USER MOD reduce.3.24.130724 H: found=0, std=0, add=600, rem=0, adj=15 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 30:sc= -0.0528 USER MOD Set 1.2: A 387 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 353 ASN : amide:sc= -0.125 K(o=0.71,f=-0.17) USER MOD Set 2.2: A 356 THR OG1 : rot -25:sc= 0.834 USER MOD Single : A 337 TYR OH : rot -130:sc= -3.47! USER MOD Single : A 338 SER OG : rot -63:sc= 1.29 USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 344 LYS NZ :NH3+ 154:sc= 1.26 (180deg=0.122!) USER MOD Single : A 350 LYS NZ :NH3+ 148:sc= -0.0188 (180deg=-1.62) USER MOD Single : A 359 HIS : no HD1:sc= -0.0525 K(o=-0.053,f=-0.69) USER MOD Single : A 367 GLN : amide:sc= 1.05 K(o=1,f=0) USER MOD Single : A 370 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 373 SER OG : rot -27:sc= 0.285 USER MOD Single : A 375 THR OG1 : rot -23:sc= 0.613 USER MOD Single : A 376 HIS : no HE2:sc= 1.02 K(o=1,f=-3!) USER MOD Single : A 379 CYS SG : rot -164:sc= 0.772 USER MOD Single : A 391 GLN : amide:sc= 1.86 K(o=1.9,f=-2.7!) USER MOD Single : A 393 SER OG : rot -72:sc= 1.14 USER MOD Single : A 395 THR OG1 : rot 100:sc= 1.19 USER MOD Single : A 407 GLN : amide:sc= 0.866 K(o=0.87,f=0) USER MOD Single : A 414 SER OG : rot 120:sc= -0.518 USER MOD ----------------------------------------------------------------- ATOM 24 N LEU A 336 3.651 3.517 -11.950 1.00 0.00 N ATOM 25 CA LEU A 336 3.618 2.538 -10.873 1.00 0.00 C ATOM 26 C LEU A 336 3.706 3.202 -9.510 1.00 0.00 C ATOM 27 O LEU A 336 4.048 4.381 -9.388 1.00 0.00 O ATOM 28 CB LEU A 336 4.818 1.599 -11.097 1.00 0.00 C ATOM 29 CG LEU A 336 4.483 0.309 -11.862 1.00 0.00 C ATOM 30 CD1 LEU A 336 4.393 -0.848 -10.865 1.00 0.00 C ATOM 31 CD2 LEU A 336 3.229 0.341 -12.752 1.00 0.00 C ATOM 0 HA LEU A 336 2.676 1.990 -10.886 1.00 0.00 H new ATOM 0 HB2 LEU A 336 5.590 2.141 -11.644 1.00 0.00 H new ATOM 0 HB3 LEU A 336 5.241 1.333 -10.128 1.00 0.00 H new ATOM 0 HG LEU A 336 5.300 0.180 -12.572 1.00 0.00 H new ATOM 0 HD11 LEU A 336 4.156 -1.769 -11.397 1.00 0.00 H new ATOM 0 HD12 LEU A 336 5.348 -0.961 -10.352 1.00 0.00 H new ATOM 0 HD13 LEU A 336 3.611 -0.639 -10.135 1.00 0.00 H new ATOM 0 HD21 LEU A 336 3.102 -0.627 -13.237 1.00 0.00 H new ATOM 0 HD22 LEU A 336 2.354 0.558 -12.140 1.00 0.00 H new ATOM 0 HD23 LEU A 336 3.341 1.115 -13.511 1.00 0.00 H new ATOM 43 N TYR A 337 3.631 2.376 -8.471 1.00 0.00 N ATOM 44 CA TYR A 337 3.703 2.873 -7.114 1.00 0.00 C ATOM 45 C TYR A 337 5.157 3.174 -6.775 1.00 0.00 C ATOM 46 O TYR A 337 5.506 4.273 -6.329 1.00 0.00 O ATOM 47 CB TYR A 337 3.081 1.866 -6.142 1.00 0.00 C ATOM 48 CG TYR A 337 2.755 2.563 -4.848 1.00 0.00 C ATOM 49 CD1 TYR A 337 3.798 2.926 -3.984 1.00 0.00 C ATOM 50 CD2 TYR A 337 1.444 3.002 -4.596 1.00 0.00 C ATOM 51 CE1 TYR A 337 3.534 3.754 -2.888 1.00 0.00 C ATOM 52 CE2 TYR A 337 1.179 3.843 -3.502 1.00 0.00 C ATOM 53 CZ TYR A 337 2.229 4.220 -2.639 1.00 0.00 C ATOM 54 OH TYR A 337 2.025 5.035 -1.582 1.00 0.00 O ATOM 0 H TYR A 337 3.521 1.365 -8.549 1.00 0.00 H new ATOM 0 HA TYR A 337 3.130 3.796 -7.021 1.00 0.00 H new ATOM 0 HB2 TYR A 337 2.178 1.435 -6.574 1.00 0.00 H new ATOM 0 HB3 TYR A 337 3.772 1.043 -5.961 1.00 0.00 H new ATOM 0 HD1 TYR A 337 4.801 2.568 -4.164 1.00 0.00 H new ATOM 0 HD2 TYR A 337 0.638 2.692 -5.245 1.00 0.00 H new ATOM 0 HE1 TYR A 337 4.339 4.039 -2.226 1.00 0.00 H new ATOM 0 HE2 TYR A 337 0.175 4.199 -3.323 1.00 0.00 H new ATOM 0 HH TYR A 337 1.274 4.698 -1.050 1.00 0.00 H new ATOM 64 N SER A 338 6.005 2.183 -7.035 1.00 0.00 N ATOM 65 CA SER A 338 7.438 2.171 -6.814 1.00 0.00 C ATOM 66 C SER A 338 8.149 3.193 -7.721 1.00 0.00 C ATOM 67 O SER A 338 9.336 3.444 -7.547 1.00 0.00 O ATOM 68 CB SER A 338 7.916 0.747 -7.140 1.00 0.00 C ATOM 69 OG SER A 338 6.979 -0.229 -6.695 1.00 0.00 O ATOM 0 H SER A 338 5.678 1.304 -7.436 1.00 0.00 H new ATOM 0 HA SER A 338 7.671 2.446 -5.785 1.00 0.00 H new ATOM 0 HB2 SER A 338 8.064 0.648 -8.215 1.00 0.00 H new ATOM 0 HB3 SER A 338 8.882 0.568 -6.668 1.00 0.00 H new ATOM 0 HG SER A 338 6.901 -0.187 -5.719 1.00 0.00 H new ATOM 75 N SER A 339 7.441 3.776 -8.701 1.00 0.00 N ATOM 76 CA SER A 339 7.996 4.745 -9.632 1.00 0.00 C ATOM 77 C SER A 339 8.442 6.010 -8.902 1.00 0.00 C ATOM 78 O SER A 339 9.419 6.614 -9.329 1.00 0.00 O ATOM 79 CB SER A 339 6.962 5.083 -10.710 1.00 0.00 C ATOM 80 OG SER A 339 7.546 5.780 -11.798 1.00 0.00 O ATOM 0 H SER A 339 6.454 3.578 -8.863 1.00 0.00 H new ATOM 0 HA SER A 339 8.873 4.306 -10.107 1.00 0.00 H new ATOM 0 HB2 SER A 339 6.501 4.164 -11.072 1.00 0.00 H new ATOM 0 HB3 SER A 339 6.167 5.689 -10.275 1.00 0.00 H new ATOM 0 HG SER A 339 6.858 5.978 -12.467 1.00 0.00 H new ATOM 86 N LEU A 340 7.689 6.475 -7.898 1.00 0.00 N ATOM 87 CA LEU A 340 8.140 7.442 -6.907 1.00 0.00 C ATOM 88 C LEU A 340 9.323 6.849 -6.126 1.00 0.00 C ATOM 89 O LEU A 340 9.072 5.957 -5.314 1.00 0.00 O ATOM 90 CB LEU A 340 6.962 7.781 -5.968 1.00 0.00 C ATOM 91 CG LEU A 340 6.583 9.259 -5.952 1.00 0.00 C ATOM 92 CD1 LEU A 340 5.261 9.442 -5.195 1.00 0.00 C ATOM 93 CD2 LEU A 340 7.672 10.088 -5.259 1.00 0.00 C ATOM 0 H LEU A 340 6.724 6.177 -7.754 1.00 0.00 H new ATOM 0 HA LEU A 340 8.475 8.360 -7.389 1.00 0.00 H new ATOM 0 HB2 LEU A 340 6.092 7.197 -6.269 1.00 0.00 H new ATOM 0 HB3 LEU A 340 7.219 7.472 -4.955 1.00 0.00 H new ATOM 0 HG LEU A 340 6.476 9.599 -6.982 1.00 0.00 H new ATOM 0 HD11 LEU A 340 4.991 10.498 -5.184 1.00 0.00 H new ATOM 0 HD12 LEU A 340 4.476 8.872 -5.691 1.00 0.00 H new ATOM 0 HD13 LEU A 340 5.376 9.086 -4.171 1.00 0.00 H new ATOM 0 HD21 LEU A 340 7.384 11.139 -5.258 1.00 0.00 H new ATOM 0 HD22 LEU A 340 7.793 9.744 -4.232 1.00 0.00 H new ATOM 0 HD23 LEU A 340 8.614 9.971 -5.794 1.00 0.00 H new ATOM 152 N LYS A 344 8.379 10.253 -0.005 1.00 0.00 N ATOM 153 CA LYS A 344 6.940 10.012 -0.007 1.00 0.00 C ATOM 154 C LYS A 344 6.634 8.602 0.515 1.00 0.00 C ATOM 155 O LYS A 344 5.652 8.439 1.211 1.00 0.00 O ATOM 156 CB LYS A 344 6.309 10.324 -1.381 1.00 0.00 C ATOM 157 CG LYS A 344 4.765 10.471 -1.341 1.00 0.00 C ATOM 158 CD LYS A 344 4.267 11.831 -1.883 1.00 0.00 C ATOM 159 CE LYS A 344 2.745 12.045 -1.730 1.00 0.00 C ATOM 160 NZ LYS A 344 2.382 12.753 -0.484 1.00 0.00 N ATOM 0 HA LYS A 344 6.464 10.707 0.684 1.00 0.00 H new ATOM 0 HB2 LYS A 344 6.743 11.246 -1.769 1.00 0.00 H new ATOM 0 HB3 LYS A 344 6.571 9.530 -2.080 1.00 0.00 H new ATOM 0 HG2 LYS A 344 4.315 9.668 -1.925 1.00 0.00 H new ATOM 0 HG3 LYS A 344 4.422 10.349 -0.314 1.00 0.00 H new ATOM 0 HD2 LYS A 344 4.791 12.633 -1.362 1.00 0.00 H new ATOM 0 HD3 LYS A 344 4.531 11.910 -2.938 1.00 0.00 H new ATOM 0 HE2 LYS A 344 2.376 12.613 -2.584 1.00 0.00 H new ATOM 0 HE3 LYS A 344 2.244 11.077 -1.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 1.478 13.249 -0.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 2.289 12.066 0.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 3.124 13.443 -0.248 1.00 0.00 H new ATOM 174 N ARG A 345 7.405 7.541 0.209 1.00 0.00 N ATOM 175 CA ARG A 345 7.147 6.234 0.817 1.00 0.00 C ATOM 176 C ARG A 345 7.234 6.220 2.352 1.00 0.00 C ATOM 177 O ARG A 345 6.467 5.496 2.973 1.00 0.00 O ATOM 178 CB ARG A 345 8.073 5.159 0.228 1.00 0.00 C ATOM 179 CG ARG A 345 7.521 4.629 -1.098 1.00 0.00 C ATOM 180 CD ARG A 345 7.841 5.485 -2.327 1.00 0.00 C ATOM 181 NE ARG A 345 6.759 5.499 -3.327 1.00 0.00 N ATOM 182 CZ ARG A 345 5.584 6.136 -3.237 1.00 0.00 C ATOM 183 NH1 ARG A 345 5.236 6.780 -2.122 1.00 0.00 N ATOM 184 NH2 ARG A 345 4.750 6.111 -4.271 1.00 0.00 N ATOM 0 H ARG A 345 8.192 7.566 -0.440 1.00 0.00 H new ATOM 0 HA ARG A 345 6.110 6.006 0.569 1.00 0.00 H new ATOM 0 HB2 ARG A 345 9.068 5.576 0.072 1.00 0.00 H new ATOM 0 HB3 ARG A 345 8.180 4.337 0.936 1.00 0.00 H new ATOM 0 HG2 ARG A 345 7.914 3.626 -1.262 1.00 0.00 H new ATOM 0 HG3 ARG A 345 6.438 4.537 -1.011 1.00 0.00 H new ATOM 0 HD2 ARG A 345 8.043 6.507 -2.006 1.00 0.00 H new ATOM 0 HD3 ARG A 345 8.752 5.111 -2.794 1.00 0.00 H new ATOM 0 HE ARG A 345 6.922 4.966 -4.181 1.00 0.00 H new ATOM 0 HH11 ARG A 345 5.868 6.792 -1.322 1.00 0.00 H new ATOM 0 HH12 ARG A 345 4.338 7.260 -2.070 1.00 0.00 H new ATOM 0 HH21 ARG A 345 5.007 5.610 -5.122 1.00 0.00 H new ATOM 0 HH22 ARG A 345 3.853 6.592 -4.214 1.00 0.00 H new ATOM 198 N GLU A 346 8.116 7.003 2.962 1.00 0.00 N ATOM 199 CA GLU A 346 8.250 7.082 4.418 1.00 0.00 C ATOM 200 C GLU A 346 7.033 7.804 4.998 1.00 0.00 C ATOM 201 O GLU A 346 6.414 7.363 5.962 1.00 0.00 O ATOM 202 CB GLU A 346 9.549 7.813 4.796 1.00 0.00 C ATOM 203 CG GLU A 346 10.790 7.294 4.054 1.00 0.00 C ATOM 204 CD GLU A 346 11.053 5.813 4.309 1.00 0.00 C ATOM 205 OE1 GLU A 346 11.428 5.477 5.450 1.00 0.00 O ATOM 206 OE2 GLU A 346 10.873 4.987 