USER MOD reduce.3.24.130724 H: found=0, std=0, add=600, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 599 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 366 TYR OH : rot 15:sc= -0.0801 USER MOD Set 1.2: A 391 GLN : amide:sc= -0.161 X(o=-0.24,f=-0.34) USER MOD Single : A 337 TYR OH : rot -120:sc= -2.84! USER MOD Single : A 338 SER OG : rot -149:sc= 1.21 USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 344 LYS NZ :NH3+ 159:sc= 0.739 (180deg=0.0309!) USER MOD Single : A 350 LYS NZ :NH3+ -138:sc= 1.26 (180deg=0.482) USER MOD Single : A 353 ASN : amide:sc= 0.231 K(o=0.23,f=-1.5) USER MOD Single : A 356 THR OG1 : rot 22:sc= 1.5 USER MOD Single : A 359 HIS : no HE2:sc= 0.278 K(o=0.28,f=-1.7) USER MOD Single : A 367 GLN : amide:sc= 0.403 X(o=0.4,f=0) USER MOD Single : A 370 HIS : no HD1:sc= 0 X(o=0,f=-0.0012) USER MOD Single : A 373 SER OG : rot -70:sc= 1.24 USER MOD Single : A 375 THR OG1 : rot -31:sc= 0.438 USER MOD Single : A 376 HIS : no HE2:sc= 1.07 K(o=1.1,f=-3.2!) USER MOD Single : A 379 CYS SG : rot -4:sc= 0.691 USER MOD Single : A 387 SER OG : rot 95:sc= 1.24 USER MOD Single : A 393 SER OG : rot -100:sc= 1.24 USER MOD Single : A 395 THR OG1 : rot 100:sc= 1.21 USER MOD Single : A 407 GLN : amide:sc= 0.779 K(o=0.78,f=0) USER MOD Single : A 414 SER OG : rot 110:sc= -0.239 USER MOD ----------------------------------------------------------------- ATOM 24 N LEU A 336 3.221 3.343 -11.988 1.00 0.00 N ATOM 25 CA LEU A 336 3.335 2.467 -10.831 1.00 0.00 C ATOM 26 C LEU A 336 3.393 3.212 -9.502 1.00 0.00 C ATOM 27 O LEU A 336 3.554 4.432 -9.447 1.00 0.00 O ATOM 28 CB LEU A 336 4.592 1.607 -11.051 1.00 0.00 C ATOM 29 CG LEU A 336 4.298 0.201 -11.605 1.00 0.00 C ATOM 30 CD1 LEU A 336 4.356 -0.811 -10.460 1.00 0.00 C ATOM 31 CD2 LEU A 336 2.985 0.007 -12.380 1.00 0.00 C ATOM 0 HA LEU A 336 2.438 1.853 -10.755 1.00 0.00 H new ATOM 0 HB2 LEU A 336 5.259 2.126 -11.740 1.00 0.00 H new ATOM 0 HB3 LEU A 336 5.124 1.510 -10.104 1.00 0.00 H new ATOM 0 HG LEU A 336 5.074 0.046 -12.355 1.00 0.00 H new ATOM 0 HD11 LEU A 336 4.149 -1.809 -10.846 1.00 0.00 H new ATOM 0 HD12 LEU A 336 5.349 -0.795 -10.010 1.00 0.00 H new ATOM 0 HD13 LEU A 336 3.612 -0.551 -9.707 1.00 0.00 H new ATOM 0 HD21 LEU A 336 2.908 -1.028 -12.712 1.00 0.00 H new ATOM 0 HD22 LEU A 336 2.141 0.244 -11.732 1.00 0.00 H new ATOM 0 HD23 LEU A 336 2.973 0.667 -13.247 1.00 0.00 H new ATOM 43 N TYR A 337 3.450 2.443 -8.419 1.00 0.00 N ATOM 44 CA TYR A 337 3.490 2.985 -7.072 1.00 0.00 C ATOM 45 C TYR A 337 4.936 3.198 -6.649 1.00 0.00 C ATOM 46 O TYR A 337 5.303 4.281 -6.186 1.00 0.00 O ATOM 47 CB TYR A 337 2.758 2.039 -6.122 1.00 0.00 C ATOM 48 CG TYR A 337 2.238 2.779 -4.918 1.00 0.00 C ATOM 49 CD1 TYR A 337 3.123 3.194 -3.908 1.00 0.00 C ATOM 50 CD2 TYR A 337 0.879 3.130 -4.857 1.00 0.00 C ATOM 51 CE1 TYR A 337 2.632 3.906 -2.804 1.00 0.00 C ATOM 52 CE2 TYR A 337 0.399 3.897 -3.786 1.00 0.00 C ATOM 53 CZ TYR A 337 1.266 4.229 -2.726 1.00 0.00 C ATOM 54 OH TYR A 337 0.798 4.846 -1.619 1.00 0.00 O ATOM 0 H TYR A 337 3.470 1.424 -8.455 1.00 0.00 H new ATOM 0 HA TYR A 337 2.987 3.952 -7.041 1.00 0.00 H new ATOM 0 HB2 TYR A 337 1.930 1.561 -6.645 1.00 0.00 H new ATOM 0 HB3 TYR A 337 3.433 1.245 -5.802 1.00 0.00 H new ATOM 0 HD1 TYR A 337 4.176 2.966 -3.982 1.00 0.00 H new ATOM 0 HD2 TYR A 337 0.203 2.809 -5.636 1.00 0.00 H new ATOM 0 HE1 TYR A 337 3.304 4.206 -2.013 1.00 0.00 H new ATOM 0 HE2 TYR A 337 -0.628 4.231 -3.774 1.00 0.00 H new ATOM 0 HH TYR A 337 0.110 4.288 -1.200 1.00 0.00 H new ATOM 64 N SER A 338 5.750 2.169 -6.878 1.00 0.00 N ATOM 65 CA SER A 338 7.203 2.157 -6.876 1.00 0.00 C ATOM 66 C SER A 338 7.821 3.112 -7.909 1.00 0.00 C ATOM 67 O SER A 338 9.030 3.328 -7.891 1.00 0.00 O ATOM 68 CB SER A 338 7.601 0.690 -7.102 1.00 0.00 C ATOM 69 OG SER A 338 7.042 0.242 -8.328 1.00 0.00 O ATOM 0 H SER A 338 5.372 1.245 -7.087 1.00 0.00 H new ATOM 0 HA SER A 338 7.594 2.532 -5.930 1.00 0.00 H new ATOM 0 HB2 SER A 338 8.686 0.594 -7.126 1.00 0.00 H new ATOM 0 HB3 SER A 338 7.245 0.072 -6.278 1.00 0.00 H new ATOM 0 HG SER A 338 6.841 -0.715 -8.265 1.00 0.00 H new ATOM 75 N SER A 339 7.010 3.721 -8.787 1.00 0.00 N ATOM 76 CA SER A 339 7.486 4.704 -9.745 1.00 0.00 C ATOM 77 C SER A 339 8.136 5.884 -9.019 1.00 0.00 C ATOM 78 O SER A 339 9.085 6.446 -9.554 1.00 0.00 O ATOM 79 CB SER A 339 6.331 5.171 -10.640 1.00 0.00 C ATOM 80 OG SER A 339 6.803 5.858 -11.784 1.00 0.00 O ATOM 0 H SER A 339 6.008 3.539 -8.845 1.00 0.00 H new ATOM 0 HA SER A 339 8.243 4.244 -10.380 1.00 0.00 H new ATOM 0 HB2 SER A 339 5.739 4.310 -10.950 1.00 0.00 H new ATOM 0 HB3 SER A 339 5.669 5.824 -10.070 1.00 0.00 H new ATOM 0 HG SER A 339 6.042 6.140 -12.333 1.00 0.00 H new ATOM 86 N LEU A 340 7.572 6.350 -7.897 1.00 0.00 N ATOM 87 CA LEU A 340 8.277 7.133 -6.888 1.00 0.00 C ATOM 88 C LEU A 340 9.425 6.313 -6.276 1.00 0.00 C ATOM 89 O LEU A 340 9.119 5.447 -5.456 1.00 0.00 O ATOM 90 CB LEU A 340 7.283 7.638 -5.820 1.00 0.00 C ATOM 91 CG LEU A 340 7.165 9.166 -5.858 1.00 0.00 C ATOM 92 CD1 LEU A 340 5.939 9.611 -5.056 1.00 0.00 C ATOM 93 CD2 LEU A 340 8.434 9.834 -5.301 1.00 0.00 C ATOM 0 H LEU A 340 6.592 6.187 -7.666 1.00 0.00 H new ATOM 0 HA LEU A 340 8.726 8.009 -7.357 1.00 0.00 H new ATOM 0 HB2 LEU A 340 6.304 7.190 -5.989 1.00 0.00 H new ATOM 0 HB3 LEU A 340 7.613 7.320 -4.831 1.00 0.00 H new ATOM 0 HG LEU A 340 7.050 9.476 -6.897 1.00 0.00 H new ATOM 0 HD11 LEU A 340 5.859 10.698 -5.086 1.00 0.00 H new ATOM 0 HD12 LEU A 340 5.041 9.169 -5.489 1.00 0.00 H new ATOM 0 HD13 LEU A 340 6.042 9.283 -4.022 1.00 0.00 H new ATOM 0 HD21 LEU A 340 8.322 10.918 -5.340 1.00 0.00 H new ATOM 0 HD22 LEU A 340 8.586 9.522 -4.268 1.00 0.00 H new ATOM 0 HD23 LEU A 340 9.295 9.536 -5.900 1.00 0.00 H new ATOM 152 N LYS A 344 9.181 9.983 -0.364 1.00 0.00 N ATOM 153 CA LYS A 344 7.724 10.094 -0.430 1.00 0.00 C ATOM 154 C LYS A 344 7.056 8.737 -0.137 1.00 0.00 C ATOM 155 O LYS A 344 5.968 8.731 0.415 1.00 0.00 O ATOM 156 CB LYS A 344 7.250 10.814 -1.705 1.00 0.00 C ATOM 157 CG LYS A 344 5.803 11.369 -1.672 1.00 0.00 C ATOM 158 CD LYS A 344 5.548 12.404 -0.556 1.00 0.00 C ATOM 159 CE LYS A 344 4.278 13.261 -0.752 1.00 0.00 C ATOM 160 NZ LYS A 344 4.058 14.208 0.365 1.00 0.00 N ATOM 0 HA LYS A 344 7.381 10.752 0.368 1.00 0.00 H new ATOM 0 HB2 LYS A 344 7.931 11.641 -1.906 1.00 0.00 H new ATOM 0 HB3 LYS A 344 7.334 10.121 -2.542 1.00 0.00 H new ATOM 0 HG2 LYS A 344 5.580 11.828 -2.635 1.00 0.00 H new ATOM 0 HG3 LYS A 344 5.110 10.537 -1.546 1.00 0.00 H new ATOM 0 HD2 LYS A 344 5.474 11.880 0.397 1.00 0.00 H new ATOM 0 HD3 LYS A 344 6.411 13.067 -0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 344 4.359 13.817 -1.686 1.00 0.00 H new ATOM 0 HE3 LYS A 344 3.412 12.606 -0.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 3.438 14.981 0.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 3.610 13.709 1.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 4.971 14.600 0.673 1.00 0.00 H new ATOM 174 N ARG A 345 7.586 7.581 -0.584 1.00 0.00 N ATOM 175 CA ARG A 345 7.083 6.266 -0.137 1.00 0.00 C ATOM 176 C ARG A 345 7.220 6.039 1.372 1.00 0.00 C ATOM 177 O ARG A 345 6.365 5.384 1.946 1.00 0.00 O ATOM 178 CB ARG A 345 7.753 5.089 -0.873 1.00 0.00 C ATOM 179 CG ARG A 345 7.710 5.031 -2.412 1.00 0.00 C ATOM 180 CD ARG A 345 6.352 5.155 -3.121 1.00 0.00 C ATOM 181 NE ARG A 345 5.618 6.391 -2.791 1.00 0.00 N ATOM 182 CZ ARG A 345 4.501 6.832 -3.382 1.00 0.00 C ATOM 183 NH1 ARG A 345 4.075 6.277 -4.515 1.00 0.00 N ATOM 184 NH2 ARG A 345 3.819 7.836 -2.830 1.00 0.00 N ATOM 0 H ARG A 345 8.357 7.531 -1.250 1.00 0.00 H new ATOM 0 HA ARG A 345 6.023 6.292 -0.388 1.00 0.00 H new ATOM 0 HB2 ARG A 345 8.801 5.072 -0.575 1.00 0.00 H new ATOM 0 HB3 ARG A 345 7.301 4.170 -0.499 1.00 0.00 H new ATOM 0 HG2 ARG A 345 8.353 5.826 -2.790 1.00 0.00 H new ATOM 0 HG3 ARG A 345 8.157 4.086 -2.719 1.00 0.00 H new ATOM 0 HD2 ARG A 345 6.510 5.115 -4.199 1.00 0.00 H new ATOM 0 HD3 ARG A 345 5.735 4.296 -2.857 1.00 0.00 H new ATOM 0 HE ARG A 345 5.999 6.966 -2.039 1.00 0.00 H new ATOM 0 HH11 ARG A 345 4.601 5.512 -4.937 1.00 0.00 H new ATOM 0 HH12 ARG A 345 3.223 6.617 -4.961 1.00 0.00 H new ATOM 0 HH21 ARG A 345 4.150 8.262 -1.964 1.00 0.00 H new ATOM 0 HH22 ARG A 345 2.967 8.178 -3.274 1.00 0.00 H new ATOM 198 N GLU A 346 8.238 6.571 2.027 1.00 0.00 N ATOM 199 CA GLU A 346 8.380 6.495 3.482 1.00 0.00 C ATOM 200 C GLU A 346 7.328 7.389 4.126 1.00 0.00 C ATOM 201 O GLU A 346 6.681 7.024 5.101 1.00 0.00 O ATOM 202 CB GLU A 346 9.833 6.792 3.900 1.00 0.00 C ATOM 203 CG GLU A 346 10.848 5.914 3.134 1.00 0.00 C ATOM 204 CD GLU A 346 12.302 6.235 3.479 1.00 0.00 C ATOM 205 OE1 GLU A 346 