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 -169:sc= 0.337 USER MOD Set 1.2: A 326 ASN : amide:sc= 0.691 X(o=1,f=1.2) USER MOD Single : A 283 THR OG1 : rot -18:sc= 0.515 USER MOD Single : A 284 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 297 THR OG1 : rot -50:sc= 1.27 USER MOD Single : A 299 LYS NZ :NH3+ 170:sc= 0.609 (180deg=0.505) USER MOD Single : A 302 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 304 LYS NZ :NH3+ 167:sc= -0.0259 (180deg=-0.183) USER MOD Single : A 305 LYS NZ :NH3+ 172:sc= 0.248 (180deg=0.119) USER MOD Single : A 307 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 MET CE :methyl 146:sc= -0.3 (180deg=-1.19) USER MOD Single : A 316 LYS NZ :NH3+ 146:sc= 0.937 (180deg=-0.31) USER MOD Single : A 318 LYS NZ :NH3+ -173:sc= 1.25 (180deg=1.18) USER MOD Single : A 319 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 321 LYS NZ :NH3+ 171:sc=-0.000111 (180deg=-0.0809) USER MOD Single : A 325 LYS NZ :NH3+ -165:sc= -0.0888 (180deg=-0.446) USER MOD Single : A 327 THR OG1 : rot 180:sc= -0.54 USER MOD Single : A 328 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 330 LYS NZ :NH3+ -166:sc= -0.064 (180deg=-0.335) USER MOD Single : A 335 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 338 GLN : amide:sc= -2.51 K(o=-2.5,f=-5.2!) USER MOD Single : A 343 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.01) USER MOD Single : A 352 MET CE :methyl -130:sc= -0.932 (180deg=-5.25!) USER MOD Single : A 366 TYR OH : rot 37:sc= -0.427 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= -0.0829 K(o=-0.083,f=-0.86) USER MOD Single : A 379 ASN :FLIP amide:sc= -0.0524 F(o=-1.2!,f=-0.052) USER MOD Single : A 380 SER OG : rot 107:sc= 1.22 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 387 LYS NZ :NH3+ 167:sc= 1.11 (180deg=1.04) USER MOD Single : A 390 SER OG : rot 180:sc= -0.678 USER MOD Single : A 391 MET CE :methyl 171:sc= -4.88! (180deg=-5.15!) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 105 N THR A 283 -4.259 -14.039 0.106 1.00 0.54 N ATOM 106 CA THR A 283 -3.322 -13.117 -0.494 1.00 0.50 C ATOM 107 C THR A 283 -3.393 -13.216 -2.014 1.00 0.56 C ATOM 108 O THR A 283 -3.480 -14.318 -2.563 1.00 0.71 O ATOM 109 CB THR A 283 -1.896 -13.445 -0.016 1.00 0.64 C ATOM 110 OG1 THR A 283 -1.736 -14.868 0.081 1.00 0.76 O ATOM 111 CG2 THR A 283 -1.609 -12.814 1.334 1.00 0.71 C ATOM 0 HA THR A 283 -3.579 -12.101 -0.193 1.00 0.50 H new ATOM 0 HB THR A 283 -1.193 -13.038 -0.743 1.00 0.64 H new ATOM 0 HG1 THR A 283 -2.618 -15.295 0.110 1.00 0.76 H new ATOM 0 HG21 THR A 283 -0.594 -13.064 1.644 1.00 0.71 H new ATOM 0 HG22 THR A 283 -1.709 -11.731 1.258 1.00 0.71 H new ATOM 0 HG23 THR A 283 -2.317 -13.193 2.071 1.00 0.71 H new ATOM 119 N LYS A 284 -3.388 -12.077 -2.694 1.00 0.52 N ATOM 120 CA LYS A 284 -3.439 -12.066 -4.149 1.00 0.58 C ATOM 121 C LYS A 284 -2.056 -11.815 -4.726 1.00 0.51 C ATOM 122 O LYS A 284 -1.207 -11.207 -4.074 1.00 0.47 O ATOM 123 CB LYS A 284 -4.395 -10.987 -4.670 1.00 0.73 C ATOM 124 CG LYS A 284 -5.867 -11.258 -4.406 1.00 0.87 C ATOM 125 CD LYS A 284 -6.748 -10.263 -5.151 1.00 1.49 C ATOM 126 CE LYS A 284 -8.227 -10.579 -4.991 1.00 1.78 C ATOM 127 NZ LYS A 284 -9.075 -9.703 -5.848 1.00 2.06 N ATOM 0 H LYS A 284 -3.349 -11.153 -2.263 1.00 0.52 H new ATOM 0 HA LYS A 284 -3.804 -13.043 -4.466 1.00 0.58 H new ATOM 0 HB2 LYS A 284 -4.128 -10.034 -4.214 1.00 0.73 H new ATOM 0 HB3 LYS A 284 -4.247 -10.878 -5.744 1.00 0.73 H new ATOM 0 HG2 LYS A 284 -6.115 -12.273 -4.717 1.00 0.87 H new ATOM 0 HG3 LYS A 284 -6.066 -11.195 -3.336 1.00 0.87 H new ATOM 0 HD2 LYS A 284 -6.550 -9.257 -4.782 1.00 1.49 H new ATOM 0 HD3 LYS A 284 -6.488 -10.271 -6.210 1.00 1.49 H new ATOM 0 HE2 LYS A 284 -8.406 -11.623 -5.249 1.00 1.78 H new ATOM 0 HE3 LYS A 284 -8.515 -10.455 -3.947 1.00 1.78 H new ATOM 0 HZ1 LYS A 284 -10.076 -9.948 -5.712 1.00 2.06 H new ATOM 0 HZ2 LYS A 284 -8.923 -8.708 -5.585 1.00 2.06 H new ATOM 0 HZ3 LYS A 284 -8.818 -9.840 -6.846 1.00 2.06 H new ATOM 141 N LEU A 285 -1.838 -12.275 -5.950 1.00 0.61 N ATOM 142 CA LEU A 285 -0.587 -12.029 -6.647 1.00 0.63 C ATOM 143 C LEU A 285 -0.824 -11.067 -7.805 1.00 0.67 C ATOM 144 O LEU A 285 -1.521 -11.396 -8.768 1.00 0.75 O ATOM 145 CB LEU A 285 0.010 -13.345 -7.163 1.00 0.76 C ATOM 146 CG LEU A 285 1.357 -13.218 -7.882 1.00 0.84 C ATOM 147 CD1 LEU A 285 2.416 -12.668 -6.940 1.00 0.78 C ATOM 148 CD2 LEU A 285 1.782 -14.569 -8.441 1.00 0.98 C ATOM 0 H LEU A 285 -2.515 -12.822 -6.481 1.00 0.61 H new ATOM 0 HA LEU A 285 0.122 -11.582 -5.950 1.00 0.63 H new ATOM 0 HB2 LEU A 285 0.130 -14.025 -6.320 1.00 0.76 H new ATOM 0 HB3 LEU A 285 -0.705 -13.806 -7.845 1.00 0.76 H new ATOM 0 HG LEU A 285 1.246 -12.519 -8.711 1.00 0.84 H new ATOM 0 HD11 LEU A 285 3.366 -12.585 -7.469 1.00 0.78 H new ATOM 0 HD12 LEU A 285 2.111 -11.684 -6.585 1.00 0.78 H new ATOM 0 HD13 LEU A 285 2.532 -13.341 -6.090 1.00 0.78 H new ATOM 0 HD21 LEU A 285 2.741 -14.467 -8.950 1.00 0.98 H new ATOM 0 HD22 LEU A 285 1.878 -15.286 -7.626 1.00 0.98 H new ATOM 0 HD23 LEU A 285 1.032 -14.923 -9.148 1.00 0.98 H new ATOM 160 N LEU A 286 -0.266 -9.873 -7.692 1.00 0.65 N ATOM 161 CA LEU A 286 -0.444 -8.843 -8.705 1.00 0.71 C ATOM 162 C LEU A 286 0.775 -8.764 -9.623 1.00 0.77 C ATOM 163 O LEU A 286 1.652 -9.628 -9.572 1.00 0.80 O ATOM 164 CB LEU A 286 -0.695 -7.490 -8.038 1.00 0.64 C ATOM 165 CG LEU A 286 -1.921 -7.435 -7.126 1.00 0.64 C ATOM 166 CD1 LEU A 286 -2.030 -6.072 -6.466 1.00 0.63 C ATOM 167 CD2 LEU A 286 -3.189 -7.746 -7.910 1.00 0.76 C ATOM 0 H LEU A 286 0.318 -9.591 -6.904 1.00 0.65 H new ATOM 0 HA LEU A 286 -1.310 -9.105 -9.313 1.00 0.71 H new ATOM 0 HB2 LEU A 286 0.185 -7.221 -7.454 1.00 0.64 H new ATOM 0 HB3 LEU A 286 -0.805 -6.734 -8.815 1.00 0.64 H new ATOM 0 HG LEU A 286 -1.803 -8.190 -6.349 1.00 0.64 H new ATOM 0 HD11 LEU A 286 -2.908 -6.050 -5.820 1.00 0.63 H new ATOM 0 HD12 LEU A 286 -1.137 -5.884 -5.871 1.00 0.63 H new ATOM 0 HD13 LEU A 286 -2.124 -5.303 -7.233 1.00 0.63 H new ATOM 0 HD21 LEU A 286 -4.050 -7.702 -7.243 1.00 0.76 H new ATOM 0 HD22 LEU A 286 -3.311 -7.015 -8.709 1.00 0.76 H new ATOM 0 HD23 LEU A 286 -3.115 -8.745 -8.340 1.00 0.76 H new ATOM 179 N GLU A 287 0.804 -7.733 -10.470 1.00 0.84 N ATOM 180 CA GLU A 287 1.890 -7.524 -11.429 1.00 0.92 C ATOM 181 C GLU A 287 3.262 -7.599 -10.758 1.00 0.77 C ATOM 182 O GLU A 287 3.471 -7.049 -9.673 1.00 0.64 O ATOM 183 CB GLU A 287 1.717 -6.164 -12.108 1.00 1.05 C ATOM 184 CG GLU A 287 2.580 -5.980 -13.349 1.00 1.39 C ATOM 185 CD GLU A 287 2.524 -4.570 -13.901 1.00 1.96 C ATOM 186 OE1 GLU A 287 1.451 -4.171 -14.410 1.00 2.48 O ATOM 187 OE2 GLU A 287 3.541 -3.848 -13.818 1.00 2.64 O ATOM 0 H GLU A 287 0.076 -7.020 -10.510 1.00 0.84 H new ATOM 0 HA GLU A 287 1.842 -8.320 -12.172 1.00 0.92 H new ATOM 0 HB2 GLU A 287 0.670 -6.037 -12.383 1.00 1.05 H new ATOM 0 HB3 GLU A 287 1.956 -5.378 -11.391 1.00 1.05 H new ATOM 0 HG2 GLU A 287 3.613 -6.230 -13.107 1.00 1.39 H new ATOM 0 HG3 GLU A 287 2.255 -6.680 -14.119 1.00 1.39 H new ATOM 194 N GLY A 288 4.190 -8.280 -11.413 1.00 0.88 N ATOM 195 CA GLY A 288 5.505 -8.470 -10.846 1.00 0.87 C ATOM 196 C GLY A 288 5.495 -9.523 -9.758 1.00 0.98 C ATOM 197 O GLY A 288 5.514 -10.720 -10.044 1.00 1.84 O ATOM 0 H GLY A 288 4.053 -8.705 -12.330 1.00 0.88 H new ATOM 0 HA2 GLY A 288 6.202 -8.764 -11.631 1.00 0.87 H new ATOM 0 HA3 GLY A 288 5.865 -7.526 -10.437 1.00 0.87 H new ATOM 201 N GLY A 289 5.457 -9.082 -8.508 1.00 0.64 N ATOM 202 CA GLY A 289 5.355 -9.998 -7.392 1.00 0.58 C ATOM 203 C GLY A 289 4.648 -9.344 -6.225 1.00 0.48 C ATOM 204 O GLY A 289 4.943 -9.632 -5.068 1.00 0.48 O ATOM 0 H GLY A 289 5.495 -8.097 -8.247 1.00 0.64 H new ATOM 0 HA2 GLY A 289 4.812 -10.892 -7.698 1.00 0.58 H new ATOM 0 HA3 GLY A 289 6.351 -10.319 -7.087 1.00 0.58 H new ATOM 208 N ILE A 290 3.721 -8.449 -6.544 1.00 0.42 N ATOM 209 CA ILE A 290 3.005 -7.693 -5.526 1.00 0.36 C ATOM 210 C ILE A 290 1.984 -8.582 -4.836 1.00 0.36 C ATOM 211 O ILE A 290 1.109 -9.154 -5.483 1.00 0.40 O ATOM 212 CB ILE A 290 2.297 -6.456 -6.123 1.00 0.34 C ATOM 213 CG1 ILE A 290 3.318 -5.529 -6.790 1.00 0.36 C ATOM 214 CG2 ILE A 290 1.523 -5.712 -5.044 1.00 0.32 C ATOM 215 CD1 ILE A 290 2.696 -4.332 -7.471 1.00 0.37 C ATOM 0 H ILE A 290 3.448 -8.229 -7.502 1.00 0.42 H new ATOM 0 HA ILE A 290 3.739 -7.344 -4.800 1.00 0.36 H new ATOM 0 HB ILE A 290 1.589 -6.793 -6.881 1.00 0.34 H new ATOM 0 HG12 ILE A 290 4.026 -5.181 -6.038 1.00 0.36 H new ATOM 0 HG13 ILE A 290 3.888 -6.099 -7.524 1.00 0.36 H new ATOM 0 HG21 ILE A 290 1.031 -4.844 -5.482 1.00 0.32 H new ATOM 0 HG22 ILE A 290 0.773 -6.375 -4.612 1.00 0.32 H new ATOM 0 HG23 ILE A 290 2.210 -5.384 -4.264 1.00 0.32 H new ATOM 0 HD11 ILE A 290 3.479 -3.721 -7.921 1.00 0.37 H new ATOM 0 HD12 ILE A 290 2.010 -4.671 -8.247 1.00 0.37 H new ATOM 0 HD13 ILE A 290 2.150 -3.739 -6.737 1.00 0.37 H new ATOM 227 N ILE A 291 2.110 -8.705 -3.528 1.00 0.35 N ATOM 228 CA ILE A 291 1.217 -9.545 -2.757 1.00 0.37 C ATOM 229 C ILE A 291 0.406 -8.679 -1.810 1.00 0.34 C ATOM 230 O ILE A 291 0.933 -7.734 -1.230 1.00 0.36 O ATOM 231 CB ILE A 291 1.997 -10.602 -1.944 1.00 0.46 C ATOM 232 CG1 ILE A 291 2.999 -11.321 -2.849 1.00 0.60 C ATOM 233 CG2 ILE A 291 1.043 -11.600 -1.299 1.00 0.60 C ATOM 234 CD1 ILE A 291 3.740 -12.449 -2.165 1.00 0.93 C ATOM 0 H ILE A 291 2.826 -8.231 -2.977 1.00 0.35 H new ATOM 0 HA ILE A 291 0.558 -10.068 -3.450 1.00 0.37 H new ATOM 0 HB ILE A 291 2.543 -10.097 -1.147 1.00 0.46 H new ATOM 0 HG12 ILE A 291 2.471 -11.719 -3.716 1.00 0.60 H new ATOM 0 HG13 ILE A 291 3.723 -10.596 -3.221 1.00 0.60 H new ATOM 0 HG21 ILE A 291 1.614 -12.335 -0.732 1.00 0.60 H new ATOM 0 HG22 ILE A 291 0.363 -11.073 -0.629 1.00 0.60 H new ATOM 0 HG23 ILE A 291 0.468 -12.107 -2.074 1.00 0.60 H new ATOM 0 HD11 ILE A 291 4.432 -12.910 -2.870 1.00 0.93 H new ATOM 0 HD12 ILE A 291 4.297 -12.056 -1.315 1.00 0.93 H new ATOM 0 HD13 ILE A 291 3.026 -13.195 -1.817 1.00 0.93 H new ATOM 246 N ILE A 292 -0.868 -8.985 -1.654 1.00 0.34 N ATOM 247 CA ILE A 292 -1.721 -8.197 -0.782 1.00 0.36 C ATOM 248 C ILE A 292 -2.610 -9.101 0.058 1.00 0.41 C ATOM 249 O ILE A 292 -3.287 -9.986 -0.471 1.00 0.43 O ATOM 250 CB ILE A 292 -2.609 -7.207 -1.579 1.00 0.38 C ATOM 251 CG1 ILE A 292 -3.363 -7.932 -2.703 1.00 0.41 C ATOM 252 CG2 ILE A 292 -1.774 -6.066 -2.146 1.00 0.39 C ATOM 253 CD1 ILE A 292 -4.331 -7.050 -3.466 1.00 0.48 C ATOM 0 H ILE A 292 -1.333 -9.767 -2.115 1.00 0.34 H new ATOM 0 HA ILE A 292 -1.062 -7.621 -0.132 1.00 0.36 H new ATOM 0 HB ILE A 292 -3.343 -6.786 -0.892 1.00 0.38 H new ATOM 0 HG12 ILE A 292 -2.638 -8.348 -3.403 1.00 0.41 H new ATOM 0 HG13 ILE A 292 -3.912 -8.771 -2.276 1.00 0.41 H new ATOM 0 HG21 ILE A 292 -2.419 -5.384 -2.701 1.00 0.39 H new ATOM 0 HG22 ILE A 292 -1.293 -5.527 -1.330 1.00 0.39 H new ATOM 0 HG23 ILE A 292 -1.012 -6.469 -2.813 1.00 0.39 H new ATOM 0 HD11 ILE A 292 -4.823 -7.636 -4.242 1.00 0.48 H new ATOM 0 HD12 ILE A 292 -5.080 -6.654 -2.780 1.00 0.48 H new ATOM 0 HD13 ILE A 292 -3.787 -6.225 -3.925 1.00 0.48 H new ATOM 265 N GLU A 293 -2.576 -8.899 1.364 1.00 0.46 N ATOM 266 CA GLU A 293 -3.485 -9.598 2.256 1.00 0.51 C ATOM 267 C GLU A 293 -4.489 -8.620 2.843 1.00 0.43 C ATOM 268 O GLU A 293 -4.124 -7.543 3.319 1.00 0.43 O ATOM 269 CB GLU A 293 -2.728 -10.347 3.359 1.00 0.60 C ATOM 270 CG GLU A 293 -1.897 -9.474 4.286 1.00 1.21 C ATOM 271 CD GLU A 293 -1.137 -10.293 5.311 1.00 1.53 C ATOM 272 OE1 GLU A 293 0.046 -9.982 5.569 1.00 2.31 O ATOM 273 OE2 GLU A 293 -1.717 -11.253 5.858 1.00 1.58 O ATOM 0 H GLU A 293 -1.932 -8.259 1.829 1.00 0.46 H new ATOM 0 HA GLU A 293 -4.025 -10.347 1.677 1.00 0.51 H new ATOM 0 HB2 GLU A 293 -3.449 -10.902 3.959 1.00 0.60 H new ATOM 0 HB3 GLU A 293 -2.071 -11.080 2.892 1.00 0.60 H new ATOM 0 HG2 GLU A 293 -1.192 -8.888 3.696 1.00 1.21 H new ATOM 0 HG3 GLU A 293 -2.549 -8.767 4.799 1.00 1.21 H new ATOM 280 N ASP A 294 -5.754 -8.989 2.796 1.00 0.46 N ATOM 281 CA ASP A 294 -6.817 -8.081 3.188 1.00 0.49 C ATOM 282 C ASP A 294 -7.098 -8.232 4.681 1.00 0.47 C ATOM 283 O ASP A 294 -7.627 -9.250 5.131 1.00 0.71 O ATOM 284 CB ASP A 294 -8.074 -8.348 2.358 1.00 0.65 C ATOM 285 CG ASP A 294 -9.038 -7.178 2.361 1.00 1.60 C ATOM 286 OD1 ASP A 294 -8.780 -6.198 1.635 1.00 2.25 O ATOM 287 OD2 ASP A 294 -10.048 -7.233 