USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 887 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 313 TYR OH : rot -8:sc= 1.37 USER MOD Set 1.2: A 326 ASN : amide:sc= 0.331 K(o=1.7,f=0.33) USER MOD Single : A 283 THR OG1 : rot -36:sc= 0.287 USER MOD Single : A 284 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 297 THR OG1 : rot 180:sc= 0 USER MOD Single : A 299 LYS NZ :NH3+ 165:sc= -0.0583 (180deg=-0.429) USER MOD Single : A 302 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 304 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 305 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0671) USER MOD Single : A 307 THR OG1 : rot -130:sc= -0.175 USER MOD Single : A 311 MET CE :methyl -166:sc= -0.433 (180deg=-0.819) USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 318 LYS NZ :NH3+ -153:sc= -2.12! (180deg=-3.13!) USER MOD Single : A 319 ASN : amide:sc= -1.23! C(o=-1.2!,f=-11!) USER MOD Single : A 321 LYS NZ :NH3+ 170:sc=-0.00542 (180deg=-0.128) USER MOD Single : A 325 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.172) USER MOD Single : A 327 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 328 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 335 LYS NZ :NH3+ 172:sc=-0.000654 (180deg=-0.0663) USER MOD Single : A 338 GLN :FLIP amide:sc= -1.83 F(o=-4.5!,f=-1.8) USER MOD Single : A 343 LYS NZ :NH3+ 171:sc= 0.785 (180deg=0.447) USER MOD Single : A 352 MET CE :methyl -163:sc= -0.274 (180deg=-0.825) USER MOD Single : A 366 TYR OH : rot 180:sc= -0.622 USER MOD Single : A 368 TYR OH : rot 180:sc= 0 USER MOD Single : A 370 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 371 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 379 ASN :FLIP amide:sc= -0.0592 F(o=-1.4!,f=-0.059) USER MOD Single : A 380 SER OG : rot 86:sc= 0.809 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 387 LYS NZ :NH3+ 146:sc= 1.67 (180deg=0.12) USER MOD Single : A 390 SER OG : rot 180:sc= 0 USER MOD Single : A 391 MET CE :methyl -162:sc= -4.3! (180deg=-5.2!) USER MOD Single : A 392 LYS NZ :NH3+ -162:sc= -0.165 (180deg=-0.633) USER MOD ----------------------------------------------------------------- ATOM 105 N THR A 283 -4.168 -14.573 0.950 1.00 0.54 N ATOM 106 CA THR A 283 -3.302 -13.604 0.303 1.00 0.50 C ATOM 107 C THR A 283 -3.450 -13.656 -1.218 1.00 0.56 C ATOM 108 O THR A 283 -4.020 -14.602 -1.764 1.00 0.71 O ATOM 109 CB THR A 283 -1.832 -13.846 0.697 1.00 0.64 C ATOM 110 OG1 THR A 283 -1.522 -15.244 0.598 1.00 0.76 O ATOM 111 CG2 THR A 283 -1.564 -13.360 2.117 1.00 0.71 C ATOM 0 HA THR A 283 -3.603 -12.613 0.642 1.00 0.50 H new ATOM 0 HB THR A 283 -1.197 -13.284 0.012 1.00 0.64 H new ATOM 0 HG1 THR A 283 -2.303 -15.772 0.865 1.00 0.76 H new ATOM 0 HG21 THR A 283 -0.520 -13.541 2.373 1.00 0.71 H new ATOM 0 HG22 THR A 283 -1.773 -12.292 2.182 1.00 0.71 H new ATOM 0 HG23 THR A 283 -2.207 -13.898 2.813 1.00 0.71 H new ATOM 119 N LYS A 284 -2.942 -12.634 -1.896 1.00 0.52 N ATOM 120 CA LYS A 284 -3.012 -12.566 -3.350 1.00 0.58 C ATOM 121 C LYS A 284 -1.629 -12.256 -3.904 1.00 0.51 C ATOM 122 O LYS A 284 -0.930 -11.397 -3.370 1.00 0.47 O ATOM 123 CB LYS A 284 -3.997 -11.480 -3.805 1.00 0.73 C ATOM 124 CG LYS A 284 -5.432 -11.674 -3.330 1.00 0.87 C ATOM 125 CD LYS A 284 -6.117 -12.835 -4.034 1.00 1.49 C ATOM 126 CE LYS A 284 -7.611 -12.854 -3.739 1.00 1.78 C ATOM 127 NZ LYS A 284 -8.311 -13.931 -4.483 1.00 2.06 N ATOM 0 H LYS A 284 -2.476 -11.838 -1.460 1.00 0.52 H new ATOM 0 HA LYS A 284 -3.363 -13.527 -3.725 1.00 0.58 H new ATOM 0 HB2 LYS A 284 -3.640 -10.514 -3.449 1.00 0.73 H new ATOM 0 HB3 LYS A 284 -3.993 -11.440 -4.894 1.00 0.73 H new ATOM 0 HG2 LYS A 284 -5.436 -11.850 -2.254 1.00 0.87 H new ATOM 0 HG3 LYS A 284 -5.998 -10.759 -3.506 1.00 0.87 H new ATOM 0 HD2 LYS A 284 -5.957 -12.757 -5.109 1.00 1.49 H new ATOM 0 HD3 LYS A 284 -5.668 -13.775 -3.712 1.00 1.49 H new ATOM 0 HE2 LYS A 284 -7.768 -12.992 -2.669 1.00 1.78 H new ATOM 0 HE3 LYS A 284 -8.045 -11.890 -4.003 1.00 1.78 H new ATOM 0 HZ1 LYS A 284 -9.325 -13.909 -4.254 1.00 2.06 H new ATOM 0 HZ2 LYS A 284 -8.184 -13.786 -5.505 1.00 2.06 H new ATOM 0 HZ3 LYS A 284 -7.915 -14.854 -4.212 1.00 2.06 H new ATOM 141 N LEU A 285 -1.235 -12.956 -4.956 1.00 0.61 N ATOM 142 CA LEU A 285 0.069 -12.739 -5.561 1.00 0.63 C ATOM 143 C LEU A 285 -0.080 -11.967 -6.865 1.00 0.67 C ATOM 144 O LEU A 285 -0.819 -12.376 -7.761 1.00 0.75 O ATOM 145 CB LEU A 285 0.775 -14.074 -5.813 1.00 0.76 C ATOM 146 CG LEU A 285 2.242 -13.965 -6.243 1.00 0.84 C ATOM 147 CD1 LEU A 285 3.064 -13.269 -5.167 1.00 0.78 C ATOM 148 CD2 LEU A 285 2.809 -15.345 -6.543 1.00 0.98 C ATOM 0 H LEU A 285 -1.798 -13.677 -5.407 1.00 0.61 H new ATOM 0 HA LEU A 285 0.677 -12.153 -4.872 1.00 0.63 H new ATOM 0 HB2 LEU A 285 0.723 -14.672 -4.903 1.00 0.76 H new ATOM 0 HB3 LEU A 285 0.227 -14.617 -6.583 1.00 0.76 H new ATOM 0 HG LEU A 285 2.293 -13.366 -7.152 1.00 0.84 H new ATOM 0 HD11 LEU A 285 4.103 -13.201 -5.490 1.00 0.78 H new ATOM 0 HD12 LEU A 285 2.670 -12.267 -4.999 1.00 0.78 H new ATOM 0 HD13 LEU A 285 3.009 -13.840 -4.240 1.00 0.78 H new ATOM 0 HD21 LEU A 285 3.852 -15.252 -6.847 1.00 0.98 H new ATOM 0 HD22 LEU A 285 2.746 -15.966 -5.650 1.00 0.98 H new ATOM 0 HD23 LEU A 285 2.236 -15.807 -7.347 1.00 0.98 H new ATOM 160 N LEU A 286 0.615 -10.846 -6.947 1.00 0.65 N ATOM 161 CA LEU A 286 0.585 -9.992 -8.123 1.00 0.71 C ATOM 162 C LEU A 286 1.947 -10.010 -8.810 1.00 0.77 C ATOM 163 O LEU A 286 2.845 -10.750 -8.395 1.00 0.80 O ATOM 164 CB LEU A 286 0.205 -8.557 -7.732 1.00 0.64 C ATOM 165 CG LEU A 286 -1.123 -8.418 -6.979 1.00 0.64 C ATOM 166 CD1 LEU A 286 -1.382 -6.967 -6.606 1.00 0.63 C ATOM 167 CD2 LEU A 286 -2.272 -8.964 -7.813 1.00 0.76 C ATOM 0 H LEU A 286 1.217 -10.501 -6.199 1.00 0.65 H new ATOM 0 HA LEU A 286 -0.167 -10.371 -8.815 1.00 0.71 H new ATOM 0 HB2 LEU A 286 1.001 -8.143 -7.113 1.00 0.64 H new ATOM 0 HB3 LEU A 286 0.157 -7.951 -8.637 1.00 0.64 H new ATOM 0 HG LEU A 286 -1.054 -9.002 -6.061 1.00 0.64 H new ATOM 0 HD11 LEU A 286 -2.330 -6.892 -6.073 1.00 0.63 H new ATOM 0 HD12 LEU A 286 -0.576 -6.606 -5.967 1.00 0.63 H new ATOM 0 HD13 LEU A 286 -1.426 -6.361 -7.511 1.00 0.63 H new ATOM 0 HD21 LEU A 286 -3.206 -8.856 -7.261 1.00 0.76 H new ATOM 0 HD22 LEU A 286 -2.338 -8.409 -8.749 1.00 0.76 H new ATOM 0 HD23 LEU A 286 -2.097 -10.018 -8.027 1.00 0.76 H new ATOM 179 N GLU A 287 2.102 -9.196 -9.849 1.00 0.84 N ATOM 180 CA GLU A 287 3.340 -9.159 -10.615 1.00 0.92 C ATOM 181 C GLU A 287 4.523 -8.758 -9.739 1.00 0.77 C ATOM 182 O GLU A 287 4.384 -7.970 -8.802 1.00 0.64 O ATOM 183 CB GLU A 287 3.213 -8.179 -11.783 1.00 1.05 C ATOM 184 CG GLU A 287 3.844 -8.694 -13.065 1.00 1.39 C ATOM 185 CD GLU A 287 3.353 -10.079 -13.424 1.00 1.96 C ATOM 186 OE1 GLU A 287 4.155 -11.029 -13.348 1.00 2.48 O ATOM 187 OE2 GLU A 287 2.159 -10.221 -13.761 1.00 2.64 O ATOM 0 H GLU A 287 1.383 -8.552 -10.180 1.00 0.84 H new ATOM 0 HA GLU A 287 3.520 -10.163 -11.000 1.00 0.92 H new ATOM 0 HB2 GLU A 287 2.158 -7.972 -11.962 1.00 1.05 H new ATOM 0 HB3 GLU A 287 3.681 -7.234 -11.509 1.00 1.05 H new ATOM 0 HG2 GLU A 287 3.619 -8.007 -13.881 1.00 1.39 H new ATOM 0 HG3 GLU A 287 4.928 -8.712 -12.953 1.00 1.39 H new ATOM 194 N GLY A 288 5.692 -9.302 -10.060 1.00 0.88 N ATOM 195 CA GLY A 288 6.893 -9.002 -9.302 1.00 0.87 C ATOM 196 C GLY A 288 6.889 -9.583 -7.900 1.00 0.98 C ATOM 197 O GLY A 288 7.868 -9.442 -7.171 1.00 1.84 O ATOM 0 H GLY A 288 5.829 -9.949 -10.836 1.00 0.88 H new ATOM 0 HA2 GLY A 288 7.759 -9.385 -9.842 1.00 0.87 H new ATOM 0 HA3 GLY A 288 7.011 -7.920 -9.237 1.00 0.87 H new ATOM 201 N GLY A 289 5.806 -10.247 -7.525 1.00 0.64 N ATOM 202 CA GLY A 289 5.724 -10.815 -6.198 1.00 0.58 C ATOM 203 C GLY A 289 4.964 -9.945 -5.211 1.00 0.48 C ATOM 204 O GLY A 289 5.071 -10.155 -4.000 1.00 0.48 O ATOM 0 H GLY A 289 4.987 -10.402 -8.113 1.00 0.64 H new ATOM 0 HA2 GLY A 289 5.240 -11.790 -6.258 1.00 0.58 H new ATOM 0 HA3 GLY A 289 6.733 -10.983 -5.820 1.00 0.58 H new ATOM 208 N ILE A 290 4.220 -8.956 -5.708 1.00 0.42 N ATOM 209 CA ILE A 290 3.403 -8.112 -4.837 1.00 0.36 C ATOM 210 C ILE A 290 2.313 -8.938 -4.162 1.00 0.36 C ATOM 211 O ILE A 290 1.514 -9.590 -4.828 1.00 0.40 O ATOM 212 CB ILE A 290 2.739 -6.947 -5.614 1.00 0.34 C ATOM 213 CG1 ILE A 290 3.798 -6.051 -6.264 1.00 0.36 C ATOM 214 CG2 ILE A 290 1.849 -6.125 -4.683 1.00 0.32 C ATOM 215 CD1 ILE A 290 3.208 -4.962 -7.134 1.00 0.37 C ATOM 0 H ILE A 290 4.166 -8.722 -6.699 1.00 0.42 H new ATOM 0 HA ILE A 290 4.073 -7.691 -4.087 1.00 0.36 H new ATOM 0 HB ILE A 290 2.121 -7.374 -6.404 1.00 0.34 H new ATOM 0 HG12 ILE A 290 4.406 -5.594 -5.483 1.00 0.36 H new ATOM 0 HG13 ILE A 290 4.465 -6.667 -6.867 1.00 0.36 H new ATOM 0 HG21 ILE A 290 1.390 -5.311 -5.244 1.00 0.32 H new ATOM 0 HG22 ILE A 290 1.070 -6.764 -4.267 1.00 0.32 H new ATOM 0 HG23 ILE A 290 2.452 -5.713 -3.873 1.00 0.32 H new ATOM 0 HD11 ILE A 290 4.012 -4.364 -7.564 1.00 0.37 H new ATOM 0 HD12 ILE A 290 2.623 -5.413 -7.936 1.00 0.37 H new ATOM 0 HD13 ILE A 290 2.563 -4.323 -6.530 1.00 0.37 H new ATOM 227 N ILE A 291 2.293 -8.929 -2.844 1.00 0.35 N ATOM 228 CA ILE A 291 1.263 -9.628 -2.102 1.00 0.37 C ATOM 229 C ILE A 291 0.291 -8.637 -1.486 1.00 0.34 C ATOM 230 O ILE A 291 0.699 -7.601 -0.969 1.00 0.36 O ATOM 231 CB ILE A 291 1.871 -10.504 -0.987 1.00 0.46 C ATOM 232 CG1 ILE A 291 2.782 -11.564 -1.604 1.00 0.60 C ATOM 233 CG2 ILE A 291 0.777 -11.160 -0.147 1.00 0.60 C ATOM 234 CD1 ILE A 291 3.497 -12.421 -0.582 1.00 0.93 C ATOM 0 H ILE A 291 2.979 -8.445 -2.265 1.00 0.35 H new ATOM 0 HA ILE A 291 0.734 -10.273 -2.803 1.00 0.37 H new ATOM 0 HB ILE A 291 2.460 -9.868 -0.326 1.00 0.46 H new ATOM 0 HG12 ILE A 291 2.188 -12.208 -2.253 1.00 0.60 H new ATOM 0 HG13 ILE A 291 3.523 -11.072 -2.234 1.00 0.60 H new ATOM 0 HG21 ILE A 291 1.233 -11.772 0.631 1.00 0.60 H new ATOM 0 HG22 ILE A 291 0.160 -10.388 0.313 1.00 0.60 H new ATOM 0 HG23 ILE A 291 0.156 -11.789 -0.785 1.00 0.60 H new ATOM 0 HD11 ILE A 291 4.125 -13.150 -1.094 1.00 0.93 H new ATOM 0 HD12 ILE A 291 4.118 -11.789 0.052 1.00 0.93 H new ATOM 0 HD13 ILE A 291 2.763 -12.942 0.033 1.00 0.93 H new ATOM 246 N ILE A 292 -0.988 -8.952 -1.546 1.00 0.34 N ATOM 247 CA ILE A 292 -1.992 -8.143 -0.886 1.00 0.36 C ATOM 248 C ILE A 292 -2.848 -9.026 0.007 1.00 0.41 C ATOM 249 O ILE A 292 -3.298 -10.101 -0.403 1.00 0.43 O ATOM 250 CB ILE A 292 -2.879 -7.350 -1.875 1.00 0.38 C ATOM 251 CG1 ILE A 292 -3.459 -8.271 -2.949 1.00 0.41 C ATOM 252 CG2 ILE A 292 -2.083 -6.219 -2.516 1.00 0.39 C ATOM 253 CD1 ILE A 292 -4.448 -7.588 -3.871 1.00 0.48 C ATOM 0 H ILE A 292 -1.356 -9.762 -2.045 1.00 0.34 H new ATOM 0 HA ILE A 292 -1.467 -7.400 -0.285 1.00 0.36 H new ATOM 0 HB ILE A 292 -3.708 -6.918 -1.315 1.00 0.38 H new ATOM 0 HG12 ILE A 292 -2.642 -8.678 -3.545 1.00 0.41 H new ATOM 0 HG13 ILE A 292 -3.951 -9.114 -2.464 1.00 0.41 H new ATOM 0 HG21 ILE A 292 -2.722 -5.672 -3.209 1.00 0.39 H new ATOM 0 HG22 ILE A 292 -1.724 -5.542 -1.741 1.00 0.39 H new ATOM 0 HG23 ILE A 292 -1.233 -6.634 -3.057 1.00 0.39 H new ATOM 0 HD11 ILE A 292 -4.816 -8.305 -4.605 1.00 0.48 H new ATOM 0 HD12 ILE A 292 -5.285 -7.205 -3.287 1.00 0.48 H new ATOM 0 HD13 ILE A 292 -3.956 -6.762 -4.385 1.00 0.48 H new ATOM 265 N GLU A 293 -3.014 -8.586 1.235 1.00 0.46 N ATOM 266 CA GLU A 293 -3.751 -9.333 2.238 1.00 0.51 C ATOM 267 C GLU A 293 -4.885 -8.482 2.790 1.00 0.43 C ATOM 268 O GLU A 293 -4.641 -7.409 3.334 1.00 0.43 O ATOM 269 CB GLU A 293 -2.795 -9.740 3.358 1.00 0.60 C ATOM 270 CG GLU A 293 -3.474 -10.400 4.543 1.00 1.21 C ATOM 271 CD GLU A 293 -2.524 -10.598 5.702 1.00 1.53 C ATOM 272 OE1 GLU A 293 -2.197 -9.608 6.387 1.00 2.31 O ATOM 273 OE2 GLU A 293 -2.115 -11.750 5.946 1.00 1.58 O ATOM 0 H GLU A 293 -2.642 -7.697 1.570 1.00 0.46 H new ATOM 0 HA GLU A 293 -4.181 -10.228 1.789 1.00 0.51 H new ATOM 0 HB2 GLU A 293 -2.049 -10.424 2.953 1.00 0.60 H new ATOM 0 HB3 GLU A 293 -2.262 -8.855 3.705 1.00 0.60 H new ATOM 0 HG2 GLU A 293 -4.316 -9.788 4.865 1.00 1.21 H new ATOM 0 HG3 GLU A 293 -3.879 -11.365 4.238 1.00 1.21 H new ATOM 280 N ASP A 294 -6.117 -8.961 2.665 1.00 0.46 N ATOM 281 CA ASP A 294 -7.276 -8.187 3.097 1.00 0.49 C ATOM 282 C ASP A 294 -7.415 -8.272 4.610 1.00 0.47 C ATOM 283 O ASP A 294 -7.726 -9.330 5.157 1.00 0.71 O ATOM 284 CB ASP A 294 -8.560 -8.676 