USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 478 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 307 HIS : no HD1:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 308 ASN : amide:sc= -5.83! C(o=-5.8!,f=-4.9!) USER MOD Single : A 311 SER OG : rot 180:sc= 0 USER MOD Single : A 313 SER OG : rot -92:sc= 1.19 USER MOD Single : A 314 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000361) USER MOD Single : A 316 TYR OH : rot 180:sc= 0 USER MOD Single : A 317 ASN : amide:sc=-0.00223 X(o=-0.0022,f=0) USER MOD Single : A 318 ASN : amide:sc= -0.623 K(o=-0.62,f=-1.5) USER MOD Single : A 320 THR OG1 : rot 180:sc= 0.0438 USER MOD Single : A 334 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0438) USER MOD Single : A 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 340 SER OG : rot 180:sc= -0.135 USER MOD Single : A 341 GLN : amide:sc= -1.34 K(o=-1.3,f=-3.1) USER MOD Single : A 342 MET CE :methyl -149:sc= -1.89 (180deg=-3.96!) USER MOD Single : A 344 THR OG1 : rot 180:sc= 0 USER MOD Single : A 348 MET CE :methyl -106:sc= -6.01! (180deg=-11!) USER MOD Single : A 349 ASN : amide:sc= -0.755 K(o=-0.75,f=-1.5) USER MOD Single : A 354 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 360 HIS : no HD1:sc= -0.813 X(o=-0.81,f=-0.76) USER MOD ----------------------------------------------------------------- ATOM 145 N ARG A 302 7.381 15.429 -6.574 1.00 0.00 N ATOM 146 CA ARG A 302 6.848 14.088 -6.741 1.00 0.00 C ATOM 147 C ARG A 302 7.978 13.058 -6.700 1.00 0.00 C ATOM 148 O ARG A 302 7.788 11.942 -6.219 1.00 0.00 O ATOM 149 CB ARG A 302 6.095 13.956 -8.067 1.00 0.00 C ATOM 150 CG ARG A 302 4.941 12.958 -7.945 1.00 0.00 C ATOM 151 CD ARG A 302 3.740 13.593 -7.241 1.00 0.00 C ATOM 152 NE ARG A 302 2.644 13.813 -8.211 1.00 0.00 N ATOM 153 CZ ARG A 302 1.501 14.450 -7.920 1.00 0.00 C ATOM 154 NH1 ARG A 302 1.298 14.933 -6.687 1.00 0.00 N ATOM 155 NH2 ARG A 302 0.562 14.604 -8.863 1.00 0.00 N ATOM 0 HA ARG A 302 6.154 13.903 -5.921 1.00 0.00 H new ATOM 0 HB2 ARG A 302 5.708 14.930 -8.368 1.00 0.00 H new ATOM 0 HB3 ARG A 302 6.781 13.630 -8.848 1.00 0.00 H new ATOM 0 HG2 ARG A 302 4.646 12.614 -8.937 1.00 0.00 H new ATOM 0 HG3 ARG A 302 5.271 12.081 -7.389 1.00 0.00 H new ATOM 0 HD2 ARG A 302 3.398 12.946 -6.433 1.00 0.00 H new ATOM 0 HD3 ARG A 302 4.032 14.541 -6.789 1.00 0.00 H new ATOM 0 HE ARG A 302 2.766 13.458 -9.159 1.00 0.00 H new ATOM 0 HH11 ARG A 302 2.013 14.816 -5.969 1.00 0.00 H new ATOM 0 HH12 ARG A 302 0.428 15.418 -6.466 1.00 0.00 H new ATOM 0 HH21 ARG A 302 0.717 14.237 -9.802 1.00 0.00 H new ATOM 0 HH22 ARG A 302 -0.308 15.089 -8.642 1.00 0.00 H new ATOM 169 N ALA A 303 9.130 13.469 -7.210 1.00 0.00 N ATOM 170 CA ALA A 303 10.291 12.596 -7.237 1.00 0.00 C ATOM 171 C ALA A 303 10.703 12.258 -5.803 1.00 0.00 C ATOM 172 O ALA A 303 11.195 11.162 -5.537 1.00 0.00 O ATOM 173 CB ALA A 303 11.417 13.269 -8.024 1.00 0.00 C ATOM 0 H ALA A 303 9.284 14.395 -7.608 1.00 0.00 H new ATOM 0 HA ALA A 303 10.055 11.659 -7.742 1.00 0.00 H new ATOM 0 HB1 ALA A 303 12.288 12.614 -8.044 1.00 0.00 H new ATOM 0 HB2 ALA A 303 11.084 13.461 -9.044 1.00 0.00 H new ATOM 0 HB3 ALA A 303 11.683 14.212 -7.545 1.00 0.00 H new ATOM 179 N VAL A 304 10.487 13.219 -4.917 1.00 0.00 N ATOM 180 CA VAL A 304 10.829 13.037 -3.517 1.00 0.00 C ATOM 181 C VAL A 304 9.856 12.040 -2.884 1.00 0.00 C ATOM 182 O VAL A 304 10.273 11.126 -2.174 1.00 0.00 O ATOM 183 CB VAL A 304 10.849 14.390 -2.802 1.00 0.00 C ATOM 184 CG1 VAL A 304 10.933 14.208 -1.286 1.00 0.00 C ATOM 185 CG2 VAL A 304 11.995 15.264 -3.314 1.00 0.00 C ATOM 0 H VAL A 304 10.079 14.126 -5.142 1.00 0.00 H new ATOM 0 HA VAL A 304 11.831 12.619 -3.420 1.00 0.00 H new ATOM 0 HB VAL A 304 9.913 14.901 -3.026 1.00 0.00 H new ATOM 0 HG11 VAL A 304 10.946 15.185 -0.802 1.00 0.00 H new ATOM 0 HG12 VAL A 304 10.068 13.643 -0.939 1.00 0.00 H new ATOM 0 HG13 VAL A 304 11.845 13.667 -1.035 1.00 0.00 H new ATOM 0 HG21 VAL A 304 11.986 16.219 -2.789 1.00 0.00 H new ATOM 0 HG22 VAL A 304 12.945 14.760 -3.135 1.00 0.00 H new ATOM 0 HG23 VAL A 304 11.872 15.436 -4.383 1.00 0.00 H new ATOM 195 N ILE A 305 8.578 12.251 -3.162 1.00 0.00 N ATOM 196 CA ILE A 305 7.543 11.383 -2.629 1.00 0.00 C ATOM 197 C ILE A 305 7.761 9.959 -3.145 1.00 0.00 C ATOM 198 O ILE A 305 7.648 8.996 -2.387 1.00 0.00 O ATOM 199 CB ILE A 305 6.156 11.946 -2.946 1.00 0.00 C ATOM 200 CG1 ILE A 305 5.943 13.297 -2.260 1.00 0.00 C ATOM 201 CG2 ILE A 305 5.061 10.940 -2.585 1.00 0.00 C ATOM 202 CD1 ILE A 305 5.211 14.272 -3.185 1.00 0.00 C ATOM 0 H ILE A 305 8.236 13.011 -3.750 1.00 0.00 H new ATOM 0 HA ILE A 305 7.604 11.341 -1.542 1.00 0.00 H new ATOM 0 HB ILE A 305 6.094 12.118 -4.021 1.00 0.00 H new ATOM 0 HG12 ILE A 305 5.368 13.157 -1.345 1.00 0.00 H new ATOM 0 HG13 ILE A 305 6.906 13.718 -1.971 1.00 0.00 H new ATOM 0 HG21 ILE A 305 4.085 11.365 -2.820 1.00 0.00 H new ATOM 0 HG22 ILE A 305 5.206 10.024 -3.158 1.00 0.00 H new ATOM 0 HG23 ILE A 305 5.111 10.714 -1.520 1.00 0.00 H new ATOM 0 HD11 ILE A 305 5.072 15.224 -2.673 1.00 0.00 H new ATOM 0 HD12 ILE A 305 5.800 14.428 -4.089 1.00 0.00 H new ATOM 0 HD13 ILE A 305 4.238 13.859 -3.453 1.00 0.00 H new ATOM 214 N GLU A 306 8.071 9.871 -4.430 1.00 0.00 N ATOM 215 CA GLU A 306 8.306 8.581 -5.056 1.00 0.00 C ATOM 216 C GLU A 306 9.437 7.841 -4.339 1.00 0.00 C ATOM 217 O GLU A 306 9.295 6.670 -3.990 1.00 0.00 O ATOM 218 CB GLU A 306 8.615 8.742 -6.546 1.00 0.00 C ATOM 219 CG GLU A 306 7.339 9.017 -7.343 1.00 0.00 C ATOM 220 CD GLU A 306 7.469 8.506 -8.780 1.00 0.00 C ATOM 221 OE1 GLU A 306 8.321 7.616 -8.990 1.00 0.00 O ATOM 222 OE2 GLU A 306 6.713 9.016 -9.634 1.00 0.00 O ATOM 0 H GLU A 306 8.165 10.672 -5.055 1.00 0.00 H new ATOM 0 HA GLU A 306 7.396 7.987 -4.969 1.00 0.00 H new ATOM 0 HB2 GLU A 306 9.321 9.560 -6.688 1.00 0.00 H new ATOM 0 HB3 GLU A 306 9.095 7.838 -6.921 1.00 0.00 H new ATOM 0 HG2 GLU A 306 6.491 8.534 -6.857 1.00 0.00 H new ATOM 0 HG3 GLU A 306 7.135 10.088 -7.351 1.00 0.00 H new ATOM 229 N HIS A 307 10.536 8.555 -4.140 1.00 0.00 N ATOM 230 CA HIS A 307 11.690 7.981 -3.470 1.00 0.00 C ATOM 231 C HIS A 307 11.353 7.716 -2.002 1.00 0.00 C ATOM 232 O HIS A 307 11.653 6.645 -1.476 1.00 0.00 O ATOM 233 CB HIS A 307 12.919 8.876 -3.644 1.00 0.00 C ATOM 234 CG HIS A 307 14.234 8.156 -3.462 1.00 0.00 C ATOM 235 ND1 HIS A 307 14.696 7.202 -4.351 1.00 0.00 N ATOM 236 CD2 HIS A 307 15.179 8.261 -2.484 1.00 0.00 C ATOM 237 CE1 HIS A 307 15.867 6.758 -3.918 1.00 0.00 C ATOM 238 NE2 HIS A 307 16.165 7.416 -2.761 1.00 0.00 N ATOM 0 H HIS A 307 10.651 9.526 -4.431 1.00 0.00 H new ATOM 0 HA HIS A 307 11.941 7.024 -3.927 1.00 0.00 H new ATOM 0 HB2 HIS A 307 12.894 9.320 -4.639 1.00 0.00 H new ATOM 0 HB3 HIS A 307 12.863 9.696 -2.928 1.00 0.00 H new ATOM 0 HD2 HIS A 