H new ATOM 0 HD23 LEU A 150 -4.575 7.430 3.653 1.00 0.84 H new ATOM 2301 N SER A 151 -4.042 9.959 8.303 1.00 0.26 N ATOM 2302 CA SER A 151 -4.361 9.707 9.689 1.00 0.29 C ATOM 2303 C SER A 151 -5.852 9.846 9.831 1.00 0.25 C ATOM 2304 O SER A 151 -6.421 10.882 9.467 1.00 0.29 O ATOM 2305 CB SER A 151 -3.689 10.668 10.646 1.00 0.46 C ATOM 2306 OG SER A 151 -4.214 10.496 11.953 1.00 1.77 O ATOM 0 H SER A 151 -4.731 10.546 7.833 1.00 0.26 H new ATOM 0 HA SER A 151 -4.001 8.711 9.946 1.00 0.29 H new ATOM 0 HB2 SER A 151 -2.613 10.496 10.652 1.00 0.46 H new ATOM 0 HB3 SER A 151 -3.846 11.694 10.314 1.00 0.46 H new ATOM 0 HG SER A 151 -3.612 9.926 12.475 1.00 1.77 H new ATOM 2312 N ALA A 152 -6.495 8.811 10.305 1.00 0.28 N ATOM 2313 CA ALA A 152 -7.912 8.881 10.564 1.00 0.31 C ATOM 2314 C ALA A 152 -8.155 9.588 11.886 1.00 0.33 C ATOM 2315 O ALA A 152 -9.287 9.911 12.244 1.00 0.41 O ATOM 2316 CB ALA A 152 -8.514 7.498 10.562 1.00 0.41 C ATOM 0 H ALA A 152 -6.063 7.912 10.519 1.00 0.28 H new ATOM 0 HA ALA A 152 -8.397 9.454 9.774 1.00 0.31 H new ATOM 0 HB1 ALA A 152 -9.584 7.567 10.759 1.00 0.41 H new ATOM 0 HB2 ALA A 152 -8.353 7.033 9.590 1.00 0.41 H new ATOM 0 HB3 ALA A 152 -8.041 6.894 11.336 1.00 0.41 H new ATOM 2322 N LYS A 153 -7.068 9.837 12.598 1.00 0.30 N ATOM 2323 CA LYS A 153 -7.138 10.573 13.851 1.00 0.34 C ATOM 2324 C LYS A 153 -7.148 12.076 13.606 1.00 0.36 C ATOM 2325 O LYS A 153 -7.960 12.790 14.190 1.00 0.49 O ATOM 2326 CB LYS A 153 -6.002 10.183 14.772 1.00 0.35 C ATOM 2327 CG LYS A 153 -6.421 9.231 15.883 1.00 0.60 C ATOM 2328 CD LYS A 153 -7.140 9.957 17.007 1.00 1.12 C ATOM 2329 CE LYS A 153 -6.178 10.404 18.098 1.00 1.65 C ATOM 2330 NZ LYS A 153 -5.120 11.325 17.600 1.00 2.30 N ATOM 0 H LYS A 153 -6.129 9.542 12.331 1.00 0.30 H new ATOM 0 HA LYS A 153 -8.075 10.309 14.340 1.00 0.34 H new ATOM 0 HB2 LYS A 153 -5.212 9.717 14.184 1.00 0.35 H new ATOM 0 HB3 LYS A 153 -5.579 11.084 15.217 1.00 0.35 H new ATOM 0 HG2 LYS A 153 -7.073 8.459 15.474 1.00 0.60 H new ATOM 0 HG3 LYS A 153 -5.540 8.727 16.281 1.00 0.60 H new ATOM 0 HD2 LYS A 153 -7.661 10.825 16.604 1.00 1.12 H new ATOM 0 HD3 LYS A 153 -7.898 9.302 17.437 1.00 1.12 H new ATOM 0 HE2 LYS A 153 -6.740 10.900 18.889 1.00 1.65 H new ATOM 0 HE3 LYS A 153 -5.708 9.526 18.542 1.00 1.65 H new ATOM 0 HZ1 LYS A 153 -4.613 11.740 18.408 1.00 2.30 H new ATOM 0 HZ2 LYS A 153 -4.450 10.796 17.006 1.00 2.30 H new ATOM 0 HZ3 LYS A 153 -5.556 12.083 17.038 1.00 2.30 H new ATOM 2344 N THR A 154 -6.257 12.567 12.746 1.00 0.30 N ATOM 2345 CA THR A 154 -6.285 13.981 12.389 1.00 0.39 C ATOM 2346 C THR A 154 -7.264 14.245 11.253 1.00 0.36 C ATOM 2347 O THR A 154 -7.536 15.393 10.900 1.00 0.41 O ATOM 2348 CB THR A 154 -4.893 14.521 12.016 1.00 0.47 C ATOM 2349 OG1 THR A 154 -4.113 13.484 11.411 1.00 0.50 O ATOM 2350 CG2 THR A 154 -4.177 15.065 13.241 1.00 0.70 C ATOM 0 H THR A 154 -5.524 12.021 12.294 1.00 0.30 H new ATOM 0 HA THR A 154 -6.621 14.514 13.279 1.00 0.39 H new ATOM 0 HB THR A 154 -5.020 15.337 11.304 1.00 0.47 H new ATOM 0 HG1 THR A 154 -3.384 13.883 10.892 1.00 0.50 H new ATOM 0 HG21 THR A 154 -3.196 15.441 12.952 1.00 0.70 H new ATOM 0 HG22 THR A 154 -4.763 15.876 13.675 1.00 0.70 H new ATOM 0 HG23 THR A 154 -4.059 14.269 13.976 1.00 0.70 H new ATOM 2358 N LYS A 155 -7.782 13.153 10.683 1.00 0.30 N ATOM 2359 CA LYS A 155 -8.829 13.216 9.665 1.00 0.32 C ATOM 2360 C LYS A 155 -8.351 13.934 8.422 1.00 0.34 C ATOM 2361 O LYS A 155 -9.074 14.735 7.834 1.00 0.41 O ATOM 2362 CB LYS A 155 -10.080 13.902 10.208 1.00 0.38 C ATOM 2363 CG LYS A 155 -10.984 12.970 10.978 1.00 0.40 C ATOM 2364 CD LYS A 155 -11.356 11.767 10.133 1.00 0.45 C ATOM 2365 CE LYS A 155 -12.535 11.022 10.726 1.00 0.61 C ATOM 2366 NZ LYS A 155 -13.698 11.920 10.949 1.00 1.36 N ATOM 0 H LYS A 155 -7.487 12.205 10.915 1.00 0.30 H new ATOM 0 HA LYS A 155 -9.077 12.189 9.396 1.00 0.32 H new ATOM 0 HB2 LYS A 155 -9.782 14.726 10.856 1.00 0.38 H new ATOM 0 HB3 LYS A 155 -10.638 14.335 9.378 1.00 0.38 H new ATOM 0 HG2 LYS A 155 -10.484 12.641 11.889 1.00 0.40 H new ATOM 0 HG3 LYS A 155 -11.886 13.500 11.283 1.00 0.40 H new ATOM 0 HD2 LYS A 155 -11.600 12.092 9.121 1.00 0.45 H new ATOM 0 HD3 LYS A 155 -10.501 11.096 10.055 1.00 0.45 H new ATOM 0 HE2 LYS A 155 -12.825 10.210 10.059 1.00 0.61 H new ATOM 0 HE3 LYS A 155 -12.240 10.568 11.672 1.00 0.61 H new ATOM 0 HZ1 LYS A 155 -14.573 11.359 10.958 1.00 1.36 H new ATOM 0 HZ2 LYS A 155 -13.590 12.408 11.861 1.00 1.36 H new ATOM 0 HZ3 LYS A 155 -13.745 12.623 10.184 1.00 1.36 H new ATOM 2380 N GLU A 156 -7.143 13.621 8.010 1.00 0.30 N ATOM 2381 CA GLU A 156 -6.529 14.350 6.901 1.00 0.33 C ATOM 2382 C GLU A 156 -6.586 13.529 5.628 1.00 0.28 C ATOM 2383 O GLU A 156 -7.364 13.791 4.696 1.00 0.30 O