2.414 1.00 0.65 C ATOM 285 CG ASP A 294 -8.551 -8.450 0.912 1.00 1.60 C ATOM 286 OD1 ASP A 294 -8.495 -7.276 0.482 1.00 2.25 O ATOM 287 OD2 ASP A 294 -8.615 -9.445 0.157 1.00 2.36 O ATOM 0 H ASP A 294 -6.339 -9.875 2.271 1.00 0.46 H new ATOM 0 HA ASP A 294 -7.122 -7.148 2.806 1.00 0.49 H new ATOM 0 HB2 ASP A 294 -8.691 -9.739 2.616 1.00 0.65 H new ATOM 0 HB3 ASP A 294 -9.416 -8.161 2.849 1.00 0.65 H new ATOM 292 N ARG A 295 -7.170 -7.155 5.275 1.00 0.35 N ATOM 293 CA ARG A 295 -7.161 -7.104 6.728 1.00 0.35 C ATOM 294 C ARG A 295 -8.564 -6.823 7.262 1.00 0.40 C ATOM 295 O ARG A 295 -9.110 -7.611 8.033 1.00 0.47 O ATOM 296 CB ARG A 295 -6.173 -6.029 7.197 1.00 0.39 C ATOM 297 CG ARG A 295 -5.967 -5.974 8.701 1.00 1.19 C ATOM 298 CD ARG A 295 -4.919 -4.934 9.073 1.00 1.47 C ATOM 299 NE ARG A 295 -4.712 -4.855 10.519 1.00 2.06 N ATOM 300 CZ ARG A 295 -3.535 -4.615 11.093 1.00 2.62 C ATOM 301 NH1 ARG A 295 -2.462 -4.374 10.354 1.00 2.77 N ATOM 302 NH2 ARG A 295 -3.439 -4.587 12.415 1.00 3.50 N ATOM 0 H ARG A 295 -6.972 -6.261 4.825 1.00 0.35 H new ATOM 0 HA ARG A 295 -6.842 -8.070 7.119 1.00 0.35 H new ATOM 0 HB2 ARG A 295 -5.210 -6.205 6.718 1.00 0.39 H new ATOM 0 HB3 ARG A 295 -6.526 -5.056 6.856 1.00 0.39 H new ATOM 0 HG2 ARG A 295 -6.911 -5.736 9.192 1.00 1.19 H new ATOM 0 HG3 ARG A 295 -5.657 -6.954 9.065 1.00 1.19 H new ATOM 0 HD2 ARG A 295 -3.976 -5.180 8.585 1.00 1.47 H new ATOM 0 HD3 ARG A 295 -5.228 -3.958 8.697 1.00 1.47 H new ATOM 0 HE ARG A 295 -5.520 -4.992 11.126 1.00 2.06 H new ATOM 0 HH11 ARG A 295 -2.534 -4.371 9.337 1.00 2.77 H new ATOM 0 HH12 ARG A 295 -1.564 -4.191 10.803 1.00 2.77 H new ATOM 0 HH21 ARG A 295 -4.266 -4.749 12.990 1.00 3.50 H new ATOM 0 HH22 ARG A 295 -2.538 -4.403 12.857 1.00 3.50 H new ATOM 316 N VAL A 296 -9.147 -5.700 6.849 1.00 0.41 N ATOM 317 CA VAL A 296 -10.511 -5.352 7.243 1.00 0.50 C ATOM 318 C VAL A 296 -11.348 -5.016 6.008 1.00 0.53 C ATOM 319 O VAL A 296 -10.857 -4.391 5.067 1.00 0.51 O ATOM 320 CB VAL A 296 -10.545 -4.163 8.237 1.00 0.56 C ATOM 321 CG1 VAL A 296 -11.971 -3.820 8.645 1.00 0.70 C ATOM 322 CG2 VAL A 296 -9.708 -4.469 9.469 1.00 0.68 C ATOM 0 H VAL A 296 -8.697 -5.015 6.242 1.00 0.41 H new ATOM 0 HA VAL A 296 -10.933 -6.220 7.749 1.00 0.50 H new ATOM 0 HB VAL A 296 -10.121 -3.298 7.728 1.00 0.56 H new ATOM 0 HG11 VAL A 296 -11.958 -2.982 9.342 1.00 0.70 H new ATOM 0 HG12 VAL A 296 -12.547 -3.547 7.761 1.00 0.70 H new ATOM 0 HG13 VAL A 296 -12.430 -4.684 9.125 1.00 0.70 H new ATOM 0 HG21 VAL A 296 -9.745 -3.622 10.154 1.00 0.68 H new ATOM 0 HG22 VAL A 296 -10.103 -5.355 9.966 1.00 0.68 H new ATOM 0 HG23 VAL A 296 -8.675 -4.650 9.171 1.00 0.68 H new ATOM 332 N THR A 297 -12.604 -5.439 6.017 1.00 0.77 N ATOM 333 CA THR A 297 -13.496 -5.219 4.887 1.00 0.88 C ATOM 334 C THR A 297 -14.357 -3.969 5.101 1.00 0.77 C ATOM 335 O THR A 297 -14.670 -3.608 6.240 1.00 0.98 O ATOM 336 CB THR A 297 -14.396 -6.451 4.639 1.00 1.21 C ATOM 337 OG1 THR A 297 -15.228 -6.239 3.492 1.00 1.89 O ATOM 338 CG2 THR A 297 -15.262 -6.747 5.852 1.00 1.93 C ATOM 0 H THR A 297 -13.030 -5.939 6.798 1.00 0.77 H new ATOM 0 HA THR A 297 -12.875 -5.064 4.005 1.00 0.88 H new ATOM 0 HB THR A 297 -13.747 -7.308 4.458 1.00 1.21 H new ATOM 0 HG1 THR A 297 -15.791 -7.028 3.346 1.00 1.89 H new ATOM 0 HG21 THR A 297 -15.885 -7.618 5.650 1.00 1.93 H new ATOM 0 HG22 THR A 297 -14.625 -6.948 6.713 1.00 1.93 H new ATOM 0 HG23 THR A 297 -15.898 -5.887 6.064 1.00 1.93 H new ATOM 346 N GLY A 298 -14.723 -3.309 4.005 1.00 0.77 N ATOM 347 CA GLY A 298 -15.489 -2.076 4.083 1.00 0.83 C ATOM 348 C GLY A 298 -16.334 -1.848 2.845 1.00 0.90 C ATOM 349 O GLY A 298 -16.549 -2.771 2.058 1.00 1.04 O ATOM 0 H GLY A 298 -14.500 -3.610 3.056 1.00 0.77 H new ATOM 0 HA2 GLY A 298 -16.134 -2.106 4.961 1.00 0.83 H new ATOM 0 HA3 GLY A 298 -14.808 -1.235 4.216 1.00 0.83 H new ATOM 353 N LYS A 299 -16.821 -0.621 2.671 1.00 0.96 N ATOM 354 CA LYS A 299 -17.532 -0.256 1.452 1.00 1.08 C ATOM 355 C LYS A 299 -16.525 -0.140 0.320 1.00 0.82 C ATOM 356 O LYS A 299 -15.435 0.388 0.518 1.00 1.36 O ATOM 357 CB LYS A 299 -18.290 1.063 1.628 1.00 1.88 C ATOM 358 CG LYS A 299 -19.012 1.501 0.370 1.00 2.40 C ATOM 359 CD LYS A 299 -19.745 2.815 0.556 1.00 3.13 C ATOM 360 CE LYS A 299 -20.454 3.223 -0.725 1.00 4.13 C ATOM 361 NZ LYS A 299 -21.376 2.160 -1.207 1.00 4.49 N ATOM 0 H LYS A 299 -16.736 0.131 3.355 1.00 0.96 H new ATOM 0 HA LYS A 299 -18.267 -1.027 1.221 1.00 1.08 H new ATOM 0 HB2 LYS A 299 -19.013 0.956 2.437 1.00 1.88 H new ATOM 0 HB3 LYS A 299 -17.589 1.842 1.928 1.00 1.88 H new ATOM 0 HG2 LYS A 299 -18.293 1.600 -0.443 1.00 2.40 H new ATOM 0 HG3 LYS A 299 -19.723 0.729 0.074 1.00 2.40 H new ATOM 0 HD2 LYS A 299 -20.470 2.721 1.364 1.00 3.13 H new ATOM 0 HD3 LYS A 299 -19.039 3.592 0.850 1.00 3.13 H new ATOM 0 HE2 LYS A 299 -21.016 4.141 -0.553 1.00 4.13 H new ATOM 0 HE3 LYS A 299 -19.715 3.441 -1.496 1.00 4.13 H new ATOM 0 HZ1 LYS A 299 -22.021 2.557 -1.920 1.00 4.49 H new ATOM 0 HZ2 LYS A 299 -20.824 1.388 -1.631 1.00 4.49 H new ATOM 0 HZ3 LYS A 299 -21.929 1.791 -0.407 1.00 4.49 H new ATOM 375 N GLY A 300 -16.877 -0.618 -0.864 1.00 0.58 N ATOM 376 CA GLY A 300 -15.887 -0.711 -1.912 1.00 1.04 C ATOM 377 C GLY A 300 -16.151 0.153 -3.131 1.00 0.73 C ATOM 378 O GLY A 300 -16.673 -0.342 -4.132 1.00 0.67 O ATOM 0 H GLY A 300 -17.813 -0.937 -1.114 1.00 0.58 H new ATOM 0 HA2 GLY A 300 -14.916 -0.439 -1.498 1.00 1.04 H new ATOM 0 HA3 GLY A 300 -15.817 -1.751 -2.232 1.00 1.04 H new ATOM 382 N PRO A 301 -15.829 1.458 -3.079 1.00 0.68 N ATOM 383 CA PRO A 301 -15.638 2.256 -4.284 1.00 0.52 C ATOM 384 C PRO A 301 -14.299 1.873 -4.899 1.00 0.51 C ATOM 385 O PRO A 301 -13.293 1.815 -4.196 1.00 0.57 O ATOM 386 CB PRO A 301 -15.619 3.709 -3.776 1.00 0.53 C ATOM 387 CG PRO A 301 -16.034 3.636 -2.343 1.00 0.77 C ATOM 388 CD PRO A 301 -15.649 2.265 -1.872 1.00 0.88 C ATOM 0 HA PRO A 301 -16.406 2.110 -5.044 1.00 0.52 H new ATOM 0 HB2 PRO A 301 -14.626 4.146 -3.875 1.00 0.53 H new ATOM 0 HB3 PRO A 301 -16.302 4.335 -4.351 1.00 0.53 H new ATOM 0 HG2 PRO A 301 -15.537 4.406 -1.753 1.00 0.77 H new ATOM 0 HG3 PRO A 301 -17.107 3.798 -2.238 1.00 0.77 H new ATOM 0 HD2 PRO A 301 -14.621 2.233 -1.511 1.00 0.88 H new ATOM 0 HD3 PRO A 301 -16.284 1.922 -1.055 1.00 0.88 H new ATOM 396 N HIS A 302 -14.271 1.608 -6.191 1.00 0.53 N ATOM 397 CA HIS A 302 -13.086 1.010 -6.794 1.00 0.60 C ATOM 398 C HIS A 302 -12.069 2.068 -7.186 1.00 0.50 C ATOM 399 O HIS A 302 -12.271 2.814 -8.146 1.00 0.57 O ATOM 400 CB HIS A 302 -13.459 0.160 -8.011 1.00 0.78 C ATOM 401 CG HIS A 302 -14.512 -0.867 -7.722 1.00 0.99 C ATOM 402 ND1 HIS A 302 -15.658 -0.964 -8.479 1.00 1.42 N ATOM 403 CD2 HIS A 302 -14.534 -1.824 -6.764 1.00 1.16 C ATOM 404 CE1 HIS A 302 -16.343 -1.975 -7.967 1.00 1.49 C ATOM 405 NE2 HIS A 302 -15.701 -2.523 -6.930 1.00 1.33 N ATOM 0 H HIS A 302 -15.038 1.792 -6.837 1.00 0.53 H new ATOM 0 HA HIS A 302 -12.632 0.363 -6.043 1.00 0.60 H new ATOM 0 HB2 HIS A 302 -13.811 0.815 -8.808 1.00 0.78 H new ATOM 0 HB3 HIS A 302 -12.565 -0.342 -8.382 1.00 0.78 H new ATOM 0 HD2 HIS A 302 -13.778 -2.002 -6.014 1.00 1.16 H new ATOM 0 HE1 HIS A 302 -17.298 -2.314 -8.340 1.00 1.49 H new ATOM 0 HE2 HIS A 302 -16.020 -3.313 -6.368 1.00 1.33 H new ATOM 413 N ALA A 303 -10.983 2.132 -6.426 1.00 0.40 N ATOM 414 CA ALA A 303 -9.882 3.035 -6.727 1.00 0.36 C ATOM 415 C ALA A 303 -9.200 2.625 -8.024 1.00 0.39 C ATOM 416 O ALA A 303 -8.532 1.592 -8.082 1.00 0.54 O ATOM 417 CB ALA A 303 -8.883 3.043 -5.580 1.00 0.38 C ATOM 0 H ALA A 303 -10.842 1.564 -5.591 1.00 0.40 H new ATOM 0 HA ALA A 303 -10.279 4.043 -6.851 1.00 0.36 H new ATOM 0 HB1 ALA A 303 -8.064 3.722 -5.816 1.00 0.38 H new ATOM 0 HB2 ALA A 303 -9.379 3.376 -4.668 1.00 0.38 H new ATOM 0 HB3 ALA A 303 -8.490 2.037 -5.433 1.00 0.38 H new ATOM 423 N LYS A 304 -9.387 3.420 -9.060 1.00 0.39 N ATOM 424 CA LYS A 304 -8.805 3.130 -10.358 1.00 0.45 C ATOM 425 C LYS A 304 -8.027 4.337 -10.866 1.00 0.44 C ATOM 426 O LYS A 304 -7.874 5.328 -10.149 1.00 0.43 O ATOM 427 CB LYS A 304 -9.902 2.720 -11.346 1.00 0.60 C ATOM 428 CG LYS A 304 -11.040 3.724 -11.460 1.00 1.03 C ATOM 429 CD LYS A 304 -12.296 3.085 -12.033 1.00 1.17 C ATOM 430 CE LYS A 304 -12.777 1.939 -11.154 1.00 2.23 C ATOM 431 NZ LYS A 304 -14.111 1.425 -11.566 1.00 2.84 N ATOM 0 H LYS A 304 -9.940 4.276 -9.028 1.00 0.39 H new ATOM 0 HA LYS A 304 -8.108 2.297 -10.261 1.00 0.45 H new ATOM 0 HB2 LYS A 304 -9.456 2.579 -12.330 1.00 0.60 H new ATOM 0 HB3 LYS A 304 -10.310 1.757 -11.040 1.00 0.60 H new ATOM 0 HG2 LYS A 304 -11.259 4.140 -10.476 1.00 1.03 H new ATOM 0 HG3 LYS A 304 -10.731 4.554 -12.095 1.00 1.03 H new ATOM 0 HD2 LYS A 304 -13.082 3.835 -12.121 1.00 1.17 H new ATOM 0 HD3 LYS A 304 -12.094 2.716 -13.039 1.00 1.17 H new ATOM 0 HE2 LYS A 304 -12.051 1.127 -11.192 1.00 2.23 H new ATOM 0 HE3 LYS A 304 -12.825 2.275 -10.118 1.00 2.23 H new ATOM 0 HZ1 LYS A 304 -14.393 0.647 -10.936 1.00 2.84 H new ATOM 0 HZ2 LYS A 304 -14.812 2.191 -11.505 1.00 2.84 H new ATOM 0 HZ3 LYS A 304 -14.062 1.078 -12.545 1.00 2.84 H new ATOM 445 N LYS A 305 -7.536 4.254 -12.093 1.00 0.51 N ATOM 446 CA LYS A 305 -6.691 5.302 -12.645 1.00 0.55 C ATOM 447 C LYS A 305 -7.472 6.603 -12.814 1.00 0.56 C ATOM 448 O LYS A 305 -8.512 6.638 -13.476 1.00 0.63 O ATOM 449 CB LYS A 305 -6.094 4.856 -13.982 1.00 0.67 C ATOM 450 CG LYS A 305 -5.004 5.781 -14.494 1.00 1.35 C ATOM 451 CD LYS A 305 -4.311 5.218 -15.722 1.00 1.42 C ATOM 452 CE LYS A 305 -3.096 6.055 -16.094 1.00 2.35 C ATOM 453 NZ LYS A 305 -3.469 7.447 -16.454 1.00 2.84 N ATOM 0 H LYS A 305 -7.708 3.472 -12.725 1.00 0.51 H new ATOM 0 HA LYS A 305 -5.877 5.487 -11.944 1.00 0.55 H new ATOM 0 HB2 LYS A 305 -5.686 3.851 -13.872 1.00 0.67 H new ATOM 0 HB3 LYS A 305 -6.889 4.797 -14.725 1.00 0.67 H new ATOM 0 HG2 LYS A 305 -5.436 6.752 -14.735 1.00 1.35 H new ATOM 0 HG3 LYS A 305 -4.269 5.946 -13.706 1.00 1.35 H new ATOM 0 HD2 LYS A 305 -4.004 4.190 -15.531 1.00 1.42 H new ATOM 0 HD3 LYS A 305 -5.009 5.192 -16.558 1.00 1.42 H new ATOM 0 HE2 LYS A 305 -2.397 6.072 -15.258 1.00 2.35 H new ATOM 0 HE3 LYS A 305 -2.578 5.590 -16.933 1.00 2.35 H new ATOM 0 HZ1 LYS A 305 -2.632 7.949 -16.814 1.00 2.84 H new ATOM 0 HZ2 LYS A 305 -4.205 7.430 -17.189 1.00 2.84 H new ATOM 0 HZ3 LYS A 305 -3.831 7.938 -15.612 1.00 2.84 H new ATOM 467 N GLY A 306 -6.959 7.670 -12.215 1.00 0.55 N ATOM 468 CA GLY A 306 -7.632 8.955 -12.268 1.00 0.61 C ATOM 469 C GLY A 306 -8.473 9.230 -11.035 1.00 0.56 C ATOM 470 O GLY A 306 -8.937 10.351 -10.829 1.00 0.70 O ATOM 0 H GLY A 306 -6.084 7.669 -11.691 1.00 0.55 H new ATOM 0 HA2 GLY A 306 -6.889 9.745 -12.379 1.00 0.61 H new ATOM 0 HA3 GLY A 306 -8.269 8.990 -13.152 1.00 0.61 H new ATOM 474 N THR A 307 -8.668 8.209 -10.214 1.00 0.40 N ATOM 475 CA THR A 307 -9.465 8.341 -9.003 1.00 0.34 C ATOM 476 C THR A 307 -8.622 8.922 -7.867 1.00 0.30 C ATOM 477 O THR A 307 -7.446 8.586 -7.738 1.00 0.31 O ATOM 478 CB THR A 307 -10.028 6.973 -8.574 1.00 0.32 C ATOM 479 OG1 THR A 307 -10.707 6.363 -9.678 1.00 0.40 O ATOM 480 CG2 THR A 307 -10.990 7.121 -7.406 1.00 0.32 C ATOM 0 H THR A 307 -8.284 7.276 -10.365 1.00 0.40 H new ATOM 0 HA THR A 307 -10.293 9.017 -9.217 1.00 0.34 H new ATOM 0 HB THR A 307 -9.195 6.344 -8.258 1.00 0.32 H new ATOM 0 HG1 THR A 307 -11.595 6.063 -9.391 1.00 0.40 H new ATOM 0 HG21 THR A 307 -11.373 6.140 -7.123 1.00 0.32 H new ATOM 0 HG22 THR A 307 -10.468 7.565 -6.558 1.00 0.32 H new ATOM 0 HG23 THR A 307 -11.820 7.764 -7.698 1.00 0.32 H new ATOM 488 N ARG A 308 -9.223 9.774 -7.034 1.00 0.33 N ATOM 489 CA ARG A 308 -8.492 10.409 -5.944 1.00 0.36 C ATOM 490 C ARG A 308 -8.910 9.788 -4.620 1.00 0.36 C ATOM 491 O ARG A 308 -10.078 9.852 -4.221 1.00 0.52 O ATOM 492 CB ARG A 308 -8.703 11.934 -5.933 1.00 0.46 C ATOM 493 CG ARG A 308 -10.151 12.374 -5.768 1.00 0.98 C ATOM 494 CD ARG A 308 -10.262 13.879 -5.573 1.00 1.14 C ATOM 495 NE ARG A 308 -11.613 14.271 -5.172 1.00 1.95 N ATOM 496 CZ ARG A 308 -12.144 15.472 -5.372 1.00 2.39 C ATOM 497 NH1 ARG A 308 -11.450 16.438 -5.967 1.00 2.12 N ATOM 498 NH2 ARG A 308 -13.380 15.703 -4.957 1.00 3.45 N ATOM 0 H ARG A 308 -10.207 10.037 -7.095 1.00 0.33 H new ATOM 0 HA ARG A 308 -7.426 10.238 -6.096 1.00 0.36 H new ATOM 0 HB2 ARG A 308 -8.113 12.363 -5.123 1.00 0.46 H new ATOM 0 HB3 ARG A 308 -8.316 12.348 -6.864 1.00 0.46 H new ATOM 0 HG2 ARG A 308 -10.724 12.077 -6.647 1.00 0.98 H new ATOM 0 HG3 ARG A 308 -10.592 11.862 -4.912 1.00 0.98 H new ATOM 0 HD2 ARG A 308 -9.549 14.202 -4.815 1.00 1.14 H new ATOM 0 HD3 ARG A 308 -9.995 14.387 -6.499 1.00 1.14 H new ATOM 0 HE ARG A 308 -12.189 13.571 -4.705 1.00 1.95 H new ATOM 0 HH11 ARG A 308 -10.494 16.262 -6.278 1.00 2.12 H new ATOM 0 HH12 ARG A 308 -11.873 17.355 -6.113 1.00 2.12 H new ATOM 0 HH21 ARG A 308 -13.908 14.965 -4.492 1.00 3.45 H new ATOM 0 HH22 ARG A 308 -13.804 16.619 -5.102 1.00 3.45 H new ATOM 512 N VAL A 309 -7.962 9.144 -3.967 1.00 0.28 N ATOM 513 CA VAL A 309 -8.236 8.457 -2.719 1.00 0.28 C ATOM 514 C VAL A 309 -7.519 9.106 -1.544 1.00 0.28 C ATOM 515 O VAL A 309 -6.431 9.662 -1.686 1.00 0.34 O ATOM 516 CB VAL A 309 -7.851 6.963 -2.799 1.00 0.29 C ATOM 517 CG1 VAL A 309 -8.622 6.273 -3.908 1.00 0.31 C ATOM 518 CG2 VAL A 309 -6.357 6.785 -3.013 1.00 0.28 C ATOM 0 H VAL A 309 -6.993 9.082 -4.280 1.00 0.28 H new ATOM 0 HA VAL A 309 -9.310 8.536 -2.554 1.00 0.28 H new ATOM 0 HB VAL A 309 -8.113 6.504 -1.846 1.00 0.29 H new ATOM 0 HG11 VAL A 309 -8.338 5.222 -3.949 1.00 0.31 H new ATOM 0 HG12 VAL A 309 -9.691 6.352 -3.712 1.00 0.31 H new ATOM 0 HG13 VAL A 309 -8.392 6.749 -4.861 1.00 0.31 H new ATOM 0 HG21 VAL A 309 -6.121 5.722 -3.065 1.00 0.28 H new ATOM 0 HG22 VAL A 309 -6.063 7.268 -3.945 1.00 0.28 H new ATOM 0 HG23 VAL A 309 -5.814 7.237 -2.183 1.00 0.28 H new ATOM 528 N GLY A 310 -8.157 9.033 -0.389 1.00 0.25 N ATOM 529 CA GLY A 310 -7.557 9.505 0.835 1.00 0.27 C ATOM 530 C GLY A 310 -7.369 8.358 1.797 1.00 0.24 C ATOM 531 O GLY A 310 -8.345 7.764 2.261 1.00 0.26 O ATOM 0 H GLY A 310 -9.095 8.648 -0.279 1.00 0.25 H new ATOM 0 HA2 GLY A 310 -6.595 9.972 0.621 1.00 0.27 H new ATOM 0 HA3 GLY A 310 -8.189 10.269 1.287 1.00 0.27 H new ATOM 535 N MET A 311 -6.127 8.026 2.091 1.00 0.22 N ATOM 536 CA MET A 311 -5.835 6.838 2.871 1.00 0.19 C ATOM 537 C MET A 311 -4.869 7.111 4.000 1.00 0.18 C ATOM 538 O MET A 311 -4.380 8.225 4.182 1.00 0.19 O ATOM 539 CB MET A 311 -5.277 5.717 1.988 1.00 0.22 C ATOM 540 CG MET A 311 -4.283 6.167 0.945 1.00 0.34 C ATOM 541 SD MET A 311 -3.935 4.877 -0.269 1.00 0.67 S ATOM 542 CE MET A 311 -3.476 3.510 0.792 1.00 0.76 C ATOM 0 H MET A 311 -5.307 8.559 1.803 1.00 0.22 H new ATOM 0 HA MET A 311 -6.784 6.521 3.304 1.00 0.19 H new ATOM 0 HB2 MET A 311 -4.800 4.974 2.627 1.00 0.22 H new ATOM 0 HB3 MET A 311 -6.108 5.221 1.487 1.00 0.22 H new ATOM 0 HG2 MET A 311 -4.669 7.049 0.434 1.00 0.34 H new ATOM 0 HG3 MET A 311 -3.355 6.463 1.434 1.00 0.34 H new ATOM 0 HE1 MET A 311 -3.000 2.731 0.196 1.00 0.76 H new ATOM 0 HE2 MET A 311 -2.780 3.859 1.555 1.00 0.76 H new ATOM 0 HE3 MET A 311 -4.368 3.106 1.272 1.00 0.76 H new ATOM 552 N ARG A 312 -4.624 6.059 4.754 1.00 0.19 N ATOM 553 CA ARG A 312 -3.695 6.079 5.867 1.00 0.21 C ATOM 554 C ARG A 312 -2.893 4.791 5.825 1.00 0.24 C ATOM 555 O ARG A 312 -3.395 3.771 5.347 1.00 0.30 O ATOM 556 CB ARG A 312 -4.439 6.227 7.198 1.00 0.27 C ATOM 557 CG ARG A 312 -5.251 7.508 7.282 1.00 0.40 C ATOM 558 CD ARG A 312 -6.029 7.604 8.580 1.00 0.67 C ATOM 559 NE ARG A 312 -6.860 8.807 8.622 1.00 1.24 N ATOM 560 CZ ARG A 312 -7.784 9.042 9.556 1.00 1.67 C ATOM 561 NH1 ARG A 312 -7.989 8.165 10.525 1.00 1.85 N ATOM 562 NH2 ARG A 312 -8.506 10.151 9.517 1.00 2.51 N ATOM 0 H ARG A 312 -5.070 5.153 4.610 1.00 0.19 H new ATOM 0 HA ARG A 312 -3.026 6.936 5.785 1.00 0.21 H new ATOM 0 HB2 ARG A 312 -5.102 5.373 7.335 1.00 0.27 H new ATOM 0 HB3 ARG A 312 -3.718 6.205 8.016 1.00 0.27 H new ATOM 0 HG2 ARG A 312 -4.584 8.366 7.195 1.00 0.40 H new ATOM 0 HG3 ARG A 312 -5.942 7.555 6.441 1.00 0.40 H new ATOM 0 HD2 ARG A 312 -6.659 6.722 8.693 1.00 0.67 H new ATOM 0 HD3 ARG A 312 -5.336 7.611 9.421 1.00 0.67 H new ATOM 0 HE ARG A 312 -6.725 9.508 7.894 1.00 1.24 H new ATOM 0 HH11 ARG A 312 -7.440 7.306 10.560 1.00 1.85 H new ATOM 0 HH12 ARG A 312 -8.696 8.348 11.237 1.00 1.85 H new ATOM 0 HH21 ARG A 312 -8.357 10.830 8.771 1.00 2.51 H new ATOM 0 HH22 ARG A 312 -9.211 10.326 10.233 1.00 2.51 H new ATOM 576 N TYR A 313 -1.663 4.829 6.303 1.00 0.23 N ATOM 577 CA TYR A 313 -0.754 3.714 6.103 1.00 0.26 C ATOM 578 C TYR A 313 0.338 3.691 7.164 1.00 0.27 C ATOM 579 O TYR A 313 0.664 4.721 7.756 1.00 0.31 O ATOM 580 CB TYR A 313 -0.108 3.808 4.710 1.00 0.28 C ATOM 581 CG TYR A 313 0.727 5.058 4.511 1.00 0.34 C ATOM 582 CD1 TYR A 313 2.047 5.108 4.945 1.00 0.45 C ATOM 583 CD2 TYR A 313 0.193 6.190 3.907 1.00 0.40 C ATOM 584 CE1 TYR A 313 2.807 6.248 4.791 1.00 0.53 C ATOM 585 CE2 TYR A 313 0.948 7.334 3.743 1.00 0.51 C ATOM 586 CZ TYR A 313 2.256 7.359 4.190 1.00 0.56 C ATOM 587 OH TYR A 313 3.015 8.501 4.043 1.00 0.68 O ATOM 0 H TYR A 313 -1.272 5.612 6.828 1.00 0.23 H new ATOM 0 HA TYR A 313 -1.332 2.794 6.183 1.00 0.26 H new ATOM 0 HB2 TYR A 313 0.521 2.932 4.550 1.00 0.28 H new ATOM 0 HB3 TYR A 313 -0.892 3.780 3.953 1.00 0.28 H new ATOM 0 HD1 TYR A 313 2.485 4.238 5.411 1.00 0.45 H new ATOM 0 HD2 TYR A 313 -0.830 6.174 3.560 1.00 0.40 H new ATOM 0 HE1 TYR A 313 3.829 6.270 5.140 1.00 0.53 H new ATOM 0 HE2 TYR A 313 0.519 8.204 3.268 1.00 0.51 H new ATOM 0 HH TYR A 313 3.863 8.394 4.522 1.00 0.68 H new ATOM 597 N VAL A 314 0.884 2.511 7.395 1.00 0.26 N ATOM 598 CA VAL A 314 2.081 2.361 8.199 1.00 0.27 C ATOM 599 C VAL A 314 3.174 1.711 7.357 1.00 0.28 C ATOM 600 O VAL A 314 3.113 0.516 7.062 1.00 0.35 O ATOM 601 CB VAL A 314 1.835 1.510 9.461 1.00 0.29 C ATOM 602 CG1 VAL A 314 3.074 1.490 10.341 1.00 0.32 C ATOM 603 CG2 VAL A 314 0.631 2.026 10.239 1.00 0.32 C ATOM 0 H VAL A 314 0.511 1.634 7.032 1.00 0.26 H new ATOM 0 HA VAL A 314 2.386 3.355 8.526 1.00 0.27 H new ATOM 0 HB VAL A 314 1.620 0.489 9.145 1.00 0.29 H new ATOM 0 HG11 VAL A 314 2.881 0.885 11.227 1.00 0.32 H new ATOM 0 HG12 VAL A 314 3.909 1.064 9.785 1.00 0.32 H new ATOM 0 HG13 VAL A 314 3.322 2.507 10.644 1.00 0.32 H new ATOM 0 HG21 VAL A 314 0.478 1.409 11.125 1.00 0.32 H new ATOM 0 HG22 VAL A 314 0.809 3.058 10.542 1.00 0.32 H new ATOM 0 HG23 VAL A 314 -0.257 1.981 9.608 1.00 0.32 H new ATOM 613 N GLY A 315 4.148 2.510 6.950 1.00 0.27 N ATOM 614 CA GLY A 315 5.226 2.019 6.122 1.00 0.28 C ATOM 615 C GLY A 315 6.333 1.397 6.938 1.00 0.25 C ATOM 616 O GLY A 315 7.085 2.098 7.637 1.00 0.27 O ATOM 0 H GLY A 315 4.210 3.501 7.183 1.00 0.27 H new ATOM 0 HA2 GLY A 315 4.836 1.282 5.420 1.00 0.28 H new ATOM 0 HA3 GLY A 315 5.630 2.840 5.530 1.00 0.28 H new ATOM 620 N LYS A 316 6.431 0.078 6.834 1.00 0.25 N ATOM 621 CA LYS A 316 7.411 -0.696 7.572 1.00 0.27 C ATOM 622 C LYS A 316 8.276 -1.510 6.617 1.00 0.30 C ATOM 623 O LYS A 316 7.914 -1.730 5.461 1.00 0.32 O ATOM 624 CB LYS A 316 6.711 -1.655 8.543 1.00 0.36 C ATOM 625 CG LYS A 316 5.949 -0.976 9.671 1.00 0.48 C ATOM 626 CD LYS A 316 5.137 -1.985 10.474 1.00 0.69 C ATOM 627 CE LYS A 316 4.552 -1.366 11.734 1.00 0.99 C ATOM 628 NZ LYS A 316 3.649 -2.307 12.454 1.00 1.94 N ATOM 0 H LYS A 316 5.829 -0.484 6.232 1.00 0.25 H new ATOM 0 HA LYS A 316 8.038 -0.001 8.130 1.00 0.27 H new ATOM 0 HB2 LYS A 316 6.018 -2.279 7.979 1.00 0.36 H new ATOM 0 HB3 LYS A 316 7.458 -2.320 8.977 1.00 0.36 H new ATOM 0 HG2 LYS A 316 6.650 -0.463 10.330 1.00 0.48 H new ATOM 0 HG3 LYS A 316 5.285 -0.216 9.259 1.00 0.48 H new ATOM 0 HD2 LYS A 316 4.331 -2.378 9.854 1.00 0.69 H new ATOM 0 HD3 LYS A 316 5.772 -2.829 10.745 1.00 0.69 H new ATOM 0 HE2 LYS A 316 5.362 -1.062 12.398 1.00 0.99 H new ATOM 0 HE3 LYS A 316 4.000 -0.464 11.471 1.00 0.99 H new ATOM 0 HZ1 LYS A 316 3.273 -1.844 13.306 1.00 1.94 H new ATOM 0 HZ2 LYS A 316 2.862 -2.578 11.831 1.00 1.94 H new ATOM 0 HZ3 LYS A 316 4.181 -3.157 12.728 1.00 1.94 H new ATOM 642 N LEU A 317 9.425 -1.941 7.104 1.00 0.35 N ATOM 643 CA LEU A 317 10.258 -2.885 6.380 1.00 0.46 C ATOM 644 C LEU A 317 9.838 -4.303 6.733 1.00 0.56 C ATOM 645 O LEU A 317 9.121 -4.519 7.713 1.00 0.54 O ATOM 646 CB LEU A 317 11.736 -2.680 6.726 1.00 0.51 C ATOM 647 CG LEU A 317 12.371 -1.398 6.190 1.00 0.53 C ATOM 648 CD1 LEU A 317 13.752 -1.188 6.802 1.00 0.61 C ATOM 649 CD2 LEU A 317 12.469 -1.470 4.676 1.00 0.65 C ATOM 0 H LEU A 317 9.805 -1.650 8.005 1.00 0.35 H new ATOM 0 HA LEU A 317 10.129 -2.719 5.310 1.00 0.46 H new ATOM 0 HB2 LEU A 317 11.841 -2.689 7.811 1.00 0.51 H new ATOM 0 HB3 LEU A 317 12.301 -3.530 6.344 1.00 0.51 H new ATOM 0 HG LEU A 317 11.744 -0.551 6.467 1.00 0.53 H new ATOM 0 HD11 LEU A 317 14.189 -0.270 6.408 1.00 0.61 H new ATOM 0 HD12 LEU A 317 13.662 -1.111 7.886 1.00 0.61 H new ATOM 0 HD13 LEU A 317 14.394 -2.032 6.550 1.00 0.61 H new ATOM 0 HD21 LEU A 317 12.922 -0.554 4.297 1.00 0.65 H new ATOM 0 HD22 LEU A 317 13.084 -2.324 4.391 1.00 0.65 H new ATOM 0 HD23 LEU A 317 11.471 -1.584 4.252 1.00 0.65 H new ATOM 661 N LYS A 318 10.298 -5.265 5.946 1.00 0.74 N ATOM 662 CA LYS A 318 9.975 -6.671 6.173 1.00 0.89 C ATOM 663 C LYS A 318 10.481 -7.154 7.537 1.00 0.81 C ATOM 664 O LYS A 318 10.000 -8.157 8.065 1.00 0.87 O ATOM 665 CB LYS A 318 10.567 -7.539 5.053 1.00 1.14 C ATOM 666 CG LYS A 318 12.085 -7.484 4.961 1.00 1.33 C ATOM 667 CD LYS A 318 12.614 -8.199 3.721 1.00 1.34 C ATOM 668 CE LYS A 318 12.496 -9.717 3.815 1.00 1.96 C ATOM 669 NZ LYS A 318 11.116 -10.212 3.550 1.00 2.42 N ATOM 0 H LYS A 318 10.900 -5.098 5.139 1.00 0.74 H new ATOM 0 HA LYS A 318 8.889 -6.767 6.167 1.00 0.89 H new ATOM 0 HB2 LYS A 318 10.260 -8.573 5.209 1.00 1.14 H new ATOM 0 HB3 LYS A 318 10.144 -7.221 4.100 1.00 1.14 H new ATOM 0 HG2 LYS A 318 12.409 -6.443 4.944 1.00 1.33 H new ATOM 0 HG3 LYS A 318 12.518 -7.938 5.852 1.00 1.33 H new ATOM 0 HD2 LYS A 318 12.066 -7.851 2.846 1.00 1.34 H new ATOM 0 HD3 LYS A 318 13.659 -7.930 3.571 1.00 1.34 H new ATOM 0 HE2 LYS A 318 13.183 -10.174 3.103 1.00 1.96 H new ATOM 0 HE3 LYS A 318 12.807 -10.039 4.809 1.00 1.96 H new ATOM 0 HZ1 LYS A 318 10.970 -11.114 4.046 1.00 2.42 H new ATOM 0 HZ2 LYS A 318 10.425 -9.513 3.891 1.00 2.42 H new ATOM 0 HZ3 LYS A 318 10.989 -10.355 2.528 1.00 2.42 H new ATOM 683 N ASN A 319 11.435 -6.424 8.111 1.00 0.73 N ATOM 684 CA ASN A 319 12.024 -6.795 9.398 1.00 0.71 C ATOM 685 C ASN A 319 11.260 -6.161 10.556 1.00 0.63 C ATOM 686 O ASN A 319 11.598 -6.372 11.723 1.00 0.69 O ATOM 687 CB ASN A 319 13.499 -6.379 9.468 1.00 0.78 C ATOM 688 CG ASN A 319 13.690 -4.875 9.556 1.00 1.31 C ATOM 689 OD1 ASN A 319 12.888 -4.104 9.035 1.00 2.20 O ATOM 690 ND2 ASN A 319 14.747 -4.447 10.227 1.00 1.70 N ATOM 0 H ASN A 319 11.818 -5.570 7.705 1.00 0.73 H new ATOM 0 HA ASN A 319 11.957 -7.880 9.484 1.00 0.71 H new ATOM 0 HB2 ASN A 319 13.962 -6.849 10.335 1.00 0.78 H new ATOM 0 HB3 ASN A 319 14.018 -6.754 8.586 1.00 0.78 H new ATOM 0 HD21 ASN A 319 14.918 -3.446 10.325 1.00 1.70 H new ATOM 0 HD22 ASN A 319 15.391 -5.118 10.646 1.00 1.70 H new ATOM 697 N GLY A 320 10.243 -5.376 10.234 1.00 0.55 N ATOM 698 CA GLY A 320 9.428 -4.766 11.267 1.00 0.57 C ATOM 699 C GLY A 320 9.878 -3.366 11.630 1.00 0.53 C ATOM 700 O GLY A 320 9.367 -2.775 12.583 1.00 0.69 O ATOM 0 H GLY A 320 9.967 -5.150 9.278 1.00 0.55 H new ATOM 0 HA2 GLY A 320 8.392 -4.732 10.931 1.00 0.57 H new ATOM 0 HA3 GLY A 320 9.454 -5.392 12.159 1.00 0.57 H new ATOM 704 N LYS A 321 10.837 -2.833 10.887 1.00 0.42 N ATOM 705 CA LYS A 321 11.315 -1.477 11.121 1.00 0.45 C ATOM 706 C LYS A 321 10.390 -0.465 10.460 1.00 0.39 C ATOM 707 O LYS A 321 10.210 -0.473 9.244 1.00 0.44 O ATOM 708 CB LYS A 321 12.744 -1.315 10.588 1.00 0.56 C ATOM 709 CG LYS A 321 13.291 0.098 10.712 1.00 1.36 C ATOM 710 CD LYS A 321 14.684 0.213 10.113 1.00 1.84 C ATOM 711 CE LYS A 321 15.199 1.643 10.173 1.00 2.33 C ATOM 712 NZ LYS A 321 15.314 2.142 11.571 1.00 2.42 N ATOM 0 H LYS A 321 11.299 -3.318 10.118 1.00 0.42 H new ATOM 0 HA LYS A 321 11.320 -1.294 12.196 1.00 0.45 H new ATOM 0 HB2 LYS A 321 13.402 -1.997 11.127 1.00 0.56 H new ATOM 0 HB3 LYS A 321 12.766 -1.612 9.539 1.00 0.56 H new ATOM 0 HG2 LYS A 321 12.620 0.794 10.209 1.00 1.36 H new ATOM 0 HG3 LYS A 321 13.321 0.386 11.763 1.00 1.36 H new ATOM 0 HD2 LYS A 321 15.368 -0.444 10.650 1.00 1.84 H new ATOM 0 HD3 LYS A 321 14.665 -0.125 9.077 1.00 1.84 H new ATOM 0 HE2 LYS A 321 16.174 1.697 9.689 1.00 2.33 H new ATOM 0 HE3 LYS A 321 14.528 2.293 9.611 1.00 2.33 H new ATOM 0 HZ1 LYS A 321 15.823 3.049 11.575 1.00 2.42 H new ATOM 0 HZ2 LYS A 321 14.363 2.277 11.971 