3.389 1.00 0.00 O ATOM 0 H GLU A 346 8.765 7.607 2.459 1.00 0.00 H new ATOM 0 HA GLU A 346 8.298 6.076 4.834 1.00 0.00 H new ATOM 0 HB2 GLU A 346 9.431 8.876 4.587 1.00 0.00 H new ATOM 0 HB3 GLU A 346 9.711 7.715 5.869 1.00 0.00 H new ATOM 0 HG2 GLU A 346 10.663 7.457 2.984 1.00 0.00 H new ATOM 0 HG3 GLU A 346 11.661 7.872 4.363 1.00 0.00 H new ATOM 213 N GLU A 347 6.654 8.904 4.354 1.00 0.00 N ATOM 214 CA GLU A 347 5.418 9.631 4.597 1.00 0.00 C ATOM 215 C GLU A 347 4.186 8.738 4.357 1.00 0.00 C ATOM 216 O GLU A 347 3.153 8.925 4.990 1.00 0.00 O ATOM 217 CB GLU A 347 5.500 10.886 3.719 1.00 0.00 C ATOM 218 CG GLU A 347 4.230 11.731 3.554 1.00 0.00 C ATOM 219 CD GLU A 347 3.838 11.752 2.076 1.00 0.00 C ATOM 220 OE1 GLU A 347 4.550 12.385 1.267 1.00 0.00 O ATOM 221 OE2 GLU A 347 2.851 11.095 1.686 1.00 0.00 O ATOM 0 H GLU A 347 7.223 9.327 3.621 1.00 0.00 H new ATOM 0 HA GLU A 347 5.298 9.935 5.637 1.00 0.00 H new ATOM 0 HB2 GLU A 347 6.279 11.530 4.128 1.00 0.00 H new ATOM 0 HB3 GLU A 347 5.829 10.579 2.726 1.00 0.00 H new ATOM 0 HG2 GLU A 347 3.420 11.315 4.153 1.00 0.00 H new ATOM 0 HG3 GLU A 347 4.403 12.746 3.913 1.00 0.00 H new ATOM 228 N VAL A 348 4.285 7.698 3.535 1.00 0.00 N ATOM 229 CA VAL A 348 3.225 6.720 3.370 1.00 0.00 C ATOM 230 C VAL A 348 3.238 5.683 4.498 1.00 0.00 C ATOM 231 O VAL A 348 2.159 5.219 4.837 1.00 0.00 O ATOM 232 CB VAL A 348 3.298 6.119 1.965 1.00 0.00 C ATOM 233 CG1 VAL A 348 2.376 4.916 1.787 1.00 0.00 C ATOM 234 CG2 VAL A 348 2.872 7.148 0.899 1.00 0.00 C ATOM 0 H VAL A 348 5.109 7.513 2.963 1.00 0.00 H new ATOM 0 HA VAL A 348 2.254 7.209 3.455 1.00 0.00 H new ATOM 0 HB VAL A 348 4.337 5.814 1.842 1.00 0.00 H new ATOM 0 HG11 VAL A 348 2.471 4.532 0.771 1.00 0.00 H new ATOM 0 HG12 VAL A 348 2.654 4.137 2.497 1.00 0.00 H new ATOM 0 HG13 VAL A 348 1.344 5.219 1.966 1.00 0.00 H new ATOM 0 HG21 VAL A 348 2.933 6.694 -0.090 1.00 0.00 H new ATOM 0 HG22 VAL A 348 1.847 7.466 1.089 1.00 0.00 H new ATOM 0 HG23 VAL A 348 3.534 8.013 0.943 1.00 0.00 H new ATOM 244 N GLU A 349 4.365 5.341 5.130 1.00 0.00 N ATOM 245 CA GLU A 349 4.316 4.561 6.388 1.00 0.00 C ATOM 246 C GLU A 349 3.519 5.317 7.470 1.00 0.00 C ATOM 247 O GLU A 349 2.788 4.719 8.257 1.00 0.00 O ATOM 248 CB GLU A 349 5.702 4.160 6.920 1.00 0.00 C ATOM 249 CG GLU A 349 6.513 3.302 5.935 1.00 0.00 C ATOM 250 CD GLU A 349 7.208 2.098 6.593 1.00 0.00 C ATOM 251 OE1 GLU A 349 7.883 2.263 7.639 1.00 0.00 O ATOM 252 OE2 GLU A 349 7.156 0.991 6.011 1.00 0.00 O ATOM 0 H GLU A 349 5.303 5.580 4.809 1.00 0.00 H new ATOM 0 HA GLU A 349 3.803 3.631 6.144 1.00 0.00 H new ATOM 0 HB2 GLU A 349 6.267 5.062 7.154 1.00 0.00 H new ATOM 0 HB3 GLU A 349 5.579 3.610 7.853 1.00 0.00 H new ATOM 0 HG2 GLU A 349 5.850 2.942 5.148 1.00 0.00 H new ATOM 0 HG3 GLU A 349 7.266 3.928 5.456 1.00 0.00 H new ATOM 259 N LYS A 350 3.573 6.650 7.427 1.00 0.00 N ATOM 260 CA LYS A 350 2.671 7.558 8.131 1.00 0.00 C ATOM 261 C LYS A 350 1.228 7.553 7.617 1.00 0.00 C ATOM 262 O LYS A 350 0.324 7.657 8.444 1.00 0.00 O ATOM 263 CB LYS A 350 3.370 8.938 8.129 1.00 0.00 C ATOM 264 CG LYS A 350 2.562 10.187 8.536 1.00 0.00 C ATOM 265 CD LYS A 350 2.146 10.856 7.202 1.00 0.00 C ATOM 266 CE LYS A 350 1.280 12.121 7.219 1.00 0.00 C ATOM 267 NZ LYS A 350 1.073 12.616 5.832 1.00 0.00 N ATOM 0 H LYS A 350 4.276 7.144 6.878 1.00 0.00 H new ATOM 0 HA LYS A 350 2.512 7.223 9.156 1.00 0.00 H new ATOM 0 HB2 LYS A 350 4.231 8.872 8.795 1.00 0.00 H new ATOM 0 HB3 LYS A 350 3.757 9.109 7.124 1.00 0.00 H new ATOM 0 HG2 LYS A 350 1.689 9.915 9.129 1.00 0.00 H new ATOM 0 HG3 LYS A 350 3.162 10.863 9.145 1.00 0.00 H new ATOM 0 HD2 LYS A 350 3.061 11.096 6.660 1.00 0.00 H new ATOM 0 HD3 LYS A 350 1.615 10.107 6.615 1.00 0.00 H new ATOM 0 HE2 LYS A 350 0.318 11.907 7.684 1.00 0.00 H new ATOM 0 HE3 LYS A 350 1.761 12.892 7.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 350 0.139 13.069 5.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 350 1.812 13.308 5.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 350 1.122 11.818 5.167 1.00 0.00 H new ATOM 281 N LEU A 351 0.966 7.487 6.310 1.00 0.00 N ATOM 282 CA LEU A 351 -0.406 7.507 5.796 1.00 0.00 C ATOM 283 C LEU A 351 -1.102 6.149 5.859 1.00 0.00 C ATOM 284 O LEU A 351 -2.159 6.021 6.473 1.00 0.00 O ATOM 285 CB LEU A 351 -0.458 7.992 4.348 1.00 0.00 C ATOM 286 CG LEU A 351 -0.088 9.451 4.094 1.00 0.00 C ATOM 287 CD1 LEU A 351 0.078 9.625 2.582 1.00 0.00 C ATOM 288 CD2 LEU A 351 -1.173 10.357 4.692 1.00 0.00 C ATOM 0 H LEU A 351 1.684 7.419 5.589 1.00 0.00 H new ATOM 0 HA LEU A 351 -0.934 8.199 6.453 1.00 0.00 H new ATOM 0 HB2 LEU A 351 0.209 7.365 3.756 1.00 0.00 H new ATOM 0 HB3 LEU A 351 -1.468 7.828 3.971 1.00 0.00 H new ATOM 0 HG LEU A 351 0.849 9.732 4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 351 0.343 10.659 2.362 1.00 0.00 H new ATOM 0 HD12 LEU A 351 0.867 8.964 2.224 1.00 0.00 H new ATOM 0 HD13 LEU A 351 -0.858 9.376 2.082 1.00 0.00 H new ATOM 0 HD21 LEU A 351 -0.914 11.401 4.514 1.00 0.00 H new ATOM 0 HD22 LEU A 351 -2.131 10.135 4.223 1.00 0.00 H new ATOM 0 HD23 LEU A 351 -1.245 10.179 5.765 1.00 0.00 H new ATOM 300 N LEU A 352 -0.552 5.152 5.159 1.00 0.00 N ATOM 301 CA LEU A 352 -0.951 3.747 5.113 1.00 0.00 C ATOM 302 C LEU A 352 -0.552 3.134 6.468 1.00 0.00 C ATOM 303 O LEU A 352 0.315 2.279 6.544 1.00 0.00 O ATOM 304 CB LEU A 352 -0.377 3.028 3.851 1.00 0.00 C ATOM 305 CG LEU A 352 -0.931 3.507 2.473 1.00 0.00 C ATOM 306 CD1 LEU A 352 -0.320 2.824 1.233 1.00 0.00 C ATOM 307 CD2 LEU A 352 -2.430 3.271 2.318 1.00 0.00 C ATOM 0 H LEU A 352 0.254 5.326 4.559 1.00 0.00 H new ATOM 0 HA LEU A 352 -2.027 3.624 4.989 1.00 0.00 H new ATOM 0 HB2 LEU A 352 0.706 3.154 3.848 1.00 0.00 H new ATOM 0 HB3 LEU A 352 -0.573 1.960 3.946 1.00 0.00 H new ATOM 0 HG LEU A 352 -0.661 4.563 2.500 1.00 0.00 H new ATOM 0 HD11 LEU A 352 -0.776 3.232 0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 352 0.754 3.006 1.210 1.00 0.00 H new ATOM 0 HD13 LEU A 352 -0.505 1.751 1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 352 -2.755 3.625 1.340 1.00 0.00 H new ATOM 0 HD22 LEU A 352 -2.642 2.205 2.407 1.00 0.00 H new ATOM 0 HD23 LEU A 352 -2.966 3.814 3.096 1.00 0.00 H new ATOM 319 N ASN A 353 -1.137 3.658 7.546 1.00 0.00 N ATOM 320 CA ASN A 353 -0.854 3.407 8.959 1.00 0.00 C ATOM 321 C ASN A 353 -0.828 1.911 9.324 1.00 0.00 C ATOM 322 O ASN A 353 -1.487 1.096 8.670 1.00 0.00 O ATOM 323 CB ASN A 353 -1.911 4.193 9.763 1.00 0.00 C ATOM 324 CG ASN A 353 -2.145 3.642 11.162 1.00 0.00 C ATOM 325 OD1 ASN A 353 -1.270 3.709 12.012 1.00 0.00 O ATOM 326 ND2 ASN A 353 -3.305 3.056 11.417 1.00 0.00 N ATOM 0 H ASN A 353 -1.894 4.334 7.441 1.00 0.00 H new ATOM 0 HA ASN A 353 0.153 3.746 9.202 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -1.597 5.234 9.839 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -2.853 4.183 9.215 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -3.480 2.651 12.336 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -4.023 3.010 10.694 1.00 0.00 H new ATOM 333 N GLY A 354 -0.111 1.571 10.407 1.00 0.00 N ATOM 334 CA GLY A 354 0.161 0.238 10.952 1.00 0.00 C ATOM 335 C GLY A 354 -1.078 -0.436 11.544 1.00 0.00 C ATOM 336 O GLY A 354 -1.181 -0.638 12.747 1.00 0.00 O ATOM 0 H GLY A 354 0.333 2.293 10.974 1.00 0.00 H new ATOM 0 HA2 GLY A 354 0.568 -0.394 10.163 1.00 0.00 H new ATOM 0 HA3 GLY A 354 0.927 0.317 11.723 1.00 0.00 H new ATOM 340 N ASP A 355 -1.996 -0.784 10.654 1.00 0.00 N ATOM 341 CA ASP A 355 -3.350 -1.312 10.796 1.00 0.00 C ATOM 342 C ASP A 355 -4.000 -1.249 9.431 1.00 0.00 C ATOM 343 O ASP A 355 -4.315 -2.244 8.784 1.00 0.00 O ATOM 344 CB ASP A 355 -4.211 -0.513 11.789 1.00 0.00 C ATOM 345 CG ASP A 355 -5.668 -0.955 11.627 1.00 0.00 C ATOM 346 OD1 ASP A 355 -5.997 -2.097 12.006 1.00 0.00 O ATOM 347 OD2 ASP A 355 -6.396 -0.172 10.963 1.00 0.00 O ATOM 0 H ASP A 355 -1.773 -0.687 9.663 1.00 0.00 H new ATOM 0 HA ASP A 355 -3.282 -2.328 11.185 1.00 0.00 H new ATOM 0 HB2 ASP A 355 -3.873 -0.687 12.810 1.00 0.00 H new ATOM 0 HB3 ASP A 355 -4.115 0.556 11.600 1.00 0.00 H new ATOM 352 N THR A 356 -4.188 -0.017 8.992 1.00 0.00 N ATOM 353 CA THR A 356 -5.102 0.346 7.945 1.00 0.00 C ATOM 354 C THR A 356 -4.527 -0.114 6.603 1.00 0.00 C ATOM 355 O THR A 356 -5.275 -0.493 5.700 1.00 0.00 O ATOM 356 CB THR A 356 -5.282 1.860 8.087 1.00 0.00 C ATOM 357 OG1 THR A 356 -5.560 2.186 9.449 1.00 0.00 O ATOM 358 CG2 THR A 356 -6.420 2.379 7.214 1.00 0.00 C ATOM 0 H THR A 356 -3.684 0.783 9.376 1.00 0.00 H new ATOM 0 HA THR A 356 -6.080 -0.130 8.005 1.00 0.00 H new ATOM 0 HB THR A 356 -4.355 2.333 7.762 1.00 0.00 H new ATOM 0 HG1 THR A 356 -5.959 1.410 9.896 1.00 0.00 H new