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 353 ASN : amide:sc= 0.605 K(o=1.2,f=0.49) USER MOD Set 1.2: A 356 THR OG1 : rot 180:sc= 0.632 USER MOD Single : A 337 TYR OH : rot -130:sc= -2.42! USER MOD Single : A 338 SER OG : rot 167:sc= 0.411 USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 344 LYS NZ :NH3+ 153:sc= 1.2 (180deg=-0.168) USER MOD Single : A 350 LYS NZ :NH3+ -141:sc= 0.37 (180deg=-1.85!) USER MOD Single : A 359 HIS : no HE2:sc= 0.535 K(o=0.53,f=-1.8!) USER MOD Single : A 366 TYR OH : rot 0:sc= 0 USER MOD Single : A 367 GLN : amide:sc= 1.08 K(o=1.1,f=-0.022) USER MOD Single : A 370 HIS : no HD1:sc= -0.0204 X(o=-0.02,f=-0.0021) USER MOD Single : A 373 SER OG : rot 180:sc= 0 USER MOD Single : A 375 THR OG1 : rot -28:sc= 1.24 USER MOD Single : A 376 HIS : no HE2:sc= 0.593 K(o=0.59,f=-2.4!) USER MOD Single : A 379 CYS SG : rot 24:sc= 0.604 USER MOD Single : A 387 SER OG : rot 86:sc= 1.06 USER MOD Single : A 391 GLN : amide:sc=-0.00788 X(o=-0.0079,f=-0.055) USER MOD Single : A 393 SER OG : rot 180:sc= 0.056 USER MOD Single : A 395 THR OG1 : rot 122:sc= 1.26 USER MOD Single : A 407 GLN : amide:sc= 0.0775 K(o=0.077,f=-4.2!) USER MOD Single : A 414 SER OG : rot 130:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 24 N LEU A 336 3.918 2.660 -12.028 1.00 0.00 N ATOM 25 CA LEU A 336 3.674 2.063 -10.731 1.00 0.00 C ATOM 26 C LEU A 336 3.313 3.082 -9.653 1.00 0.00 C ATOM 27 O LEU A 336 3.505 4.287 -9.795 1.00 0.00 O ATOM 28 CB LEU A 336 4.989 1.341 -10.363 1.00 0.00 C ATOM 29 CG LEU A 336 5.002 -0.177 -10.599 1.00 0.00 C ATOM 30 CD1 LEU A 336 4.829 -0.876 -9.255 1.00 0.00 C ATOM 31 CD2 LEU A 336 3.990 -0.729 -11.613 1.00 0.00 C ATOM 0 HA LEU A 336 2.816 1.393 -10.785 1.00 0.00 H new ATOM 0 HB2 LEU A 336 5.800 1.787 -10.938 1.00 0.00 H new ATOM 0 HB3 LEU A 336 5.203 1.529 -9.311 1.00 0.00 H new ATOM 0 HG LEU A 336 5.966 -0.387 -11.062 1.00 0.00 H new ATOM 0 HD11 LEU A 336 4.836 -1.956 -9.403 1.00 0.00 H new ATOM 0 HD12 LEU A 336 5.647 -0.596 -8.591 1.00 0.00 H new ATOM 0 HD13 LEU A 336 3.881 -0.577 -8.809 1.00 0.00 H new ATOM 0 HD21 LEU A 336 4.102 -1.811 -11.687 1.00 0.00 H new ATOM 0 HD22 LEU A 336 2.978 -0.491 -11.284 1.00 0.00 H new ATOM 0 HD23 LEU A 336 4.170 -0.278 -12.589 1.00 0.00 H new ATOM 43 N TYR A 337 3.038 2.564 -8.464 1.00 0.00 N ATOM 44 CA TYR A 337 2.948 3.335 -7.238 1.00 0.00 C ATOM 45 C TYR A 337 4.345 3.825 -6.867 1.00 0.00 C ATOM 46 O TYR A 337 4.585 5.006 -6.599 1.00 0.00 O ATOM 47 CB TYR A 337 2.362 2.411 -6.171 1.00 0.00 C ATOM 48 CG TYR A 337 2.071 3.104 -4.866 1.00 0.00 C ATOM 49 CD1 TYR A 337 3.092 3.338 -3.926 1.00 0.00 C ATOM 50 CD2 TYR A 337 0.763 3.546 -4.618 1.00 0.00 C ATOM 51 CE1 TYR A 337 2.790 4.012 -2.731 1.00 0.00 C ATOM 52 CE2 TYR A 337 0.468 4.257 -3.450 1.00 0.00 C ATOM 53 CZ TYR A 337 1.476 4.457 -2.487 1.00 0.00 C ATOM 54 OH TYR A 337 1.184 5.071 -1.318 1.00 0.00 O ATOM 0 H TYR A 337 2.867 1.568 -8.325 1.00 0.00 H new ATOM 0 HA TYR A 337 2.309 4.212 -7.342 1.00 0.00 H new ATOM 0 HB2 TYR A 337 1.441 1.969 -6.551 1.00 0.00 H new ATOM 0 HB3 TYR A 337 3.058 1.592 -5.990 1.00 0.00 H new ATOM 0 HD1 TYR A 337 4.100 3.002 -4.122 1.00 0.00 H new ATOM 0 HD2 TYR A 337 -0.020 3.336 -5.332 1.00 0.00 H new ATOM 0 HE1 TYR A 337 3.565 4.189 -2.000 1.00 0.00 H new ATOM 0 HE2 TYR A 337 -0.525 4.650 -3.288 1.00 0.00 H new ATOM 0 HH TYR A 337 0.390 4.656 -0.920 1.00 0.00 H new ATOM 64 N SER A 338 5.286 2.892 -6.909 1.00 0.00 N ATOM 65 CA SER A 338 6.722 3.053 -6.798 1.00 0.00 C ATOM 66 C SER A 338 7.340 3.770 -8.013 1.00 0.00 C ATOM 67 O SER A 338 8.553 3.947 -8.055 1.00 0.00 O ATOM 68 CB SER A 338 7.307 1.661 -6.533 1.00 0.00 C ATOM 69 OG SER A 338 6.585 1.098 -5.440 1.00 0.00 O ATOM 0 H SER A 338 5.035 1.911 -7.034 1.00 0.00 H new ATOM 0 HA SER A 338 6.971 3.716 -5.969 1.00 0.00 H new ATOM 0 HB2 SER A 338 7.217 1.031 -7.418 1.00 0.00 H new ATOM 0 HB3 SER A 338 8.369 1.729 -6.297 1.00 0.00 H new ATOM 0 HG SER A 338 6.780 0.139 -5.379 1.00 0.00 H new ATOM 75 N SER A 339 6.536 4.191 -9.005 1.00 0.00 N ATOM 76 CA SER A 339 6.987 5.155 -10.009 1.00 0.00 C ATOM 77 C SER A 339 7.493 6.414 -9.305 1.00 0.00 C ATOM 78 O SER A 339 8.431 7.020 -9.808 1.00 0.00 O ATOM 79 CB SER A 339 5.895 5.483 -11.035 1.00 0.00 C ATOM 80 OG SER A 339 6.420 6.123 -12.186 1.00 0.00 O ATOM 0 H SER A 339 5.574 3.876 -9.128 1.00 0.00 H new ATOM 0 HA SER A 339 7.803 4.707 -10.575 1.00 0.00 H new ATOM 0 HB2 SER A 339 5.388 4.564 -11.331 1.00 0.00 H new ATOM 0 HB3 SER A 339 5.146 6.126 -10.573 1.00 0.00 H new ATOM 0 HG SER A 339 5.693 6.313 -12.815 1.00 0.00 H new ATOM 86 N LEU A 340 6.844 6.869 -8.222 1.00 0.00 N ATOM 87 CA LEU A 340 7.464 7.741 -7.236 1.00 0.00 C ATOM 88 C LEU A 340 8.650 6.994 -6.609 1.00 0.00 C ATOM 89 O LEU A 340 8.385 6.090 -5.812 1.00 0.00 O ATOM 90 CB LEU A 340 6.436 8.133 -6.151 1.00 0.00 C ATOM 91 CG LEU A 340 6.231 