1.00 2.42 H new ATOM 0 HZ3 LYS A 321 15.836 1.449 12.145 1.00 2.42 H new ATOM 726 N VAL A 322 9.796 0.394 11.268 1.00 0.35 N ATOM 727 CA VAL A 322 8.901 1.417 10.762 1.00 0.33 C ATOM 728 C VAL A 322 9.699 2.641 10.337 1.00 0.35 C ATOM 729 O VAL A 322 10.536 3.130 11.096 1.00 0.42 O ATOM 730 CB VAL A 322 7.874 1.836 11.828 1.00 0.36 C ATOM 731 CG1 VAL A 322 6.778 2.691 11.211 1.00 1.17 C ATOM 732 CG2 VAL A 322 7.291 0.618 12.525 1.00 1.26 C ATOM 0 H VAL A 322 9.918 0.403 12.281 1.00 0.35 H new ATOM 0 HA VAL A 322 8.369 1.000 9.907 1.00 0.33 H new ATOM 0 HB VAL A 322 8.387 2.437 12.579 1.00 0.36 H new ATOM 0 HG11 VAL A 322 6.062 2.977 11.982 1.00 1.17 H new ATOM 0 HG12 VAL A 322 7.218 3.588 10.774 1.00 1.17 H new ATOM 0 HG13 VAL A 322 6.267 2.122 10.434 1.00 1.17 H new ATOM 0 HG21 VAL A 322 6.568 0.939 13.274 1.00 1.26 H new ATOM 0 HG22 VAL A 322 6.796 -0.018 11.792 1.00 1.26 H new ATOM 0 HG23 VAL A 322 8.091 0.058 13.010 1.00 1.26 H new ATOM 742 N PHE A 323 9.456 3.129 9.129 1.00 0.35 N ATOM 743 CA PHE A 323 10.152 4.316 8.658 1.00 0.38 C ATOM 744 C PHE A 323 9.205 5.507 8.525 1.00 0.41 C ATOM 745 O PHE A 323 9.534 6.612 8.955 1.00 0.55 O ATOM 746 CB PHE A 323 10.908 4.055 7.339 1.00 0.37 C ATOM 747 CG PHE A 323 10.098 3.414 6.240 1.00 0.37 C ATOM 748 CD1 PHE A 323 10.068 2.036 6.090 1.00 0.36 C ATOM 749 CD2 PHE A 323 9.349 4.193 5.371 1.00 0.43 C ATOM 750 CE1 PHE A 323 9.314 1.447 5.091 1.00 0.39 C ATOM 751 CE2 PHE A 323 8.594 3.610 4.370 1.00 0.48 C ATOM 752 CZ PHE A 323 8.631 2.228 4.194 1.00 0.43 C ATOM 0 H PHE A 323 8.792 2.728 8.466 1.00 0.35 H new ATOM 0 HA PHE A 323 10.896 4.567 9.414 1.00 0.38 H new ATOM 0 HB2 PHE A 323 11.299 5.004 6.971 1.00 0.37 H new ATOM 0 HB3 PHE A 323 11.766 3.418 7.553 1.00 0.37 H new ATOM 0 HD1 PHE A 323 10.641 1.414 6.762 1.00 0.36 H new ATOM 0 HD2 PHE A 323 9.355 5.268 5.477 1.00 0.43 H new ATOM 0 HE1 PHE A 323 9.263 0.371 5.017 1.00 0.39 H new ATOM 0 HE2 PHE A 323 7.979 4.223 3.728 1.00 0.48 H new ATOM 0 HZ PHE A 323 8.124 1.774 3.355 1.00 0.43 H new ATOM 762 N ASP A 324 8.019 5.286 7.972 1.00 0.37 N ATOM 763 CA ASP A 324 7.080 6.387 7.765 1.00 0.45 C ATOM 764 C ASP A 324 5.649 5.908 7.885 1.00 0.36 C ATOM 765 O ASP A 324 5.262 4.933 7.256 1.00 0.47 O ATOM 766 CB ASP A 324 7.291 7.042 6.397 1.00 0.61 C ATOM 767 CG ASP A 324 6.389 8.248 6.190 1.00 0.85 C ATOM 768 OD1 ASP A 324 5.451 8.168 5.371 1.00 1.68 O ATOM 769 OD2 ASP A 324 6.621 9.287 6.853 1.00 0.91 O ATOM 0 H ASP A 324 7.686 4.373 7.663 1.00 0.37 H new ATOM 0 HA ASP A 324 7.271 7.128 8.541 1.00 0.45 H new ATOM 0 HB2 ASP A 324 8.332 7.349 6.300 1.00 0.61 H new ATOM 0 HB3 ASP A 324 7.100 6.310 5.613 1.00 0.61 H new ATOM 774 N LYS A 325 4.872 6.591 8.704 1.00 0.35 N ATOM 775 CA LYS A 325 3.488 6.220 8.921 1.00 0.31 C ATOM 776 C LYS A 325 2.626 7.451 9.144 1.00 0.32 C ATOM 777 O LYS A 325 2.932 8.298 9.984 1.00 0.45 O ATOM 778 CB LYS A 325 3.371 5.277 10.123 1.00 0.43 C ATOM 779 CG LYS A 325 4.299 5.641 11.272 1.00 0.61 C ATOM 780 CD LYS A 325 3.946 4.905 12.554 1.00 1.17 C ATOM 781 CE LYS A 325 5.101 4.933 13.545 1.00 1.44 C ATOM 782 NZ LYS A 325 5.761 6.268 13.608 1.00 1.99 N ATOM 0 H LYS A 325 5.178 7.409 9.231 1.00 0.35 H new ATOM 0 HA LYS A 325 3.133 5.705 8.028 1.00 0.31 H new ATOM 0 HB2 LYS A 325 2.342 5.284 10.481 1.00 0.43 H new ATOM 0 HB3 LYS A 325 3.589 4.259 9.799 1.00 0.43 H new ATOM 0 HG2 LYS A 325 5.327 5.409 10.994 1.00 0.61 H new ATOM 0 HG3 LYS A 325 4.252 6.716 11.448 1.00 0.61 H new ATOM 0 HD2 LYS A 325 3.065 5.360 13.006 1.00 1.17 H new ATOM 0 HD3 LYS A 325 3.687 3.872 12.323 1.00 1.17 H new ATOM 0 HE2 LYS A 325 4.733 4.665 14.536 1.00 1.44 H new ATOM 0 HE3 LYS A 325 5.837 4.180 13.263 1.00 1.44 H new ATOM 0 HZ1 LYS A 325 6.346 6.326 14.466 1.00 1.99 H new ATOM 0 HZ2 LYS A 325 6.362 6.398 12.769 1.00 1.99 H new ATOM 0 HZ3 LYS A 325 5.036 7.013 13.633 1.00 1.99 H new ATOM 796 N ASN A 326 1.549 7.537 8.385 1.00 0.33 N ATOM 797 CA ASN A 326 0.560 8.583 8.578 1.00 0.40 C ATOM 798 C ASN A 326 -0.803 7.947 8.764 1.00 0.39 C ATOM 799 O ASN A 326 -1.316 7.270 7.872 1.00 0.42 O ATOM 800 CB ASN A 326 0.534 9.564 7.398 1.00 0.56 C ATOM 801 CG ASN A 326 1.775 10.439 7.341 1.00 0.95 C ATOM 802 OD1 ASN A 326 1.844 11.480 7.992 1.00 1.92 O ATOM 803 ND2 ASN A 326 2.750 10.046 6.535 1.00 0.82 N ATOM 0 H ASN A 326 1.336 6.891 7.625 1.00 0.33 H new ATOM 0 HA ASN A 326 0.828 9.154 9.467 1.00 0.40 H new ATOM 0 HB2 ASN A 326 0.445 9.005 6.467 1.00 0.56 H new ATOM 0 HB3 ASN A 326 -0.350 10.197 7.476 1.00 0.56 H new ATOM 0 HD21 ASN A 326 3.592 10.613 6.439 1.00 0.82 H new ATOM 0 HD22 ASN A 326 2.658 9.176 6.010 1.00 0.82 H new ATOM 810 N THR A 327 -1.373 8.148 9.939 1.00 0.45 N ATOM 811 CA THR A 327 -2.650 7.555 10.290 1.00 0.54 C ATOM 812 C THR A 327 -3.317 8.362 11.393 1.00 0.52 C ATOM 813 O THR A 327 -4.531 8.564 11.387 1.00 0.58 O ATOM 814 CB THR A 327 -2.488 6.098 10.763 1.00 0.69 C ATOM 815 OG1 THR A 327 -1.729 5.348 9.808 1.00 1.69 O ATOM 816 CG2 THR A 327 -3.841 5.428 10.970 1.00 1.26 C ATOM 0 H THR A 327 -0.965 8.725 10.674 1.00 0.45 H new ATOM 0 HA THR A 327 -3.270 7.562 9.394 1.00 0.54 H new ATOM 0 HB THR A 327 -1.961 6.118 11.717 1.00 0.69 H new ATOM 0 HG1 THR A 327 -1.632 4.424 10.120 1.00 1.69 H new ATOM 0 HG21 THR A 327 -3.691 4.401 11.304 1.00 1.26 H new ATOM 0 HG22 THR A 327 -4.407 5.976 11.724 1.00 1.26 H new ATOM 0 HG23 THR A 327 -4.394 5.427 10.031 1.00 1.26 H new ATOM 824 N LYS A 328 -2.507 8.830 12.338 1.00 0.51 N ATOM 825 CA LYS A 328 -3.009 9.626 13.449 1.00 0.60 C ATOM 826 C LYS A 328 -3.336 11.038 12.984 1.00 0.61 C ATOM 827 O LYS A 328 -2.462 11.900 12.940 1.00 0.63 O ATOM 828 CB LYS A 328 -1.965 9.676 14.571 1.00 0.65 C ATOM 829 CG LYS A 328 -1.496 8.301 15.025 1.00 1.07 C ATOM 830 CD LYS A 328 -2.564 7.570 15.827 1.00 1.29 C ATOM 831 CE LYS A 328 -2.832 8.272 17.145 1.00 1.63 C ATOM 832 NZ LYS A 328 -3.839 7.558 17.968 1.00 2.55 N ATOM 0 H LYS A 328 -1.500 8.671 12.355 1.00 0.51 H new ATOM 0 HA LYS A 328 -3.920 9.162 13.827 1.00 0.60 H new ATOM 0 HB2 LYS A 328 -1.104 10.251 14.230 1.00 0.65 H new ATOM 0 HB3 LYS A 328 -2.385 10.208 15.424 1.00 0.65 H new ATOM 0 HG2 LYS A 328 -1.225 7.704 14.154 1.00 1.07 H new ATOM 0 HG3 LYS A 328 -0.596 8.407 15.631 1.00 1.07 H new ATOM 0 HD2 LYS A 328 -3.485 7.515 15.247 1.00 1.29 H new ATOM 0 HD3 LYS A 328 -2.244 6.545 16.015 1.00 1.29 H new ATOM 0 HE2 LYS A 328 -1.901 8.356 17.706 1.00 1.63 H new ATOM 0 HE3 LYS A 328 -3.179 9.287 16.950 1.00 1.63 H new ATOM 0 HZ1 LYS A 328 -3.989 8.074 18.858 1.00 2.55 H new ATOM 0 HZ2 LYS A 328 -4.736 7.500 17.446 1.00 2.55 H new ATOM 0 HZ3 LYS A 328 -3.498 6.598 18.178 1.00 2.55 H new ATOM 846 N GLY A 329 -4.587 11.255 12.601 1.00 0.78 N ATOM 847 CA GLY A 329 -5.031 12.577 12.188 1.00 0.97 C ATOM 848 C GLY A 329 -4.547 12.977 10.801 1.00 0.84 C ATOM 849 O GLY A 329 -5.093 13.900 10.197 1.00 0.88 O ATOM 0 H GLY A 329 -5.309 10.535 12.568 1.00 0.78 H new ATOM 0 HA2 GLY A 329 -6.120 12.607 12.206 1.00 0.97 H new ATOM 0 HA3 GLY A 329 -4.680 13.312 12.912 1.00 0.97 H new ATOM 853 N LYS A 330 -3.527 12.291 10.297 1.00 0.72 N ATOM 854 CA LYS A 330 -2.917 12.648 9.022 1.00 0.62 C ATOM 855 C LYS A 330 -3.355 11.704 7.907 1.00 0.49 C ATOM 856 O LYS A 330 -2.899 10.559 7.838 1.00 0.41 O ATOM 857 CB LYS A 330 -1.390 12.632 9.129 1.00 0.64 C ATOM 858 CG LYS A 330 -0.840 13.483 10.261 1.00 0.90 C ATOM 859 CD LYS A 330 0.663 13.674 10.131 1.00 1.51 C ATOM 860 CE LYS A 330 1.199 14.614 11.194 1.00 1.80 C ATOM 861 NZ LYS A 330 2.619 14.966 10.949 1.00 2.08 N ATOM 0 H LYS A 330 -3.105 11.483 10.754 1.00 0.72 H new ATOM 0 HA LYS A 330 -3.253 13.655 8.776 1.00 0.62 H new ATOM 0 HB2 LYS A 330 -1.057 11.603 9.267 1.00 0.64 H new ATOM 0 HB3 LYS A 330 -0.967 12.981 8.187 1.00 0.64 H new ATOM 0 HG2 LYS A 330 -1.333 14.455 10.260 1.00 0.90 H new ATOM 0 HG3 LYS A 330 -1.067 13.011 11.217 1.00 0.90 H new ATOM 0 HD2 LYS A 330 1.162 12.708 10.213 1.00 1.51 H new ATOM 0 HD3 LYS A 330 0.896 14.070 9.143 1.00 1.51 H new ATOM 0 HE2 LYS A 330 0.597 15.522 11.214 1.00 1.80 H new ATOM 0 HE3 LYS A 330 1.104 14.147 12.174 1.00 1.80 H new ATOM 0 HZ1 LYS A 330 2.951 15.610 11.695 1.00 2.08 H new ATOM 0 HZ2 LYS A 330 3.197 14.101 10.955 1.00 2.08 H new ATOM 0 HZ3 LYS A 330 2.706 15.434 10.024 1.00 2.08 H new ATOM 875 N PRO A 331 -4.274 12.151 7.043 1.00 0.49 N ATOM 876 CA PRO A 331 -4.645 11.424 5.843 1.00 0.43 C ATOM 877 C PRO A 331 -3.749 11.776 4.655 1.00 0.39 C ATOM 878 O PRO A 331 -3.295 12.915 4.521 1.00 0.55 O ATOM 879 CB PRO A 331 -6.074 11.890 5.606 1.00 0.53 C ATOM 880 CG PRO A 331 -6.101 13.299 6.100 1.00 0.62 C ATOM 881 CD PRO A 331 -5.034 13.410 7.166 1.00 0.60 C ATOM 0 HA PRO A 331 -4.544 10.344 5.953 1.00 0.43 H new ATOM 0 HB2 PRO A 331 -6.338 11.836 4.550 1.00 0.53 H new ATOM 0 HB3 PRO A 331 -6.788 11.268 6.145 1.00 0.53 H new ATOM 0 HG2 PRO A 331 -5.908 13.998 5.286 1.00 0.62 H new ATOM 0 HG3 PRO A 331 -7.081 13.547 6.507 1.00 0.62 H new ATOM 0 HD2 PRO A 331 -4.396 14.279 7.003 1.00 0.60 H new ATOM 0 HD3 PRO A 331 -5.471 13.517 8.159 1.00 0.60 H new ATOM 889 N PHE A 332 -3.492 10.803 3.803 1.00 0.28 N ATOM 890 CA PHE A 332 -2.732 11.046 2.587 1.00 0.29 C ATOM 891 C PHE A 332 -3.651 10.904 1.380 1.00 0.27 C ATOM 892 O PHE A 332 -4.236 9.842 1.166 1.00 0.26 O ATOM 893 CB PHE A 332 -1.551 10.074 2.484 1.00 0.31 C ATOM 894 CG PHE A 332 -0.633 10.351 1.327 1.00 0.40 C ATOM 895 CD1 PHE A 332 0.231 11.434 1.359 1.00 0.53 C ATOM 896 CD2 PHE A 332 -0.630 9.527 0.216 1.00 0.42 C ATOM 897 CE1 PHE A 332 1.081 11.690 0.300 1.00 0.64 C ATOM 898 CE2 PHE A 332 0.215 9.778 -0.847 1.00 0.53 C ATOM 899 CZ PHE A 332 1.073 10.860 -0.806 1.00 0.63 C ATOM 0 H PHE A 332 -3.797 9.838 3.928 1.00 0.28 H new ATOM 0 HA PHE A 332 -2.330 12.059 2.613 1.00 0.29 H new ATOM 0 HB2 PHE A 332 -0.976 10.117 3.409 1.00 0.31 H new ATOM 0 HB3 PHE A 332 -1.936 9.058 2.394 1.00 0.31 H new ATOM 0 HD1 PHE A 332 0.240 12.085 2.221 1.00 0.53 H new ATOM 0 HD2 PHE A 332 -1.296 8.678 0.179 1.00 0.42 H new ATOM 0 HE1 PHE A 332 1.750 12.537 0.336 1.00 0.64 H new ATOM 0 HE2 PHE A 332 0.205 9.129 -1.710 1.00 0.53 H new ATOM 0 HZ PHE A 332 1.736 11.057 -1.636 1.00 0.63 H new ATOM 909 N VAL A 333 -3.794 11.973 0.610 1.00 0.29 N ATOM 910 CA VAL A 333 -4.693 11.969 -0.535 1.00 0.30 C ATOM 911 C VAL A 333 -3.908 12.040 -1.842 1.00 0.30 C ATOM 912 O VAL A 333 -3.078 12.930 -2.028 1.00 0.36 O ATOM 913 CB VAL A 333 -5.694 13.145 -0.472 1.00 0.34 C ATOM 914 CG1 VAL A 333 -6.681 13.082 -1.633 1.00 0.38 C ATOM 915 CG2 VAL A 333 -6.429 13.159 0.863 1.00 0.36 C ATOM 0 H VAL A 333 -3.300 12.853 0.757 1.00 0.29 H new ATOM 0 HA VAL A 333 -5.252 11.034 -0.501 1.00 0.30 H new ATOM 0 HB VAL A 333 -5.130 14.074 -0.559 1.00 0.34 H new ATOM 0 HG11 VAL A 333 -7.375 13.920 -1.567 1.00 0.38 H new ATOM 0 HG12 VAL A 333 -6.137 13.135 -2.576 1.00 0.38 H new ATOM 0 HG13 VAL A 333 -7.237 12.146 -1.587 1.00 0.38 H new ATOM 0 HG21 VAL A 333 -7.128 13.995 0.885 1.00 0.36 H new ATOM 0 HG22 VAL A 333 -6.977 12.225 0.987 1.00 0.36 H new ATOM 0 HG23 VAL A 333 -5.709 13.267 1.674 1.00 0.36 H new ATOM 925 N PHE A 334 -4.168 11.097 -2.736 1.00 0.29 N ATOM 926 CA PHE A 334 -3.512 11.074 -4.033 1.00 0.31 C ATOM 927 C PHE A 334 -4.394 10.366 -5.057 1.00 0.28 C ATOM 928 O PHE A 334 -5.393 9.747 -4.699 1.00 0.30 O ATOM 929 CB PHE A 334 -2.148 10.374 -3.937 1.00 0.33 C ATOM 930 CG PHE A 334 -2.233 8.878 -3.778 1.00 0.31 C ATOM 931 CD1 PHE A 334 -2.067 8.036 -4.865 1.00 0.36 C ATOM 932 CD2 PHE A 334 -2.482 8.316 -2.533 1.00 0.33 C ATOM 933 CE1 PHE A 334 -2.149 6.667 -4.714 1.00 0.39 C ATOM 934 CE2 PHE A 334 -2.565 6.946 -2.377 1.00 0.39 C ATOM 935 CZ PHE A 334 -2.381 6.117 -3.498 1.00 0.41 C ATOM 0 H PHE A 334 -4.831 10.336 -2.585 1.00 0.29 H new ATOM 0 HA PHE A 334 -3.351 12.103 -4.356 1.00 0.31 H new ATOM 0 HB2 PHE A 334 -1.572 10.601 -4.834 1.00 0.33 H new ATOM 0 HB3 PHE A 334 -1.598 10.788 -3.092 1.00 0.33 H new ATOM 0 HD1 PHE A 334 -1.871 8.455 -5.841 1.00 0.36 H new ATOM 0 HD2 PHE A 334 -2.613 8.959 -1.675 1.00 0.33 H new ATOM 0 HE1 PHE A 334 -2.027 6.027 -5.575 1.00 0.39 H new ATOM 0 HE2 PHE A 334 -2.769 6.517 -1.407 1.00 0.39 H new ATOM 0 HZ PHE A 334 -2.425 5.043 -3.390 1.00 0.41 H new ATOM 945 N LYS A 335 -4.032 10.459 -6.327 1.00 0.33 N ATOM 946 CA LYS A 335 -4.771 9.771 -7.369 1.00 0.35 C ATOM 947 C LYS A 335 -3.938 8.662 -8.003 1.00 0.35 C ATOM 948 O LYS A 335 -2.715 8.762 -8.103 1.00 0.43 O ATOM 949 CB LYS A 335 -5.282 10.771 -8.423 1.00 0.53 C ATOM 950 CG LYS A 335 -4.328 11.918 -8.750 1.00 1.05 C ATOM 951 CD LYS A 335 -3.094 11.456 -9.509 1.00 1.46 C ATOM 952 CE LYS A 335 -3.442 10.842 -10.860 1.00 1.95 C ATOM 953 NZ LYS A 335 -4.043 11.836 -11.788 1.00 2.58 N ATOM 0 H LYS A 335 -3.235 11.002 -6.658 1.00 0.33 H new ATOM 0 HA LYS A 335 -5.639 9.296 -6.911 1.00 0.35 H new ATOM 0 HB2 LYS A 335 -5.498 10.226 -9.342 1.00 0.53 H new ATOM 0 HB3 LYS A 335 -6.224 11.192 -8.073 1.00 0.53 H new ATOM 0 HG2 LYS A 335 -4.855 12.666 -9.342 1.00 1.05 H new ATOM 0 HG3 LYS A 335 -4.020 12.404 -7.824 1.00 1.05 H new ATOM 0 HD2 LYS A 335 -2.424 12.303 -9.659 1.00 1.46 H new ATOM 0 HD3 LYS A 335 -2.553 10.724 -8.908 1.00 1.46 H new ATOM 0 HE2 LYS A 335 -2.542 10.424 -11.311 1.00 1.95 H new ATOM 0 HE3 LYS A 335 -4.138 10.016 -10.714 1.00 1.95 H new ATOM 0 HZ1 LYS A 335 -4.139 11.414 -12.734 1.00 2.58 H new ATOM 0 HZ2 LYS A 335 -4.981 12.116 -11.437 1.00 2.58 H new ATOM 0 HZ3 LYS A 335 -3.430 12.674 -11.843 1.00 2.58 H new ATOM 967 N LEU A 336 -4.607 7.592 -8.397 1.00 0.33 N ATOM 968 CA LEU A 336 -3.949 6.477 -9.064 1.00 0.41 C ATOM 969 C LEU A 336 -3.693 6.814 -10.525 1.00 0.51 C ATOM 970 O LEU A 336 -4.431 7.597 -11.129 1.00 0.58 O ATOM 971 CB LEU A 336 -4.785 5.197 -8.957 1.00 0.40 C ATOM 972 CG LEU A 336 -4.652 4.422 -7.642 1.00 0.38 C ATOM 973 CD1 LEU A 336 -5.191 5.224 -6.469 1.00 0.33 C ATOM 974 CD2 LEU A 336 -5.372 3.095 -7.746 1.00 0.46 C ATOM 0 H LEU A 336 -5.611 7.470 -8.266 1.00 0.33 H new ATOM 0 HA LEU A 336 -2.995 6.302 -8.566 1.00 0.41 H new ATOM 0 HB2 LEU A 336 -5.834 5.458 -9.099 1.00 0.40 H new ATOM 0 HB3 LEU A 336 -4.507 4.535 -9.777 1.00 0.40 H new ATOM 0 HG LEU A 336 -3.592 4.241 -7.463 1.00 0.38 H new ATOM 0 HD11 LEU A 336 -5.082 4.645 -5.552 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -4.633 6.156 -6.379 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -6.245 5.446 -6.634 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -5.271 2.552 -6.806 1.00 0.46 H new ATOM 0 HD22 LEU A 336 -6.428 3.269 -7.953 1.00 0.46 H new ATOM 0 HD23 LEU A 336 -4.936 2.507 -8.553 1.00 0.46 H new ATOM 986 N GLY A 337 -2.645 6.232 -11.083 1.00 0.67 N ATOM 987 CA GLY A 337 -2.278 6.525 -12.450 1.00 0.84 C ATOM 988 C GLY A 337 -1.332 7.700 -12.555 1.00 0.75 C ATOM 989 O GLY A 337 -1.310 8.400 -13.567 1.00 0.94 O ATOM 0 H GLY A 337 -2.040 5.560 -10.612 1.00 0.67 H new ATOM 0 HA2 GLY A 337 -1.811 5.646 -12.894 1.00 0.84 H new ATOM 0 HA3 GLY A 337 -3.178 6.734 -13.028 1.00 0.84 H new ATOM 993 N GLN A 338 -0.560 7.925 -11.501 1.00 0.82 N ATOM 994 CA GLN A 338 0.444 8.974 -11.506 1.00 0.87 C ATOM 995 C GLN A 338 1.832 8.372 -11.305 1.00 0.64 C ATOM 996 O GLN A 338 1.960 7.229 -10.858 1.00 0.63 O ATOM 997 CB GLN A 338 0.153 10.002 -10.410 1.00 1.14 C ATOM 998 CG GLN A 338 0.307 9.458 -8.995 1.00 1.26 C ATOM 999 CD GLN A 338 -0.002 10.501 -7.939 1.00 1.97 C ATOM 1000 OE1 GLN A 338 -0.447 10.056 -6.778 1.00 2.30 O flip ATOM 1001 NE2 GLN A 338 0.161 11.695 -8.163 1.00 2.62 N flip ATOM 0 H GLN A 338 -0.612 7.393 -10.632 1.00 0.82 H new ATOM 0 HA GLN A 338 0.412 9.479 -12.471 1.00 0.87 H new ATOM 0 HB2 GLN A 338 0.823 10.852 -10.536 1.00 1.14 H new ATOM 0 HB3 GLN A 338 -0.863 10.375 -10.536 1.00 1.14 H new ATOM 0 HG2 GLN A 338 -0.356 8.603 -8.863 1.00 1.26 H new ATOM 0 HG3 GLN A 338 1.326 9.095 -8.857 1.00 1.26 H new ATOM 0 HE21 GLN A 338 0.507 12.001 -9.073 1.00 2.62 H new ATOM 0 HE22 GLN A 338 -0.049 12.383 -7.440 1.00 2.62 H new ATOM 1010 N GLY A 339 2.861 9.143 -11.629 1.00 0.74 N ATOM 1011 CA GLY A 339 4.224 8.670 -11.479 1.00 0.70 C ATOM 1012 C GLY A 339 4.826 9.064 -10.148 1.00 0.55 C ATOM 1013 O GLY A 339 5.995 8.786 -9.883 1.00 0.70 O ATOM 0 H GLY A 339 2.776 10.091 -11.995 1.00 0.74 H new ATOM 0 HA2 GLY A 339 4.242 7.584 -11.576 1.00 0.70 H new ATOM 0 HA3 GLY A 339 4.837 9.073 -12.286 1.00 0.70 H new ATOM 1017 N GLU A 340 4.021 9.714 -9.313 1.00 0.49 N ATOM 1018 CA GLU A 340 4.475 10.175 -8.005 1.00 0.54 C ATOM 1019 C GLU A 340 4.556 9.014 -7.017 1.00 0.41 C ATOM 1020 O GLU A 340 5.307 9.062 -6.046 1.00 0.53 O ATOM 1021 CB GLU A 340 3.524 11.248 -7.461 1.00 0.82 C ATOM 1022 CG GLU A 340 3.214 12.355 -8.458 1.00 1.01 C ATOM 1023 CD GLU A 340 4.451 13.079 -8.942 1.00 1.53 C ATOM 1024 OE1 GLU A 340 4.838 14.089 -8.315 1.00 2.09 O ATOM 1025 OE2 GLU A 340 5.030 12.653 -9.960 1.00 1.89 O ATOM 0 H GLU A 340 3.047 9.934 -9.520 1.00 0.49 H new ATOM 0 HA GLU A 340 5.471 10.602 -8.125 1.00 0.54 H new ATOM 0 HB2 GLU A 340 2.591 10.773 -7.157 1.00 0.82 H new ATOM 0 HB3 GLU A 340 3.963 11.690 -6.566 1.00 0.82 H new ATOM 0 HG2 GLU A 340 2.691 11.929 -9.314 1.00 1.01 H new ATOM 0 HG3 GLU A 340 2.537 13.073 -7.996 1.00 1.01 H new ATOM 1032 N VAL A 341 3.776 7.971 -7.272 1.00 0.34 N ATOM 1033 CA VAL A 341 3.743 6.816 -6.391 1.00 0.30 C ATOM 1034 C VAL A 341 4.417 5.617 -7.047 1.00 0.29 C ATOM 1035 O VAL A 341 4.455 5.510 -8.275 1.00 0.36 O ATOM 1036 CB VAL A 341 2.297 6.437 -5.989 1.00 0.35 C ATOM 1037 CG1 VAL A 341 1.614 7.596 -5.279 1.00 0.41 C ATOM 1038 CG2 VAL A 341 1.485 6.006 -7.202 1.00 0.43 C ATOM 0 H VAL A 341 3.159 7.903 -8.082 1.00 0.34 H new ATOM 0 HA VAL A 341 4.288 7.091 -5.488 1.00 0.30 H new ATOM 0 HB VAL A 341 2.353 5.593 -5.301 1.00 0.35 H new ATOM 0 HG11 VAL A 341 0.599 7.308 -5.005 1.00 0.41 H new ATOM 0 HG12 VAL A 341 2.173 7.852 -4.379 1.00 0.41 H new ATOM 0 HG13 VAL A 341 1.579 8.460 -5.943 1.00 0.41 H new ATOM 0 HG21 VAL A 341 0.474 5.746 -6.889 1.00 0.43 H new ATOM 0 HG22 VAL A 341 1.443 6.824 -7.921 1.00 0.43 H new ATOM 0 HG23 VAL A 341 1.956 5.139 -7.666 1.00 0.43 H new ATOM 1048 N ILE A 342 4.954 4.720 -6.229 1.00 0.29 N ATOM 1049 CA ILE A 342 5.596 3.516 -6.737 1.00 0.30 C ATOM 1050 C ILE A 342 4.544 2.569 -7.308 1.00 0.31 C ATOM 1051 O ILE A 342 3.371 2.634 -6.933 1.00 0.32 O ATOM 1052 CB ILE A 342 6.425 2.801 -5.643 1.00 0.30 C ATOM 1053 CG1 ILE A 342 5.524 2.344 -4.490 1.00 0.30 C ATOM 1054 CG2 ILE A 342 7.535 3.716 -5.133 1.00 0.32 C ATOM 1055 CD1 ILE A 342 6.279 1.770 -3.310 1.00 0.32 C ATOM 0 H ILE A 342 4.957 4.804 -5.212 1.00 0.29 H new ATOM 0 HA ILE A 342 6.285 3.812 -7.528 1.00 0.30 H new ATOM 0 HB ILE A 342 6.884 1.916 -6.083 1.00 0.30 H new ATOM 0 HG12 ILE A 342 4.928 3.191 -4.150 1.00 0.30 H new ATOM 0 HG13 ILE A 342 4.827 1.593 -4.862 1.00 0.30 H new ATOM 0 HG21 ILE A 342 8.109 3.198 -4.364 1.00 0.32 H new ATOM 0 HG22 ILE A 342 8.194 3.984 -5.959 1.00 0.32 H new ATOM 0 HG23 ILE A 342 7.096 4.620 -4.711 1.00 0.32 H new ATOM 0 HD11 ILE A 342 5.572 1.470 -2.537 1.00 0.32 H new ATOM 0 HD12 ILE A 342 6.853 0.902 -3.633 1.00 0.32 H new ATOM 0 HD13 ILE A 342 6.956 2.524 -2.910 1.00 0.32 H new ATOM 1067 N LYS A 343 4.960 1.696 -8.214 1.00 0.34 N ATOM 1068 CA LYS A 343 4.026 0.810 -8.900 1.00 0.38 C ATOM 1069 C LYS A 343 3.365 -0.160 -7.929 1.00 0.32 C ATOM 1070 O LYS A 343 2.217 -0.530 -8.123 1.00 0.36 O ATOM 1071 CB LYS A 343 4.731 0.061 -10.032 1.00 0.46 C ATOM 1072 CG LYS A 343 5.099 0.957 -11.211 1.00 0.60 C ATOM 1073 CD LYS A 343 4.247 0.663 -12.447 1.00 1.39 C ATOM 1074 CE LYS A 343 2.757 0.885 -12.199 1.00 2.16 C ATOM 1075 NZ LYS A 343 2.408 2.326 -12.076 1.00 2.93 N ATOM 0 H LYS A 343 5.935 1.581 -8.492 1.00 0.34 H new ATOM 0 HA LYS A 343 3.237 1.424 -9.335 1.00 0.38 H new ATOM 0 HB2 LYS A 343 5.636 -0.404 -9.642 1.00 0.46 H new ATOM 0 HB3 LYS A 343 4.085 -0.743 -10.384 1.00 0.46 H new ATOM 0 HG2 LYS A 343 4.973 2.001 -10.925 1.00 0.60 H new ATOM 0 HG3 LYS A 343 6.152 0.818 -11.456 1.00 0.60 H new ATOM 0 HD2 LYS A 343 4.574 1.300 -13.269 1.00 1.39 H new ATOM 0 HD3 LYS A 343 4.410 -0.369 -12.759 1.00 1.39 H new ATOM 0 HE2 LYS A 343 2.186 0.445 -13.017 1.00 2.16 H new ATOM 0 HE3 LYS A 343 2.462 0.364 -11.288 1.00 2.16 H new ATOM 0 HZ1 LYS A 343 1.374 2.433 -12.062 1.00 2.93 H new ATOM 0 HZ2 LYS A 343 2.808 2.706 -11.194 1.00 2.93 H new ATOM 0 HZ3 LYS A 343 2.799 2.848 -12.886 1.00 2.93 H new ATOM 1089 N GLY A 344 4.087 -0.565 -6.888 1.00 0.28 N ATOM 1090 CA GLY A 344 3.486 -1.377 -5.840 1.00 0.28 C ATOM 1091 C GLY A 344 2.227 -0.738 -5.269 1.00 0.27 C ATOM 1092 O GLY A 344 1.230 -1.418 -5.030 1.00 0.30 O ATOM 0 H GLY A 344 5.074 -0.347 -6.750 1.00 0.28 H new ATOM 0 HA2 GLY A 344 3.243 -2.361 -6.240 1.00 0.28 H new ATOM 0 HA3 GLY A 344 4.210 -1.528 -5.039 1.00 0.28 H new ATOM 1096 N TRP A 345 2.278 0.572 -5.059 1.00 0.27 N ATOM 1097 CA TRP A 345 1.111 1.327 -4.607 1.00 0.27 C ATOM 1098 C TRP A 345 0.073 1.421 -5.719 1.00 0.29 C ATOM 1099 O TRP A 345 -1.058 0.982 -5.558 1.00 0.32 O ATOM 1100 CB TRP A 345 1.523 2.729 -4.158 1.00 0.27 C ATOM 1101 CG TRP A 345 1.921 2.811 -2.722 1.00 0.28 C ATOM 1102 CD1 TRP A 345 2.980 2.200 -2.120 1.00 0.32 C ATOM 1103 CD2 TRP A 345 1.253 3.556 -1.706 1.00 0.28 C ATOM 1104 NE1 TRP A 345 3.009 2.519 -0.785 1.00 0.36 N ATOM 1105 CE2 TRP A 345 1.957 3.351 -0.507 1.00 0.34 C ATOM 1106 CE3 TRP A 345 0.129 4.380 -1.698 1.00 0.27 C ATOM 1107 CZ2 TRP A 345 1.564 3.935 0.693 1.00 0.39 C ATOM 1108 CZ3 TRP A 345 -0.260 4.961 -0.510 1.00 0.32 C ATOM 1109 CH2 TRP A 345 0.458 4.738 0.674 1.00 0.37 C ATOM 0 H TRP A 345 3.117 1.137 -5.194 1.00 0.27 H new ATOM 0 HA TRP A 345 0.671 0.801 -3.760 1.00 0.27 H new ATOM 0 HB2 TRP A 345 2.355 3.068 -4.775 1.00 0.27 H new ATOM 0 HB3 TRP A 345 0.695 3.415 -4.335 1.00 0.27 H new ATOM 0 HD1 TRP A 345 3.692 1.559 -2.620 1.00 0.32 H new ATOM 0 HE1 TRP A 345 3.700 2.190 -0.111 1.00 0.36 H new ATOM 0 HE3 TRP A 345 -0.427 4.560 -2.606 1.00 0.27 H new ATOM 0 HZ2 TRP A 345 2.113 3.760 1.607 1.00 0.39 H new ATOM 0 HZ3 TRP A 345 -1.132 5.598 -0.491 1.00 0.32 H new ATOM 0 HH2 TRP A 345 0.131 5.210 1.589 1.00 0.37 H new ATOM 1120 N ASP A 346 0.482 1.987 -6.846 1.00 0.34 N ATOM 1121 CA ASP A 346 -0.389 2.173 -8.014 1.00 0.40 C ATOM 1122 C ASP A 346 -1.134 0.886 -8.398 1.00 0.39 C ATOM 1123 O ASP A 346 -2.265 0.931 -8.878 1.00 0.46 O ATOM 1124 CB ASP A 346 0.472 2.670 -9.178 1.00 0.49 C ATOM 1125 CG ASP A 346 -0.320 3.003 -10.424 1.00 0.84 C ATOM 1126 OD1 ASP A 346 -1.019 4.038 -10.420 1.00 1.75 O ATOM 1127 OD2 ASP A 346 -0.300 2.199 -11.383 1.00 0.97 O ATOM 0 H ASP A 346 1.431 2.334 -6.983 1.00 0.34 H new ATOM 0 HA ASP A 346 -1.157 2.906 -7.767 1.00 0.40 H new ATOM 0 HB2 ASP A 346 1.021 3.556 -8.860 1.00 0.49 H new ATOM 0 HB3 ASP A 346 1.212 1.908 -9.422 1.00 0.49 H new ATOM 1132 N ILE A 347 -0.500 -0.255 -8.169 1.00 0.34 N ATOM 1133 CA ILE A 347 -1.099 -1.548 -8.477 1.00 0.35 C ATOM 1134 C ILE A 347 -1.913 -2.094 -7.297 1.00 0.35 C ATOM 1135 O ILE A 347 -3.079 -2.456 -7.454 1.00 0.38 O ATOM 1136 CB ILE A 347 -0.009 -2.570 -8.880 1.00 0.35 C ATOM 1137 CG1 ILE A 347 0.666 -2.131 -10.183 1.00 0.36 C ATOM 1138 CG2 ILE A 347 -0.591 -3.966 -9.030 1.00 0.38 C ATOM 1139 CD1 ILE A 347 1.771 -3.057 -10.645 1.00 0.39 C ATOM 0 H ILE A 347 0.436 -0.312 -7.768 1.00 0.34 H new ATOM 0 HA ILE A 347 -1.779 -1.397 -9.315 1.00 0.35 H new ATOM 0 HB ILE A 347 0.737 -2.603 -8.086 1.00 0.35 H new ATOM 0 HG12 ILE A 347 -0.089 -2.063 -10.966 1.00 0.36 H new ATOM 0 HG13 ILE A 347 1.077 -1.130 -10.048 1.00 0.36 H new ATOM 0 HG21 ILE A 347 0.199 -4.661 -9.314 1.00 0.38 H new ATOM 0 HG22 ILE A 347 -1.029 -4.281 -8.083 1.00 0.38 H new ATOM 0 HG23 ILE A 347 -1.361 -3.958 -9.801 1.00 0.38 H new ATOM 0 HD11 ILE A 347 2.199 -2.678 -11.573 1.00 0.39 H new ATOM 0 HD12 ILE A 347 2.547 -3.107 -9.881 1.00 0.39 H new ATOM 0 HD13 ILE A 347 1.364 -4.054 -10.814 1.00 0.39 H new ATOM 1151 N GLY A 348 -1.289 -2.167 -6.123 1.00 0.33 N ATOM 1152 CA GLY A 348 -1.954 -2.717 -4.947 1.00 0.34 C ATOM 1153 C GLY A 348 -3.151 -1.903 -4.487 1.00 0.31 C ATOM 1154 O GLY A 348 -4.120 -2.452 -3.955 1.00 0.34 O ATOM 0 H GLY A 348 -0.331 -1.855 -5.963 1.00 0.33 H new ATOM 0 HA2 GLY A 348 -2.280 -3.734 -5.167 1.00 0.34 H new ATOM 0 HA3 GLY A 348 -1.235 -2.782 -4.131 1.00 0.34 H new ATOM 1158 N VAL A 349 -3.083 -0.592 -4.670 1.00 0.28 N ATOM 1159 CA VAL A 349 -4.170 0.296 -4.268 1.00 0.27 C ATOM 1160 C VAL A 349 -5.317 0.259 -5.287 1.00 0.24 C ATOM 1161 O VAL A 349 -6.443 0.671 -4.992 1.00 0.24 O ATOM 1162 CB VAL A 349 -3.658 1.747 -4.081 1.00 0.28 C ATOM 1163 CG1 VAL A 349 -4.783 2.704 -3.712 1.00 0.28 C ATOM 1164 CG2 VAL A 349 -2.572 1.792 -3.017 1.00 0.32 C ATOM 0 H VAL A 349 -2.286 -0.117 -5.095 1.00 0.28 H new ATOM 0 HA VAL