ATOM 0 HG21 THR A 356 -6.515 3.457 7.343 1.00 0.00 H new ATOM 0 HG22 THR A 356 -6.207 2.156 6.168 1.00 0.00 H new ATOM 0 HG23 THR A 356 -7.352 1.895 7.506 1.00 0.00 H new ATOM 366 N TRP A 357 -3.195 -0.151 6.489 1.00 0.00 N ATOM 367 CA TRP A 357 -2.513 -0.837 5.412 1.00 0.00 C ATOM 368 C TRP A 357 -3.005 -2.292 5.259 1.00 0.00 C ATOM 369 O TRP A 357 -3.271 -2.666 4.131 1.00 0.00 O ATOM 370 CB TRP A 357 -0.991 -0.696 5.560 1.00 0.00 C ATOM 371 CG TRP A 357 -0.354 -1.788 6.346 1.00 0.00 C ATOM 372 CD1 TRP A 357 -0.131 -1.816 7.676 1.00 0.00 C ATOM 373 CD2 TRP A 357 0.019 -3.095 5.849 1.00 0.00 C ATOM 374 NE1 TRP A 357 0.280 -3.082 8.047 1.00 0.00 N ATOM 375 CE2 TRP A 357 0.322 -3.926 6.957 1.00 0.00 C ATOM 376 CE3 TRP A 357 0.032 -3.680 4.570 1.00 0.00 C ATOM 377 CZ2 TRP A 357 0.566 -5.289 6.772 1.00 0.00 C ATOM 378 CZ3 TRP A 357 0.403 -5.016 4.376 1.00 0.00 C ATOM 379 CH2 TRP A 357 0.665 -5.807 5.492 1.00 0.00 C ATOM 0 H TRP A 357 -2.565 0.301 7.152 1.00 0.00 H new ATOM 0 HA TRP A 357 -2.769 -0.357 4.468 1.00 0.00 H new ATOM 0 HB2 TRP A 357 -0.541 -0.667 4.568 1.00 0.00 H new ATOM 0 HB3 TRP A 357 -0.770 0.258 6.038 1.00 0.00 H new ATOM 0 HD1 TRP A 357 -0.255 -0.979 8.347 1.00 0.00 H new ATOM 0 HE1 TRP A 357 0.520 -3.356 9.000 1.00 0.00 H new ATOM 0 HE3 TRP A 357 -0.251 -3.083 3.716 1.00 0.00 H new ATOM 0 HZ2 TRP A 357 0.677 -5.939 7.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 357 0.484 -5.425 3.380 1.00 0.00 H new ATOM 0 HH2 TRP A 357 0.950 -6.840 5.357 1.00 0.00 H new ATOM 390 N ARG A 358 -3.089 -3.135 6.308 1.00 0.00 N ATOM 391 CA ARG A 358 -3.642 -4.509 6.245 1.00 0.00 C ATOM 392 C ARG A 358 -4.912 -4.590 5.397 1.00 0.00 C ATOM 393 O ARG A 358 -4.995 -5.385 4.464 1.00 0.00 O ATOM 394 CB ARG A 358 -3.821 -5.184 7.626 1.00 0.00 C ATOM 395 CG ARG A 358 -2.498 -5.317 8.400 1.00 0.00 C ATOM 396 CD ARG A 358 -2.604 -5.896 9.820 1.00 0.00 C ATOM 397 NE ARG A 358 -2.899 -7.343 9.862 1.00 0.00 N ATOM 398 CZ ARG A 358 -4.072 -7.926 10.129 1.00 0.00 C ATOM 399 NH1 ARG A 358 -5.186 -7.196 10.220 1.00 0.00 N ATOM 400 NH2 ARG A 358 -4.127 -9.238 10.311 1.00 0.00 N ATOM 0 H ARG A 358 -2.769 -2.878 7.242 1.00 0.00 H new ATOM 0 HA ARG A 358 -2.876 -5.094 5.736 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -4.528 -4.604 8.220 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -4.257 -6.173 7.488 1.00 0.00 H new ATOM 0 HG2 ARG A 358 -1.823 -5.948 7.821 1.00 0.00 H new ATOM 0 HG3 ARG A 358 -2.037 -4.331 8.464 1.00 0.00 H new ATOM 0 HD2 ARG A 358 -1.668 -5.712 10.347 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -3.385 -5.361 10.361 1.00 0.00 H new ATOM 0 HE ARG A 358 -2.118 -7.969 9.665 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -5.146 -6.186 10.085 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -6.077 -7.649 10.424 1.00 0.00 H new ATOM 0 HH21 ARG A 358 -3.277 -9.798 10.247 1.00 0.00 H new ATOM 0 HH22 ARG A 358 -5.020 -9.688 10.515 1.00 0.00 H new ATOM 414 N HIS A 359 -5.902 -3.772 5.755 1.00 0.00 N ATOM 415 CA HIS A 359 -7.201 -3.648 5.095 1.00 0.00 C ATOM 416 C HIS A 359 -7.020 -3.371 3.604 1.00 0.00 C ATOM 417 O HIS A 359 -7.599 -4.069 2.777 1.00 0.00 O ATOM 418 CB HIS A 359 -8.024 -2.587 5.840 1.00 0.00 C ATOM 419 CG HIS A 359 -8.249 -2.955 7.293 1.00 0.00 C ATOM 420 ND1 HIS A 359 -7.486 -2.586 8.389 1.00 0.00 N ATOM 421 CD2 HIS A 359 -9.235 -3.790 7.747 1.00 0.00 C ATOM 422 CE1 HIS A 359 -8.029 -3.163 9.476 1.00 0.00 C ATOM 423 NE2 HIS A 359 -9.084 -3.921 9.129 1.00 0.00 N ATOM 0 H HIS A 359 -5.814 -3.145 6.555 1.00 0.00 H new ATOM 0 HA HIS A 359 -7.760 -4.583 5.142 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -7.511 -1.627 5.785 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -8.987 -2.463 5.345 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -9.995 -4.263 7.143 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -7.668 -3.035 10.486 1.00 0.00 H new ATOM 0 HE2 HIS A 359 -9.662 -4.483 9.754 1.00 0.00 H new ATOM 431 N LEU A 360 -6.180 -2.398 3.254 1.00 0.00 N ATOM 432 CA LEU A 360 -5.820 -2.121 1.869 1.00 0.00 C ATOM 433 C LEU A 360 -5.141 -3.321 1.206 1.00 0.00 C ATOM 434 O LEU A 360 -5.504 -3.693 0.100 1.00 0.00 O ATOM 435 CB LEU A 360 -4.916 -0.880 1.843 1.00 0.00 C ATOM 436 CG LEU A 360 -4.222 -0.666 0.492 1.00 0.00 C ATOM 437 CD1 LEU A 360 -5.246 -0.306 -0.584 1.00 0.00 C ATOM 438 CD2 LEU A 360 -3.190 0.437 0.644 1.00 0.00 C ATOM 0 H LEU A 360 -5.730 -1.779 3.928 1.00 0.00 H new ATOM 0 HA LEU A 360 -6.725 -1.929 1.293 1.00 0.00 H new ATOM 0 HB2 LEU A 360 -5.512 0.001 2.081 1.00 0.00 H new ATOM 0 HB3 LEU A 360 -4.159 -0.973 2.622 1.00 0.00 H new ATOM 0 HG LEU A 360 -3.727 -1.586 0.182 1.00 0.00 H new ATOM 0 HD11 LEU A 360 -4.736 -0.158 -1.536 1.00 0.00 H new ATOM 0 HD12 LEU A 360 -5.970 -1.115 -0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 360 -5.763 0.611 -0.302 1.00 0.00 H new ATOM 0 HD21 LEU A 360 -2.688 0.600 -0.310 1.00 0.00 H new ATOM 0 HD22 LEU A 360 -3.684 1.357 0.956 1.00 0.00 H new ATOM 0 HD23 LEU A 360 -2.455 0.147 1.395 1.00 0.00 H new ATOM 450 N ALA A 361 -4.090 -3.849 1.820 1.00 0.00 N ATOM 451 CA ALA A 361 -3.264 -4.937 1.338 1.00 0.00 C ATOM 452 C ALA A 361 -4.116 -6.145 0.932 1.00 0.00 C ATOM 453 O ALA A 361 -3.933 -6.670 -0.164 1.00 0.00 O ATOM 454 CB ALA A 361 -2.175 -5.219 2.380 1.00 0.00 C ATOM 0 H ALA A 361 -3.776 -3.503 2.726 1.00 0.00 H new ATOM 0 HA ALA A 361 -2.751 -4.665 0.416 1.00 0.00 H new ATOM 0 HB1 ALA A 361 -1.543 -6.036 2.033 1.00 0.00 H new ATOM 0 HB2 ALA A 361 -1.567 -4.325 2.522 1.00 0.00 H new ATOM 0 HB3 ALA A 361 -2.640 -5.496 3.326 1.00 0.00 H new ATOM 460 N GLY A 362 -5.049 -6.573 1.789 1.00 0.00 N ATOM 461 CA GLY A 362 -5.980 -7.653 1.476 1.00 0.00 C ATOM 462 C GLY A 362 -6.855 -7.300 0.277 1.00 0.00 C ATOM 463 O GLY A 362 -7.090 -8.127 -0.604 1.00 0.00 O ATOM 0 H GLY A 362 -5.177 -6.177 2.720 1.00 0.00 H new ATOM 0 HA2 GLY A 362 -5.424 -8.567 1.266 1.00 0.00 H new ATOM 0 HA3 GLY A 362 -6.610 -7.855 2.342 1.00 0.00 H new ATOM 467 N GLU A 363 -7.310 -6.049 0.220 1.00 0.00 N ATOM 468 CA GLU A 363 -8.120 -5.540 -0.885 1.00 0.00 C ATOM 469 C GLU A 363 -7.295 -5.428 -2.187 1.00 0.00 C ATOM 470 O GLU A 363 -7.865 -5.360 -3.281 1.00 0.00 O ATOM 471 CB GLU A 363 -8.752 -4.198 -0.462 1.00 0.00 C ATOM 472 CG GLU A 363 -9.923 -4.379 0.524 1.00 0.00 C ATOM 473 CD GLU A 363 -11.248 -4.615 -0.204 1.00 0.00 C ATOM 474 OE1 GLU A 363 -11.340 -5.583 -0.990 1.00 0.00 O ATOM 475 OE2 GLU A 363 -12.142 -3.745 -0.141 1.00 0.00 O ATOM 0 H GLU A 363 -7.125 -5.356 0.945 1.00 0.00 H new ATOM 0 HA GLU A 363 -8.923 -6.243 -1.107 1.00 0.00 H new ATOM 0 HB2 GLU A 363 -7.989 -3.570 -0.003 1.00 0.00 H new ATOM 0 HB3 GLU A 363 -9.106 -3.672 -1.349 1.00 0.00 H new ATOM 0 HG2 GLU A 363 -9.716 -5.222 1.184 1.00 0.00 H new ATOM 0 HG3 GLU A 363 -10.007 -3.494 1.154 1.00 0.00 H new ATOM 482 N LEU A 364 -5.963 -5.448 -2.095 1.00 0.00 N ATOM 483 CA LEU A 364 -5.003 -5.539 -3.193 1.00 0.00 C ATOM 484 C LEU A 364 -4.627 -6.992 -3.514 1.00 0.00 C ATOM 485 O LEU A 364 -3.475 -7.290 -3.827 1.00 0.00 O ATOM 486 CB LEU A 364 -3.781 -4.647 -2.907 1.00 0.00 C ATOM 487 CG LEU A 364 -4.080 -3.141 -2.999 1.00 0.00 C ATOM 488 CD1 LEU A 364 -2.820 -2.359 -2.616 1.00 0.00 C ATOM 489 CD2 LEU A 364 -4.537 -2.733 -4.407 1.00 0.00 C ATOM 0 H LEU A 364 -5.497 -5.398 -1.189 1.00 0.00 H new ATOM 0 HA LEU A 364 -5.478 -5.160 -4.098 1.00 0.00 H new ATOM 0 HB2 LEU A 364 -3.403 -4.873 -1.910 1.00 0.00 H new ATOM 0 HB3 LEU A 364 -2.988 -4.895 -3.613 1.00 0.00 H new ATOM 0 HG LEU A 364 -4.894 -2.911 -2.312 1.00 0.00 H new ATOM 0 HD11 LEU A 364 -3.022 -1.290 -2.678 1.00 0.00 H new ATOM 0 HD12 LEU A 364 -2.529 -2.614 -1.597 1.00 0.00 H new ATOM 0 HD13 LEU A 364 -2.011 -2.616 -3.300 1.00 0.00 H new ATOM 0 HD21 LEU A 364 -4.738 -1.662 -4.428 1.00 0.00 H new ATOM 0 HD22 LEU A 364 -3.753 -2.970 -5.127 1.00 0.00 H new ATOM 0 HD23 LEU A 364 -5.445 -3.277 -4.667 1.00 0.00 H new ATOM 501 N GLY A 365 -5.626 -7.877 -3.529 1.00 0.00 N ATOM 502 CA GLY A 365 -5.541 -9.241 -4.042 1.00 0.00 C ATOM 503 C GLY A 365 -4.394 -10.090 -3.506 1.00 0.00 C ATOM 504 O GLY A 365 -3.942 -11.001 -4.198 1.00 0.00 O ATOM 0 H GLY A 365 -6.553 -7.651 -3.169 1.00 0.00 H new ATOM 0 HA2 GLY A 365 -6.478 -9.750 -3.818 1.00 0.00 H new ATOM 0 HA3 GLY A 365 -5.455 -9.194 -5.128 1.00 0.00 H new ATOM 508 N TYR A 366 -3.972 -9.854 -2.267 1.00 0.00 N ATOM 509 CA TYR A 366 -3.028 -10.704 -1.566 1.00 0.00 C ATOM 510 C TYR A 366 -3.806 -11.428 -0.466 1.00 0.00 C ATOM 511 O TYR A 366 -4.451 -10.795 0.367 1.00 0.00 O ATOM 512 CB TYR A 366 -1.862 -9.855 -1.040 1.00 0.00 C ATOM 513 CG TYR A 366 -0.805 -9.423 -2.054 1.00 0.00 C ATOM 514 CD1 TYR A 366 -0.186 -10.374 -2.891 1.00 0.00 C ATOM 