9.641 -6.044 1.00 0.00 C ATOM 92 CD1 LEU A 340 5.102 9.923 -5.046 1.00 0.00 C ATOM 93 CD2 LEU A 340 7.505 10.336 -5.539 1.00 0.00 C ATOM 0 H LEU A 340 5.873 6.637 -8.013 1.00 0.00 H new ATOM 0 HA LEU A 340 7.815 8.657 -7.712 1.00 0.00 H new ATOM 0 HB2 LEU A 340 5.481 7.657 -6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 340 6.768 7.747 -5.187 1.00 0.00 H new ATOM 0 HG LEU A 340 5.984 10.024 -7.034 1.00 0.00 H new ATOM 0 HD11 LEU A 340 4.949 10.999 -4.964 1.00 0.00 H new ATOM 0 HD12 LEU A 340 4.183 9.452 -5.394 1.00 0.00 H new ATOM 0 HD13 LEU A 340 5.370 9.519 -4.070 1.00 0.00 H new ATOM 0 HD21 LEU A 340 7.331 11.410 -5.472 1.00 0.00 H new ATOM 0 HD22 LEU A 340 7.765 9.948 -4.554 1.00 0.00 H new ATOM 0 HD23 LEU A 340 8.324 10.143 -6.232 1.00 0.00 H new ATOM 152 N LYS A 344 8.904 9.899 -0.241 1.00 0.00 N ATOM 153 CA LYS A 344 7.455 9.987 -0.110 1.00 0.00 C ATOM 154 C LYS A 344 6.915 8.635 0.355 1.00 0.00 C ATOM 155 O LYS A 344 5.949 8.629 1.098 1.00 0.00 O ATOM 156 CB LYS A 344 6.748 10.547 -1.361 1.00 0.00 C ATOM 157 CG LYS A 344 5.216 10.705 -1.193 1.00 0.00 C ATOM 158 CD LYS A 344 4.759 11.737 -0.138 1.00 0.00 C ATOM 159 CE LYS A 344 3.331 11.435 0.353 1.00 0.00 C ATOM 160 NZ LYS A 344 2.886 12.354 1.418 1.00 0.00 N ATOM 0 HA LYS A 344 7.222 10.730 0.652 1.00 0.00 H new ATOM 0 HB2 LYS A 344 7.179 11.517 -1.607 1.00 0.00 H new ATOM 0 HB3 LYS A 344 6.946 9.887 -2.205 1.00 0.00 H new ATOM 0 HG2 LYS A 344 4.791 10.986 -2.157 1.00 0.00 H new ATOM 0 HG3 LYS A 344 4.796 9.734 -0.930 1.00 0.00 H new ATOM 0 HD2 LYS A 344 5.447 11.726 0.707 1.00 0.00 H new ATOM 0 HD3 LYS A 344 4.795 12.739 -0.566 1.00 0.00 H new ATOM 0 HE2 LYS A 344 2.641 11.500 -0.488 1.00 0.00 H new ATOM 0 HE3 LYS A 344 3.288 10.410 0.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 1.849 12.432 1.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 3.188 11.986 2.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 3.307 13.293 1.265 1.00 0.00 H new ATOM 174 N ARG A 345 7.434 7.480 -0.101 1.00 0.00 N ATOM 175 CA ARG A 345 7.050 6.208 0.494 1.00 0.00 C ATOM 176 C ARG A 345 7.238 6.125 2.017 1.00 0.00 C ATOM 177 O ARG A 345 6.425 5.470 2.649 1.00 0.00 O ATOM 178 CB ARG A 345 7.751 5.045 -0.223 1.00 0.00 C ATOM 179 CG ARG A 345 6.973 4.631 -1.479 1.00 0.00 C ATOM 180 CD ARG A 345 7.275 5.403 -2.768 1.00 0.00 C ATOM 181 NE ARG A 345 6.088 5.621 -3.621 1.00 0.00 N ATOM 182 CZ ARG A 345 5.029 6.403 -3.369 1.00 0.00 C ATOM 183 NH1 ARG A 345 4.933 7.064 -2.217 1.00 0.00 N ATOM 184 NH2 ARG A 345 4.068 6.527 -4.277 1.00 0.00 N ATOM 0 H ARG A 345 8.106 7.411 -0.865 1.00 0.00 H new ATOM 0 HA ARG A 345 5.973 6.128 0.346 1.00 0.00 H new ATOM 0 HB2 ARG A 345 8.764 5.339 -0.498 1.00 0.00 H new ATOM 0 HB3 ARG A 345 7.838 4.195 0.453 1.00 0.00 H new ATOM 0 HG2 ARG A 345 7.165 3.574 -1.664 1.00 0.00 H new ATOM 0 HG3 ARG A 345 5.908 4.729 -1.266 1.00 0.00 H new ATOM 0 HD2 ARG A 345 7.708 6.369 -2.509 1.00 0.00 H new ATOM 0 HD3 ARG A 345 8.027 4.859 -3.339 1.00 0.00 H new ATOM 0 HE ARG A 345 6.073 5.116 -4.507 1.00 0.00 H new ATOM 0 HH11 ARG A 345 5.670 6.978 -1.517 1.00 0.00 H new ATOM 0 HH12 ARG A 345 4.123 7.657 -2.035 1.00 0.00 H new ATOM 0 HH21 ARG A 345 4.137 6.028 -5.164 1.00 0.00 H new ATOM 0 HH22 ARG A 345 3.261 7.121 -4.088 1.00 0.00 H new ATOM 198 N GLU A 346 8.209 6.803 2.618 1.00 0.00 N ATOM 199 CA GLU A 346 8.349 6.845 4.078 1.00 0.00 C ATOM 200 C GLU A 346 7.220 7.688 4.673 1.00 0.00 C ATOM 201 O GLU A 346 6.593 7.321 5.660 1.00 0.00 O ATOM 202 CB GLU A 346 9.737 7.371 4.499 1.00 0.00 C ATOM 203 CG GLU A 346 10.892 6.872 3.611 1.00 0.00 C ATOM 204 CD GLU A 346 12.253 6.968 4.304 1.00 0.00 C ATOM 205 OE1 GLU A 346 12.635 5.981 4.980 1.00 0.00 O ATOM 206 OE2 GLU A 346 12.922 8.005 4.114 1.00 0.00 O ATOM 0 H GLU A 346 8.919 7.337 2.116 1.00 0.00 H new ATOM 0 HA GLU A 346 8.271 5.831 4.469 1.00 0.00 H new ATOM 0 HB2 GLU A 346 9.722 8.461 4.480 1.00 0.00 H new ATOM 0 HB3 GLU A 346 9.930 7.073 5.530 1.00 0.00 H new ATOM 0 HG2 GLU A 346 10.705 5.836 3.327 1.00 0.00 H new ATOM 0 HG3 GLU A 346 10.915 7.455 2.691 1.00 0.00 H new ATOM 213 N GLU A 347 6.890 8.798 4.017 1.00 0.00 N ATOM 214 CA GLU A 347 5.710 9.602 4.321 1.00 0.00 C ATOM 215 C GLU A 347 4.415 8.775 4.128 1.00 0.00 C ATOM 216 O GLU A 347 3.384 9.048 4.732 1.00 0.00 O ATOM 217 CB GLU A 347 5.758 10.844 3.412 1.00 0.00 C ATOM 218 CG GLU A 347 5.594 12.176 4.149 1.00 0.00 C ATOM 219 CD GLU A 347 4.237 12.315 4.825 1.00 0.00 C ATOM 220 OE1 GLU A 347 3.215 12.239 4.109 1.00 0.00 O ATOM 221 OE2 GLU A 347 4.191 12.525 6.051 1.00 0.00 O ATOM 0 H GLU A 347 7.445 9.170 3.246 1.00 0.00 H new ATOM 0 HA GLU A 347 5.706 9.916 5.365 1.00 0.00 H new ATOM 0 HB2 GLU A 347 6.709 10.852 2.879 1.00 0.00 H new ATOM 0 HB3 GLU A 347 4.973 10.760 2.661 1.00 0.00 H new ATOM 0 HG2 GLU A 347 6.379 12.270 4.899 1.00 0.00 H new ATOM 0 HG3 GLU A 347 5.728 12.995 