307 15.133 8.920 -1.629 1.00 0.00 H new ATOM 0 HE1 HIS A 307 16.478 6.007 -4.397 1.00 0.00 H new ATOM 0 HE2 HIS A 307 17.007 7.281 -2.201 1.00 0.00 H new ATOM 246 N ASN A 308 10.734 8.710 -1.381 1.00 0.00 N ATOM 247 CA ASN A 308 10.353 8.598 0.016 1.00 0.00 C ATOM 248 C ASN A 308 9.489 7.349 0.206 1.00 0.00 C ATOM 249 O ASN A 308 9.619 6.647 1.207 1.00 0.00 O ATOM 250 CB ASN A 308 9.536 9.811 0.463 1.00 0.00 C ATOM 251 CG ASN A 308 10.383 11.085 0.433 1.00 0.00 C ATOM 252 OD1 ASN A 308 11.575 11.062 0.176 1.00 0.00 O ATOM 253 ND2 ASN A 308 9.703 12.194 0.710 1.00 0.00 N ATOM 0 H ASN A 308 10.487 9.597 -1.821 1.00 0.00 H new ATOM 0 HA ASN A 308 11.265 8.539 0.611 1.00 0.00 H new ATOM 0 HB2 ASN A 308 8.670 9.931 -0.188 1.00 0.00 H new ATOM 0 HB3 ASN A 308 9.156 9.646 1.471 1.00 0.00 H new ATOM 0 HD21 ASN A 308 10.179 13.096 0.716 1.00 0.00 H new ATOM 0 HD22 ASN A 308 8.705 12.142 0.917 1.00 0.00 H new ATOM 260 N LEU A 309 8.627 7.112 -0.771 1.00 0.00 N ATOM 261 CA LEU A 309 7.741 5.960 -0.724 1.00 0.00 C ATOM 262 C LEU A 309 8.577 4.679 -0.738 1.00 0.00 C ATOM 263 O LEU A 309 8.258 3.717 -0.041 1.00 0.00 O ATOM 264 CB LEU A 309 6.708 6.033 -1.850 1.00 0.00 C ATOM 265 CG LEU A 309 5.241 6.019 -1.415 1.00 0.00 C ATOM 266 CD1 LEU A 309 4.916 7.233 -0.543 1.00 0.00 C ATOM 267 CD2 LEU A 309 4.311 5.917 -2.627 1.00 0.00 C ATOM 0 H LEU A 309 8.523 7.697 -1.600 1.00 0.00 H new ATOM 0 HA LEU A 309 7.168 5.957 0.203 1.00 0.00 H new ATOM 0 HB2 LEU A 309 6.888 6.943 -2.423 1.00 0.00 H new ATOM 0 HB3 LEU A 309 6.875 5.193 -2.524 1.00 0.00 H new ATOM 0 HG LEU A 309 5.074 5.131 -0.805 1.00 0.00 H new ATOM 0 HD11 LEU A 309 3.867 7.199 -0.248 1.00 0.00 H new ATOM 0 HD12 LEU A 309 5.544 7.220 0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 309 5.104 8.147 -1.107 1.00 0.00 H new ATOM 0 HD21 LEU A 309 3.274 5.909 -2.290 1.00 0.00 H new ATOM 0 HD22 LEU A 309 4.473 6.772 -3.283 1.00 0.00 H new ATOM 0 HD23 LEU A 309 4.523 4.997 -3.172 1.00 0.00 H new ATOM 279 N LEU A 310 9.632 4.707 -1.540 1.00 0.00 N ATOM 280 CA LEU A 310 10.516 3.560 -1.654 1.00 0.00 C ATOM 281 C LEU A 310 11.374 3.455 -0.392 1.00 0.00 C ATOM 282 O LEU A 310 11.618 2.358 0.108 1.00 0.00 O ATOM 283 CB LEU A 310 11.330 3.638 -2.947 1.00 0.00 C ATOM 284 CG LEU A 310 10.610 3.191 -4.221 1.00 0.00 C ATOM 285 CD1 LEU A 310 11.520 3.331 -5.443 1.00 0.00 C ATOM 286 CD2 LEU A 310 10.064 1.770 -4.073 1.00 0.00 C ATOM 0 H LEU A 310 9.894 5.506 -2.117 1.00 0.00 H new ATOM 0 HA LEU A 310 9.938 2.639 -1.724 1.00 0.00 H new ATOM 0 HB2 LEU A 310 11.661 4.668 -3.083 1.00 0.00 H new ATOM 0 HB3 LEU A 310 12.225 3.028 -2.827 1.00 0.00 H new ATOM 0 HG LEU A 310 9.755 3.849 -4.379 1.00 0.00 H new ATOM 0 HD11 LEU A 310 10.984 3.007 -6.335 1.00 0.00 H new ATOM 0 HD12 LEU A 310 11.818 4.373 -5.557 1.00 0.00 H new ATOM 0 HD13 LEU A 310 12.408 2.713 -5.308 1.00 0.00 H new ATOM 0 HD21 LEU A 310 9.557 1.477 -4.993 1.00 0.00 H new ATOM 0 HD22 LEU A 310 10.887 1.083 -3.878 1.00 0.00 H new ATOM 0 HD23 LEU A 310 9.358 1.736 -3.243 1.00 0.00 H new ATOM 298 N SER A 311 11.809 4.611 0.087 1.00 0.00 N ATOM 299 CA SER A 311 12.635 4.664 1.281 1.00 0.00 C ATOM 300 C SER A 311 11.815 4.247 2.503 1.00 0.00 C ATOM 301 O SER A 311 12.283 3.468 3.333 1.00 0.00 O ATOM 302 CB SER A 311 13.219 6.063 1.486 1.00 0.00 C ATOM 303 OG SER A 311 14.233 6.363 0.531 1.00 0.00 O ATOM 0 H SER A 311 11.605 5.519 -0.331 1.00 0.00 H new ATOM 0 HA SER A 311 13.465 3.969 1.153 1.00 0.00 H new ATOM 0 HB2 SER A 311 12.422 6.803 1.413 1.00 0.00 H new ATOM 0 HB3 SER A 311 13.634 6.139 2.491 1.00 0.00 H new ATOM 0 HG SER A 311 14.579 7.265 0.694 1.00 0.00 H new ATOM 309 N ALA A 312 10.606 4.783 2.576 1.00 0.00 N ATOM 310 CA ALA A 312 9.716 4.476 3.683 1.00 0.00 C ATOM 311 C ALA A 312 9.346 2.992 3.638 1.00 0.00 C ATOM 312 O ALA A 312 8.961 2.414 4.653 1.00 0.00 O ATOM 313 CB ALA A 312 8.487 5.386 3.617 1.00 0.00 C ATOM 0 H ALA A 312 10.221 5.428 1.886 1.00 0.00 H new ATOM 0 HA ALA A 312 10.210 4.664 4.636 1.00 0.00 H new ATOM 0 HB1 ALA A 312 7.819 5.156 4.447 1.00 0.00 H new ATOM 0 HB2 ALA A 312 8.802 6.428 3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 312 7.964 5.223 2.675 1.00 0.00 H new ATOM 319 N SER A 313 9.476 2.418 2.451 1.00 0.00 N ATOM 320 CA SER A 313 9.161 1.013 2.261 1.00 0.00 C ATOM 321 C SER A 313 10.243 0.142 2.903 1.00 0.00 C ATOM 322 O SER A 313 9.938 -0.872 3.530 1.00 0.00 O ATOM 323 CB SER A 313 9.021 0.676 0.775 1.00 0.00 C ATOM 324 OG SER A 313 10.256 0.253 0.205 1.00 0.00 O ATOM 0 H SER A 313 9.795 2.901 1.611 1.00 0.00 H new ATOM 0 HA SER A 313 8.205 0.809 2.744 1.00 0.00 H new ATOM 0 HB2 SER A 313 8.276 -0.110 0.650 1.00 0.00 H new ATOM 0 HB3 SER A 313 8.655 1.551 0.238 1.00 0.00 H new ATOM 0 HG SER A 313 10.728 1.028 -0.166 1.00 0.00 H new ATOM 330 N LYS A 314 11.484 0.569 2.725 1.00 0.00 N ATOM 331 CA LYS A 314 12.613 -0.159 3.279 1.00 0.00 C ATOM 332 C LYS A 314 12.810 0.249 4.740 1.00 0.00 C ATOM 333 O LYS A 314 13.558 -0.396 5.473 1.00 0.00 O ATOM 334 CB LYS A 314 13.858 0.042 2.412 1.00 0.00 C ATOM 335 CG LYS A 314 13.640 -0.514 1.003 1.00 0.00 C ATOM 336 CD LYS A 314 14.171 0.454 -0.057 1.00 0.00 C ATOM 337 CE LYS A 314 14.148 -0.188 -1.445 1.00 0.00 C ATOM 338 NZ LYS A 314 14.488 0.811 -2.483 1.00 0.00 N ATOM 0 H LYS A 314 11.733 1.410 2.205 1.00 0.00 H new ATOM 0 HA LYS A 314 12.416 -1.231 3.270 1.00 0.00 H new ATOM 0 HB2 LYS A 314 14.098 1.104 2.355 1.00 0.00 H new ATOM 0 HB3 LYS A 314 14.712 -0.454 2.874 1.00 0.00 H new ATOM 0 HG2 LYS A 314 14.143 -1.476 0.906 1.00 0.00 H new ATOM 0 HG3 LYS A 314 12.577 -0.692 0.839 1.00 0.00 H new ATOM 0 HD2 LYS A 314 13.567 1.361 -0.062 1.00 0.00 H new ATOM 0 HD3 LYS A 314 15.189 0.751 0.194 1.00 0.00 H new ATOM 0 HE2 LYS A 314 14.857 -1.015 -1.482 1.00 0.00 H new ATOM 0 HE3 LYS A 314 13.161 -0.605 -1.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 314 14.451 0.363 -3.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 314 13.806 1.595 -2.