515 CD2 TYR A 366 -0.319 -8.102 -2.025 1.00 0.00 C ATOM 516 CE1 TYR A 366 0.914 -10.013 -3.688 1.00 0.00 C ATOM 517 CE2 TYR A 366 0.800 -7.740 -2.795 1.00 0.00 C ATOM 518 CZ TYR A 366 1.423 -8.697 -3.625 1.00 0.00 C ATOM 519 OH TYR A 366 2.524 -8.349 -4.347 1.00 0.00 O ATOM 0 H TYR A 366 -4.284 -9.053 -1.718 1.00 0.00 H new ATOM 0 HA TYR A 366 -2.578 -11.453 -2.217 1.00 0.00 H new ATOM 0 HB2 TYR A 366 -2.277 -8.958 -0.580 1.00 0.00 H new ATOM 0 HB3 TYR A 366 -1.364 -10.417 -0.250 1.00 0.00 H new ATOM 0 HD1 TYR A 366 -0.560 -11.387 -2.920 1.00 0.00 H new ATOM 0 HD2 TYR A 366 -0.808 -7.363 -1.408 1.00 0.00 H new ATOM 0 HE1 TYR A 366 1.368 -10.739 -4.346 1.00 0.00 H new ATOM 0 HE2 TYR A 366 1.183 -6.731 -2.752 1.00 0.00 H new ATOM 0 HH TYR A 366 2.563 -8.889 -5.164 1.00 0.00 H new ATOM 529 N GLN A 367 -3.832 -12.765 -0.529 1.00 0.00 N ATOM 530 CA GLN A 367 -4.459 -13.613 0.486 1.00 0.00 C ATOM 531 C GLN A 367 -3.962 -13.263 1.907 1.00 0.00 C ATOM 532 O GLN A 367 -2.836 -12.775 2.042 1.00 0.00 O ATOM 533 CB GLN A 367 -4.190 -15.088 0.125 1.00 0.00 C ATOM 534 CG GLN A 367 -5.465 -15.819 -0.321 1.00 0.00 C ATOM 535 CD GLN A 367 -5.312 -17.342 -0.345 1.00 0.00 C ATOM 536 OE1 GLN A 367 -5.613 -17.981 -1.347 1.00 0.00 O ATOM 537 NE2 GLN A 367 -4.886 -17.964 0.744 1.00 0.00 N ATOM 0 H GLN A 367 -3.413 -13.292 -1.295 1.00 0.00 H new ATOM 0 HA GLN A 367 -5.535 -13.438 0.495 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -3.448 -15.135 -0.672 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -3.763 -15.599 0.988 1.00 0.00 H new ATOM 0 HG2 GLN A 367 -6.282 -15.553 0.350 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -5.745 -15.473 -1.316 1.00 0.00 H new ATOM 0 HE21 GLN A 367 -4.637 -17.426 1.574 1.00 0.00 H new ATOM 0 HE22 GLN A 367 -4.807 -18.981 0.752 1.00 0.00 H new ATOM 546 N PRO A 368 -4.707 -13.601 2.980 1.00 0.00 N ATOM 547 CA PRO A 368 -4.444 -13.077 4.320 1.00 0.00 C ATOM 548 C PRO A 368 -3.116 -13.559 4.904 1.00 0.00 C ATOM 549 O PRO A 368 -2.491 -12.826 5.668 1.00 0.00 O ATOM 550 CB PRO A 368 -5.637 -13.500 5.183 1.00 0.00 C ATOM 551 CG PRO A 368 -6.195 -14.722 4.459 1.00 0.00 C ATOM 552 CD PRO A 368 -5.915 -14.412 2.991 1.00 0.00 C ATOM 0 HA PRO A 368 -4.341 -11.992 4.287 1.00 0.00 H new ATOM 0 HB2 PRO A 368 -5.329 -13.744 6.200 1.00 0.00 H new ATOM 0 HB3 PRO A 368 -6.379 -12.705 5.257 1.00 0.00 H new ATOM 0 HG2 PRO A 368 -5.702 -15.640 4.778 1.00 0.00 H new ATOM 0 HG3 PRO A 368 -7.261 -14.851 4.648 1.00 0.00 H new ATOM 0 HD2 PRO A 368 -5.776 -15.328 2.418 1.00 0.00 H new ATOM 0 HD3 PRO A 368 -6.750 -13.876 2.538 1.00 0.00 H new ATOM 560 N GLU A 369 -2.658 -14.748 4.514 1.00 0.00 N ATOM 561 CA GLU A 369 -1.378 -15.305 4.918 1.00 0.00 C ATOM 562 C GLU A 369 -0.248 -14.375 4.465 1.00 0.00 C ATOM 563 O GLU A 369 0.678 -14.103 5.227 1.00 0.00 O ATOM 564 CB GLU A 369 -1.196 -16.713 4.316 1.00 0.00 C ATOM 565 CG GLU A 369 -2.262 -17.753 4.724 1.00 0.00 C ATOM 566 CD GLU A 369 -3.620 -17.648 4.002 1.00 0.00 C ATOM 567 OE1 GLU A 369 -3.759 -16.838 3.054 1.00 0.00 O ATOM 568 OE2 GLU A 369 -4.547 -18.386 4.391 1.00 0.00 O ATOM 0 H GLU A 369 -3.184 -15.362 3.892 1.00 0.00 H new ATOM 0 HA GLU A 369 -1.350 -15.392 6.004 1.00 0.00 H new ATOM 0 HB2 GLU A 369 -1.194 -16.627 3.229 1.00 0.00 H new ATOM 0 HB3 GLU A 369 -0.216 -17.090 4.607 1.00 0.00 H new ATOM 0 HG2 GLU A 369 -1.855 -18.749 4.548 1.00 0.00 H new ATOM 0 HG3 GLU A 369 -2.435 -17.665 5.796 1.00 0.00 H new ATOM 575 N HIS A 370 -0.353 -13.831 3.247 1.00 0.00 N ATOM 576 CA HIS A 370 0.606 -12.868 2.730 1.00 0.00 C ATOM 577 C HIS A 370 0.490 -11.555 3.492 1.00 0.00 C ATOM 578 O HIS A 370 1.513 -10.916 3.716 1.00 0.00 O ATOM 579 CB HIS A 370 0.407 -12.608 1.232 1.00 0.00 C ATOM 580 CG HIS A 370 0.619 -13.822 0.368 1.00 0.00 C ATOM 581 ND1 HIS A 370 1.819 -14.232 -0.169 1.00 0.00 N ATOM 582 CD2 HIS A 370 -0.344 -14.706 -0.030 1.00 0.00 C ATOM 583 CE1 HIS A 370 1.576 -15.344 -0.885 1.00 0.00 C ATOM 584 NE2 HIS A 370 0.273 -15.663 -0.839 1.00 0.00 N ATOM 0 H HIS A 370 -1.108 -14.051 2.598 1.00 0.00 H new ATOM 0 HA HIS A 370 1.600 -13.293 2.869 1.00 0.00 H new ATOM 0 HB2 HIS A 370 -0.603 -12.231 1.070 1.00 0.00 H new ATOM 0 HB3 HIS A 370 1.095 -11.824 0.915 1.00 0.00 H new ATOM 0 HD2 HIS A 370 -1.391 -14.671 0.233 1.00 0.00 H new ATOM 0 HE1 HIS A 370 2.326 -15.904 -1.423 1.00 0.00 H new ATOM 0 HE2 HIS A 370 -0.178 -16.451 -1.304 1.00 0.00 H new ATOM 592 N ILE A 371 -0.726 -11.120 3.846 1.00 0.00 N ATOM 593 CA ILE A 371 -0.909 -9.839 4.521 1.00 0.00 C ATOM 594 C ILE A 371 -0.157 -9.863 5.843 1.00 0.00 C ATOM 595 O ILE A 371 0.640 -8.972 6.121 1.00 0.00 O ATOM 596 CB ILE A 371 -2.394 -9.507 4.750 1.00 0.00 C ATOM 597 CG1 ILE A 371 -3.176 -9.588 3.434 1.00 0.00 C ATOM 598 CG2 ILE A 371 -2.566 -8.113 5.392 1.00 0.00 C ATOM 599 CD1 ILE A 371 -2.636 -8.740 2.292 1.00 0.00 C ATOM 0 H ILE A 371 -1.589 -11.636 3.676 1.00 0.00 H new ATOM 0 HA ILE A 371 -0.509 -9.055 3.878 1.00 0.00 H new ATOM 0 HB ILE A 371 -2.795 -10.248 5.441 1.00 0.00 H new ATOM 0 HG12 ILE A 371 -3.199 -10.628 3.110 1.00 0.00 H new ATOM 0 HG13 ILE A 371 -4.207 -9.291 3.627 1.00 0.00 H new ATOM 0 HG21 ILE A 371 -3.626 -7.909 5.540 1.00 0.00 H new ATOM 0 HG22 ILE A 371 -2.054 -8.090 6.354 1.00 0.00 H new ATOM 0 HG23 ILE A 371 -2.139 -7.355 4.735 1.00 0.00 H new ATOM 0 HD11 ILE A 371 -3.264 -8.873 1.411 1.00 0.00 H new ATOM 0 HD12 ILE A 371 -2.640 -7.690 2.585 1.00 0.00 H new ATOM 0 HD13 ILE A 371 -1.616 -9.048 2.060 1.00 0.00 H new ATOM 611 N ASP A 372 -0.379 -10.882 6.668 1.00 0.00 N ATOM 612 CA ASP A 372 0.259 -10.863 7.979 1.00 0.00 C ATOM 613 C ASP A 372 1.770 -11.118 7.823 1.00 0.00 C ATOM 614 O ASP A 372 2.578 -10.498 8.513 1.00 0.00 O ATOM 615 CB ASP A 372 -0.499 -11.749 8.983 1.00 0.00 C ATOM 616 CG ASP A 372 -1.453 -10.922 9.877 1.00 0.00 C ATOM 617 OD1 ASP A 372 -1.336 -9.678 9.998 1.00 0.00 O ATOM 618 OD2 ASP A 372 -2.456 -11.481 10.369 1.00 0.00 O ATOM 0 H ASP A 372 -0.965 -11.693 6.468 1.00 0.00 H new ATOM 0 HA ASP A 372 0.192 -9.875 8.435 1.00 0.00 H new ATOM 0 HB2 ASP A 372 -1.071 -12.503 8.442 1.00 0.00 H new ATOM 0 HB3 ASP A 372 0.216 -12.281 9.610 1.00 0.00 H new ATOM 623 N SER A 373 2.181 -11.912 6.824 1.00 0.00 N ATOM 624 CA SER A 373 3.583 -12.099 6.442 1.00 0.00 C ATOM 625 C SER A 373 4.223 -10.863 5.794 1.00 0.00 C ATOM 626 O SER A 373 5.431 -10.877 5.568 1.00 0.00 O ATOM 627 CB SER A 373 3.698 -13.319 5.518 1.00 0.00 C ATOM 628 OG SER A 373 5.042 -13.737 5.377 1.00 0.00 O ATOM 0 H SER A 373 1.534 -12.451 6.249 1.00 0.00 H new ATOM 0 HA SER A 373 4.144 -12.265 7.362 1.00 0.00 H new ATOM 0 HB2 SER A 373 3.101 -14.138 5.919 1.00 0.00 H new ATOM 0 HB3 SER A 373 3.287 -13.075 4.538 1.00 0.00 H new ATOM 0 HG SER A 373 5.639 -12.972 5.516 1.00 0.00 H new ATOM 634 N PHE A 374 3.482 -9.788 5.535 1.00 0.00 N ATOM 635 CA PHE A 374 4.054 -8.517 5.098 1.00 0.00 C ATOM 636 C PHE A 374 4.402 -7.684 6.324 1.00 0.00 C ATOM 637 O PHE A 374 5.423 -7.004 6.304 1.00 0.00 O ATOM 638 CB PHE A 374 3.082 -7.735 4.197 1.00 0.00 C ATOM 639 CG PHE A 374 3.316 -7.779 2.708 1.00 0.00 C ATOM 640 CD1 PHE A 374 4.518 -7.286 2.164 1.00 0.00 C ATOM 641 CD2 PHE A 374 2.329 -8.302 1.849 1.00 0.00 C ATOM 642 CE1 PHE A 374 4.737 -7.337 0.775 1.00 0.00 C ATOM 643 CE2 PHE A 374 2.541 -8.338 0.460 1.00 0.00 C ATOM 644 CZ PHE A 374 3.745 -7.854 -0.079 1.00 0.00 C ATOM 0 H PHE A 374 2.466 -9.774 5.622 1.00 0.00 H new ATOM 0 HA PHE A 374 4.950 -8.726 4.513 1.00 0.00 H new ATOM 0 HB2 PHE A 374 2.075 -8.106 4.389 1.00 0.00 H new ATOM 0 HB3 PHE A 374 3.102 -6.691 4.509 1.00 0.00 H new ATOM 0 HD1 PHE A 374 5.273 -6.868 2.814 1.00 0.00 H new ATOM 0 HD2 PHE A 374 1.404 -8.678 2.261 1.00 0.00 H new ATOM 0 HE1 PHE A 374 5.669 -6.978 0.363 1.00 0.00 H new ATOM 0 HE2 PHE A 374 1.779 -8.737 -0.193 1.00 0.00 H new ATOM 0 HZ PHE A 374 3.909 -7.879 -1.146 1.00 0.00 H new ATOM 654 N THR A 375 3.604 -7.740 7.398 1.00 0.00 N ATOM 655 CA THR A 375 3.961 -7.060 8.644 1.00 0.00 C ATOM 656 C THR A 375 4.973 -7.870 9.477 1.00 0.00 C ATOM 657 O THR A 375 5.331 -7.440 10.573 1.00 0.00 O ATOM 658 CB THR A 375 2.733 -6.578 9.436 1.00 0.00 C ATOM 659 OG1 THR A 375 3.103 -5.786 10.542 1.00 0.00 O ATOM 660 CG2 THR A 375 1.774 -7.678 9.885 1.00 0.00 C ATOM 0 H THR A 375 2.717 -8.244 7.428 1.00 0.00 H new ATOM 0 HA THR A 375 4.482 -6.144 8.368 1.00 0.00 H new ATOM 0 HB THR A 375 2.180 -5.975 8.715 1.00 0.00 H new ATOM 0 HG1 THR A 375 4.023 -6.000 10.805 1.00 0.00 H new ATOM 0 HG21 THR A 375 0.943 -7.235 10.434 1.00 0.00 H new ATOM 0 HG22 THR A 375 1.391 -8.206 9.012 1.00 0.00 H new ATOM 0 HG23 THR A 375 2.302 -8.380 10.530 1.00 0.00 H new ATOM 668 N HIS A 376 5.408 -9.032 8.983 1.00 0.00 N ATOM 669 CA HIS