3.443 1.00 0.00 H new ATOM 228 N VAL A 348 4.437 7.725 3.307 1.00 0.00 N ATOM 229 CA VAL A 348 3.321 6.803 3.156 1.00 0.00 C ATOM 230 C VAL A 348 3.304 5.791 4.302 1.00 0.00 C ATOM 231 O VAL A 348 2.217 5.368 4.663 1.00 0.00 O ATOM 232 CB VAL A 348 3.348 6.158 1.764 1.00 0.00 C ATOM 233 CG1 VAL A 348 2.426 4.954 1.598 1.00 0.00 C ATOM 234 CG2 VAL A 348 2.959 7.188 0.687 1.00 0.00 C ATOM 0 H VAL A 348 5.241 7.492 2.724 1.00 0.00 H new ATOM 0 HA VAL A 348 2.380 7.349 3.222 1.00 0.00 H new ATOM 0 HB VAL A 348 4.373 5.806 1.648 1.00 0.00 H new ATOM 0 HG11 VAL A 348 2.513 4.566 0.583 1.00 0.00 H new ATOM 0 HG12 VAL A 348 2.710 4.178 2.309 1.00 0.00 H new ATOM 0 HG13 VAL A 348 1.395 5.257 1.783 1.00 0.00 H new ATOM 0 HG21 VAL A 348 2.983 6.715 -0.295 1.00 0.00 H new ATOM 0 HG22 VAL A 348 1.954 7.560 0.886 1.00 0.00 H new ATOM 0 HG23 VAL A 348 3.664 8.019 0.707 1.00 0.00 H new ATOM 244 N GLU A 349 4.425 5.416 4.914 1.00 0.00 N ATOM 245 CA GLU A 349 4.401 4.646 6.166 1.00 0.00 C ATOM 246 C GLU A 349 3.638 5.417 7.260 1.00 0.00 C ATOM 247 O GLU A 349 2.913 4.815 8.053 1.00 0.00 O ATOM 248 CB GLU A 349 5.823 4.288 6.632 1.00 0.00 C ATOM 249 CG GLU A 349 6.575 3.469 5.575 1.00 0.00 C ATOM 250 CD GLU A 349 8.085 3.430 5.780 1.00 0.00 C ATOM 251 OE1 GLU A 349 8.567 3.195 6.912 1.00 0.00 O ATOM 252 OE2 GLU A 349 8.805 3.584 4.773 1.00 0.00 O ATOM 0 H GLU A 349 5.361 5.629 4.569 1.00 0.00 H new ATOM 0 HA GLU A 349 3.875 3.711 5.975 1.00 0.00 H new ATOM 0 HB2 GLU A 349 6.377 5.202 6.847 1.00 0.00 H new ATOM 0 HB3 GLU A 349 5.770 3.722 7.562 1.00 0.00 H new ATOM 0 HG2 GLU A 349 6.191 2.449 5.580 1.00 0.00 H new ATOM 0 HG3 GLU A 349 6.363 3.884 4.590 1.00 0.00 H new ATOM 259 N LYS A 350 3.723 6.754 7.246 1.00 0.00 N ATOM 260 CA LYS A 350 2.866 7.637 8.039 1.00 0.00 C ATOM 261 C LYS A 350 1.409 7.636 7.573 1.00 0.00 C ATOM 262 O LYS A 350 0.522 7.640 8.425 1.00 0.00 O ATOM 263 CB LYS A 350 3.516 9.039 8.019 1.00 0.00 C ATOM 264 CG LYS A 350 2.696 10.240 8.533 1.00 0.00 C ATOM 265 CD LYS A 350 1.839 10.860 7.400 1.00 0.00 C ATOM 266 CE LYS A 350 1.597 12.378 7.503 1.00 0.00 C ATOM 267 NZ LYS A 350 1.407 12.989 6.164 1.00 0.00 N ATOM 0 H LYS A 350 4.401 7.257 6.674 1.00 0.00 H new ATOM 0 HA LYS A 350 2.802 7.275 9.065 1.00 0.00 H new ATOM 0 HB2 LYS A 350 4.432 8.988 8.607 1.00 0.00 H new ATOM 0 HB3 LYS A 350 3.809 9.254 6.991 1.00 0.00 H new ATOM 0 HG2 LYS A 350 2.048 9.919 9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 350 3.368 10.996 8.939 1.00 0.00 H new ATOM 0 HD2 LYS A 350 2.324 10.651 6.446 1.00 0.00 H new ATOM 0 HD3 LYS A 350 0.872 10.356 7.383 1.00 0.00 H new ATOM 0 HE2 LYS A 350 0.717 12.567 8.119 1.00 0.00 H new ATOM 0 HE3 LYS A 350 2.443 12.850 8.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 350 1.880 13.915 6.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 350 1.817 12.368 5.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 350 0.391 13.113 5.980 1.00 0.00 H new ATOM 281 N LEU A 351 1.132 7.643 6.267 1.00 0.00 N ATOM 282 CA LEU A 351 -0.243 7.738 5.772 1.00 0.00 C ATOM 283 C LEU A 351 -0.964 6.388 5.794 1.00 0.00 C ATOM 284 O LEU A 351 -1.984 6.249 6.467 1.00 0.00 O ATOM 285 CB LEU A 351 -0.285 8.337 4.362 1.00 0.00 C ATOM 286 CG LEU A 351 0.111 9.818 4.269 1.00 0.00 C ATOM 287 CD1 LEU A 351 0.392 10.183 2.808 1.00 0.00 C ATOM 288 CD2 LEU A 351 -0.994 10.706 4.855 1.00 0.00 C ATOM 0 H LEU A 351 1.840 7.584 5.535 1.00 0.00 H new ATOM 0 HA LEU A 351 -0.771 8.405 6.453 1.00 0.00 H new ATOM 0 HB2 LEU A 351 0.379 7.759 3.719 1.00 0.00 H new ATOM 0 HB3 LEU A 351 -1.294 8.221 3.965 1.00 0.00 H new ATOM 0 HG LEU A 351 1.017 9.986 4.852 1.00 0.00 H new ATOM 0 HD11 LEU A 351 0.673 11.234 2.743 1.00 0.00 H new ATOM 0 HD12 LEU A 351 1.206 9.566 2.429 1.00 0.00 H new ATOM 0 HD13 LEU A 351 -0.503 10.009 2.211 1.00 0.00 H new ATOM 0 HD21 LEU A 351 -0.697 11.752 4.781 1.00 0.00 H new ATOM 0 HD22 LEU A 351 -1.919 10.551 4.299 1.00 0.00 H new ATOM 0 HD23 LEU A 351 -1.152 10.447 5.902 1.00 0.00 H new ATOM 300 N LEU A 352 -0.461 5.390 5.057 1.00 0.00 N ATOM 301 CA LEU A 352 -0.855 3.978 5.094 1.00 0.00 C ATOM 302 C LEU A 352 -0.353 3.393 6.428 1.00 0.00 C ATOM 303 O LEU A 352 0.432 2.452 6.448 1.00 0.00 O ATOM 304 CB LEU A 352 -0.362 3.206 3.831 1.00 0.00 C ATOM 305 CG LEU A 352 -0.922 3.641 2.443 1.00 0.00 C ATOM 306 CD1 LEU A 352 -0.276 2.880 1.270 1.00 0.00 C ATOM 307 CD2 LEU A 352 -2.429 3.416 2.257 1.00 0.00 C ATOM 0 H LEU A 352 0.279 5.559 4.376 1.00 0.00 H new ATOM 0 HA LEU A 352 -1.939 3.873 5.057 1.00 0.00 H new ATOM 0 HB2 LEU A 352 0.724 3.287 3.793 1.00 0.00 H new ATOM 0 HB3 LEU A 352 -0.598 2.151 3.971 1.00 0.00 H new ATOM 0 HG LEU A 352 -0.687 4.705 2.434 1.00 0.00 H new ATOM 0 HD11 LEU A 352 -0.707 3.226 0.330 1.00 0.00 H new ATOM 0 HD12 LEU A 352 0.799 3.062 1.266 1.00 0.00 H new ATOM 0 HD13 LEU A 352 -0.462 1.812 1.383 1.00 0.00 H new