ATOM 2384 CB GLU A 156 -5.073 14.673 7.229 1.00 0.40 C ATOM 2385 CG GLU A 156 -4.878 15.191 8.634 1.00 1.30 C ATOM 2386 CD GLU A 156 -3.423 15.386 8.994 1.00 1.70 C ATOM 2387 OE1 GLU A 156 -2.733 14.385 9.277 1.00 2.48 O ATOM 2388 OE2 GLU A 156 -2.961 16.544 8.975 1.00 1.52 O ATOM 0 H GLU A 156 -6.567 12.881 8.412 1.00 0.30 H new ATOM 0 HA GLU A 156 -7.084 15.276 6.752 1.00 0.33 H new ATOM 0 HB2 GLU A 156 -4.469 13.776 7.093 1.00 0.40 H new ATOM 0 HB3 GLU A 156 -4.704 15.415 6.521 1.00 0.40 H new ATOM 0 HG2 GLU A 156 -5.404 16.140 8.742 1.00 1.30 H new ATOM 0 HG3 GLU A 156 -5.331 14.494 9.339 1.00 1.30 H new ATOM 2395 N GLY A 157 -5.771 12.504 5.620 1.00 0.29 N ATOM 2396 CA GLY A 157 -5.644 11.668 4.463 1.00 0.28 C ATOM 2397 C GLY A 157 -6.911 10.901 4.138 1.00 0.27 C ATOM 2398 O GLY A 157 -7.002 10.300 3.079 1.00 0.29 O ATOM 0 H GLY A 157 -5.185 12.231 6.409 1.00 0.29 H new ATOM 0 HA2 GLY A 157 -5.370 12.284 3.606 1.00 0.28 H new ATOM 0 HA3 GLY A 157 -4.830 10.961 4.621 1.00 0.28 H new ATOM 2402 N LEU A 158 -7.884 10.905 5.053 1.00 0.26 N ATOM 2403 CA LEU A 158 -9.146 10.227 4.809 1.00 0.28 C ATOM 2404 C LEU A 158 -9.916 10.961 3.737 1.00 0.30 C ATOM 2405 O LEU A 158 -10.532 10.347 2.870 1.00 0.33 O ATOM 2406 CB LEU A 158 -9.983 10.135 6.082 1.00 0.31 C ATOM 2407 CG LEU A 158 -9.530 9.073 7.084 1.00 0.47 C ATOM 2408 CD1 LEU A 158 -10.534 8.962 8.218 1.00 0.73 C ATOM 2409 CD2 LEU A 158 -9.358 7.725 6.395 1.00 0.80 C ATOM 0 H LEU A 158 -7.817 11.368 5.960 1.00 0.26 H new ATOM 0 HA LEU A 158 -8.930 9.212 4.477 1.00 0.28 H new ATOM 0 HB2 LEU A 158 -9.971 11.106 6.576 1.00 0.31 H new ATOM 0 HB3 LEU A 158 -11.017 9.931 5.804 1.00 0.31 H new ATOM 0 HG LEU A 158 -8.566 9.373 7.496 1.00 0.47 H new ATOM 0 HD11 LEU A 158 -10.201 8.203 8.926 1.00 0.73 H new ATOM 0 HD12 LEU A 158 -10.615 9.922 8.727 1.00 0.73 H new ATOM 0 HD13 LEU A 158 -11.507 8.681 7.816 1.00 0.73 H new ATOM 0 HD21 LEU A 158 -9.035 6.982 7.124 1.00 0.80 H new ATOM 0 HD22 LEU A 158 -10.308 7.416 5.958 1.00 0.80 H new ATOM 0 HD23 LEU A 158 -8.608 7.811 5.609 1.00 0.80 H new ATOM 2421 N ASP A 159 -9.850 12.283 3.790 1.00 0.32 N ATOM 2422 CA ASP A 159 -10.450 13.106 2.761 1.00 0.38 C ATOM 2423 C ASP A 159 -9.763 12.823 1.442 1.00 0.32 C ATOM 2424 O ASP A 159 -10.408 12.607 0.419 1.00 0.33 O ATOM 2425 CB ASP A 159 -10.328 14.595 3.090 1.00 0.50 C ATOM 2426 CG ASP A 159 -11.071 