12.801 5.660 4.476 1.00 0.00 O ATOM 206 OE2 GLU A 346 12.918 7.018 2.717 1.00 0.00 O ATOM 0 H GLU A 346 8.997 7.072 1.566 1.00 0.00 H new ATOM 0 HA GLU A 346 8.191 5.485 3.846 1.00 0.00 H new ATOM 0 HB2 GLU A 346 10.054 7.844 3.719 1.00 0.00 H new ATOM 0 HB3 GLU A 346 9.944 6.623 4.971 1.00 0.00 H new ATOM 0 HG2 GLU A 346 10.652 4.865 3.356 1.00 0.00 H new ATOM 0 HG3 GLU A 346 10.698 6.047 2.063 1.00 0.00 H new ATOM 213 N GLU A 347 7.065 8.541 3.527 1.00 0.00 N ATOM 214 CA GLU A 347 5.885 9.332 3.818 1.00 0.00 C ATOM 215 C GLU A 347 4.565 8.562 3.591 1.00 0.00 C ATOM 216 O GLU A 347 3.537 8.981 4.110 1.00 0.00 O ATOM 217 CB GLU A 347 5.932 10.623 3.000 1.00 0.00 C ATOM 218 CG GLU A 347 5.701 11.856 3.871 1.00 0.00 C ATOM 219 CD GLU A 347 5.244 13.002 2.984 1.00 0.00 C ATOM 220 OE1 GLU A 347 6.075 13.595 2.264 1.00 0.00 O ATOM 221 OE2 GLU A 347 4.012 13.208 2.936 1.00 0.00 O ATOM 0 H GLU A 347 7.672 8.954 2.819 1.00 0.00 H new ATOM 0 HA GLU A 347 5.897 9.572 4.881 1.00 0.00 H new ATOM 0 HB2 GLU A 347 6.900 10.704 2.505 1.00 0.00 H new ATOM 0 HB3 GLU A 347 5.175 10.585 2.217 1.00 0.00 H new ATOM 0 HG2 GLU A 347 4.950 11.645 4.632 1.00 0.00 H new ATOM 0 HG3 GLU A 347 6.618 12.126 4.394 1.00 0.00 H new ATOM 228 N VAL A 348 4.529 7.455 2.839 1.00 0.00 N ATOM 229 CA VAL A 348 3.350 6.589 2.797 1.00 0.00 C ATOM 230 C VAL A 348 3.314 5.678 4.026 1.00 0.00 C ATOM 231 O VAL A 348 2.220 5.356 4.468 1.00 0.00 O ATOM 232 CB VAL A 348 3.253 5.798 1.481 1.00 0.00 C ATOM 233 CG1 VAL A 348 2.016 4.904 1.427 1.00 0.00 C ATOM 234 CG2 VAL A 348 3.163 6.726 0.259 1.00 0.00 C ATOM 0 H VAL A 348 5.303 7.140 2.253 1.00 0.00 H new ATOM 0 HA VAL A 348 2.466 7.226 2.826 1.00 0.00 H new ATOM 0 HB VAL A 348 4.162 5.197 1.453 1.00 0.00 H new ATOM 0 HG11 VAL A 348 1.995 4.368 0.478 1.00 0.00 H new ATOM 0 HG12 VAL A 348 2.049 4.187 2.248 1.00 0.00 H new ATOM 0 HG13 VAL A 348 1.120 5.517 1.517 1.00 0.00 H new ATOM 0 HG21 VAL A 348 3.096 6.127 -0.649 1.00 0.00 H new ATOM 0 HG22 VAL A 348 2.277 7.355 0.344 1.00 0.00 H new ATOM 0 HG23 VAL A 348 4.052 7.355 0.214 1.00 0.00 H new ATOM 244 N GLU A 349 4.439 5.291 4.630 1.00 0.00 N ATOM 245 CA GLU A 349 4.441 4.604 5.934 1.00 0.00 C ATOM 246 C GLU A 349 3.752 5.470 6.997 1.00 0.00 C ATOM 247 O GLU A 349 3.071 4.948 7.879 1.00 0.00 O ATOM 248 CB GLU A 349 5.864 4.236 6.393 1.00 0.00 C ATOM 249 CG GLU A 349 6.632 3.401 5.360 1.00 0.00 C ATOM 250 CD GLU A 349 8.139 3.373 5.596 1.00 0.00 C ATOM 251 OE1 GLU A 349 8.612 3.245 6.749 1.00 0.00 O ATOM 252 OE2 GLU A 349 8.868 3.429 4.588 1.00 0.00 O ATOM 0 H GLU A 349 5.369 5.440 4.238 1.00 0.00 H new ATOM 0 HA GLU A 349 3.885 3.675 5.809 1.00 0.00 H new ATOM 0 HB2 GLU A 349 6.421 5.150 6.599 1.00 0.00 H new ATOM 0 HB3 GLU A 349 5.805 3.681 7.329 1.00 0.00 H new ATOM 0 HG2 GLU A 349 6.251 2.380 5.375 1.00 0.00 H new ATOM 0 HG3 GLU A 349 6.436 3.800 4.365 1.00 0.00 H new ATOM 259 N LYS A 350 3.843 6.800 6.858 1.00 0.00 N ATOM 260 CA LYS A 350 3.073 7.730 7.693 1.00 0.00 C ATOM 261 C LYS A 350 1.574 7.632 7.358 1.00 0.00 C ATOM 262 O LYS A 350 0.745 7.691 8.265 1.00 0.00 O ATOM 263 CB LYS A 350 3.638 9.152 7.436 1.00 0.00 C ATOM 264 CG LYS A 350 2.857 10.364 7.979 1.00 0.00 C ATOM 265 CD LYS A 350 3.064 11.663 7.155 1.00 0.00 C ATOM 266 CE LYS A 350 2.240 11.636 5.851 1.00 0.00 C ATOM 267 NZ LYS A 350 2.285 12.871 5.027 1.00 0.00 N ATOM 0 H LYS A 350 4.445 7.256 6.172 1.00 0.00 H new ATOM 0 HA LYS A 350 3.168 7.486 8.751 1.00 0.00 H new ATOM 0 HB2 LYS A 350 4.643 9.190 7.857 1.00 0.00 H new ATOM 0 HB3 LYS A 350 3.739 9.279 6.358 1.00 0.00 H new ATOM 0 HG2 LYS A 350 1.794 10.121 7.997 1.00 0.00 H new ATOM 0 HG3 LYS A 350 3.159 10.547 9.010 1.00 0.00 H new ATOM 0 HD2 LYS A 350 2.773 12.526 7.754 1.00 0.00 H new ATOM 0 HD3 LYS A 350 4.121 11.781 6.917 1.00 0.00 H new ATOM 0 HE2 LYS A 350 2.589 10.803 5.241 1.00 0.00 H new ATOM 0 HE3 LYS A 350 1.200 11.431 6.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 350 1.332 13.085 4.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 350 2.623 13.664 5.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 350 2.931 12.730 4.225 1.00 0.00 H new ATOM 281 N LEU A 351 1.211 7.530 6.077 1.00 0.00 N ATOM 282 CA LEU A 351 -0.175 7.580 5.609 1.00 0.00 C ATOM 283 C LEU A 351 -0.932 6.261 5.730 1.00 0.00 C ATOM 284 O LEU A 351 -1.970 6.208 6.391 1.00 0.00 O ATOM 285 CB LEU A 351 -0.226 8.068 4.158 1.00 0.00 C ATOM 286 CG LEU A 351 0.294 9.492 3.969 1.00 0.00 C ATOM 287 CD1 LEU A 351 0.590 9.721 2.485 1.00 0.00 C ATOM 288 CD2 LEU A 351 -0.696 10.501 4.563 1.00 0.00 C ATOM 0 H LEU A 351 1.886 7.408 5.322 1.00 0.00 H new ATOM 0 HA LEU A 351 -0.680 8.282 6.272 1.00 0.00 H new ATOM 0 HB2 LEU A 351 0.360 7.391 3.536 1.00 0.00 H new ATOM 0 HB3 LEU A 351 -1.255 8.017 3.803 1.00 0.00 H new ATOM 0 HG LEU A 351 1.229 9.639 4.510 1.00 0.00 H new ATOM 0 HD11 LEU A 351 0.962 10.735 2.340 1.00 0.00 H new ATOM 0 HD12 LEU A 351 1.343 9.007 2.150 1.00 0.00 H new ATOM 0 HD13 LEU A 351 -0.323 9.584 1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 351 -0.314 11.512 4.422 1.00 0.00 H new ATOM 0 HD22 LEU A 351 -1.659 10.404 4.062 1.00 0.00 H new ATOM 0 HD23 LEU A 351 -0.820 10.305 5.628 1.00 0.00 H new ATOM 300 N LEU A 352 -0.458 5.214 5.043 1.00 0.00 N ATOM 301 CA LEU A 352 -0.948 3.832 5.032 1.00 0.00 C ATOM 302 C LEU A 352 -0.548 3.199 6.372 1.00 0.00 C ATOM 303 O LEU A 352 0.261 2.283 6.455 1.00 0.00 O ATOM 304 CB LEU A 352 -0.485 3.059 3.766 1.00 0.00 C ATOM 305 CG LEU A 352 -1.134 3.538 2.436 1.00 0.00 C ATOM 306 CD1 LEU A 352 -0.613 2.836 1.170 1.00 0.00 C ATOM 307 CD2 LEU A 352 -2.646 3.309 2.400 1.00 0.00 C ATOM 0 H LEU A 352 0.348 5.323 4.428 1.00 0.00 H new ATOM 0 HA LEU A 352 -2.034 3.792 4.952 1.00 0.00 H new ATOM 0 HB2 LEU A 352 0.598 3.149 3.678 1.00 0.00 H new ATOM 0 HB3 LEU A 352 -0.707 2.001 3.902 1.00 0.00 H new ATOM 0 HG LEU A 352 -0.865 4.594 2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 352 -1.124 3.237 0.295 1.00 0.00 H new ATOM 0 HD12 LEU A 352 0.459 3.008 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 352 -0.804 1.765 1.243 1.00 0.00 H new ATOM 0 HD21 LEU A 352 -3.045 3.662 1.449 1.00 0.00 H new ATOM 0 HD22 LEU A 352 -2.856 2.245 2.509 1.00 0.00 H new ATOM 0 HD23 LEU A 352 -3.116 3.857 3.217 1.00 0.00 H new ATOM 319 N ASN A 353 -1.078 3.794 7.434 1.00 0.00 N ATOM 320 CA ASN A 353 -0.819 3.567 8.844 1.00 0.00 C ATOM 321 C ASN A 353 -1.074 2.118 9.270 1.00 0.00 C ATOM 322 O ASN A 353 -1.773 1.358 8.589 1.00 0.00 O ATOM 323 CB ASN A 353 -1.683 4.550 9.660 1.00 0.00 C ATOM 324 CG ASN A 353 -3.178 4.425 9.356 1.00 0.00 C ATOM 325 OD1 ASN A 353 -3.902 3.661 9.980 1.00 0.00 O ATOM 326 ND2 ASN A 353 -3.690 5.174 8.389 1.00 0.00 N ATOM 0 H ASN A 353 -1.776 4.527 7.310 1.00 0.00 H new ATOM 0 HA ASN A 353 0.239 3.745 9.036 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -1.518 4.374 10.723 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -1.359 5.570 9.451 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -4.684 5.112 8.168 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -3.090 5.812 7.866 1.00 0.00 H new ATOM 333 N GLY A 354 -0.497 1.761 10.427 1.00 0.00 N ATOM 334 CA GLY A 354 -0.417 0.421 11.005 1.00 0.00 C ATOM 335 C GLY A 354 -1.762 -0.091 11.514 1.00 0.00 C ATOM 336 O GLY A 354 -1.946 -0.279 12.709 1.00 0.00 O ATOM 0 H GLY A 354 -0.043 2.454 11.022 1.00 0.00 H new ATOM 0 HA2 GLY A 354 -0.032 -0.270 10.255 1.00 0.00 H new ATOM 0 HA3 GLY A 354 0.298 0.429 11.828 1.00 0.00 H new ATOM 340 N ASP A 355 -2.657 -0.350 10.570 1.00 0.00 N ATOM 341 CA ASP A 355 -4.048 -0.768 10.672 1.00 0.00 C ATOM 342 C ASP A 355 -4.637 -0.882 9.279 1.00 0.00 C ATOM 343 O ASP A 355 -4.847 -1.965 8.732 1.00 0.00 O ATOM 344 CB ASP A 355 -4.875 0.261 11.471 1.00 0.00 C ATOM 345 CG ASP A 355 -6.367 -0.036 11.303 1.00 0.00 C ATOM 346 OD1 ASP A 355 -6.825 -1.090 11.786 1.00 0.00 O ATOM 347 OD2 ASP A 355 -6.988 0.745 10.535 1.00 0.00 O ATOM 0 H ASP A 355 -2.389 -0.260 9.590 1.00 0.00 H new ATOM 0 HA ASP A 355 -4.082 -1.728 11.186 1.00 0.00 H new ATOM 0 HB2 ASP A 355 -4.603 0.221 12.526 1.00 0.00 H new ATOM 0 HB3 ASP A 355 -4.653 1.270 11.123 1.00 0.00 H new ATOM 352 N THR A 356 -4.845 0.271 8.661 1.00 0.00 N ATOM 353 CA THR A 356 -5.608 0.373 7.445 1.00 0.00 C ATOM 354 C THR A 356 -4.810 -0.212 6.290 1.00 0.00 C ATOM 355 O THR A 356 -5.412 -0.727 5.347 1.00 0.00 O ATOM 356 CB THR A 356 -6.001 1.839 7.304 1.00 0.00 C ATOM 357 OG1 THR A 356 -7.088 2.074 8.192 1.00 0.00 O ATOM 358 CG2 THR A 356 -6.384 2.226 5.877 1.00 0.00 C ATOM 0 H THR A 356 -4.483 1.163 8.998 1.00 0.00 H new ATOM 0 HA THR A 356 -6.528 -0.211 7.453 1.00 0.00 H new ATOM 0 HB THR A 356 -5.139 2.458 7.552 1.00 0.00 