ATOM 0 HD21 LEU A 352 -2.726 3.748 1.262 1.00 0.00 H new ATOM 0 HD22 LEU A 352 -2.655 2.355 2.368 1.00 0.00 H new ATOM 0 HD23 LEU A 352 -2.977 3.984 3.008 1.00 0.00 H new ATOM 319 N ASN A 353 -0.841 3.955 7.541 1.00 0.00 N ATOM 320 CA ASN A 353 -0.538 3.627 8.935 1.00 0.00 C ATOM 321 C ASN A 353 -0.530 2.115 9.166 1.00 0.00 C ATOM 322 O ASN A 353 -1.292 1.396 8.505 1.00 0.00 O ATOM 323 CB ASN A 353 -1.587 4.322 9.830 1.00 0.00 C ATOM 324 CG ASN A 353 -1.834 3.577 11.140 1.00 0.00 C ATOM 325 OD1 ASN A 353 -0.976 3.539 12.010 1.00 0.00 O ATOM 326 ND2 ASN A 353 -2.976 2.922 11.290 1.00 0.00 N ATOM 0 H ASN A 353 -1.517 4.717 7.481 1.00 0.00 H new ATOM 0 HA ASN A 353 0.461 3.983 9.186 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -1.254 5.336 10.051 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -2.526 4.407 9.283 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -3.145 2.380 12.137 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -3.686 2.960 10.558 1.00 0.00 H new ATOM 333 N GLY A 354 0.274 1.641 10.133 1.00 0.00 N ATOM 334 CA GLY A 354 0.504 0.227 10.414 1.00 0.00 C ATOM 335 C GLY A 354 -0.702 -0.475 11.044 1.00 0.00 C ATOM 336 O GLY A 354 -0.591 -1.069 12.116 1.00 0.00 O ATOM 0 H GLY A 354 0.795 2.257 10.757 1.00 0.00 H new ATOM 0 HA2 GLY A 354 0.766 -0.282 9.486 1.00 0.00 H new ATOM 0 HA3 GLY A 354 1.360 0.132 11.083 1.00 0.00 H new ATOM 340 N ASP A 355 -1.763 -0.609 10.250 1.00 0.00 N ATOM 341 CA ASP A 355 -3.007 -1.358 10.401 1.00 0.00 C ATOM 342 C ASP A 355 -3.988 -0.934 9.310 1.00 0.00 C ATOM 343 O ASP A 355 -4.629 -1.770 8.674 1.00 0.00 O ATOM 344 CB ASP A 355 -3.689 -1.182 11.762 1.00 0.00 C ATOM 345 CG ASP A 355 -4.795 -2.225 11.831 1.00 0.00 C ATOM 346 OD1 ASP A 355 -4.408 -3.416 11.907 1.00 0.00 O ATOM 347 OD2 ASP A 355 -5.973 -1.833 11.735 1.00 0.00 O ATOM 0 H ASP A 355 -1.767 -0.121 9.354 1.00 0.00 H new ATOM 0 HA ASP A 355 -2.734 -2.410 10.319 1.00 0.00 H new ATOM 0 HB2 ASP A 355 -2.975 -1.320 12.574 1.00 0.00 H new ATOM 0 HB3 ASP A 355 -4.097 -0.177 11.864 1.00 0.00 H new ATOM 352 N THR A 356 -4.041 0.364 9.001 1.00 0.00 N ATOM 353 CA THR A 356 -4.859 0.858 7.905 1.00 0.00 C ATOM 354 C THR A 356 -4.380 0.217 6.595 1.00 0.00 C ATOM 355 O THR A 356 -5.198 -0.201 5.774 1.00 0.00 O ATOM 356 CB THR A 356 -4.769 2.393 7.835 1.00 0.00 C ATOM 357 OG1 THR A 356 -4.977 2.971 9.114 1.00 0.00 O ATOM 358 CG2 THR A 356 -5.845 2.928 6.885 1.00 0.00 C ATOM 0 H THR A 356 -3.524 1.088 9.499 1.00 0.00 H new ATOM 0 HA THR A 356 -5.903 0.590 8.067 1.00 0.00 H new ATOM 0 HB THR A 356 -3.774 2.657 7.477 1.00 0.00 H new ATOM 0 HG1 THR A 356 -4.914 3.947 9.046 1.00 0.00 H new ATOM 0 HG21 THR A 356 -5.780 4.015 6.837 1.00 0.00 H new ATOM 0 HG22 THR A 356 -5.692 2.511 5.890 1.00 0.00 H new ATOM 0 HG23 THR A 356 -6.830 2.640 7.252 1.00 0.00 H new ATOM 366 N TRP A 357 -3.060 0.100 6.404 1.00 0.00 N ATOM 367 CA TRP A 357 -2.509 -0.698 5.322 1.00 0.00 C ATOM 368 C TRP A 357 -3.086 -2.126 5.293 1.00 0.00 C ATOM 369 O TRP A 357 -3.442 -2.558 4.212 1.00 0.00 O ATOM 370 CB TRP A 357 -0.977 -0.650 5.286 1.00 0.00 C ATOM 371 CG TRP A 357 -0.336 -1.729 6.092 1.00 0.00 C ATOM 372 CD1 TRP A 357 -0.067 -1.634 7.405 1.00 0.00 C ATOM 373 CD2 TRP A 357 -0.067 -3.115 5.727 1.00 0.00 C ATOM 374 NE1 TRP A 357 0.324 -2.863 7.897 1.00 0.00 N ATOM 375 CE2 TRP A 357 0.297 -3.821 6.905 1.00 0.00 C ATOM 376 CE3 TRP A 357 -0.177 -3.870 4.544 1.00 0.00 C ATOM 377 CZ2 TRP A 357 0.518 -5.202 6.882 1.00 0.00 C ATOM 378 CZ3 TRP A 357 0.117 -5.247 4.508 1.00 0.00 C ATOM 379 CH2 TRP A 357 0.442 -5.915 5.692 1.00 0.00 C ATOM 0 H TRP A 357 -2.359 0.552 6.991 1.00 0.00 H new ATOM 0 HA TRP A 357 -2.835 -0.238 4.389 1.00 0.00 H new ATOM 0 HB2 TRP A 357 -0.642 -0.730 4.252 1.00 0.00 H new ATOM 0 HB3 TRP A 357 -0.642 0.319 5.656 1.00 0.00 H new ATOM 0 HD1 TRP A 357 -0.145 -0.729 7.989 1.00 0.00 H new ATOM 0 HE1 TRP A 357 0.596 -3.039 8.864 1.00 0.00 H new ATOM 0 HE3 TRP A 357 -0.496 -3.379 3.637 1.00 0.00 H new ATOM 0 HZ2 TRP A 357 0.751 -5.720 7.800 1.00 0.00 H new ATOM 0 HZ3 TRP A 357 0.091 -5.784 3.571 1.00 0.00 H new ATOM 0 HH2 TRP A 357 0.633 -6.978 5.682 1.00 0.00 H new ATOM 390 N ARG A 358 -3.124 -2.893 6.402 1.00 0.00 N ATOM 391 CA ARG A 358 -3.737 -4.237 6.471 1.00 0.00 C ATOM 392 C ARG A 358 -5.067 -4.313 5.727 1.00 0.00 C ATOM 393 O ARG A 358 -5.276 -5.213 4.918 1.00 0.00 O ATOM 394 CB ARG A 358 -3.868 -4.816 7.897 1.00 0.00 C ATOM 395 CG ARG A 358 -2.524 -4.986 8.617 1.00 0.00 C ATOM 396 CD ARG A 358 -2.664 -5.696 9.973 1.00 0.00 C ATOM 397 NE ARG A 358 -1.372 -5.736 10.690 1.00 0.00 N ATOM 398 CZ ARG A 358 -0.916 -4.818 11.556 1.00 0.00 C ATOM 399 NH1 ARG A 358 -1.698 -3.853 12.026 1.00 0.00 N ATOM 400 NH2 ARG A 358 0.358 -4.848 11.933 1.00 0.00 N ATOM 0 H ARG A 358 -2.723 -2.591 7.290 1.00 0.00 H new ATOM 0 HA ARG A 358 -3.020 -4.877 5.957 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -4.507 -4.161 8.489 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -4.367 -5.784 7.843 1.00 0.00 H new ATOM 0 HG2 ARG A 358 -1.845 -5.555 7.982 1.00 0.00 H new ATOM 0 HG3 ARG A 358 -2.071 -4.006 8.769 1.00 0.00 H new ATOM 0 HD2 ARG A 358 -3.405 -5.179 10.582 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -3.029 -6.711 9.819 1.00 0.00 H new ATOM 0 HE ARG A 358 -0.769 -6.539 10.509 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -2.672 -3.796 11.730 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -1.324 -3.169 12.683 1.00 0.00 H new ATOM 0 HH21 ARG A 358 0.982 -5.566 11.564 1.00 0.00 H new ATOM 0 HH22 ARG A 358 0.712 -4.153 12.591 1.00 0.00 H new ATOM 414 N HIS A 359 -5.965 -3.374 6.027 1.00 0.00 N ATOM 415 CA HIS A 359 -7.290 -3.307 5.423 1.00 0.00 C ATOM 416 C HIS A 359 -7.170 -3.179 3.902 1.00 0.00 C ATOM 417 O HIS A 359 -7.812 -3.918 3.159 1.00 0.00 O ATOM 418 CB HIS A 359 -8.076 -2.137 6.032 1.00 0.00 C ATOM 419 CG HIS A 359 -8.437 -2.326 7.488 1.00 0.00 C ATOM 420 ND1 HIS A 359 -7.602 -2.244 8.590 1.00 0.00 N ATOM 421 CD2 HIS A 359 -9.696 -2.610 7.946 1.00 0.00 C ATOM 422 CE1 HIS A 359 -8.356 -2.478 9.680 1.00 0.00 C ATOM 423 NE2 HIS A 359 -9.637 -2.699 9.336 1.00 0.00 N ATOM 0 H HIS A 359 -5.788 -2.632 6.704 1.00 0.00 H new ATOM 0 HA HIS A 359 -7.837 -4.226 5.633 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -7.487 -1.226 5.930 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -8.991 -1.990 5.458 1.00 0.00 H new ATOM 0 HD1 HIS A 359 -6.602 -2.044 8.578 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -10.579 -2.742 7.338 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -7.983 -2.487 10.693 1.00 0.00 H new ATOM 431 N LEU A 360 -6.322 -2.261 3.435 1.00 0.00 N ATOM 432 CA LEU A 360 -5.988 -2.111 2.026 1.00 0.00 C ATOM 433 C LEU A 360 -5.365 -3.391 1.452 1.00 0.00 C ATOM 434 O LEU A 360 -5.677 -3.749 0.324 1.00 0.00 O ATOM 435 CB LEU A 360 -5.065 -0.886 1.904 1.00 0.00 C ATOM 436 CG LEU A 360 -4.153 -0.876 0.667 1.00 0.00 C ATOM 437 CD1 LEU A 360 -4.976 -0.553 -0.576 1.00 0.00 C ATOM 438 CD2 LEU A 360 -3.048 0.156 0.851 1.00 0.00 C ATOM 0 H LEU A 360 -5.843 -1.593 4.038 1.00 0.00 H new ATOM 0 HA LEU A 360 -6.886 -1.948 1.431 1.00 0.00 H new ATOM 0 HB2 LEU A 360 -5.681 0.013 1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 360 -4.441 -0.830 2.796 1.00 0.00 H new ATOM 0 HG LEU A 360 -3.699 -1.859 0.544 1.00 0.00 H new ATOM 0 HD11 LEU A 360 -4.326 -0.547 -1.451 1.00 0.00 H new ATOM 0 HD12 LEU A 360 -5.751 -1.308 -0.705 1.00 0.00 H new ATOM 0 HD13 LEU A 360 -5.439 0.427 -0.461 1.00 0.00 H new ATOM 0 HD21 LEU A 360 -2.404 0.160 -0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 360 -3.490 1.144 0.981 1.00 0.00 H new ATOM 0 HD23 LEU A 360 -2.458 -0.096 1.732 1.00 0.00 H new ATOM 450 N ALA A 361 -4.450 -4.033 2.174 1.00 0.00 N ATOM 451 CA ALA A 361 -3.678 -5.192 1.753 1.00 0.00 C ATOM 452 C ALA A 361 -4.597 -6.289 1.207 1.00 0.00 C ATOM 453 O ALA A 361 -4.365 -6.777 0.105 1.00 0.00 O ATOM 454 CB ALA A 361 -2.732 -5.631 2.883 1.00 0.00 C ATOM 0 H ALA A 361 -4.217 -3.739 3.122 1.00 0.00 H new ATOM 0 HA ALA A 361 -3.031 -4.935 0.915 1.00 0.00 H new ATOM 0 HB1 ALA A 361 -2.158 -6.499 2.560 1.00 0.00 H new ATOM 0 HB2 ALA A 361 -2.051 -4.815 3.125 1.00 0.00 H new ATOM 0 HB3 ALA A 361 -3.316 -5.890 3.766 1.00 0.00 H new ATOM 460 N GLY A 362 -5.664 -6.630 1.937 1.00 0.00 N ATOM 461 CA GLY A 362 -6.664 -7.576 1.454 1.00 0.00 C ATOM 462 C GLY A 362 -7.344 -7.077 0.182 1.00 0.00 C ATOM 463 O GLY A 362 -7.513 -7.827 -0.782 1.00 0.00 O ATOM 0 H GLY A 362 -5.854 -6.260 2.869 1.00 0.00 H new ATOM 0 HA2 GLY A 362 -6.191 -8.539 1.260 1.00 0.00 H new ATOM 0 HA3 GLY A 362 -7.414 -7.740 2.228 1.00 0.00 H new ATOM 467 N GLU A 363 -7.715 -5.795 0.151 1.00 0.00 N ATOM 468 CA GLU A 363 -8.394 -5.207 -0.994 1.00 0.00 C ATOM 469 C GLU A 363 -7.497 -5.157 -2.248 1.00 0.00 C ATOM 470 O GLU A 363 -8.023 -5.053 -3.364 1.00 0.00 O ATOM 471 CB GLU A 363 -8.947 -3.820 -0.614 1.00 0.00 C ATOM 472 CG GLU A 363 -10.080 -3.883 0.430 1.00 0.00 C ATOM 473 CD GLU A 363 -11.415 -4.325 -0.180 1.00 0.00 C ATOM 474 OE1 GLU A 363 -11.556 -5.516 -0.538 1.00 0.00 O ATOM 475 OE2 GLU A 363 -12.267 -3.456 -0.463 1.00 0.00 O ATOM 0 H GLU A 363 -7.552 -5.142 0.918 1.00 0.00 H new ATOM 0 HA GLU A 363 -9.232 -5.850 -1.262 1.00 0.00 H new ATOM 0 HB2 GLU A 363 -8.135 -3.207 -0.223 1.00 0.00 H new ATOM 0 HB3 GLU A 363 -9.316 -3.325 -1.512 1.00 0.00 H new ATOM 0 HG2 GLU A 363 -9.800 -4.575 1.224 1.00 0.00 H new ATOM 0 HG3 GLU A 363 -10.201 -2.902 0.890 1.00 0.00 H new ATOM 482 N LEU A 364 -6.171 -5.296 -2.105 1.00 0.00 N ATOM 483 CA LEU A 364 -5.199 -5.386 -3.200 1.00 0.00 C ATOM 484 C LEU A 364 -5.080 -6.806 -3.774 1.00 0.00 C ATOM 485 O LEU A 364 -4.076 -7.130 -4.410 1.00 0.00 O ATOM 486 CB LEU A 364 -3.815 -4.902 -2.704 1.00 0.00 C ATOM 487 