A 376 6.485 -9.826 9.553 1.00 0.00 C ATOM 670 C HIS A 376 7.832 -9.212 9.154 1.00 0.00 C ATOM 671 O HIS A 376 8.762 -9.202 9.961 1.00 0.00 O ATOM 672 CB HIS A 376 6.348 -11.263 9.024 1.00 0.00 C ATOM 673 CG HIS A 376 7.540 -12.151 9.264 1.00 0.00 C ATOM 674 ND1 HIS A 376 8.567 -12.365 8.373 1.00 0.00 N ATOM 675 CD2 HIS A 376 7.801 -12.894 10.384 1.00 0.00 C ATOM 676 CE1 HIS A 376 9.436 -13.205 8.954 1.00 0.00 C ATOM 677 NE2 HIS A 376 9.007 -13.573 10.177 1.00 0.00 N ATOM 0 H HIS A 376 5.003 -9.455 8.148 1.00 0.00 H new ATOM 0 HA HIS A 376 6.432 -9.839 10.642 1.00 0.00 H new ATOM 0 HB2 HIS A 376 5.474 -11.722 9.487 1.00 0.00 H new ATOM 0 HB3 HIS A 376 6.156 -11.222 7.952 1.00 0.00 H new ATOM 0 HD1 HIS A 376 8.652 -11.959 7.441 1.00 0.00 H new ATOM 0 HD2 HIS A 376 7.185 -12.947 11.270 1.00 0.00 H new ATOM 0 HE1 HIS A 376 10.357 -13.542 8.502 1.00 0.00 H new ATOM 685 N GLU A 377 7.946 -8.721 7.916 1.00 0.00 N ATOM 686 CA GLU A 377 9.161 -8.078 7.441 1.00 0.00 C ATOM 687 C GLU A 377 9.373 -6.735 8.150 1.00 0.00 C ATOM 688 O GLU A 377 8.459 -6.202 8.781 1.00 0.00 O ATOM 689 CB GLU A 377 9.081 -7.890 5.914 1.00 0.00 C ATOM 690 CG GLU A 377 8.963 -9.219 5.149 1.00 0.00 C ATOM 691 CD GLU A 377 10.041 -10.222 5.574 1.00 0.00 C ATOM 692 OE1 GLU A 377 11.236 -9.857 5.475 1.00 0.00 O ATOM 693 OE2 GLU A 377 9.664 -11.319 6.046 1.00 0.00 O ATOM 0 H GLU A 377 7.199 -8.761 7.223 1.00 0.00 H new ATOM 0 HA GLU A 377 10.017 -8.713 7.672 1.00 0.00 H new ATOM 0 HB2 GLU A 377 8.222 -7.263 5.675 1.00 0.00 H new ATOM 0 HB3 GLU A 377 9.969 -7.358 5.572 1.00 0.00 H new ATOM 0 HG2 GLU A 377 7.977 -9.651 5.322 1.00 0.00 H new ATOM 0 HG3 GLU A 377 9.045 -9.030 4.079 1.00 0.00 H new ATOM 700 N ALA A 378 10.573 -6.159 7.971 1.00 0.00 N ATOM 701 CA ALA A 378 11.099 -5.003 8.708 1.00 0.00 C ATOM 702 C ALA A 378 10.050 -3.907 8.916 1.00 0.00 C ATOM 703 O ALA A 378 9.905 -3.404 10.027 1.00 0.00 O ATOM 704 CB ALA A 378 12.348 -4.461 8.003 1.00 0.00 C ATOM 0 H ALA A 378 11.233 -6.505 7.274 1.00 0.00 H new ATOM 0 HA ALA A 378 11.375 -5.344 9.706 1.00 0.00 H new ATOM 0 HB1 ALA A 378 12.734 -3.603 8.554 1.00 0.00 H new ATOM 0 HB2 ALA A 378 13.110 -5.239 7.963 1.00 0.00 H new ATOM 0 HB3 ALA A 378 12.089 -4.154 6.990 1.00 0.00 H new ATOM 710 N CYS A 379 9.362 -3.535 7.836 1.00 0.00 N ATOM 711 CA CYS A 379 8.070 -2.879 7.878 1.00 0.00 C ATOM 712 C CYS A 379 7.269 -3.479 6.715 1.00 0.00 C ATOM 713 O CYS A 379 7.869 -3.723 5.661 1.00 0.00 O ATOM 714 CB CYS A 379 8.150 -1.360 7.667 1.00 0.00 C ATOM 715 SG CYS A 379 8.846 -0.451 9.073 1.00 0.00 S ATOM 0 H CYS A 379 9.703 -3.689 6.887 1.00 0.00 H new ATOM 0 HA CYS A 379 7.622 -3.034 8.860 1.00 0.00 H new ATOM 0 HB2 CYS A 379 8.755 -1.158 6.783 1.00 0.00 H new ATOM 0 HB3 CYS A 379 7.149 -0.980 7.462 1.00 0.00 H new ATOM 0 HG CYS A 379 8.572 0.814 8.950 1.00 0.00 H new ATOM 721 N PRO A 380 5.932 -3.592 6.836 1.00 0.00 N ATOM 722 CA PRO A 380 5.047 -3.858 5.710 1.00 0.00 C ATOM 723 C PRO A 380 5.231 -2.769 4.672 1.00 0.00 C ATOM 724 O PRO A 380 5.836 -3.025 3.642 1.00 0.00 O ATOM 725 CB PRO A 380 3.635 -3.959 6.293 1.00 0.00 C ATOM 726 CG PRO A 380 3.708 -3.220 7.628 1.00 0.00 C ATOM 727 CD PRO A 380 5.168 -3.347 8.052 1.00 0.00 C ATOM 0 HA PRO A 380 5.263 -4.790 5.187 1.00 0.00 H new ATOM 0 HB2 PRO A 380 2.900 -3.504 5.629 1.00 0.00 H new ATOM 0 HB3 PRO A 380 3.338 -4.999 6.432 1.00 0.00 H new ATOM 0 HG2 PRO A 380 3.415 -2.176 7.521 1.00 0.00 H new ATOM 0 HG3 PRO A 380 3.040 -3.665 8.366 1.00 0.00 H new ATOM 0 HD2 PRO A 380 5.509 -2.438 8.548 1.00 0.00 H new ATOM 0 HD3 PRO A 380 5.296 -4.164 8.762 1.00 0.00 H new ATOM 735 N VAL A 381 4.670 -1.587 4.901 1.00 0.00 N ATOM 736 CA VAL A 381 4.536 -0.511 3.932 1.00 0.00 C ATOM 737 C VAL A 381 5.785 -0.290 3.048 1.00 0.00 C ATOM 738 O VAL A 381 5.639 -0.209 1.829 1.00 0.00 O ATOM 739 CB VAL A 381 3.965 0.720 4.656 1.00 0.00 C ATOM 740 CG1 VAL A 381 3.664 1.866 3.691 1.00 0.00 C ATOM 741 CG2 VAL A 381 2.652 0.391 5.381 1.00 0.00 C ATOM 0 H VAL A 381 4.279 -1.344 5.811 1.00 0.00 H new ATOM 0 HA VAL A 381 3.816 -0.788 3.162 1.00 0.00 H new ATOM 0 HB VAL A 381 4.734 1.019 5.368 1.00 0.00 H new ATOM 0 HG11 VAL A 381 3.263 2.714 4.247 1.00 0.00 H new ATOM 0 HG12 VAL A 381 4.581 2.166 3.184 1.00 0.00 H new ATOM 0 HG13 VAL A 381 2.933 1.537 2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 381 2.279 1.285 5.881 1.00 0.00 H new ATOM 0 HG22 VAL A 381 1.914 0.045 4.658 1.00 0.00 H new ATOM 0 HG23 VAL A 381 2.830 -0.390 6.120 1.00 0.00 H new ATOM 751 N ARG A 382 7.017 -0.336 3.566 1.00 0.00 N ATOM 752 CA ARG A 382 8.207 -0.303 2.707 1.00 0.00 C ATOM 753 C ARG A 382 8.283 -1.504 1.761 1.00 0.00 C ATOM 754 O ARG A 382 8.327 -1.298 0.545 1.00 0.00 O ATOM 755 CB ARG A 382 9.496 -0.106 3.526 1.00 0.00 C ATOM 756 CG ARG A 382 10.245 1.164 3.078 1.00 0.00 C ATOM 757 CD ARG A 382 11.488 1.488 3.927 1.00 0.00 C ATOM 758 NE ARG A 382 11.219 2.537 4.923 1.00 0.00 N ATOM 759 CZ ARG A 382 10.562 2.404 6.078 1.00 0.00 C ATOM 760 NH1 ARG A 382 10.229 1.214 6.554 1.00 0.00 N ATOM 761 NH2 ARG A 382 10.206 3.472 6.765 1.00 0.00 N ATOM 0 H ARG A 382 7.216 -0.396 4.565 1.00 0.00 H new ATOM 0 HA ARG A 382 8.109 0.572 2.064 1.00 0.00 H new ATOM 0 HB2 ARG A 382 9.251 -0.033 4.586 1.00 0.00 H new ATOM 0 HB3 ARG A 382 10.143 -0.975 3.408 1.00 0.00 H new ATOM 0 HG2 ARG A 382 10.548 1.047 2.038 1.00 0.00 H new ATOM 0 HG3 ARG A 382 9.560 2.011 3.117 1.00 0.00 H new ATOM 0 HD2 ARG A 382 11.825 0.584 4.435 1.00 0.00 H new ATOM 0 HD3 ARG A 382 12.299 1.808 3.274 1.00 0.00 H new ATOM 0 HE ARG A 382 11.574 3.469 4.707 1.00 0.00 H new ATOM 0 HH11 ARG A 382 10.474 0.370 6.036 1.00 0.00 H new ATOM 0 HH12 ARG A 382 9.727 1.141 7.439 1.00 0.00 H new ATOM 0 HH21 ARG A 382 10.432 4.403 6.414 1.00 0.00 H new ATOM 0 HH22 ARG A 382 9.704 3.367 7.647 1.00 0.00 H new ATOM 775 N ALA A 383 8.331 -2.742 2.271 1.00 0.00 N ATOM 776 CA ALA A 383 8.492 -3.897 1.384 1.00 0.00 C ATOM 777 C ALA A 383 7.206 -4.211 0.604 1.00 0.00 C ATOM 778 O ALA A 383 7.253 -4.860 -0.438 1.00 0.00 O ATOM 779 CB ALA A 383 8.858 -5.119 2.237 1.00 0.00 C ATOM 0 H ALA A 383 8.263 -2.965 3.264 1.00 0.00 H new ATOM 0 HA ALA A 383 9.274 -3.662 0.662 1.00 0.00 H new ATOM 0 HB1 ALA A 383 8.982 -5.989 1.592 1.00 0.00 H new ATOM 0 HB2 ALA A 383 9.790 -4.926 2.769 1.00 0.00 H new ATOM 0 HB3 ALA A 383 8.063 -5.311 2.957 1.00 0.00 H new ATOM 785 N LEU A 384 6.089 -3.605 0.986 1.00 0.00 N ATOM 786 CA LEU A 384 4.783 -3.718 0.369 1.00 0.00 C ATOM 787 C LEU A 384 4.775 -2.909 -0.908 1.00 0.00 C ATOM 788 O LEU A 384 4.349 -3.389 -1.949 1.00 0.00 O ATOM 789 CB LEU A 384 3.773 -3.147 1.365 1.00 0.00 C ATOM 790 CG LEU A 384 2.308 -3.143 0.932 1.00 0.00 C ATOM 791 CD1 LEU A 384 1.780 -4.580 0.926 1.00 0.00 C ATOM 792 CD2 LEU A 384 1.573 -2.283 1.958 1.00 0.00 C ATOM 0 H LEU A 384 6.076 -2.979 1.791 1.00 0.00 H new ATOM 0 HA LEU A 384 4.536 -4.751 0.125 1.00 0.00 H new ATOM 0 HB2 LEU A 384 3.852 -3.714 2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 384 4.063 -2.121 1.593 1.00 0.00 H new ATOM 0 HG LEU A 384 2.168 -2.744 -0.072 1.00 0.00 H new ATOM 0 HD11 LEU A 384 0.735 -4.582 0.618 1.00 0.00 H new ATOM 0 HD12 LEU A 384 2.365 -5.180 0.229 1.00 0.00 H new ATOM 0 HD13 LEU A 384 1.864 -5.003 1.927 1.00 0.00 H new ATOM 0 HD21 LEU A 384 0.514 -2.239 1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 384 1.691 -2.720 2.950 1.00 0.00 H new ATOM 0 HD23 LEU A 384 1.989 -1.276 1.953 1.00 0.00 H new ATOM 804 N LEU A 385 5.263 -1.675 -0.837 1.00 0.00 N ATOM 805 CA LEU A 385 5.251 -0.731 -1.944 1.00 0.00 C ATOM 806 C LEU A 385 6.385 -1.042 -2.924 1.00 0.00 C ATOM 807 O LEU A 385 6.339 -0.585 -4.069 1.00 0.00 O ATOM 808 CB LEU A 385 5.238 0.707 -1.390 1.00 0.00 C ATOM 809 CG LEU A 385 3.984 0.944 -0.504 1.00 0.00 C ATOM 810 CD1 LEU A 385 4.106 2.264 0.256 1.00 0.00 C ATOM 811 CD2 LEU A 385 2.647 0.834 -1.247 1.00 0.00 C ATOM 0 H LEU A 385 5.686 -1.297 0.011 1.00 0.00 H new ATOM 0 HA LEU A 385 4.340 -0.831 -2.534 1.00 0.00 H new ATOM 0 HB2 LEU A 385 6.141 0.885 -0.806 1.00 0.00 H new ATOM 0 HB3 LEU A 385 5.246 1.420 -2.215 1.00 0.00 H new ATOM 0 HG LEU A 385 3.965 0.122 0.212 1.00 0.00 H new ATOM 0 HD11 LEU A 385 3.219 2.413 0.871 1.00 0.00 H new ATOM 0 HD12 LEU A 385 4.989 2.236 0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 385 4.197 3.086 -0.454 1.00 0.00 H new ATOM 0 HD21 LEU A 385 1.828 1.014 -0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 385 2.613 1.574 -2.046 1.00 0.00 H new ATOM 0 HD23 LEU A 385 2.548 -0.165 -1.673 1.00 0.00 H new ATOM 823 N ALA A 386 7.398 -1.805 -2.497 1.00 0.00 N ATOM 824 CA ALA A 386 8.316 -2.486 -3.402 1.00 0.00 C ATOM 825 C ALA A 386 7.666 -3.706 -4.083 1.00 0.00 C ATOM 826 O