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 314 15.446 1.177 -2.312 1.00 0.00 H new ATOM 352 N LEU A 315 12.125 1.318 5.120 1.00 0.00 N ATOM 353 CA LEU A 315 12.215 1.819 6.481 1.00 0.00 C ATOM 354 C LEU A 315 11.032 1.289 7.295 1.00 0.00 C ATOM 355 O LEU A 315 11.154 0.280 7.988 1.00 0.00 O ATOM 356 CB LEU A 315 12.328 3.345 6.484 1.00 0.00 C ATOM 357 CG LEU A 315 13.710 3.915 6.158 1.00 0.00 C ATOM 358 CD1 LEU A 315 13.602 5.098 5.193 1.00 0.00 C ATOM 359 CD2 LEU A 315 14.465 4.286 7.436 1.00 0.00 C ATOM 0 H LEU A 315 11.506 1.851 4.509 1.00 0.00 H new ATOM 0 HA LEU A 315 13.123 1.454 6.962 1.00 0.00 H new ATOM 0 HB2 LEU A 315 11.613 3.744 5.764 1.00 0.00 H new ATOM 0 HB3 LEU A 315 12.029 3.710 7.467 1.00 0.00 H new ATOM 0 HG LEU A 315 14.289 3.140 5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 315 14.598 5.484 4.978 1.00 0.00 H new ATOM 0 HD12 LEU A 315 13.132 4.770 4.266 1.00 0.00 H new ATOM 0 HD13 LEU A 315 12.998 5.884 5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 315 15.444 4.689 7.176 1.00 0.00 H new ATOM 0 HD22 LEU A 315 13.899 5.036 7.988 1.00 0.00 H new ATOM 0 HD23 LEU A 315 14.591 3.398 8.055 1.00 0.00 H new ATOM 371 N TYR A 316 9.915 1.993 7.183 1.00 0.00 N ATOM 372 CA TYR A 316 8.712 1.606 7.900 1.00 0.00 C ATOM 373 C TYR A 316 8.133 0.306 7.337 1.00 0.00 C ATOM 374 O TYR A 316 7.924 0.186 6.131 1.00 0.00 O ATOM 375 CB TYR A 316 7.706 2.737 7.676 1.00 0.00 C ATOM 376 CG TYR A 316 8.067 4.040 8.391 1.00 0.00 C ATOM 377 CD1 TYR A 316 8.951 4.925 7.808 1.00 0.00 C ATOM 378 CD2 TYR A 316 7.508 4.332 9.619 1.00 0.00 C ATOM 379 CE1 TYR A 316 9.290 6.153 8.480 1.00 0.00 C ATOM 380 CE2 TYR A 316 7.848 5.559 10.291 1.00 0.00 C ATOM 381 CZ TYR A 316 8.722 6.409 9.689 1.00 0.00 C ATOM 382 OH TYR A 316 9.043 7.568 10.324 1.00 0.00 O ATOM 0 H TYR A 316 9.818 2.829 6.607 1.00 0.00 H new ATOM 0 HA TYR A 316 8.930 1.443 8.955 1.00 0.00 H new ATOM 0 HB2 TYR A 316 7.625 2.931 6.607 1.00 0.00 H new ATOM 0 HB3 TYR A 316 6.724 2.408 8.015 1.00 0.00 H new ATOM 0 HD1 TYR A 316 9.389 4.697 6.847 1.00 0.00 H new ATOM 0 HD2 TYR A 316 6.816 3.640 10.076 1.00 0.00 H new ATOM 0 HE1 TYR A 316 9.979 6.855 8.034 1.00 0.00 H new ATOM 0 HE2 TYR A 316 7.418 5.799 11.252 1.00 0.00 H new ATOM 0 HH TYR A 316 8.562 7.618 11.176 1.00 0.00 H new ATOM 392 N ASN A 317 7.890 -0.635 8.238 1.00 0.00 N ATOM 393 CA ASN A 317 7.340 -1.921 7.847 1.00 0.00 C ATOM 394 C ASN A 317 5.896 -1.732 7.379 1.00 0.00 C ATOM 395 O ASN A 317 5.464 -2.363 6.415 1.00 0.00 O ATOM 396 CB ASN A 317 7.330 -2.897 9.025 1.00 0.00 C ATOM 397 CG ASN A 317 8.265 -4.080 8.765 1.00 0.00 C ATOM 398 OD1 ASN A 317 8.007 -4.938 7.936 1.00 0.00 O ATOM 399 ND2 ASN A 317 9.362 -4.078 9.516 1.00 0.00 N ATOM 0 H ASN A 317 8.064 -0.532 9.238 1.00 0.00 H new ATOM 0 HA ASN A 317 7.963 -2.325 7.049 1.00 0.00 H new ATOM 0 HB2 ASN A 317 7.637 -2.379 9.934 1.00 0.00 H new ATOM 0 HB3 ASN A 317 6.316 -3.260 9.192 1.00 0.00 H new ATOM 0 HD21 ASN A 317 10.049 -4.825 9.417 1.00 0.00 H new ATOM 0 HD22 ASN A 317 9.516 -3.329 10.191 1.00 0.00 H new ATOM 406 N ASN A 318 5.188 -0.860 8.082 1.00 0.00 N ATOM 407 CA ASN A 318 3.802 -0.580 7.750 1.00 0.00 C ATOM 408 C ASN A 318 3.460 0.851 8.171 1.00 0.00 C ATOM 409 O ASN A 318 3.816 1.281 9.268 1.00 0.00 O ATOM 410 CB ASN A 318 2.856 -1.529 8.489 1.00 0.00 C ATOM 411 CG ASN A 318 3.493 -2.042 9.782 1.00 0.00 C ATOM 412 OD1 ASN A 318 4.103 -3.097 9.827 1.00 0.00 O ATOM 413 ND2 ASN A 318 3.319 -1.238 10.827 1.00 0.00 N ATOM 0 H ASN A 318 5.549 -0.338 8.881 1.00 0.00 H new ATOM 0 HA ASN A 318 3.679 -0.713 6.675 1.00 0.00 H new ATOM 0 HB2 ASN A 318 1.924 -1.013 8.719 1.00 0.00 H new ATOM 0 HB3 ASN A 318 2.604 -2.371 7.845 1.00 0.00 H new ATOM 0 HD21 ASN A 318 3.707 -1.491 11.736 1.00 0.00 H new ATOM 0 HD22 ASN A 318 2.797 -0.368 10.720 1.00 0.00 H new ATOM 420 N ILE A 319 2.775 1.549 7.277 1.00 0.00 N ATOM 421 CA ILE A 319 2.382 2.922 7.542 1.00 0.00 C ATOM 422 C ILE A 319 1.035 3.201 6.872 1.00 0.00 C ATOM 423 O ILE A 319 0.737 2.647 5.815 1.00 0.00 O ATOM 424 CB ILE A 319 3.490 3.888 7.119 1.00 0.00 C ATOM 425 CG1 ILE A 319 3.219 5.299 7.646 1.00 0.00 C ATOM 426 CG2 ILE A 319 3.684 3.870 5.601 1.00 0.00 C ATOM 427 CD1 ILE A 319 4.442 6.199 7.457 1.00 0.00 C ATOM 0 H ILE A 319 2.482 1.189 6.369 1.00 0.00 H new ATOM 0 HA ILE A 319 2.245 3.079 8.612 1.00 0.00 H new ATOM 0 HB ILE A 319 4.425 3.552 7.567 1.00 0.00 H new ATOM 0 HG12 ILE A 319 2.363 5.728 7.124 1.00 0.00 H new ATOM 0 HG13 ILE A 319 2.957 5.252 8.703 1.00 0.00 H new ATOM 0 HG21 ILE A 319 4.477 4.566 5.327 1.00 0.00 H new ATOM 0 HG22 ILE A 319 3.957 2.864 5.281 1.00 0.00 H new ATOM 0 HG23 ILE A 319 2.756 4.167 5.112 1.00 0.00 H new ATOM 0 HD11 ILE A 319 4.223 7.196 7.840 1.00 0.00 H new ATOM 0 HD12 ILE A 319 5.289 5.780 8.000 1.00 0.00 H new ATOM 0 HD13 ILE A 319 4.686 6.263 6.397 1.00 0.00 H new ATOM 439 N THR A 320 0.256 4.059 7.515 1.00 0.00 N ATOM 440 CA THR A 320 -1.052 4.417 6.995 1.00 0.00 C ATOM 441 C THR A 320 -0.940 5.614 6.049 1.00 0.00 C ATOM 442 O THR A 320 0.055 6.337 6.072 1.00 0.00 O ATOM 443 CB THR A 320 -1.981 4.668 8.184 1.00 0.00 C ATOM 444 OG1 THR A 320 -1.526 5.905 8.726 1.00 0.00 O ATOM 445 CG2 THR A 320 -1.766 3.663 9.318 1.00 0.00 C ATOM 0 H THR A 320 0.506 4.517 8.392 1.00 0.00 H new ATOM 0 HA THR A 320 -1.475 3.609 6.398 1.00 0.00 H new ATOM 0 HB THR A 320 -3.018 4.622 7.850 1.00 0.00 H new ATOM 0 HG1 THR A 320 -2.075 6.144 9.501 1.00 0.00 H new ATOM 0 HG21 THR A 320 -2.450 3.886 10.137 1.00 0.00 H new ATOM 0 HG22 THR A 320 -1.956 2.654 8.951 1.00 0.00 H new ATOM 0 HG23 THR A 320 -0.738 3.732 9.675 1.00 0.00 H new ATOM 453 N PHE A 321 -1.974 5.786 5.238 1.00 0.00 N ATOM 454 CA PHE A 321 -2.004 6.883 4.286 1.00 0.00 C ATOM 455 C PHE A 321 -1.814 8.227 4.991 1.00 0.00 C ATOM 456 O PHE A 321 -1.140 9.115 4.471 1.00 0.00 O ATOM 457 CB PHE A 321 -3.382 6.860 3.620 1.00 0.00 C ATOM 458 CG PHE A 321 -3.758 5.506 3.015 1.00 0.00 C ATOM 459 CD1 PHE A 321 -2.966 4.942 2.064 1.00 0.00 C ATOM 460 CD2 PHE A 321 -4.884 4.865 3.428 1.00 0.00 C ATOM 461 CE1 PHE A 321 -3.315 3.686 1.502 1.00 0.00 C ATOM 462 CE2 PHE A 321 -5.233 3.609 2.867 1.00 0.00 C ATOM 463 CZ PHE A 321 -4.441 3.046 1.916 1.00 0.00 C ATOM 0 H PHE A 321 -2.797 5.184 5.221 1.00 0.00 H new ATOM 0 HA PHE A 321 -1.199 6.767 3.560 1.00 0.00 H new ATOM 0 HB2 PHE A 321 -4.135 7.139 4.357 1.00 0.00 H new ATOM 0 HB3 PHE A 321 -3.408 7.617 2.836 1.00 0.00 H new ATOM 0 HD1 PHE A 321 -2.071 5.450 1.736 1.00 0.00 H new ATOM 0 HD2 PHE A 321 -5.513 5.312 4.183 1.00 0.00 H new ATOM 0 HE1 PHE A 321 -2.686 3.239 0.746 1.00 0.00 H new ATOM 0 HE2 PHE A 321 -6.127 3.101 3.195 1.00 0.00 H new ATOM 0 HZ PHE A 321 -4.706 2.090 1.489 1.00 0.00 H new ATOM 473 N GLU A 322 -2.420 8.334 6.164 1.00 0.00 N ATOM 474 CA GLU A 322 -2.325 9.555 6.946 1.00 0.00 C ATOM 475 C GLU A 322 -0.869 9.832 7.325 1.00 0.00 C ATOM 476 O GLU A 322 -0.376 10.943 7.139 1.00 0.00 O ATOM 477 CB GLU A 322 -3.211 9.478 8.192 1.00 0.00 C ATOM 478 CG GLU A 322 -4.671 9.778 7.846 1.00 0.00 C ATOM 479 CD GLU A 322 -5.603 9.342 8.978 1.00 0.00 C ATOM 480 OE1 GLU A 322 -5.933 8.137 9.008 1.00 0.00 O ATOM 481 OE2 GLU A 322 -5.964 10.223 9.787 1.00 0.00 O ATOM 0 H GLU A 322 -2.979 7.596 6.592 1.00 0.00 H new ATOM 0 HA GLU A 322 -2.684 10.383 6.335 1.00 0.00 H new ATOM 0 HB2 GLU A 322 -3.135 8.485 8.636 1.00 0.00 H new ATOM 0 HB3 GLU A 322 -2.857 10.189 8.939 1.00 0.00 H new ATOM 0 HG2 GLU A 322 -4.793 10.845 7.661 1.00 0.00 H new ATOM 0 HG3 GLU A 322 -4.944 9.261 6.926 1.00 0.00 H new ATOM 488 N GLU A 323 -0.221 8.802 7.850 1.00 0.00 N ATOM 489 CA GLU A 323 1.169 8.920 