14.999 4.346 1.00 1.25 C ATOM 2427 OD1 ASP A 159 -12.283 14.709 4.440 1.00 1.42 O ATOM 2428 OD2 ASP A 159 -10.443 15.578 5.260 1.00 2.20 O ATOM 0 H ASP A 159 -9.387 12.804 4.535 1.00 0.32 H new ATOM 0 HA ASP A 159 -11.511 12.862 2.700 1.00 0.38 H new ATOM 0 HB2 ASP A 159 -9.274 14.849 3.203 1.00 0.50 H new ATOM 0 HB3 ASP A 159 -10.707 15.177 2.250 1.00 0.50 H new ATOM 2433 N HIS A 160 -8.431 12.792 1.484 1.00 0.30 N ATOM 2434 CA HIS A 160 -7.637 12.517 0.286 1.00 0.30 C ATOM 2435 C HIS A 160 -7.858 11.086 -0.206 1.00 0.28 C ATOM 2436 O HIS A 160 -7.737 10.809 -1.398 1.00 0.33 O ATOM 2437 CB HIS A 160 -6.147 12.762 0.572 1.00 0.34 C ATOM 2438 CG HIS A 160 -5.233 12.460 -0.584 1.00 0.41 C ATOM 2439 ND1 HIS A 160 -4.915 13.381 -1.558 1.00 0.52 N ATOM 2440 CD2 HIS A 160 -4.553 11.333 -0.902 1.00 0.46 C ATOM 2441 CE1 HIS A 160 -4.084 12.835 -2.425 1.00 0.58 C ATOM 2442 NE2 HIS A 160 -3.847 11.595 -2.048 1.00 0.54 N ATOM 0 H HIS A 160 -7.882 12.953 2.328 1.00 0.30 H new ATOM 0 HA HIS A 160 -7.963 13.196 -0.502 1.00 0.30 H new ATOM 0 HB2 HIS A 160 -6.012 13.804 0.863 1.00 0.34 H new ATOM 0 HB3 HIS A 160 -5.848 12.152 1.424 1.00 0.34 H new ATOM 0 HD2 HIS A 160 -4.565 10.402 -0.355 1.00 0.46 H new ATOM 0 HE1 HIS A 160 -3.669 13.321 -3.295 1.00 0.58 H new ATOM 0 HE2 HIS A 160 -3.237 10.936 -2.531 1.00 0.54 H new ATOM 2451 N LEU A 161 -8.192 10.191 0.711 1.00 0.27 N ATOM 2452 CA LEU A 161 -8.375 8.782 0.382 1.00 0.28 C ATOM 2453 C LEU A 161 -9.566 8.608 -0.538 1.00 0.29 C ATOM 2454 O LEU A 161 -9.443 8.060 -1.629 1.00 0.31 O ATOM 2455 CB LEU A 161 -8.582 7.964 1.658 1.00 0.29 C ATOM 2456 CG LEU A 161 -8.599 6.443 1.471 1.00 0.57 C ATOM 2457 CD1 LEU A 161 -7.258 5.952 0.950 1.00 1.15 C ATOM 2458 CD2 LEU A 161 -8.948 5.752 2.779 1.00 1.16 C ATOM 0 H LEU A 161 -8.343 10.415 1.695 1.00 0.27 H new ATOM 0 HA LEU A 161 -7.479 8.426 -0.127 1.00 0.28 H new ATOM 0 HB2 LEU A 161 -7.790 8.217 2.363 1.00 0.29 H new ATOM 0 HB3 LEU A 161 -9.524 8.267 2.114 1.00 0.29 H new ATOM 0 HG LEU A 161 -9.363 6.196 0.734 1.00 0.57 H new ATOM 0 HD11 LEU A 161 -7.291 4.870 0.824 1.00 1.15 H new ATOM 0 HD12 LEU A 161 -7.046 6.423 -0.010 1.00 1.15 H new ATOM 0 HD13 LEU A 161 -6.474 6.211 1.662 1.00 1.15 H new ATOM 0 HD21 LEU A 161 -8.956 4.672 2.629 1.00 1.16 H new ATOM 0 HD22 LEU A 161 -8.206 6.008 3.535 1.00 1.16 H new ATOM 0 HD23 LEU A 161 -9.933 6.079 3.112 1.00 