3.109 1.00 2.36 O ATOM 0 H ASP A 294 -6.072 -9.909 2.491 1.00 0.46 H new ATOM 0 HA ASP A 294 -6.504 -7.054 2.999 1.00 0.49 H new ATOM 0 HB2 ASP A 294 -7.785 -8.573 1.331 1.00 0.65 H new ATOM 0 HB3 ASP A 294 -8.580 -9.231 2.747 1.00 0.65 H new ATOM 292 N ARG A 295 -6.712 -7.212 5.436 1.00 0.35 N ATOM 293 CA ARG A 295 -6.777 -7.231 6.896 1.00 0.35 C ATOM 294 C ARG A 295 -8.201 -6.990 7.389 1.00 0.40 C ATOM 295 O ARG A 295 -8.741 -7.779 8.164 1.00 0.47 O ATOM 296 CB ARG A 295 -5.820 -6.162 7.444 1.00 0.39 C ATOM 297 CG ARG A 295 -6.020 -5.796 8.908 1.00 1.19 C ATOM 298 CD ARG A 295 -5.614 -6.910 9.858 1.00 1.47 C ATOM 299 NE ARG A 295 -5.530 -6.418 11.230 1.00 2.06 N ATOM 300 CZ ARG A 295 -5.561 -7.186 12.317 1.00 2.62 C ATOM 301 NH1 ARG A 295 -5.691 -8.504 12.214 1.00 2.77 N ATOM 302 NH2 ARG A 295 -5.469 -6.626 13.516 1.00 3.50 N ATOM 0 H ARG A 295 -6.342 -6.342 5.053 1.00 0.35 H new ATOM 0 HA ARG A 295 -6.476 -8.214 7.258 1.00 0.35 H new ATOM 0 HB2 ARG A 295 -4.796 -6.512 7.311 1.00 0.39 H new ATOM 0 HB3 ARG A 295 -5.928 -5.259 6.843 1.00 0.39 H new ATOM 0 HG2 ARG A 295 -5.440 -4.902 9.136 1.00 1.19 H new ATOM 0 HG3 ARG A 295 -7.068 -5.547 9.075 1.00 1.19 H new ATOM 0 HD2 ARG A 295 -6.338 -7.723 9.802 1.00 1.47 H new ATOM 0 HD3 ARG A 295 -4.651 -7.320 9.554 1.00 1.47 H new ATOM 0 HE ARG A 295 -5.441 -5.411 11.366 1.00 2.06 H new ATOM 0 HH11 ARG A 295 -5.768 -8.939 11.294 1.00 2.77 H new ATOM 0 HH12 ARG A 295 -5.713 -9.081 13.054 1.00 2.77 H new ATOM 0 HH21 ARG A 295 -5.375 -5.614 13.600 1.00 3.50 H new ATOM 0 HH22 ARG A 295 -5.492 -7.208 14.354 1.00 3.50 H new ATOM 316 N VAL A 296 -8.798 -5.898 6.945 1.00 0.41 N ATOM 317 CA VAL A 296 -10.162 -5.565 7.312 1.00 0.50 C ATOM 318 C VAL A 296 -10.962 -5.274 6.052 1.00 0.53 C ATOM 319 O VAL A 296 -10.777 -4.238 5.419 1.00 0.51 O ATOM 320 CB VAL A 296 -10.225 -4.339 8.256 1.00 0.56 C ATOM 321 CG1 VAL A 296 -11.665 -4.009 8.620 1.00 0.70 C ATOM 322 CG2 VAL A 296 -9.397 -4.574 9.510 1.00 0.68 C ATOM 0 H VAL A 296 -8.354 -5.221 6.324 1.00 0.41 H new ATOM 0 HA VAL A 296 -10.584 -6.417 7.845 1.00 0.50 H new ATOM 0 HB VAL A 296 -9.802 -3.486 7.725 1.00 0.56 H new ATOM 0 HG11 VAL A 296 -11.684 -3.145 9.284 1.00 0.70 H new ATOM 0 HG12 VAL A 296 -12.227 -3.783 7.714 1.00 0.70 H new ATOM 0 HG13 VAL A 296 -12.118 -4.863 9.124 1.00 0.70 H new ATOM 0 HG21 VAL A 296 -9.458 -3.698 10.156 1.00 0.68 H new ATOM 0 HG22 VAL A 296 -9.781 -5.445 10.042 1.00 0.68 H new ATOM 0 HG23 VAL A 296 -8.357 -4.748 9.232 1.00 0.68 H new ATOM 332 N THR A 297 -11.830 -6.196 5.687 1.00 0.77 N ATOM 333 CA THR A 297 -12.586 -6.085 4.454 1.00 0.88 C ATOM 334 C THR A 297 -13.680 -5.025 4.555 1.00 0.77 C ATOM 335 O THR A 297 -14.633 -5.164 5.326 1.00 0.98 O ATOM 336 CB THR A 297 -13.203 -7.442 4.081 1.00 1.21 C ATOM 337 OG1 THR A 297 -12.179 -8.441 4.107 1.00 1.89 O ATOM 338 CG2 THR A 297 -13.836 -7.397 2.699 1.00 1.93 C ATOM 0 H THR A 297 -12.031 -7.036 6.230 1.00 0.77 H new ATOM 0 HA THR A 297 -11.892 -5.777 3.672 1.00 0.88 H new ATOM 0 HB THR A 297 -13.984 -7.681 4.803 1.00 1.21 H new ATOM 0 HG1 THR A 297 -11.412 -8.137 3.579 1.00 1.89 H new ATOM 0 HG21 THR A 297 -14.264 -8.371 2.463 1.00 1.93 H new ATOM 0 HG22 THR A 297 -14.622 -6.642 2.683 1.00 1.93 H new ATOM 0 HG23 THR A 297 -13.076 -7.146 1.959 1.00 1.93 H new ATOM 346 N GLY A 298 -13.524 -3.967 3.775 1.00 0.77 N ATOM 347 CA GLY A 298 -14.506 -2.905 3.740 1.00 0.83 C ATOM 348 C GLY A 298 -15.190 -2.830 2.398 1.00 0.90 C ATOM 349 O GLY A 298 -14.775 -3.498 1.450 1.00 1.04 O ATOM 0 H GLY A 298 -12.724 -3.825 3.158 1.00 0.77 H new ATOM 0 HA2 GLY A 298 -15.249 -3.069 4.520 1.00 0.83 H new ATOM 0 HA3 GLY A 298 -14.022 -1.953 3.957 1.00 0.83 H new ATOM 353 N LYS A 299 -16.231 -2.019 2.302 1.00 0.96 N ATOM 354 CA LYS A 299 -16.948 -1.866 1.050 1.00 1.08 C ATOM 355 C LYS A 299 -17.290 -0.406 0.789 1.00 0.82 C ATOM 356 O LYS A 299 -17.863 0.279 1.634 1.00 1.36 O ATOM 357 CB LYS A 299 -18.219 -2.723 1.030 1.00 1.88 C ATOM 358 CG LYS A 299 -19.040 -2.563 -0.241 1.00 2.40 C ATOM 359 CD LYS A 299 -18.224 -2.882 -1.486 1.00 3.13 C ATOM 360 CE LYS A 299 -19.001 -2.579 -2.757 1.00 4.13 C ATOM 361 NZ LYS A 299 -19.290 -1.124 -2.921 1.00 4.49 N ATOM 0 H LYS A 299 -16.596 -1.460 3.073 1.00 0.96 H new ATOM 0 HA LYS A 299 -16.290 -2.212 0.253 1.00 1.08 H new ATOM 0 HB2 LYS A 299 -17.943 -3.771 1.145 1.00 1.88 H new ATOM 0 HB3 LYS A 299 -18.838 -2.461 1.888 1.00 1.88 H new ATOM 0 HG2 LYS A 299 -19.909 -3.220 -0.198 1.00 2.40 H new ATOM 0 HG3 LYS A 299 -19.416 -1.542 -0.305 1.00 2.40 H new ATOM 0 HD2 LYS A 299 -17.301 -2.302 -1.476 1.00 3.13 H new ATOM 0 HD3 LYS A 299 -17.939 -3.934 -1.475 1.00 3.13 H new ATOM 0 HE2 LYS A 299 -18.433 -2.932 -3.618 1.00 4.13 H new ATOM 0 HE3 LYS A 299 -19.940 -3.133 -2.745 1.00 4.13 H new ATOM 0 HZ1 LYS A 299 -19.668 -0.950 -3.874 1.00 4.49 H new ATOM 0 HZ2 LYS A 299 -19.990 -0.827 -2.212 1.00 4.49 H new ATOM 0 HZ3 LYS A 299 -18.414 -0.579 -2.791 1.00 4.49 H new ATOM 375 N GLY A 300 -16.915 0.058 -0.387 1.00 0.58 N ATOM 376 CA GLY A 300 -17.239 1.396 -0.811 1.00 1.04 C ATOM 377 C GLY A 300 -16.882 1.576 -2.264 1.00 0.73 C ATOM 378 O GLY A 300 -16.857 0.592 -3.007 1.00 0.67 O ATOM 0 H GLY A 300 -16.381 -0.482 -1.068 1.00 0.58 H new ATOM 0 HA2 GLY A 300 -18.302 1.586 -0.663 1.00 1.04 H new ATOM 0 HA3 GLY A 300 -16.698 2.120 -0.202 1.00 1.04 H new ATOM 382 N PRO A 301 -16.624 2.812 -2.704 1.00 0.68 N ATOM 383 CA PRO A 301 -16.071 3.069 -4.034 1.00 0.52 C ATOM 384 C PRO A 301 -14.717 2.378 -4.207 1.00 0.51 C ATOM 385 O PRO A 301 -13.963 2.237 -3.241 1.00 0.57 O ATOM 386 CB PRO A 301 -15.909 4.597 -4.082 1.00 0.53 C ATOM 387 CG PRO A 301 -16.034 5.064 -2.670 1.00 0.77 C ATOM 388 CD PRO A 301 -16.877 4.049 -1.956 1.00 0.88 C ATOM 0 HA PRO A 301 -16.709 2.687 -4.831 1.00 0.52 H new ATOM 0 HB2 PRO A 301 -14.942 4.875 -4.501 1.00 0.53 H new ATOM 0 HB3 PRO A 301 -16.673 5.052 -4.713 1.00 0.53 H new ATOM 0 HG2 PRO A 301 -15.053 5.151 -2.202 1.00 0.77 H new ATOM 0 HG3 PRO A 301 -16.496 6.050 -2.628 1.00 0.77 H new ATOM 0 HD2 PRO A 301 -16.589 3.952 -0.909 1.00 0.88 H new ATOM 0 HD3 PRO A 301 -17.933 4.320 -1.972 1.00 0.88 H new ATOM 396 N HIS A 302 -14.419 1.937 -5.424 1.00 0.53 N ATOM 397 CA HIS A 302 -13.169 1.234 -5.693 1.00 0.60 C ATOM 398 C HIS A 302 -12.193 2.110 -6.469 1.00 0.50 C ATOM 399 O HIS A 302 -12.580 2.832 -7.389 1.00 0.57 O ATOM 400 CB HIS A 302 -13.421 -0.076 -6.446 1.00 0.78 C ATOM 401 CG HIS A 302 -14.003 -1.159 -5.585 1.00 0.99 C ATOM 402 ND1 HIS A 302 -15.226 -1.727 -5.861 1.00 1.42 N ATOM 403 CD2 HIS A 302 -13.489 -1.743 -4.475 1.00 1.16 C ATOM 404 CE1 HIS A 302 -15.426 -2.632 -4.921 1.00 1.49 C ATOM 405 NE2 HIS A 302 -14.401 -2.679 -4.058 1.00 1.33 N ATOM 0 H HIS A 302 -15.023 2.053 -6.238 1.00 0.53 H new ATOM 0 HA HIS A 302 -12.719 0.996 -4.729 1.00 0.60 H new ATOM 0 HB2 HIS A 302 -14.097 0.117 -7.279 1.00 0.78 H new ATOM 0 HB3 HIS A 302 -12.481 -0.427 -6.872 1.00 0.78 H new ATOM 0 HD2 HIS A 302 -12.542 -1.515 -4.008 1.00 1.16 H new ATOM 0 HE1 HIS A 302 -16.305 -3.256 -4.855 1.00 1.49 H new ATOM 0 HE2 HIS A 302 -14.316 -3.292 -3.248 1.00 1.33 H new ATOM 413 N ALA A 303 -10.924 2.032 -6.081 1.00 0.40 N ATOM 414 CA ALA A 303 -9.880 2.874 -6.653 1.00 0.36 C ATOM 415 C ALA A 303 -9.498 2.448 -8.067 1.00 0.39 C ATOM 416 O ALA A 303 -9.423 1.257 -8.379 1.00 0.54 O ATOM 417 CB ALA A 303 -8.656 2.859 -5.756 1.00 0.38 C ATOM 0 H ALA A 303 -10.592 1.386 -5.365 1.00 0.40 H new ATOM 0 HA ALA A 303 -10.278 3.886 -6.719 1.00 0.36 H new ATOM 0 HB1 ALA A 303 -7.880 3.490 -6.189 1.00 0.38 H new ATOM 0 HB2 ALA A 303 -8.923 3.238 -4.770 1.00 0.38 H new ATOM 0 HB3 ALA A 303 -8.285 1.838 -5.664 1.00 0.38 H new ATOM 423 N LYS A 304 -9.232 3.444 -8.902 1.00 0.39 N ATOM 424 CA LYS A 304 -8.864 3.239 -10.292 1.00 0.45 C ATOM 425 C LYS A 304 -7.954 4.392 -10.719 1.00 0.44 C ATOM 426 O LYS A 304 -7.868 5.393 -10.008 1.00 0.43 O ATOM 427 CB LYS A 304 -10.140 3.209 -11.143 1.00 0.60 C ATOM 428 CG LYS A 304 -9.939 2.784 -12.587 1.00 1.03 C ATOM 429 CD LYS A 304 -11.254 2.822 -13.353 1.00 1.17 C ATOM 430 CE LYS A 304 -11.102 2.302 -14.774 1.00 2.23 C ATOM 431 NZ LYS A 304 -10.724 0.865 -14.804 1.00 2.84 N ATOM 0 H LYS A 304 -9.267 4.426 -8.628 1.00 0.39 H new ATOM 0 HA LYS A 304 -8.335 2.295 -10.425 1.00 0.45 H new ATOM 0 HB2 LYS A 304 -10.854 2.530 -10.676 1.00 0.60 H new ATOM 0 HB3 LYS A 304 -10.590 4.202 -11.132 1.00 0.60 H new ATOM 0 HG2 LYS A 304 -9.215 3.443 -13.067 1.00 1.03 H new ATOM 0 HG3 LYS A 304 -9.524 1.777 -12.619 1.00 1.03 H new ATOM 0 HD2 LYS A 304 -11.998 2.224 -12.826 1.00 1.17 H new ATOM 0 HD3 LYS A 304 -11.628 3.845 -13.380 1.00 1.17 H new ATOM 0 HE2 LYS A 304 -12.039 2.442 -15.313 1.00 2.23 H new ATOM 0 HE3 LYS A 304 -10.344 2.887 -15.295 1.00 2.23 H new ATOM 0 HZ1 LYS A 304 -10.844 0.494 -15.768 1.00 2.84 H new ATOM 0 HZ2 LYS A 304 -9.730 0.761 -14.515 1.00 2.84 H new ATOM 0 HZ3 LYS A 304 -11.332 0.332 -14.150 1.00 2.84 H new ATOM 445 N LYS A 305 -7.264 4.263 -11.849 1.00 0.51 N ATOM 446 CA LYS A 305 -6.467 5.362 -12.368 1.00 0.55 C ATOM 447 C LYS A 305 -7.370 6.543 -12.710 1.00 0.56 C ATOM 448 O LYS A 305 -8.429 6.370 -13.315 1.00 0.63 O ATOM 449 CB LYS A 305 -5.672 4.925 -13.596 1.00 0.67 C ATOM 450 CG LYS A 305 -4.454 4.071 -13.268 1.00 1.35 C ATOM 451 CD LYS A 305 -3.630 3.776 -14.513 1.00 1.42 C ATOM 452 CE LYS A 305 -2.441 2.874 -14.209 1.00 2.35 C ATOM 453 NZ LYS A 305 -1.397 3.557 -13.397 1.00 2.84 N ATOM 0 H LYS A 305 -7.242 3.415 -12.416 1.00 0.51 H new ATOM 0 HA LYS A 305 -5.758 5.669 -11.599 1.00 0.55 H new ATOM 0 HB2 LYS A 305 -6.328 4.365 -14.262 1.00 0.67 H new ATOM 0 HB3 LYS A 305 -5.347 5.811 -14.141 1.00 0.67 H new ATOM 0 HG2 LYS A 305 -3.834 4.585 -12.533 1.00 1.35 H new ATOM 0 HG3 LYS A 305 -4.776 3.134 -12.813 1.00 1.35 H new ATOM 0 HD2 LYS A 305 -4.263 3.301 -15.263 1.00 1.42 H new ATOM 0 HD3 LYS A 305 -3.274 4.712 -14.943 1.00 1.42 H new ATOM 0 HE2 LYS A 305 -2.788 1.988 -13.677 1.00 2.35 H new ATOM 0 HE3 LYS A 305 -2.001 2.531 -15.145 1.00 2.35 H new ATOM 0 HZ1 LYS A 305 -0.678 2.866 -13.104 1.00 2.84 H new ATOM 0 HZ2 LYS A 305 -0.949 4.304 -13.965 1.00 2.84 H new ATOM 0 HZ3 LYS A 305 -1.835 3.980 -12.554 1.00 2.84 H new ATOM 467 N GLY A 306 -6.950 7.735 -12.311 1.00 0.55 N ATOM 468 CA GLY A 306 -7.782 8.914 -12.468 1.00 0.61 C ATOM 469 C GLY A 306 -8.627 9.176 -11.238 1.00 0.56 C ATOM 470 O GLY A 306 -9.310 10.196 -11.142 1.00 0.70 O ATOM 0 H GLY A 306 -6.043 7.909 -11.879 1.00 0.55 H new ATOM 0 HA2 GLY A 306 -7.151 9.780 -12.666 1.00 0.61 H new ATOM 0 HA3 GLY A 306 -8.431 8.788 -13.334 1.00 0.61 H new ATOM 474 N THR A 307 -8.581 8.244 -10.298 1.00 0.40 N ATOM 475 CA THR A 307 -9.326 8.359 -9.057 1.00 0.34 C ATOM 476 C THR A 307 -8.391 8.775 -7.924 1.00 0.30 C ATOM 477 O THR A 307 -7.220 8.393 -7.912 1.00 0.31 O ATOM 478 CB THR A 307 -10.000 7.013 -8.713 1.00 0.32 C ATOM 479 OG1 THR A 307 -10.732 6.545 -9.850 1.00 0.40 O ATOM 480 CG2 THR A 307 -10.942 7.145 -7.530 1.00 0.32 C ATOM 0 H THR A 307 -8.028 7.390 -10.375 1.00 0.40 H new ATOM 0 HA THR A 307 -10.098 9.119 -9.180 1.00 0.34 H new ATOM 0 HB THR A 307 -9.218 6.303 -8.445 1.00 0.32 H new ATOM 0 HG1 THR A 307 -11.159 5.690 -9.635 1.00 0.40 H new ATOM 0 HG21 THR A 307 -11.397 6.178 -7.318 1.00 0.32 H new ATOM 0 HG22 THR A 307 -10.384 7.483 -6.657 1.00 0.32 H new ATOM 0 HG23 THR A 307 -11.722 7.869 -7.765 1.00 0.32 H new ATOM 488 N ARG A 308 -8.895 9.562 -6.981 1.00 0.33 N ATOM 489 CA ARG A 308 -8.084 10.006 -5.859 1.00 0.36 C ATOM 490 C ARG A 308 -8.544 9.304 -4.591 1.00 0.36 C ATOM 491 O ARG A 308 -9.724 9.341 -4.241 1.00 0.52 O ATOM 492 CB ARG A 308 -8.160 11.529 -5.685 1.00 0.46 C ATOM 493 CG ARG A 308 -9.546 12.040 -5.332 1.00 0.98 C ATOM 494 CD ARG A 308 -9.521 13.495 -4.907 1.00 1.14 C ATOM 495 NE ARG A 308 -9.165 14.379 -6.008 1.00 1.95 N ATOM 496 CZ ARG A 308 -10.044 15.152 -6.639 1.00 2.39 C ATOM 497 NH1 ARG A 308 -11.338 15.081 -6.338 1.00 2.12 N ATOM 498 NH2 ARG A 308 -9.632 15.973 -7.591 1.00 3.45 N ATOM 0 H ARG A 308 -9.856 9.903 -6.972 1.00 0.33 H new ATOM 0 HA ARG A 308 -7.044 9.749 -6.060 1.00 0.36 H new ATOM 0 HB2 ARG A 308 -7.462 11.831 -4.904 1.00 0.46 H new ATOM 0 HB3 ARG A 308 -7.831 12.007 -6.608 1.00 0.46 H new ATOM 0 HG2 ARG A 308 -10.205 11.924 -6.192 1.00 0.98 H new ATOM 0 HG3 ARG A 308 -9.962 11.434 -4.527 1.00 0.98 H new ATOM 0 HD2 ARG A 308 -10.500 13.776 -4.518 1.00 1.14 H new ATOM 0 HD3 ARG A 308 -8.807 13.623 -4.094 1.00 1.14 H new ATOM 0 HE ARG A 308 -8.191 14.407 -6.311 1.00 1.95 H new ATOM 0 HH11 ARG A 308 -11.660 14.432 -5.620 1.00 2.12 H new ATOM 0 HH12 ARG A 308 -12.008 15.676 -6.825 1.00 2.12 H new ATOM 0 HH21 ARG A 308 -8.643 16.011 -7.839 1.00 3.45 H new ATOM 0 HH22 ARG A 308 -10.303 16.568 -8.077 1.00 3.45 H new ATOM 512 N VAL A 309 -7.627 8.627 -3.930 1.00 0.28 N ATOM 513 CA VAL A 309 -7.962 7.932 -2.703 1.00 0.28 C ATOM 514 C VAL A 309 -7.316 8.589 -1.491 1.00 0.28 C ATOM 515 O VAL A 309 -6.164 9.025 -1.535 1.00 0.34 O ATOM 516 CB VAL A 309 -7.582 6.441 -2.763 1.00 0.29 C ATOM 517 CG1 VAL A 309 -8.370 5.747 -3.858 1.00 0.31 C ATOM 518 CG2 VAL A 309 -6.090 6.258 -2.971 1.00 0.28 C ATOM 0 H VAL A 309 -6.652 8.543 -4.218 1.00 0.28 H new ATOM 0 HA VAL A 309 -9.045 8.001 -2.596 1.00 0.28 H new ATOM 0 HB VAL A 309 -7.835 5.985 -1.806 1.00 0.29 H new ATOM 0 HG11 VAL A 309 -8.094 4.693 -3.893 1.00 0.31 H new ATOM 0 HG12 VAL A 309 -9.436 5.836 -3.651 1.00 0.31 H new ATOM 0 HG13 VAL A 309 -8.146 6.212 -4.818 1.00 0.31 H new ATOM 0 HG21 VAL A 309 -5.856 5.194 -3.009 1.00 0.28 H new ATOM 0 HG22 VAL A 309 -5.793 6.728 -3.908 1.00 0.28 H new ATOM 0 HG23 VAL A 309 -5.548 6.720 -2.146 1.00 0.28 H new ATOM 528 N GLY A 310 -8.084 8.665 -0.422 1.00 0.25 N ATOM 529 CA GLY A 310 -7.590 9.201 0.825 1.00 0.27 C ATOM 530 C GLY A 310 -7.477 8.107 1.852 1.00 0.24 C ATOM 531 O GLY A 310 -8.487 7.509 2.242 1.00 0.26 O ATOM 0 H GLY A 310 -9.057 8.360 -0.395 1.00 0.25 H new ATOM 0 HA2 GLY A 310 -6.616 9.666 0.669 1.00 0.27 H new ATOM 0 HA3 GLY A 310 -8.261 9.980 1.186 1.00 0.27 H new ATOM 535 N MET A 311 -6.268 7.826 2.287 1.00 0.22 N ATOM 536 CA MET A 311 -6.023 6.665 3.115 1.00 0.19 C ATOM 537 C MET A 311 -5.158 7.000 4.318 1.00 0.18 C ATOM 538 O MET A 311 -4.716 8.137 4.497 1.00 0.19 O ATOM 539 CB MET A 311 -5.350 5.556 2.299 1.00 0.22 C ATOM 540 CG MET A 311 -3.989 5.941 1.747 1.00 0.34 C ATOM 541 SD MET A 311 -3.076 4.522 1.101 1.00 0.67 S ATOM 542 CE MET A 311 -4.256 3.845 -0.063 1.00 0.76 C ATOM 0 H MET A 311 -5.440 8.385 2.081 1.00 0.22 H new ATOM 0 HA MET A 311 -6.992 6.320 3.476 1.00 0.19 H new ATOM 0 HB2 MET A 311 -5.240 4.672 2.927 1.00 0.22 H new ATOM 0 HB3 MET A 311 -6.003 5.280 1.471 1.00 0.22 H new ATOM 0 HG2 MET A 311 -4.118 6.678 0.954 1.00 0.34 H new ATOM 0 HG3 MET A 311 -3.404 6.418 2.533 1.00 0.34 H new ATOM 0 HE1 MET A 311 -3.724 3.420 -0.915 1.00 0.76 H new ATOM 0 HE2 MET A 311 -4.842 3.066 0.424 1.00 0.76 H new ATOM 0 HE3 MET A 311 -4.921 4.636 -0.409 1.00 0.76 H new ATOM 552 N ARG A 312 -4.943 5.984 5.132 1.00 0.19 N ATOM 553 CA ARG A 312 -4.068 6.059 6.287 1.00 0.21 C ATOM 554 C ARG A 312 -3.159 4.843 6.241 1.00 0.24 C ATOM 555 O ARG A 312 -3.600 3.773 5.815 1.00 0.30 O ATOM 556 CB ARG A 312 -4.880 6.068 7.582 1.00 0.27 C ATOM 557 CG ARG A 312 -5.913 7.177 7.658 1.00 0.40 C ATOM 558 CD ARG A 312 -6.675 7.110 8.967 1.00 0.67 C ATOM 559 NE ARG A 312 -7.741 8.106 9.048 1.00 1.24 N ATOM 560 CZ ARG A 312 -8.374 8.422 10.175 1.00 1.67 C ATOM 561 NH1 ARG A 312 -7.992 7.893 11.333 1.00 1.85 N ATOM 562 NH2 ARG A 312 -9.369 9.296 10.147 1.00 2.51 N ATOM 0 H ARG A 312 -5.378 5.070 5.008 1.00 0.19 H new ATOM 0 HA ARG A 312 -3.485 6.980 6.264 1.00 0.21 H new ATOM 0 HB2 ARG A 312 -5.385 5.108 7.688 1.00 0.27 H new ATOM 0 HB3 ARG A 312 -4.197 6.164 8.426 1.00 0.27 H new ATOM 0 HG2 ARG A 312 -5.422 8.146 7.567 1.00 0.40 H new ATOM 0 HG3 ARG A 312 -6.608 7.092 6.822 1.00 0.40 H new ATOM 0 HD2 ARG A 312 -7.103 6.114 9.083 1.00 0.67 H new ATOM 0 HD3 ARG A 312 -5.981 7.257 9.795 1.00 0.67 H new ATOM 0 HE ARG A 312 -8.016 8.587 8.191 1.00 1.24 H new ATOM 0 HH11 ARG A 312 -7.209 7.240 11.362 1.00 1.85 H new ATOM 0 HH12 ARG A 312 -8.482 8.140 12.193 1.00 1.85 H new ATOM 0 HH21 ARG A 312 -9.647 9.724 9.264 1.00 2.51 H new ATOM 0 HH22 ARG A 312 -9.857 9.541 11.009 1.00 2.51 H new ATOM 576 N TYR A 313 -1.912 4.980 6.665 1.00 0.23 N ATOM 577 CA TYR A 313 -0.963 3.891 6.488 1.00 0.26 C ATOM 578 C TYR A 313 0.233 3.980 7.427 1.00 0.27 C ATOM 579 O TYR A 313 0.555 5.042 7.967 1.00 0.31 O ATOM 580 CB TYR A 313 -0.468 3.839 5.037 1.00 0.28 C ATOM 581 CG TYR A 313 0.130 5.133 4.528 1.00 0.34 C ATOM 582 CD1 TYR A 313 1.444 5.482 4.817 1.00 0.45 C ATOM 583 CD2 TYR A 313 -0.618 5.996 3.741 1.00 0.40 C ATOM 584 CE1 TYR A 313 1.990 6.655 4.341 1.00 0.53 C ATOM 585 CE2 TYR A 313 -0.079 7.171 3.262 1.00 0.51 C ATOM 586 CZ TYR A 313 1.225 7.496 3.562 1.00 0.56 C ATOM 587 OH TYR A 313 1.764 8.671 3.091 1.00 0.68 O ATOM 0 H TYR A 313 -1.540 5.812 7.123 1.00 0.23 H new ATOM 0 HA TYR A 313 -1.502 2.976 6.734 1.00 0.26 H new ATOM 0 HB2 TYR A 313 0.279 3.050 4.950 1.00 0.28 H new ATOM 0 HB3 TYR A 313 -1.302 3.561 4.392 1.00 0.28 H new ATOM 0 HD1 TYR A 313 2.047 4.823 5.424 1.00 0.45 H new ATOM 0 HD2 TYR A 313 -1.640 5.743 3.499 1.00 0.40 H new ATOM 0 HE1 TYR A 313 3.012 6.913 4.577 1.00 0.53 H new ATOM 0 HE2 TYR A 313 -0.677 7.834 2.654 1.00 0.51 H new ATOM 0 HH TYR A 313 1.054 9.225 2.704 1.00 0.68 H new ATOM 597 N VAL A 314 0.880 2.836 7.614 1.00 0.26 N ATOM 598 CA VAL A 314 2.143 2.756 8.330 1.00 0.27 C ATOM 599 C VAL A 314 3.156 2.003 7.470 1.00 0.28 C ATOM 600 O VAL A 314 2.991 0.806 7.205 1.00 0.35 O ATOM 601 CB VAL A 314 1.996 2.043 9.696 1.00 0.29 C ATOM 602 CG1 VAL A 314 3.329 2.014 10.433 1.00 0.32 C ATOM 603 CG2 VAL A 314 0.936 2.724 10.549 1.00 0.32 C ATOM 0 H VAL A 314 0.541 1.937 7.272 1.00 0.26 H new ATOM 0 HA VAL A 314 2.483 3.773 8.526 1.00 0.27 H new ATOM 0 HB VAL A 314 1.681 1.017 9.509 1.00 0.29 H new ATOM 0 HG11 VAL A 314 3.204 1.509 11.391 1.00 0.32 H new ATOM 0 HG12 VAL A 314 4.065 1.478 9.833 1.00 0.32 H new ATOM 0 HG13 VAL A 314 3.673 3.034 10.603 1.00 0.32 H new ATOM 0 HG21 VAL A 314 0.850 2.206 11.504 1.00 0.32 H new ATOM 0 HG22 VAL A 314 1.221 3.762 10.723 1.00 0.32 H new ATOM 0 HG23 VAL A 314 -0.023 2.693 10.031 1.00 0.32 H new ATOM 613 N GLY A 315 4.186 2.711 7.023 1.00 0.27 N ATOM 614 CA GLY A 315 5.172 2.126 6.135 1.00 0.28 C ATOM 615 C GLY A 315 6.362 1.561 6.879 1.00 0.25 C ATOM 616 O GLY A 315 7.113 2.303 7.528 1.00 0.27 O ATOM 0 H GLY A 315 4.356 3.688 7.262 1.00 0.27 H new ATOM 0 HA2 GLY A 315 4.704 1.334 5.550 1.00 0.28 H new ATOM 0 HA3 GLY A 315 5.515 2.883 5.430 1.00 0.28 H new ATOM 620 N LYS A 316 6.545 0.249 6.783 1.00 0.25 N ATOM 621 CA LYS A 316 7.619 -0.422 7.493 1.00 0.27 C ATOM 622 C LYS A 316 8.528 -1.165 6.525 1.00 0.30 C ATOM 623 O LYS A 316 8.116 -1.546 5.427 1.00 0.32 O ATOM 624 CB LYS A 316 7.060 -1.425 8.506 1.00 0.36 C ATOM 625 CG LYS A 316 5.860 -0.924 9.293 1.00 0.48 C ATOM 626 CD LYS A 316 5.438 -1.937 10.345 1.00 0.69 C ATOM 627 CE LYS A 316 3.962 -1.816 10.670 1.00 0.99 C ATOM 628 NZ LYS A 316 3.126 -2.115 9.479 1.00 1.94 N ATOM 0 H LYS A 316 5.961 -0.369 6.219 1.00 0.25 H new ATOM 0 HA LYS A 316 8.191 0.345 8.015 1.00 0.27 H new ATOM 0 HB2 LYS A 316 6.778 -2.336 7.978 1.00 0.36 H new ATOM 0 HB3 LYS A 316 7.851 -1.694 9.206 1.00 0.36 H new ATOM 0 HG2 LYS A 316 6.105 0.024 9.773 1.00 0.48 H new ATOM 0 HG3 LYS A 316 5.029 -0.732 8.614 1.00 0.48 H new ATOM 0 HD2 LYS A 316 5.652 -2.945 9.988 1.00 0.69 H new ATOM 0 HD3 LYS A 316 6.025 -1.788 11.251 1.00 0.69 H new ATOM 0 HE2 LYS A 316 3.707 -2.501 11.478 1.00 0.99 H new ATOM 0 HE3 LYS A 316 3.746 -0.809 11.026 1.00 0.99 H new ATOM 0 HZ1 LYS A 316 2.247 -2.582 9.780 1.00 1.94 H new ATOM 0 HZ2 LYS A 316 2.896 -1.229 8.985 1.00 1.94 H new ATOM 0 HZ3 LYS A 316 3.649 -2.744 8.837 1.00 1.94 H new ATOM 642 N LEU A 317 9.764 -1.357 6.949 1.00 0.35 N ATOM 643 CA LEU A 317 10.717 -2.182 6.228 1.00 0.46 C ATOM 644 C LEU A 317 10.468 -3.645 6.553 1.00 0.56 C ATOM 645 O LEU A 317 9.801 -3.955 7.540 1.00 0.54 O ATOM 646 CB LEU A 317 12.145 -1.816 6.643 1.00 0.51 C ATOM 647 CG LEU A 317 12.559 -0.375 6.360 1.00 0.53 C ATOM 648 CD1 LEU A 317 13.877 -0.060 7.044 1.00 0.61 C ATOM 649 CD2 LEU A 317 12.666 -0.143 4.863 1.00 0.65 C ATOM 0 H LEU A 317 10.136 -0.945 7.804 1.00 0.35 H new ATOM 0 HA LEU A 317 10.595 -2.012 5.158 1.00 0.46 H new ATOM 0 HB2 LEU A 317 12.255 -2.005 7.711 1.00 0.51 H new ATOM 0 HB3 LEU A 317 12.837 -2.483 6.129 1.00 0.51 H new ATOM 0 HG LEU A 317 11.796 0.293 6.760 1.00 0.53 H new ATOM 0 HD11 LEU A 317 14.159 0.971 6.833 1.00 0.61 H new ATOM 0 HD12 LEU A 317 13.769 -0.194 8.120 1.00 0.61 H new ATOM 0 HD13 LEU A 317 14.650 -0.731 6.671 1.00 0.61 H new ATOM 0 HD21 LEU A 317 12.962 0.889 4.675 1.00 0.65 H new ATOM 0 HD22 LEU A 317 13.413 -0.817 4.443 1.00 0.65 H new ATOM 0 HD23 LEU A 317 11.700 -0.334 4.395 1.00 0.65 H new ATOM 661 N LYS A 318 11.022 -4.544 5.748 1.00 0.74 N ATOM 662 CA LYS A 318 10.928 -5.975 6.030 1.00 0.89 C ATOM 663 C LYS A 318 11.586 -6.289 7.371 1.00 0.81 C ATOM 664 O LYS A 318 11.235 -7.257 8.037 1.00 0.87 O ATOM 665 CB LYS A 318 11.597 -6.793 4.922 1.00 1.14 C ATOM 666 CG LYS A 318 11.348 -8.291 5.033 1.00 1.33 C ATOM 667 CD LYS A 318 9.873 -8.632 4.863 1.00 1.34 C ATOM 668 CE LYS A 318 9.622 -10.126 5.004 1.00 1.96 C ATOM 669 NZ LYS A 318 8.207 -10.478 4.716 1.00 2.42 N ATOM 0 H LYS A 318 11.538 -4.312 4.900 1.00 0.74 H new ATOM 0 HA LYS A 318 9.873 -6.246 6.073 1.00 0.89 H new ATOM 0 HB2 LYS A 318 11.234 -6.444 3.955 1.00 1.14 H new ATOM 0 HB3 LYS A 318 12.671 -6.609 4.945 1.00 1.14 H new ATOM 0 HG2 LYS A 318 11.932 -8.814 4.276 1.00 1.33 H new ATOM 0 HG3 LYS A 318 11.694 -8.646 6.004 1.00 1.33 H new ATOM 0 HD2 LYS A 318 9.287 -8.092 5.607 1.00 1.34 H new ATOM 0 HD3 LYS A 318 9.532 -8.296 3.884 1.00 1.34 H new ATOM 0 HE2 LYS A 318 10.277 -10.670 4.324 1.00 1.96 H new ATOM 0 HE3 LYS A 318 9.877 -10.443 6.015 1.00 1.96 H new ATOM 0 HZ1 LYS A 318 8.047 -11.482 4.937 1.00 2.42 H new ATOM 0 HZ2 LYS A 318 7.578 -9.891 5.299 1.00 2.42 H new ATOM 0 HZ3 LYS A 318 8.005 -10.308 3.710 1.00 2.42 H new ATOM 683 N ASN A 319 12.528 -5.437 7.768 1.00 0.73 N ATOM 684 CA ASN A 319 13.257 -5.616 9.023 1.00 0.71 C ATOM 685 C ASN A 319 12.389 -5.241 10.225 1.00 0.63 C ATOM 686 O ASN A 319 12.832 -5.336 11.369 1.00 0.69 O ATOM 687 CB ASN A 319 14.535 -4.768 9.025 1.00 0.78 C ATOM 688 CG ASN A 319 15.476 -5.117 7.886 1.00 1.31 C ATOM 689 OD1 ASN A 319 15.492 -6.247 7.400 1.00 2.20 O ATOM 690 ND2 ASN A 319 16.271 -4.148 7.455 1.00 1.70 N ATOM 0 H ASN A 319 12.806 -4.612 7.237 1.00 0.73 H new ATOM 0 HA ASN A 319 13.524 -6.670 9.104 1.00 0.71 H new ATOM 0 HB2 ASN A 319 14.266 -3.714 8.958 1.00 0.78 H new ATOM 0 HB3 ASN A 319 15.054 -4.904 9.974 1.00 0.78 H new ATOM 0 HD21 ASN A 319 16.926 -4.327 6.694 1.00 1.70 H new ATOM 0 HD22 ASN A 319 16.228 -3.224 7.884 1.00 1.70 H new ATOM 697 N GLY A 320 11.156 -4.808 9.959 1.00 0.55 N ATOM 698 CA GLY A 320 10.239 -4.461 11.032 1.00 0.57 C ATOM 699 C GLY A 320 10.424 -3.040 11.518 1.00 0.53 C ATOM 700 O GLY A 320 9.879 -2.650 12.552 1.00 0.69 O ATOM 0 H GLY A 320 10.777 -4.692 9.019 1.00 0.55 H new ATOM 0 HA2 GLY A 320 9.214 -4.592 10.686 1.00 0.57 H new ATOM 0 HA3 GLY A 320 10.384 -5.148 11.866 1.00 0.57 H new ATOM 704 N LYS A 321 11.206 -2.270 10.776 1.00 0.42 N ATOM 705 CA LYS A 321 11.477 -0.886 11.136 1.00 0.45 C ATOM 706 C LYS A 321 10.527 0.049 10.394 1.00 0.39 C ATOM 707 O LYS A 321 10.442 0.007 9.167 1.00 0.44 O ATOM 708 CB LYS A 321 12.931 -0.513 10.810 1.00 0.56 C ATOM 709 CG LYS A 321 13.964 -1.526 11.297 1.00 1.36 C ATOM 710 CD LYS A 321 13.812 -1.820 12.780 1.00 1.84 C ATOM 711 CE LYS A 321 14.878 -2.785 13.273 1.00 2.33 C ATOM 712 NZ LYS A 321 16.235 -2.170 13.273 1.00 2.42 N ATOM 0 H LYS A 321 11.665 -2.581 9.920 1.00 0.42 H new ATOM 0 HA LYS A 321 11.321 -0.778 12.209 1.00 0.45 H new ATOM 0 HB2 LYS A 321 13.031 -0.400 9.731 1.00 0.56 H new ATOM 0 HB3 LYS A 321 13.153 0.457 11.254 1.00 0.56 H new ATOM 0 HG2 LYS A 321 13.860 -2.452 10.731 1.00 1.36 H new ATOM 0 HG3 LYS A 321 14.966 -1.144 11.103 1.00 1.36 H new ATOM 0 HD2 LYS A 321 13.875 -0.889 13.344 1.00 1.84 H new ATOM 0 HD3 LYS A 321 12.824 -2.241 12.968 1.00 1.84 H new ATOM 0 HE2 LYS A 321 14.630 -3.114 14.282 1.00 2.33 H new ATOM 0 HE3 LYS A 321 14.883 -3.673 12.641 1.00 2.33 H new ATOM 0 HZ1 LYS A 321 16.903 -2.804 13.756 1.00 2.42 H new ATOM 0 HZ2 LYS A 321 16.548 -2.019 12.293 1.00 2.42 H new ATOM 0 HZ3 LYS A 321 16.203 -1.257 13.771 1.00 2.42 H new ATOM 726 N VAL A 322 9.814 0.882 11.132 