8.256 1.00 0.00 C ATOM 490 C GLU A 323 2.075 9.011 7.027 1.00 0.00 C ATOM 491 O GLU A 323 2.991 9.831 6.986 1.00 0.00 O ATOM 492 CB GLU A 323 1.578 7.752 9.155 1.00 0.00 C ATOM 493 CG GLU A 323 1.113 7.978 10.595 1.00 0.00 C ATOM 494 CD GLU A 323 2.105 8.857 11.360 1.00 0.00 C ATOM 495 OE1 GLU A 323 3.209 8.347 11.649 1.00 0.00 O ATOM 496 OE2 GLU A 323 1.737 10.019 11.637 1.00 0.00 O ATOM 0 H GLU A 323 -0.633 7.882 8.003 1.00 0.00 H new ATOM 0 HA GLU A 323 1.282 9.837 8.834 1.00 0.00 H new ATOM 0 HB2 GLU A 323 1.149 6.826 8.772 1.00 0.00 H new ATOM 0 HB3 GLU A 323 2.661 7.634 9.133 1.00 0.00 H new ATOM 0 HG2 GLU A 323 0.130 8.449 10.594 1.00 0.00 H new ATOM 0 HG3 GLU A 323 1.006 7.019 11.101 1.00 0.00 H new ATOM 503 N LEU A 324 1.789 8.156 6.056 1.00 0.00 N ATOM 504 CA LEU A 324 2.567 8.130 4.829 1.00 0.00 C ATOM 505 C LEU A 324 2.531 9.514 4.178 1.00 0.00 C ATOM 506 O LEU A 324 3.553 10.005 3.700 1.00 0.00 O ATOM 507 CB LEU A 324 2.082 7.006 3.911 1.00 0.00 C ATOM 508 CG LEU A 324 2.984 6.677 2.720 1.00 0.00 C ATOM 509 CD1 LEU A 324 4.431 6.468 3.169 1.00 0.00 C ATOM 510 CD2 LEU A 324 2.446 5.474 1.941 1.00 0.00 C ATOM 0 H LEU A 324 1.029 7.476 6.094 1.00 0.00 H new ATOM 0 HA LEU A 324 3.612 7.906 5.045 1.00 0.00 H new ATOM 0 HB2 LEU A 324 1.959 6.103 4.509 1.00 0.00 H new ATOM 0 HB3 LEU A 324 1.096 7.274 3.532 1.00 0.00 H new ATOM 0 HG LEU A 324 2.978 7.530 2.041 1.00 0.00 H new ATOM 0 HD11 LEU A 324 5.051 6.235 2.303 1.00 0.00 H new ATOM 0 HD12 LEU A 324 4.799 7.377 3.645 1.00 0.00 H new ATOM 0 HD13 LEU A 324 4.476 5.643 3.879 1.00 0.00 H new ATOM 0 HD21 LEU A 324 3.105 5.261 1.100 1.00 0.00 H new ATOM 0 HD22 LEU A 324 2.403 4.605 2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 324 1.446 5.698 1.570 1.00 0.00 H new ATOM 522 N GLY A 325 1.345 10.103 4.179 1.00 0.00 N ATOM 523 CA GLY A 325 1.163 11.421 3.594 1.00 0.00 C ATOM 524 C GLY A 325 1.749 12.507 4.498 1.00 0.00 C ATOM 525 O GLY A 325 2.246 13.522 4.012 1.00 0.00 O ATOM 0 H GLY A 325 0.500 9.692 4.576 1.00 0.00 H new ATOM 0 HA2 GLY A 325 1.643 11.458 2.616 1.00 0.00 H new ATOM 0 HA3 GLY A 325 0.101 11.609 3.435 1.00 0.00 H new ATOM 529 N ALA A 326 1.671 12.257 5.796 1.00 0.00 N ATOM 530 CA ALA A 326 2.188 13.202 6.772 1.00 0.00 C ATOM 531 C ALA A 326 3.713 13.257 6.665 1.00 0.00 C ATOM 532 O ALA A 326 4.323 14.282 6.964 1.00 0.00 O ATOM 533 CB ALA A 326 1.716 12.800 8.171 1.00 0.00 C ATOM 0 H ALA A 326 1.258 11.414 6.195 1.00 0.00 H new ATOM 0 HA ALA A 326 1.808 14.204 6.574 1.00 0.00 H new ATOM 0 HB1 ALA A 326 2.103 13.508 8.903 1.00 0.00 H new ATOM 0 HB2 ALA A 326 0.626 12.805 8.203 1.00 0.00 H new ATOM 0 HB3 ALA A 326 2.081 11.800 8.405 1.00 0.00 H new ATOM 539 N LEU A 327 4.285 12.141 6.236 1.00 0.00 N ATOM 540 CA LEU A 327 5.727 12.050 6.085 1.00 0.00 C ATOM 541 C LEU A 327 6.153 12.805 4.824 1.00 0.00 C ATOM 542 O LEU A 327 7.155 13.518 4.832 1.00 0.00 O ATOM 543 CB LEU A 327 6.176 10.588 6.107 1.00 0.00 C ATOM 544 CG LEU A 327 7.308 10.219 5.146 1.00 0.00 C ATOM 545 CD1 LEU A 327 8.617 10.898 5.555 1.00 0.00 C ATOM 546 CD2 LEU A 327 7.460 8.701 5.034 1.00 0.00 C ATOM 0 H LEU A 327 3.776 11.293 5.988 1.00 0.00 H new ATOM 0 HA LEU A 327 6.229 12.527 6.927 1.00 0.00 H new ATOM 0 HB2 LEU A 327 6.492 10.341 7.121 1.00 0.00 H new ATOM 0 HB3 LEU A 327 5.314 9.961 5.880 1.00 0.00 H new ATOM 0 HG LEU A 327 7.049 10.590 4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 327 9.405 10.619 4.856 1.00 0.00 H new ATOM 0 HD12 LEU A 327 8.485 11.980 5.541 1.00 0.00 H new ATOM 0 HD13 LEU A 327 8.894 10.579 6.560 1.00 0.00 H new ATOM 0 HD21 LEU A 327 8.271 8.466 4.345 1.00 0.00 H new ATOM 0 HD22 LEU A 327 7.686 8.285 6.016 1.00 0.00 H new ATOM 0 HD23 LEU A 327 6.531 8.269 4.662 1.00 0.00 H new ATOM 558 N LEU A 328 5.369 12.623 3.772 1.00 0.00 N ATOM 559 CA LEU A 328 5.652 13.278 2.506 1.00 0.00 C ATOM 560 C LEU A 328 4.970 14.648 2.482 1.00 0.00 C ATOM 561 O LEU A 328 5.019 15.352 1.475 1.00 0.00 O ATOM 562 CB LEU A 328 5.260 12.375 1.335 1.00 0.00 C ATOM 563 CG LEU A 328 5.343 10.869 1.593 1.00 0.00 C ATOM 564 CD1 LEU A 328 4.051 10.168 1.169 1.00 0.00 C ATOM 565 CD2 LEU A 328 6.573 10.264 0.914 1.00 0.00 C ATOM 0 H LEU A 328 4.538 12.032 3.770 1.00 0.00 H new ATOM 0 HA LEU A 328 6.723 13.452 2.398 1.00 0.00 H new ATOM 0 HB2 LEU A 328 4.239 12.618 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 328 5.901 12.614 0.487 1.00 0.00 H new ATOM 0 HG LEU A 328 5.457 10.712 2.666 1.00 0.00 H new ATOM 0 HD11 LEU A 328 4.137 9.099 1.363 1.00 0.00 H new ATOM 0 HD12 LEU A 328 3.214 10.574 1.737 1.00 0.00 H new ATOM 0 HD13 LEU A 328 3.881 10.331 0.105 1.00 0.00 H new ATOM 0 HD21 LEU A 328 6.608 9.193 1.113 1.00 0.00 H new ATOM 0 HD22 LEU A 328 6.514 10.432 -0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 328 7.474 10.736 1.306 1.00 0.00 H new ATOM 577 N GLU A 329 4.349 14.984 3.603 1.00 0.00 N ATOM 578 CA GLU A 329 3.658 16.256 3.723 1.00 0.00 C ATOM 579 C GLU A 329 2.465 16.305 2.766 1.00 0.00 C ATOM 580 O GLU A 329 1.851 17.355 2.587 1.00 0.00 O ATOM 581 CB GLU A 329 4.612 17.425 3.469 1.00 0.00 C ATOM 582 CG GLU A 329 5.402 17.772 4.733 1.00 0.00 C ATOM 583 CD GLU A 329 4.619 18.743 5.620 1.00 0.00 C ATOM 584 OE1 GLU A 329 4.196 19.788 5.080 1.00 0.00 O ATOM 585 OE2 GLU A 329 4.461 18.417 6.816 1.00 0.00 O ATOM 0 H GLU A 329 4.310 14.397 4.436 1.00 0.00 H new ATOM 0 HA GLU A 329 3.285 16.349 4.743 1.00 0.00 H new ATOM 0 HB2 GLU A 329 5.301 17.169 2.664 1.00 0.00 H new ATOM 0 HB3 GLU A 329 4.046 18.296 3.139 1.00 0.00 H new ATOM 0 HG2 GLU A 329 5.622 16.861 5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 329 6.359 18.216 4.458 1.00 0.00 H new ATOM 592 N ILE A 330 2.174 15.155 2.175 1.00 0.00 N ATOM 593 CA ILE A 330 1.066 15.053 1.241 1.00 0.00 C ATOM 594 C ILE A 330 -0.120 14.378 1.934 1.00 0.00 C ATOM 595 O ILE A 330 0.043 13.746 2.977 1.00 0.00 O ATOM 596 CB ILE A 330 1.510 14.348 -0.042 1.00 0.00 C ATOM 597 CG1 ILE A 330 1.458 12.828 0.121 1.00 0.00 C ATOM 598 CG2 ILE A 330 2.894 14.830 -0.481 1.00 0.00 C ATOM 599 CD1 ILE A 330 1.804 12.123 -1.193 1.00 0.00 C ATOM 0 H ILE A 330 2.687 14.286 2.325 1.00 0.00 H new ATOM 0 HA ILE A 330 0.734 16.045 0.934 1.00 0.00 H new ATOM 0 HB ILE A 330 0.810 14.611 -0.836 1.00 0.00 H new ATOM 0 HG12 ILE A 330 2.156 12.518 0.899 1.00 0.00 H new ATOM 0 HG13 ILE A 330 0.462 12.528 0.448 1.00 0.00 H new ATOM 0 HG21 ILE A 330 3.186 14.313 -1.395 1.00 0.00 H new ATOM 0 HG22 ILE A 330 2.864 15.904 -0.665 1.00 0.00 H new ATOM 0 HG23 ILE A 330 3.620 14.617 0.304 1.00 0.00 H new ATOM 0 HD11 ILE A 330 1.760 11.043 -1.049 1.00 0.00 H new ATOM 0 HD12 ILE A 330 1.090 12.416 -1.962 1.00 0.00 H new ATOM 0 HD13 ILE A 330 2.809 12.407 -1.504 1.00 0.00 H new ATOM 611 N PRO A 331 -1.318 14.539 1.311 1.00 0.00 N ATOM 612 CA PRO A 331 -2.530 