H new ATOM 0 HG1 THR A 356 -7.085 1.395 8.899 1.00 0.00 H new ATOM 0 HG21 THR A 356 -6.653 3.282 5.846 1.00 0.00 H new ATOM 0 HG22 THR A 356 -5.539 2.047 5.212 1.00 0.00 H new ATOM 0 HG23 THR A 356 -7.234 1.626 5.553 1.00 0.00 H new ATOM 366 N TRP A 357 -3.475 -0.167 6.354 1.00 0.00 N ATOM 367 CA TRP A 357 -2.669 -0.862 5.375 1.00 0.00 C ATOM 368 C TRP A 357 -3.124 -2.343 5.266 1.00 0.00 C ATOM 369 O TRP A 357 -3.300 -2.797 4.149 1.00 0.00 O ATOM 370 CB TRP A 357 -1.169 -0.692 5.659 1.00 0.00 C ATOM 371 CG TRP A 357 -0.606 -1.766 6.520 1.00 0.00 C ATOM 372 CD1 TRP A 357 -0.593 -1.799 7.867 1.00 0.00 C ATOM 373 CD2 TRP A 357 -0.181 -3.077 6.071 1.00 0.00 C ATOM 374 NE1 TRP A 357 -0.217 -3.059 8.291 1.00 0.00 N ATOM 375 CE2 TRP A 357 0.023 -3.896 7.215 1.00 0.00 C ATOM 376 CE3 TRP A 357 -0.070 -3.676 4.799 1.00 0.00 C ATOM 377 CZ2 TRP A 357 0.332 -5.253 7.065 1.00 0.00 C ATOM 378 CZ3 TRP A 357 0.286 -5.026 4.658 1.00 0.00 C ATOM 379 CH2 TRP A 357 0.486 -5.802 5.801 1.00 0.00 C ATOM 0 H TRP A 357 -2.947 0.338 7.066 1.00 0.00 H new ATOM 0 HA TRP A 357 -2.825 -0.413 4.394 1.00 0.00 H new ATOM 0 HB2 TRP A 357 -0.627 -0.673 4.713 1.00 0.00 H new ATOM 0 HB3 TRP A 357 -1.005 0.272 6.140 1.00 0.00 H new ATOM 0 HD1 TRP A 357 -0.838 -0.970 8.514 1.00 0.00 H new ATOM 0 HE1 TRP A 357 -0.128 -3.336 9.269 1.00 0.00 H new ATOM 0 HE3 TRP A 357 -0.263 -3.084 3.916 1.00 0.00 H new ATOM 0 HZ2 TRP A 357 0.451 -5.876 7.939 1.00 0.00 H new ATOM 0 HZ3 TRP A 357 0.404 -5.460 3.676 1.00 0.00 H new ATOM 0 HH2 TRP A 357 0.764 -6.841 5.700 1.00 0.00 H new ATOM 390 N ARG A 358 -3.272 -3.124 6.360 1.00 0.00 N ATOM 391 CA ARG A 358 -3.872 -4.479 6.353 1.00 0.00 C ATOM 392 C ARG A 358 -5.116 -4.589 5.479 1.00 0.00 C ATOM 393 O ARG A 358 -5.197 -5.460 4.617 1.00 0.00 O ATOM 394 CB ARG A 358 -4.119 -5.104 7.745 1.00 0.00 C ATOM 395 CG ARG A 358 -2.826 -5.439 8.504 1.00 0.00 C ATOM 396 CD ARG A 358 -2.983 -6.514 9.597 1.00 0.00 C ATOM 397 NE ARG A 358 -3.137 -7.869 9.025 1.00 0.00 N ATOM 398 CZ ARG A 358 -2.561 -9.012 9.441 1.00 0.00 C ATOM 399 NH1 ARG A 358 -1.806 -9.072 10.532 1.00 0.00 N ATOM 400 NH2 ARG A 358 -2.737 -10.137 8.760 1.00 0.00 N ATOM 0 H ARG A 358 -2.973 -2.826 7.289 1.00 0.00 H new ATOM 0 HA ARG A 358 -3.087 -5.081 5.896 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -4.714 -4.415 8.344 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -4.708 -6.014 7.627 1.00 0.00 H new ATOM 0 HG2 ARG A 358 -2.077 -5.775 7.787 1.00 0.00 H new ATOM 0 HG3 ARG A 358 -2.443 -4.527 8.962 1.00 0.00 H new ATOM 0 HD2 ARG A 358 -2.112 -6.494 10.252 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -3.851 -6.280 10.213 1.00 0.00 H new ATOM 0 HE ARG A 358 -3.755 -7.947 8.217 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -1.645 -8.232 11.088 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -1.387 -9.958 10.814 1.00 0.00 H new ATOM 0 HH21 ARG A 358 -3.311 -10.138 7.917 1.00 0.00 H new ATOM 0 HH22 ARG A 358 -2.298 -11.001 9.080 1.00 0.00 H new ATOM 414 N HIS A 359 -6.107 -3.750 5.779 1.00 0.00 N ATOM 415 CA HIS A 359 -7.393 -3.705 5.091 1.00 0.00 C ATOM 416 C HIS A 359 -7.156 -3.527 3.592 1.00 0.00 C ATOM 417 O HIS A 359 -7.667 -4.295 2.778 1.00 0.00 O ATOM 418 CB HIS A 359 -8.252 -2.585 5.700 1.00 0.00 C ATOM 419 CG HIS A 359 -8.587 -2.797 7.162 1.00 0.00 C ATOM 420 ND1 HIS A 359 -7.809 -2.486 8.267 1.00 0.00 N ATOM 421 CD2 HIS A 359 -9.769 -3.308 7.627 1.00 0.00 C ATOM 422 CE1 HIS A 359 -8.530 -2.777 9.365 1.00 0.00 C ATOM 423 NE2 HIS A 359 -9.720 -3.300 9.021 1.00 0.00 N ATOM 0 H HIS A 359 -6.033 -3.063 6.530 1.00 0.00 H new ATOM 0 HA HIS A 359 -7.941 -4.638 5.221 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -7.726 -1.637 5.591 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -9.179 -2.502 5.133 1.00 0.00 H new ATOM 0 HD1 HIS A 359 -6.863 -2.106 8.250 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -10.593 -3.656 7.022 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -8.199 -2.613 10.380 1.00 0.00 H new ATOM 431 N LEU A 360 -6.326 -2.547 3.235 1.00 0.00 N ATOM 432 CA LEU A 360 -5.920 -2.292 1.868 1.00 0.00 C ATOM 433 C LEU A 360 -5.196 -3.496 1.252 1.00 0.00 C ATOM 434 O LEU A 360 -5.480 -3.835 0.113 1.00 0.00 O ATOM 435 CB LEU A 360 -5.041 -1.038 1.878 1.00 0.00 C ATOM 436 CG LEU A 360 -4.404 -0.730 0.521 1.00 0.00 C ATOM 437 CD1 LEU A 360 -5.463 -0.330 -0.505 1.00 0.00 C ATOM 438 CD2 LEU A 360 -3.408 0.401 0.715 1.00 0.00 C ATOM 0 H LEU A 360 -5.913 -1.900 3.907 1.00 0.00 H new ATOM 0 HA LEU A 360 -6.796 -2.129 1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 360 -5.643 -0.184 2.191 1.00 0.00 H new ATOM 0 HB3 LEU A 360 -4.253 -1.162 2.621 1.00 0.00 H new ATOM 0 HG LEU A 360 -3.902 -1.620 0.142 1.00 0.00 H new ATOM 0 HD11 LEU A 360 -4.982 -0.117 -1.460 1.00 0.00 H new ATOM 0 HD12 LEU A 360 -6.174 -1.146 -0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 360 -5.989 0.559 -0.157 1.00 0.00 H new ATOM 0 HD21 LEU A 360 -2.939 0.640 -0.239 1.00 0.00 H new ATOM 0 HD22 LEU A 360 -3.926 1.281 1.095 1.00 0.00 H new ATOM 0 HD23 LEU A 360 -2.643 0.094 1.428 1.00 0.00 H new ATOM 450 N ALA A 361 -4.244 -4.105 1.960 1.00 0.00 N ATOM 451 CA ALA A 361 -3.419 -5.224 1.521 1.00 0.00 C ATOM 452 C ALA A 361 -4.288 -6.357 0.968 1.00 0.00 C ATOM 453 O ALA A 361 -4.026 -6.845 -0.131 1.00 0.00 O ATOM 454 CB ALA A 361 -2.484 -5.667 2.663 1.00 0.00 C ATOM 0 H ALA A 361 -4.017 -3.811 2.910 1.00 0.00 H new ATOM 0 HA ALA A 361 -2.781 -4.909 0.696 1.00 0.00 H new ATOM 0 HB1 ALA A 361 -1.871 -6.503 2.327 1.00 0.00 H new ATOM 0 HB2 ALA A 361 -1.839 -4.836 2.948 1.00 0.00 H new ATOM 0 HB3 ALA A 361 -3.080 -5.976 3.522 1.00 0.00 H new ATOM 460 N GLY A 362 -5.330 -6.749 1.706 1.00 0.00 N ATOM 461 CA GLY A 362 -6.284 -7.747 1.244 1.00 0.00 C ATOM 462 C GLY A 362 -7.015 -7.278 -0.008 1.00 0.00 C ATOM 463 O GLY A 362 -7.095 -8.008 -0.997 1.00 0.00 O ATOM 0 H GLY A 362 -5.531 -6.382 2.636 1.00 0.00 H new ATOM 0 HA2 GLY A 362 -5.763 -8.681 1.035 1.00 0.00 H new ATOM 0 HA3 GLY A 362 -7.007 -7.955 2.033 1.00 0.00 H new ATOM 467 N GLU A 363 -7.516 -6.040 0.009 1.00 0.00 N ATOM 468 CA GLU A 363 -8.234 -5.461 -1.120 1.00 0.00 C ATOM 469 C GLU A 363 -7.339 -5.299 -2.364 1.00 0.00 C ATOM 470 O GLU A 363 -7.860 -5.132 -3.472 1.00 0.00 O ATOM 471 CB GLU A 363 -8.860 -4.122 -0.679 1.00 0.00 C ATOM 472 CG GLU A 363 -10.053 -4.294 0.282 1.00 0.00 C ATOM 473 CD GLU A 363 -11.307 -4.770 -0.456 1.00 0.00 C ATOM 474 OE1 GLU A 363 -11.345 -5.941 -0.888 1.00 0.00 O ATOM 475 OE2 GLU A 363 -12.174 -3.928 -0.784 1.00 0.00 O ATOM 0 H GLU A 363 -7.433 -5.413 0.809 1.00 0.00 H new ATOM 0 HA GLU A 363 -9.027 -6.146 -1.421 1.00 0.00 H new ATOM 0 HB2 GLU A 363 -8.096 -3.514 -0.194 1.00 0.00 H new ATOM 0 HB3 GLU A 363 -9.190 -3.575 -1.562 1.00 0.00 H new ATOM 0 HG2 GLU A 363 -9.794 -5.012 1.060 1.00 0.00 H new ATOM 0 HG3 GLU A 363 -10.260 -3.346 0.779 1.00 0.00 H new ATOM 482 N LEU A 364 -6.011 -5.363 -2.208 1.00 0.00 N ATOM 483 CA LEU A 364 -5.000 -5.369 -3.262 1.00 0.00 C ATOM 484 C LEU A 364 -4.621 -6.781 -3.725 1.00 0.00 C ATOM 485 O LEU A 364 -3.548 -6.968 -4.302 1.00 0.00 O ATOM 486 CB LEU A 364 -3.764 -4.582 -2.781 1.00 0.00 C ATOM 487 CG LEU A 364 -3.967 -3.061 -2.738 1.00 0.00 C ATOM 488 CD1 LEU A 364 -2.658 -2.399 -2.300 1.00 0.00 C ATOM 489 CD2 LEU A 364 -4.408 -2.514 -4.100 1.00 0.00 C ATOM 0 H LEU A 364 -5.591 -5.415 -1.280 1.00 0.00 H new ATOM 0 HA LEU A 364 -5.427 -4.882 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 364 -3.490 -4.930 -1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 364 -2.925 -4.807 -3.439 1.00 0.00 H new ATOM 0 HG LEU A 364 -4.759 -2.833 -2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 364 -2.791 -1.318 -2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 364 -2.380 -2.762 -1.310 1.00 0.00 H new ATOM 0 HD13 LEU A 364 -1.870 -2.646 -3.011 1.00 0.00 H new ATOM 0 HD21 LEU A 364 -4.542 -1.434 -4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 364 -3.646 -2.739 -4.846 1.00 0.00 H new ATOM 0 HD23 LEU A 364 -5.350 -2.979 -4.391 1.00 0.00 H new ATOM 501 N GLY A 365 -5.543 -7.740 -3.623 1.00 0.00 N ATOM 502 CA GLY A 365 -5.339 -9.117 -4.053 1.00 0.00 C ATOM 503 C GLY A 365 -4.092 -9.798 -3.514 1.00 0.00 C ATOM 504 O GLY A 365 -3.506 -10.615 -4.224 1.00 0.00 O ATOM 0 H GLY A 365 -6.470 -7.574 -3.231 1.00 0.00 H new ATOM 0 HA2 GLY A 365 -6.208 -9.704 -3.756 1.00 0.00 H new ATOM 0 HA3 GLY A 365 -5.299 -9.136 -5.142 1.00 0.00 H new ATOM 508 N TYR A 366 -3.749 -9.559 -2.248 1.00 0.00 N ATOM 509 CA TYR A 366 -2.804 -10.394 -1.530 1.00 0.00 C ATOM 510 C TYR A 366 -3.568 -11.190 -0.481 1.00 0.00 C ATOM 511 O TYR A 366 -4.304 -10.624 0.328 1.00 0.00 O ATOM 512 CB TYR A 366 -1.680 -9.544 -0.935 1.00 0.00 C ATOM 513 CG TYR A 366 -0.578 -9.201 -1.927 1.00 0.00 C ATOM 514 CD1 TYR A 366 0.108 -10.237 -2.592 1.00 0.00 C ATOM 515 CD2 TYR A 366 -0.157 -7.868 -2.071 1.00 0.00 C ATOM 516 CE1 TYR A 366 1.206 -9.946 -3.414 1.00 0.00 C ATOM 517 CE2 TYR A 366 0.977 -7.582 -2.844 1.00 0.00 C ATOM 518 CZ TYR A 366 1.648 -8.614 -3.530 1.00 0.00 C ATOM 519 OH TYR A 366 2.768 -8.328 -4.244 1.00 0.00 O ATOM 0 H TYR A 366 -4.120 -8.783 -1.699 1.00 0.00 H new ATOM 0 HA TYR A 366 -2.319 -11.099 -2.206 1.00 0.00 H new ATOM 0 HB2 TYR A 366 -2.105 -8.619 -0.544 1.00 0.00 H new ATOM 0 HB3 TYR A 366 -1.243 -10.076 -0.090 1.00 0.00 H new ATOM 0 HD1 TYR A 366 -0.214 -11.260 -2.468 1.00 0.00 H new ATOM 0 HD2 TYR A 366 -0.703 -7.070 -1.590 1.00 0.00 H new ATOM 0 HE1 TYR A 366 1.708 -10.736 -3.953 1.00 0.00 H new ATOM 0 HE2 TYR A 366 1.338 -6.566 -2.914 1.00 0.00 H new ATOM 0 HH TYR A 366 3.008 -9.099 -4.799 1.00 0.00 H new ATOM 529 N GLN A 367 -3.438 -12.519 -0.546 1.00 0.00 N ATOM 530 CA GLN A 367 -4.016 -13.445 0.423 1.00 0.00 C ATOM 531 C GLN A 367 -3.648 -13.048 1.865 1.00 0.00 C ATOM 532 O GLN A 367 -2.594 -12.439 2.075 1.00 0.00 O ATOM 533 CB GLN A 367 -3.519 -14.868 0.100 1.00 0.00 C ATOM 534 CG GLN A 367 -4.598 -15.717 -0.586 1.00 0.00 C ATOM 535 CD GLN A 367 -4.195 -17.185 -0.727 1.00 0.00 C ATOM 536 OE1 GLN A 367 -4.162 -17.718 -1.830 1.00 0.00 O ATOM 537 NE2 GLN A 367 -3.911 -17.871 0.367 1.00 0.00 N ATOM 0 H GLN A 367 -2.918 -12.986 -1.289 1.00 0.00 H new ATOM 0 HA GLN A 367 -5.103 -13.410 0.352 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -2.642 -14.807 -0.545 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -3.204 -15.359 1.021 1.00 0.00 H new ATOM 0 HG2 GLN A 367 -5.523 -15.652 -0.014 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -4.805 -15.305 -1.574 1.00 0.00 H new ATOM 0 HE21 GLN A 367 -3.943 -17.414 1.278 1.00 0.00 H new ATOM 0 HE22 GLN A 367 -3.660 -18.857 0.300 1.00 0.00 H new ATOM 546 N PRO A 368 -4.417 -13.487 2.880 1.00 0.00 N ATOM 547 CA PRO A 368 -4.205 -13.055 4.254 1.00 0.00 C ATOM 548 C PRO A 368 -2.863 -13.520 4.815 1.00 0.00 C ATOM 549 O PRO A 368 -2.300 -12.816 5.652 1.00 0.00 O ATOM 550 CB PRO A 368 -5.399 -13.579 5.057 1.00 0.00 C ATOM 551 CG PRO A 368 -5.921 -14.747 4.224 1.00 0.00 C ATOM 552 CD PRO A 368 -5.600 -14.329 2.790 1.00 0.00 C ATOM 0 HA PRO A 368 -4.151 -11.968 4.314 1.00 0.00 H new ATOM 0 HB2 PRO A 368 -5.099 -13.902 6.054 1.00 0.00 H new ATOM 0 HB3 PRO A 368 -6.161 -12.810 5.187 1.00 0.00 H new ATOM 0 HG2 PRO A 368 -5.428 -15.682 4.490 1.00 0.00 H new ATOM 0 HG3 PRO A 368 -6.991 -14.898 4.369 1.00 0.00 H new ATOM 0 HD2 PRO A 368 -5.414 -15.199 2.161 1.00 0.00 H new ATOM 0 HD3 PRO A 368 -6.434 -13.786 2.345 1.00 0.00 H new ATOM 560 N GLU A 369 -2.325 -14.640 4.332 1.00 0.00 N ATOM 561 CA GLU A 369 -1.004 -15.133 4.691 1.00 0.00 C ATOM 562 C GLU A 369 0.075 -14.124 4.282 1.00 0.00 C ATOM 563 O GLU A 369 0.996 -13.874 5.055 1.00 0.00 O ATOM 564 CB GLU A 369 -0.743 -16.506 4.043 1.00 0.00 C ATOM 565 CG GLU A 369 -1.759 -17.599 4.431 1.00 0.00 C ATOM 566 CD GLU A 369 -2.900 -17.774 3.416 1.00 0.00 C ATOM 567 OE1 GLU A 369 -3.491 -16.758 2.978 1.00 0.00 O ATOM 568 OE2 GLU A 369 -3.193 -18.927 3.042 1.00 0.00 O ATOM 0 H GLU A 369 -2.810 -15.240 3.665 1.00 0.00 H new ATOM 0 HA GLU A 369 -0.964 -15.256 5.773 1.00 0.00 H new ATOM 0 HB2 GLU A 369 -0.750 -16.389 2.959 1.00 0.00 H new ATOM 0 HB3 GLU A 369 0.256 -16.841 4.321 1.00 0.00 H new ATOM 0 HG2 GLU A 369 -1.234 -18.548 4.540 1.00 0.00 H new ATOM 0 HG3 GLU A 369 -2.185 -17.357 5.404 1.00 0.00 H new ATOM 575 N HIS A 370 -0.050 -13.498 3.105 1.00 0.00 N ATOM 576 CA HIS A 370 0.870 -12.444 2.686 1.00 0.00 C ATOM 577 C HIS A 370 0.675 -11.193 3.534 1.00 0.00 C ATOM 578 O HIS A 370 1.663 -10.569 3.906 1.00 0.00 O ATOM 579 CB HIS A 370 0.721 -12.112 1.194 1.00 0.00 C ATOM 580 CG HIS A 370 1.632 -12.941 0.328 1.00 0.00 C ATOM 581 ND1 HIS A 370 2.998 -12.780 0.225 1.00 0.00 N ATOM 582 CD2 HIS A 370 1.270 -13.988 -0.475 1.00 0.00 C ATOM 583 CE1 HIS A 370 3.446 -13.714 -0.630 1.00 0.00 C ATOM 584 NE2 HIS A 370 2.431 -14.468 -1.087 1.00 0.00 N ATOM 0 H HIS A 370 -0.783 -13.707 2.427 1.00 0.00 H new ATOM 0 HA HIS A 370 1.883 -12.818 2.838 1.00 0.00 H new ATOM 0 HB2 HIS A 370 -0.313 -12.275 0.890 1.00 0.00 H new ATOM 0 HB3 HIS A 370 0.937 -11.055 1.036 1.00 0.00 H new ATOM 0 HD2 HIS A 370 0.270 -14.373 -0.611 1.00 0.00 H new ATOM 0 HE1 HIS A 370 4.481 -13.842 -0.912 1.00 0.00 H new ATOM 0 HE2 HIS A 370 2.496 -15.240 -1.751 1.00 0.00 H new ATOM 592 N ILE A 371 -0.566 -10.824 3.874 1.00 0.00 N ATOM 593 CA ILE A 371 -0.805 -9.680 4.755 1.00 0.00 C ATOM 594 C ILE A 371 -0.098 -9.934 6.093 1.00 0.00 C ATOM 595 O ILE A 371 0.470 -9.010 6.675 1.00 0.00 O ATOM 596 CB ILE A 371 -2.311 -9.395 4.962 1.00 0.00 C ATOM 597 CG1 ILE A 371 -3.106 -9.341 3.640 1.00 0.00 C ATOM 598 CG2 ILE A 371 -2.482 -8.058 5.710 1.00 0.00 C ATOM 599 CD1 ILE A 371 -4.619 -9.261 3.862 1.00 0.00 C ATOM 0 H ILE A 371 -1.411 -11.297 3.555 1.00 0.00 H new ATOM 0 HA ILE A 371 -0.396 -8.787 4.282 1.00 0.00 H new ATOM 0 HB ILE A 371 -2.712 -10.224 5.545 1.00 0.00 H new ATOM 0 HG12 ILE A 371 -2.782 -8.476 3.061 1.00 0.00 H new ATOM 0 HG13 ILE A 371 -2.876 -10.226 3.047 1.00 0.00 H new ATOM 0 HG21 ILE A 371 -3.543 -7.856 5.856 1.00 0.00 H new ATOM 0 HG22 ILE A 371 -1.987 -8.117 6.679 1.00 0.00 H new ATOM 0 HG23 ILE A 371 -2.037 -7.254 5.124 1.00 0.00 H new ATOM 0 HD11 ILE A 371 -5.127 -9.225 2.898 1.00 0.00 H new ATOM 0 HD12 ILE A 371 -4.952 -10.139 4.416 1.00 0.00 H new ATOM 0 HD13 ILE A 371 -4.856 -8.362 4.430 1.00 0.00 H new ATOM 611 N ASP A 372 -0.134 -11.167 6.600 1.00 0.00 N ATOM 612 CA ASP A 372 0.561 -11.478 7.839 1.00 0.00 C ATOM 613 C ASP A 372 2.075 -11.474 7.642 1.00 0.00 C ATOM 614 O ASP A 372 2.782 -10.904 8.473 1.00 0.00 O ATOM 615 CB ASP A 372 0.044 -12.761 8.500 1.00 0.00 C ATOM 616 CG ASP A 372 -0.157 -12.480 9.989 1.00 0.00 C ATOM 617 OD1 ASP A 372 -1.114 -11.719 10.287 1.00 0.00 O ATOM 618 OD2 ASP A 372 0.649 -12.951 10.811 1.00 0.00 O ATOM 0 H ASP A 372 -0.630 -11.952 6.177 1.00 0.00 H new ATOM 0 HA ASP A 372 0.334 -10.680 8.546 1.00 0.00 H new ATOM 0 HB2 ASP A 372 -0.894 -13.074 8.042 1.00 0.00 H new ATOM 0 HB3 ASP A 372 0.755 -13.575 8.359 1.00 0.00 H new ATOM 623 N SER A 373 2.594 -12.008 6.525 1.00 0.00 N ATOM 624 CA SER A 373 4.039 -11.989 6.295 1.00 0.00 C ATOM 625 C SER A 373 4.565 -10.585 6.006 1.00 0.00 C ATOM 626 O SER A 373 5.700 -10.276 6.352 1.00 0.00 O ATOM 627 CB SER A 373 4.354 -12.908 5.102 1.00 0.00 C ATOM 628 OG SER A 373 5.741 -13.102 4.893 1.00 0.00 O ATOM 0 H SER A 373 2.046 -12.448 5.785 1.00 0.00 H new ATOM 0 HA SER A 373 4.532 -12.337 7.203 1.00 0.00 H new ATOM 0 HB2 SER A 373 3.879 -13.876 5.263 1.00 0.00 H new ATOM 0 HB3 SER A 373 3.914 -12.484 4.200 1.00 0.00 H new ATOM 0 HG SER A 373 6.141 -12.272 4.558 1.00 0.00 H new ATOM 634 N PHE A 374 3.682 -9.632 5.748 1.00 0.00 N ATOM 635 CA PHE A 374 4.089 -8.278 5.402 1.00 0.00 C ATOM 636 C PHE A 374 4.246 -7.494 6.701 1.00 0.00 C ATOM 637 O PHE A 374 5.072 -6.589 6.762 1.00 0.00 O ATOM 638 CB PHE A 374 3.021 -7.596 4.527 1.00 0.00 C ATOM 639 CG PHE A 374 3.115 -7.678 3.015 1.00 0.00 C ATOM 640 CD1 PHE A 374 4.342 -7.518 2.339 1.00 0.00 C ATOM 641 CD2 PHE A 374 1.942 -7.849 2.251 1.00 0.00 C ATOM 642 CE1 PHE A 374 4.389 -7.526 0.931 1.00 0.00 C ATOM 643 CE2 PHE A 374 1.990 -7.854 0.844 1.00 0.00 C ATOM 644 CZ PHE A 374 3.211 -7.674 0.173 1.00 0.00 C ATOM 0 H PHE A 374 2.672 -9.773 5.772 1.00 0.00 H new ATOM 0 HA PHE A 374 5.024 -8.307 4.842 1.00 0.00 H new ATOM 0 HB2 PHE A 374 2.054 -8.009 4.815 1.00 0.00 H new ATOM 0 HB3 PHE A 374 3.009 -6.539 4.794 1.00 0.00 H new ATOM 0 HD1 PHE A 374 5.253 -7.388 2.905 1.00 0.00 H new ATOM 0 HD2 PHE A 374 0.994 -7.978 2.752 1.00 0.00 H new ATOM 0 HE1 PHE A 374 5.338 -7.418 0.427 1.00 0.00 H new ATOM 0 HE2 PHE A 374 1.082 -7.997 0.277 1.00 0.00 H new ATOM 0 HZ PHE A 374 3.246 -7.649 -0.906 1.00 0.00 H new ATOM 654 N THR A 375 3.497 -7.832 7.758 1.00 0.00 N ATOM 655 CA THR A 375 3.739 -7.240 9.066 1.00 0.00 C ATOM 656 C THR A 375 4.883 -7.953 9.816 1.00 0.00 C ATOM 657 O THR A 375 5.271 -7.463 10.878 1.00 0.00 O ATOM 658 CB THR A 375 2.435 -7.128 9.874 1.00 0.00 C ATOM 659 OG1 THR A 375 2.632 -6.402 11.069 1.00 0.00 O ATOM 660 CG2 THR A 375 1.746 -8.452 10.192 1.00 0.00 C ATOM 0 H THR A 375 2.730 -8.504 7.728 1.00 0.00 H new ATOM 0 HA THR A 375 4.089 -6.218 8.921 1.00 0.00 H new ATOM 0 HB THR A 375 1.760 -6.591 9.207 1.00 0.00 H new ATOM 0 HG1 THR A 375 3.549 -6.537 11.386 1.00 0.00 H new ATOM 0 HG21 THR A 375 0.838 -8.261 10.764 1.00 0.00 H new ATOM 0 HG22 THR A 375 1.490 -8.961 9.263 