ALA A 386 7.865 -3.893 -5.279 1.00 0.00 O ATOM 827 CB ALA A 386 9.558 -2.924 -2.619 1.00 0.00 C ATOM 0 H ALA A 386 7.600 -1.965 -1.510 1.00 0.00 H new ATOM 0 HA ALA A 386 8.592 -1.787 -4.192 1.00 0.00 H new ATOM 0 HB1 ALA A 386 10.250 -3.434 -3.289 1.00 0.00 H new ATOM 0 HB2 ALA A 386 10.046 -2.048 -2.192 1.00 0.00 H new ATOM 0 HB3 ALA A 386 9.263 -3.602 -1.818 1.00 0.00 H new ATOM 833 N SER A 387 6.879 -4.514 -3.364 1.00 0.00 N ATOM 834 CA SER A 387 6.457 -5.841 -3.821 1.00 0.00 C ATOM 835 C SER A 387 5.166 -5.768 -4.636 1.00 0.00 C ATOM 836 O SER A 387 5.080 -6.390 -5.692 1.00 0.00 O ATOM 837 CB SER A 387 6.300 -6.779 -2.616 1.00 0.00 C ATOM 838 OG SER A 387 6.003 -8.105 -3.012 1.00 0.00 O ATOM 0 H SER A 387 6.516 -4.264 -2.444 1.00 0.00 H new ATOM 0 HA SER A 387 7.228 -6.241 -4.480 1.00 0.00 H new ATOM 0 HB2 SER A 387 7.219 -6.773 -2.030 1.00 0.00 H new ATOM 0 HB3 SER A 387 5.506 -6.407 -1.968 1.00 0.00 H new ATOM 0 HG SER A 387 5.912 -8.671 -2.217 1.00 0.00 H new ATOM 844 N TRP A 388 4.141 -5.069 -4.141 1.00 0.00 N ATOM 845 CA TRP A 388 2.842 -4.927 -4.792 1.00 0.00 C ATOM 846 C TRP A 388 2.990 -4.465 -6.246 1.00 0.00 C ATOM 847 O TRP A 388 2.220 -4.891 -7.101 1.00 0.00 O ATOM 848 CB TRP A 388 1.978 -3.936 -4.002 1.00 0.00 C ATOM 849 CG TRP A 388 0.646 -3.725 -4.638 1.00 0.00 C ATOM 850 CD1 TRP A 388 -0.295 -4.686 -4.780 1.00 0.00 C ATOM 851 CD2 TRP A 388 0.158 -2.570 -5.385 1.00 0.00 C ATOM 852 NE1 TRP A 388 -1.305 -4.226 -5.593 1.00 0.00 N ATOM 853 CE2 TRP A 388 -1.106 -2.922 -5.942 1.00 0.00 C ATOM 854 CE3 TRP A 388 0.663 -1.287 -5.705 1.00 0.00 C ATOM 855 CZ2 TRP A 388 -1.869 -2.049 -6.707 1.00 0.00 C ATOM 856 CZ3 TRP A 388 -0.101 -0.406 -6.499 1.00 0.00 C ATOM 857 CH2 TRP A 388 -1.361 -0.776 -6.955 1.00 0.00 C ATOM 0 H TRP A 388 4.197 -4.574 -3.251 1.00 0.00 H new ATOM 0 HA TRP A 388 2.356 -5.903 -4.806 1.00 0.00 H new ATOM 0 HB2 TRP A 388 1.840 -4.305 -2.986 1.00 0.00 H new ATOM 0 HB3 TRP A 388 2.499 -2.981 -3.926 1.00 0.00 H new ATOM 0 HD1 TRP A 388 -0.259 -5.665 -4.325 1.00 0.00 H new ATOM 0 HE1 TRP A 388 -2.101 -4.788 -5.896 1.00 0.00 H new ATOM 0 HE3 TRP A 388 1.633 -0.982 -5.341 1.00 0.00 H new ATOM 0 HZ2 TRP A 388 -2.830 -2.349 -7.099 1.00 0.00 H new ATOM 0 HZ3 TRP A 388 0.297 0.565 -6.755 1.00 0.00 H new ATOM 0 HH2 TRP A 388 -1.955 -0.065 -7.510 1.00 0.00 H new ATOM 868 N GLY A 389 4.011 -3.655 -6.548 1.00 0.00 N ATOM 869 CA GLY A 389 4.311 -3.194 -7.897 1.00 0.00 C ATOM 870 C GLY A 389 4.603 -4.316 -8.906 1.00 0.00 C ATOM 871 O GLY A 389 4.693 -4.026 -10.095 1.00 0.00 O ATOM 0 H GLY A 389 4.659 -3.299 -5.846 1.00 0.00 H new ATOM 0 HA2 GLY A 389 3.469 -2.606 -8.261 1.00 0.00 H new ATOM 0 HA3 GLY A 389 5.172 -2.527 -7.856 1.00 0.00 H new ATOM 875 N ALA A 390 4.763 -5.571 -8.470 1.00 0.00 N ATOM 876 CA ALA A 390 4.882 -6.730 -9.347 1.00 0.00 C ATOM 877 C ALA A 390 3.522 -7.265 -9.827 1.00 0.00 C ATOM 878 O ALA A 390 3.503 -8.128 -10.705 1.00 0.00 O ATOM 879 CB ALA A 390 5.650 -7.837 -8.614 1.00 0.00 C ATOM 0 H ALA A 390 4.814 -5.808 -7.479 1.00 0.00 H new ATOM 0 HA ALA A 390 5.422 -6.411 -10.238 1.00 0.00 H new ATOM 0 HB1 ALA A 390 5.743 -8.707 -9.264 1.00 0.00 H new ATOM 0 HB2 ALA A 390 6.643 -7.476 -8.347 1.00 0.00 H new ATOM 0 HB3 ALA A 390 5.110 -8.116 -7.709 1.00 0.00 H new ATOM 885 N GLN A 391 2.393 -6.819 -9.262 1.00 0.00 N ATOM 886 CA GLN A 391 1.079 -7.135 -9.808 1.00 0.00 C ATOM 887 C GLN A 391 0.922 -6.311 -11.093 1.00 0.00 C ATOM 888 O GLN A 391 0.966 -5.080 -11.049 1.00 0.00 O ATOM 889 CB GLN A 391 -0.033 -6.822 -8.785 1.00 0.00 C ATOM 890 CG GLN A 391 -0.053 -7.748 -7.560 1.00 0.00 C ATOM 891 CD GLN A 391 -1.191 -7.391 -6.596 1.00 0.00 C ATOM 892 OE1 GLN A 391 -2.096 -6.619 -6.903 1.00 0.00 O ATOM 893 NE2 GLN A 391 -1.163 -7.920 -5.386 1.00 0.00 N ATOM 0 H GLN A 391 2.370 -6.237 -8.425 1.00 0.00 H new ATOM 0 HA GLN A 391 0.992 -8.198 -10.031 1.00 0.00 H new ATOM 0 HB2 GLN A 391 0.084 -5.793 -8.445 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -0.999 -6.884 -9.287 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -0.164 -8.782 -7.887 1.00 0.00 H new ATOM 0 HG3 GLN A 391 0.901 -7.680 -7.037 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.413 -8.561 -5.127 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -1.891 -7.687 -4.711 1.00 0.00 H new ATOM 902 N ASP A 392 0.752 -6.966 -12.244 1.00 0.00 N ATOM 903 CA ASP A 392 0.495 -6.282 -13.512 1.00 0.00 C ATOM 904 C ASP A 392 -0.880 -5.616 -13.458 1.00 0.00 C ATOM 905 O ASP A 392 -1.898 -6.310 -13.488 1.00 0.00 O ATOM 906 CB ASP A 392 0.619 -7.194 -14.738 1.00 0.00 C ATOM 907 CG ASP A 392 0.407 -6.396 -16.037 1.00 0.00 C ATOM 908 OD1 ASP A 392 0.610 -5.157 -16.010 1.00 0.00 O ATOM 909 OD2 ASP A 392 0.081 -7.038 -17.059 1.00 0.00 O ATOM 0 H ASP A 392 0.789 -7.982 -12.323 1.00 0.00 H new ATOM 0 HA ASP A 392 1.271 -5.526 -13.635 1.00 0.00 H new ATOM 0 HB2 ASP A 392 1.603 -7.662 -14.750 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -0.115 -7.997 -14.675 1.00 0.00 H new ATOM 914 N SER A 393 -0.873 -4.298 -13.231 1.00 0.00 N ATOM 915 CA SER A 393 -1.945 -3.308 -13.048 1.00 0.00 C ATOM 916 C SER A 393 -1.650 -2.358 -11.877 1.00 0.00 C ATOM 917 O SER A 393 -2.392 -1.394 -11.688 1.00 0.00 O ATOM 918 CB SER A 393 -3.367 -3.897 -12.952 1.00 0.00 C ATOM 919 OG SER A 393 -3.481 -4.885 -11.952 1.00 0.00 O ATOM 0 H SER A 393 0.029 -3.828 -13.160 1.00 0.00 H new ATOM 0 HA SER A 393 -1.943 -2.731 -13.973 1.00 0.00 H new ATOM 0 HB2 SER A 393 -4.075 -3.094 -12.746 1.00 0.00 H new ATOM 0 HB3 SER A 393 -3.643 -4.327 -13.915 1.00 0.00 H new ATOM 0 HG SER A 393 -3.022 -5.700 -12.244 1.00 0.00 H new ATOM 925 N ALA A 394 -0.565 -2.579 -11.119 1.00 0.00 N ATOM 926 CA ALA A 394 -0.185 -1.843 -9.915 1.00 0.00 C ATOM 927 C ALA A 394 0.301 -0.402 -10.172 1.00 0.00 C ATOM 928 O ALA A 394 1.331 0.039 -9.643 1.00 0.00 O ATOM 929 CB ALA A 394 0.869 -2.662 -9.161 1.00 0.00 C ATOM 0 H ALA A 394 0.103 -3.316 -11.346 1.00 0.00 H new ATOM 0 HA ALA A 394 -1.084 -1.718 -9.311 1.00 0.00 H new ATOM 0 HB1 ALA A 394 1.166 -2.129 -8.258 1.00 0.00 H new ATOM 0 HB2 ALA A 394 0.451 -3.631 -8.889 1.00 0.00 H new ATOM 0 HB3 ALA A 394 1.740 -2.809 -9.799 1.00 0.00 H new ATOM 935 N THR A 395 -0.440 0.388 -10.949 1.00 0.00 N ATOM 936 CA THR A 395 -0.189 1.816 -11.026 1.00 0.00 C ATOM 937 C THR A 395 -0.570 2.423 -9.669 1.00 0.00 C ATOM 938 O THR A 395 -1.316 1.811 -8.900 1.00 0.00 O ATOM 939 CB THR A 395 -0.882 2.435 -12.247 1.00 0.00 C ATOM 940 OG1 THR A 395 -2.282 2.458 -12.123 1.00 0.00 O ATOM 941 CG2 THR A 395 -0.528 1.720 -13.555 1.00 0.00 C ATOM 0 H THR A 395 -1.213 0.060 -11.528 1.00 0.00 H new ATOM 0 HA THR A 395 0.864 2.039 -11.197 1.00 0.00 H new ATOM 0 HB THR A 395 -0.507 3.458 -12.283 1.00 0.00 H new ATOM 0 HG1 THR A 395 -2.572 3.354 -11.853 1.00 0.00 H new ATOM 0 HG21 THR A 395 -1.047 2.201 -14.384 1.00 0.00 H new ATOM 0 HG22 THR A 395 0.548 1.774 -13.720 1.00 0.00 H new ATOM 0 HG23 THR A 395 -0.833 0.675 -13.493 1.00 0.00 H new ATOM 949 N LEU A 396 -0.089 3.621 -9.318 1.00 0.00 N ATOM 950 CA LEU A 396 -0.463 4.200 -8.023 1.00 0.00 C ATOM 951 C LEU A 396 -1.985 4.383 -7.938 1.00 0.00 C ATOM 952 O LEU A 396 -2.548 4.312 -6.849 1.00 0.00 O ATOM 953 CB LEU A 396 0.315 5.494 -7.729 1.00 0.00 C ATOM 954 CG LEU A 396 0.251 5.862 -6.225 1.00 0.00 C ATOM 955 CD1 LEU A 396 1.638 6.295 -5.721 1.00 0.00 C ATOM 956 CD2 LEU A 396 -0.770 6.956 -5.904 1.00 0.00 C ATOM 0 H LEU A 396 0.537 4.191 -9.888 1.00 0.00 H new ATOM 0 HA LEU A 396 -0.178 3.501 -7.237 1.00 0.00 H new ATOM 0 HB2 LEU A 396 1.355 5.372 -8.031 1.00 0.00 H new ATOM 0 HB3 LEU A 396 -0.096 6.310 -8.323 1.00 0.00 H new ATOM 0 HG LEU A 396 -0.077 4.959 -5.710 1.00 0.00 H new ATOM 0 HD11 LEU A 396 1.577 6.550 -4.663 1.00 0.00 H new ATOM 0 HD12 LEU A 396 2.346 5.477 -5.857 1.00 0.00 H new ATOM 0 HD13 LEU A 396 1.975 7.164 -6.285 1.00 0.00 H new ATOM 0 HD21 LEU A 396 -0.759 7.161 -4.834 1.00 0.00 H new ATOM 0 HD22 LEU A 396 -0.514 7.864 -6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 396 -1.765 6.623 -6.200 1.00 0.00 H new ATOM 968 N ASP A 397 -2.652 4.495 -9.091 1.00 0.00 N ATOM 969 CA ASP A 397 -4.093 4.662 -9.245 1.00 0.00 C ATOM 970 C ASP A 397 -4.847 3.392 -8.830 1.00 0.00 C ATOM 971 O ASP A 397 -6.005 3.480 -8.429 1.00 0.00 O ATOM 972 CB ASP A 397 -4.508 4.995 -10.705 1.00 0.00 C ATOM 973 CG ASP A 397 -3.453 5.641 -11.608 1.00 0.00 C ATOM 974 OD1 ASP A 397 -2.351 5.058 -11.743 1.00 0.00 O ATOM 975 OD2 ASP A 397 -3.719 6.636 -12.314 1.00 0.00 O ATOM 0 H ASP A 397 -2.170 4.470 -9.990 1.00 0.00 H new ATOM 0 HA ASP A 397 -4.356 5.498 -8.598 1.00 0.00 H new ATOM 0 HB2 ASP A 397 -4.838 4.071 -11.180 1.00 0.00 H new ATOM 0 HB3 ASP A 397 -5.371 5.660 -10.667 