13.953 1.856 1.00 0.00 C ATOM 613 C PRO A 331 -2.567 12.443 1.612 1.00 0.00 C ATOM 614 O PRO A 331 -1.915 11.942 0.697 1.00 0.00 O ATOM 615 CB PRO A 331 -3.667 14.694 1.172 1.00 0.00 C ATOM 616 CG PRO A 331 -3.061 15.337 -0.065 1.00 0.00 C ATOM 617 CD PRO A 331 -1.549 15.281 0.074 1.00 0.00 C ATOM 0 HA PRO A 331 -2.598 14.058 2.939 1.00 0.00 H new ATOM 0 HB2 PRO A 331 -4.472 14.011 0.902 1.00 0.00 H new ATOM 0 HB3 PRO A 331 -4.096 15.447 1.833 1.00 0.00 H new ATOM 0 HG2 PRO A 331 -3.381 14.811 -0.964 1.00 0.00 H new ATOM 0 HG3 PRO A 331 -3.397 16.369 -0.162 1.00 0.00 H new ATOM 0 HD2 PRO A 331 -1.091 14.781 -0.779 1.00 0.00 H new ATOM 0 HD3 PRO A 331 -1.119 16.281 0.126 1.00 0.00 H new ATOM 625 N ALA A 332 -3.337 11.760 2.446 1.00 0.00 N ATOM 626 CA ALA A 332 -3.467 10.317 2.333 1.00 0.00 C ATOM 627 C ALA A 332 -3.996 9.965 0.941 1.00 0.00 C ATOM 628 O ALA A 332 -3.643 8.927 0.383 1.00 0.00 O ATOM 629 CB ALA A 332 -4.375 9.797 3.449 1.00 0.00 C ATOM 0 H ALA A 332 -3.877 12.179 3.203 1.00 0.00 H new ATOM 0 HA ALA A 332 -2.497 9.834 2.450 1.00 0.00 H new ATOM 0 HB1 ALA A 332 -4.472 8.715 3.364 1.00 0.00 H new ATOM 0 HB2 ALA A 332 -3.941 10.048 4.417 1.00 0.00 H new ATOM 0 HB3 ALA A 332 -5.359 10.258 3.362 1.00 0.00 H new ATOM 635 N ALA A 333 -4.833 10.850 0.420 1.00 0.00 N ATOM 636 CA ALA A 333 -5.414 10.646 -0.897 1.00 0.00 C ATOM 637 C ALA A 333 -4.300 10.648 -1.946 1.00 0.00 C ATOM 638 O ALA A 333 -4.334 9.865 -2.894 1.00 0.00 O ATOM 639 CB ALA A 333 -6.468 11.723 -1.163 1.00 0.00 C ATOM 0 H ALA A 333 -5.123 11.710 0.886 1.00 0.00 H new ATOM 0 HA ALA A 333 -5.916 9.680 -0.950 1.00 0.00 H new ATOM 0 HB1 ALA A 333 -6.903 11.570 -2.150 1.00 0.00 H new ATOM 0 HB2 ALA A 333 -7.251 11.660 -0.407 1.00 0.00 H new ATOM 0 HB3 ALA A 333 -6.001 12.707 -1.121 1.00 0.00 H new ATOM 645 N LYS A 334 -3.339 11.537 -1.741 1.00 0.00 N ATOM 646 CA LYS A 334 -2.218 11.651 -2.658 1.00 0.00 C ATOM 647 C LYS A 334 -1.260 10.479 -2.434 1.00 0.00 C ATOM 648 O LYS A 334 -0.836 9.828 -3.387 1.00 0.00 O ATOM 649 CB LYS A 334 -1.553 13.023 -2.524 1.00 0.00 C ATOM 650 CG LYS A 334 -0.802 13.396 -3.803 1.00 0.00 C ATOM 651 CD LYS A 334 -1.375 14.672 -4.423 1.00 0.00 C ATOM 652 CE LYS A 334 -0.720 15.916 -3.821 1.00 0.00 C ATOM 653 NZ LYS A 334 -1.731 16.759 -3.144 1.00 0.00 N ATOM 0 H LYS A 334 -3.314 12.185 -0.954 1.00 0.00 H new ATOM 0 HA LYS A 334 -2.563 11.589 -3.690 1.00 0.00 H new ATOM 0 HB2 LYS A 334 -2.309 13.778 -2.309 1.00 0.00 H new ATOM 0 HB3 LYS A 334 -0.862 13.015 -1.681 1.00 0.00 H new ATOM 0 HG2 LYS A 334 0.255 13.539 -3.580 1.00 0.00 H new ATOM 0 HG3 LYS A 334 -0.868 12.578 -4.520 1.00 0.00 H new ATOM 0 HD2 LYS A 334 -1.217 14.659 -5.501 1.00 0.00 H new ATOM 0 HD3 LYS A 334 -2.452 14.708 -4.259 1.00 0.00 H new ATOM 0 HE2 LYS A 334 0.051 15.620 -3.109 1.00 0.00 H new ATOM 0 HE3 LYS A 334 -0.226 16.490 -4.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 334 -1.253 17.505 -2.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 334 -2.353 17.194 -3.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 334 -2.299 16.171 -2.501 1.00 0.00 H new ATOM 667 N ALA A 335 -0.947 10.246 -1.167 1.00 0.00 N ATOM 668 CA ALA A 335 -0.047 9.165 -0.806 1.00 0.00 C ATOM 669 C ALA A 335 -0.686 7.827 -1.185 1.00 0.00 C ATOM 670 O ALA A 335 0.015 6.870 -1.509 1.00 0.00 O ATOM 671 CB ALA A 335 0.283 9.251 0.686 1.00 0.00 C ATOM 0 H ALA A 335 -1.301 10.788 -0.379 1.00 0.00 H new ATOM 0 HA ALA A 335 0.892 9.249 -1.353 1.00 0.00 H new ATOM 0 HB1 ALA A 335 0.959 8.439 0.957 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.761 10.207 0.898 1.00 0.00 H new ATOM 0 HB3 ALA A 335 -0.635 9.168 1.267 1.00 0.00 H new ATOM 677 N GLU A 336 -2.009 7.804 -1.131 1.00 0.00 N ATOM 678 CA GLU A 336 -2.751 6.600 -1.464 1.00 0.00 C ATOM 679 C GLU A 336 -2.678 6.331 -2.969 1.00 0.00 C ATOM 680 O GLU A 336 -2.415 5.206 -3.390 1.00 0.00 O ATOM 681 CB GLU A 336 -4.204 6.703 -0.996 1.00 0.00 C ATOM 682 CG GLU A 336 -4.995 5.452 -1.384 1.00 0.00 C ATOM 683 CD GLU A 336 -6.462 5.793 -1.653 1.00 0.00 C ATOM 684 OE1 GLU A 336 -6.691 6.811 -2.342 1.00 0.00 O ATOM 685 OE2 GLU A 336 -7.322 5.028 -1.165 1.00 0.00 O ATOM 0 H GLU A 336 -2.587 8.600 -0.862 1.00 0.00 H new ATOM 0 HA GLU A 336 -2.294 5.760 -0.941 1.00 0.00 H new ATOM 0 HB2 GLU A 336 -4.233 6.835 0.086 1.00 0.00 H new ATOM 0 HB3 GLU A 336 -4.670 7.584 -1.437 1.00 0.00 H new ATOM 0 HG2 GLU A 336 -4.554 5.000 -2.272 1.00 0.00 H new ATOM 0 HG3 GLU A 336 -4.930 4.714 -0.585 1.00 0.00 H new ATOM 692 N LYS A 337 -2.916 7.383 -3.738 1.00 0.00 N ATOM 693 CA LYS A 337 -2.880 7.275 -5.186 1.00 0.00 C ATOM 694 C LYS A 337 -1.448 6.981 -5.637 1.00 0.00 C ATOM 695 O LYS A 337 -1.223 6.107 -6.473 1.00 0.00 O ATOM 696 CB LYS A 337 -3.483 8.524 -5.832 1.00 0.00 C ATOM 697 CG LYS A 337 -3.053 8.647 -7.295 1.00 0.00 C ATOM 698 CD LYS A 337 -3.718 7.570 -8.155 1.00 0.00 C ATOM 699 CE LYS A 337 -5.219 7.832 -8.299 1.00 0.00 C ATOM 700 NZ LYS A 337 -5.719 7.287 -9.581 1.00 0.00 N ATOM 0 H LYS A 337 -3.135 8.315 -3.385 1.00 0.00 H new ATOM 0 HA LYS A 337 -3.497 6.441 -5.520 1.00 0.00 H new ATOM 0 HB2 LYS A 337 -4.570 8.480 -5.771 1.00 0.00 H new ATOM 0 HB3 LYS A 337 -3.169 9.410 -5.281 1.00 0.00 H new ATOM 0 HG2 LYS A 337 -3.318 9.634 -7.674 1.00 0.00 H new ATOM 0 HG3 LYS A 337 -1.969 8.558 -7.368 1.00 0.00 H new ATOM 0 HD2 LYS A 337 -3.253 7.548 -9.141 1.00 0.00 H new ATOM 0 HD3 LYS A 337 -3.558 6.590 -7.705 1.00 0.00 H new ATOM 0 HE2 LYS A 337 -5.756 7.374 -7.468 1.00 0.00 H new ATOM 0 HE3 LYS A 337 -5.413 8.903 -8.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 337 -6.739 7.473 -9.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 337 -5.219 7.743 -10.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 337 -5.551 6.261 -9.611 1.00 0.00 H new ATOM 714 N ILE A 338 -0.516 7.728 -5.062 1.00 0.00 N ATOM 715 CA ILE A 338 0.889 7.558 -5.394 1.00 0.00 C ATOM 716 C ILE A 338 1.348 6.166 -4.953 1.00 0.00 C ATOM 717 O ILE A 338 1.995 5.452 -5.717 1.00 0.00 O ATOM 718 CB ILE A 338 1.721 8.696 -4.800 1.00 0.00 C ATOM 719 CG1 ILE A 338 1.289 10.048 -5.374 1.00 0.00 C ATOM 720 CG2 ILE A 338 3.217 8.442 -4.996 1.00 0.00 C ATOM 721 CD1 ILE A 338 2.016 11.198 -4.674 1.00 0.00 C ATOM 0 H ILE A 338 -0.706 8.452 -4.369 1.00 0.00 H new ATOM 0 HA ILE A 338 1.035 7.616 -6.473 1.00 0.00 H new ATOM 0 HB ILE A 338 1.538 8.728 -3.726 1.00 0.00 H new ATOM 0 HG12 ILE A 338 1.499 10.077 -6.443 1.00 0.00 H new ATOM 0 HG13 ILE A 338 0.212 10.169 -5.258 1.00 0.00 H new ATOM 0 HG21 ILE A 338 3.786 9.266 -4.565 1.00 0.00 H new ATOM 0 HG22 ILE A 338 3.496 7.511 -4.502 1.00 0.00 H new ATOM 0 HG23 ILE A 338 3.437 8.368 -6.061 1.00 0.00 H new ATOM 0 HD11 ILE A 338 1.691 12.147 -5.100 1.00 0.00 H new ATOM 0 HD12 ILE A 338 1.784 11.180 -3.609 1.00 0.00 H new ATOM 0 