1.00 0.00 H new ATOM 0 HG23 THR A 375 2.418 -9.080 10.777 1.00 0.00 H new ATOM 668 N HIS A 376 5.391 -9.087 9.318 1.00 0.00 N ATOM 669 CA HIS A 376 6.579 -9.765 9.835 1.00 0.00 C ATOM 670 C HIS A 376 7.842 -9.275 9.122 1.00 0.00 C ATOM 671 O HIS A 376 8.904 -9.186 9.741 1.00 0.00 O ATOM 672 CB HIS A 376 6.436 -11.287 9.707 1.00 0.00 C ATOM 673 CG HIS A 376 5.530 -11.890 10.752 1.00 0.00 C ATOM 674 ND1 HIS A 376 4.161 -12.016 10.681 1.00 0.00 N ATOM 675 CD2 HIS A 376 5.929 -12.412 11.953 1.00 0.00 C ATOM 676 CE1 HIS A 376 3.747 -12.614 11.812 1.00 0.00 C ATOM 677 NE2 HIS A 376 4.791 -12.871 12.622 1.00 0.00 N ATOM 0 H HIS A 376 4.973 -9.569 8.522 1.00 0.00 H new ATOM 0 HA HIS A 376 6.674 -9.521 10.893 1.00 0.00 H new ATOM 0 HB2 HIS A 376 6.048 -11.527 8.717 1.00 0.00 H new ATOM 0 HB3 HIS A 376 7.422 -11.745 9.782 1.00 0.00 H new ATOM 0 HD1 HIS A 376 3.568 -11.711 9.910 1.00 0.00 H new ATOM 0 HD2 HIS A 376 6.944 -12.461 12.319 1.00 0.00 H new ATOM 0 HE1 HIS A 376 2.719 -12.855 12.039 1.00 0.00 H new ATOM 685 N GLU A 377 7.757 -9.034 7.812 1.00 0.00 N ATOM 686 CA GLU A 377 8.822 -8.449 7.012 1.00 0.00 C ATOM 687 C GLU A 377 9.177 -7.050 7.548 1.00 0.00 C ATOM 688 O GLU A 377 8.447 -6.469 8.351 1.00 0.00 O ATOM 689 CB GLU A 377 8.363 -8.411 5.541 1.00 0.00 C ATOM 690 CG GLU A 377 8.395 -9.803 4.875 1.00 0.00 C ATOM 691 CD GLU A 377 7.394 -9.934 3.716 1.00 0.00 C ATOM 692 OE1 GLU A 377 7.328 -8.981 2.905 1.00 0.00 O ATOM 693 OE2 GLU A 377 6.717 -10.990 3.635 1.00 0.00 O ATOM 0 H GLU A 377 6.921 -9.248 7.269 1.00 0.00 H new ATOM 0 HA GLU A 377 9.728 -9.051 7.076 1.00 0.00 H new ATOM 0 HB2 GLU A 377 7.350 -8.011 5.490 1.00 0.00 H new ATOM 0 HB3 GLU A 377 9.004 -7.729 4.981 1.00 0.00 H new ATOM 0 HG2 GLU A 377 9.401 -10.000 4.504 1.00 0.00 H new ATOM 0 HG3 GLU A 377 8.177 -10.564 5.624 1.00 0.00 H new ATOM 700 N ALA A 378 10.297 -6.490 7.062 1.00 0.00 N ATOM 701 CA ALA A 378 11.040 -5.407 7.716 1.00 0.00 C ATOM 702 C ALA A 378 10.139 -4.276 8.218 1.00 0.00 C ATOM 703 O ALA A 378 10.256 -3.854 9.367 1.00 0.00 O ATOM 704 CB ALA A 378 12.125 -4.878 6.769 1.00 0.00 C ATOM 0 H ALA A 378 10.719 -6.787 6.182 1.00 0.00 H new ATOM 0 HA ALA A 378 11.510 -5.825 8.606 1.00 0.00 H new ATOM 0 HB1 ALA A 378 12.675 -4.074 7.258 1.00 0.00 H new ATOM 0 HB2 ALA A 378 12.812 -5.685 6.516 1.00 0.00 H new ATOM 0 HB3 ALA A 378 11.660 -4.498 5.859 1.00 0.00 H new ATOM 710 N CYS A 379 9.268 -3.777 7.342 1.00 0.00 N ATOM 711 CA CYS A 379 8.060 -3.048 7.688 1.00 0.00 C ATOM 712 C CYS A 379 7.040 -3.435 6.607 1.00 0.00 C ATOM 713 O CYS A 379 7.479 -3.602 5.463 1.00 0.00 O ATOM 714 CB CYS A 379 8.263 -1.519 7.660 1.00 0.00 C ATOM 715 SG CYS A 379 9.681 -0.946 8.638 1.00 0.00 S ATOM 0 H CYS A 379 9.394 -3.876 6.335 1.00 0.00 H new ATOM 0 HA CYS A 379 7.745 -3.298 8.701 1.00 0.00 H new ATOM 0 HB2 CYS A 379 8.394 -1.199 6.626 1.00 0.00 H new ATOM 0 HB3 CYS A 379 7.359 -1.036 8.031 1.00 0.00 H new ATOM 0 HG CYS A 379 10.222 -1.957 9.251 1.00 0.00 H new ATOM 721 N PRO A 380 5.721 -3.438 6.894 1.00 0.00 N ATOM 722 CA PRO A 380 4.667 -3.663 5.905 1.00 0.00 C ATOM 723 C PRO A 380 4.814 -2.686 4.761 1.00 0.00 C ATOM 724 O PRO A 380 5.356 -3.079 3.742 1.00 0.00 O ATOM 725 CB PRO A 380 3.339 -3.609 6.662 1.00 0.00 C ATOM 726 CG PRO A 380 3.667 -2.876 7.960 1.00 0.00 C ATOM 727 CD PRO A 380 5.131 -3.235 8.209 1.00 0.00 C ATOM 0 HA PRO A 380 4.726 -4.638 5.422 1.00 0.00 H new ATOM 0 HB2 PRO A 380 2.577 -3.080 6.089 1.00 0.00 H new ATOM 0 HB3 PRO A 380 2.953 -4.609 6.858 1.00 0.00 H new ATOM 0 HG2 PRO A 380 3.529 -1.799 7.860 1.00 0.00 H new ATOM 0 HG3 PRO A 380 3.028 -3.204 8.780 1.00 0.00 H new ATOM 0 HD2 PRO A 380 5.643 -2.437 8.748 1.00 0.00 H new ATOM 0 HD3 PRO A 380 5.214 -4.135 8.818 1.00 0.00 H new ATOM 735 N VAL A 381 4.368 -1.436 4.882 1.00 0.00 N ATOM 736 CA VAL A 381 4.471 -0.446 3.811 1.00 0.00 C ATOM 737 C VAL A 381 5.822 -0.456 3.050 1.00 0.00 C ATOM 738 O VAL A 381 5.812 -0.290 1.833 1.00 0.00 O ATOM 739 CB VAL A 381 3.939 0.916 4.289 1.00 0.00 C ATOM 740 CG1 VAL A 381 4.069 2.005 3.217 1.00 0.00 C ATOM 741 CG2 VAL A 381 2.450 0.805 4.644 1.00 0.00 C ATOM 0 H VAL A 381 3.924 -1.081 5.729 1.00 0.00 H new ATOM 0 HA VAL A 381 3.804 -0.742 3.001 1.00 0.00 H new ATOM 0 HB VAL A 381 4.540 1.192 5.156 1.00 0.00 H new ATOM 0 HG11 VAL A 381 3.679 2.946 3.605 1.00 0.00 H new ATOM 0 HG12 VAL A 381 5.118 2.129 2.950 1.00 0.00 H new ATOM 0 HG13 VAL A 381 3.502 1.715 2.333 1.00 0.00 H new ATOM 0 HG21 VAL A 381 2.083 1.774 4.981 1.00 0.00 H new ATOM 0 HG22 VAL A 381 1.889 0.491 3.764 1.00 0.00 H new ATOM 0 HG23 VAL A 381 2.319 0.071 5.439 1.00 0.00 H new ATOM 751 N ARG A 382 6.973 -0.738 3.682 1.00 0.00 N ATOM 752 CA ARG A 382 8.228 -0.871 2.930 1.00 0.00 C ATOM 753 C ARG A 382 8.199 -2.080 1.995 1.00 0.00 C ATOM 754 O ARG A 382 8.313 -1.896 0.781 1.00 0.00 O ATOM 755 CB ARG A 382 9.457 -0.922 3.858 1.00 0.00 C ATOM 756 CG ARG A 382 9.683 0.448 4.506 1.00 0.00 C ATOM 757 CD ARG A 382 10.950 0.550 5.365 1.00 0.00 C ATOM 758 NE ARG A 382 10.962 1.850 6.050 1.00 0.00 N ATOM 759 CZ ARG A 382 11.651 2.955 5.742 1.00 0.00 C ATOM 760 NH1 ARG A 382 12.717 2.940 4.947 1.00 0.00 N ATOM 761 NH2 ARG A 382 11.259 4.113 6.241 1.00 0.00 N ATOM 0 H ARG A 382 7.060 -0.875 4.689 1.00 0.00 H new ATOM 0 HA ARG A 382 8.320 0.025 2.316 1.00 0.00 H new ATOM 0 HB2 ARG A 382 9.309 -1.678 4.629 1.00 0.00 H new ATOM 0 HB3 ARG A 382 10.340 -1.215 3.290 1.00 0.00 H new ATOM 0 HG2 ARG A 382 9.731 1.203 3.721 1.00 0.00 H new ATOM 0 HG3 ARG A 382 8.820 0.688 5.126 1.00 0.00 H new ATOM 0 HD2 ARG A 382 10.976 -0.260 6.094 1.00 0.00 H new ATOM 0 HD3 ARG A 382 11.837 0.446 4.741 1.00 0.00 H new ATOM 0 HE ARG A 382 10.363 1.920 6.873 1.00 0.00 H new ATOM 0 HH11 ARG A 382 13.040 2.061 4.544 1.00 0.00 H new ATOM 0 HH12 ARG A 382 13.211 3.808 4.740 1.00 0.00 H new ATOM 0 HH21 ARG A 382 10.443 4.155 6.851 1.00 0.00 H new ATOM 0 HH22 ARG A 382 11.773 4.965 6.017 1.00 0.00 H new ATOM 775 N ALA A 383 8.052 -3.304 2.517 1.00 0.00 N ATOM 776 CA ALA A 383 8.101 -4.477 1.643 1.00 0.00 C ATOM 777 C ALA A 383 6.814 -4.628 0.821 1.00 0.00 C ATOM 778 O ALA A 383 6.825 -5.278 -0.221 1.00 0.00 O ATOM 779 CB ALA A 383 8.302 -5.729 2.506 1.00 0.00 C ATOM 0 H ALA A 383 7.903 -3.503 3.506 1.00 0.00 H new ATOM 0 HA ALA A 383 8.929 -4.350 0.946 1.00 0.00 H new ATOM 0 HB1 ALA A 383 8.340 -6.610 1.865 1.00 0.00 H new ATOM 0 HB2 ALA A 383 9.237 -5.643 3.060 1.00 0.00 H new ATOM 0 HB3 ALA A 383 7.472 -5.825 3.206 1.00 0.00 H new ATOM 785 N LEU A 384 5.768 -3.880 1.159 1.00 0.00 N ATOM 786 CA LEU A 384 4.483 -3.824 0.489 1.00 0.00 C ATOM 787 C LEU A 384 4.624 -3.010 -0.777 1.00 0.00 C ATOM 788 O LEU A 384 4.184 -3.453 -1.827 1.00 0.00 O ATOM 789 CB LEU A 384 3.486 -3.143 1.427 1.00 0.00 C ATOM 790 CG LEU A 384 2.025 -3.050 0.978 1.00 0.00 C ATOM 791 CD1 LEU A 384 1.397 -4.442 1.043 1.00 0.00 C ATOM 792 CD2 LEU A 384 1.322 -2.093 1.946 1.00 0.00 C ATOM 0 H LEU A 384 5.804 -3.256 1.965 1.00 0.00 H new ATOM 0 HA LEU A 384 4.136 -4.826 0.237 1.00 0.00 H new ATOM 0 HB2 LEU A 384 3.509 -3.672 2.380 1.00 0.00 H new ATOM 0 HB3 LEU A 384 3.843 -2.130 1.615 1.00 0.00 H new ATOM 0 HG LEU A 384 1.936 -2.683 -0.045 1.00 0.00 H new ATOM 0 HD11 LEU A 384 0.356 -4.387 0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 384 1.942 -5.118 0.384 1.00 0.00 H new ATOM 0 HD13 LEU A 384 1.445 -4.815 2.066 1.00 0.00 H new ATOM 0 HD21 LEU A 384 0.274 -1.995 1.664 1.00 0.00 H new ATOM 0 HD22 LEU A 384 1.390 -2.487 2.960 1.00 0.00 H new ATOM 0 HD23 LEU A 384 1.802 -1.115 1.904 1.00 0.00 H new ATOM 804 N LEU A 385 5.233 -1.823 -0.711 1.00 0.00 N ATOM 805 CA LEU A 385 5.332 -0.980 -1.896 1.00 0.00 C ATOM 806 C LEU A 385 6.453 -1.470 -2.807 1.00 0.00 C ATOM 807 O LEU A 385 6.412 -1.163 -3.997 1.00 0.00 O ATOM 808 CB LEU A 385 5.530 0.502 -1.517 1.00 0.00 C ATOM 809 CG LEU A 385 4.366 1.067 -0.675 1.00 0.00 C ATOM 810 CD1 LEU A 385 4.700 2.515 -0.307 1.00 0.00 C ATOM 811 CD2 LEU A 385 3.003 0.923 -1.365 1.00 0.00 C ATOM 0 H LEU A 385 5.655 -1.434 0.132 1.00 0.00 H new ATOM 0 HA LEU A 385 4.391 -1.052 -2.442 1.00 0.00 H new ATOM 0 HB2 LEU A 385 6.460 0.608 -0.959 1.00 0.00 H new ATOM 0 HB3 LEU A 385 5.635 1.094 -2.426 1.00 0.00 H new ATOM 0 HG LEU A 385 4.265 0.479 0.237 1.00 0.00 H new ATOM 0 HD11 LEU A 385 3.890 2.935 0.289 1.00 0.00 H new ATOM 0 HD12 LEU A 385 5.625 2.540 0.269 1.00 0.00 H new ATOM 0 HD13 LEU A 385 4.823 3.102 -1.217 1.00 0.00 H new ATOM 0 HD21 LEU A 385 2.225 1.338 -0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 385 3.017 1.460 -2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 385 2.798 -0.132 -1.548 1.00 0.00 H new ATOM 823 N ALA A 386 7.407 -2.254 -2.289 1.00 0.00 N ATOM 