1.16 H new ATOM 2470 N LEU A 162 -10.710 9.100 -0.090 1.00 0.31 N ATOM 2471 CA LEU A 162 -11.946 9.019 -0.862 1.00 0.37 C ATOM 2472 C LEU A 162 -11.758 9.688 -2.209 1.00 0.38 C ATOM 2473 O LEU A 162 -12.163 9.158 -3.238 1.00 0.45 O ATOM 2474 CB LEU A 162 -13.074 9.715 -0.107 1.00 0.47 C ATOM 2475 CG LEU A 162 -13.089 9.461 1.397 1.00 0.85 C ATOM 2476 CD1 LEU A 162 -14.183 10.274 2.067 1.00 1.49 C ATOM 2477 CD2 LEU A 162 -13.263 7.977 1.695 1.00 1.51 C ATOM 0 H LEU A 162 -10.811 9.564 0.813 1.00 0.31 H new ATOM 0 HA LEU A 162 -12.201 7.970 -1.011 1.00 0.37 H new ATOM 0 HB2 LEU A 162 -12.999 10.789 -0.279 1.00 0.47 H new ATOM 0 HB3 LEU A 162 -14.027 9.391 -0.526 1.00 0.47 H new ATOM 0 HG LEU A 162 -12.129 9.778 1.804 1.00 0.85 H new ATOM 0 HD11 LEU A 162 -14.177 10.078 3.139 1.00 1.49 H new ATOM 0 HD12 LEU A 162 -14.007 11.335 1.891 1.00 1.49 H new ATOM 0 HD13 LEU A 162 -15.151 9.993 1.653 1.00 1.49 H new ATOM 0 HD21 LEU A 162 -13.271 7.821 2.774 1.00 1.51 H new ATOM 0 HD22 LEU A 162 -14.205 7.629 1.271 1.00 1.51 H new ATOM 0 HD23 LEU A 162 -12.438 7.418 1.253 1.00 1.51 H new ATOM 2489 N GLU A 163 -11.126 10.854 -2.186 1.00 0.37 N ATOM 2490 CA GLU A 163 -10.859 11.604 -3.408 1.00 0.44 C ATOM 2491 C GLU A 163 -10.004 10.797 -4.381 1.00 0.41 C ATOM 2492 O GLU A 163 -10.289 10.749 -5.577 1.00 0.50 O ATOM 2493 CB GLU A 163 -10.161 12.917 -3.072 1.00 0.56 C ATOM 2494 CG GLU A 163 -11.023 13.872 -2.266 1.00 1.03 C ATOM 2495 CD GLU A 163 -12.225 14.369 -3.040 1.00 1.78 C ATOM 2496 OE1 GLU A 163 -12.048 15.232 -3.927 1.00 2.14 O ATOM 2497 OE2 GLU A 163 -13.352 13.913 -2.764 1.00 2.57 O ATOM 0 H GLU A 163 -10.788 11.302 -1.334 1.00 0.37 H new ATOM 0 HA GLU A 163 -11.815 11.812 -3.889 1.00 0.44 H new ATOM 0 HB2 GLU A 163 -9.250 12.702 -2.513 1.00 0.56 H new ATOM 0 HB3 GLU A 163 -9.859 13.406 -3.998 1.00 0.56 H new ATOM 0 HG2 GLU A 163 -11.362 13.372 -1.359 1.00 1.03 H new ATOM 0 HG3 GLU A 163 -10.419 14.724 -1.954 1.00 1.03 H new ATOM 2504 N MET A 164 -8.962 10.153 -3.865 1.00 0.37 N ATOM 2505 CA MET A 164 -8.045 9.397 -4.708 1.00 0.39 C ATOM 2506 C MET A 164 -8.698 8.100 -5.179 1.00 0.37 C ATOM 2507 O MET A 164 -8.537 7.690 -6.328 1.00 0.43 O ATOM 2508 CB MET A 164 -6.751 9.095 -3.951 1.00 0.43 C ATOM 2509 CG MET A 164 -5.534 8.958 -4.854 1.00 0.64 C ATOM 2510 SD MET A 164 -4.692 10.529 -5.159 1.00 0.58 S ATOM 2511 CE MET A 164 -5.972 