HD13 ILE A 338 3.091 11.087 -4.813 1.00 0.00 H new ATOM 733 N ALA A 339 0.994 5.823 -3.724 1.00 0.00 N ATOM 734 CA ALA A 339 1.362 4.530 -3.172 1.00 0.00 C ATOM 735 C ALA A 339 0.831 3.422 -4.084 1.00 0.00 C ATOM 736 O ALA A 339 1.532 2.450 -4.359 1.00 0.00 O ATOM 737 CB ALA A 339 0.829 4.414 -1.743 1.00 0.00 C ATOM 0 H ALA A 339 0.456 6.418 -3.094 1.00 0.00 H new ATOM 0 HA ALA A 339 2.446 4.427 -3.124 1.00 0.00 H new ATOM 0 HB1 ALA A 339 1.105 3.444 -1.329 1.00 0.00 H new ATOM 0 HB2 ALA A 339 1.258 5.206 -1.129 1.00 0.00 H new ATOM 0 HB3 ALA A 339 -0.257 4.509 -1.751 1.00 0.00 H new ATOM 743 N SER A 340 -0.404 3.607 -4.529 1.00 0.00 N ATOM 744 CA SER A 340 -1.037 2.635 -5.404 1.00 0.00 C ATOM 745 C SER A 340 -0.393 2.682 -6.791 1.00 0.00 C ATOM 746 O SER A 340 -0.052 1.644 -7.357 1.00 0.00 O ATOM 747 CB SER A 340 -2.543 2.887 -5.509 1.00 0.00 C ATOM 748 OG SER A 340 -2.888 3.562 -6.716 1.00 0.00 O ATOM 0 H SER A 340 -0.982 4.415 -4.300 1.00 0.00 H new ATOM 0 HA SER A 340 -0.891 1.643 -4.976 1.00 0.00 H new ATOM 0 HB2 SER A 340 -3.074 1.936 -5.461 1.00 0.00 H new ATOM 0 HB3 SER A 340 -2.872 3.480 -4.655 1.00 0.00 H new ATOM 0 HG SER A 340 -3.857 3.703 -6.746 1.00 0.00 H new ATOM 754 N GLN A 341 -0.246 3.897 -7.299 1.00 0.00 N ATOM 755 CA GLN A 341 0.351 4.093 -8.609 1.00 0.00 C ATOM 756 C GLN A 341 1.774 3.531 -8.633 1.00 0.00 C ATOM 757 O GLN A 341 2.198 2.947 -9.629 1.00 0.00 O ATOM 758 CB GLN A 341 0.339 5.571 -9.002 1.00 0.00 C ATOM 759 CG GLN A 341 -0.798 5.869 -9.981 1.00 0.00 C ATOM 760 CD GLN A 341 -0.961 7.376 -10.191 1.00 0.00 C ATOM 761 OE1 GLN A 341 -0.626 8.187 -9.343 1.00 0.00 O ATOM 762 NE2 GLN A 341 -1.492 7.705 -11.365 1.00 0.00 N ATOM 0 H GLN A 341 -0.530 4.755 -6.827 1.00 0.00 H new ATOM 0 HA GLN A 341 -0.246 3.551 -9.343 1.00 0.00 H new ATOM 0 HB2 GLN A 341 0.226 6.187 -8.110 1.00 0.00 H new ATOM 0 HB3 GLN A 341 1.294 5.838 -9.456 1.00 0.00 H new ATOM 0 HG2 GLN A 341 -0.596 5.385 -10.937 1.00 0.00 H new ATOM 0 HG3 GLN A 341 -1.729 5.448 -9.601 1.00 0.00 H new ATOM 0 HE21 GLN A 341 -1.750 6.976 -12.030 1.00 0.00 H new ATOM 0 HE22 GLN A 341 -1.641 8.686 -11.600 1.00 0.00 H new ATOM 771 N MET A 342 2.473 3.727 -7.525 1.00 0.00 N ATOM 772 CA MET A 342 3.839 3.248 -7.406 1.00 0.00 C ATOM 773 C MET A 342 3.895 1.721 -7.501 1.00 0.00 C ATOM 774 O MET A 342 4.774 1.168 -8.159 1.00 0.00 O ATOM 775 CB MET A 342 4.424 3.698 -6.066 1.00 0.00 C ATOM 776 CG MET A 342 4.695 5.204 -6.064 1.00 0.00 C ATOM 777 SD MET A 342 6.343 5.528 -6.667 1.00 0.00 S ATOM 778 CE MET A 342 7.295 4.575 -5.496 1.00 0.00 C ATOM 0 H MET A 342 2.118 4.212 -6.701 1.00 0.00 H new ATOM 0 HA MET A 342 4.423 3.666 -8.226 1.00 0.00 H new ATOM 0 HB2 MET A 342 3.733 3.448 -5.261 1.00 0.00 H new ATOM 0 HB3 MET A 342 5.350 3.158 -5.870 1.00 0.00 H new ATOM 0 HG2 MET A 342 3.963 5.714 -6.690 1.00 0.00 H new ATOM 0 HG3 MET A 342 4.584 5.601 -5.055 1.00 0.00 H new ATOM 0 HE1 MET A 342 8.265 5.049 -5.344 1.00 0.00 H new ATOM 0 HE2 MET A 342 6.762 4.528 -4.546 1.00 0.00 H new ATOM 0 HE3 MET A 342 7.440 3.566 -5.881 1.00 0.00 H new ATOM 788 N ILE A 343 2.944 1.084 -6.833 1.00 0.00 N ATOM 789 CA ILE A 343 2.873 -0.367 -6.834 1.00 0.00 C ATOM 790 C ILE A 343 2.505 -0.855 -8.237 1.00 0.00 C ATOM 791 O ILE A 343 3.007 -1.881 -8.693 1.00 0.00 O ATOM 792 CB ILE A 343 1.920 -0.858 -5.742 1.00 0.00 C ATOM 793 CG1 ILE A 343 2.584 -0.792 -4.365 1.00 0.00 C ATOM 794 CG2 ILE A 343 1.397 -2.260 -6.060 1.00 0.00 C ATOM 795 CD1 ILE A 343 1.573 -1.087 -3.255 1.00 0.00 C ATOM 0 H ILE A 343 2.217 1.546 -6.288 1.00 0.00 H new ATOM 0 HA ILE A 343 3.845 -0.796 -6.592 1.00 0.00 H new ATOM 0 HB ILE A 343 1.058 -0.192 -5.716 1.00 0.00 H new ATOM 0 HG12 ILE A 343 3.402 -1.510 -4.317 1.00 0.00 H new ATOM 0 HG13 ILE A 343 3.018 0.196 -4.213 1.00 0.00 H new ATOM 0 HG21 ILE A 343 0.722 -2.585 -5.268 1.00 0.00 H new ATOM 0 HG22 ILE A 343 0.861 -2.242 -7.009 1.00 0.00 H new ATOM 0 HG23 ILE A 343 2.235 -2.954 -6.130 1.00 0.00 H new ATOM 0 HD11 ILE A 343 2.070 -1.034 -2.286 1.00 0.00 H new ATOM 0 HD12 ILE A 343 0.769 -0.352 -3.291 1.00 0.00 H new ATOM 0 HD13 ILE A 343 1.159 -2.085 -3.396 1.00 0.00 H new ATOM 807 N THR A 344 1.631 -0.096 -8.882 1.00 0.00 N ATOM 808 CA THR A 344 1.190 -0.438 -10.223 1.00 0.00 C ATOM 809 C THR A 344 2.310 -0.185 -11.234 1.00 0.00 C ATOM 810 O THR A 344 2.362 -0.827 -12.282 1.00 0.00 O ATOM 811 CB THR A 344 -0.086 0.354 -10.518 1.00 0.00 C ATOM 812 OG1 THR A 344 -1.122 -0.423 -9.924 1.00 0.00 O ATOM 813 CG2 THR A 344 -0.436 0.367 -12.007 1.00 0.00 C ATOM 0 H THR A 344 1.217 0.754 -8.501 1.00 0.00 H new ATOM 0 HA THR A 344 0.956 -1.500 -10.304 1.00 0.00 H new ATOM 0 HB THR A 344 0.033 1.378 -10.165 1.00 0.00 H new ATOM 0 HG1 THR A 344 -1.985 0.019 -10.066 1.00 0.00 H new ATOM 0 HG21 THR A 344 -1.349 0.942 -12.161 1.00 0.00 H new ATOM 0 HG22 THR A 344 0.379 0.823 -12.568 1.00 0.00 H new ATOM 0 HG23 THR A 344 -0.588 -0.655 -12.354 1.00 0.00 H new ATOM 821 N GLU A 345 3.178 0.752 -10.884 1.00 0.00 N ATOM 822 CA GLU A 345 4.294 1.098 -11.748 1.00 0.00 C ATOM 823 C GLU A 345 5.454 0.124 -11.532 1.00 0.00 C ATOM 824 O GLU A 345 6.431 0.141 -12.280 1.00 0.00 O ATOM 825 CB GLU A 345 4.741 2.543 -11.514 1.00 0.00 C ATOM 826 CG GLU A 345 3.878 3.520 -12.316 1.00 0.00 C ATOM 827 CD GLU A 345 4.745 4.413 -13.206 1.00 0.00 C ATOM 828 OE1 GLU A 345 5.626 3.849 -13.890 1.00 0.00 O ATOM 829 OE2 GLU A 345 4.506 5.640 -13.183 1.00 0.00 O ATOM 0 H GLU A 345 3.131 1.283 -10.014 1.00 0.00 H new ATOM 0 HA GLU A 345 3.965 1.017 -12.784 1.00 0.00 H new ATOM 0 HB2 GLU A 345 4.675 2.781 -10.452 1.00 0.00 H new ATOM 0 HB3 GLU A 345 5.786 2.655 -11.801 1.00 0.00 H new ATOM 0 HG2 GLU A 345 3.170 2.965 -12.931 1.00 0.00 H new ATOM 0 HG3 GLU A 345 3.293 4.138 -11.635 1.00 0.00 H new ATOM 836 N GLY A 346 5.309 -0.702 -10.506 1.00 0.00 N ATOM 837 CA GLY A 346 6.332 -1.681 -10.183 1.00 0.00 C ATOM 838 C GLY A 346 7.358 -1.100 -9.207 1.00 0.00 C ATOM 839 O GLY A 346 7.940 -1.830 -8.406 1.00 0.00 O ATOM 0 H GLY A 346 4.498 -0.713 -9.888 1.00 0.00 H new ATOM 0 HA2 GLY A 346 5.869 -2.565 -9.746 1.00 0.00 H new ATOM 0 HA3 GLY A 346 6.834 -2.002 -11.096 1.00 0.00 H new ATOM 843 N ARG A 347 7.547 0.207 -9.306 1.00 0.00 N ATOM 844 CA ARG A 347 8.493 0.894 -8.443 1.00 0.00 C ATOM 845 C ARG A 347 8.429 0.322 -7.025 1.00 0.00 C ATOM 846 O ARG A 347 9.452 -0.064 -6.461 1.00 0.00 O ATOM 847 CB ARG A 347 8.202 2.395 -8.392 1.00 0.00 C ATOM 848 CG ARG A 347 8.539 3.064 -9.727 1.00 0.00 C ATOM 849 CD ARG A 347 8.882 4.542 -9.529 1.00 0.00 C ATOM 850 NE ARG A 347 8.540 5.308 -10.748 1.00 0.00 N ATOM 851 CZ ARG A 347 7.298 5.697 -11.067 1.00 0.00 C ATOM 852 NH1 ARG A 347 6.273 5.394 -10.259 1.00 0.00 N ATOM 853 NH2 ARG A 347 7.082 6.390 -12.193 1.00 0.00 N ATOM 0 H ARG A 347 7.061 0.809 -9.971 1.00 0.00 H new