1.00 0.00 H new ATOM 980 N ALA A 398 -4.189 2.230 -8.820 1.00 0.00 N ATOM 981 CA ALA A 398 -4.776 0.971 -8.369 1.00 0.00 C ATOM 982 C ALA A 398 -4.774 0.922 -6.838 1.00 0.00 C ATOM 983 O ALA A 398 -5.795 0.590 -6.233 1.00 0.00 O ATOM 984 CB ALA A 398 -4.033 -0.237 -8.967 1.00 0.00 C ATOM 0 H ALA A 398 -3.221 2.139 -9.129 1.00 0.00 H new ATOM 0 HA ALA A 398 -5.806 0.918 -8.720 1.00 0.00 H new ATOM 0 HB1 ALA A 398 -4.493 -1.159 -8.613 1.00 0.00 H new ATOM 0 HB2 ALA A 398 -4.090 -0.197 -10.055 1.00 0.00 H new ATOM 0 HB3 ALA A 398 -2.988 -0.211 -8.658 1.00 0.00 H new ATOM 990 N LEU A 399 -3.661 1.299 -6.198 1.00 0.00 N ATOM 991 CA LEU A 399 -3.588 1.350 -4.738 1.00 0.00 C ATOM 992 C LEU A 399 -4.565 2.398 -4.220 1.00 0.00 C ATOM 993 O LEU A 399 -5.284 2.173 -3.249 1.00 0.00 O ATOM 994 CB LEU A 399 -2.149 1.640 -4.274 1.00 0.00 C ATOM 995 CG LEU A 399 -2.025 1.532 -2.742 1.00 0.00 C ATOM 996 CD1 LEU A 399 -0.701 0.868 -2.345 1.00 0.00 C ATOM 997 CD2 LEU A 399 -2.153 2.881 -2.024 1.00 0.00 C ATOM 0 H LEU A 399 -2.800 1.573 -6.671 1.00 0.00 H new ATOM 0 HA LEU A 399 -3.869 0.380 -4.327 1.00 0.00 H new ATOM 0 HB2 LEU A 399 -1.463 0.938 -4.747 1.00 0.00 H new ATOM 0 HB3 LEU A 399 -1.855 2.639 -4.596 1.00 0.00 H new ATOM 0 HG LEU A 399 -2.863 0.913 -2.422 1.00 0.00 H new ATOM 0 HD11 LEU A 399 -0.638 0.804 -1.259 1.00 0.00 H new ATOM 0 HD12 LEU A 399 -0.654 -0.134 -2.771 1.00 0.00 H new ATOM 0 HD13 LEU A 399 0.131 1.462 -2.722 1.00 0.00 H new ATOM 0 HD21 LEU A 399 -2.056 2.731 -0.949 1.00 0.00 H new ATOM 0 HD22 LEU A 399 -1.367 3.553 -2.369 1.00 0.00 H new ATOM 0 HD23 LEU A 399 -3.127 3.319 -2.243 1.00 0.00 H new ATOM 1009 N LEU A 400 -4.626 3.529 -4.918 1.00 0.00 N ATOM 1010 CA LEU A 400 -5.544 4.620 -4.681 1.00 0.00 C ATOM 1011 C LEU A 400 -6.996 4.138 -4.802 1.00 0.00 C ATOM 1012 O LEU A 400 -7.854 4.573 -4.034 1.00 0.00 O ATOM 1013 CB LEU A 400 -5.191 5.691 -5.736 1.00 0.00 C ATOM 1014 CG LEU A 400 -6.256 6.727 -6.138 1.00 0.00 C ATOM 1015 CD1 LEU A 400 -5.562 8.011 -6.626 1.00 0.00 C ATOM 1016 CD2 LEU A 400 -7.217 6.315 -7.264 1.00 0.00 C ATOM 0 H LEU A 400 -4.001 3.710 -5.703 1.00 0.00 H new ATOM 0 HA LEU A 400 -5.454 5.028 -3.674 1.00 0.00 H new ATOM 0 HB2 LEU A 400 -4.322 6.238 -5.370 1.00 0.00 H new ATOM 0 HB3 LEU A 400 -4.881 5.170 -6.642 1.00 0.00 H new ATOM 0 HG LEU A 400 -6.850 6.850 -5.232 1.00 0.00 H new ATOM 0 HD11 LEU A 400 -6.315 8.746 -6.911 1.00 0.00 H new ATOM 0 HD12 LEU A 400 -4.944 8.417 -5.826 1.00 0.00 H new ATOM 0 HD13 LEU A 400 -4.935 7.781 -7.488 1.00 0.00 H new ATOM 0 HD21 LEU A 400 -7.920 7.125 -7.457 1.00 0.00 H new ATOM 0 HD22 LEU A 400 -6.648 6.105 -8.169 1.00 0.00 H new ATOM 0 HD23 LEU A 400 -7.766 5.422 -6.965 1.00 0.00 H new ATOM 1028 N ALA A 401 -7.297 3.262 -5.765 1.00 0.00 N ATOM 1029 CA ALA A 401 -8.641 2.743 -5.968 1.00 0.00 C ATOM 1030 C ALA A 401 -9.039 1.834 -4.811 1.00 0.00 C ATOM 1031 O ALA A 401 -10.134 1.989 -4.270 1.00 0.00 O ATOM 1032 CB ALA A 401 -8.734 1.990 -7.296 1.00 0.00 C ATOM 0 H ALA A 401 -6.610 2.896 -6.424 1.00 0.00 H new ATOM 0 HA ALA A 401 -9.333 3.585 -6.003 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -9.747 1.610 -7.429 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -8.490 2.666 -8.115 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -8.031 1.157 -7.292 1.00 0.00 H new ATOM 1038 N ALA A 402 -8.173 0.888 -4.438 1.00 0.00 N ATOM 1039 CA ALA A 402 -8.418 0.002 -3.309 1.00 0.00 C ATOM 1040 C ALA A 402 -8.562 0.807 -2.012 1.00 0.00 C ATOM 1041 O ALA A 402 -9.476 0.542 -1.234 1.00 0.00 O ATOM 1042 CB ALA A 402 -7.323 -1.059 -3.235 1.00 0.00 C ATOM 0 H ALA A 402 -7.286 0.719 -4.912 1.00 0.00 H new ATOM 0 HA ALA A 402 -9.363 -0.522 -3.451 1.00 0.00 H new ATOM 0 HB1 ALA A 402 -7.512 -1.719 -2.388 1.00 0.00 H new ATOM 0 HB2 ALA A 402 -7.319 -1.642 -4.156 1.00 0.00 H new ATOM 0 HB3 ALA A 402 -6.355 -0.574 -3.108 1.00 0.00 H new ATOM 1048 N LEU A 403 -7.751 1.850 -1.802 1.00 0.00 N ATOM 1049 CA LEU A 403 -7.979 2.782 -0.707 1.00 0.00 C ATOM 1050 C LEU A 403 -9.357 3.425 -0.747 1.00 0.00 C ATOM 1051 O LEU A 403 -10.053 3.473 0.267 1.00 0.00 O ATOM 1052 CB LEU A 403 -6.956 3.911 -0.749 1.00 0.00 C ATOM 1053 CG LEU A 403 -5.602 3.597 -0.130 1.00 0.00 C ATOM 1054 CD1 LEU A 403 -4.679 4.765 -0.492 1.00 0.00 C ATOM 1055 CD2 LEU A 403 -5.778 3.453 1.384 1.00 0.00 C ATOM 0 H LEU A 403 -6.936 2.064 -2.377 1.00 0.00 H new ATOM 0 HA LEU A 403 -7.891 2.190 0.204 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -6.802 4.198 -1.789 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -7.377 4.777 -0.238 1.00 0.00 H new ATOM 0 HG LEU A 403 -5.173 2.665 -0.498 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -3.689 4.591 -0.071 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -4.603 4.846 -1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -5.088 5.691 -0.087 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.815 3.228 1.842 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -6.167 4.385 1.795 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -6.478 2.644 1.594 1.00 0.00 H new ATOM 1067 N ARG A 404 -9.747 3.983 -1.892 1.00 0.00 N ATOM 1068 CA ARG A 404 -10.988 4.748 -1.958 1.00 0.00 C ATOM 1069 C ARG A 404 -12.171 3.776 -1.790 1.00 0.00 C ATOM 1070 O ARG A 404 -13.183 4.169 -1.214 1.00 0.00 O ATOM 1071 CB ARG A 404 -11.009 5.594 -3.245 1.00 0.00 C ATOM 1072 CG ARG A 404 -12.212 6.553 -3.302 1.00 0.00 C ATOM 1073 CD ARG A 404 -12.210 7.505 -4.514 1.00 0.00 C ATOM 1074 NE ARG A 404 -10.964 8.281 -4.702 1.00 0.00 N ATOM 1075 CZ ARG A 404 -10.582 9.425 -4.105 1.00 0.00 C ATOM 1076 NH1 ARG A 404 -11.260 9.952 -3.095 1.00 0.00 N ATOM 1077 NH2 ARG A 404 -9.500 10.053 -4.534 1.00 0.00 N ATOM 0 H ARG A 404 -9.232 3.921 -2.770 1.00 0.00 H new ATOM 0 HA ARG A 404 -11.070 5.470 -1.146 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -10.086 6.170 -3.312 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -11.035 4.932 -4.111 1.00 0.00 H new ATOM 0 HG2 ARG A 404 -13.130 5.965 -3.319 1.00 0.00 H new ATOM 0 HG3 ARG A 404 -12.231 7.147 -2.388 1.00 0.00 H new ATOM 0 HD2 ARG A 404 -12.395 6.921 -5.415 1.00 0.00 H new ATOM 0 HD3 ARG A 404 -13.041 8.202 -4.410 1.00 0.00 H new ATOM 0 HE ARG A 404 -10.304 7.896 -5.377 1.00 0.00 H new ATOM 0 HH11 ARG A 404 -12.100 9.489 -2.747 1.00 0.00 H new ATOM 0 HH12 ARG A 404 -10.942 10.821 -2.666 1.00 0.00 H new ATOM 0 HH21 ARG A 404 -8.962 9.670 -5.311 1.00 0.00 H new ATOM 0 HH22 ARG A 404 -9.203 10.921 -4.087 1.00 0.00 H new ATOM 1091 N ARG A 405 -12.034 2.505 -2.199 1.00 0.00 N ATOM 1092 CA ARG A 405 -12.943 1.407 -1.861 1.00 0.00 C ATOM 1093 C ARG A 405 -13.151 1.262 -0.353 1.00 0.00 C ATOM 1094 O ARG A 405 -14.302 1.283 0.080 1.00 0.00 O ATOM 1095 CB ARG A 405 -12.491 0.105 -2.552 1.00 0.00 C ATOM 1096 CG ARG A 405 -13.227 -1.131 -2.019 1.00 0.00 C ATOM 1097 CD ARG A 405 -13.322 -2.271 -3.048 1.00 0.00 C ATOM 1098 NE ARG A 405 -12.269 -3.279 -2.875 1.00 0.00 N ATOM 1099 CZ ARG A 405 -11.234 -3.596 -3.659 1.00 0.00 C ATOM 1100 NH1 ARG A 405 -10.893 -2.836 -4.700 1.00 0.00 N ATOM 1101 NH2 ARG A 405 -10.542 -4.689 -3.394 1.00 0.00 N ATOM 0 H ARG A 405 -11.261 2.207 -2.794 1.00 0.00 H new ATOM 0 HA ARG A 405 -13.932 1.648 -2.252 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -12.661 0.190 -3.625 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -11.418 -0.025 -2.408 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -12.714 -1.496 -1.129 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -14.232 -0.843 -1.712 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -14.297 -2.751 -2.963 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -13.259 -1.854 -4.053 1.00 0.00 H new ATOM 0 HE ARG A 405 -12.338 -3.826 -2.017 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -11.426 -1.993 -4.912 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -10.099 -3.098 -5.284 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -10.800 -5.277 -2.601 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -9.749 -4.946 -3.982 1.00 0.00 H new ATOM 1115 N ILE A 406 -12.099 1.261 0.464 1.00 0.00 N ATOM 1116 CA ILE A 406 -12.237 1.151 1.928 1.00 0.00 C ATOM 1117 C ILE A 406 -12.413 2.543 2.551 1.00 0.00 C ATOM 1118 O ILE A 406 -12.183 2.754 3.743 1.00 0.00 O ATOM 1119 CB ILE A 406 -11.075 0.364 2.556 1.00 0.00 C ATOM 1120 CG1 ILE A 406 -9.704 0.972 2.233 1.00 0.00 C ATOM 1121 CG2 ILE A 406 -11.169 -1.098 2.115 1.00 0.00 C ATOM 1122 CD1 ILE A 406 -8.569 0.003 2.509 1.00 0.00 C ATOM 0 H ILE A 406 -11.134 1.335 0.142 1.00 0.00 H new ATOM 0 HA ILE A 406 -13.137 0.576 2.147 1.00 0.00 H new ATOM 0 HB ILE A 406 -11.166 0.421 3.641 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -9.678 