11.488 -5.971 1.00 0.53 C ATOM 0 H MET A 164 -8.733 10.140 -2.871 1.00 0.37 H new ATOM 0 HA MET A 164 -7.804 10.001 -5.583 1.00 0.39 H new ATOM 0 HB2 MET A 164 -6.569 9.890 -3.228 1.00 0.43 H new ATOM 0 HB3 MET A 164 -6.878 8.172 -3.385 1.00 0.43 H new ATOM 0 HG2 MET A 164 -4.831 8.258 -4.402 1.00 0.64 H new ATOM 0 HG3 MET A 164 -5.843 8.528 -5.807 1.00 0.64 H new ATOM 0 HE1 MET A 164 -5.516 12.311 -6.521 1.00 0.53 H new ATOM 0 HE2 MET A 164 -6.522 10.849 -6.663 1.00 0.53 H new ATOM 0 HE3 MET A 164 -6.657 11.887 -5.223 1.00 0.53 H new ATOM 2521 N ILE A 165 -9.438 7.467 -4.280 1.00 0.34 N ATOM 2522 CA ILE A 165 -10.182 6.256 -4.596 1.00 0.38 C ATOM 2523 C ILE A 165 -11.243 6.539 -5.654 1.00 0.44 C ATOM 2524 O ILE A 165 -11.407 5.780 -6.608 1.00 0.52 O ATOM 2525 CB ILE A 165 -10.858 5.682 -3.336 1.00 0.40 C ATOM 2526 CG1 ILE A 165 -9.810 5.045 -2.416 1.00 0.42 C ATOM 2527 CG2 ILE A 165 -11.932 4.673 -3.711 1.00 0.50 C ATOM 2528 CD1 ILE A 165 -10.380 4.510 -1.121 1.00 0.50 C ATOM 0 H ILE A 165 -9.540 7.777 -3.314 1.00 0.34 H new ATOM 0 HA ILE A 165 -9.474 5.524 -4.983 1.00 0.38 H new ATOM 0 HB ILE A 165 -11.339 6.499 -2.799 1.00 0.40 H new ATOM 0 HG12 ILE A 165 -9.318 4.231 -2.949 1.00 0.42 H new ATOM 0 HG13 ILE A 165 -9.043 5.785 -2.187 1.00 0.42 H new ATOM 0 HG21 ILE A 165 -12.395 4.281 -2.805 1.00 0.50 H new ATOM 0 HG22 ILE A 165 -12.690 5.160 -4.325 1.00 0.50 H new ATOM 0 HG23 ILE A 165 -11.482 3.854 -4.272 1.00 0.50 H new ATOM 0 HD11 ILE A 165 -9.579 4.075 -0.523 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -10.847 5.323 -0.565 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -11.126 3.746 -1.340 1.00 0.50 H new ATOM 2540 N LEU A 166 -11.957 7.639 -5.478 1.00 0.46 N ATOM 2541 CA LEU A 166 -12.989 8.045 -6.419 1.00 0.57 C ATOM 2542 C LEU A 166 -12.392 8.367 -7.780 1.00 0.61 C ATOM 2543 O LEU A 166 -12.998 8.080 -8.809 1.00 0.70 O ATOM 2544 CB LEU A 166 -13.758 9.249 -5.875 1.00 0.66 C ATOM 2545 CG LEU A 166 -14.463 10.088 -6.931 1.00 1.07 C ATOM 2546 CD1 LEU A 166 -15.952 10.180 -6.639 1.00 1.73 C ATOM 2547 CD2 LEU A 166 -13.840 11.472 -7.001 1.00 1.38 C ATOM 0 H LEU A 166 -11.840 8.271 -4.686 1.00 0.46 H new ATOM 0 HA LEU A 166 -13.682 7.213 -6.544 1.00 0.57 H new ATOM 0 HB2 LEU A 166 -14.499 8.895 -5.158 1.00 0.66 H new ATOM 0 HB3 LEU A 166 -13.065 9.888 -5.327 1.00 0.66 H new ATOM 0 HG LEU A 166 -14.340 9.603 -7.900 