CG LEU A 364 -3.714 -3.393 -2.453 1.00 0.00 C ATOM 488 CD1 LEU A 364 -2.333 -3.039 -1.892 1.00 0.00 C ATOM 489 CD2 LEU A 364 -3.939 -2.622 -3.752 1.00 0.00 C ATOM 0 H LEU A 364 -5.731 -5.351 -1.187 1.00 0.00 H new ATOM 0 HA LEU A 364 -5.558 -4.746 -4.006 1.00 0.00 H new ATOM 0 HB2 LEU A 364 -3.572 -5.427 -1.780 1.00 0.00 H new ATOM 0 HB3 LEU A 364 -3.062 -5.185 -3.439 1.00 0.00 H new ATOM 0 HG LEU A 364 -4.481 -3.116 -1.730 1.00 0.00 H new ATOM 0 HD11 LEU A 364 -2.275 -1.964 -1.719 1.00 0.00 H new ATOM 0 HD12 LEU A 364 -2.176 -3.567 -0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 364 -1.564 -3.333 -2.606 1.00 0.00 H new ATOM 0 HD21 LEU A 364 -3.864 -1.552 -3.558 1.00 0.00 H new ATOM 0 HD22 LEU A 364 -3.184 -2.912 -4.483 1.00 0.00 H new ATOM 0 HD23 LEU A 364 -4.930 -2.851 -4.144 1.00 0.00 H new ATOM 501 N GLY A 365 -6.147 -7.605 -3.697 1.00 0.00 N ATOM 502 CA GLY A 365 -6.168 -8.995 -4.141 1.00 0.00 C ATOM 503 C GLY A 365 -5.045 -9.861 -3.587 1.00 0.00 C ATOM 504 O GLY A 365 -4.665 -10.835 -4.234 1.00 0.00 O ATOM 0 H GLY A 365 -7.040 -7.293 -3.315 1.00 0.00 H new ATOM 0 HA2 GLY A 365 -7.123 -9.438 -3.857 1.00 0.00 H new ATOM 0 HA3 GLY A 365 -6.119 -9.014 -5.230 1.00 0.00 H new ATOM 508 N TYR A 366 -4.544 -9.548 -2.393 1.00 0.00 N ATOM 509 CA TYR A 366 -3.488 -10.285 -1.727 1.00 0.00 C ATOM 510 C TYR A 366 -4.109 -10.956 -0.507 1.00 0.00 C ATOM 511 O TYR A 366 -4.562 -10.287 0.421 1.00 0.00 O ATOM 512 CB TYR A 366 -2.322 -9.330 -1.425 1.00 0.00 C ATOM 513 CG TYR A 366 -1.288 -9.112 -2.539 1.00 0.00 C ATOM 514 CD1 TYR A 366 -1.360 -9.779 -3.781 1.00 0.00 C ATOM 515 CD2 TYR A 366 -0.146 -8.354 -2.225 1.00 0.00 C ATOM 516 CE1 TYR A 366 -0.283 -9.736 -4.674 1.00 0.00 C ATOM 517 CE2 TYR A 366 0.936 -8.298 -3.116 1.00 0.00 C ATOM 518 CZ TYR A 366 0.868 -8.998 -4.340 1.00 0.00 C ATOM 519 OH TYR A 366 1.940 -8.978 -5.175 1.00 0.00 O ATOM 0 H TYR A 366 -4.876 -8.750 -1.852 1.00 0.00 H new ATOM 0 HA TYR A 366 -3.056 -11.074 -2.342 1.00 0.00 H new ATOM 0 HB2 TYR A 366 -2.740 -8.360 -1.158 1.00 0.00 H new ATOM 0 HB3 TYR A 366 -1.798 -9.704 -0.546 1.00 0.00 H new ATOM 0 HD1 TYR A 366 -2.253 -10.327 -4.044 1.00 0.00 H new ATOM 0 HD2 TYR A 366 -0.102 -7.812 -1.292 1.00 0.00 H new ATOM 0 HE1 TYR A 366 -0.335 -10.266 -5.614 1.00 0.00 H new ATOM 0 HE2 TYR A 366 1.816 -7.723 -2.867 1.00 0.00 H new ATOM 0 HH TYR A 366 1.751 -9.528 -5.964 1.00 0.00 H new ATOM 529 N GLN A 367 -4.230 -12.284 -0.587 1.00 0.00 N ATOM 530 CA GLN A 367 -4.786 -13.156 0.447 1.00 0.00 C ATOM 531 C GLN A 367 -4.117 -12.896 1.814 1.00 0.00 C ATOM 532 O GLN A 367 -2.988 -12.394 1.845 1.00 0.00 O ATOM 533 CB GLN A 367 -4.660 -14.624 -0.016 1.00 0.00 C ATOM 534 CG GLN A 367 -5.283 -14.880 -1.401 1.00 0.00 C ATOM 535 CD GLN A 367 -5.589 -16.351 -1.711 1.00 0.00 C ATOM 536 OE1 GLN A 367 -6.461 -16.636 -2.526 1.00 0.00 O ATOM 537 NE2 GLN A 367 -4.913 -17.320 -1.117 1.00 0.00 N ATOM 0 H GLN A 367 -3.929 -12.802 -1.412 1.00 0.00 H new ATOM 0 HA GLN A 367 -5.844 -12.936 0.591 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -3.606 -14.900 -0.042 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -5.141 -15.272 0.717 1.00 0.00 H new ATOM 0 HG2 GLN A 367 -6.207 -14.308 -1.479 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -4.606 -14.496 -2.164 1.00 0.00 H new ATOM 0 HE21 GLN A 367 -4.186 -17.093 -0.438 1.00 0.00 H new ATOM 0 HE22 GLN A 367 -5.118 -18.294 -1.338 1.00 0.00 H new ATOM 546 N PRO A 368 -4.742 -13.260 2.952 1.00 0.00 N ATOM 547 CA PRO A 368 -4.211 -12.930 4.271 1.00 0.00 C ATOM 548 C PRO A 368 -2.817 -13.499 4.553 1.00 0.00 C ATOM 549 O PRO A 368 -2.116 -12.931 5.384 1.00 0.00 O ATOM 550 CB PRO A 368 -5.255 -13.388 5.294 1.00 0.00 C ATOM 551 CG PRO A 368 -6.113 -14.389 4.526 1.00 0.00 C ATOM 552 CD PRO A 368 -6.054 -13.876 3.090 1.00 0.00 C ATOM 0 HA PRO A 368 -4.049 -11.854 4.333 1.00 0.00 H new ATOM 0 HB2 PRO A 368 -4.786 -13.849 6.163 1.00 0.00 H new ATOM 0 HB3 PRO A 368 -5.850 -12.551 5.659 1.00 0.00 H new ATOM 0 HG2 PRO A 368 -5.719 -15.402 4.607 1.00 0.00 H new ATOM 0 HG3 PRO A 368 -7.136 -14.414 4.902 1.00 0.00 H new ATOM 0 HD2 PRO A 368 -6.183 -14.690 2.377 1.00 0.00 H new ATOM 0 HD3 PRO A 368 -6.849 -13.155 2.898 1.00 0.00 H new ATOM 560 N GLU A 369 -2.370 -14.527 3.831 1.00 0.00 N ATOM 561 CA GLU A 369 -1.017 -15.073 3.915 1.00 0.00 C ATOM 562 C GLU A 369 0.025 -13.995 3.583 1.00 0.00 C ATOM 563 O GLU A 369 1.069 -13.910 4.228 1.00 0.00 O ATOM 564 CB GLU A 369 -0.841 -16.252 2.938 1.00 0.00 C ATOM 565 CG GLU A 369 -1.899 -17.365 3.031 1.00 0.00 C ATOM 566 CD GLU A 369 -3.132 -17.051 2.174 1.00 0.00 C ATOM 567 OE1 GLU A 369 -3.127 -17.397 0.973 1.00 0.00 O ATOM 568 OE2 GLU A 369 -4.067 -16.406 2.698 1.00 0.00 O ATOM 0 H GLU A 369 -2.956 -15.015 3.154 1.00 0.00 H new ATOM 0 HA GLU A 369 -0.867 -15.423 4.936 1.00 0.00 H new ATOM 0 HB2 GLU A 369 -0.843 -15.859 1.921 1.00 0.00 