1.270 1.185 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -9.560 1.876 2.825 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -10.349 -1.664 2.556 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -12.119 -1.518 2.446 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -11.107 -1.155 1.028 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -7.618 0.477 2.266 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -8.576 -0.275 3.563 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -8.696 -0.890 1.897 1.00 0.00 H new ATOM 1134 N GLN A 407 -12.845 3.503 1.726 1.00 0.00 N ATOM 1135 CA GLN A 407 -13.109 4.898 2.025 1.00 0.00 C ATOM 1136 C GLN A 407 -11.914 5.581 2.695 1.00 0.00 C ATOM 1137 O GLN A 407 -12.065 6.674 3.241 1.00 0.00 O ATOM 1138 CB GLN A 407 -14.427 5.007 2.813 1.00 0.00 C ATOM 1139 CG GLN A 407 -15.650 4.645 1.945 1.00 0.00 C ATOM 1140 CD GLN A 407 -16.411 3.449 2.517 1.00 0.00 C ATOM 1141 OE1 GLN A 407 -17.226 3.604 3.416 1.00 0.00 O ATOM 1142 NE2 GLN A 407 -16.176 2.240 2.030 1.00 0.00 N ATOM 0 H GLN A 407 -13.033 3.295 0.745 1.00 0.00 H new ATOM 0 HA GLN A 407 -13.242 5.453 1.096 1.00 0.00 H new ATOM 0 HB2 GLN A 407 -14.388 4.345 3.678 1.00 0.00 H new ATOM 0 HB3 GLN A 407 -14.540 6.022 3.193 1.00 0.00 H new ATOM 0 HG2 GLN A 407 -16.318 5.504 1.879 1.00 0.00 H new ATOM 0 HG3 GLN A 407 -15.323 4.417 0.931 1.00 0.00 H new ATOM 0 HE21 GLN A 407 -15.496 2.116 1.280 1.00 0.00 H new ATOM 0 HE22 GLN A 407 -16.675 1.433 2.405 1.00 0.00 H new ATOM 1151 N ARG A 408 -10.706 5.012 2.584 1.00 0.00 N ATOM 1152 CA ARG A 408 -9.468 5.676 2.999 1.00 0.00 C ATOM 1153 C ARG A 408 -8.992 6.662 1.939 1.00 0.00 C ATOM 1154 O ARG A 408 -7.842 6.660 1.507 1.00 0.00 O ATOM 1155 CB ARG A 408 -8.409 4.652 3.428 1.00 0.00 C ATOM 1156 CG ARG A 408 -8.767 3.872 4.705 1.00 0.00 C ATOM 1157 CD ARG A 408 -8.594 4.652 6.023 1.00 0.00 C ATOM 1158 NE ARG A 408 -9.421 5.860 6.160 1.00 0.00 N ATOM 1159 CZ ARG A 408 -10.752 5.965 6.226 1.00 0.00 C ATOM 1160 NH1 ARG A 408 -11.544 4.898 6.109 1.00 0.00 N ATOM 1161 NH2 ARG A 408 -11.280 7.169 6.391 1.00 0.00 N ATOM 0 H ARG A 408 -10.562 4.077 2.203 1.00 0.00 H new ATOM 0 HA ARG A 408 -9.668 6.277 3.886 1.00 0.00 H new ATOM 0 HB2 ARG A 408 -8.254 3.943 2.614 1.00 0.00 H new ATOM 0 HB3 ARG A 408 -7.462 5.169 3.585 1.00 0.00 H new ATOM 0 HG2 ARG A 408 -9.803 3.542 4.631 1.00 0.00 H new ATOM 0 HG3 ARG A 408 -8.149 2.975 4.749 1.00 0.00 H new ATOM 0 HD2 ARG A 408 -8.820 3.982 6.853 1.00 0.00 H new ATOM 0 HD3 ARG A 408 -7.547 4.938 6.120 1.00 0.00 H new ATOM 0 HE ARG A 408 -8.908 6.740 6.212 1.00 0.00 H new ATOM 0 HH11 ARG A 408 -11.137 3.974 5.965 1.00 0.00 H new ATOM 0 HH12 ARG A 408 -12.557 5.006 6.163 1.00 0.00 H new ATOM 0 HH21 ARG A 408 -10.674 7.986 6.464 1.00 0.00 H new ATOM 0 HH22 ARG A 408 -12.293 7.279 6.445 1.00 0.00 H new ATOM 1175 N ALA A 409 -9.921 7.515 1.513 1.00 0.00 N ATOM 1176 CA ALA A 409 -9.704 8.599 0.576 1.00 0.00 C ATOM 1177 C ALA A 409 -8.841 9.707 1.193 1.00 0.00 C ATOM 1178 O ALA A 409 -8.195 10.451 0.468 1.00 0.00 O ATOM 1179 CB ALA A 409 -11.079 9.144 0.194 1.00 0.00 C ATOM 0 H ALA A 409 -10.889 7.461 1.831 1.00 0.00 H new ATOM 0 HA ALA A 409 -9.169 8.235 -0.301 1.00 0.00 H new ATOM 0 HB1 ALA A 409 -10.961 9.965 -0.513 1.00 0.00 H new ATOM 0 HB2 ALA A 409 -11.670 8.351 -0.265 1.00 0.00 H new ATOM 0 HB3 ALA A 409 -11.588 9.505 1.088 1.00 0.00 H new ATOM 1185 N ASP A 410 -8.778 9.770 2.521 1.00 0.00 N ATOM 1186 CA ASP A 410 -7.839 10.580 3.289 1.00 0.00 C ATOM 1187 C ASP A 410 -6.400 10.252 2.883 1.00 0.00 C ATOM 1188 O ASP A 410 -5.649 11.153 2.509 1.00 0.00 O ATOM 1189 CB ASP A 410 -8.085 10.416 4.808 1.00 0.00 C ATOM 1190 CG ASP A 410 -8.428 8.997 5.296 1.00 0.00 C ATOM 1191 OD1 ASP A 410 -8.104 8.001 4.614 1.00 0.00 O ATOM 1192 OD2 ASP A 410 -9.160 8.864 6.300 1.00 0.00 O ATOM 0 H ASP A 410 -9.409 9.233 3.116 1.00 0.00 H new ATOM 0 HA ASP A 410 -8.004 11.633 3.061 1.00 0.00 H new ATOM 0 HB2 ASP A 410 -7.194 10.753 5.337 1.00 0.00 H new ATOM 0 HB3 ASP A 410 -8.898 11.082 5.096 1.00 0.00 H new ATOM 1197 N ILE A 411 -6.019 8.971 2.883 1.00 0.00 N ATOM 1198 CA ILE A 411 -4.689 8.559 2.436 1.00 0.00 C ATOM 1199 C ILE A 411 -4.535 8.881 0.955 1.00 0.00 C ATOM 1200 O ILE A 411 -3.456 9.297 0.549 1.00 0.00 O ATOM 1201 CB ILE A 411 -4.413 7.054 2.695 1.00 0.00 C ATOM 1202 CG1 ILE A 411 -4.815 6.672 4.150 1.00 0.00 C ATOM 1203 CG2 ILE A 411 -2.957 6.688 2.350 1.00 0.00 C ATOM 1204 CD1 ILE A 411 -4.657 5.209 4.583 1.00 0.00 C ATOM 0 H ILE A 411 -6.615 8.202 3.188 1.00 0.00 H new ATOM 0 HA ILE A 411 -3.954 9.115 3.018 1.00 0.00 H new ATOM 0 HB ILE A 411 -5.037 6.458 2.029 1.00 0.00 H new ATOM 0 HG12 ILE A 411 -4.226 7.287 4.831 1.00 0.00 H new ATOM 0 HG13 ILE A 411 -5.859 6.951 4.291 1.00 0.00 H new ATOM 0 HG21 ILE A 411 -2.793 5.628 2.542 1.00 0.00 H new ATOM 0 HG22 ILE A 411 -2.768 6.900 1.298 1.00 0.00 H new ATOM 0 HG23 ILE A 411 -2.278 7.277 2.966 1.00 0.00 H new ATOM 0 HD11 ILE A 411 -4.977 5.100 5.619 1.00 0.00 H new ATOM 0 HD12 ILE A 411 -5.270 4.572 3.945 1.00 0.00 H new ATOM 0 HD13 ILE A 411 -3.612 4.914 4.493 1.00 0.00 H new ATOM 1216 N VAL A 412 -5.576 8.671 0.145 1.00 0.00 N ATOM 1217 CA VAL A 412 -5.475 8.874 -1.291 1.00 0.00 C ATOM 1218 C VAL A 412 -5.125 10.333 -1.604 1.00 0.00 C ATOM 1219 O VAL A 412 -4.247 10.596 -2.420 1.00 0.00 O ATOM 1220 CB VAL A 412 -6.792 8.522 -2.005 1.00 0.00 C ATOM 1221 CG1 VAL A 412 -6.701 8.829 -3.495 1.00 0.00 C ATOM 1222 CG2 VAL A 412 -7.129 7.042 -1.867 1.00 0.00 C ATOM 0 H VAL A 412 -6.494 8.361 0.464 1.00 0.00 H new ATOM 0 HA VAL A 412 -4.687 8.214 -1.653 1.00 0.00 H new ATOM 0 HB VAL A 412 -7.567 9.126 -1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 412 -7.644 8.572 -3.978 1.00 0.00 H new ATOM 0 HG12 VAL A 412 -6.499 9.891 -3.636 1.00 0.00 H new ATOM 0 HG13 VAL A 412 -5.895 8.244 -3.938 1.00 0.00 H new ATOM 0 HG21 VAL A 412 -8.065 6.832 -2.384 1.00 0.00 H new ATOM 0 HG22 VAL A 412 -6.330 6.444 -2.306 1.00 0.00 H new ATOM 0 HG23 VAL A 412 -7.233 6.789 -0.812 1.00 0.00 H new ATOM 1232 N GLU A 413 -5.873 11.279 -1.042 1.00 0.00 N ATOM 1233 CA GLU A 413 -5.699 12.698 -1.311 1.00 0.00 C ATOM 1234 C GLU A 413 -4.297 13.161 -0.887 1.00 0.00 C ATOM 1235 O GLU A 413 -3.678 13.949 -1.602 1.00 0.00 O ATOM 1236 CB GLU A 413 -6.861 13.474 -0.663 1.00 0.00 C ATOM 1237 CG GLU A 413 -8.093 13.684 -1.578 1.00 0.00 C ATOM 1238 CD GLU A 413 -8.664 12.443 -2.294 1.00 0.00 C ATOM 1239 OE1 GLU A 413 -8.075 12.010 -3.309 1.00 0.00 O ATOM 1240 OE2 GLU A 413 -9.779 11.963 -1.971 1.00 0.00 O ATOM 0 H GLU A 413 -6.623 11.077 -0.381 1.00 0.00 H new ATOM 0 HA GLU A 413 -5.746 12.904 -2.380 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -7.179 12.942 0.234 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -6.494 14.449 -0.342 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -8.889 14.122 -0.976 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -7.827 14.419 -2.338 1.00 0.00 H new ATOM 1247 N SER A 414 -3.749 12.620 0.208 1.00 0.00 N ATOM 1248 CA SER A 414 -2.366 12.882 0.595 1.00 0.00 C ATOM 1249 C SER A 414 -1.387 12.222 -0.383 1.00 0.00 C ATOM 1250 O SER A 414 -0.401 12.820 -0.809 1.00 0.00 O ATOM 1251 CB SER A 414 -2.173 12.334 2.001 1.00 0.00 C ATOM 1252 OG SER A 414 -0.910 12.705 2.496 1.00 0.00 O ATOM 0 H SER A 414 -4.249 11.996 0.841 1.00 0.00 H new ATOM 0 HA SER A 414 -2.165 13.953 0.572 1.00 0.00 H new ATOM 0 HB2 SER A 414 -2.955 12.714 2.658 1.00 0.00 H new ATOM 0 HB3 SER A 414 -2.264 11.248 1.992 1.00 0.00 H new ATOM 0 HG SER A 414 -1.022 13.240 3.310 1.00 0.00 H new ATOM 1258 N LEU A 415 -1.686 10.994 -0.805 1.00 0.00 N ATOM 1259 CA LEU A 415 -0.951 10.278 -1.851 1.00 0.00 C ATOM 1260 C LEU A 415 -0.851 11.101 -3.131 1.00 0.00 C ATOM 1261 O LEU A 415 0.179 11.044 -3.803 1.00 0.00 O ATOM 1262 CB LEU A 415 -1.603 8.916 -2.175 1.00 0.00 C ATOM 1263 CG LEU A 415 -0.884 7.732 -1.533 1.00 0.00 C ATOM 1264 CD1 LEU A 415 -1.748 6.463 -1.617 1.00 0.00 C ATOM 1265 CD2 LEU A 415 0.446 7.499 -2.262 1.00 0.00 C ATOM 0 H LEU A 415 -2.463 10.456 -0.422 1.00 0.00 H new ATOM 0 HA LEU A 415 0.052 10.107 -1.459 1.00 0.00 H new ATOM 0 HB2 LEU A 415 -2.640 8.928 -1.838 1.00 0.00 H new ATOM 0 HB3 LEU A 415 -1.621 8.778 -3.256 1.00 0.00 H new ATOM 0 HG LEU A 415 -0.700 7.955 -0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 415 -1.218 5.631 -1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 415 -2.690 6.629 -1.094 1.00 0.00 H new ATOM 0 HD13 LEU A 415 -1.949 6.228 -2.662 1.00 0.00 H new ATOM 0 HD21 LEU A 415 0.966 6.655 -1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 415 0.252 7.285 -3.313 1.00 0.00 H new ATOM 0 HD23 LEU A 415 1.066 8.392 -2.182 1.00 0.00 H new