1.00 1.07 H new ATOM 0 HD11 LEU A 166 -16.437 10.784 -7.406 1.00 1.73 H new ATOM 0 HD12 LEU A 166 -16.385 9.180 -6.638 1.00 1.73 H new ATOM 0 HD13 LEU A 166 -16.104 10.642 -5.664 1.00 1.73 H new ATOM 0 HD21 LEU A 166 -14.352 12.064 -7.760 1.00 1.38 H new ATOM 0 HD22 LEU A 166 -13.935 11.963 -6.033 1.00 1.38 H new ATOM 0 HD23 LEU A 166 -12.785 11.383 -7.261 1.00 1.38 H new ATOM 2559 N LEU A 167 -11.218 8.977 -7.774 1.00 0.56 N ATOM 2560 CA LEU A 167 -10.460 9.193 -8.999 1.00 0.64 C ATOM 2561 C LEU A 167 -10.328 7.878 -9.752 1.00 0.66 C ATOM 2562 O LEU A 167 -10.617 7.791 -10.947 1.00 0.75 O ATOM 2563 CB LEU A 167 -9.070 9.737 -8.673 1.00 0.64 C ATOM 2564 CG LEU A 167 -8.250 10.201 -9.876 1.00 0.81 C ATOM 2565 CD1 LEU A 167 -8.886 11.425 -10.510 1.00 1.47 C ATOM 2566 CD2 LEU A 167 -6.814 10.492 -9.466 1.00 1.51 C ATOM 0 H LEU A 167 -10.766 9.333 -6.932 1.00 0.56 H new ATOM 0 HA LEU A 167 -10.987 9.920 -9.618 1.00 0.64 H new ATOM 0 HB2 LEU A 167 -9.178 10.574 -7.984 1.00 0.64 H new ATOM 0 HB3 LEU A 167 -8.509 8.963 -8.149 1.00 0.64 H new ATOM 0 HG LEU A 167 -8.236 9.399 -10.614 1.00 0.81 H new ATOM 0 HD11 LEU A 167 -8.290 11.743 -11.365 1.00 1.47 H new ATOM 0 HD12 LEU A 167 -9.895 11.180 -10.842 1.00 1.47 H new ATOM 0 HD13 LEU A 167 -8.930 12.232 -9.779 1.00 1.47 H new ATOM 0 HD21 LEU A 167 -6.247 10.821 -10.337 1.00 1.51 H new ATOM 0 HD22 LEU A 167 -6.804 11.276 -8.709 1.00 1.51 H new ATOM 0 HD23 LEU A 167 -6.362 9.588 -9.059 1.00 1.51 H new ATOM 2578 N VAL A 168 -9.920 6.852 -9.022 1.00 0.61 N ATOM 2579 CA VAL A 168 -9.793 5.515 -9.566 1.00 0.69 C ATOM 2580 C VAL A 168 -11.166 4.947 -9.947 1.00 0.77 C ATOM 2581 O VAL A 168 -11.308 4.287 -10.978 1.00 0.89 O ATOM 2582 CB VAL A 168 -9.094 4.582 -8.558 1.00 0.68 C ATOM 2583 CG1 VAL A 168 -9.051 3.163 -9.075 1.00 0.84 C ATOM 2584 CG2 VAL A 168 -7.688 5.081 -8.264 1.00 0.66 C ATOM 0 H VAL A 168 -9.668 6.926 -8.036 1.00 0.61 H new ATOM 0 HA VAL A 168 -9.183 5.576 -10.467 1.00 0.69 H new ATOM 0 HB VAL A 168 -9.670 4.589 -7.633 1.00 0.68 H new ATOM 0 HG11 VAL A 168 -8.553 2.525 -8.345 1.00 0.84 H new ATOM 0 HG12 VAL A 168 -10.067 2.804 -9.237 1.00 0.84 H new ATOM 0 HG13 VAL A 168 -8.502 3.135 -10.016 1.00 0.84 H new ATOM 0 HG21 VAL A 168 -7.206 4.412 -7.551 1.00 0.66 H new ATOM 0 HG22 VAL A 168 -7.110 5.104 -9.188 1.00 0.66 H new ATOM 0 HG23 VAL A 168 -7.739 6.085 -7.843 1.00 0.66 H new