824 CA ALA A 386 8.376 -2.946 -3.125 1.00 0.00 C ATOM 825 C ALA A 386 7.747 -4.157 -3.826 1.00 0.00 C ATOM 826 O ALA A 386 7.984 -4.340 -5.016 1.00 0.00 O ATOM 827 CB ALA A 386 9.556 -3.396 -2.257 1.00 0.00 C ATOM 0 H ALA A 386 7.522 -2.421 -1.289 1.00 0.00 H new ATOM 0 HA ALA A 386 8.722 -2.260 -3.898 1.00 0.00 H new ATOM 0 HB1 ALA A 386 10.286 -3.916 -2.877 1.00 0.00 H new ATOM 0 HB2 ALA A 386 10.024 -2.525 -1.798 1.00 0.00 H new ATOM 0 HB3 ALA A 386 9.198 -4.068 -1.477 1.00 0.00 H new ATOM 833 N SER A 387 6.912 -4.939 -3.133 1.00 0.00 N ATOM 834 CA SER A 387 6.408 -6.205 -3.663 1.00 0.00 C ATOM 835 C SER A 387 5.123 -5.985 -4.448 1.00 0.00 C ATOM 836 O SER A 387 5.029 -6.438 -5.588 1.00 0.00 O ATOM 837 CB SER A 387 6.198 -7.232 -2.548 1.00 0.00 C ATOM 838 OG SER A 387 7.386 -7.374 -1.797 1.00 0.00 O ATOM 0 H SER A 387 6.571 -4.713 -2.199 1.00 0.00 H new ATOM 0 HA SER A 387 7.160 -6.606 -4.342 1.00 0.00 H new ATOM 0 HB2 SER A 387 5.382 -6.915 -1.898 1.00 0.00 H new ATOM 0 HB3 SER A 387 5.910 -8.193 -2.975 1.00 0.00 H new ATOM 0 HG SER A 387 7.351 -6.785 -1.014 1.00 0.00 H new ATOM 844 N TRP A 388 4.147 -5.254 -3.889 1.00 0.00 N ATOM 845 CA TRP A 388 2.958 -4.901 -4.649 1.00 0.00 C ATOM 846 C TRP A 388 3.401 -4.107 -5.876 1.00 0.00 C ATOM 847 O TRP A 388 2.946 -4.380 -6.977 1.00 0.00 O ATOM 848 CB TRP A 388 1.949 -4.062 -3.848 1.00 0.00 C ATOM 849 CG TRP A 388 0.635 -3.886 -4.558 1.00 0.00 C ATOM 850 CD1 TRP A 388 -0.285 -4.854 -4.804 1.00 0.00 C ATOM 851 CD2 TRP A 388 0.110 -2.679 -5.191 1.00 0.00 C ATOM 852 NE1 TRP A 388 -1.320 -4.334 -5.559 1.00 0.00 N ATOM 853 CE2 TRP A 388 -1.135 -3.004 -5.805 1.00 0.00 C ATOM 854 CE3 TRP A 388 0.557 -1.347 -5.331 1.00 0.00 C ATOM 855 CZ2 TRP A 388 -1.919 -2.073 -6.486 1.00 0.00 C ATOM 856 CZ3 TRP A 388 -0.217 -0.413 -6.044 1.00 0.00 C ATOM 857 CH2 TRP A 388 -1.449 -0.766 -6.586 1.00 0.00 C ATOM 0 H TRP A 388 4.163 -4.905 -2.931 1.00 0.00 H new ATOM 0 HA TRP A 388 2.450 -5.827 -4.919 1.00 0.00 H new ATOM 0 HB2 TRP A 388 1.773 -4.539 -2.884 1.00 0.00 H new ATOM 0 HB3 TRP A 388 2.380 -3.082 -3.645 1.00 0.00 H new ATOM 0 HD1 TRP A 388 -0.218 -5.876 -4.462 1.00 0.00 H new ATOM 0 HE1 TRP A 388 -2.119 -4.875 -5.890 1.00 0.00 H new ATOM 0 HE3 TRP A 388 1.495 -1.044 -4.890 1.00 0.00 H new ATOM 0 HZ2 TRP A 388 -2.864 -2.358 -6.924 1.00 0.00 H new ATOM 0 HZ3 TRP A 388 0.151 0.594 -6.173 1.00 0.00 H new ATOM 0 HH2 TRP A 388 -2.046 -0.020 -7.089 1.00 0.00 H new ATOM 868 N GLY A 389 4.369 -3.198 -5.704 1.00 0.00 N ATOM 869 CA GLY A 389 4.947 -2.375 -6.757 1.00 0.00 C ATOM 870 C GLY A 389 5.852 -3.136 -7.728 1.00 0.00 C ATOM 871 O GLY A 389 6.586 -2.478 -8.469 1.00 0.00 O ATOM 0 H GLY A 389 4.782 -3.014 -4.790 1.00 0.00 H new ATOM 0 HA2 GLY A 389 4.140 -1.909 -7.321 1.00 0.00 H new ATOM 0 HA3 GLY A 389 5.522 -1.570 -6.298 1.00 0.00 H new ATOM 875 N ALA A 390 5.814 -4.471 -7.727 1.00 0.00 N ATOM 876 CA ALA A 390 6.381 -5.339 -8.748 1.00 0.00 C ATOM 877 C ALA A 390 5.285 -6.049 -9.561 1.00 0.00 C ATOM 878 O ALA A 390 5.608 -6.742 -10.525 1.00 0.00 O ATOM 879 CB ALA A 390 7.286 -6.374 -8.066 1.00 0.00 C ATOM 0 H ALA A 390 5.365 -4.995 -6.976 1.00 0.00 H new ATOM 0 HA ALA A 390 6.959 -4.731 -9.444 1.00 0.00 H new ATOM 0 HB1 ALA A 390 7.718 -7.032 -8.820 1.00 0.00 H new ATOM 0 HB2 ALA A 390 8.085 -5.862 -7.530 1.00 0.00 H new ATOM 0 HB3 ALA A 390 6.698 -6.964 -7.363 1.00 0.00 H new ATOM 885 N GLN A 391 4.008 -5.926 -9.176 1.00 0.00 N ATOM 886 CA GLN A 391 2.895 -6.602 -9.831 1.00 0.00 C ATOM 887 C GLN A 391 2.367 -5.739 -10.989 1.00 0.00 C ATOM 888 O GLN A 391 2.590 -4.529 -11.033 1.00 0.00 O ATOM 889 CB GLN A 391 1.821 -6.987 -8.783 1.00 0.00 C ATOM 890 CG GLN A 391 2.416 -7.900 -7.702 1.00 0.00 C ATOM 891 CD GLN A 391 1.362 -8.651 -6.894 1.00 0.00 C ATOM 892 OE1 GLN A 391 1.545 -9.822 -6.587 1.00 0.00 O ATOM 893 NE2 GLN A 391 0.272 -8.011 -6.494 1.00 0.00 N ATOM 0 H GLN A 391 3.721 -5.344 -8.389 1.00 0.00 H new ATOM 0 HA GLN A 391 3.224 -7.539 -10.281 1.00 0.00 H new ATOM 0 HB2 GLN A 391 1.417 -6.086 -8.322 1.00 0.00 H new ATOM 0 HB3 GLN A 391 0.991 -7.493 -9.276 1.00 0.00 H new ATOM 0 HG2 GLN A 391 3.083 -8.621 -8.174 1.00 0.00 H new ATOM 0 HG3 GLN A 391 3.023 -7.300 -7.024 1.00 0.00 H new ATOM 0 HE21 GLN A 391 0.129 -7.035 -6.755 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -0.423 -8.494 -5.925 1.00 0.00 H new ATOM 902 N ASP A 392 1.623 -6.376 -11.898 1.00 0.00 N ATOM 903 CA ASP A 392 1.306 -5.919 -13.261 1.00 0.00 C ATOM 904 C ASP A 392 0.810 -4.477 -13.345 1.00 0.00 C ATOM 905 O ASP A 392 1.459 -3.609 -13.929 1.00 0.00 O ATOM 906 CB ASP A 392 0.231 -6.877 -13.805 1.00 0.00 C ATOM 907 CG ASP A 392 -0.414 -6.376 -15.100 1.00 0.00 C ATOM 908 OD1 ASP A 392 0.208 -6.537 -16.170 1.00 0.00 O ATOM 909 OD2 ASP A 392 -1.546 -5.846 -14.978 1.00 0.00 O ATOM 0 H ASP A 392 1.198 -7.280 -11.693 1.00 0.00 H new ATOM 0 HA ASP A 392 2.224 -5.932 -13.849 1.00 0.00 H new ATOM 0 HB2 ASP A 392 0.679 -7.854 -13.983 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -0.542 -7.014 -13.049 1.00 0.00 H new ATOM 914 N SER A 393 -0.311 -4.203 -12.694 1.00 0.00 N ATOM 915 CA SER A 393 -1.036 -2.948 -12.765 1.00 0.00 C ATOM 916 C SER A 393 -1.107 -2.313 -11.378 1.00 0.00 C ATOM 917 O SER A 393 -2.101 -1.698 -10.993 1.00 0.00 O ATOM 918 CB SER A 393 -2.347 -3.176 -13.534 1.00 0.00 C ATOM 919 OG SER A 393 -2.942 -4.425 -13.232 1.00 0.00 O ATOM 0 H SER A 393 -0.757 -4.880 -12.076 1.00 0.00 H new ATOM 0 HA SER A 393 -0.524 -2.184 -13.350 1.00 0.00 H new ATOM 0 HB2 SER A 393 -3.048 -2.376 -13.296 1.00 0.00 H new ATOM 0 HB3 SER A 393 -2.151 -3.120 -14.605 1.00 0.00 H new ATOM 0 HG SER A 393 -2.733 -5.067 -13.942 1.00 0.00 H new ATOM 925 N ALA A 394 -0.003 -2.436 -10.632 1.00 0.00 N ATOM 926 CA ALA A 394 0.212 -1.868 -9.310 1.00 0.00 C ATOM 927 C ALA A 394 0.420 -0.346 -9.362 1.00 0.00 C ATOM 928 O ALA A 394 1.426 0.202 -8.892 1.00 0.00 O ATOM 929 CB ALA A 394 1.391 -2.594 -8.677 1.00 0.00 C ATOM 0 H ALA A 394 0.805 -2.965 -10.959 1.00 0.00 H new ATOM 0 HA ALA A 394 -0.677 -2.011 -8.696 1.00 0.00 H new ATOM 0 HB1 ALA A 394 1.576 -2.189 -7.682 1.00 0.00 H new ATOM 0 HB2 ALA A 394 1.164 -3.657 -8.599 1.00 0.00 H new ATOM 0 HB3 ALA A 394 2.278 -2.457 -9.296 1.00 0.00 H new ATOM 935 N THR A 395 -0.505 0.362 -9.998 1.00 0.00 N ATOM 936 CA THR A 395 -0.370 1.773 -10.277 1.00 0.00 C ATOM 937 C THR A 395 -0.838 2.605 -9.082 1.00 0.00 C ATOM 938 O THR A 395 -1.525 2.104 -8.188 1.00 0.00 O ATOM 939 CB THR A 395 -0.999 2.075 -11.645 1.00 0.00 C ATOM 940 OG1 THR A 395 -2.379 1.813 -11.690 1.00 0.00 O ATOM 941 CG2 THR A 395 -0.355 1.267 -12.780 1.00 0.00 C ATOM 0 H THR A 395 -1.379 -0.040 -10.336 1.00 0.00 H new ATOM 0 HA THR A 395 0.671 2.077 -10.385 1.00 0.00 H new ATOM 0 HB THR A 395 -0.820 3.141 -11.785 1.00 0.00 H new ATOM 0 HG1 THR A 395 -2.875 2.652 -11.589 1.00 0.00 H new ATOM 0 HG21 THR A 395 -0.837 1.519 -13.725 1.00 0.00 H new ATOM 0 HG22 THR A 395 0.707 1.506 -12.839 1.00 0.00 H new ATOM 0 HG23 THR A 395 -0.477 0.202 -12.583 1.00 0.00 H new ATOM 949 N LEU A 396 -0.461 3.886 -9.023 1.00 0.00 N ATOM 950 CA LEU A 396 -0.857 4.740 -7.901 1.00 0.00 C ATOM 951 C LEU A 396 -2.388 4.768 -7.810 1.00 0.00 C ATOM 952 O LEU A 396 -2.958 4.598 -6.736 1.00 0.00 O ATOM 953 CB LEU A 396 -0.265 6.153 -8.084 1.00 0.00 C ATOM 954 CG LEU A 396 -0.045 6.976 -6.795 1.00 0.00 C ATOM 955 CD1 LEU A 396 -1.222 6.963 -5.815 1.00 0.00 C ATOM 956 CD2 LEU A 396 1.236 6.547 -6.063 1.00 0.00 C ATOM 0 H LEU A 396 0.111 4.349 -9.730 1.00 0.00 H new ATOM 0 HA LEU A 396 -0.467 4.342 -6.964 1.00 0.00 H new ATOM 0 HB2 LEU A 396 0.692 6.059 -8.597 1.00 0.00 H new ATOM 0 HB3 LEU A 396 -0.925 6.718 -8.742 1.00 0.00 H new ATOM 0 HG LEU A 396 0.052 8.003 -7.148 1.00 0.00 H new ATOM 0 HD11 LEU A 396 -0.975 7.567 -4.942 1.00 0.00 H new ATOM 0 HD12 LEU A 396 -2.106 7.374 -6.303 1.00 0.00 H new ATOM 0 HD13 LEU A 396 -1.424 5.939 -5.502 1.00 0.00 H new ATOM 0 HD21 LEU A 396 1.358 7.147 -5.161 1.00 0.00 H new ATOM 0 HD22 LEU A 396 1.164 5.494 -5.791 1.00 0.00 H new ATOM 0 HD23 LEU A 396 2.096 6.695 -6.717 1.00 0.00 H new ATOM 968 N ASP A 397 -3.042 4.857 -8.967 1.00 0.00 N ATOM 969 CA ASP A 397 -4.484 4.841 -9.186 1.00 0.00 C ATOM 970 C ASP A 397 -5.135 3.480 -8.903 1.00 0.00 C ATOM 971 O ASP A 397 -6.335 3.452 -8.641 1.00 0.00 O ATOM 972 CB ASP A 397 -4.848 5.386 -10.588 1.00 0.00 C ATOM 973 CG ASP A 397 -4.116 4.740 -11.767 1.00 0.00 C ATOM 974 OD1 ASP A 397 -2.935 4.353 -11.609 1.00 0.00 O ATOM 975 OD2 ASP A 397 -4.627 4.707 -12.905 1.00 0.00 O ATOM 0 H ASP A 397 -2.533 4.950 -9.846 1.00 0.00 H new ATOM 0 HA ASP A 397 -4.910 5.519 -8.446 1.00 0.00 H new ATOM 0 HB2 ASP A 397 -5.920 5.260 -10.738 1.00 0.00 H new