1.00 0.35 N ATOM 727 CA VAL A 322 8.887 1.831 10.525 1.00 0.33 C ATOM 728 C VAL A 322 9.634 3.081 10.072 1.00 0.35 C ATOM 729 O VAL A 322 10.188 3.811 10.895 1.00 0.42 O ATOM 730 CB VAL A 322 7.763 2.242 11.504 1.00 0.36 C ATOM 731 CG1 VAL A 322 6.778 3.185 10.828 1.00 1.17 C ATOM 732 CG2 VAL A 322 7.047 1.014 12.045 1.00 1.26 C ATOM 0 H VAL A 322 9.856 0.923 12.150 1.00 0.35 H new ATOM 0 HA VAL A 322 8.433 1.335 9.667 1.00 0.33 H new ATOM 0 HB VAL A 322 8.217 2.769 12.343 1.00 0.36 H new ATOM 0 HG11 VAL A 322 5.996 3.462 11.535 1.00 1.17 H new ATOM 0 HG12 VAL A 322 7.302 4.082 10.497 1.00 1.17 H new ATOM 0 HG13 VAL A 322 6.330 2.688 9.967 1.00 1.17 H new ATOM 0 HG21 VAL A 322 6.260 1.325 12.732 1.00 1.26 H new ATOM 0 HG22 VAL A 322 6.608 0.455 11.219 1.00 1.26 H new ATOM 0 HG23 VAL A 322 7.760 0.380 12.573 1.00 1.26 H new ATOM 742 N PHE A 323 9.662 3.324 8.770 1.00 0.35 N ATOM 743 CA PHE A 323 10.373 4.477 8.240 1.00 0.38 C ATOM 744 C PHE A 323 9.450 5.685 8.121 1.00 0.41 C ATOM 745 O PHE A 323 9.889 6.826 8.274 1.00 0.55 O ATOM 746 CB PHE A 323 11.038 4.151 6.890 1.00 0.37 C ATOM 747 CG PHE A 323 10.106 3.641 5.820 1.00 0.37 C ATOM 748 CD1 PHE A 323 9.899 2.281 5.656 1.00 0.36 C ATOM 749 CD2 PHE A 323 9.455 4.519 4.965 1.00 0.43 C ATOM 750 CE1 PHE A 323 9.059 1.805 4.668 1.00 0.39 C ATOM 751 CE2 PHE A 323 8.610 4.048 3.974 1.00 0.48 C ATOM 752 CZ PHE A 323 8.414 2.690 3.826 1.00 0.43 C ATOM 0 H PHE A 323 9.205 2.744 8.067 1.00 0.35 H new ATOM 0 HA PHE A 323 11.164 4.731 8.945 1.00 0.38 H new ATOM 0 HB2 PHE A 323 11.532 5.050 6.520 1.00 0.37 H new ATOM 0 HB3 PHE A 323 11.816 3.406 7.057 1.00 0.37 H new ATOM 0 HD1 PHE A 323 10.401 1.583 6.310 1.00 0.36 H new ATOM 0 HD2 PHE A 323 9.609 5.582 5.074 1.00 0.43 H new ATOM 0 HE1 PHE A 323 8.907 0.742 4.554 1.00 0.39 H new ATOM 0 HE2 PHE A 323 8.105 4.742 3.318 1.00 0.48 H new ATOM 0 HZ PHE A 323 7.757 2.320 3.053 1.00 0.43 H new ATOM 762 N ASP A 324 8.169 5.440 7.877 1.00 0.37 N ATOM 763 CA ASP A 324 7.193 6.524 7.798 1.00 0.45 C ATOM 764 C ASP A 324 5.824 6.025 8.234 1.00 0.36 C ATOM 765 O ASP A 324 5.530 4.834 8.123 1.00 0.47 O ATOM 766 CB ASP A 324 7.117 7.100 6.378 1.00 0.61 C ATOM 767 CG ASP A 324 6.258 8.352 6.315 1.00 0.85 C ATOM 768 OD1 ASP A 324 6.780 9.447 6.621 1.00 1.68 O ATOM 769 OD2 ASP A 324 5.064 8.251 5.967 1.00 0.91 O ATOM 0 H ASP A 324 7.782 4.508 7.731 1.00 0.37 H new ATOM 0 HA ASP A 324 7.516 7.321 8.468 1.00 0.45 H new ATOM 0 HB2 ASP A 324 8.122 7.333 6.027 1.00 0.61 H new ATOM 0 HB3 ASP A 324 6.710 6.347 5.703 1.00 0.61 H new ATOM 774 N LYS A 325 4.995 6.925 8.739 1.00 0.35 N ATOM 775 CA LYS A 325 3.686 6.548 9.245 1.00 0.31 C ATOM 776 C LYS A 325 2.795 7.775 9.381 1.00 0.32 C ATOM 777 O LYS A 325 3.222 8.817 9.886 1.00 0.45 O ATOM 778 CB LYS A 325 3.828 5.842 10.598 1.00 0.43 C ATOM 779 CG LYS A 325 4.526 6.687 11.650 1.00 0.61 C ATOM 780 CD LYS A 325 4.879 5.883 12.887 1.00 1.17 C ATOM 781 CE LYS A 325 5.560 6.753 13.928 1.00 1.44 C ATOM 782 NZ LYS A 325 6.699 7.516 13.356 1.00 1.99 N ATOM 0 H LYS A 325 5.206 7.921 8.809 1.00 0.35 H new ATOM 0 HA LYS A 325 3.222 5.861 8.537 1.00 0.31 H new ATOM 0 HB2 LYS A 325 2.838 5.567 10.962 1.00 0.43 H new ATOM 0 HB3 LYS A 325 4.385 4.915 10.459 1.00 0.43 H new ATOM 0 HG2 LYS A 325 5.434 7.116 11.226 1.00 0.61 H new ATOM 0 HG3 LYS A 325 3.881 7.520 11.931 1.00 0.61 H new ATOM 0 HD2 LYS A 325 3.975 5.445 13.310 1.00 1.17 H new ATOM 0 HD3 LYS A 325 5.536 5.057 12.613 1.00 1.17 H new ATOM 0 HE2 LYS A 325 4.834 7.448 14.351 1.00 1.44 H new ATOM 0 HE3 LYS A 325 5.917 6.127 14.746 1.00 1.44 H new ATOM 0 HZ1 LYS A 325 7.287 7.892 14.127 1.00 1.99 H new ATOM 0 HZ2 LYS A 325 7.273 6.887 12.758 1.00 1.99 H new ATOM 0 HZ3 LYS A 325 6.336 8.304 12.782 1.00 1.99 H new ATOM 796 N ASN A 326 1.572 7.656 8.899 1.00 0.33 N ATOM 797 CA ASN A 326 0.577 8.699 9.066 1.00 0.40 C ATOM 798 C ASN A 326 -0.819 8.106 8.991 1.00 0.39 C ATOM 799 O ASN A 326 -1.189 7.456 8.013 1.00 0.42 O ATOM 800 CB ASN A 326 0.759 9.836 8.047 1.00 0.56 C ATOM 801 CG ASN A 326 0.894 9.362 6.616 1.00 0.95 C ATOM 802 OD1 ASN A 326 -0.094 9.211 5.901 1.00 1.92 O ATOM 803 ND2 ASN A 326 2.128 9.142 6.183 1.00 0.82 N ATOM 0 H ASN A 326 1.242 6.840 8.384 1.00 0.33 H new ATOM 0 HA ASN A 326 0.715 9.140 10.053 1.00 0.40 H new ATOM 0 HB2 ASN A 326 -0.093 10.512 8.116 1.00 0.56 H new ATOM 0 HB3 ASN A 326 1.645 10.411 8.314 1.00 0.56 H new ATOM 0 HD21 ASN A 326 2.284 8.835 5.223 1.00 0.82 H new ATOM 0 HD22 ASN A 326 2.921 9.280 6.810 1.00 0.82 H new ATOM 810 N THR A 327 -1.580 8.297 10.058 1.00 0.45 N ATOM 811 CA THR A 327 -2.902 7.708 10.155 1.00 0.54 C ATOM 812 C THR A 327 -3.749 8.404 11.224 1.00 0.52 C ATOM 813 O THR A 327 -4.925 8.681 11.002 1.00 0.58 O ATOM 814 CB THR A 327 -2.819 6.185 10.443 1.00 0.69 C ATOM 815 OG1 THR A 327 -4.129 5.642 10.637 1.00 1.69 O ATOM 816 CG2 THR A 327 -1.958 5.888 11.664 1.00 1.26 C ATOM 0 H THR A 327 -1.303 8.855 10.866 1.00 0.45 H new ATOM 0 HA THR A 327 -3.388 7.850 9.190 1.00 0.54 H new ATOM 0 HB THR A 327 -2.354 5.716 9.576 1.00 0.69 H new ATOM 0 HG1 THR A 327 -4.061 4.681 10.816 1.00 1.69 H new ATOM 0 HG21 THR A 327 -1.925 4.812 11.833 1.00 1.26 H new ATOM 0 HG22 THR A 327 -0.947 6.260 11.496 1.00 1.26 H new ATOM 0 HG23 THR A 327 -2.385 6.379 12.538 1.00 1.26 H new ATOM 824 N LYS A 328 -3.155 8.704 12.376 1.00 0.51 N ATOM 825 CA LYS A 328 -3.904 9.333 13.452 1.00 0.60 C ATOM 826 C LYS A 328 -4.061 10.830 13.191 1.00 0.61 C ATOM 827 O LYS A 328 -3.165 11.629 13.463 1.00 0.63 O ATOM 828 CB LYS A 328 -3.261 9.055 14.822 1.00 0.65 C ATOM 829 CG LYS A 328 -1.850 9.603 15.016 1.00 1.07 C ATOM 830 CD LYS A 328 -1.371 9.323 16.436 1.00 1.29 C ATOM 831 CE LYS A 328 -0.038 9.985 16.744 1.00 1.63 C ATOM 832 NZ LYS A 328 1.103 9.287 16.095 1.00 2.55 N ATOM 0 H LYS A 328 -2.173 8.524 12.584 1.00 0.51 H new ATOM 0 HA LYS A 328 -4.901 8.893 13.477 1.00 0.60 H new ATOM 0 HB2 LYS A 328 -3.903 9.475 15.596 1.00 0.65 H new ATOM 0 HB3 LYS A 328 -3.237 7.977 14.979 1.00 0.65 H new ATOM 0 HG2 LYS A 328 -1.171 9.144 14.297 1.00 1.07 H new ATOM 0 HG3 LYS A 328 -1.839 10.676 14.825 1.00 1.07 H new ATOM 0 HD2 LYS A 328 -2.120 9.676 17.145 1.00 1.29 H new ATOM 0 HD3 LYS A 328 -1.279 8.246 16.579 1.00 1.29 H new ATOM 0 HE2 LYS A 328 -0.064 11.022 16.409 1.00 1.63 H new ATOM 0 HE3 LYS A 328 0.116 10.002 17.823 1.00 1.63 H new ATOM 0 HZ1 LYS A 328 1.990 9.775 16.334 1.00 2.55 H new ATOM 0 HZ2 LYS A 328 1.146 8.304 16.433 1.00 2.55 H new ATOM 0 HZ3 LYS A 328 0.972 9.293 15.063 1.00 2.55 H new ATOM 846 N GLY A 329 -5.190 11.190 12.599 1.00 0.78 N ATOM 847 CA GLY A 329 -5.467 12.580 12.305 1.00 0.97 C ATOM 848 C GLY A 329 -4.871 13.027 10.982 1.00 0.84 C ATOM 849 O GLY A 329 -5.228 14.082 10.460 1.00 0.88 O ATOM 0 H GLY A 329 -5.923 10.540 12.316 1.00 0.78 H new ATOM 0 HA2 GLY A 329 -6.546 12.735 12.284 1.00 0.97 H new ATOM 0 HA3 GLY A 329 -5.071 13.203 13.107 1.00 0.97 H new ATOM 853 N LYS A 330 -3.948 12.233 10.450 1.00 0.72 N ATOM 854 CA LYS A 330 -3.283 12.557 9.192 1.00 0.62 C ATOM 855 C LYS A 330 -3.824 11.705 8.043 1.00 0.49 C ATOM 856 O LYS A 330 -3.471 10.532 7.915 1.00 0.41 O ATOM 857 CB LYS A 330 -1.764 12.357 9.310 1.00 0.64 C ATOM 858 CG LYS A 330 -1.028 13.465 10.062 1.00 0.90 C ATOM 859 CD LYS A 330 -1.438 13.544 11.525 1.00 1.51 C ATOM 860 CE LYS A 330 -0.724 14.671 12.251 1.00 1.80 C ATOM 861 NZ LYS A 330 0.749 14.592 12.081 1.00 2.08 N ATOM 0 H LYS A 330 -3.642 11.356 10.872 1.00 0.72 H new ATOM 0 HA LYS A 330 -3.489 13.605 8.976 1.00 0.62 H new ATOM 0 HB2 LYS A 330 -1.575 11.408 9.813 1.00 0.64 H new ATOM 0 HB3 LYS A 330 -1.343 12.276 8.308 1.00 0.64 H new ATOM 0 HG2 LYS A 330 0.046 13.293 9.997 1.00 0.90 H new ATOM 0 HG3 LYS A 330 -1.227 14.422 9.580 1.00 0.90 H new ATOM 0 HD2 LYS A 330 -2.516 13.693 11.593 1.00 1.51 H new ATOM 0 HD3 LYS A 330 -1.216 12.597 12.016 1.00 1.51 H new ATOM 0 HE2 LYS A 330 -1.082 15.629 11.875 1.00 1.80 H new ATOM 0 HE3 LYS A 330 -0.970 14.633 13.312 1.00 1.80 H new ATOM 0 HZ1 LYS A 330 1.212 15.219 12.769 1.00 2.08 H new ATOM 0 HZ2 LYS A 330 1.065 13.613 12.237 1.00 2.08 H new ATOM 0 HZ3 LYS A 330 1.004 14.888 11.117 1.00 2.08 H new ATOM 875 N PRO A 331 -4.716 12.270 7.221 1.00 0.49 N ATOM 876 CA PRO A 331 -5.181 11.625 6.005 1.00 0.43 C ATOM 877 C PRO A 331 -4.282 11.941 4.808 1.00 0.39 C ATOM 878 O PRO A 331 -3.942 13.101 4.562 1.00 0.55 O ATOM 879 CB PRO A 331 -6.580 12.213 5.826 1.00 0.53 C ATOM 880 CG PRO A 331 -6.525 13.572 6.455 1.00 0.62 C ATOM 881 CD PRO A 331 -5.352 13.583 7.411 1.00 0.60 C ATOM 0 HA PRO A 331 -5.173 10.537 6.071 1.00 0.43 H new ATOM 0 HB2 PRO A 331 -6.846 12.279 4.771 1.00 0.53 H new ATOM 0 HB3 PRO A 331 -7.333 11.588 6.306 1.00 0.53 H new ATOM 0 HG2 PRO A 331 -6.406 14.343 5.693 1.00 0.62 H new ATOM 0 HG3 PRO A 331 -7.453 13.787 6.984 1.00 0.62 H new ATOM 0 HD2 PRO A 331 -4.662 14.396 7.185 1.00 0.60 H new ATOM 0 HD3 PRO A 331 -5.680 13.721 8.441 1.00 0.60 H new ATOM 889 N PHE A 332 -3.893 10.917 4.069 1.00 0.28 N ATOM 890 CA PHE A 332 -3.082 11.116 2.880 1.00 0.29 C ATOM 891 C PHE A 332 -3.910 10.807 1.643 1.00 0.27 C ATOM 892 O PHE A 332 -4.420 9.696 1.493 1.00 0.26 O ATOM 893 CB PHE A 332 -1.830 10.239 2.928 1.00 0.31 C ATOM 894 CG PHE A 332 -0.890 10.465 1.780 1.00 0.40 C ATOM 895 CD1 PHE A 332 -0.028 11.550 1.776 1.00 0.53 C ATOM 896 CD2 PHE A 332 -0.865 9.588 0.709 1.00 0.42 C ATOM 897 CE1 PHE A 332 0.841 11.755 0.722 1.00 0.64 C ATOM 898 CE2 PHE A 332 0.000 9.788 -0.346 1.00 0.53 C ATOM 899 CZ PHE A 332 0.856 10.872 -0.341 1.00 0.63 C ATOM 0 H PHE A 332 -4.124 9.944 4.269 1.00 0.28 H new ATOM 0 HA PHE A 332 -2.759 12.156 2.839 1.00 0.29 H new ATOM 0 HB2 PHE A 332 -1.301 10.428 3.862 1.00 0.31 H new ATOM 0 HB3 PHE A 332 -2.131 9.192 2.938 1.00 0.31 H new ATOM 0 HD1 PHE A 332 -0.036 12.242 2.605 1.00 0.53 H new ATOM 0 HD2 PHE A 332 -1.531 8.738 0.700 1.00 0.42 H new ATOM 0 HE1 PHE A 332 1.508 12.604 0.729 1.00 0.64 H new ATOM 0 HE2 PHE A 332 0.008 9.097 -1.176 1.00 0.53 H new ATOM 0 HZ PHE A 332 1.535 11.029 -1.166 1.00 0.63 H new ATOM 909 N VAL A 333 -4.054 11.793 0.768 1.00 0.29 N ATOM 910 CA VAL A 333 -4.870 11.641 -0.430 1.00 0.30 C ATOM 911 C VAL A 333 -4.002 11.713 -1.676 1.00 0.30 C ATOM 912 O VAL A 333 -3.387 12.743 -1.957 1.00 0.36 O ATOM 913 CB VAL A 333 -5.966 12.728 -0.519 1.00 0.34 C ATOM 914 CG1 VAL A 333 -6.842 12.519 -1.751 1.00 0.38 C ATOM 915 CG2 VAL A 333 -6.812 12.742 0.746 1.00 0.36 C ATOM 0 H VAL A 333 -3.615 12.709 0.865 1.00 0.29 H new ATOM 0 HA VAL A 333 -5.352 10.665 -0.367 1.00 0.30 H new ATOM 0 HB VAL A 333 -5.475 13.697 -0.614 1.00 0.34 H new ATOM 0 HG11 VAL A 333 -7.605 13.296 -1.791 1.00 0.38 H new ATOM 0 HG12 VAL A 333 -6.226 12.569 -2.649 1.00 0.38 H new ATOM 0 HG13 VAL A 333 -7.322 11.542 -1.695 1.00 0.38 H new ATOM 0 HG21 VAL A 333 -7.577 13.514 0.663 1.00 0.36 H new ATOM 0 HG22 VAL A 333 -7.289 11.770 0.876 1.00 0.36 H new ATOM 0 HG23 VAL A 333 -6.177 12.952 1.606 1.00 0.36 H new ATOM 925 N PHE A 334 -3.943 10.622 -2.421 1.00 0.29 N ATOM 926 CA PHE A 334 -3.160 10.591 -3.644 1.00 0.31 C ATOM 927 C PHE A 334 -4.002 10.071 -4.800 1.00 0.28 C ATOM 928 O PHE A 334 -4.998 9.374 -4.593 1.00 0.30 O ATOM 929 CB PHE A 334 -1.899 9.735 -3.473 1.00 0.33 C ATOM 930 CG PHE A 334 -2.165 8.258 -3.371 1.00 0.31 C ATOM 931 CD1 PHE A 334 -2.020 7.442 -4.484 1.00 0.36 C ATOM 932 CD2 PHE A 334 -2.559 7.684 -2.172 1.00 0.33 C ATOM 933 CE1 PHE A 334 -2.267 6.087 -4.404 1.00 0.39 C ATOM 934 CE2 PHE A 334 -2.805 6.329 -2.088 1.00 0.39 C ATOM 935 CZ PHE A 334 -2.659 5.531 -3.206 1.00 0.41 C ATOM 0 H PHE A 334 -4.425 9.750 -2.202 1.00 0.29 H new ATOM 0 HA PHE A 334 -2.847 11.610 -3.869 1.00 0.31 H new ATOM 0 HB2 PHE A 334 -1.234 9.915 -4.317 1.00 0.33 H new ATOM 0 HB3 PHE A 334 -1.371 10.060 -2.576 1.00 0.33 H new ATOM 0 HD1 PHE A 334 -1.710 7.873 -5.424 1.00 0.36 H new ATOM 0 HD2 PHE A 334 -2.674 8.304 -1.295 1.00 0.33 H new ATOM 0 HE1 PHE A 334 -2.153 5.464 -5.279 1.00 0.39 H new ATOM 0 HE2 PHE A 334 -3.111 5.893 -1.149 1.00 0.39 H new ATOM 0 HZ PHE A 334 -2.852 4.470 -3.141 1.00 0.41 H new ATOM 945 N LYS A 335 -3.608 10.421 -6.013 1.00 0.33 N ATOM 946 CA LYS A 335 -4.333 9.996 -7.198 1.00 0.35 C ATOM 947 C LYS A 335 -3.648 8.799 -7.845 1.00 0.35 C ATOM 948 O LYS A 335 -2.427 8.763 -7.964 1.00 0.43 O ATOM 949 CB LYS A 335 -4.453 11.144 -8.213 1.00 0.53 C ATOM 950 CG LYS A 335 -5.377 12.283 -7.781 1.00 1.05 C ATOM 951 CD LYS A 335 -4.777 13.135 -6.664 1.00 1.46 C ATOM 952 CE LYS A 335 -3.539 13.886 -7.131 1.00 1.95 C ATOM 953 NZ LYS A 335 -2.943 14.714 -6.050 1.00 2.58 N ATOM 0 H LYS A 335 -2.789 10.999 -6.203 1.00 0.33 H new ATOM 0 HA LYS A 335 -5.336 9.704 -6.888 1.00 0.35 H new ATOM 0 HB2 LYS A 335 -3.459 11.551 -8.400 1.00 0.53 H new ATOM 0 HB3 LYS A 335 -4.815 10.739 -9.158 1.00 0.53 H new ATOM 0 HG2 LYS A 335 -5.592 12.917 -8.641 1.00 1.05 H new ATOM 0 HG3 LYS A 335 -6.327 11.868 -7.446 1.00 1.05 H new ATOM 0 HD2 LYS A 335 -5.522 13.847 -6.309 1.00 1.46 H new ATOM 0 HD3 LYS A 335 -4.518 12.497 -5.819 1.00 1.46 H new ATOM 0 HE2 LYS A 335 -2.797 13.173 -7.490 1.00 1.95 H new ATOM 0 HE3 LYS A 335 -3.801 14.526 -7.974 1.00 1.95 H new ATOM 0 HZ1 LYS A 335 -2.103 15.207 -6.414 1.00 2.58 H new ATOM 0 HZ2 LYS A 335 -3.640 15.413 -5.724 1.00 2.58 H new ATOM 0 HZ3 LYS A 335 -2.668 14.102 -5.255 1.00 2.58 H new ATOM 967 N LEU A 336 -4.429 7.808 -8.237 1.00 0.33 N ATOM 968 CA LEU A 336 -3.885 6.680 -8.979 1.00 0.41 C ATOM 969 C LEU A 336 -3.651 7.091 -10.424 1.00 0.51 C ATOM 970 O LEU A 336 -4.505 7.730 -11.046 1.00 0.58 O ATOM 971 CB LEU A 336 -4.800 5.448 -8.911 1.00 0.40 C ATOM 972 CG LEU A 336 -4.721 4.629 -7.614 1.00 0.38 C ATOM 973 CD1 LEU A 336 -5.315 5.394 -6.440 1.00 0.33 C ATOM 974 CD2 LEU A 336 -5.417 3.285 -7.789 1.00 0.46 C ATOM 0 H LEU A 336 -5.432 7.759 -8.057 1.00 0.33 H new ATOM 0 HA LEU A 336 -2.938 6.398 -8.519 1.00 0.41 H new ATOM 0 HB2 LEU A 336 -5.830 5.776 -9.050 1.00 0.40 H new ATOM 0 HB3 LEU A 336 -4.559 4.793 -9.748 1.00 0.40 H new ATOM 0 HG LEU A 336 -3.669 4.449 -7.394 1.00 0.38 H new ATOM 0 HD11 LEU A 336 -5.244 4.787 -5.537 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -4.765 6.324 -6.296 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -6.362 5.619 -6.645 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -5.351 2.718 -6.861 1.00 0.46 H new ATOM 0 HD22 LEU A 336 -6.465 3.448 -8.041 1.00 0.46 H new ATOM 0 HD23 LEU A 336 -4.933 2.726 -8.590 1.00 0.46 H new ATOM 986 N GLY A 337 -2.497 6.737 -10.953 1.00 0.67 N ATOM 987 CA GLY A 337 -2.146 7.165 -12.286 1.00 0.84 C ATOM 988 C GLY A 337 -1.192 8.345 -12.280 1.00 0.75 C ATOM 989 O GLY A 337 -0.782 8.826 -13.336 1.00 0.94 O ATOM 0 H GLY A 337 -1.797 6.162 -10.485 1.00 0.67 H new ATOM 0 HA2 GLY A 337 -1.689 6.334 -12.823 1.00 0.84 H new ATOM 0 HA3 GLY A 337 -3.052 7.436 -12.828 1.00 0.84 H new ATOM 993 N GLN A 338 -0.847 8.825 -11.089 1.00 0.82 N ATOM 994 CA GLN A 338 0.105 9.917 -10.965 1.00 0.87 C ATOM 995 C GLN A 338 1.522 9.358 -10.903 1.00 0.64 C ATOM 996 O GLN A 338 1.772 8.350 -10.237 1.00 0.63 O ATOM 997 CB GLN A 338 -0.181 10.766 -9.718 1.00 1.14 C ATOM 998 CG GLN A 338 0.171 10.080 -8.404 1.00 1.26 C ATOM 999 CD GLN A 338 -0.155 10.929 -7.189 1.00 1.97 C ATOM 1000 OE1 GLN A 338 -1.094 11.727 -7.204 1.00 2.30 O ATOM 1001 NE2 GLN A 338 0.612 10.758 -6.125 1.00 2.62 N ATOM 0 H GLN A 338 -1.211 8.476 -10.203 1.00 0.82 H new ATOM 0 HA GLN A 338 0.004 10.560 -11.839 1.00 0.87 H new ATOM 0 HB2 GLN A 338 0.379 11.698 -9.790 1.00 1.14 H new ATOM 0 HB3 GLN A 338 -1.239 11.030 -9.706 1.00 1.14 H new ATOM 0 HG2 GLN A 338 -0.369 9.136 -8.337 1.00 1.26 H new ATOM 0 HG3 GLN A 338 1.234 9.840 -8.399 1.00 1.26 H new ATOM 0 HE21 GLN A 338 1.380 10.087 -6.152 1.00 2.62 H new ATOM 0 HE22 GLN A 338 0.435 11.297 -5.277 1.00 2.62 H new ATOM 1010 N GLY A 339 2.447 10.013 -11.586 1.00 0.74 N ATOM 1011 CA GLY A 339 3.815 9.538 -11.618 1.00 0.70 C ATOM 1012 C GLY A 339 4.602 9.964 -10.394 1.00 0.55 C ATOM 1013 O GLY A 339 5.723 10.451 -10.510 1.00 0.70 O ATOM 0 H GLY A 339 2.276 10.865 -12.119 1.00 0.74 H new ATOM 0 HA2 GLY A 339 3.818 8.450 -11.688 1.00 0.70 H new ATOM 0 HA3 GLY A 339 4.308 9.917 -12.514 1.00 0.70 H new ATOM 1017 N GLU A 340 4.002 9.796 -9.220 1.00 0.49 N ATOM 1018 CA GLU A 340 4.656 10.149 -7.966 1.00 0.54 C ATOM 1019 C GLU A 340 4.764 8.931 -7.053 1.00 0.41 C ATOM 1020 O GLU A 340 5.591 8.897 -6.142 1.00 0.53 O ATOM 1021 CB GLU A 340 3.891 11.264 -7.242 1.00 0.82 C ATOM 1022 CG GLU A 340 3.587 12.477 -8.106 1.00 1.01 C ATOM 1023 CD GLU A 340 3.279 13.704 -7.280 1.00 1.53 C ATOM 1024 OE1 GLU A 340 2.223 13.737 -6.613 1.00 2.09 O ATOM 1025 OE2 GLU A 340 4.102 14.646 -7.290 1.00 1.89 O ATOM 0 H GLU A 340 3.061 9.417 -9.111 1.00 0.49 H new ATOM 0 HA GLU A 340 5.657 10.507 -8.206 1.00 0.54 H new ATOM 0 HB2 GLU A 340 2.953 10.858 -6.863 1.00 0.82 H new ATOM 0 HB3 GLU A 340 4.472 11.585 -6.377 1.00 0.82 H new ATOM 0 HG2 GLU A 340 4.439 12.682 -8.754 1.00 1.01 H new ATOM 0 HG3 GLU A 340 2.739 12.256 -8.755 1.00 1.01 H new ATOM 1032 N VAL A 341 3.929 7.931 -7.302 1.00 0.34 N ATOM 1033 CA VAL A 341 3.890 6.753 -6.455 1.00 0.30 C ATOM 1034 C VAL A 341 4.659 5.609 -7.096 1.00 0.29 C ATOM 1035 O VAL A 341 4.920 5.621 -8.300 1.00 0.36 O ATOM 1036 CB VAL A 341 2.442 6.296 -6.168 1.00 0.35 C ATOM 1037 CG1 VAL A 341 1.644 7.419 -5.520 1.00 0.41 C ATOM 1038 CG2 VAL A 341 1.756 5.800 -7.436 1.00 0.43 C ATOM 0 H VAL A 341 3.272 7.915 -8.082 1.00 0.34 H new ATOM 0 HA VAL A 341 4.357 7.026 -5.509 1.00 0.30 H new ATOM 0 HB VAL A 341 2.486 5.460 -5.470 1.00 0.35 H new ATOM 0 HG11 VAL A 341 0.627 7.078 -5.326 1.00 0.41 H new ATOM 0 HG12 VAL A 341 2.116 7.706 -4.580 1.00 0.41 H new ATOM 0 HG13 VAL A 341 1.616 8.279 -6.189 1.00 0.41 H new ATOM 0 HG21 VAL A 341 0.739 5.486 -7.200 1.00 0.43 H new ATOM 0 HG22 VAL A 341 1.726 6.604 -8.172 1.00 0.43 H new ATOM 0 HG23 VAL A 341 2.311 4.955 -7.844 1.00 0.43 H new ATOM 1048 N ILE A 342 5.032 4.635 -6.281 1.00 0.29 N ATOM 1049 CA ILE A 342 5.697 3.442 -6.777 1.00 0.30 C ATOM 1050 C ILE A 342 4.651 2.459 -7.293 1.00 0.31 C ATOM 1051 O ILE A 342 3.474 2.560 -6.932 1.00 0.32 O ATOM 1052 CB ILE A 342 6.581 2.786 -5.687 1.00 0.30 C ATOM 1053 CG1 ILE A 342 5.728 2.246 -4.527 1.00 0.30 C ATOM 1054 CG2 ILE A 342 7.606 3.793 -5.173 1.00 0.32 C ATOM 1055 CD1 ILE A 342 6.524 1.909 -3.282 1.00 0.32 C ATOM 0 H ILE A 342 4.885 4.648 -5.272 1.00 0.29 H new ATOM 0 HA ILE A 342 6.359 3.728 -7.594 1.00 0.30 H new ATOM 0 HB ILE A 342 7.105 1.941 -6.134 1.00 0.30 H new ATOM 0 HG12 ILE A 342 4.970 2.986 -4.272 1.00 0.30 H new ATOM 0 HG13 ILE A 342 5.201 1.353 -4.862 1.00 0.30 H new ATOM 0 HG21 ILE A 342 8.224 3.324 -4.407 1.00 0.32 H new ATOM 0 HG22 ILE A 342 8.238 4.122 -5.998 1.00 0.32 H new ATOM 0 HG23 ILE A 342 7.089 4.653 -4.747 1.00 0.32 H new ATOM 0 HD11 ILE A 342 5.851 1.535 -2.510 1.00 0.32 H new ATOM 0 HD12 ILE A 342 7.265 1.145 -3.519 1.00 0.32 H new ATOM 0 HD13 ILE A 342 7.029 2.804 -2.920 1.00 0.32 H new ATOM 1067 N LYS A 343 5.066 1.522 -8.136 1.00 0.34 N ATOM 1068 CA LYS A 343 4.118 0.628 -8.796 1.00 0.38 C ATOM 1069 C LYS A 343 3.336 -0.202 -7.790 1.00 0.32 C ATOM 1070 O LYS A 343 2.151 -0.455 -7.980 1.00 0.36 O ATOM 1071 CB LYS A 343 4.812 -0.289 -9.801 1.00 0.46 C ATOM 1072 CG LYS A 343 5.435 0.455 -10.967 1.00 0.60 C ATOM 1073 CD LYS A 343 5.323 -0.341 -12.256 1.00 1.39 C ATOM 1074 CE LYS A 343 3.869 -0.471 -12.698 1.00 2.16 C ATOM 1075 NZ LYS A 343 3.734 -1.231 -13.972 1.00 2.93 N ATOM 0 H LYS A 343 6.043 1.360 -8.379 1.00 0.34 H new ATOM 0 HA LYS A 343 3.417 1.263 -9.338 1.00 0.38 H new ATOM 0 HB2 LYS A 343 5.587 -0.858 -9.287 1.00 0.46 H new ATOM 0 HB3 LYS A 343 4.089 -1.009 -10.184 1.00 0.46 H new ATOM 0 HG2 LYS A 343 4.943 1.420 -11.090 1.00 0.60 H new ATOM 0 HG3 LYS A 343 6.484 0.657 -10.753 1.00 0.60 H new ATOM 0 HD2 LYS A 343 5.902 0.147 -13.040 1.00 1.39 H new ATOM 0 HD3 LYS A 343 5.753 -1.332 -12.113 1.00 1.39 H new ATOM 0 HE2 LYS A 343 3.297 -0.971 -11.916 1.00 2.16 H new ATOM 0 HE3 LYS A 343 3.439 0.523 -12.822 1.00 2.16 H new ATOM 0 HZ1 LYS A 343 2.743 -1.208 -14.287 1.00 2.93 H new ATOM 0 HZ2 LYS A 343 4.339 -0.799 -14.700 1.00 2.93 H new ATOM 0 HZ3 LYS A 343 4.026 -2.218 -13.820 1.00 2.93 H new ATOM 1089 N GLY A 344 4.003 -0.620 -6.722 1.00 0.28 N ATOM 1090 CA GLY A 344 3.335 -1.356 -5.664 1.00 0.28 C ATOM 1091 C GLY A 344 2.109 -0.632 -5.135 1.00 0.27 C ATOM 1092 O GLY A 344 1.112 -1.258 -4.785 1.00 0.30 O ATOM 0 H GLY A 344 4.999 -0.462 -6.568 1.00 0.28 H new ATOM 0 HA2 GLY A 344 3.040 -2.336 -6.038 1.00 0.28 H new ATOM 0 HA3 GLY A 344 4.035 -1.524 -4.845 1.00 0.28 H new ATOM 1096 N TRP A 345 2.187 0.692 -5.087 1.00 0.27 N ATOM 1097 CA TRP A 345 1.077 1.517 -4.632 1.00 0.27 C ATOM 1098 C TRP A 345 -0.042 1.583 -5.668 1.00 0.29 C ATOM 1099 O TRP A 345 -1.151 1.139 -5.405 1.00 0.32 O ATOM 1100 CB TRP A 345 1.579 2.918 -4.302 1.00 0.27 C ATOM 1101 CG TRP A 345 2.076 3.038 -2.894 1.00 0.28 C ATOM 1102 CD1 TRP A 345 3.116 2.368 -2.315 1.00 0.32 C ATOM 1103 CD2 TRP A 345 1.532 3.884 -1.886 1.00 0.28 C ATOM 1104 NE1 TRP A 345 3.244 2.748 -0.999 1.00 0.36 N ATOM 1105 CE2 TRP A 345 2.281 3.682 -0.714 1.00 0.34 C ATOM 1106 CE3 TRP A 345 0.481 4.796 -1.866 1.00 0.27 C ATOM 1107 CZ2 TRP A 345 2.003 4.363 0.469 1.00 0.39 C ATOM 1108 CZ3 TRP A 345 0.207 5.469 -0.700 1.00 0.32 C ATOM 1109 CH2 TRP A 345 0.964 5.253 0.455 1.00 0.37 C ATOM 0 H TRP A 345 3.016 1.220 -5.360 1.00 0.27 H new ATOM 0 HA TRP A 345 0.662 1.059 -3.735 1.00 0.27 H new ATOM 0 HB2 TRP A 345 2.382 3.183 -4.990 1.00 0.27 H new ATOM 0 HB3 TRP A 345 0.773 3.635 -4.461 1.00 0.27 H new ATOM 0 HD1 TRP A 345 3.745 1.647 -2.816 1.00 0.32 H new ATOM 0 HE1 TRP A 345 3.940 2.394 -0.343 1.00 0.36 H new ATOM 0 HE3 TRP A 345 -0.110 4.972 -2.753 1.00 0.27 H new ATOM 0 HZ2 TRP A 345 2.585 4.195 1.363 1.00 0.39 H new ATOM 0 HZ3 TRP A 345 -0.608 6.178 -0.675 1.00 0.32 H new ATOM 0 HH2 TRP A 345 0.724 5.800 1.355 1.00 0.37 H new ATOM 1120 N ASP A 346 0.265 2.114 -6.848 1.00 0.34 N ATOM 1121 CA ASP A 346 -0.730 2.268 -7.920 1.00 0.40 C ATOM 1122 C ASP A 346 -1.445 0.947 -8.215 1.00 0.39 C ATOM 1123 O ASP A 346 -2.646 0.924 -8.482 1.00 0.46 O ATOM 1124 CB ASP A 346 -0.053 2.789 -9.197 1.00 0.49 C ATOM 1125 CG ASP A 346 -1.008 2.935 -10.375 1.00 0.84 C ATOM 1126 OD1 ASP A 346 -1.522 4.052 -10.610 1.00 1.75 O ATOM 1127 OD2 ASP A 346 -1.227 1.937 -11.099 1.00 0.97 O ATOM 0 H ASP A 346 1.197 2.448 -7.093 1.00 0.34 H new ATOM 0 HA ASP A 346 -1.475 2.988 -7.582 1.00 0.40 H new ATOM 0 HB2 ASP A 346 0.404 3.756 -8.988 1.00 0.49 H new ATOM 0 HB3 ASP A 346 0.753 2.109 -9.475 1.00 0.49 H new ATOM 1132 N ILE A 347 -0.704 -0.151 -8.138 1.00 0.34 N ATOM 1133 CA ILE A 347 -1.246 -1.466 -8.447 1.00 0.35 C ATOM 1134 C ILE A 347 -1.956 -2.075 -7.237 1.00 0.35 C ATOM 1135 O ILE A 347 -3.075 -2.566 -7.353 1.00 0.38 O ATOM 1136 CB ILE A 347 -0.134 -2.413 -8.947 1.00 0.35 C ATOM 1137 CG1 ILE A 347 0.478 -1.852 -10.235 1.00 0.36 C ATOM 1138 CG2 ILE A 347 -0.671 -3.821 -9.175 1.00 0.38 C ATOM 1139 CD1 ILE A 347 1.622 -2.679 -10.783 1.00 0.39 C ATOM 0 H ILE A 347 0.278 -0.156 -7.863 1.00 0.34 H new ATOM 0 HA ILE A 347 -1.981 -1.340 -9.242 1.00 0.35 H new ATOM 0 HB ILE A 347 0.639 -2.477 -8.182 1.00 0.35 H new ATOM 0 HG12 ILE A 347 -0.301 -1.780 -10.994 1.00 0.36 H new ATOM 0 HG13 ILE A 347 0.833 -0.839 -10.045 1.00 0.36 H new ATOM 0 HG21 ILE A 347 0.135 -4.465 -9.527 1.00 0.38 H new ATOM 0 HG22 ILE A 347 -1.068 -4.215 -8.239 1.00 0.38 H new ATOM 0 HG23 ILE A 347 -1.464 -3.791 -9.922 1.00 0.38 H new ATOM 0 HD11 ILE A 347 2.001 -2.217 -11.695 1.00 0.39 H new ATOM 0 HD12 ILE A 347 2.421 -2.731 -10.043 1.00 0.39 H new ATOM 0 HD13 ILE A 347 1.269 -3.686 -11.006 1.00 0.39 H new ATOM 1151 N GLY A 348 -1.304 -2.043 -6.079 1.00 0.33 N ATOM 1152 CA GLY A 348 -1.896 -2.596 -4.868 1.00 0.34 C ATOM 1153 C GLY A 348 -3.144 -1.855 -4.417 1.00 0.31 C ATOM 1154 O GLY A 348 -4.064 -2.454 -3.852 1.00 0.34 O ATOM 0 H GLY A 348 -0.374 -1.644 -5.955 1.00 0.33 H new ATOM 0 HA2 GLY A 348 -2.145 -3.643 -5.039 1.00 0.34 H new ATOM 0 HA3 GLY A 348 -1.157 -2.571 -4.067 1.00 0.34 H new ATOM 1158 N VAL A 349 -3.169 -0.548 -4.649 1.00 0.28 N ATOM 1159 CA VAL A 349 -4.309 0.281 -4.282 1.00 0.27 C ATOM 1160 C VAL A 349 -5.419 0.173 -5.332 1.00 0.24 C ATOM 1161 O VAL A 349 -6.565 0.557 -5.087 1.00 0.24 O ATOM 1162 CB VAL A 349 -3.873 1.758 -4.080 1.00 0.28 C ATOM 1163 CG1 VAL A 349 -5.050 2.660 -3.738 1.00 0.28 C ATOM 1164 CG2 VAL A 349 -2.810 1.838 -2.990 1.00 0.32 C ATOM 0 H VAL A 349 -2.406 -0.037 -5.093 1.00 0.28 H new ATOM 0 HA VAL A 349 -4.706 -0.084 -3.335 1.00 0.27 H new ATOM 0 HB VAL A 349 -3.457 2.114 -5.023 1.00 0.28 H new ATOM 0 HG11 VAL A 349 -4.698 3.683 -3.606 1.00 0.28 H new ATOM 0 HG12 VAL A 349 -5.779 2.629 -4.547 1.00 0.28 H new ATOM 0 HG13 VAL A 349 -5.517 2.315 -2.816 1.00 0.28 H new ATOM 0 HG21 VAL A 349 -2.508 2.876 -2.852 1.00 0.32 H new ATOM 0 HG22 VAL A 349 -3.217 1.452 -2.056 1.00 0.32 H new ATOM 0 HG23 VAL A 349 -1.944 1.244 -3.282 1.00 0.32 H new ATOM 1174 N ALA A 350 -5.089 -0.375 -6.495 1.00 0.28 N ATOM 1175 CA ALA A 350 -6.095 -0.625 -7.518 1.00 0.28 C ATOM 1176 C ALA A 350 -7.094 -1.661 -7.022 1.00 0.30 C ATOM 1177 O ALA A 350 -6.740 -2.815 -6.771 1.00 0.47 O ATOM 1178 CB ALA A 350 -5.450 -1.082 -8.820 1.00 0.37 C ATOM 0 H ALA A 350 -4.142 -0.652 -6.751 1.00 0.28 H new ATOM 0 HA ALA A 350 -6.623 0.307 -7.718 1.00 0.28 H new ATOM 0 HB1 ALA A 350 -6.224 -1.261 -9.566 1.00 0.37 H new ATOM 0 HB2 ALA A 350 -4.771 -0.309 -9.180 1.00 0.37 H new ATOM 0 HB3 ALA A 350 -4.893 -2.003 -8.647 1.00 0.37 H new ATOM 1184 N GLY A 351 -8.343 -1.248 -6.870 1.00 0.30 N ATOM 1185 CA GLY A 351 -9.347 -2.137 -6.323 1.00 0.37 C ATOM 1186 C GLY A 351 -9.415 -2.062 -4.808 1.00 0.33 C ATOM 1187 O GLY A 351 -9.853 -3.005 -4.144 1.00 0.39 O ATOM 0 H GLY A 351 -8.679 -0.316 -7.115 1.00 0.30 H new ATOM 0 HA2 GLY A 351 -10.321 -1.884 -6.742 1.00 0.37 H new ATOM 0 HA3 GLY A 351 -9.127 -3.161 -6.625 1.00 0.37 H new ATOM 1191 N MET A 352 -8.937 -0.953 -4.254 1.00 0.30 N ATOM 1192 CA MET A 352 -9.050 -0.701 -2.826 1.00 0.31 C ATOM 1193 C MET A 352 -10.443 -0.165 -2.523 1.00 0.26 C ATOM 1194 O MET A 352 -11.063 0.468 -3.378 1.00 0.37 O ATOM 1195 CB MET A 352 -7.986 0.311 -2.387 1.00 0.41 C ATOM 1196 CG MET A 352 -7.254 -0.057 -1.103 1.00 0.65 C ATOM 1197 SD MET A 352 -8.349 -0.188 0.321 1.00 1.28 S ATOM 1198 CE MET A 352 -7.171 -0.514 1.628 1.00 0.56 C ATOM 0 H MET A 352 -8.467 -0.214 -4.776 1.00 0.30 H new ATOM 0 HA MET A 352 -8.892 -1.629 -2.277 1.00 0.31 H new ATOM 0 HB2 MET A 352 -7.255 0.421 -3.188 1.00 0.41 H new ATOM 0 HB3 MET A 352 -8.461 1.283 -2.253 1.00 0.41 H new ATOM 0 HG2 MET A 352 -6.738 -1.006 -1.245 1.00 0.65 H new ATOM 0 HG3 MET A 352 -6.491 0.694 -0.899 1.00 0.65 H new ATOM 0 HE1 MET A 352 -7.498 -1.379 2.205 1.00 0.56 H new ATOM 0 HE2 MET A 352 -6.192 -0.716 1.193 1.00 0.56 H new ATOM 0 HE3 MET A 352 -7.105 0.355 2.283 1.00 0.56 H new ATOM 1208 N ALA A 353 -10.932 -0.420 -1.320 1.00 0.34 N ATOM 1209 CA ALA A 353 -12.281 -0.022 -0.951 1.00 0.37 C ATOM 1210 C ALA A 353 -12.275 0.899 0.258 1.00 0.32 C ATOM 1211 O ALA A 353 -11.628 0.610 1.267 1.00 0.34 O ATOM 1212 CB ALA A 353 -13.133 -1.248 -0.666 1.00 0.55 C ATOM 0 H ALA A 353 -10.416 -0.900 -0.583 1.00 0.34 H new ATOM 0 HA ALA A 353 -12.709 0.525 -1.791 1.00 0.37 H new ATOM 0 HB1 ALA A 353 -14.140 -0.935 -0.391 1.00 0.55 H new ATOM 0 HB2 ALA A 353 -13.178 -1.875 -1.557 1.00 0.55 H new ATOM 0 HB3 ALA A 353 -12.692 -1.815 0.154 1.00 0.55 H new ATOM 1218 N VAL A 354 -12.984 2.013 0.145 1.00 0.31 N ATOM 1219 CA VAL A 354 -13.166 2.924 1.262 1.00 0.29 C ATOM 1220 C VAL A 354 -13.802 2.196 2.446 1.00 0.29 C ATOM 1221 O VAL A 354 -14.905 1.664 2.337 1.00 0.32 O ATOM 1222 CB VAL A 354 -14.045 4.128 0.857 1.00 0.33 C ATOM 1223 CG1 VAL A 354 -14.313 5.037 2.046 1.00 0.35 C ATOM 1224 CG2 VAL A 354 -13.382 4.907 -0.267 1.00 0.36 C ATOM 0 H VAL A 354 -13.445 2.308 -0.716 1.00 0.31 H new ATOM 0 HA VAL A 354 -12.184 3.294 1.555 1.00 0.29 H new ATOM 0 HB VAL A 354 -15.003 3.745 0.505 1.00 0.33 H new ATOM 0 HG11 VAL A 354 -14.934 5.875 1.730 1.00 0.35 H new ATOM 0 HG12 VAL A 354 -14.830 4.475 2.824 1.00 0.35 H new ATOM 0 HG13 VAL A 354 -13.368 5.413 2.437 1.00 0.35 H new ATOM 0 HG21 VAL A 354 -14.011 5.753 -0.544 1.00 0.36 H new ATOM 0 HG22 VAL A 354 -12.410 5.271 0.067 1.00 0.36 H new ATOM 0 HG23 VAL A 354 -13.248 4.256 -1.131 1.00 0.36 H new ATOM 1234 N GLY A 355 -13.089 2.167 3.564 1.00 0.28 N ATOM 1235 CA GLY A 355 -13.564 1.460 4.735 1.00 0.30 C ATOM 1236 C GLY A 355 -12.784 0.188 4.983 1.00 0.30 C ATOM 1237 O GLY A 355 -12.916 -0.439 6.034 1.00 0.44 O ATOM 0 H GLY A 355 -12.184 2.624 3.680 1.00 0.28 H new ATOM 0 HA2 GLY A 355 -13.486 2.109 5.607 1.00 0.30 H new ATOM 0 HA3 GLY A 355 -14.620 1.220 4.610 1.00 0.30 H new ATOM 1241 N GLY A 356 -11.971 -0.194 4.011 1.00 0.26 N ATOM 1242 CA GLY A 356 -11.195 -1.409 4.129 1.00 0.30 C ATOM 1243 C GLY A 356 -9.738 -1.148 4.435 1.00 0.25 C ATOM 1244 O GLY A 356 -9.232 -0.044 4.212 1.00 0.27 O ATOM 0 H GLY A 356 -11.835 0.318 3.139 1.00 0.26 H new ATOM 0 HA2 GLY A 356 -11.621 -2.031 4.916 1.00 0.30 H new ATOM 0 HA3 GLY A 356 -11.271 -1.974 3.200 1.00 0.30 H new ATOM 1248 N GLU A 357 -9.067 -2.170 4.947 1.00 0.27 N ATOM 1249 CA GLU A 357 -7.651 -2.098 5.274 1.00 0.33 C ATOM 1250 C GLU A 357 -6.948 -3.367 4.817 1.00 0.30 C ATOM 1251 O GLU A 357 -7.438 -4.469 5.042 1.00 0.34 O ATOM 1252 CB GLU A 357 -7.468 -1.913 6.784 1.00 0.48 C ATOM 1253 CG GLU A 357 -6.015 -1.904 7.232 1.00 0.99 C ATOM 1254 CD GLU A 357 -5.861 -1.588 8.704 1.00 1.06 C ATOM 1255 OE1 GLU A 357 -6.112 -2.483 9.537 1.00 1.18 O ATOM 1256 OE2 GLU A 357 -5.469 -0.450 9.039 1.00 1.41 O ATOM 0 H GLU A 357 -9.491 -3.076 5.148 1.00 0.27 H new ATOM 0 HA GLU A 357 -7.213 -1.243 4.759 1.00 0.33 H new ATOM 0 HB2 GLU A 357 -7.937 -0.976 7.085 1.00 0.48 H new ATOM 0 HB3 GLU A 357 -7.994 -2.714 7.305 1.00 0.48 H new ATOM 0 HG2 GLU A 357 -5.569 -2.877 7.025 1.00 0.99 H new ATOM 0 HG3 GLU A 357 -5.463 -1.169 6.647 1.00 0.99 H new ATOM 1263 N ARG A 358 -5.805 -3.218 4.173 1.00 0.31 N ATOM 1264 CA ARG A 358 -5.059 -4.369 3.696 1.00 0.30 C ATOM 1265 C ARG A 358 -3.564 -4.118 3.751 1.00 0.28 C ATOM 1266 O ARG A 358 -3.098 -2.990 3.588 1.00 0.31 O ATOM 1267 CB ARG A 358 -5.487 -4.755 2.276 1.00 0.37 C ATOM 1268 CG ARG A 358 -5.327 -3.642 1.255 1.00 0.73 C ATOM 1269 CD ARG A 358 -5.744 -4.089 -0.137 1.00 0.75 C ATOM 1270 NE ARG A 358 -7.112 -4.604 -0.157 1.00 0.93 N ATOM 1271 CZ ARG A 358 -7.930 -4.517 -1.200 1.00 1.09 C ATOM 1272 NH1 ARG A 358 -7.517 -3.941 -2.331 1.00 1.17 N ATOM 1273 NH2 ARG A 358 -9.152 -5.022 -1.107 1.00 1.37 N ATOM 0 H ARG A 358 -5.374 -2.316 3.969 1.00 0.31 H new ATOM 0 HA ARG A 358 -5.286 -5.203 4.360 1.00 0.30 H new ATOM 0 HB2 ARG A 358 -4.902 -5.616 1.953 1.00 0.37 H new ATOM 0 HB3 ARG A 358 -6.531 -5.068 2.295 1.00 0.37 H new ATOM 0 HG2 ARG A 358 -5.927 -2.783 1.556 1.00 0.73 H new ATOM 0 HG3 ARG A 358 -4.288 -3.313 1.235 1.00 0.73 H new ATOM 0 HD2 ARG A 358 -5.662 -3.250 -0.828 1.00 0.75 H new ATOM 0 HD3 ARG A 358 -5.060 -4.861 -0.491 1.00 0.75 H new ATOM 0 HE ARG A 358 -7.462 -5.060 0.686 1.00 0.93 H new ATOM 0 HH11 ARG A 358 -6.571 -3.566 -2.396 1.00 1.17 H new ATOM 0 HH12 ARG A 358 -8.148 -3.876 -3.130 1.00 1.17 H new ATOM 0 HH21 ARG A 358 -9.454 -5.471 -0.242 1.00 1.37 H new ATOM 0 HH22 ARG A 358 -9.790 -4.962 -1.900 1.00 1.37 H new ATOM 1287 N ARG A 359 -2.829 -5.178 4.011 1.00 0.26 N ATOM 1288 CA ARG A 359 -1.385 -5.123 4.050 1.00 0.27 C ATOM 1289 C ARG A 359 -0.821 -5.357 2.660 1.00 0.31 C ATOM 1290 O ARG A 359 -1.048 -6.406 2.054 1.00 0.40 O ATOM 1291 CB ARG A 359 -0.857 -6.164 5.032 1.00 0.35 C ATOM 1292 CG ARG A 359 0.648 -6.344 5.001 1.00 0.85 C ATOM 1293 CD ARG A 359 1.131 -7.077 6.238 1.00 0.93 C ATOM 1294 NE ARG A 359 0.961 -6.264 7.436 1.00 1.42 N ATOM 1295 CZ ARG A 359 0.905 -6.747 8.674 1.00 1.87 C ATOM 1296 NH1 ARG A 359 0.948 -8.059 8.889 1.00 1.91 N ATOM 1297 NH2 ARG A 359 0.772 -5.912 9.697 1.00 2.79 N ATOM 0 H ARG A 359 -3.217 -6.102 4.201 1.00 0.26 H new ATOM 0 HA ARG A 359 -1.068 -4.136 4.387 1.00 0.27 H new ATOM 0 HB2 ARG A 359 -1.156 -5.880 6.041 1.00 0.35 H new ATOM 0 HB3 ARG A 359 -1.330 -7.122 4.817 1.00 0.35 H new ATOM 0 HG2 ARG A 359 0.933 -6.901 4.109 1.00 0.85 H new ATOM 0 HG3 ARG A 359 1.134 -5.370 4.938 1.00 0.85 H new ATOM 0 HD2 ARG A 359 0.580 -8.011 6.348 1.00 0.93 H new ATOM 0 HD3 ARG A 359 2.182 -7.340 6.120 1.00 0.93 H new ATOM 0 HE ARG A 359 0.879 -5.254 7.317 1.00 1.42 H new ATOM 0 HH11 ARG A 359 1.024 -8.703 8.101 1.00 1.91 H new ATOM 0 HH12 ARG A 359 0.905 -8.421 9.841 1.00 1.91 H new ATOM 0 HH21 ARG A 359 0.713 -4.907 9.531 1.00 2.79 H new ATOM 0 HH22 ARG A 359 0.728 -6.275 10.649 1.00 2.79 H new ATOM 1311 N ILE A 360 -0.104 -4.369 2.153 1.00 0.29 N ATOM 1312 CA ILE A 360 0.496 -4.467 0.841 1.00 0.30 C ATOM 1313 C ILE A 360 1.957 -4.865 0.969 1.00 0.31 C ATOM 1314 O ILE A 360 2.754 -4.170 1.603 1.00 0.34 O ATOM 1315 CB ILE A 360 0.396 -3.135 0.065 1.00 0.32 C ATOM 1316 CG1 ILE A 360 -1.057 -2.651 0.014 1.00 0.34 C ATOM 1317 CG2 ILE A 360 0.941 -3.309 -1.348 1.00 0.35 C ATOM 1318 CD1 ILE A 360 -1.229 -1.322 -0.689 1.00 0.38 C ATOM 0 H ILE A 360 0.075 -3.488 2.635 1.00 0.29 H new ATOM 0 HA ILE A 360 -0.052 -5.227 0.284 1.00 0.30 H new ATOM 0 HB ILE A 360 0.993 -2.385 0.585 1.00 0.32 H new ATOM 0 HG12 ILE A 360 -1.664 -3.402 -0.493 1.00 0.34 H new ATOM 0 HG13 ILE A 360 -1.439 -2.566 1.031 1.00 0.34 H new ATOM 0 HG21 ILE A 360 0.866 -2.364 -1.886 1.00 0.35 H new ATOM 0 HG22 ILE A 360 1.986 -3.617 -1.300 1.00 0.35 H new ATOM 0 HG23 ILE A 360 0.362 -4.071 -1.870 1.00 0.35 H new ATOM 0 HD11 ILE A 360 -2.283 -1.043 -0.687 1.00 0.38 H new ATOM 0 HD12 ILE A 360 -0.650 -0.558 -0.170 1.00 0.38 H new ATOM 0 HD13 ILE A 360 -0.878 -1.406 -1.718 1.00 0.38 H new ATOM 1330 N VAL A 361 2.285 -6.000 0.380 1.00 0.29 N ATOM 1331 CA VAL A 361 3.630 -6.534 0.405 1.00 0.30 C ATOM 1332 C VAL A 361 4.287 -6.276 -0.944 1.00 0.29 C ATOM 1333 O VAL A 361 3.906 -6.874 -1.955 1.00 0.33 O ATOM 1334 CB VAL A 361 3.616 -8.050 0.703 1.00 0.35 C ATOM 1335 CG1 VAL A 361 5.026 -8.613 0.712 1.00 0.39 C ATOM 1336 CG2 VAL A 361 2.916 -8.333 2.028 1.00 0.38 C ATOM 0 H VAL A 361 1.620 -6.579 -0.132 1.00 0.29 H new ATOM 0 HA VAL A 361 4.195 -6.041 1.196 1.00 0.30 H new ATOM 0 HB VAL A 361 3.058 -8.545 -0.092 1.00 0.35 H new ATOM 0 HG11 VAL A 361 4.990 -9.682 0.924 1.00 0.39 H new ATOM 0 HG12 VAL A 361 5.488 -8.452 -0.262 1.00 0.39 H new ATOM 0 HG13 VAL A 361 5.614 -8.110 1.480 1.00 0.39 H new ATOM 0 HG21 VAL A 361 2.917 -9.406 2.218 1.00 0.38 H new ATOM 0 HG22 VAL A 361 3.442 -7.821 2.834 1.00 0.38 H new ATOM 0 HG23 VAL A 361 1.888 -7.974 1.980 1.00 0.38 H new ATOM 1346 N ILE A 362 5.248 -5.367 -0.968 1.00 0.25 N ATOM 1347 CA ILE A 362 5.842 -4.939 -2.221 1.00 0.25 C ATOM 1348 C ILE A 362 7.314 -5.322 -2.287 1.00 0.26 C ATOM 1349 O ILE A 362 8.145 -4.745 -1.580 1.00 0.29 O ATOM 1350 CB ILE A 362 5.716 -3.412 -2.413 1.00 0.25 C ATOM 1351 CG1 ILE A 362 4.283 -2.953 -2.136 1.00 0.25 C ATOM 1352 CG2 ILE A 362 6.133 -3.025 -3.823 1.00 0.28 C ATOM 1353 CD1 ILE A 362 4.098 -1.450 -2.203 1.00 0.27 C ATOM 0 H ILE A 362 5.631 -4.914 -0.138 1.00 0.25 H new ATOM 0 HA ILE A 362 5.297 -5.446 -3.018 1.00 0.25 H new ATOM 0 HB ILE A 362 6.379 -2.916 -1.703 1.00 0.25 H new ATOM 0 HG12 ILE A 362 3.615 -3.424 -2.857 1.00 0.25 H new ATOM 0 HG13 ILE A 362 3.984 -3.303 -1.148 1.00 0.25 H new ATOM 0 HG21 ILE A 362 6.040 -1.946 -3.947 1.00 0.28 H new ATOM 0 HG22 ILE A 362 7.168 -3.322 -3.991 1.00 0.28 H new ATOM 0 HG23 ILE A 362 5.490 -3.530 -4.544 1.00 0.28 H new ATOM 0 HD11 ILE A 362 3.057 -1.202 -1.996 1.00 0.27 H new ATOM 0 HD12 ILE A 362 4.739 -0.971 -1.463 1.00 0.27 H new ATOM 0 HD13 ILE A 362 4.364 -1.095 -3.198 1.00 0.27 H new ATOM 1365 N PRO A 363 7.652 -6.322 -3.122 1.00 0.28 N ATOM 1366 CA PRO A 363 9.045 -6.661 -3.415 1.00 0.29 C ATOM 1367 C PRO A 363 9.804 -5.452 -3.957 1.00 0.26 C ATOM 1368 O PRO A 363 9.214 -4.576 -4.600 1.00 0.27 O ATOM 1369 CB PRO A 363 8.942 -7.756 -4.486 1.00 0.36 C ATOM 1370 CG PRO A 363 7.534 -7.696 -4.978 1.00 0.66 C ATOM 1371 CD PRO A 363 6.714 -7.213 -3.821 1.00 0.36 C ATOM 0 HA PRO A 363 9.589 -6.984 -2.527 1.00 0.29 H new ATOM 0 HB2 PRO A 363 9.649 -7.581 -5.297 1.00 0.36 H new ATOM 0 HB3 PRO A 363 9.171 -8.737 -4.069 1.00 0.36 H new ATOM 0 HG2 PRO A 363 7.446 -7.020 -5.828 1.00 0.66 H new ATOM 0 HG3 PRO A 363 7.196 -8.676 -5.314 1.00 0.66 H new ATOM 0 HD2 PRO A 363 5.819 -6.684 -4.149 1.00 0.36 H new ATOM 0 HD3 PRO A 363 6.384 -8.035 -3.186 1.00 0.36 H new ATOM 1379 N ALA A 364 11.111 -5.428 -3.713 1.00 0.29 N ATOM 1380 CA ALA A 364 11.963 -4.285 -4.052 1.00 0.34 C ATOM 1381 C ALA A 364 11.747 -3.739 -5.477 1.00 0.34 C ATOM 1382 O ALA A 364 11.590 -2.527 -5.630 1.00 0.36 O ATOM 1383 CB ALA A 364 13.431 -4.628 -3.826 1.00 0.42 C ATOM 0 H ALA A 364 11.613 -6.200 -3.274 1.00 0.29 H new ATOM 0 HA ALA A 364 