ATOM 0 HA ARG A 347 9.490 0.742 -8.856 1.00 0.00 H new ATOM 0 HB2 ARG A 347 7.151 2.558 -8.155 1.00 0.00 H new ATOM 0 HB3 ARG A 347 8.784 2.855 -7.593 1.00 0.00 H new ATOM 0 HG2 ARG A 347 9.381 2.551 -10.193 1.00 0.00 H new ATOM 0 HG3 ARG A 347 7.693 2.971 -10.408 1.00 0.00 H new ATOM 0 HD2 ARG A 347 8.335 4.940 -8.674 1.00 0.00 H new ATOM 0 HD3 ARG A 347 9.944 4.651 -9.307 1.00 0.00 H new ATOM 0 HE ARG A 347 9.297 5.555 -11.385 1.00 0.00 H new ATOM 0 HH11 ARG A 347 6.438 4.867 -9.401 1.00 0.00 H new ATOM 0 HH12 ARG A 347 5.328 5.690 -10.502 1.00 0.00 H new ATOM 0 HH21 ARG A 347 7.863 6.621 -12.807 1.00 0.00 H new ATOM 0 HH22 ARG A 347 6.137 6.686 -12.436 1.00 0.00 H new ATOM 867 N MET A 348 7.217 0.284 -6.490 1.00 0.00 N ATOM 868 CA MET A 348 7.007 -0.234 -5.149 1.00 0.00 C ATOM 869 C MET A 348 6.843 -1.756 -5.169 1.00 0.00 C ATOM 870 O MET A 348 6.797 -2.364 -6.237 1.00 0.00 O ATOM 871 CB MET A 348 5.756 0.406 -4.544 1.00 0.00 C ATOM 872 CG MET A 348 5.943 0.670 -3.049 1.00 0.00 C ATOM 873 SD MET A 348 4.929 2.048 -2.541 1.00 0.00 S ATOM 874 CE MET A 348 3.441 1.181 -2.071 1.00 0.00 C ATOM 0 H MET A 348 6.371 0.604 -6.961 1.00 0.00 H new ATOM 0 HA MET A 348 7.880 0.011 -4.544 1.00 0.00 H new ATOM 0 HB2 MET A 348 5.538 1.342 -5.058 1.00 0.00 H new ATOM 0 HB3 MET A 348 4.898 -0.249 -4.697 1.00 0.00 H new ATOM 0 HG2 MET A 348 5.675 -0.219 -2.478 1.00 0.00 H new ATOM 0 HG3 MET A 348 6.991 0.881 -2.837 1.00 0.00 H new ATOM 0 HE1 MET A 348 2.673 1.338 -2.829 1.00 0.00 H new ATOM 0 HE2 MET A 348 3.653 0.115 -1.985 1.00 0.00 H new ATOM 0 HE3 MET A 348 3.087 1.559 -1.112 1.00 0.00 H new ATOM 884 N ASN A 349 6.760 -2.325 -3.976 1.00 0.00 N ATOM 885 CA ASN A 349 6.602 -3.764 -3.843 1.00 0.00 C ATOM 886 C ASN A 349 5.721 -4.066 -2.629 1.00 0.00 C ATOM 887 O ASN A 349 6.109 -3.795 -1.494 1.00 0.00 O ATOM 888 CB ASN A 349 7.954 -4.448 -3.629 1.00 0.00 C ATOM 889 CG ASN A 349 8.930 -3.519 -2.905 1.00 0.00 C ATOM 890 OD1 ASN A 349 10.016 -3.228 -3.377 1.00 0.00 O ATOM 891 ND2 ASN A 349 8.484 -3.073 -1.734 1.00 0.00 N ATOM 0 H ASN A 349 6.799 -1.816 -3.093 1.00 0.00 H new ATOM 0 HA ASN A 349 6.148 -4.140 -4.760 1.00 0.00 H new ATOM 0 HB2 ASN A 349 7.816 -5.360 -3.048 1.00 0.00 H new ATOM 0 HB3 ASN A 349 8.373 -4.743 -4.591 1.00 0.00 H new ATOM 0 HD21 ASN A 349 9.062 -2.448 -1.173 1.00 0.00 H new ATOM 0 HD22 ASN A 349 7.564 -3.356 -1.397 1.00 0.00 H new ATOM 898 N GLY A 350 4.553 -4.623 -2.910 1.00 0.00 N ATOM 899 CA GLY A 350 3.614 -4.965 -1.856 1.00 0.00 C ATOM 900 C GLY A 350 2.173 -4.695 -2.295 1.00 0.00 C ATOM 901 O GLY A 350 1.874 -4.693 -3.488 1.00 0.00 O ATOM 0 H GLY A 350 4.235 -4.846 -3.853 1.00 0.00 H new ATOM 0 HA2 GLY A 350 3.726 -6.016 -1.591 1.00 0.00 H new ATOM 0 HA3 GLY A 350 3.840 -4.385 -0.961 1.00 0.00 H new ATOM 905 N PHE A 351 1.319 -4.473 -1.307 1.00 0.00 N ATOM 906 CA PHE A 351 -0.083 -4.202 -1.577 1.00 0.00 C ATOM 907 C PHE A 351 -0.659 -3.222 -0.553 1.00 0.00 C ATOM 908 O PHE A 351 -0.076 -3.015 0.510 1.00 0.00 O ATOM 909 CB PHE A 351 -0.826 -5.534 -1.464 1.00 0.00 C ATOM 910 CG PHE A 351 -1.048 -6.003 -0.025 1.00 0.00 C ATOM 911 CD1 PHE A 351 -0.044 -6.626 0.650 1.00 0.00 C ATOM 912 CD2 PHE A 351 -2.248 -5.798 0.580 1.00 0.00 C ATOM 913 CE1 PHE A 351 -0.249 -7.061 1.986 1.00 0.00 C ATOM 914 CE2 PHE A 351 -2.454 -6.233 1.916 1.00 0.00 C ATOM 915 CZ PHE A 351 -1.450 -6.855 2.591 1.00 0.00 C ATOM 0 H PHE A 351 1.571 -4.475 -0.319 1.00 0.00 H new ATOM 0 HA PHE A 351 -0.192 -3.758 -2.566 1.00 0.00 H new ATOM 0 HB2 PHE A 351 -1.793 -5.442 -1.958 1.00 0.00 H new ATOM 0 HB3 PHE A 351 -0.265 -6.298 -2.002 1.00 0.00 H new ATOM 0 HD1 PHE A 351 0.909 -6.790 0.169 1.00 0.00 H new ATOM 0 HD2 PHE A 351 -3.045 -5.304 0.044 1.00 0.00 H new ATOM 0 HE1 PHE A 351 0.548 -7.555 2.522 1.00 0.00 H new ATOM 0 HE2 PHE A 351 -3.408 -6.070 2.396 1.00 0.00 H new ATOM 0 HZ PHE A 351 -1.606 -7.185 3.607 1.00 0.00 H new ATOM 925 N ILE A 352 -1.797 -2.645 -0.909 1.00 0.00 N ATOM 926 CA ILE A 352 -2.459 -1.692 -0.034 1.00 0.00 C ATOM 927 C ILE A 352 -3.663 -2.364 0.629 1.00 0.00 C ATOM 928 O ILE A 352 -4.627 -2.723 -0.045 1.00 0.00 O ATOM 929 CB ILE A 352 -2.812 -0.416 -0.801 1.00 0.00 C ATOM 930 CG1 ILE A 352 -1.550 0.348 -1.206 1.00 0.00 C ATOM 931 CG2 ILE A 352 -3.778 0.457 0.002 1.00 0.00 C ATOM 932 CD1 ILE A 352 -1.896 1.750 -1.712 1.00 0.00 C ATOM 0 H ILE A 352 -2.278 -2.819 -1.792 1.00 0.00 H new ATOM 0 HA ILE A 352 -1.788 -1.380 0.766 1.00 0.00 H new ATOM 0 HB ILE A 352 -3.324 -0.701 -1.720 1.00 0.00 H new ATOM 0 HG12 ILE A 352 -0.876 0.422 -0.353 1.00 0.00 H new ATOM 0 HG13 ILE A 352 -1.021 -0.203 -1.984 1.00 0.00 H new ATOM 0 HG21 ILE A 352 -4.013 1.357 -0.566 1.00 0.00 H new ATOM 0 HG22 ILE A 352 -4.695 -0.099 0.196 1.00 0.00 H new ATOM 0 HG23 ILE A 352 -3.315 0.735 0.949 1.00 0.00 H new ATOM 0 HD11 ILE A 352 -0.981 2.271 -1.993 1.00 0.00 H new ATOM 0 HD12 ILE A 352 -2.551 1.672 -2.580 1.00 0.00 H new ATOM 0 HD13 ILE A 352 -2.403 2.306 -0.924 1.00 0.00 H new ATOM 944 N ASP A 353 -3.567 -2.515 1.942 1.00 0.00 N ATOM 945 CA ASP A 353 -4.636 -3.139 2.703 1.00 0.00 C ATOM 946 C ASP A 353 -5.783 -2.141 2.874 1.00 0.00 C ATOM 947 O ASP A 353 -5.653 -1.158 3.602 1.00 0.00 O ATOM 948 CB ASP A 353 -4.154 -3.548 4.096 1.00 0.00 C ATOM 949 CG ASP A 353 -5.209 -4.228 4.971 1.00 0.00 C ATOM 950 OD1 ASP A 353 -6.349 -4.369 4.480 1.00 0.00 O ATOM 951 OD2 ASP A 353 -4.851 -4.591 6.113 1.00 0.00 O ATOM 0 H ASP A 353 -2.766 -2.216 2.498 1.00 0.00 H new ATOM 0 HA ASP A 353 -4.964 -4.026 2.160 1.00 0.00 H new ATOM 0 HB2 ASP A 353 -3.305 -4.222 3.987 1.00 0.00 H new ATOM 0 HB3 ASP A 353 -3.791 -2.660 4.614 1.00 0.00 H new ATOM 956 N GLN A 354 -6.882 -2.428 2.191 1.00 0.00 N ATOM 957 CA GLN A 354 -8.051 -1.568 2.258 1.00 0.00 C ATOM 958 C GLN A 354 -8.886 -1.903 3.495 1.00 0.00 C ATOM 959 O GLN A 354 -9.703 -1.095 3.935 1.00 0.00 O ATOM 960 CB GLN A 354 -8.890 -1.682 0.983 1.00 0.00 C ATOM 961 CG GLN A 354 -8.165 -1.053 -0.208 1.00 0.00 C ATOM 962 CD GLN A 354 -9.130 -0.232 -1.065 1.00 0.00 C ATOM 963 OE1 GLN A 354 -9.257 0.973 -0.923 1.00 0.00 O ATOM 964 NE2 GLN A 354 -9.802 -0.949 -1.961 1.00 0.00 N ATOM 0 H GLN A 354 -6.987 -3.244 1.588 1.00 0.00 H new ATOM 0 HA GLN A 354 -7.713 -0.535 2.340 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -9.099 -2.731 0.773 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -9.851 -1.189 1.130 1.00 0.00 H new ATOM 0 HG2 GLN A 354 -7.357 -0.415 0.149 1.00 0.00 H new ATOM 0 HG3 GLN A 354 -7.709 -1.835 -0.815 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -9.648 -1.955 -2.028 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -10.471 -0.493 -2.581 1.00 0.00 H new ATOM 973 N ILE A 355 -8.652 -3.096 4.022 1.00 0.00 N ATOM 974 CA ILE A 355 -9.373 -3.548 5.200 1.00 0.00 C ATOM 975 C ILE A 355 -8.971 -2.688 