ATOM 0 HB3 ASP A 397 -4.647 6.457 -10.604 1.00 0.00 H new ATOM 980 N ALA A 398 -4.379 2.378 -8.816 1.00 0.00 N ATOM 981 CA ALA A 398 -4.910 1.091 -8.356 1.00 0.00 C ATOM 982 C ALA A 398 -5.006 1.124 -6.831 1.00 0.00 C ATOM 983 O ALA A 398 -6.055 0.812 -6.262 1.00 0.00 O ATOM 984 CB ALA A 398 -4.016 -0.093 -8.781 1.00 0.00 C ATOM 0 H ALA A 398 -3.389 2.354 -9.061 1.00 0.00 H new ATOM 0 HA ALA A 398 -5.889 0.944 -8.811 1.00 0.00 H new ATOM 0 HB1 ALA A 398 -4.449 -1.025 -8.418 1.00 0.00 H new ATOM 0 HB2 ALA A 398 -3.947 -0.125 -9.868 1.00 0.00 H new ATOM 0 HB3 ALA A 398 -3.020 0.033 -8.357 1.00 0.00 H new ATOM 990 N LEU A 399 -3.923 1.523 -6.158 1.00 0.00 N ATOM 991 CA LEU A 399 -3.886 1.553 -4.700 1.00 0.00 C ATOM 992 C LEU A 399 -4.887 2.568 -4.164 1.00 0.00 C ATOM 993 O LEU A 399 -5.602 2.302 -3.200 1.00 0.00 O ATOM 994 CB LEU A 399 -2.461 1.842 -4.218 1.00 0.00 C ATOM 995 CG LEU A 399 -2.323 1.624 -2.700 1.00 0.00 C ATOM 996 CD1 LEU A 399 -0.974 0.975 -2.351 1.00 0.00 C ATOM 997 CD2 LEU A 399 -2.500 2.927 -1.914 1.00 0.00 C ATOM 0 H LEU A 399 -3.059 1.830 -6.605 1.00 0.00 H new ATOM 0 HA LEU A 399 -4.176 0.577 -4.311 1.00 0.00 H new ATOM 0 HB2 LEU A 399 -1.760 1.195 -4.745 1.00 0.00 H new ATOM 0 HB3 LEU A 399 -2.194 2.870 -4.465 1.00 0.00 H new ATOM 0 HG LEU A 399 -3.124 0.945 -2.407 1.00 0.00 H new ATOM 0 HD11 LEU A 399 -0.906 0.834 -1.272 1.00 0.00 H new ATOM 0 HD12 LEU A 399 -0.896 0.009 -2.849 1.00 0.00 H new ATOM 0 HD13 LEU A 399 -0.162 1.622 -2.684 1.00 0.00 H new ATOM 0 HD21 LEU A 399 -2.395 2.726 -0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 399 -1.741 3.645 -2.225 1.00 0.00 H new ATOM 0 HD23 LEU A 399 -3.490 3.338 -2.110 1.00 0.00 H new ATOM 1009 N LEU A 400 -4.972 3.716 -4.831 1.00 0.00 N ATOM 1010 CA LEU A 400 -5.911 4.780 -4.557 1.00 0.00 C ATOM 1011 C LEU A 400 -7.347 4.260 -4.674 1.00 0.00 C ATOM 1012 O LEU A 400 -8.203 4.655 -3.885 1.00 0.00 O ATOM 1013 CB LEU A 400 -5.613 5.882 -5.601 1.00 0.00 C ATOM 1014 CG LEU A 400 -6.734 6.858 -6.012 1.00 0.00 C ATOM 1015 CD1 LEU A 400 -6.122 8.208 -6.423 1.00 0.00 C ATOM 1016 CD2 LEU A 400 -7.607 6.410 -7.196 1.00 0.00 C ATOM 0 H LEU A 400 -4.354 3.932 -5.614 1.00 0.00 H new ATOM 0 HA LEU A 400 -5.809 5.171 -3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 400 -4.784 6.478 -5.220 1.00 0.00 H new ATOM 0 HB3 LEU A 400 -5.261 5.388 -6.507 1.00 0.00 H new ATOM 0 HG LEU A 400 -7.372 6.911 -5.130 1.00 0.00 H new ATOM 0 HD11 LEU A 400 -6.917 8.895 -6.713 1.00 0.00 H new ATOM 0 HD12 LEU A 400 -5.568 8.627 -5.583 1.00 0.00 H new ATOM 0 HD13 LEU A 400 -5.446 8.060 -7.265 1.00 0.00 H new ATOM 0 HD21 LEU A 400 -8.362 7.170 -7.399 1.00 0.00 H new ATOM 0 HD22 LEU A 400 -6.982 6.274 -8.078 1.00 0.00 H new ATOM 0 HD23 LEU A 400 -8.097 5.468 -6.951 1.00 0.00 H new ATOM 1028 N ALA A 401 -7.635 3.394 -5.653 1.00 0.00 N ATOM 1029 CA ALA A 401 -8.972 2.854 -5.848 1.00 0.00 C ATOM 1030 C ALA A 401 -9.331 1.912 -4.704 1.00 0.00 C ATOM 1031 O ALA A 401 -10.427 2.017 -4.157 1.00 0.00 O ATOM 1032 CB ALA A 401 -9.071 2.135 -7.195 1.00 0.00 C ATOM 0 H ALA A 401 -6.947 3.054 -6.325 1.00 0.00 H new ATOM 0 HA ALA A 401 -9.684 3.679 -5.853 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -10.078 1.738 -7.322 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -8.853 2.838 -7.999 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -8.352 1.316 -7.224 1.00 0.00 H new ATOM 1038 N ALA A 402 -8.431 0.995 -4.341 1.00 0.00 N ATOM 1039 CA ALA A 402 -8.639 0.088 -3.218 1.00 0.00 C ATOM 1040 C ALA A 402 -8.805 0.863 -1.902 1.00 0.00 C ATOM 1041 O ALA A 402 -9.698 0.554 -1.116 1.00 0.00 O ATOM 1042 CB ALA A 402 -7.508 -0.936 -3.178 1.00 0.00 C ATOM 0 H ALA A 402 -7.540 0.863 -4.819 1.00 0.00 H new ATOM 0 HA ALA A 402 -9.572 -0.460 -3.354 1.00 0.00 H new ATOM 0 HB1 ALA A 402 -7.661 -1.615 -2.339 1.00 0.00 H new ATOM 0 HB2 ALA A 402 -7.499 -1.504 -4.108 1.00 0.00 H new ATOM 0 HB3 ALA A 402 -6.555 -0.421 -3.058 1.00 0.00 H new ATOM 1048 N LEU A 403 -8.027 1.926 -1.682 1.00 0.00 N ATOM 1049 CA LEU A 403 -8.253 2.829 -0.559 1.00 0.00 C ATOM 1050 C LEU A 403 -9.628 3.484 -0.589 1.00 0.00 C ATOM 1051 O LEU A 403 -10.314 3.557 0.429 1.00 0.00 O ATOM 1052 CB LEU A 403 -7.230 3.956 -0.577 1.00 0.00 C ATOM 1053 CG LEU A 403 -5.886 3.666 0.077 1.00 0.00 C ATOM 1054 CD1 LEU A 403 -4.979 4.848 -0.292 1.00 0.00 C ATOM 1055 CD2 LEU A 403 -6.084 3.542 1.592 1.00 0.00 C ATOM 0 H LEU A 403 -7.234 2.180 -2.271 1.00 0.00 H new ATOM 0 HA LEU A 403 -8.169 2.213 0.336 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -7.051 4.237 -1.615 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -7.669 4.823 -0.084 1.00 0.00 H new ATOM 0 HG LEU A 403 -5.439 2.731 -0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -3.993 4.701 0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -4.886 4.911 -1.376 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -5.413 5.772 0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -5.126 3.334 2.068 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -6.489 4.475 1.984 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -6.778 2.728 1.803 1.00 0.00 H new ATOM 1067 N ARG A 404 -10.025 4.041 -1.730 1.00 0.00 N ATOM 1068 CA ARG A 404 -11.281 4.783 -1.789 1.00 0.00 C ATOM 1069 C ARG A 404 -12.443 3.786 -1.627 1.00 0.00 C ATOM 1070 O ARG A 404 -13.475 4.153 -1.075 1.00 0.00 O ATOM 1071 CB ARG A 404 -11.328 5.633 -3.070 1.00 0.00 C ATOM 1072 CG ARG A 404 -12.557 6.559 -3.093 1.00 0.00 C ATOM 1073 CD ARG A 404 -12.607 7.521 -4.294 1.00 0.00 C ATOM 1074 NE ARG A 404 -11.368 8.292 -4.531 1.00 0.00 N ATOM 1075 CZ ARG A 404 -10.917 9.385 -3.890 1.00 0.00 C ATOM 1076 NH1 ARG A 404 -11.492 9.840 -2.784 1.00 0.00 N ATOM 1077 NH2 ARG A 404 -9.869 10.029 -4.378 1.00 0.00 N ATOM 0 H ARG A 404 -9.508 3.995 -2.608 1.00 0.00 H new ATOM 0 HA ARG A 404 -11.370 5.500 -0.973 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -10.420 6.231 -3.143 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -11.349 4.978 -3.941 1.00 0.00 H new ATOM 0 HG2 ARG A 404 -13.458 5.946 -3.096 1.00 0.00 H new ATOM 0 HG3 ARG A 404 -12.573 7.144 -2.174 1.00 0.00 H new ATOM 0 HD2 ARG A 404 -12.836 6.946 -5.191 1.00 0.00 H new ATOM 0 HD3 ARG A 404 -13.429 8.221 -4.145 1.00 0.00 H new ATOM 0 HE ARG A 404 -10.773 7.947 -5.285 1.00 0.00 H new ATOM 0 HH11 ARG A 404 -12.302 9.358 -2.395 1.00 0.00 H new ATOM 0 HH12 ARG A 404 -11.124 10.672 -2.323 1.00 0.00 H new ATOM 0 HH21 ARG A 404 -9.416 9.695 -5.228 1.00 0.00 H new ATOM 0 HH22 ARG A 404 -9.515 10.860 -3.904 1.00 0.00 H new ATOM 1091 N ARG A 405 -12.268 2.527 -2.045 1.00 0.00 N ATOM 1092 CA ARG A 405 -13.148 1.397 -1.751 1.00 0.00 C ATOM 1093 C ARG A 405 -13.297 1.122 -0.251 1.00 0.00 C ATOM 1094 O ARG A 405 -14.432 0.927 0.170 1.00 0.00 O ATOM 1095 CB ARG A 405 -12.684 0.183 -2.576 1.00 0.00 C ATOM 1096 CG ARG A 405 -13.322 -1.157 -2.186 1.00 0.00 C ATOM 1097 CD ARG A 405 -13.181 -2.226 -3.286 1.00 0.00 C ATOM 1098 NE ARG A 405 -11.801 -2.360 -3.810 1.00 0.00 N ATOM 1099 CZ ARG A 405 -11.066 -3.483 -3.863 1.00 0.00 C ATOM 1100 NH1 ARG A 405 -11.514 -4.619 -3.355 1.00 0.00 N ATOM 1101 NH2 ARG A 405 -9.868 -3.463 -4.441 1.00 0.00 N ATOM 0 H ARG A 405 -11.472 2.259 -2.624 1.00 0.00 H new ATOM 0 HA ARG A 405 -14.165 1.643 -2.056 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -12.897 0.376 -3.627 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -11.602 0.093 -2.482 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -12.859 -1.522 -1.269 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -14.379 -1.002 -1.969 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -13.505 -3.188 -2.890 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -13.851 -1.979 -4.109 1.00 0.00 H new ATOM 0 HE ARG A 405 -11.364 -1.511 -4.168 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -12.433 -4.653 -2.913 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -10.941 -5.461 -3.405 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -9.510 -2.596 -4.842 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -9.308 -4.314 -4.483 1.00 0.00 H new ATOM 1115 N ILE A 406 -12.247 1.211 0.575 1.00 0.00 N ATOM 1116 CA ILE A 406 -12.402 1.116 2.041 1.00 0.00 C ATOM 1117 C ILE A 406 -12.677 2.494 2.660 1.00 0.00 C ATOM 1118 O ILE A 406 -12.426 2.705 3.843 1.00 0.00 O ATOM 1119 CB ILE A 406 -11.256 0.343 2.732 1.00 0.00 C ATOM 1120 CG1 ILE A 406 -9.868 1.000 2.611 1.00 0.00 C ATOM 1121 CG2 ILE A 406 -11.302 -1.106 2.246 1.00 0.00 C ATOM 1122 CD1 ILE A 406 -8.709 0.043 2.343 1.00 0.00 C ATOM 0 H ILE A 406 -11.286 1.348 0.261 1.00 0.00 H new ATOM 0 HA ILE A 406 -13.285 0.505 2.229 1.00 0.00 H new ATOM 0 HB ILE A 406 -11.421 0.370 3.809 