H new ATOM 0 HB3 GLU A 369 0.140 -16.695 3.107 1.00 0.00 H new ATOM 0 HG2 GLU A 369 -1.462 -18.310 2.707 1.00 0.00 H new ATOM 0 HG3 GLU A 369 -2.202 -17.493 4.070 1.00 0.00 H new ATOM 575 N HIS A 370 -0.282 -13.127 2.613 1.00 0.00 N ATOM 576 CA HIS A 370 0.579 -12.014 2.239 1.00 0.00 C ATOM 577 C HIS A 370 0.586 -11.004 3.384 1.00 0.00 C ATOM 578 O HIS A 370 1.634 -10.498 3.772 1.00 0.00 O ATOM 579 CB HIS A 370 0.034 -11.298 0.994 1.00 0.00 C ATOM 580 CG HIS A 370 -0.033 -12.096 -0.282 1.00 0.00 C ATOM 581 ND1 HIS A 370 0.680 -11.817 -1.425 1.00 0.00 N ATOM 582 CD2 HIS A 370 -0.921 -13.096 -0.582 1.00 0.00 C ATOM 583 CE1 HIS A 370 0.218 -12.619 -2.398 1.00 0.00 C ATOM 584 NE2 HIS A 370 -0.761 -13.411 -1.934 1.00 0.00 N ATOM 0 H HIS A 370 -1.141 -13.182 2.066 1.00 0.00 H new ATOM 0 HA HIS A 370 1.577 -12.399 2.031 1.00 0.00 H new ATOM 0 HB2 HIS A 370 -0.970 -10.940 1.222 1.00 0.00 H new ATOM 0 HB3 HIS A 370 0.652 -10.419 0.811 1.00 0.00 H new ATOM 0 HD2 HIS A 370 -1.618 -13.557 0.102 1.00 0.00 H new ATOM 0 HE1 HIS A 370 0.584 -12.626 -3.414 1.00 0.00 H new ATOM 0 HE2 HIS A 370 -1.286 -14.107 -2.464 1.00 0.00 H new ATOM 592 N ILE A 371 -0.605 -10.668 3.882 1.00 0.00 N ATOM 593 CA ILE A 371 -0.818 -9.631 4.881 1.00 0.00 C ATOM 594 C ILE A 371 -0.058 -10.016 6.153 1.00 0.00 C ATOM 595 O ILE A 371 0.607 -9.163 6.740 1.00 0.00 O ATOM 596 CB ILE A 371 -2.330 -9.410 5.127 1.00 0.00 C ATOM 597 CG1 ILE A 371 -3.087 -9.255 3.786 1.00 0.00 C ATOM 598 CG2 ILE A 371 -2.533 -8.155 6.002 1.00 0.00 C ATOM 599 CD1 ILE A 371 -4.596 -9.074 3.931 1.00 0.00 C ATOM 0 H ILE A 371 -1.469 -11.125 3.591 1.00 0.00 H new ATOM 0 HA ILE A 371 -0.429 -8.676 4.528 1.00 0.00 H new ATOM 0 HB ILE A 371 -2.732 -10.281 5.645 1.00 0.00 H new ATOM 0 HG12 ILE A 371 -2.680 -8.397 3.250 1.00 0.00 H new ATOM 0 HG13 ILE A 371 -2.896 -10.135 3.171 1.00 0.00 H new ATOM 0 HG21 ILE A 371 -3.598 -8.000 6.175 1.00 0.00 H new ATOM 0 HG22 ILE A 371 -2.027 -8.292 6.957 1.00 0.00 H new ATOM 0 HG23 ILE A 371 -2.118 -7.285 5.493 1.00 0.00 H new ATOM 0 HD11 ILE A 371 -5.047 -8.973 2.944 1.00 0.00 H new ATOM 0 HD12 ILE A 371 -5.020 -9.942 4.436 1.00 0.00 H new ATOM 0 HD13 ILE A 371 -4.800 -8.178 4.517 1.00 0.00 H new ATOM 611 N ASP A 372 -0.128 -11.289 6.551 1.00 0.00 N ATOM 612 CA ASP A 372 0.628 -11.833 7.671 1.00 0.00 C ATOM 613 C ASP A 372 2.119 -11.655 7.413 1.00 0.00 C ATOM 614 O ASP A 372 2.811 -11.029 8.218 1.00 0.00 O ATOM 615 CB ASP A 372 0.312 -13.324 7.849 1.00 0.00 C ATOM 616 CG ASP A 372 1.259 -13.954 8.873 1.00 0.00 C ATOM 617 OD1 ASP A 372 2.398 -14.304 8.483 1.00 0.00 O ATOM 618 OD2 ASP A 372 0.857 -14.047 10.052 1.00 0.00 O ATOM 0 H ASP A 372 -0.723 -11.979 6.093 1.00 0.00 H new ATOM 0 HA ASP A 372 0.348 -11.301 8.580 1.00 0.00 H new ATOM 0 HB2 ASP A 372 -0.720 -13.446 8.176 1.00 0.00 H new ATOM 0 HB3 ASP A 372 0.406 -13.839 6.893 1.00 0.00 H new ATOM 623 N SER A 373 2.608 -12.087 6.247 1.00 0.00 N ATOM 624 CA SER A 373 4.049 -12.140 6.069 1.00 0.00 C ATOM 625 C SER A 373 4.639 -10.744 5.836 1.00 0.00 C ATOM 626 O SER A 373 5.820 -10.532 6.095 1.00 0.00 O ATOM 627 CB SER A 373 4.351 -13.092 4.911 1.00 0.00 C ATOM 628 OG SER A 373 4.467 -14.407 5.426 1.00 0.00 O ATOM 0 H SER A 373 2.051 -12.391 5.449 1.00 0.00 H new ATOM 0 HA SER A 373 4.522 -12.514 6.977 1.00 0.00 H new ATOM 0 HB2 SER A 373 3.556 -13.046 4.166 1.00 0.00 H new ATOM 0 HB3 SER A 373 5.274 -12.799 4.411 1.00 0.00 H new ATOM 0 HG SER A 373 4.659 -15.029 4.694 1.00 0.00 H new ATOM 634 N PHE A 374 3.800 -9.740 5.586 1.00 0.00 N ATOM 635 CA PHE A 374 4.219 -8.351 5.470 1.00 0.00 C ATOM 636 C PHE A 374 4.202 -7.680 6.838 1.00 0.00 C ATOM 637 O PHE A 374 4.998 -6.771 7.062 1.00 0.00 O ATOM 638 CB PHE A 374 3.282 -7.572 4.533 1.00 0.00 C ATOM 639 CG PHE A 374 3.483 -7.744 3.041 1.00 0.00 C ATOM 640 CD1 PHE A 374 4.770 -7.672 2.470 1.00 0.00 C ATOM 641 CD2 PHE A 374 2.369 -7.940 2.200 1.00 0.00 C ATOM 642 CE1 PHE A 374 4.940 -7.817 1.083 1.00 0.00 C ATOM 643 CE2 PHE A 374 2.539 -8.077 0.811 1.00 0.00 C ATOM 644 CZ PHE A 374 3.825 -8.017 0.249 1.00 0.00 C ATOM 0 H PHE A 374 2.797 -9.874 5.457 1.00 0.00 H new ATOM 0 HA PHE A 374 5.229 -8.343 5.061 1.00 0.00 H new ATOM 0 HB2 PHE A 374 2.257 -7.857 4.769 1.00 0.00 H new ATOM 0 HB3 PHE A 374 3.379 -6.512 4.765 1.00 0.00 H new ATOM 0 HD1 PHE A 374 5.630 -7.505 3.102 1.00 0.00 H new ATOM 0 HD2 PHE A 374 1.377 -7.985 2.626 1.00 0.00 H new ATOM 0 HE1 PHE A 374 5.931 -7.775 0.655 1.00 0.00 H new ATOM 0 HE2 PHE A 374 1.679 -8.229 0.175 1.00 0.00 H new ATOM 0 HZ PHE A 374 3.957 -8.124 -0.818 1.00 0.00 H new ATOM 654 N THR A 375 3.330 -8.093 7.765 1.00 0.00 N ATOM 655 CA THR A 375 3.429 -7.606 9.136 1.00 0.00 C ATOM 656 C THR A 375 4.517 -8.358 9.921 1.00 0.00 C ATOM 657 O THR A 375 4.839 -7.916 11.025 1.00 0.00 O ATOM 658 CB THR A 375 2.058 -7.572 9.836 1.00 0.00 C ATOM 659 OG1 THR A 375 2.152 -6.873 