6.400 1.00 0.00 C ATOM 976 O ILE A 355 -9.818 -2.303 7.204 1.00 0.00 O ATOM 977 CB ILE A 355 -9.156 -5.047 5.419 1.00 0.00 C ATOM 978 CG1 ILE A 355 -9.573 -5.847 4.183 1.00 0.00 C ATOM 979 CG2 ILE A 355 -9.875 -5.527 6.681 1.00 0.00 C ATOM 980 CD1 ILE A 355 -8.719 -7.107 4.031 1.00 0.00 C ATOM 0 H ILE A 355 -7.973 -3.763 3.655 1.00 0.00 H new ATOM 0 HA ILE A 355 -10.447 -3.421 5.061 1.00 0.00 H new ATOM 0 HB ILE A 355 -8.090 -5.219 5.571 1.00 0.00 H new ATOM 0 HG12 ILE A 355 -10.624 -6.123 4.262 1.00 0.00 H new ATOM 0 HG13 ILE A 355 -9.473 -5.226 3.293 1.00 0.00 H new ATOM 0 HG21 ILE A 355 -9.704 -6.595 6.813 1.00 0.00 H new ATOM 0 HG22 ILE A 355 -9.489 -4.988 7.547 1.00 0.00 H new ATOM 0 HG23 ILE A 355 -10.944 -5.340 6.584 1.00 0.00 H new ATOM 0 HD11 ILE A 355 -9.036 -7.657 3.145 1.00 0.00 H new ATOM 0 HD12 ILE A 355 -7.671 -6.826 3.928 1.00 0.00 H new ATOM 0 HD13 ILE A 355 -8.840 -7.737 4.912 1.00 0.00 H new ATOM 992 N ASP A 356 -7.678 -2.411 6.482 1.00 0.00 N ATOM 993 CA ASP A 356 -7.153 -1.603 7.570 1.00 0.00 C ATOM 994 C ASP A 356 -6.705 -0.247 7.022 1.00 0.00 C ATOM 995 O ASP A 356 -6.476 0.690 7.785 1.00 0.00 O ATOM 996 CB ASP A 356 -5.942 -2.275 8.220 1.00 0.00 C ATOM 997 CG ASP A 356 -6.247 -3.572 8.971 1.00 0.00 C ATOM 998 OD1 ASP A 356 -6.603 -3.468 10.164 1.00 0.00 O ATOM 999 OD2 ASP A 356 -6.117 -4.640 8.334 1.00 0.00 O ATOM 0 H ASP A 356 -6.978 -2.732 5.813 1.00 0.00 H new ATOM 0 HA ASP A 356 -7.941 -1.485 8.313 1.00 0.00 H new ATOM 0 HB2 ASP A 356 -5.204 -2.486 7.446 1.00 0.00 H new ATOM 0 HB3 ASP A 356 -5.484 -1.570 8.914 1.00 0.00 H new ATOM 1004 N GLY A 357 -6.592 -0.185 5.703 1.00 0.00 N ATOM 1005 CA GLY A 357 -6.175 1.041 5.044 1.00 0.00 C ATOM 1006 C GLY A 357 -4.704 1.345 5.333 1.00 0.00 C ATOM 1007 O GLY A 357 -4.315 2.507 5.436 1.00 0.00 O ATOM 0 H GLY A 357 -6.782 -0.964 5.073 1.00 0.00 H new ATOM 0 HA2 GLY A 357 -6.327 0.950 3.968 1.00 0.00 H new ATOM 0 HA3 GLY A 357 -6.795 1.870 5.384 1.00 0.00 H new ATOM 1011 N ILE A 358 -3.925 0.280 5.455 1.00 0.00 N ATOM 1012 CA ILE A 358 -2.505 0.418 5.729 1.00 0.00 C ATOM 1013 C ILE A 358 -1.707 -0.029 4.502 1.00 0.00 C ATOM 1014 O ILE A 358 -2.130 -0.926 3.776 1.00 0.00 O ATOM 1015 CB ILE A 358 -2.132 -0.329 7.011 1.00 0.00 C ATOM 1016 CG1 ILE A 358 -3.140 -0.043 8.126 1.00 0.00 C ATOM 1017 CG2 ILE A 358 -0.698 -0.005 7.437 1.00 0.00 C ATOM 1018 CD1 ILE A 358 -3.037 -1.088 9.239 1.00 0.00 C ATOM 0 H ILE A 358 -4.251 -0.683 5.369 1.00 0.00 H new ATOM 0 HA ILE A 358 -2.252 1.462 5.911 1.00 0.00 H new ATOM 0 HB ILE A 358 -2.173 -1.399 6.807 1.00 0.00 H new ATOM 0 HG12 ILE A 358 -2.961 0.950 8.537 1.00 0.00 H new ATOM 0 HG13 ILE A 358 -4.150 -0.041 7.716 1.00 0.00 H new ATOM 0 HG21 ILE A 358 -0.458 -0.549 8.351 1.00 0.00 H new ATOM 0 HG22 ILE A 358 -0.008 -0.301 6.647 1.00 0.00 H new ATOM 0 HG23 ILE A 358 -0.605 1.066 7.617 1.00 0.00 H new ATOM 0 HD11 ILE A 358 -3.764 -0.862 10.019 1.00 0.00 H new ATOM 0 HD12 ILE A 358 -3.241 -2.077 8.829 1.00 0.00 H new ATOM 0 HD13 ILE A 358 -2.033 -1.070 9.663 1.00 0.00 H new ATOM 1030 N VAL A 359 -0.568 0.619 4.309 1.00 0.00 N ATOM 1031 CA VAL A 359 0.293 0.300 3.183 1.00 0.00 C ATOM 1032 C VAL A 359 1.259 -0.817 3.585 1.00 0.00 C ATOM 1033 O VAL A 359 2.049 -0.655 4.514 1.00 0.00 O ATOM 1034 CB VAL A 359 1.008 1.562 2.697 1.00 0.00 C ATOM 1035 CG1 VAL A 359 2.080 1.220 1.660 1.00 0.00 C ATOM 1036 CG2 VAL A 359 0.009 2.577 2.139 1.00 0.00 C ATOM 0 H VAL A 359 -0.221 1.364 4.914 1.00 0.00 H new ATOM 0 HA VAL A 359 -0.297 -0.067 2.343 1.00 0.00 H new ATOM 0 HB VAL A 359 1.505 2.017 3.554 1.00 0.00 H new ATOM 0 HG11 VAL A 359 2.573 2.135 1.331 1.00 0.00 H new ATOM 0 HG12 VAL A 359 2.816 0.551 2.105 1.00 0.00 H new ATOM 0 HG13 VAL A 359 1.615 0.730 0.804 1.00 0.00 H new ATOM 0 HG21 VAL A 359 0.543 3.465 1.800 1.00 0.00 H new ATOM 0 HG22 VAL A 359 -0.529 2.135 1.300 1.00 0.00 H new ATOM 0 HG23 VAL A 359 -0.700 2.856 2.918 1.00 0.00 H new ATOM 1046 N HIS A 360 1.163 -1.925 2.866 1.00 0.00 N ATOM 1047 CA HIS A 360 2.019 -3.069 3.136 1.00 0.00 C ATOM 1048 C HIS A 360 3.278 -2.984 2.271 1.00 0.00 C ATOM 1049 O HIS A 360 3.210 -3.138 1.053 1.00 0.00 O ATOM 1050 CB HIS A 360 1.252 -4.378 2.941 1.00 0.00 C ATOM 1051 CG HIS A 360 0.822 -5.036 4.230 1.00 0.00 C ATOM 1052 ND1 HIS A 360 1.550 -6.045 4.836 1.00 0.00 N ATOM 1053 CD2 HIS A 360 -0.268 -4.819 5.021 1.00 0.00 C ATOM 1054 CE1 HIS A 360 0.917 -6.411 5.941 1.00 0.00 C ATOM 1055 NE2 HIS A 360 -0.209 -5.651 6.054 1.00 0.00 N ATOM 0 H HIS A 360 0.506 -2.056 2.097 1.00 0.00 H new ATOM 0 HA HIS A 360 2.336 -3.053 4.179 1.00 0.00 H new ATOM 0 HB2 HIS A 360 0.369 -4.182 2.333 1.00 0.00 H new ATOM 0 HB3 HIS A 360 1.877 -5.073 2.381 1.00 0.00 H new ATOM 0 HD2 HIS A 360 -1.047 -4.094 4.838 1.00 0.00 H new ATOM 0 HE1 HIS A 360 1.237 -7.177 6.631 1.00 0.00 H new ATOM 0 HE2 HIS A 360 -0.893 -5.712 6.808 1.00 0.00 H new ATOM 1063 N PHE A 361 4.398 -2.738 2.935 1.00 0.00 N ATOM 1064 CA PHE A 361 5.670 -2.630 2.242 1.00 0.00 C ATOM 1065 C PHE A 361 6.449 -3.945 2.318 1.00 0.00 C ATOM 1066 O PHE A 361 6.371 -4.660 3.316 1.00 0.00 O ATOM 1067 CB PHE A 361 6.472 -1.535 2.948 1.00 0.00 C ATOM 1068 CG PHE A 361 5.971 -0.117 2.666 1.00 0.00 C ATOM 1069 CD1 PHE A 361 5.583 0.230 1.409 1.00 0.00 C ATOM 1070 CD2 PHE A 361 5.913 0.796 3.672 1.00 0.00 C ATOM 1071 CE1 PHE A 361 5.118 1.546 1.147 1.00 0.00 C ATOM 1072 CE2 PHE A 361 5.448 2.112 3.410 1.00 0.00 C ATOM 1073 CZ PHE A 361 5.060 2.459 2.153 1.00 0.00 C ATOM 0 H PHE A 361 4.451 -2.610 3.946 1.00 0.00 H new ATOM 0 HA PHE A 361 5.502 -2.398 1.190 1.00 0.00 H new ATOM 0 HB2 PHE A 361 6.442 -1.713 4.023 1.00 0.00 H new ATOM 0 HB3 PHE A 361 7.515 -1.608 2.642 1.00 0.00 H new ATOM 0 HD1 PHE A 361 5.629 -0.496 0.610 1.00 0.00 H new ATOM 0 HD2 PHE A 361 6.220 0.520 4.670 1.00 0.00 H new ATOM 0 HE1 PHE A 361 4.811 1.822 0.149 1.00 0.00 H new ATOM 0 HE2 PHE A 361 5.402 2.838 4.209 1.00 0.00 H new ATOM 0 HZ PHE A 361 4.706 3.460 1.954 1.00 0.00 H new ATOM 1083 N GLU A 362 7.182 -4.224 1.250 1.00 0.00 N ATOM 1084 CA GLU A 362 7.974 -5.441 1.184 1.00 0.00 C ATOM 1085 C GLU A 362 9.402 -5.171 1.661 1.00 0.00 C ATOM 1086 O GLU A 362 9.938 -4.085 1.444 1.00 0.00 O ATOM 1087 CB GLU A 362 7.969 -6.021 -0.232 1.00 0.00 C ATOM 1088 CG GLU A 362 9.193 -6.910 -0.464 1.00 0.00 C ATOM 1089 CD GLU A 362 9.152 -8.145 0.438 1.00 0.00 C ATOM 1090 OE1 GLU A 362 8.429 -8.081 1.456 1.00 0.00 O ATOM 1091 OE2 GLU A 362 9.845 -9.125 0.090 1.00 0.00 O ATOM 0 H GLU A 362 7.244 -3.629 0.424 1.00 0.00 H new ATOM 0 HA GLU A 362 7.525 -6.181 1.846 1.00 0.00 H new ATOM 0 HB2 GLU A 362 7.059 -6.600 -0.388 1.00 0.00 H new ATOM 0 HB3 GLU A 362 7.960 -5.211 -0.961 1.00 0.00 H new ATOM 0 HG2 GLU A 362 9.230 -7.219 -1.509 1.00 0.00 H new ATOM 0 HG3 GLU A 362 10.102 -6.342 -0.268 1.00 0.00 H new