A 349 -4.553 -0.059 -3.311 1.00 0.27 H new ATOM 0 HB VAL A 349 -3.245 2.070 -5.036 1.00 0.28 H new ATOM 0 HG11 VAL A 349 -4.380 3.710 -3.590 1.00 0.28 H new ATOM 0 HG12 VAL A 349 -5.533 2.707 -4.503 1.00 0.28 H new ATOM 0 HG13 VAL A 349 -5.243 2.382 -2.778 1.00 0.28 H new ATOM 0 HG21 VAL A 349 -2.222 2.817 -2.897 1.00 0.32 H new ATOM 0 HG22 VAL A 349 -2.975 1.433 -2.070 1.00 0.32 H new ATOM 0 HG23 VAL A 349 -1.739 1.158 -3.320 1.00 0.32 H new ATOM 1174 N ALA A 350 -5.033 -0.259 -6.477 1.00 0.28 N ATOM 1175 CA ALA A 350 -6.041 -0.379 -7.520 1.00 0.28 C ATOM 1176 C ALA A 350 -7.130 -1.355 -7.091 1.00 0.30 C ATOM 1177 O ALA A 350 -6.921 -2.569 -7.052 1.00 0.47 O ATOM 1178 CB ALA A 350 -5.406 -0.818 -8.836 1.00 0.37 C ATOM 0 H ALA A 350 -4.110 -0.603 -6.742 1.00 0.28 H new ATOM 0 HA ALA A 350 -6.497 0.599 -7.677 1.00 0.28 H new ATOM 0 HB1 ALA A 350 -6.177 -0.902 -9.602 1.00 0.37 H new ATOM 0 HB2 ALA A 350 -4.665 -0.081 -9.146 1.00 0.37 H new ATOM 0 HB3 ALA A 350 -4.922 -1.785 -8.702 1.00 0.37 H new ATOM 1184 N GLY A 351 -8.288 -0.808 -6.753 1.00 0.30 N ATOM 1185 CA GLY A 351 -9.389 -1.621 -6.292 1.00 0.37 C ATOM 1186 C GLY A 351 -9.501 -1.646 -4.781 1.00 0.33 C ATOM 1187 O GLY A 351 -10.059 -2.582 -4.208 1.00 0.39 O ATOM 0 H GLY A 351 -8.483 0.192 -6.791 1.00 0.30 H new ATOM 0 HA2 GLY A 351 -10.319 -1.241 -6.715 1.00 0.37 H new ATOM 0 HA3 GLY A 351 -9.263 -2.639 -6.660 1.00 0.37 H new ATOM 1191 N MET A 352 -8.941 -0.630 -4.130 1.00 0.30 N ATOM 1192 CA MET A 352 -9.105 -0.465 -2.688 1.00 0.31 C ATOM 1193 C MET A 352 -10.541 -0.087 -2.351 1.00 0.26 C ATOM 1194 O MET A 352 -11.344 0.173 -3.243 1.00 0.37 O ATOM 1195 CB MET A 352 -8.156 0.605 -2.148 1.00 0.41 C ATOM 1196 CG MET A 352 -6.762 0.089 -1.840 1.00 0.65 C ATOM 1197 SD MET A 352 -6.735 -1.066 -0.456 1.00 1.28 S ATOM 1198 CE MET A 352 -7.283 -0.016 0.886 1.00 0.56 C ATOM 0 H MET A 352 -8.372 0.089 -4.576 1.00 0.30 H new ATOM 0 HA MET A 352 -8.865 -1.418 -2.217 1.00 0.31 H new ATOM 0 HB2 MET A 352 -8.082 1.412 -2.876 1.00 0.41 H new ATOM 0 HB3 MET A 352 -8.584 1.032 -1.241 1.00 0.41 H new ATOM 0 HG2 MET A 352 -6.357 -0.402 -2.725 1.00 0.65 H new ATOM 0 HG3 MET A 352 -6.108 0.932 -1.616 1.00 0.65 H new ATOM 0 HE1 MET A 352 -7.034 -0.484 1.839 1.00 0.56 H new ATOM 0 HE2 MET A 352 -6.787 0.952 0.816 1.00 0.56 H new ATOM 0 HE3 MET A 352 -8.362 0.124 0.821 1.00 0.56 H new ATOM 1208 N ALA A 353 -10.845 -0.043 -1.063 1.00 0.34 N ATOM 1209 CA ALA A 353 -12.193 0.254 -0.601 1.00 0.37 C ATOM 1210 C ALA A 353 -12.169 1.245 0.557 1.00 0.32 C ATOM 1211 O ALA A 353 -11.341 1.125 1.457 1.00 0.34 O ATOM 1212 CB ALA A 353 -12.876 -1.035 -0.169 1.00 0.55 C ATOM 0 H ALA A 353 -10.172 -0.210 -0.315 1.00 0.34 H new ATOM 0 HA ALA A 353 -12.750 0.707 -1.421 1.00 0.37 H new ATOM 0 HB1 ALA A 353 -13.886 -0.813 0.177 1.00 0.55 H new ATOM 0 HB2 ALA A 353 -12.925 -1.722 -1.014 1.00 0.55 H new ATOM 0 HB3 ALA A 353 -12.308 -1.494 0.640 1.00 0.55 H new ATOM 1218 N VAL A 354 -13.068 2.227 0.522 1.00 0.31 N ATOM 1219 CA VAL A 354 -13.220 3.171 1.621 1.00 0.29 C ATOM 1220 C VAL A 354 -13.727 2.446 2.862 1.00 0.29 C ATOM 1221 O VAL A 354 -14.860 1.962 2.906 1.00 0.32 O ATOM 1222 CB VAL A 354 -14.187 4.321 1.262 1.00 0.33 C ATOM 1223 CG1 VAL A 354 -14.311 5.304 2.415 1.00 0.35 C ATOM 1224 CG2 VAL A 354 -13.726 5.039 0.002 1.00 0.36 C ATOM 0 H VAL A 354 -13.703 2.388 -0.260 1.00 0.31 H new ATOM 0 HA VAL A 354 -12.240 3.606 1.819 1.00 0.29 H new ATOM 0 HB VAL A 354 -15.169 3.887 1.073 1.00 0.33 H new ATOM 0 HG11 VAL A 354 -14.997 6.105 2.138 1.00 0.35 H new ATOM 0 HG12 VAL A 354 -14.693 4.786 3.295 1.00 0.35 H new ATOM 0 HG13 VAL A 354 -13.332 5.727 2.640 1.00 0.35 H new ATOM 0 HG21 VAL A 354 -14.421 5.845 -0.233 1.00 0.36 H new ATOM 0 HG22 VAL A 354 -12.731 5.454 0.163 1.00 0.36 H new ATOM 0 HG23 VAL A 354 -13.695 4.333 -0.828 1.00 0.36 H new ATOM 1234 N GLY A 355 -12.872 2.366 3.862 1.00 0.28 N ATOM 1235 CA GLY A 355 -13.167 1.576 5.028 1.00 0.30 C ATOM 1236 C GLY A 355 -12.371 0.291 5.001 1.00 0.30 C ATOM 1237 O GLY A 355 -12.088 -0.299 6.044 1.00 0.44 O ATOM 0 H GLY A 355 -11.969 2.840 3.885 1.00 0.28 H new ATOM 0 HA2 GLY A 355 -12.929 2.141 5.929 1.00 0.30 H new ATOM 0 HA3 GLY A 355 -14.233 1.352 5.064 1.00 0.30 H new ATOM 1241 N GLY A 356 -11.981 -0.124 3.798 1.00 0.26 N ATOM 1242 CA GLY A 356 -11.212 -1.335 3.632 1.00 0.30 C ATOM 1243 C GLY A 356 -9.778 -1.162 4.078 1.00 0.25 C ATOM 1244 O GLY A 356 -9.185 -0.093 3.918 1.00 0.27 O ATOM 0 H GLY A 356 -12.190 0.367 2.929 1.00 0.26 H new ATOM 0 HA2 GLY A 356 -11.675 -2.139 4.204 1.00 0.30 H new ATOM 0 HA3 GLY A 356 -11.232 -1.636 2.585 1.00 0.30 H new ATOM 1248 N GLU A 357 -9.229 -2.227 4.625 1.00 0.27 N ATOM 1249 CA GLU A 357 -7.913 -2.213 5.242 1.00 0.33 C ATOM 1250 C GLU A 357 -7.158 -3.456 4.784 1.00 0.30 C ATOM 1251 O GLU A 357 -7.722 -4.546 4.807 1.00 0.34 O ATOM 1252 CB GLU A 357 -8.135 -2.216 6.759 1.00 0.48 C ATOM 1253 CG GLU A 357 -6.926 -1.931 7.627 1.00 0.99 C ATOM 1254 CD GLU A 357 -7.321 -1.843 9.092 1.00 1.06 C ATOM 1255 OE1 GLU A 357 -6.769 -2.602 9.915 1.00 1.18 O ATOM 1256 OE2 GLU A 357 -8.225 -1.040 9.411 1.00 1.41 O ATOM 0 H GLU A 357 -9.687 -3.138 4.655 1.00 0.27 H new ATOM 0 HA GLU A 357 -7.326 -1.338 4.962 1.00 0.33 H new ATOM 0 HB2 GLU A 357 -8.902 -1.477 6.992 1.00 0.48 H new ATOM 0 HB3 GLU A 357 -8.534 -3.190 7.042 1.00 0.48 H new ATOM 0 HG2 GLU A 357 -6.183 -2.717 7.493 1.00 0.99 H new ATOM 0 HG3 GLU A 357 -6.461 -0.996 7.314 1.00 0.99 H new ATOM 1263 N ARG A 358 -5.917 -3.312 4.333 1.00 0.31 N ATOM 1264 CA ARG A 358 -5.172 -4.464 3.838 1.00 0.30 C ATOM 1265 C ARG A 358 -3.664 -4.272 3.943 1.00 0.28 C ATOM 1266 O ARG A 358 -3.150 -3.160 3.825 1.00 0.31 O ATOM 1267 CB ARG A 358 -5.545 -4.779 2.385 1.00 0.37 C ATOM 1268 CG ARG A 358 -5.278 -3.655 1.404 1.00 0.73 C ATOM 1269 CD ARG A 358 -5.342 -4.154 -0.034 1.00 0.75 C ATOM 1270 NE ARG A 358 -6.550 -4.934 -0.306 1.00 0.93 N ATOM 1271 CZ ARG A 358 -7.270 -4.834 -1.422 1.00 1.09 C ATOM 1272 NH1 ARG A 358 -6.919 -3.975 -2.377 1.00 1.17 N ATOM 1273 NH2 ARG A 358 -8.346 -5.594 -1.570 1.00 1.37 N ATOM 0 H ARG A 358 -5.413 -2.426 4.300 1.00 0.31 H new ATOM 0 HA ARG A 358 -5.450 -5.303 4.476 1.00 0.30 H new ATOM 0 HB2 ARG A 358 -4.991 -5.661 2.065 1.00 0.37 H new ATOM 0 HB3 ARG A 358 -6.604 -5.035 2.343 1.00 0.37 H new ATOM 0 HG2 ARG A 358 -6.010 -2.860 1.549 1.00 0.73 H new ATOM 0 HG3 ARG A 358 -4.296 -3.224 1.599 1.00 0.73 H new ATOM 0 HD2 ARG A 358 -5.304 -3.302 -0.712 1.00 0.75 H new ATOM 0 HD3 ARG A 358 -4.464 -4.766 -0.242 1.00 0.75 H new ATOM 0 HE ARG A 358 -6.860 -5.597 0.405 1.00 0.93 H new ATOM 0 HH11 ARG A 358 -6.094 -3.388 -2.257 1.00 1.17 H new ATOM 0 HH12 ARG A 358 -7.475 -3.904 -3.229 1.00 1.17 H new ATOM 0 HH21 ARG A 358 -8.615 -6.247 -0.834 1.00 1.37 H new ATOM 0 HH22 ARG A 358 -8.905 -5.526 -2.420 1.00 1.37 H new ATOM 1287 N ARG A 359 -2.963 -5.379 4.157 1.00 0.26 N ATOM 1288 CA ARG A 359 -1.511 -5.381 4.208 1.00 0.27 C ATOM 1289 C ARG A 359 -0.945 -5.604 2.810 1.00 0.31 C ATOM 1290 O ARG A 359 -1.145 -6.663 2.211 1.00 0.40 O ATOM 1291 CB ARG A 359 -1.019 -6.479 5.159 1.00 0.35 C ATOM 1292 CG ARG A 359 0.488 -6.485 5.364 1.00 0.85 C ATOM 1293 CD ARG A 359 0.903 -7.450 6.466 1.00 0.93 C ATOM 1294 NE ARG A 359 0.376 -8.799 6.253 1.00 1.42 N ATOM 1295 CZ ARG A 359 1.134 -9.895 6.157 1.00 1.87 C ATOM 1296 NH1 ARG A 359 2.457 -9.806 6.185 1.00 1.91 N ATOM 1297 NH2 ARG A 359 0.571 -11.085 6.019 1.00 2.79 N ATOM 0 H ARG A 359 -3.386 -6.296 4.299 1.00 0.26 H new ATOM 0 HA ARG A 359 -1.167 -4.416 4.580 1.00 0.27 H new ATOM 0 HB2 ARG A 359 -1.507 -6.355 6.126 1.00 0.35 H new ATOM 0 HB3 ARG A 359 -1.327 -7.449 4.769 1.00 0.35 H new ATOM 0 HG2 ARG A 359 0.981 -6.763 4.432 1.00 0.85 H new ATOM 0 HG3 ARG A 359 0.825 -5.479 5.615 1.00 0.85 H new ATOM 0 HD2 ARG A 359 1.991 -7.492 6.518 1.00 0.93 H new ATOM 0 HD3 ARG A 359 0.552 -7.073 7.427 1.00 0.93 H new ATOM 0 HE ARG A 359 -0.635 -8.909 6.173 1.00 1.42 H new ATOM 0 HH11 ARG A 359 2.905 -8.895 6.281 1.00 1.91 H new ATOM 0 HH12 ARG A 359 3.027 -10.649 6.111 1.00 1.91 H new ATOM 0 HH21 ARG A 359 -0.445 -11.168 5.986 1.00 2.79 H new ATOM 0 HH22 ARG A 359 1.153 -11.919 5.946 1.00 2.79 H new ATOM 1311 N ILE A 360 -0.259 -4.602 2.287 1.00 0.29 N ATOM 1312 CA ILE A 360 0.348 -4.698 0.969 1.00 0.30 C ATOM 1313 C ILE A 360 1.847 -4.941 1.103 1.00 0.31 C ATOM 1314 O ILE A 360 2.570 -4.128 1.679 1.00 0.34 O ATOM 1315 CB ILE A 360 0.100 -3.426 0.122 1.00 0.32 C ATOM 1316 CG1 ILE A 360 -1.403 -3.179 -0.034 1.00 0.34 C ATOM 1317 CG2 ILE A 360 0.764 -3.553 -1.247 1.00 0.35 C ATOM 1318 CD1 ILE A 360 -1.735 -1.925 -0.819 1.00 0.38 C ATOM 0 H ILE A 360 -0.108 -3.709 2.756 1.00 0.29 H new ATOM 0 HA ILE A 360 -0.119 -5.537 0.454 1.00 0.30 H new ATOM 0 HB ILE A 360 0.543 -2.575 0.639 1.00 0.32 H new ATOM 0 HG12 ILE A 360 -1.854 -4.038 -0.530 1.00 0.34 H new ATOM 0 HG13 ILE A 360 -1.856 -3.109 0.955 1.00 0.34 H new ATOM 0 HG21 ILE A 360 0.578 -2.649 -1.827 1.00 0.35 H new ATOM 0 HG22 ILE A 360 1.838 -3.688 -1.119 1.00 0.35 H new ATOM 0 HG23 ILE A 360 0.351 -4.413 -1.774 1.00 0.35 H new ATOM 0 HD11 ILE A 360 -2.817 -1.815 -0.889 1.00 0.38 H new ATOM 0 HD12 ILE A 360 -1.314 -1.057 -0.312 1.00 0.38 H new ATOM 0 HD13 ILE A 360 -1.313 -2.001 -1.821 1.00 0.38 H new ATOM 1330 N VAL A 361 2.305 -6.064 0.587 1.00 0.29 N ATOM 1331 CA VAL A 361 3.710 -6.417 0.637 1.00 0.30 C ATOM 1332 C VAL A 361 4.349 -6.125 -0.716 1.00 0.29 C ATOM 1333 O VAL A 361 4.047 -6.787 -1.712 1.00 0.33 O ATOM 1334 CB VAL A 361 3.890 -7.905 1.002 1.00 0.35 C ATOM 1335 CG1 VAL A 361 5.364 -8.249 1.161 1.00 0.39 C ATOM 1336 CG2 VAL A 361 3.112 -8.234 2.271 1.00 0.38 C ATOM 0 H VAL A 361 1.716 -6.756 0.123 1.00 0.29 H new ATOM 0 HA VAL A 361 4.198 -5.821 1.408 1.00 0.30 H new ATOM 0 HB VAL A 361 3.493 -8.512 0.188 1.00 0.35 H new ATOM 0 HG11 VAL A 361 5.466 -9.303 1.418 1.00 0.39 H new ATOM 0 HG12 VAL A 361 5.887 -8.052 0.225 1.00 0.39 H new ATOM 0 HG13 VAL A 361 5.797 -7.639 1.954 1.00 0.39 H new ATOM 0 HG21 VAL A 361 3.247 -9.287 2.518 1.00 0.38 H new ATOM 0 HG22 VAL A 361 3.479 -7.619 3.093 1.00 0.38 H new ATOM 0 HG23 VAL A 361 2.053 -8.032 2.111 1.00 0.38 H new ATOM 1346 N ILE A 362 5.219 -5.125 -0.752 1.00 0.25 N ATOM 1347 CA ILE A 362 5.755 -4.630 -2.010 1.00 0.25 C ATOM 1348 C ILE A 362 7.213 -5.022 -2.188 1.00 0.26 C ATOM 1349 O ILE A 362 8.090 -4.553 -1.459 1.00 0.29 O ATOM 1350 CB ILE A 362 5.634 -3.095 -2.111 1.00 0.25 C ATOM 1351 CG1 ILE A 362 4.181 -2.665 -1.901 1.00 0.25 C ATOM 1352 CG2 ILE A 362 6.150 -2.607 -3.460 1.00 0.28 C ATOM 1353 CD1 ILE A 362 3.982 -1.165 -1.903 1.00 0.27 C ATOM 0 H ILE A 362 5.568 -4.642 0.076 1.00 0.25 H new ATOM 0 HA ILE A 362 5.162 -5.089 -2.801 1.00 0.25 H new ATOM 0 HB ILE A 362 6.245 -2.644 -1.329 1.00 0.25 H new ATOM 0 HG12 ILE A 362 3.565 -3.105 -2.685 1.00 0.25 H new ATOM 0 HG13 ILE A 362 3.826 -3.068 -0.953 1.00 0.25 H new ATOM 0 HG21 ILE A 362 6.057 -1.522 -3.514 1.00 0.28 H new ATOM 0 HG22 ILE A 362 7.197 -2.888 -3.572 1.00 0.28 H new ATOM 0 HG23 ILE A 362 5.565 -3.062 -4.259 1.00 0.28 H new ATOM 0 HD11 ILE A 362 2.927 -0.938 -1.749 1.00 0.27 H new ATOM 0 HD12 ILE A 362 4.570 -0.719 -1.101 1.00 0.27 H new ATOM 0 HD13 ILE A 362 4.305 -0.756 -2.861 1.00 0.27 H new ATOM 1365 N PRO A 363 7.484 -5.898 -3.164 1.00 0.28 N ATOM 1366 CA PRO A 363 8.846 -6.291 -3.523 1.00 0.29 C ATOM 1367 C PRO A 363 9.651 -5.113 -4.068 1.00 0.26 C ATOM 1368 O PRO A 363 9.087 -4.160 -4.615 1.00 0.27 O ATOM 1369 CB PRO A 363 8.645 -7.349 -4.613 1.00 0.36 C ATOM 1370 CG PRO A 363 7.285 -7.077 -5.151 1.00 0.66 C ATOM 1371 CD PRO A 363 6.481 -6.582 -3.987 1.00 0.36 C ATOM 0 HA PRO A 363 9.406 -6.657 -2.662 1.00 0.29 H new ATOM 0 HB2 PRO A 363 9.404 -7.266 -5.391 1.00 0.36 H new ATOM 0 HB3 PRO A 363 8.716 -8.357 -4.205 1.00 0.36 H new ATOM 0 HG2 PRO A 363 7.320 -6.333 -5.947 1.00 0.66 H new ATOM 0 HG3 PRO A 363 6.844 -7.979 -5.576 1.00 0.66 H new ATOM 0 HD2 PRO A 363 5.687 -5.905 -4.303 1.00 0.36 H new ATOM 0 HD3 PRO A 363 6.005 -7.401 -3.447 1.00 0.36 H new ATOM 1379 N ALA A 364 10.967 -5.209 -3.944 1.00 0.29 N ATOM 1380 CA ALA A 364 11.869 -4.122 -4.312 1.00 0.34 C ATOM 1381 C ALA A 364 11.634 -3.560 -5.727 1.00 0.34 C ATOM 1382 O ALA A 364 11.532 -2.343 -5.875 1.00 0.36 O ATOM 1383 CB ALA A 364 13.312 -4.565 -4.165 1.00 0.42 C ATOM 0 H ALA A 364 11.440 -6.039 -3.587 1.00 0.29 H new ATOM 0 HA ALA A 364 11.650 -3.307 -3.622 1.00 0.34 H new ATOM 0 HB1 ALA A 364 13.974 -3.745 -4.443 1.00 0.42 H new ATOM 0 HB2 ALA A 364 13.501 -4.850 -3.130 1.00 0.42 H new ATOM 0 HB3 ALA A 364 13.499 -5.419 -4.817 1.00 0.42 H new ATOM 1389 N PRO A 365 11.541 -4.408 -6.789 1.00 0.35 N ATOM 1390 CA PRO A 365 11.467 -3.920 -8.181 1.00 0.40 C ATOM 1391 C PRO A 365 10.273 -3.000 -8.447 1.00 0.36 C ATOM 1392 O PRO A 365 10.309 -2.177 -9.359 1.00 0.41 O ATOM 1393 CB PRO A 365 11.343 -5.205 -9.012 1.00 0.47 C ATOM 1394 CG PRO A 365 11.874 -6.281 -8.134 1.00 0.70 C ATOM 1395 CD PRO A 365 11.499 -5.886 -6.740 1.00 0.38 C ATOM 0 HA PRO A 365 12.338 -3.312 -8.425 1.00 0.40 H new ATOM 0 HB2 PRO A 365 10.307 -5.397 -9.290 1.00 0.47 H new ATOM 0 HB3 PRO A 365 11.913 -5.133 -9.938 1.00 0.47 H new ATOM 0 HG2 PRO A 365 11.445 -7.248 -8.396 1.00 0.70 H new ATOM 0 HG3 PRO A 365 12.955 -6.373 -8.238 1.00 0.70 H new ATOM 0 HD2 PRO A 365 10.509 -6.253 -6.469 1.00 0.38 H new ATOM 0 HD3 PRO A 365 12.198 -6.285 -6.006 1.00 0.38 H new ATOM 1403 N TYR A 366 9.225 -3.131 -7.648 1.00 0.31 N ATOM 1404 CA TYR A 366 8.009 -2.351 -7.862 1.00 0.29 C ATOM 1405 C TYR A 366 7.942 -1.157 -6.919 1.00 0.30 C ATOM 1406 O TYR A 366 6.912 -0.485 -6.815 1.00 0.30 O ATOM 1407 CB TYR A 366 6.770 -3.239 -7.719 1.00 0.30 C ATOM 1408 CG TYR A 366 6.571 -4.167 -8.899 1.00 0.36 C ATOM 1409 CD1 TYR A 366 5.383 -4.156 -9.618 1.00 0.43 C ATOM 1410 CD2 TYR A 366 7.560 -5.066 -9.285 1.00 0.53 C ATOM 1411 CE1 TYR A 366 5.182 -5.011 -10.678 1.00 0.50 C ATOM 1412 CE2 TYR A 366 7.368 -5.924 -10.354 1.00 0.64 C ATOM 1413 CZ TYR A 366 6.242 -5.849 -11.089 1.00 0.59 C ATOM 1414 OH TYR A 366 5.961 -6.746 -12.100 1.00 0.69 O ATOM 0 H TYR A 366 9.189 -3.765 -6.850 1.00 0.31 H new ATOM 0 HA TYR A 366 8.033 -1.960 -8.879 1.00 0.29 H new ATOM 0 HB2 TYR A 366 6.857 -3.831 -6.808 1.00 0.30 H new ATOM 0 HB3 TYR A 366 5.888 -2.608 -7.606 1.00 0.30 H new ATOM 0 HD1 TYR A 366 4.602 -3.464 -9.340 1.00 0.43 H new ATOM 0 HD2 TYR A 366 8.493 -5.095 -8.742 1.00 0.53 H new ATOM 0 HE1 TYR A 366 4.230 -5.040 -11.187 1.00 0.50 H new ATOM 0 HE2 TYR A 366 8.123 -6.656 -10.599 1.00 0.64 H new ATOM 0 HH TYR A 366 6.763 -7.271 -12.304 1.00 0.69 H new ATOM 1424 N ALA A 367 9.049 -0.891 -6.243 1.00 0.33 N ATOM 1425 CA ALA A 367 9.166 0.288 -5.405 1.00 0.40 C ATOM 1426 C ALA A 367 10.349 1.148 -5.856 1.00 0.50 C ATOM 1427 O ALA A 367 10.276 1.820 -6.884 1.00 0.86 O ATOM 1428 CB ALA A 367 9.285 -0.104 -3.938 1.00 0.40 C ATOM 0 H ALA A 367 9.882 -1.480 -6.260 1.00 0.33 H new ATOM 0 HA ALA A 367 8.260 0.885 -5.512 1.00 0.40 H new ATOM 0 HB1 ALA A 367 9.372 0.795 -3.327 1.00 0.40 H new ATOM 0 HB2 ALA A 367 8.399 -0.663 -3.638 1.00 0.40 H new ATOM 0 HB3 ALA A 367 10.170 -0.725 -3.798 1.00 0.40 H new ATOM 1434 N TYR A 368 11.435 1.132 -5.089 1.00 0.44 N ATOM 1435 CA TYR A 368 12.629 1.890 -5.450 1.00 0.52 C ATOM 1436 C TYR A 368 13.605 1.044 -6.258 1.00 0.51 C ATOM 1437 O TYR A 368 14.512 1.574 -6.901 1.00 0.58 O ATOM 1438 CB TYR A 368 13.312 2.438 -4.198 1.00 0.57 C ATOM 1439 CG TYR A 368 12.432 3.384 -3.411 1.00 0.63 C ATOM 1440 CD1 TYR A 368 12.295 4.716 -3.784 1.00 0.74 C ATOM 1441 CD2 TYR A 368 11.749 2.946 -2.283 1.00 0.69 C ATOM 1442 CE1 TYR A 368 11.500 5.581 -3.056 1.00 0.85 C ATOM 1443 CE2 TYR A 368 10.951 3.805 -1.552 1.00 0.80 C ATOM 1444 CZ TYR A 368 10.800 5.125 -1.983 1.00 0.86 C ATOM 1445 OH TYR A 368 10.037 5.980 -1.217 1.00 1.00 O ATOM 0 H TYR A 368 11.513 0.606 -4.219 1.00 0.44 H new ATOM 0 HA TYR A 368 12.314 2.725 -6.076 1.00 0.52 H new ATOM 0 HB2 TYR A 368 13.606 1.606 -3.558 1.00 0.57 H new ATOM 0 HB3 TYR A 368 14.226 2.956 -4.487 1.00 0.57 H new ATOM 0 HD1 TYR A 368 12.818 5.081 -4.656 1.00 0.74 H new ATOM 0 HD2 TYR A 368 11.844 1.916 -1.972 1.00 0.69 H new ATOM 0 HE1 TYR A 368 11.435 6.621 -3.340 1.00 0.85 H new ATOM 0 HE2 TYR A 368 10.451 3.460 -0.659 1.00 0.80 H new ATOM 0 HH TYR A 368 9.608 5.477 -0.494 1.00 1.00 H new ATOM 1455 N GLY A 369 13.414 -0.268 -6.227 1.00 0.51 N ATOM 1456 CA GLY A 369 14.266 -1.163 -6.986 1.00 0.56 C ATOM 1457 C GLY A 369 15.684 -1.216 -6.449 1.00 0.52 C ATOM 1458 O GLY A 369 15.925 -1.731 -5.354 1.00 0.54 O ATOM 0 H GLY A 369 12.682 -0.730 -5.688 1.00 0.51 H new ATOM 0 HA2 GLY A 369 13.838 -2.165 -6.971 1.00 0.56 H new ATOM 0 HA3 GLY A 369 14.288 -0.842 -8.027 1.00 0.56 H new ATOM 1462 N LYS A 370 16.619 -0.671 -7.215 1.00 0.55 N ATOM 1463 CA LYS A 370 18.029 -0.701 -6.842 1.00 0.59 C ATOM 1464 C LYS A 370 18.473 0.636 -6.259 1.00 0.65 C ATOM 1465 O LYS A 370 19.665 0.872 -6.061 1.00 0.74 O ATOM 1466 CB LYS A 370 18.897 -1.050 -8.050 1.00 0.61 C ATOM 1467 CG LYS A 370 18.570 -2.397 -8.676 1.00 1.27 C ATOM 1468 CD LYS A 370 19.594 -2.780 -9.734 1.00 1.26 C ATOM 1469 CE LYS A 370 20.964 -3.011 -9.120 1.00 2.26 C ATOM 1470 NZ LYS A 370 21.980 -3.373 -10.138 1.00 2.76 N ATOM 0 H LYS A 370 16.427 -0.202 -8.100 1.00 0.55 H new ATOM 0 HA LYS A 370 18.152 -1.470 -6.079 1.00 0.59 H new ATOM 0 HB2 LYS A 370 18.781 -0.272 -8.805 1.00 0.61 H new ATOM 0 HB3 LYS A 370 19.944 -1.046 -7.746 1.00 0.61 H new ATOM 0 HG2 LYS A 370 18.541 -3.163 -7.901 1.00 1.27 H new ATOM 0 HG3 LYS A 370 17.577 -2.360 -9.125 1.00 1.27 H new ATOM 0 HD2 LYS A 370 19.267 -3.683 -10.249 1.00 1.26 H new ATOM 0 HD3 LYS A 370 19.658 -1.991 -10.484 1.00 1.26 H new ATOM 0 HE2 LYS A 370 21.282 -2.110 -8.596 1.00 2.26 H new ATOM 0 HE3 LYS A 370 20.898 -3.805 -8.377 1.00 2.26 H new ATOM 0 HZ1 LYS A 370 22.899 -3.521 -9.674 1.00 2.76 H new ATOM 0 HZ2 LYS A 370 21.691 -4.247 -10.621 1.00 2.76 H new ATOM 0 HZ3 LYS A 370 22.063 -2.605 -10.834 1.00 2.76 H new ATOM 1484 N GLN A 371 17.516 1.508 -5.989 1.00 0.63 N ATOM 1485 CA GLN A 371 17.819 2.803 -5.404 1.00 0.70 C ATOM 1486 C GLN A 371 17.972 2.685 -3.890 1.00 0.73 C ATOM 1487 O GLN A 371 16.985 2.595 -3.161 1.00 0.74 O ATOM 1488 CB GLN A 371 16.729 3.819 -5.752 1.00 0.76 C ATOM 1489 CG GLN A 371 16.980 5.194 -5.163 1.00 1.22 C ATOM 1490 CD GLN A 371 15.945 6.216 -5.578 1.00 1.85 C ATOM 1491 OE1 GLN A 371 14.787 5.885 -5.838 1.00 2.65 O ATOM 1492 NE2 GLN A 371 16.362 7.467 -5.640 1.00 2.26 N ATOM 0 H GLN A 371 16.525 1.343 -6.165 1.00 0.63 H new ATOM 0 HA GLN A 371 18.763 3.154 -5.820 1.00 0.70 H new ATOM 0 HB2 GLN A 371 16.654 3.904 -6.836 1.00 0.76 H new ATOM 0 HB3 GLN A 371 15.769 3.448 -5.394 1.00 0.76 H new ATOM 0 HG2 GLN A 371 16.993 5.120 -4.076 1.00 1.22 H new ATOM 0 HG3 GLN A 371 17.967 5.540 -5.471 1.00 1.22 H new ATOM 0 HE21 GLN A 371 17.331 7.693 -5.415 1.00 2.26 H new ATOM 0 HE22 GLN A 371 15.715 8.207 -5.912 1.00 2.26 H new ATOM 1501 N ALA A 372 19.215 2.654 -3.426 1.00 0.77 N ATOM 1502 CA ALA A 372 19.495 2.574 -2.004 1.00 0.79 C ATOM 1503 C ALA A 372 19.338 3.932 -1.332 1.00 0.86 C ATOM 1504 O ALA A 372 20.153 4.833 -1.530 1.00 1.01 O ATOM 1505 CB ALA A 372 20.895 2.031 -1.770 1.00 0.86 C ATOM 0 H ALA A 372 20.045 2.683 -4.018 1.00 0.77 H new ATOM 0 HA ALA A 372 18.771 1.892 -1.559 1.00 0.79 H new ATOM 0 HB1 ALA A 372 21.090 1.977 -0.699 1.00 0.86 H new ATOM 0 HB2 ALA A 372 20.976 1.035 -2.204 1.00 0.86 H new ATOM 0 HB3 ALA A 372 21.624 2.691 -2.239 1.00 0.86 H new ATOM 1511 N LEU A 373 18.280 4.072 -0.555 1.00 0.77 N ATOM 1512 CA LEU A 373 18.053 5.267 0.240 1.00 0.82 C ATOM 1513 C LEU A 373 18.417 4.986 1.690 1.00 0.84 C ATOM 1514 O LEU A 373 18.515 3.823 2.085 1.00 0.80 O ATOM 1515 CB LEU A 373 16.584 5.692 0.167 1.00 0.79 C ATOM 1516 CG LEU A 373 16.046 5.976 -1.232 1.00 0.81 C ATOM 1517 CD1 LEU A 373 14.565 6.293 -1.167 1.00 0.80 C ATOM 1518 CD2 LEU A 373 16.799 7.128 -1.869 1.00 0.93 C ATOM 0 H LEU A 373 17.554 3.362 -0.456 1.00 0.77 H new ATOM 0 HA LEU A 373 18.674 6.071 -0.155 1.00 0.82 H new ATOM 0 HB2 LEU A 373 15.975 4.908 0.618 1.00 0.79 H new ATOM 0 HB3 LEU A 373 16.453 6.587 0.775 1.00 0.79 H new ATOM 0 HG LEU A 373 16.191 5.087 -1.845 1.00 0.81 H new ATOM 0 HD11 LEU A 373 14.192 6.494 -2.171 1.00 0.80 H new ATOM 0 HD12 LEU A 373 14.029 5.443 -0.744 1.00 0.80 H new ATOM 0 HD13 LEU A 373 14.408 7.170 -0.539 1.00 0.80 H new ATOM 0 HD21 LEU A 373 16.401 7.316 -2.866 1.00 0.93 H new ATOM 0 HD22 LEU A 373 16.681 8.022 -1.257 1.00 0.93 H new ATOM 0 HD23 LEU A 373 17.857 6.875 -1.942 1.00 0.93 H new ATOM 1530 N PRO A 374 18.634 6.029 2.502 1.00 0.94 N ATOM 1531 CA PRO A 374 18.827 5.853 3.937 1.00 0.98 C ATOM 1532 C PRO A 374 17.567 5.295 4.592 1.00 0.92 C ATOM 1533 O PRO A 374 16.519 5.943 4.600 1.00 0.92 O ATOM 1534 CB PRO A 374 19.131 7.263 4.447 1.00 1.10 C ATOM 1535 CG PRO A 374 18.602 8.180 3.396 1.00 1.31 C ATOM 1536 CD PRO A 374 18.730 7.442 2.095 1.00 1.05 C ATOM 0 HA PRO A 374 19.622 5.144 4.169 1.00 0.98 H new ATOM 0 HB2 PRO A 374 18.651 7.446 5.408 1.00 1.10 H new ATOM 0 HB3 PRO A 374 20.202 7.407 4.593 1.00 1.10 H new ATOM 0 HG2 PRO A 374 17.563 8.442 3.595 1.00 1.31 H new ATOM 0 HG3 PRO A 374 19.167 9.112 3.372 1.00 1.31 H new ATOM 0 HD2 PRO A 374 17.939 7.715 1.397 1.00 1.05 H new ATOM 0 HD3 PRO A 374 19.678 7.656 1.602 1.00 1.05 H new ATOM 1544 N GLY A 375 17.671 4.084 5.109 1.00 0.90 N ATOM 1545 CA GLY A 375 16.521 3.423 5.693 1.00 0.90 C ATOM 1546 C GLY A 375 15.839 2.481 4.712 1.00 0.82 C ATOM 1547 O GLY A 375 15.228 1.494 5.113 1.00 0.86 O ATOM 0 H GLY A 375 18.535 3.542 5.136 1.00 0.90 H new ATOM 0 HA2 GLY A 375 16.835 2.863 6.574 1.00 0.90 H new ATOM 0 HA3 GLY A 375 15.806 4.173 6.031 1.00 0.90 H new ATOM 1551 N ILE A 376 15.946 2.794 3.426 1.00 0.74 N ATOM 1552 CA ILE A 376 15.356 1.968 2.374 1.00 0.68 C ATOM 1553 C ILE A 376 16.389 1.684 1.279 1.00 0.65 C ATOM 1554 O ILE A 376 16.383 2.324 0.229 1.00 0.67 O ATOM 1555 CB ILE A 376 14.125 2.649 1.722 1.00 0.66 C ATOM 1556 CG1 ILE A 376 13.172 3.212 2.784 1.00 0.72 C ATOM 1557 CG2 ILE A 376 13.388 1.658 0.826 1.00 0.64 C ATOM 1558 CD1 ILE A 376 12.036 4.037 2.201 1.00 0.74 C ATOM 0 H ILE A 376 16.439 3.619 3.083 1.00 0.74 H new ATOM 0 HA ILE A 376 15.034 1.039 2.845 1.00 0.68 H new ATOM 0 HB ILE A 376 14.483 3.481 1.116 1.00 0.66 H new ATOM 0 HG12 ILE A 376 12.753 2.387 3.360 1.00 0.72 H new ATOM 0 HG13 ILE A 376 13.740 3.830 3.480 1.00 0.72 H new ATOM 0 HG21 ILE A 376 12.526 2.148 0.374 1.00 0.64 H new ATOM 0 HG22 ILE A 376 14.059 1.308 0.042 1.00 0.64 H new ATOM 0 HG23 ILE A 376 13.052 0.809 1.422 1.00 0.64 H new ATOM 0 HD11 ILE A 376 11.401 4.404 3.008 1.00 0.74 H new ATOM 0 HD12 ILE A 376 12.446 4.883 1.649 1.00 0.74 H new ATOM 0 HD13 ILE A 376 11.445 3.417 1.527 1.00 0.74 H new ATOM 1570 N PRO A 377 17.318 0.750 1.519 1.00 0.64 N ATOM 1571 CA PRO A 377 18.350 0.404 0.544 1.00 0.67 C ATOM 1572 C PRO A 377 17.828 -0.497 -0.578 1.00 0.63 C ATOM 1573 O PRO A 377 16.721 -1.026 -0.499 1.00 0.58 O ATOM 1574 CB PRO A 377 19.393 -0.328 1.377 1.00 0.71 C ATOM 1575 CG PRO A 377 18.619 -0.951 2.489 1.00 0.71 C ATOM 1576 CD PRO A 377 17.450 -0.037 2.762 1.00 0.63 C ATOM 0 HA PRO A 377 18.734 1.287 0.033 1.00 0.67 H new ATOM 0 HB2 PRO A 377 19.914 -1.081 0.786 1.00 0.71 H new ATOM 0 HB3 PRO A 377 20.150 0.359 1.757 1.00 0.71 H new ATOM 0 HG2 PRO A 377 18.276 -1.948 2.212 1.00 0.71 H new ATOM 0 HG3 PRO A 377 19.239 -1.063 3.378 1.00 0.71 H new ATOM 0 HD2 PRO A 377 16.543 -0.602 2.976 1.00 0.63 H new ATOM 0 HD3 PRO A 377 17.637 0.604 3.623 1.00 0.63 H new ATOM 1584 N ALA A 378 18.633 -0.649 -1.629 1.00 0.68 N ATOM 1585 CA ALA A 378 18.271 -1.474 -2.782 1.00 0.68 C ATOM 1586 C ALA A 378 17.863 -2.885 -2.369 1.00 0.65 C ATOM 1587 O ALA A 378 18.426 -3.453 -1.435 1.00 0.65 O ATOM 1588 CB ALA A 378 19.436 -1.546 -3.756 1.00 0.74 C ATOM 0 H ALA A 378 19.549 -0.207 -1.706 1.00 0.68 H new ATOM 0 HA ALA A 378 17.413 -1.004 -3.263 1.00 0.68 H new ATOM 0 HB1 ALA A 378 19.158 -2.162 -4.611 1.00 0.74 H new ATOM 0 HB2 ALA A 378 19.687 -0.542 -4.098 1.00 0.74 H new ATOM 0 HB3 ALA A 378 20.300 -1.986 -3.258 1.00 0.74 H new ATOM 1594 N ASN A 379 16.872 -3.427 -3.076 1.00 0.68 N ATOM 1595 CA ASN A 379 16.400 -4.803 -2.872 1.00 0.69 C ATOM 1596 C ASN A 379 15.708 -4.984 -1.522 1.00 0.62 C ATOM 1597 O ASN A 379 15.555 -6.111 -1.042 1.00 0.67 O ATOM 1598 CB ASN A 379 17.545 -5.814 -3.012 1.00 0.80 C ATOM 1599 CG ASN A 379 18.058 -5.943 -4.437 1.00 0.93 C ATOM 1600 OD1 ASN A 379 17.183 -5.746 -5.413 1.00 1.49 O flip ATOM 1601 ND2 ASN A 379 19.237 -6.226 -4.655 1.00 1.37 N flip ATOM 0 H ASN A 379 16.370 -2.926 -3.809 1.00 0.68 H new ATOM 0 HA ASN