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -9.902 1.735 1.807 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -9.661 1.544 3.533 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -10.502 -1.674 2.720 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -12.264 -1.547 2.507 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -11.173 -1.131 1.164 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -7.779 0.608 2.276 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -8.637 -0.679 3.157 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -8.882 -0.484 1.405 1.00 0.00 H new ATOM 1134 N GLN A 407 -13.167 3.442 1.852 1.00 0.00 N ATOM 1135 CA GLN A 407 -13.396 4.858 2.127 1.00 0.00 C ATOM 1136 C GLN A 407 -12.257 5.567 2.873 1.00 0.00 C ATOM 1137 O GLN A 407 -12.471 6.660 3.403 1.00 0.00 O ATOM 1138 CB GLN A 407 -14.802 5.101 2.712 1.00 0.00 C ATOM 1139 CG GLN A 407 -14.976 4.792 4.213 1.00 0.00 C ATOM 1140 CD GLN A 407 -15.510 5.998 4.987 1.00 0.00 C ATOM 1141 OE1 GLN A 407 -16.647 6.017 5.441 1.00 0.00 O ATOM 1142 NE2 GLN A 407 -14.707 7.039 5.143 1.00 0.00 N ATOM 0 H GLN A 407 -13.438 3.209 0.897 1.00 0.00 H new ATOM 0 HA GLN A 407 -13.377 5.359 1.159 1.00 0.00 H new ATOM 0 HB2 GLN A 407 -15.068 6.145 2.544 1.00 0.00 H new ATOM 0 HB3 GLN A 407 -15.516 4.496 2.152 1.00 0.00 H new ATOM 0 HG2 GLN A 407 -15.660 3.952 4.333 1.00 0.00 H new ATOM 0 HG3 GLN A 407 -14.018 4.486 4.634 1.00 0.00 H new ATOM 0 HE21 GLN A 407 -13.761 7.015 4.762 1.00 0.00 H new ATOM 0 HE22 GLN A 407 -15.034 7.865 5.644 1.00 0.00 H new ATOM 1151 N ARG A 408 -11.038 5.016 2.876 1.00 0.00 N ATOM 1152 CA ARG A 408 -9.852 5.667 3.446 1.00 0.00 C ATOM 1153 C ARG A 408 -9.285 6.688 2.459 1.00 0.00 C ATOM 1154 O ARG A 408 -8.122 6.651 2.054 1.00 0.00 O ATOM 1155 CB ARG A 408 -8.867 4.602 3.940 1.00 0.00 C ATOM 1156 CG ARG A 408 -9.215 4.249 5.397 1.00 0.00 C ATOM 1157 CD ARG A 408 -8.651 5.322 6.358 1.00 0.00 C ATOM 1158 NE ARG A 408 -8.155 4.743 7.613 1.00 0.00 N ATOM 1159 CZ ARG A 408 -7.269 5.296 8.454 1.00 0.00 C ATOM 1160 NH1 ARG A 408 -6.812 6.534 8.284 1.00 0.00 N ATOM 1161 NH2 ARG A 408 -6.798 4.567 9.462 1.00 0.00 N ATOM 0 H ARG A 408 -10.845 4.097 2.479 1.00 0.00 H new ATOM 0 HA ARG A 408 -10.108 6.252 4.330 1.00 0.00 H new ATOM 0 HB2 ARG A 408 -8.924 3.713 3.311 1.00 0.00 H new ATOM 0 HB3 ARG A 408 -7.844 4.973 3.875 1.00 0.00 H new ATOM 0 HG2 ARG A 408 -10.297 4.179 5.513 1.00 0.00 H new ATOM 0 HG3 ARG A 408 -8.804 3.272 5.650 1.00 0.00 H new ATOM 0 HD2 ARG A 408 -7.842 5.859 5.864 1.00 0.00 H new ATOM 0 HD3 ARG A 408 -9.429 6.052 6.580 1.00 0.00 H new ATOM 0 HE ARG A 408 -8.522 3.827 7.871 1.00 0.00 H new ATOM 0 HH11 ARG A 408 -7.136 7.093 7.495 1.00 0.00 H new ATOM 0 HH12 ARG A 408 -6.138 6.924 8.943 1.00 0.00 H new ATOM 0 HH21 ARG A 408 -7.111 3.604 9.585 1.00 0.00 H new ATOM 0 HH22 ARG A 408 -6.123 4.971 10.112 1.00 0.00 H new ATOM 1175 N ALA A 409 -10.169 7.586 2.028 1.00 0.00 N ATOM 1176 CA ALA A 409 -9.935 8.649 1.072 1.00 0.00 C ATOM 1177 C ALA A 409 -9.023 9.741 1.640 1.00 0.00 C ATOM 1178 O ALA A 409 -8.382 10.452 0.876 1.00 0.00 O ATOM 1179 CB ALA A 409 -11.299 9.216 0.680 1.00 0.00 C ATOM 0 H ALA A 409 -11.132 7.584 2.365 1.00 0.00 H new ATOM 0 HA ALA A 409 -9.417 8.254 0.198 1.00 0.00 H new ATOM 0 HB1 ALA A 409 -11.164 10.022 -0.041 1.00 0.00 H new ATOM 0 HB2 ALA A 409 -11.906 8.428 0.235 1.00 0.00 H new ATOM 0 HB3 ALA A 409 -11.801 9.603 1.567 1.00 0.00 H new ATOM 1185 N ASP A 410 -8.912 9.831 2.963 1.00 0.00 N ATOM 1186 CA ASP A 410 -7.920 10.621 3.687 1.00 0.00 C ATOM 1187 C ASP A 410 -6.513 10.296 3.188 1.00 0.00 C ATOM 1188 O ASP A 410 -5.756 11.202 2.839 1.00 0.00 O ATOM 1189 CB ASP A 410 -8.050 10.375 5.207 1.00 0.00 C ATOM 1190 CG ASP A 410 -7.922 8.900 5.621 1.00 0.00 C ATOM 1191 OD1 ASP A 410 -8.658 8.067 5.046 1.00 0.00 O ATOM 1192 OD2 ASP A 410 -7.118 8.568 6.517 1.00 0.00 O ATOM 0 H ASP A 410 -9.542 9.330 3.590 1.00 0.00 H new ATOM 0 HA ASP A 410 -8.103 11.679 3.500 1.00 0.00 H new ATOM 0 HB2 ASP A 410 -7.284 10.953 5.724 1.00 0.00 H new ATOM 0 HB3 ASP A 410 -9.016 10.752 5.543 1.00 0.00 H new ATOM 1197 N ILE A 411 -6.169 9.010 3.090 1.00 0.00 N ATOM 1198 CA ILE A 411 -4.858 8.602 2.598 1.00 0.00 C ATOM 1199 C ILE A 411 -4.766 8.917 1.107 1.00 0.00 C ATOM 1200 O ILE A 411 -3.701 9.293 0.628 1.00 0.00 O ATOM 1201 CB ILE A 411 -4.589 7.096 2.860 1.00 0.00 C ATOM 1202 CG1 ILE A 411 -5.045 6.683 4.292 1.00 0.00 C ATOM 1203 CG2 ILE A 411 -3.116 6.753 2.573 1.00 0.00 C ATOM 1204 CD1 ILE A 411 -4.784 5.240 4.750 1.00 0.00 C ATOM 0 H ILE A 411 -6.782 8.236 3.346 1.00 0.00 H new ATOM 0 HA ILE A 411 -4.093 9.159 3.139 1.00 0.00 H new ATOM 0 HB ILE A 411 -5.191 6.505 2.170 1.00 0.00 H new ATOM 0 HG12 ILE A 411 -4.557 7.351 5.002 1.00 0.00 H new ATOM 0 HG13 ILE A 411 -6.117 6.867 4.366 1.00 0.00 H new ATOM 0 HG21 ILE A 411 -2.946 5.693 2.762 1.00 0.00 H new ATOM 0 HG22 ILE A 411 -2.887 6.977 1.531 1.00 0.00 H new ATOM 0 HG23 ILE A 411 -2.471 7.345 3.222 1.00 0.00 H new ATOM 0 HD11 ILE A 411 -5.157 5.107 5.766 1.00 0.00 H new ATOM 0 HD12 ILE A 411 -5.297 4.548 4.082 1.00 0.00 H new ATOM 0 HD13 ILE A 411 -3.713 5.039 4.728 1.00 0.00 H new ATOM 1216 N VAL A 412 -5.853 8.719 0.359 1.00 0.00 N ATOM 1217 CA VAL A 412 -5.853 8.911 -1.079 1.00 0.00 C ATOM 1218 C VAL A 412 -5.522 10.365 -1.440 1.00 0.00 C ATOM 1219 O VAL A 412 -4.700 10.608 -2.315 1.00 0.00 O ATOM 1220 CB VAL A 412 -7.216 8.543 -1.692 1.00 0.00 C ATOM 1221 CG1 VAL A 412 -7.169 8.689 -3.206 1.00 0.00 C ATOM 1222 CG2 VAL A 412 -7.595 7.094 -1.413 1.00 0.00 C ATOM 0 H VAL A 412 -6.752 8.422 0.739 1.00 0.00 H new ATOM 0 HA VAL A 412 -5.087 8.252 -1.488 1.00 0.00 H new ATOM 0 HB VAL A 412 -7.945 9.216 -1.240 1.00 0.00 H new ATOM 0 HG11 VAL A 412 -8.139 8.426 -3.627 1.00 0.00 H new ATOM 0 HG12 VAL A 412 -6.929 9.720 -3.465 1.00 0.00 H new ATOM 0 HG13 VAL A 412 -6.405 8.026 -3.612 1.00 0.00 H new ATOM 0 HG21 VAL A 412 -8.564 6.878 -1.864 1.00 0.00 H new ATOM 0 HG22 VAL A 412 -6.841 6.432 -1.839 1.00 0.00 H new ATOM 0 HG23 VAL A 412 -7.652 6.934 -0.336 1.00 0.00 H new ATOM 1232 N GLU A 413 -6.244 11.327 -0.874 1.00 0.00 N ATOM 1233 CA GLU A 413 -6.049 12.746 -1.148 1.00 0.00 C ATOM 1234 C GLU A 413 -4.654 13.229 -0.744 1.00 0.00 C ATOM 1235 O GLU A 413 -4.107 14.096 -1.426 1.00 0.00 O ATOM 1236 CB GLU A 413 -7.218 13.536 -0.530 1.00 0.00 C ATOM 1237 CG GLU A 413 -8.431 13.705 -1.474 1.00 0.00 C ATOM 1238 CD GLU A 413 -8.993 12.416 -2.107 1.00 0.00 C ATOM 1239 OE1 GLU A 413 -8.432 11.950 -3.123 1.00 0.00 O ATOM 1240 OE2 GLU A 413 -10.068 11.912 -1.700 1.00 0.00 O ATOM 0 H GLU A 413 -6.990 11.140 -0.204 1.00 0.00 H new ATOM 0 HA GLU A 413 -6.073 12.928 -2.222 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -7.545 13.030 0.378 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -6.860 14.522 -0.234 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -9.233 14.189 -0.916 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -8.146 14.384 -2.278 1.00 0.00 H new ATOM 1247 N SER A 414 -4.030 12.625 0.272 1.00 0.00 N ATOM 1248 CA SER A 414 -2.618 12.868 0.544 1.00 0.00 C ATOM 1249 C SER A 414 -1.775 12.262 -0.577 1.00 0.00 C ATOM 1250 O SER A 414 -0.918 12.914 -1.156 1.00 0.00 O ATOM 1251 CB SER A 414 -2.260 12.215 1.871 1.00 0.00 C ATOM 1252 OG SER A 414 -0.879 12.324 2.099 1.00 0.00 O ATOM 0 H SER A 414 -4.479 11.970 0.912 1.00 0.00 H new ATOM 0 HA SER A 414 -2.422 13.939 0.596 1.00 0.00 H new ATOM 0 HB2 SER A 414 -2.810 12.693 2.682 1.00 0.00 H new ATOM 0 HB3 SER A 414 -2.554 11.166 1.861 1.00 0.00 H new ATOM 0 HG SER A 414 -0.717 12.954 2.832 1.00 0.00 H new ATOM 1258 N LEU A 415 -2.086 11.028 -0.958 1.00 0.00 N ATOM 1259 CA LEU A 415 -1.441 10.314 -2.058 1.00 0.00 C ATOM 1260 C LEU A 415 -1.467 11.123 -3.353 1.00 0.00 C ATOM 1261 O LEU A 415 -0.531 11.022 -4.147 1.00 0.00 O ATOM 1262 CB LEU A 415 -2.091 8.936 -2.283 1.00 0.00 C ATOM 1263 CG LEU A 415 -1.275 7.803 -1.671 1.00 0.00 C ATOM 1264 CD1 LEU A 415 -2.128 6.524 -1.632 1.00 0.00 C ATOM 1265 CD2 LEU A 415 0.008 7.589 -2.485 1.00 0.00 C ATOM 0 H LEU A 415 -2.814 10.480 -0.499 1.00 0.00 H new ATOM 0 HA LEU A 415 -0.399 10.168 -1.772 1.00 0.00 H new ATOM 0 HB2 LEU A 415 -3.092 8.934 -1.851 1.00 0.00 H new ATOM 0 HB3 LEU A 415 -2.205 8.761 -3.353 1.00 0.00 H new ATOM 0 HG LEU A 415 -0.989 8.060 -0.651 1.00 0.00 H new ATOM 0 HD11 LEU A 415 -1.547 5.712 -1.195 1.00 0.00 H new ATOM 0 HD12 LEU A 415 -3.018 6.699 -1.028 1.00 0.00 H new ATOM 0 HD13 LEU A 415 -2.424 6.253 -2.645 1.00 0.00 H new ATOM 0 HD21 LEU A 415 0.588 6.778 -2.044 1.00 0.00 H new ATOM 0 HD22 LEU A 415 -0.251 7.332 -3.512 1.00 0.00 H new ATOM 0 HD23 LEU A 415 0.600 8.504 -2.478 1.00 0.00 H new