11.665 -3.481 -3.379 1.00 0.34 H new ATOM 0 HB1 ALA A 364 14.049 -3.768 -4.083 1.00 0.42 H new ATOM 0 HB2 ALA A 364 13.587 -4.887 -2.779 1.00 0.42 H new ATOM 0 HB3 ALA A 364 13.708 -5.474 -4.455 1.00 0.42 H new ATOM 1389 N PRO A 365 11.732 -4.592 -6.542 1.00 0.35 N ATOM 1390 CA PRO A 365 11.612 -4.119 -7.939 1.00 0.40 C ATOM 1391 C PRO A 365 10.438 -3.163 -8.176 1.00 0.36 C ATOM 1392 O PRO A 365 10.503 -2.295 -9.044 1.00 0.41 O ATOM 1393 CB PRO A 365 11.403 -5.409 -8.740 1.00 0.47 C ATOM 1394 CG PRO A 365 12.061 -6.463 -7.925 1.00 0.70 C ATOM 1395 CD PRO A 365 11.849 -6.069 -6.489 1.00 0.38 C ATOM 0 HA PRO A 365 12.492 -3.543 -8.225 1.00 0.40 H new ATOM 0 HB2 PRO A 365 10.343 -5.621 -8.882 1.00 0.47 H new ATOM 0 HB3 PRO A 365 11.850 -5.337 -9.732 1.00 0.47 H new ATOM 0 HG2 PRO A 365 11.627 -7.442 -8.129 1.00 0.70 H new ATOM 0 HG3 PRO A 365 13.124 -6.530 -8.158 1.00 0.70 H new ATOM 0 HD2 PRO A 365 10.950 -6.527 -6.077 1.00 0.38 H new ATOM 0 HD3 PRO A 365 12.683 -6.382 -5.861 1.00 0.38 H new ATOM 1403 N TYR A 366 9.377 -3.308 -7.395 1.00 0.31 N ATOM 1404 CA TYR A 366 8.170 -2.514 -7.607 1.00 0.29 C ATOM 1405 C TYR A 366 8.011 -1.427 -6.550 1.00 0.30 C ATOM 1406 O TYR A 366 7.010 -0.707 -6.535 1.00 0.30 O ATOM 1407 CB TYR A 366 6.934 -3.417 -7.625 1.00 0.30 C ATOM 1408 CG TYR A 366 6.633 -3.998 -8.988 1.00 0.36 C ATOM 1409 CD1 TYR A 366 5.457 -3.690 -9.660 1.00 0.43 C ATOM 1410 CD2 TYR A 366 7.526 -4.866 -9.597 1.00 0.53 C ATOM 1411 CE1 TYR A 366 5.183 -4.232 -10.900 1.00 0.50 C ATOM 1412 CE2 TYR A 366 7.264 -5.409 -10.838 1.00 0.64 C ATOM 1413 CZ TYR A 366 6.071 -5.040 -11.502 1.00 0.59 C ATOM 1414 OH TYR A 366 5.823 -5.635 -12.718 1.00 0.69 O ATOM 0 H TYR A 366 9.325 -3.962 -6.614 1.00 0.31 H new ATOM 0 HA TYR A 366 8.270 -2.022 -8.574 1.00 0.29 H new ATOM 0 HB2 TYR A 366 7.078 -4.231 -6.915 1.00 0.30 H new ATOM 0 HB3 TYR A 366 6.071 -2.846 -7.283 1.00 0.30 H new ATOM 0 HD1 TYR A 366 4.746 -3.016 -9.206 1.00 0.43 H new ATOM 0 HD2 TYR A 366 8.445 -5.122 -9.090 1.00 0.53 H new ATOM 0 HE1 TYR A 366 4.248 -4.004 -11.390 1.00 0.50 H new ATOM 0 HE2 TYR A 366 7.956 -6.102 -11.293 1.00 0.64 H new ATOM 0 HH TYR A 366 5.323 -5.015 -13.289 1.00 0.69 H new ATOM 1424 N ALA A 367 8.997 -1.301 -5.679 1.00 0.33 N ATOM 1425 CA ALA A 367 8.940 -0.308 -4.618 1.00 0.40 C ATOM 1426 C ALA A 367 10.050 0.729 -4.738 1.00 0.50 C ATOM 1427 O ALA A 367 9.859 1.880 -4.366 1.00 0.86 O ATOM 1428 CB ALA A 367 9.000 -0.987 -3.269 1.00 0.40 C ATOM 0 H ALA A 367 9.843 -1.870 -5.684 1.00 0.33 H new ATOM 0 HA ALA A 367 7.993 0.222 -4.717 1.00 0.40 H new ATOM 0 HB1 ALA A 367 8.957 -0.235 -2.481 1.00 0.40 H new ATOM 0 HB2 ALA A 367 8.156 -1.669 -3.167 1.00 0.40 H new ATOM 0 HB3 ALA A 367 9.931 -1.548 -3.185 1.00 0.40 H new ATOM 1434 N TYR A 368 11.191 0.324 -5.289 1.00 0.44 N ATOM 1435 CA TYR A 368 12.360 1.199 -5.401 1.00 0.52 C ATOM 1436 C TYR A 368 13.375 0.612 -6.371 1.00 0.51 C ATOM 1437 O TYR A 368 14.083 1.343 -7.067 1.00 0.58 O ATOM 1438 CB TYR A 368 13.025 1.454 -4.038 1.00 0.57 C ATOM 1439 CG TYR A 368 12.427 2.619 -3.286 1.00 0.63 C ATOM 1440 CD1 TYR A 368 12.359 3.884 -3.851 1.00 0.74 C ATOM 1441 CD2 TYR A 368 11.951 2.449 -1.993 1.00 0.69 C ATOM 1442 CE1 TYR A 368 11.827 4.949 -3.148 1.00 0.85 C ATOM 1443 CE2 TYR A 368 11.416 3.505 -1.285 1.00 0.80 C ATOM 1444 CZ TYR A 368 11.299 4.771 -1.938 1.00 0.86 C ATOM 1445 OH TYR A 368 10.825 5.810 -1.160 1.00 1.00 O ATOM 0 H TYR A 368 11.334 -0.612 -5.668 1.00 0.44 H new ATOM 0 HA TYR A 368 12.007 2.157 -5.782 1.00 0.52 H new ATOM 0 HB2 TYR A 368 12.940 0.555 -3.427 1.00 0.57 H new ATOM 0 HB3 TYR A 368 14.089 1.637 -4.190 1.00 0.57 H new ATOM 0 HD1 TYR A 368 12.727 4.039 -4.854 1.00 0.74 H new ATOM 0 HD2 TYR A 368 12.000 1.473 -1.533 1.00 0.69 H new ATOM 0 HE1 TYR A 368 11.840 5.937 -3.585 1.00 0.85 H new ATOM 0 HE2 TYR A 368 11.093 3.378 -0.262 1.00 0.80 H new ATOM 0 HH TYR A 368 10.482 5.455 -0.314 1.00 1.00 H new ATOM 1455 N GLY A 369 13.438 -0.709 -6.418 1.00 0.51 N ATOM 1456 CA GLY A 369 14.334 -1.376 -7.337 1.00 0.56 C ATOM 1457 C GLY A 369 15.583 -1.874 -6.648 1.00 0.52 C ATOM 1458 O GLY A 369 15.510 -2.553 -5.624 1.00 0.54 O ATOM 0 H GLY A 369 12.882 -1.333 -5.833 1.00 0.51 H new ATOM 0 HA2 GLY A 369 13.817 -2.215 -7.802 1.00 0.56 H new ATOM 0 HA3 GLY A 369 14.610 -0.689 -8.137 1.00 0.56 H new ATOM 1462 N LYS A 370 16.728 -1.529 -7.208 1.00 0.55 N ATOM 1463 CA LYS A 370 18.011 -1.946 -6.660 1.00 0.59 C ATOM 1464 C LYS A 370 18.736 -0.761 -6.036 1.00 0.65 C ATOM 1465 O LYS A 370 19.910 -0.852 -5.681 1.00 0.74 O ATOM 1466 CB LYS A 370 18.871 -2.566 -7.761 1.00 0.61 C ATOM 1467 CG LYS A 370 19.007 -1.676 -8.985 1.00 1.27 C ATOM 1468 CD LYS A 370 19.868 -2.319 -10.063 1.00 1.26 C ATOM 1469 CE LYS A 370 21.317 -2.465 -9.622 1.00 2.26 C ATOM 1470 NZ LYS A 370 22.174 -3.013 -10.706 1.00 2.76 N ATOM 0 H LYS A 370 16.798 -0.956 -8.049 1.00 0.55 H new ATOM 0 HA LYS A 370 17.833 -2.690 -5.884 1.00 0.59 H new ATOM 0 HB2 LYS A 370 19.863 -2.779 -7.362 1.00 0.61 H new ATOM 0 HB3 LYS A 370 18.436 -3.520 -8.059 1.00 0.61 H new ATOM 0 HG2 LYS A 370 18.018 -1.463 -9.390 1.00 1.27 H new ATOM 0 HG3 LYS A 370 19.444 -0.721 -8.693 1.00 1.27 H new ATOM 0 HD2 LYS A 370 19.464 -3.300 -10.312 1.00 1.26 H new ATOM 0 HD3 LYS A 370 19.824 -1.716 -10.970 1.00 1.26 H new ATOM 0 HE2 LYS A 370 21.702 -1.494 -9.311 1.00 2.26 H new ATOM 0 HE3 LYS A 370 21.368 -3.121 -8.753 1.00 2.26 H new ATOM 0 HZ1 LYS A 370 23.153 -3.097 -10.366 1.00 2.76 H new ATOM 0 HZ2 LYS A 370 21.823 -3.951 -10.985 1.00 2.76 H new ATOM 0 HZ3 LYS A 370 22.146 -2.375 -11.527 1.00 2.76 H new ATOM 1484 N GLN A 371 18.022 0.343 -5.889 1.00 0.63 N ATOM 1485 CA GLN A 371 18.601 1.568 -5.364 1.00 0.70 C ATOM 1486 C GLN A 371 18.572 1.556 -3.837 1.00 0.73 C ATOM 1487 O GLN A 371 17.520 1.752 -3.228 1.00 0.74 O ATOM 1488 CB GLN A 371 17.828 2.773 -5.905 1.00 0.76 C ATOM 1489 CG GLN A 371 18.462 4.117 -5.587 1.00 1.22 C ATOM 1490 CD GLN A 371 17.742 5.273 -6.263 1.00 1.85 C ATOM 1491 OE1 GLN A 371 17.158 5.119 -7.337 1.00 2.65 O ATOM 1492 NE2 GLN A 371 17.799 6.445 -5.656 1.00 2.26 N ATOM 0 H GLN A 371 17.033 0.415 -6.128 1.00 0.63 H new ATOM 0 HA GLN A 371 19.640 1.640 -5.685 1.00 0.70 H new ATOM 0 HB2 GLN A 371 17.736 2.675 -6.987 1.00 0.76 H new ATOM 0 HB3 GLN A 371 16.818 2.755 -5.496 1.00 0.76 H new ATOM 0 HG2 GLN A 371 18.458 4.271 -4.508 1.00 1.22 H new ATOM 0 HG3 GLN A 371 19.505 4.107 -5.903 1.00 1.22 H new ATOM 0 HE21 GLN A 371 18.291 6.536 -4.767 1.00 2.26 H new ATOM 0 HE22 GLN A 371 17.351 7.259 -6.076 1.00 2.26 H new ATOM 1501 N ALA A 372 19.722 1.295 -3.227 1.00 0.77 N ATOM 1502 CA ALA A 372 19.820 1.249 -1.778 1.00 0.79 C ATOM 1503 C ALA A 372 19.856 2.655 -1.190 1.00 0.86 C ATOM 1504 O ALA A 372 20.911 3.288 -1.119 1.00 1.01 O ATOM 1505 CB ALA A 372 21.047 0.456 -1.349 1.00 0.86 C ATOM 0 H ALA A 372 20.598 1.112 -3.716 1.00 0.77 H new ATOM 0 HA ALA A 372 18.933 0.745 -1.394 1.00 0.79 H new ATOM 0 HB1 ALA A 372 21.103 0.433 -0.261 1.00 0.86 H new ATOM 0 HB2 ALA A 372 20.974 -0.562 -1.730 1.00 0.86 H new ATOM 0 HB3 ALA A 372 21.944 0.929 -1.749 1.00 0.86 H new ATOM 1511 N LEU A 373 18.690 3.142 -0.794 1.00 0.77 N ATOM 1512 CA LEU A 373 18.575 4.434 -0.139 1.00 0.82 C ATOM 1513 C LEU A 373 19.091 4.330 1.290 1.00 0.84 C ATOM 1514 O LEU A 373 19.111 3.239 1.861 1.00 0.80 O ATOM 1515 CB LEU A 373 17.110 4.893 -0.123 1.00 0.79 C ATOM 1516 CG LEU A 373 16.435 5.009 -1.489 1.00 0.81 C ATOM 1517 CD1 LEU A 373 14.965 5.361 -1.323 1.00 0.80 C ATOM 1518 CD2 LEU A 373 17.143 6.045 -2.345 1.00 0.93 C ATOM 0 H LEU A 373 17.802 2.655 -0.917 1.00 0.77 H new ATOM 0 HA LEU A 373 19.169 5.163 -0.690 1.00 0.82 H new ATOM 0 HB2 LEU A 373 16.537 4.195 0.486 1.00 0.79 H new ATOM 0 HB3 LEU A 373 17.058 5.864 0.371 1.00 0.79 H new ATOM 0 HG LEU A 373 16.503 4.046 -1.995 1.00 0.81 H new ATOM 0 HD11 LEU A 373 14.497 5.440 -2.304 1.00 0.80 H new ATOM 0 HD12 LEU A 373 14.467 4.582 -0.745 1.00 0.80 H new ATOM 0 HD13 LEU A 373 14.876 6.313 -0.800 1.00 0.80 H new ATOM 0 HD21 LEU A 373 16.649 6.115 -3.314 1.00 0.93 H new ATOM 0 HD22 LEU A 373 17.106 7.014 -1.848 1.00 0.93 H new ATOM 0 HD23 LEU A 373 18.183 5.750 -2.488 1.00 0.93 H new ATOM 1530 N PRO A 374 19.528 5.446 1.888 1.00 0.94 N ATOM 1531 CA PRO A 374 19.915 5.460 3.296 1.00 0.98 C ATOM 1532 C PRO A 374 18.759 4.999 4.181 1.00 0.92 C ATOM 1533 O PRO A 374 17.712 5.645 4.247 1.00 0.92 O ATOM 1534 CB PRO A 374 20.266 6.929 3.574 1.00 1.10 C ATOM 1535 CG PRO A 374 19.708 7.703 2.425 1.00 1.31 C ATOM 1536 CD PRO A 374 19.690 6.762 1.253 1.00 1.05 C ATOM 0 HA PRO A 374 20.744 4.786 3.509 1.00 0.98 H new ATOM 0 HB2 PRO A 374 19.834 7.263 4.517 1.00 1.10 H new ATOM 0 HB3 PRO A 374 21.345 7.066 3.651 1.00 1.10 H new ATOM 0 HG2 PRO A 374 18.704 8.064 2.650 1.00 1.31 H new ATOM 0 HG3 PRO A 374 20.321 8.579 2.211 1.00 1.31 H new ATOM 0 HD2 PRO A 374 18.870 6.984 0.570 1.00 1.05 H new ATOM 0 HD3 PRO A 374 20.612 6.820 0.674 1.00 1.05 H new ATOM 1544 N GLY A 375 18.944 3.856 4.833 1.00 0.90 N ATOM 1545 CA GLY A 375 17.899 3.294 5.670 1.00 0.90 C ATOM 1546 C GLY A 375 17.094 2.222 4.956 1.00 0.82 C ATOM 1547 O GLY A 375 16.593 1.290 5.585 1.00 0.86 O ATOM 0 H GLY A 375 19.803 3.307 4.797 1.00 0.90 H new ATOM 0 HA2 GLY A 375 18.347 2.869 6.568 1.00 0.90 H new ATOM 0 HA3 GLY A 375 17.230 4.091 5.994 1.00 0.90 H new ATOM 1551 N ILE A 376 16.984 2.342 3.638 1.00 0.74 N ATOM 1552 CA ILE A 376 16.211 1.393 2.841 1.00 0.68 C ATOM 1553 C ILE A 376 17.077 0.790 1.736 1.00 0.65 C ATOM 1554 O ILE A 376 17.102 1.298 0.615 1.00 0.67 O ATOM 1555 CB ILE A 376 14.974 2.054 2.189 1.00 0.66 C ATOM 1556 CG1 ILE A 376 14.195 2.882 3.216 1.00 0.72 C ATOM 1557 CG2 ILE A 376 14.074 0.986 1.573 1.00 0.64 C ATOM 1558 CD1 ILE A 376 13.018 3.627 2.624 1.00 0.74 C ATOM 0 H ILE A 376 17.421 3.088 3.097 1.00 0.74 H new ATOM 0 HA ILE A 376 15.873 0.614 3.525 1.00 0.68 H new ATOM 0 HB ILE A 376 15.315 2.725 1.401 1.00 0.66 H new ATOM 0 HG12 ILE A 376 13.837 2.222 4.006 1.00 0.72 H new ATOM 0 HG13 ILE A 376 14.872 3.599 3.681 1.00 0.72 H new ATOM 0 HG21 ILE A 376 13.206 1.461 1.116 1.00 0.64 H new ATOM 0 HG22 ILE A 376 14.629 0.437 0.812 1.00 0.64 H new ATOM 0 HG23 ILE A 376 13.744 0.296 2.350 1.00 0.64 H new ATOM 0 HD11 ILE A 376 12.513 4.192 3.408 1.00 0.74 H new ATOM 0 HD12 ILE A 376 13.371 4.312 1.854 1.00 0.74 H new ATOM 0 HD13 ILE A 376 12.321 2.914 2.184 1.00 0.74 H new ATOM 1570 N PRO A 377 17.825 -0.277 2.038 1.00 0.64 N ATOM 1571 CA PRO A 377 18.684 -0.939 1.061 1.00 0.67 C ATOM 1572 C PRO A 377 17.891 -1.785 0.067 1.00 0.63 C ATOM 1573 O PRO A 377 16.712 -2.074 0.279 1.00 0.58 O ATOM 1574 CB PRO A 377 19.605 -1.825 1.911 1.00 0.71 C ATOM 1575 CG PRO A 377 19.317 -1.465 3.335 1.00 0.71 C ATOM 1576 CD PRO A 377 17.920 -0.920 3.350 1.00 0.63 C ATOM 0 HA PRO A 377 19.225 -0.216 0.451 1.00 0.67 H new ATOM 0 HB2 PRO A 377 19.409 -2.882 1.728 1.00 0.71 H new ATOM 0 HB3 PRO A 377 20.652 -1.648 1.667 1.00 0.71 H new ATOM 0 HG2 PRO A 377 19.402 -2.337 3.983 1.00 0.71 H new ATOM 0 HG3 PRO A 377 20.028 -0.725 3.702 1.00 0.71 H new ATOM 0 HD2 PRO A 377 17.177 -1.708 3.472 1.00 0.63 H new ATOM 0 HD3 PRO A 377 17.769 -0.210 4.163 1.00 0.63 H new ATOM 1584 N ALA A 378 18.547 -2.179 -1.018 1.00 0.68 N ATOM 1585 CA ALA A 378 17.910 -2.972 -2.061 1.00 0.68 C ATOM 1586 C ALA A 378 17.502 -4.352 -1.548 1.00 0.65 C ATOM 1587 O ALA A 378 18.007 -4.816 -0.523 1.00 0.65 O ATOM 1588 CB ALA A 378 18.843 -3.108 -3.253 1.00 0.74 C ATOM 0 H ALA A 378 19.527 -1.960 -1.198 1.00 0.68 H new ATOM 0 HA ALA A 378 17.003 -2.453 -2.370 1.00 0.68 H new ATOM 0 HB1 ALA A 378 18.359 -3.702 -4.028 1.00 0.74 H new ATOM 0 HB2 ALA A 378 19.077 -2.119 -3.647 1.00 0.74 H new ATOM 0 HB3 ALA A 378 19.764 -3.601 -2.940 1.00 0.74 H new ATOM 1594 N ASN A 379 16.564 -4.979 -2.266 1.00 0.68 N ATOM 1595 CA ASN A 379 16.053 -6.320 -1.936 1.00 0.69 C ATOM 1596 C ASN A 379 15.132 -6.293 -0.718 1.00 0.62 C ATOM 1597 O ASN A 379 14.484 -7.290 -0.400 1.00 0.67 O ATOM 1598 CB ASN A 379 17.191 -7.325 -1.723 1.00 0.80 C ATOM 1599 CG ASN A 379 17.871 -7.735 -3.017 1.00 0.93 C ATOM 1600 OD1 ASN A 379 17.095 -7.896 -4.082 1.00 1.49 O flip ATOM 1601 ND2 ASN A 379 19.084 -7.937 -3.051 1.00 1.37 N flip ATOM 0 H ASN A 379 16.134 -4.571 -3.096 1.00 0.68 H new ATOM 0 HA ASN A 379 15.467 -6.649 -2.794 1.00 0.69 H new ATOM 0 HB2 ASN A 379 17.932 -6.890 -1.052 1.00 0.80 H new ATOM 0 HB3 ASN A 379 16.796 -8.213 -1.229 1.00 0.80 H new ATOM 0 HD21 ASN A 379 19.647 -7.802 -2.211 1.00 1.37 H new ATOM 0 HD22 ASN A 379 19.527 -8.239 -3.919 1.00 1.37 H new ATOM 1608 N SER A 380 15.060 -5.150 -0.051 1.00 0.63 N ATOM 1609 CA SER A 380 14.202 -4.996 1.112 1.00 0.64 C ATOM 1610 C SER A 380 12.731 -4.998 0.708 1.00 0.49 C ATOM 1611 O SER A 380 12.267 -4.108 -0.004 1.00 0.60 O ATOM 1612 CB SER A 380 14.554 -3.706 1.856 1.00 0.84 C ATOM 1613 OG SER A 380 15.916 -3.712 2.253 1.00 1.84 O ATOM 0 H SER A 380 15.588 -4.313 -0.298 1.00 0.63 H new ATOM 0 HA SER A 380 14.368 -5.843 1.778 1.00 0.64 H new ATOM 0 HB2 SER A 380 14.361 -2.846 1.215 1.00 0.84 H new ATOM 0 HB3 SER A 380 13.915 -3.600 2.733 1.00 0.84 H new ATOM 0 HG SER A 380 16.423 -3.088 1.693 1.00 1.84 H new ATOM 1619 N GLU A 381 12.019 -6.025 1.148 1.00 0.39 N ATOM 1620 CA GLU A 381 10.592 -6.147 0.894 1.00 0.30 C ATOM 1621 C GLU A 381 9.824 -5.155 1.763 1.00 0.27 C ATOM 1622 O GLU A 381 9.727 -5.331 2.976 1.00 0.32 O ATOM 1623 CB GLU A 381 10.146 -7.578 1.197 1.00 0.39 C ATOM 1624 CG GLU A 381 8.683 -7.858 0.908 1.00 0.52 C ATOM 1625 CD GLU A 381 8.277 -9.244 1.359 1.00 0.82 C ATOM 1626 OE1 GLU A 381 8.610 -10.222 0.662 1.00 0.98 O ATOM 1627 OE2 GLU A 381 7.598 -9.362 2.400 1.00 1.03 O ATOM 0 H GLU A 381 12.413 -6.795 1.689 1.00 0.39 H new ATOM 0 HA GLU A 381 10.385 -5.923 -0.152 1.00 0.30 H new ATOM 0 HB2 GLU A 381 10.756 -8.266 0.613 1.00 0.39 H new ATOM 0 HB3 GLU A 381 10.343 -7.791 2.248 1.00 0.39 H new ATOM 0 HG2 GLU A 381 8.064 -7.116 1.412 1.00 0.52 H new ATOM 0 HG3 GLU A 381 8.497 -7.755 -0.161 1.00 0.52 H new ATOM 1634 N LEU A 382 9.309 -4.101 1.152 1.00 0.24 N ATOM 1635 CA LEU A 382 8.589 -3.071 1.890 1.00 0.23 C ATOM 1636 C LEU A 382 7.174 -3.531 2.197 1.00 0.20 C ATOM 1637 O LEU A 382 6.531 -4.179 1.371 1.00 0.22 O ATOM 1638 CB LEU A 382 8.554 -1.765 1.093 1.00 0.27 C ATOM 1639 CG LEU A 382 9.921 -1.176 0.738 1.00 0.32 C ATOM 1640 CD1 LEU A 382 9.759 0.166 0.046 1.00 0.37 C ATOM 1641 CD2 LEU A 382 10.787 -1.026 1.977 1.00 0.37 C ATOM 0 H LEU A 382 9.375 -3.934 0.148 1.00 0.24 H new ATOM 0 HA LEU A 382 9.113 -2.893 2.829 1.00 0.23 H new ATOM 0 HB2 LEU A 382 8.001 -1.937 0.170 1.00 0.27 H new ATOM 0 HB3 LEU A 382 7.996 -1.024 1.666 1.00 0.27 H new ATOM 0 HG LEU A 382 10.417 -1.866 0.055 1.00 0.32 H new ATOM 0 HD11 LEU A 382 10.741 0.570 -0.199 1.00 0.37 H new ATOM 0 HD12 LEU A 382 9.181 0.036 -0.869 1.00 0.37 H new ATOM 0 HD13 LEU A 382 9.238 0.857 0.709 1.00 0.37 H new ATOM 0 HD21 LEU A 382 11.753 -0.605 1.697 1.00 0.37 H new ATOM 0 HD22 LEU A 382 10.294 -0.362 2.687 1.00 0.37 H new ATOM 0 HD23 LEU A 382 10.936 -2.003 2.437 1.00 0.37 H new ATOM 1653 N THR A 383 6.691 -3.204 3.385 1.00 0.20 N ATOM 1654 CA THR A 383 5.357 -3.590 3.793 1.00 0.20 C ATOM 1655 C THR A 383 4.549 -2.356 4.192 1.00 0.19 C ATOM 1656 O THR A 383 4.966 -1.573 5.052 1.00 0.18 O ATOM 1657 CB THR A 383 5.417 -4.570 4.979 1.00 0.23 C ATOM 1658 OG1 THR A 383 6.315 -5.647 4.678 1.00 0.26 O ATOM 1659 CG2 THR A 383 4.043 -5.132 5.296 1.00 0.27 C ATOM 0 H THR A 383 7.208 -2.670 4.083 1.00 0.20 H new ATOM 0 HA THR A 383 4.872 -4.082 2.950 1.00 0.20 H new ATOM 0 HB THR A 383 5.776 -4.022 5.850 1.00 0.23 H new ATOM 0 HG1 THR A 383 6.350 -6.266 5.437 1.00 0.26 H new ATOM 0 HG21 THR A 383 4.117 -5.821 6.138 1.00 0.27 H new ATOM 0 HG22 THR A 383 3.367 -4.317 5.553 1.00 0.27 H new ATOM 0 HG23 THR A 383 3.657 -5.663 4.426 1.00 0.27 H new ATOM 1667 N PHE A 384 3.398 -2.183 3.565 1.00 0.21 N ATOM 1668 CA PHE A 384 2.559 -1.024 3.830 1.00 0.20 C ATOM 1669 C PHE A 384 1.192 -1.449 4.346 1.00 0.21 C ATOM 1670 O PHE A 384 0.404 -2.052 3.615 1.00 0.24 O ATOM 1671 CB PHE A 384 2.385 -0.175 2.566 1.00 0.21 C ATOM 1672 CG PHE A 384 3.644 0.494 2.090 1.00 0.21 C ATOM 1673 CD1 PHE A 384 4.005 1.744 2.565 1.00 0.27 C ATOM 1674 CD2 PHE A 384 4.470 -0.134 1.170 1.00 0.22 C ATOM 1675 CE1 PHE A 384 5.167 2.358 2.132 1.00 0.32 C ATOM 1676 CE2 PHE A 384 5.633 0.476 0.734 1.00 0.27 C ATOM 1677 CZ PHE A 384 5.964 1.742 1.198 1.00 0.31 C ATOM 0 H PHE A 384 3.023 -2.828 2.870 1.00 0.21 H new ATOM 0 HA PHE A 384 3.057 -0.427 4.594 1.00 0.20 H new ATOM 0 HB2 PHE A 384 2.000 -0.809 1.767 1.00 0.21 H new ATOM 0 HB3 PHE A 384 1.632 0.589 2.757 1.00 0.21 H new ATOM 0 HD1 PHE A 384 3.372 2.246 3.282 1.00 0.27 H new ATOM 0 HD2 PHE A 384 4.203 -1.109 0.790 1.00 0.22 H new ATOM 0 HE1 PHE A 384 5.448 3.322 2.529 1.00 0.32 H new ATOM 0 HE2 PHE A 384 6.281 -0.031 0.035 1.00 0.27 H new ATOM 0 HZ PHE A 384 6.846 2.241 0.825 1.00 0.31 H new ATOM 1687 N ASP A 385 0.923 -1.143 5.608 1.00 0.21 N ATOM 1688 CA ASP A 385 -0.402 -1.384 6.179 1.00 0.27 C ATOM 1689 C ASP A 385 -1.286 -0.185 5.883 1.00 0.23 C ATOM 1690 O ASP A 385 -1.123 0.873 6.493 1.00 0.27 O ATOM 1691 CB ASP A 385 -0.337 -1.606 7.697 1.00 0.42 C ATOM 1692 CG ASP A 385 0.431 -2.849 8.103 1.00 0.95 C ATOM 1693 OD1 ASP A 385 0.668 -3.050 9.307 1.00 1.80 O ATOM 1694 OD2 ASP A 385 0.790 -3.645 7.205 1.00 1.30 O ATOM 0 H ASP A 385 1.596 -0.731 6.254 1.00 0.21 H new ATOM 0 HA ASP A 385 -0.811 -2.288 5.728 1.00 0.27 H new ATOM 0 HB2 ASP A 385 0.127 -0.736 8.162 1.00 0.42 H new ATOM 0 HB3 ASP A 385 -1.352 -1.674 8.088 1.00 0.42 H new ATOM 1699 N VAL A 386 -2.205 -0.340 4.939 1.00 0.21 N ATOM 1700 CA VAL A 386 -3.012 0.786 4.482 1.00 0.23 C ATOM 1701 C VAL A 386 -4.508 0.533 4.667 1.00 0.22 C ATOM 1702 O VAL A 386 -5.011 -0.558 4.388 1.00 0.31 O ATOM 1703 CB VAL A 386 -2.732 1.114 2.991 1.00 0.26 C ATOM 1704 CG1 VAL A 386 -1.258 1.407 2.762 1.00 0.28 C ATOM 1705 CG2 VAL A 386 -3.185 -0.015 2.075 1.00 0.29 C ATOM 0 H VAL A 386 -2.410 -1.226 4.477 1.00 0.21 H new ATOM 0 HA VAL A 386 -2.725 1.637 5.099 1.00 0.23 H new ATOM 0 HB VAL A 386 -3.309 2.006 2.746 1.00 0.26 H new ATOM 0 HG11 VAL A 386 -1.091 1.633 1.709 1.00 0.28 H new ATOM 0 HG12 VAL A 386 -0.958 2.262 3.369 1.00 0.28 H new ATOM 0 HG13 VAL A 386 -0.666 0.536 3.044 1.00 0.28 H new ATOM 0 HG21 VAL A 386 -2.973 0.250 1.039 1.00 0.29 H new ATOM 0 HG22 VAL A 386 -2.650 -0.929 2.333 1.00 0.29 H new ATOM 0 HG23 VAL A 386 -4.256 -0.175 2.197 1.00 0.29 H new ATOM 1715 N LYS A 387 -5.209 1.547 5.153 1.00 0.19 N ATOM 1716 CA LYS A 387 -6.666 1.530 5.187 1.00 0.22 C ATOM 1717 C LYS A 387 -7.203 2.745 4.452 1.00 0.21 C ATOM 1718 O LYS A 387 -6.685 3.852 4.599 1.00 0.22 O ATOM 1719 CB LYS A 387 -7.222 1.491 6.620 1.00 0.32 C ATOM 1720 CG LYS A 387 -6.688 2.577 7.547 1.00 1.08 C ATOM 1721 CD LYS A 387 -7.701 2.941 8.627 1.00 1.06 C ATOM 1722 CE LYS A 387 -8.260 1.715 9.339 1.00 1.62 C ATOM 1723 NZ LYS A 387 -7.251 1.034 10.193 1.00 2.53 N ATOM 0 H LYS A 387 -4.790 2.397 5.531 1.00 0.19 H new ATOM 0 HA LYS A 387 -6.996 0.616 4.694 1.00 0.22 H new ATOM 0 HB2 LYS A 387 -8.308 1.574 6.575 1.00 0.32 H new ATOM 0 HB3 LYS A 387 -6.995 0.518 7.056 1.00 0.32 H new ATOM 0 HG2 LYS A 387 -5.764 2.236 8.014 1.00 1.08 H new ATOM 0 HG3 LYS A 387 -6.442 3.465 6.964 1.00 1.08 H new ATOM 0 HD2 LYS A 387 -7.228 3.598 9.358 1.00 1.06 H new ATOM 0 HD3 LYS A 387 -8.521 3.502 8.178 1.00 1.06 H new ATOM 0 HE2 LYS A 387 -9.108 2.014 9.955 1.00 1.62 H new ATOM 0 HE3 LYS A 387 -8.637 1.010 8.598 1.00 1.62 H new ATOM 0 HZ1 LYS A 387 -7.728 0.352 10.817 1.00 2.53 H new ATOM 0 HZ2 LYS A 387 -6.567 0.533 9.590 1.00 2.53 H new ATOM 0 HZ3 LYS A 387 -6.751 1.740 10.770 1.00 2.53 H new ATOM 1737 N LEU A 388 -8.233 2.534 3.656 1.00 0.21 N ATOM 1738 CA LEU A 388 -8.807 3.600 2.852 1.00 0.21 C ATOM 1739 C LEU A 388 -9.993 4.213 3.589 1.00 0.24 C ATOM 1740 O LEU A 388 -10.830 3.490 4.125 1.00 0.28 O ATOM 1741 CB LEU A 388 -9.246 3.053 1.489 1.00 0.21 C ATOM 1742 CG LEU A 388 -9.546 4.105 0.420 1.00 0.21 C ATOM 1743 CD1 LEU A 388 -8.337 4.994 0.193 1.00 0.22 C ATOM 1744 CD2 LEU A 388 -9.950 3.438 -0.885 1.00 0.24 C ATOM 0 H LEU A 388 -8.693 1.630 3.547 1.00 0.21 H new ATOM 0 HA LEU A 388 -8.056 4.373 2.687 1.00 0.21 H new ATOM 0 HB2 LEU A 388 -8.464 2.392 1.114 1.00 0.21 H new ATOM 0 HB3 LEU A 388 -10.137 2.442 1.633 1.00 0.21 H new ATOM 0 HG LEU A 388 -10.374 4.721 0.772 1.00 0.21 H new ATOM 0 HD11 LEU A 388 -8.569 5.736 -0.571 1.00 0.22 H new ATOM 0 HD12 LEU A 388 -8.077 5.500 1.123 1.00 0.22 H new ATOM 0 HD13 LEU A 388 -7.495 4.386 -0.137 1.00 0.22 H new ATOM 0 HD21 LEU A 388 -10.160 4.201 -1.634 1.00 0.24 H new ATOM 0 HD22 LEU A 388 -9.138 2.800 -1.234 1.00 0.24 H new ATOM 0 HD23 LEU A 388 -10.842 2.833 -0.724 1.00 0.24 H new ATOM 1756 N VAL A 389 -10.062 5.538 3.624 1.00 0.26 N ATOM 1757 CA VAL A 389 -11.089 6.218 4.412 1.00 0.32 C ATOM 1758 C VAL A 389 -11.862 7.243 3.581 1.00 0.33 C ATOM 1759 O VAL A 389 -12.833 7.832 4.059 1.00 0.39 O ATOM 1760 CB VAL A 389 -10.487 6.913 5.657 1.00 0.39 C ATOM 1761 CG1 VAL A 389 -9.918 5.888 6.630 1.00 0.45 C ATOM 1762 CG2 VAL A 389 -9.420 7.924 5.259 1.00 0.40 C ATOM 0 H VAL A 389 -9.428 6.160 3.123 1.00 0.26 H new ATOM 0 HA VAL A 389 -11.782 5.444 4.741 1.00 0.32 H new ATOM 0 HB VAL A 389 -11.292 7.451 6.159 1.00 0.39 H new ATOM 0 HG11 VAL A 389 -9.501 6.401 7.496 1.00 0.45 H new ATOM 0 HG12 VAL A 389 -10.711 5.215 6.954 1.00 0.45 H new ATOM 0 HG13 VAL A 389 -9.134 5.314 6.136 1.00 0.45 H new ATOM 0 HG21 VAL A 389 -9.015 8.397 6.154 1.00 0.40 H new ATOM 0 HG22 VAL A 389 -8.619 7.415 4.723 1.00 0.40 H new ATOM 0 HG23 VAL A 389 -9.862 8.685 4.615 1.00 0.40 H new ATOM 1772 N SER A 390 -11.439 7.443 2.337 1.00 0.32 N ATOM 1773 CA SER A 390 -12.080 8.420 1.466 1.00 0.35 C ATOM 1774 C SER A 390 -11.660 8.220 0.015 1.00 0.31 C ATOM 1775 O SER A 390 -10.640 7.589 -0.261 1.00 0.26 O ATOM 1776 CB SER A 390 -11.728 9.835 1.930 1.00 0.43 C ATOM 1777 OG SER A 390 -10.337 9.956 2.162 1.00 1.32 O ATOM 0 H SER A 390 -10.658 6.943 1.911 1.00 0.32 H new ATOM 0 HA SER A 390 -13.159 8.279 1.525 1.00 0.35 H new ATOM 0 HB2 SER A 390 -12.040 10.558 1.176 1.00 0.43 H new ATOM 0 HB3 SER A 390 -12.275 10.070 2.843 1.00 0.43 H new ATOM 0 HG SER A 390 -10.133 10.868 2.456 1.00 1.32 H new ATOM 1783 N MET A 391 -12.464 8.747 -0.901 1.00 0.38 N ATOM 1784 CA MET A 391 -12.178 8.671 -2.325 1.00 0.37 C ATOM 1785 C MET A 391 -13.048 9.668 -3.081 1.00 0.49 C ATOM 1786 O MET A 391 -14.104 10.060 -2.585 1.00 0.56 O ATOM 1787 CB MET A 391 -12.436 7.250 -2.838 1.00 0.36 C ATOM 1788 CG MET A 391 -12.158 7.064 -4.318 1.00 0.41 C ATOM 1789 SD MET A 391 -12.628 5.430 -4.914 1.00 0.49 S ATOM 1790 CE MET A 391 -11.679 4.387 -3.814 1.00 0.44 C ATOM 0 H MET A 391 -13.330 9.237 -0.676 1.00 0.38 H new ATOM 0 HA MET A 391 -11.129 8.918 -2.491 1.00 0.37 H new ATOM 0 HB2 MET A 391 -11.817 6.554 -2.273 1.00 0.36 H new ATOM 0 HB3 MET A 391 -13.475 6.987 -2.639 1.00 0.36 H new ATOM 0 HG2 MET A 391 -12.700 7.822 -4.883 1.00 0.41 H new ATOM 0 HG3 MET A 391 -11.096 7.224 -4.507 1.00 0.41 H new ATOM 0 HE1 MET A 391 -11.981 3.348 -3.947 1.00 0.44 H new ATOM 0 HE2 MET A 391 -10.618 4.489 -4.042 1.00 0.44 H new ATOM 0 HE3 MET A 391 -11.859 4.688 -2.782 1.00 0.44 H new ATOM 1800 N LYS A 392 -12.578 10.071 -4.264 1.00 0.56 N ATOM 1801 CA LYS A 392 -13.318 10.940 -5.172 1.00 0.71 C ATOM 1802 C LYS A 392 -13.445 12.354 -4.617 1.00 1.63 C ATOM 1803 O LYS A 392 -14.470 12.660 -3.977 1.00 2.38 O ATOM 1804 CB LYS A 392 -14.692 10.349 -5.452 1.00 1.70 C ATOM 1805 CG LYS A 392 -14.649 9.025 -6.197 1.00 2.54 C ATOM 1806 CD LYS A 392 -14.096 9.175 -7.608 1.00 3.38 C ATOM 1807 CE LYS A 392 -15.044 9.946 -8.511 1.00 4.14 C ATOM 1808 NZ LYS A 392 -14.609 9.913 -9.935 1.00 4.91 N ATOM 1809 OXT LYS A 392 -12.515 13.153 -4.827 1.00 2.36 O ATOM 0 H LYS A 392 -11.662 9.798 -4.619 1.00 0.56 H new ATOM 0 HA LYS A 392 -12.761 11.006 -6.106 1.00 0.71 H new ATOM 0 HB2 LYS A 392 -15.216 10.207 -4.507 1.00 1.70 H new ATOM 0 HB3 LYS A 392 -15.273 11.064 -6.034 1.00 1.70 H new ATOM 0 HG2 LYS A 392 -14.034 8.317 -5.641 1.00 2.54 H new ATOM 0 HG3 LYS A 392 -15.654 8.605 -6.245 1.00 2.54 H new ATOM 0 HD2 LYS A 392 -13.135 9.688 -7.568 1.00 3.38 H new ATOM 0 HD3 LYS A 392 -13.913 8.188 -8.033 1.00 3.38 H new ATOM 0 HE2 LYS A 392 -16.046 9.525 -8.428 1.00 4.14 H new ATOM 0 HE3 LYS A 392 -15.104 10.981 -8.174 1.00 4.14 H new ATOM 0 HZ1 LYS A 392 -15.283 10.451 -10.516 1.00 4.91 H new ATOM 0 HZ2 LYS A 392 -13.663 10.338 -10.019 1.00 4.91 H new ATOM 0 HZ3 LYS A 392 -14.576 8.927 -10.265 1.00 4.91 H new