A 379 15.665 -4.993 -3.654 1.00 0.69 H new ATOM 0 HB2 ASN A 379 18.367 -5.514 -2.362 1.00 0.80 H new ATOM 0 HB3 ASN A 379 17.204 -6.790 -2.666 1.00 0.80 H new ATOM 0 HD21 ASN A 379 19.879 -6.370 -3.876 1.00 1.37 H new ATOM 0 HD22 ASN A 379 19.571 -6.316 -5.615 1.00 1.37 H new ATOM 1608 N SER A 380 15.262 -3.891 -0.922 1.00 0.63 N ATOM 1609 CA SER A 380 14.525 -3.977 0.330 1.00 0.64 C ATOM 1610 C SER A 380 13.037 -4.178 0.081 1.00 0.49 C ATOM 1611 O SER A 380 12.422 -3.480 -0.730 1.00 0.60 O ATOM 1612 CB SER A 380 14.754 -2.736 1.189 1.00 0.84 C ATOM 1613 OG SER A 380 16.120 -2.615 1.528 1.00 1.84 O ATOM 0 H SER A 380 15.395 -2.944 -1.276 1.00 0.63 H new ATOM 0 HA SER A 380 14.902 -4.845 0.871 1.00 0.64 H new ATOM 0 HB2 SER A 380 14.427 -1.847 0.649 1.00 0.84 H new ATOM 0 HB3 SER A 380 14.152 -2.798 2.096 1.00 0.84 H new ATOM 0 HG SER A 380 16.595 -2.146 0.810 1.00 1.84 H new ATOM 1619 N GLU A 381 12.478 -5.151 0.785 1.00 0.39 N ATOM 1620 CA GLU A 381 11.060 -5.460 0.701 1.00 0.30 C ATOM 1621 C GLU A 381 10.276 -4.557 1.641 1.00 0.27 C ATOM 1622 O GLU A 381 10.423 -4.643 2.866 1.00 0.32 O ATOM 1623 CB GLU A 381 10.841 -6.926 1.069 1.00 0.39 C ATOM 1624 CG GLU A 381 9.400 -7.393 0.990 1.00 0.52 C ATOM 1625 CD GLU A 381 9.239 -8.764 1.603 1.00 0.82 C ATOM 1626 OE1 GLU A 381 9.921 -9.704 1.143 1.00 0.98 O ATOM 1627 OE2 GLU A 381 8.475 -8.904 2.575 1.00 1.03 O ATOM 0 H GLU A 381 12.995 -5.748 1.430 1.00 0.39 H new ATOM 0 HA GLU A 381 10.709 -5.289 -0.317 1.00 0.30 H new ATOM 0 HB2 GLU A 381 11.446 -7.546 0.408 1.00 0.39 H new ATOM 0 HB3 GLU A 381 11.206 -7.090 2.083 1.00 0.39 H new ATOM 0 HG2 GLU A 381 8.755 -6.682 1.507 1.00 0.52 H new ATOM 0 HG3 GLU A 381 9.079 -7.417 -0.051 1.00 0.52 H new ATOM 1634 N LEU A 382 9.469 -3.677 1.072 1.00 0.24 N ATOM 1635 CA LEU A 382 8.664 -2.763 1.864 1.00 0.23 C ATOM 1636 C LEU A 382 7.317 -3.390 2.183 1.00 0.20 C ATOM 1637 O LEU A 382 6.717 -4.053 1.341 1.00 0.22 O ATOM 1638 CB LEU A 382 8.451 -1.447 1.105 1.00 0.27 C ATOM 1639 CG LEU A 382 9.723 -0.682 0.736 1.00 0.32 C ATOM 1640 CD1 LEU A 382 9.384 0.567 -0.066 1.00 0.37 C ATOM 1641 CD2 LEU A 382 10.499 -0.316 1.989 1.00 0.37 C ATOM 0 H LEU A 382 9.354 -3.576 0.063 1.00 0.24 H new ATOM 0 HA LEU A 382 9.192 -2.557 2.795 1.00 0.23 H new ATOM 0 HB2 LEU A 382 7.900 -1.662 0.190 1.00 0.27 H new ATOM 0 HB3 LEU A 382 7.821 -0.797 1.712 1.00 0.27 H new ATOM 0 HG LEU A 382 10.347 -1.326 0.116 1.00 0.32 H new ATOM 0 HD11 LEU A 382 10.302 1.097 -0.319 1.00 0.37 H new ATOM 0 HD12 LEU A 382 8.866 0.282 -0.982 1.00 0.37 H new ATOM 0 HD13 LEU A 382 8.741 1.217 0.527 1.00 0.37 H new ATOM 0 HD21 LEU A 382 11.402 0.228 1.712 1.00 0.37 H new ATOM 0 HD22 LEU A 382 9.880 0.311 2.630 1.00 0.37 H new ATOM 0 HD23 LEU A 382 10.773 -1.224 2.526 1.00 0.37 H new ATOM 1653 N THR A 383 6.845 -3.199 3.397 1.00 0.20 N ATOM 1654 CA THR A 383 5.541 -3.687 3.786 1.00 0.20 C ATOM 1655 C THR A 383 4.664 -2.510 4.197 1.00 0.19 C ATOM 1656 O THR A 383 4.980 -1.787 5.143 1.00 0.18 O ATOM 1657 CB THR A 383 5.663 -4.682 4.956 1.00 0.23 C ATOM 1658 OG1 THR A 383 6.585 -5.728 4.617 1.00 0.26 O ATOM 1659 CG2 THR A 383 4.313 -5.288 5.306 1.00 0.27 C ATOM 0 H THR A 383 7.349 -2.706 4.134 1.00 0.20 H new ATOM 0 HA THR A 383 5.089 -4.204 2.939 1.00 0.20 H new ATOM 0 HB THR A 383 6.031 -4.136 5.824 1.00 0.23 H new ATOM 0 HG1 THR A 383 6.658 -6.355 5.366 1.00 0.26 H new ATOM 0 HG21 THR A 383 4.431 -5.986 6.135 1.00 0.27 H new ATOM 0 HG22 THR A 383 3.622 -4.496 5.595 1.00 0.27 H new ATOM 0 HG23 THR A 383 3.916 -5.818 4.440 1.00 0.27 H new ATOM 1667 N PHE A 384 3.566 -2.320 3.492 1.00 0.21 N ATOM 1668 CA PHE A 384 2.691 -1.197 3.757 1.00 0.20 C ATOM 1669 C PHE A 384 1.341 -1.682 4.250 1.00 0.21 C ATOM 1670 O PHE A 384 0.569 -2.280 3.503 1.00 0.24 O ATOM 1671 CB PHE A 384 2.512 -0.325 2.508 1.00 0.21 C ATOM 1672 CG PHE A 384 3.690 0.569 2.213 1.00 0.21 C ATOM 1673 CD1 PHE A 384 3.766 1.837 2.773 1.00 0.27 C ATOM 1674 CD2 PHE A 384 4.720 0.147 1.387 1.00 0.22 C ATOM 1675 CE1 PHE A 384 4.843 2.664 2.514 1.00 0.32 C ATOM 1676 CE2 PHE A 384 5.798 0.971 1.123 1.00 0.27 C ATOM 1677 CZ PHE A 384 5.860 2.229 1.689 1.00 0.31 C ATOM 0 H PHE A 384 3.260 -2.928 2.733 1.00 0.21 H new ATOM 0 HA PHE A 384 3.156 -0.589 4.533 1.00 0.20 H new ATOM 0 HB2 PHE A 384 2.334 -0.971 1.648 1.00 0.21 H new ATOM 0 HB3 PHE A 384 1.622 0.292 2.632 1.00 0.21 H new ATOM 0 HD1 PHE A 384 2.973 2.182 3.420 1.00 0.27 H new ATOM 0 HD2 PHE A 384 4.680 -0.837 0.944 1.00 0.22 H new ATOM 0 HE1 PHE A 384 4.888 3.648 2.956 1.00 0.32 H new ATOM 0 HE2 PHE A 384 6.592 0.631 0.474 1.00 0.27 H new ATOM 0 HZ PHE A 384 6.704 2.872 1.486 1.00 0.31 H new ATOM 1687 N ASP A 385 1.078 -1.442 5.517 1.00 0.21 N ATOM 1688 CA ASP A 385 -0.222 -1.737 6.088 1.00 0.27 C ATOM 1689 C ASP A 385 -1.118 -0.529 5.874 1.00 0.23 C ATOM 1690 O ASP A 385 -0.920 0.515 6.497 1.00 0.27 O ATOM 1691 CB ASP A 385 -0.085 -2.064 7.573 1.00 0.42 C ATOM 1692 CG ASP A 385 -1.382 -2.528 8.196 1.00 0.95 C ATOM 1693 OD1 ASP A 385 -1.932 -1.793 9.047 1.00 1.80 O ATOM 1694 OD2 ASP A 385 -1.879 -3.597 7.798 1.00 1.30 O ATOM 0 H ASP A 385 1.748 -1.042 6.174 1.00 0.21 H new ATOM 0 HA ASP A 385 -0.662 -2.608 5.602 1.00 0.27 H new ATOM 0 HB2 ASP A 385 0.671 -2.839 7.701 1.00 0.42 H new ATOM 0 HB3 ASP A 385 0.271 -1.181 8.103 1.00 0.42 H new ATOM 1699 N VAL A 386 -2.065 -0.652 4.955 1.00 0.21 N ATOM 1700 CA VAL A 386 -2.816 0.504 4.501 1.00 0.23 C ATOM 1701 C VAL A 386 -4.314 0.327 4.697 1.00 0.22 C ATOM 1702 O VAL A 386 -4.849 -0.781 4.623 1.00 0.31 O ATOM 1703 CB VAL A 386 -2.541 0.811 3.009 1.00 0.26 C ATOM 1704 CG1 VAL A 386 -1.065 1.072 2.768 1.00 0.28 C ATOM 1705 CG2 VAL A 386 -3.014 -0.323 2.116 1.00 0.29 C ATOM 0 H VAL A 386 -2.328 -1.533 4.514 1.00 0.21 H new ATOM 0 HA VAL A 386 -2.477 1.340 5.112 1.00 0.23 H new ATOM 0 HB VAL A 386 -3.103 1.710 2.756 1.00 0.26 H new ATOM 0 HG11 VAL A 386 -0.901 1.285 1.712 1.00 0.28 H new ATOM 0 HG12 VAL A 386 -0.744 1.926 3.364 1.00 0.28 H new ATOM 0 HG13 VAL A 386 -0.488 0.193 3.055 1.00 0.28 H new ATOM 0 HG21 VAL A 386 -2.807 -0.077 1.075 1.00 0.29 H new ATOM 0 HG22 VAL A 386 -2.489 -1.240 2.384 1.00 0.29 H new ATOM 0 HG23 VAL A 386 -4.086 -0.467 2.248 1.00 0.29 H new ATOM 1715 N LYS A 387 -4.974 1.442 4.943 1.00 0.19 N ATOM 1716 CA LYS A 387 -6.418 1.486 5.057 1.00 0.22 C ATOM 1717 C LYS A 387 -6.941 2.734 4.357 1.00 0.21 C ATOM 1718 O LYS A 387 -6.409 3.831 4.543 1.00 0.22 O ATOM 1719 CB LYS A 387 -6.834 1.485 6.532 1.00 0.32 C ATOM 1720 CG LYS A 387 -8.338 1.533 6.754 1.00 1.08 C ATOM 1721 CD LYS A 387 -8.674 1.787 8.215 1.00 1.06 C ATOM 1722 CE LYS A 387 -10.137 1.509 8.511 1.00 1.62 C ATOM 1723 NZ LYS A 387 -10.461 0.062 8.382 1.00 2.53 N ATOM 0 H LYS A 387 -4.521 2.347 5.070 1.00 0.19 H new ATOM 0 HA LYS A 387 -6.846 0.603 4.582 1.00 0.22 H new ATOM 0 HB2 LYS A 387 -6.436 0.590 7.010 1.00 0.32 H new ATOM 0 HB3 LYS A 387 -6.377 2.341 7.028 1.00 0.32 H new ATOM 0 HG2 LYS A 387 -8.774 2.319 6.137 1.00 1.08 H new ATOM 0 HG3 LYS A 387 -8.785 0.592 6.434 1.00 1.08 H new ATOM 0 HD2 LYS A 387 -8.049 1.157 8.847 1.00 1.06 H new ATOM 0 HD3 LYS A 387 -8.442 2.822 8.467 1.00 1.06 H new ATOM 0 HE2 LYS A 387 -10.374 1.846 9.520 1.00 1.62 H new ATOM 0 HE3 LYS A 387 -10.762 2.084 7.828 1.00 1.62 H new ATOM 0 HZ1 LYS A 387 -11.188 -0.195 9.080 1.00 2.53 H new ATOM 0 HZ2 LYS A 387 -10.818 -0.130 7.424 1.00 2.53 H new ATOM 0 HZ3 LYS A 387 -9.604 -0.502 8.552 1.00 2.53 H new ATOM 1737 N LEU A 388 -7.969 2.564 3.545 1.00 0.21 N ATOM 1738 CA LEU A 388 -8.543 3.675 2.809 1.00 0.21 C ATOM 1739 C LEU A 388 -9.672 4.272 3.632 1.00 0.24 C ATOM 1740 O LEU A 388 -10.519 3.545 4.141 1.00 0.28 O ATOM 1741 CB LEU A 388 -9.051 3.204 1.442 1.00 0.21 C ATOM 1742 CG LEU A 388 -9.491 4.311 0.481 1.00 0.21 C ATOM 1743 CD1 LEU A 388 -8.349 5.275 0.214 1.00 0.22 C ATOM 1744 CD2 LEU A 388 -9.981 3.716 -0.826 1.00 0.24 C ATOM 0 H LEU A 388 -8.424 1.666 3.379 1.00 0.21 H new ATOM 0 HA LEU A 388 -7.783 4.436 2.633 1.00 0.21 H new ATOM 0 HB2 LEU A 388 -8.263 2.623 0.962 1.00 0.21 H new ATOM 0 HB3 LEU A 388 -9.893 2.530 1.600 1.00 0.21 H new ATOM 0 HG LEU A 388 -10.309 4.859 0.948 1.00 0.21 H new ATOM 0 HD11 LEU A 388 -8.683 6.054 -0.471 1.00 0.22 H new ATOM 0 HD12 LEU A 388 -8.030 5.729 1.152 1.00 0.22 H new ATOM 0 HD13 LEU A 388 -7.513 4.735 -0.230 1.00 0.22 H new ATOM 0 HD21 LEU A 388 -10.290 4.517 -1.497 1.00 0.24 H new ATOM 0 HD22 LEU A 388 -9.177 3.144 -1.289 1.00 0.24 H new ATOM 0 HD23 LEU A 388 -10.829 3.059 -0.631 1.00 0.24 H new ATOM 1756 N VAL A 389 -9.680 5.586 3.781 1.00 0.26 N ATOM 1757 CA VAL A 389 -10.646 6.232 4.661 1.00 0.32 C ATOM 1758 C VAL A 389 -11.536 7.218 3.915 1.00 0.33 C ATOM 1759 O VAL A 389 -12.457 7.789 4.503 1.00 0.39 O ATOM 1760 CB VAL A 389 -9.954 6.956 5.842 1.00 0.39 C ATOM 1761 CG1 VAL A 389 -9.247 5.962 6.752 1.00 0.45 C ATOM 1762 CG2 VAL A 389 -8.973 8.006 5.342 1.00 0.40 C ATOM 0 H VAL A 389 -9.037 6.223 3.311 1.00 0.26 H new ATOM 0 HA VAL A 389 -11.272 5.432 5.055 1.00 0.32 H new ATOM 0 HB VAL A 389 -10.729 7.460 6.419 1.00 0.39 H new ATOM 0 HG11 VAL A 389 -8.769 6.496 7.573 1.00 0.45 H new ATOM 0 HG12 VAL A 389 -9.974 5.255 7.153 1.00 0.45 H new ATOM 0 HG13 VAL A 389 -8.491 5.421 6.183 1.00 0.45 H new ATOM 0 HG21 VAL A 389 -8.502 8.498 6.193 1.00 0.40 H new ATOM 0 HG22 VAL A 389 -8.208 7.527 4.731 1.00 0.40 H new ATOM 0 HG23 VAL A 389 -9.505 8.746 4.744 1.00 0.40 H new ATOM 1772 N SER A 390 -11.261 7.418 2.630 1.00 0.32 N ATOM 1773 CA SER A 390 -12.053 8.337 1.824 1.00 0.35 C ATOM 1774 C SER A 390 -11.695 8.220 0.341 1.00 0.31 C ATOM 1775 O SER A 390 -10.577 7.837 -0.014 1.00 0.26 O ATOM 1776 CB SER A 390 -11.843 9.781 2.309 1.00 0.43 C ATOM 1777 OG SER A 390 -12.785 10.667 1.729 1.00 1.32 O ATOM 0 H SER A 390 -10.501 6.959 2.128 1.00 0.32 H new ATOM 0 HA SER A 390 -13.104 8.071 1.939 1.00 0.35 H new ATOM 0 HB2 SER A 390 -11.929 9.817 3.395 1.00 0.43 H new ATOM 0 HB3 SER A 390 -10.833 10.107 2.058 1.00 0.43 H new ATOM 0 HG SER A 390 -12.625 11.576 2.059 1.00 1.32 H new ATOM 1783 N MET A 391 -12.663 8.527 -0.511 1.00 0.38 N ATOM 1784 CA MET A 391 -12.461 8.580 -1.952 1.00 0.37 C ATOM 1785 C MET A 391 -13.523 9.468 -2.581 1.00 0.49 C ATOM 1786 O MET A 391 -14.644 9.543 -2.075 1.00 0.56 O ATOM 1787 CB MET A 391 -12.527 7.179 -2.577 1.00 0.36 C ATOM 1788 CG MET A 391 -12.470 7.179 -4.097 1.00 0.41 C ATOM 1789 SD MET A 391 -12.868 5.571 -4.808 1.00 0.49 S ATOM 1790 CE MET A 391 -11.724 4.522 -3.923 1.00 0.44 C ATOM 0 H MET A 391 -13.616 8.747 -0.220 1.00 0.38 H new ATOM 0 HA MET A 391 -11.470 8.991 -2.142 1.00 0.37 H new ATOM 0 HB2 MET A 391 -11.701 6.581 -2.192 1.00 0.36 H new ATOM 0 HB3 MET A 391 -13.449 6.692 -2.258 1.00 0.36 H new ATOM 0 HG2 MET A 391 -13.166 7.924 -4.483 1.00 0.41 H new ATOM 0 HG3 MET A 391 -11.472 7.477 -4.419 1.00 0.41 H new ATOM 0 HE1 MET A 391 -11.612 3.577 -4.454 1.00 0.44 H new ATOM 0 HE2 MET A 391 -10.755 5.017 -3.855 1.00 0.44 H new ATOM 0 HE3 MET A 391 -12.106 4.332 -2.920 1.00 0.44 H new ATOM 1800 N LYS A 392 -13.147 10.151 -3.663 1.00 0.56 N ATOM 1801 CA LYS A 392 -14.081 10.939 -4.466 1.00 0.71 C ATOM 1802 C LYS A 392 -14.496 12.221 -3.743 1.00 1.63 C ATOM 1803 O LYS A 392 -13.792 13.238 -3.908 1.00 2.38 O ATOM 1804 CB LYS A 392 -15.317 10.105 -4.820 1.00 1.70 C ATOM 1805 CG LYS A 392 -16.240 10.763 -5.828 1.00 2.54 C ATOM 1806 CD LYS A 392 -15.724 10.621 -7.248 1.00 3.38 C ATOM 1807 CE LYS A 392 -16.722 11.172 -8.252 1.00 4.14 C ATOM 1808 NZ LYS A 392 -18.082 10.597 -8.062 1.00 4.91 N ATOM 1809 OXT LYS A 392 -15.526 12.213 -3.033 1.00 2.36 O ATOM 0 H LYS A 392 -12.187 10.173 -4.007 1.00 0.56 H new ATOM 0 HA LYS A 392 -13.570 11.224 -5.386 1.00 0.71 H new ATOM 0 HB2 LYS A 392 -14.992 9.143 -5.215 1.00 1.70 H new ATOM 0 HB3 LYS A 392 -15.878 9.902 -3.908 1.00 1.70 H new ATOM 0 HG2 LYS A 392 -17.232 10.317 -5.756 1.00 2.54 H new ATOM 0 HG3 LYS A 392 -16.347 11.820 -5.585 1.00 2.54 H new ATOM 0 HD2 LYS A 392 -14.775 11.148 -7.347 1.00 3.38 H new ATOM 0 HD3 LYS A 392 -15.529 9.570 -7.464 1.00 3.38 H new ATOM 0 HE2 LYS A 392 -16.771 12.257 -8.156 1.00 4.14 H new ATOM 0 HE3 LYS A 392 -16.376 10.956 -9.263 1.00 4.14 H new ATOM 0 HZ1 LYS A 392 -18.646 10.749 -8.922 1.00 4.91 H new ATOM 0 HZ2 LYS A 392 -18.005 9.577 -7.874 1.00 4.91 H new ATOM 0 HZ3 LYS A 392 -18.546 11.063 -7.256 1.00 4.91 H new