11.063 1.00 0.00 O ATOM 660 CG2 THR A 375 1.389 -8.915 10.091 1.00 0.00 C ATOM 0 H THR A 375 2.567 -8.748 7.593 1.00 0.00 H new ATOM 0 HA THR A 375 3.755 -6.566 9.104 1.00 0.00 H new ATOM 0 HB THR A 375 1.417 -7.063 9.117 1.00 0.00 H new ATOM 0 HG1 THR A 375 3.063 -6.951 11.415 1.00 0.00 H new ATOM 0 HG21 THR A 375 0.432 -8.756 10.588 1.00 0.00 H new ATOM 0 HG22 THR A 375 1.225 -9.426 9.142 1.00 0.00 H new ATOM 0 HG23 THR A 375 2.031 -9.526 10.726 1.00 0.00 H new ATOM 668 N HIS A 376 5.056 -9.458 9.384 1.00 0.00 N ATOM 669 CA HIS A 376 6.237 -10.148 9.881 1.00 0.00 C ATOM 670 C HIS A 376 7.527 -9.534 9.324 1.00 0.00 C ATOM 671 O HIS A 376 8.526 -9.515 10.046 1.00 0.00 O ATOM 672 CB HIS A 376 6.140 -11.660 9.624 1.00 0.00 C ATOM 673 CG HIS A 376 5.254 -12.366 10.627 1.00 0.00 C ATOM 674 ND1 HIS A 376 4.114 -13.101 10.376 1.00 0.00 N ATOM 675 CD2 HIS A 376 5.457 -12.387 11.983 1.00 0.00 C ATOM 676 CE1 HIS A 376 3.638 -13.531 11.555 1.00 0.00 C ATOM 677 NE2 HIS A 376 4.428 -13.129 12.569 1.00 0.00 N ATOM 0 H HIS A 376 4.660 -9.905 8.557 1.00 0.00 H new ATOM 0 HA HIS A 376 6.278 -10.012 10.962 1.00 0.00 H new ATOM 0 HB2 HIS A 376 5.752 -11.830 8.620 1.00 0.00 H new ATOM 0 HB3 HIS A 376 7.139 -12.095 9.658 1.00 0.00 H new ATOM 0 HD1 HIS A 376 3.706 -13.285 9.459 1.00 0.00 H new ATOM 0 HD2 HIS A 376 6.272 -11.912 12.508 1.00 0.00 H new ATOM 0 HE1 HIS A 376 2.741 -14.121 11.675 1.00 0.00 H new ATOM 685 N GLU A 377 7.562 -9.109 8.053 1.00 0.00 N ATOM 686 CA GLU A 377 8.723 -8.396 7.520 1.00 0.00 C ATOM 687 C GLU A 377 9.058 -7.130 8.329 1.00 0.00 C ATOM 688 O GLU A 377 8.259 -6.621 9.117 1.00 0.00 O ATOM 689 CB GLU A 377 8.520 -8.027 6.035 1.00 0.00 C ATOM 690 CG GLU A 377 8.814 -9.175 5.061 1.00 0.00 C ATOM 691 CD GLU A 377 9.062 -8.612 3.660 1.00 0.00 C ATOM 692 OE1 GLU A 377 10.224 -8.212 3.411 1.00 0.00 O ATOM 693 OE2 GLU A 377 8.090 -8.523 2.876 1.00 0.00 O ATOM 0 H GLU A 377 6.805 -9.247 7.383 1.00 0.00 H new ATOM 0 HA GLU A 377 9.567 -9.081 7.606 1.00 0.00 H new ATOM 0 HB2 GLU A 377 7.491 -7.696 5.891 1.00 0.00 H new ATOM 0 HB3 GLU A 377 9.164 -7.182 5.790 1.00 0.00 H new ATOM 0 HG2 GLU A 377 9.686 -9.736 5.398 1.00 0.00 H new ATOM 0 HG3 GLU A 377 7.975 -9.871 5.041 1.00 0.00 H new ATOM 700 N ALA A 378 10.243 -6.570 8.048 1.00 0.00 N ATOM 701 CA ALA A 378 10.878 -5.493 8.801 1.00 0.00 C ATOM 702 C ALA A 378 9.941 -4.308 9.030 1.00 0.00 C ATOM 703 O ALA A 378 9.863 -3.791 10.142 1.00 0.00 O ATOM 704 CB ALA A 378 12.168 -5.058 8.095 1.00 0.00 C ATOM 0 H ALA A 378 10.806 -6.873 7.253 1.00 0.00 H new ATOM 0 HA ALA A 378 11.126 -5.878 9.790 1.00 0.00 H new ATOM 0 HB1 ALA A 378 12.639 -4.254 8.660 1.00 0.00 H new ATOM 0 HB2 ALA A 378 12.851 -5.905 8.031 1.00 0.00 H new ATOM 0 HB3 ALA A 378 11.932 -4.706 7.091 1.00 0.00 H new ATOM 710 N CYS A 379 9.282 -3.844 7.967 1.00 0.00 N ATOM 711 CA CYS A 379 8.074 -3.039 8.033 1.00 0.00 C ATOM 712 C CYS A 379 7.223 -3.437 6.822 1.00 0.00 C ATOM 713 O CYS A 379 7.800 -3.508 5.732 1.00 0.00 O ATOM 714 CB CYS A 379 8.410 -1.540 7.939 1.00 0.00 C ATOM 715 SG CYS A 379 8.992 -0.885 9.527 1.00 0.00 S ATOM 0 H CYS A 379 9.588 -4.027 7.011 1.00 0.00 H new ATOM 0 HA CYS A 379 7.554 -3.208 8.976 1.00 0.00 H new ATOM 0 HB2 CYS A 379 9.175 -1.385 7.179 1.00 0.00 H new ATOM 0 HB3 CYS A 379 7.526 -0.988 7.619 1.00 0.00 H new ATOM 0 HG CYS A 379 9.485 -1.853 10.241 1.00 0.00 H new ATOM 721 N PRO A 380 5.887 -3.572 6.959 1.00 0.00 N ATOM 722 CA PRO A 380 4.970 -3.856 5.857 1.00 0.00 C ATOM 723 C PRO A 380 5.155 -2.835 4.757 1.00 0.00 C ATOM 724 O PRO A 380 5.765 -3.166 3.756 1.00 0.00 O ATOM 725 CB PRO A 380 3.561 -3.898 6.453 1.00 0.00 C ATOM 726 CG PRO A 380 3.693 -3.200 7.804 1.00 0.00 C ATOM 727 CD PRO A 380 5.142 -3.459 8.204 1.00 0.00 C ATOM 0 HA PRO A 380 5.165 -4.817 5.382 1.00 0.00 H new ATOM 0 HB2 PRO A 380 2.844 -3.387 5.811 1.00 0.00 H new ATOM 0 HB3 PRO A 380 3.210 -4.923 6.569 1.00 0.00 H new ATOM 0 HG2 PRO A 380 3.484 -2.133 7.726 1.00 0.00 H new ATOM 0 HG3 PRO A 380 2.996 -3.609 8.536 1.00 0.00 H new ATOM 0 HD2 PRO A 380 5.529 -2.646 8.818 1.00 0.00 H new ATOM 0 HD3 PRO A 380 5.227 -4.372 8.794 1.00 0.00 H new ATOM 735 N VAL A 381 4.644 -1.614 4.908 1.00 0.00 N ATOM 736 CA VAL A 381 4.629 -0.588 3.869 1.00 0.00 C ATOM 737 C VAL A 381 5.931 -0.482 3.042 1.00 0.00 C ATOM 738 O VAL A 381 5.846 -0.271 1.835 1.00 0.00 O ATOM 739 CB VAL A 381 4.080 0.724 4.454 1.00 0.00 C ATOM 740 CG1 VAL A 381 4.088 1.884 3.451 1.00 0.00 C ATOM 741 CG2 VAL A 381 2.631 0.521 4.919 1.00 0.00 C ATOM 0 H VAL A 381 4.217 -1.304 5.781 1.00 0.00 H new ATOM 0 HA VAL A 381 3.934 -0.895 3.088 1.00 0.00 H new ATOM 0 HB VAL A 381 4.739 0.983 5.283 1.00 0.00 H new ATOM 0 HG11 VAL A 381 3.688 2.779 3.927 1.00 0.00 H new ATOM 0 HG12 VAL A 381 5.110 2.073 3.122 1.00 0.00 H new ATOM 0 HG13 VAL A 381 3.472 1.625 2.590 1.00 0.00 H new ATOM 0 HG21 VAL A 381 2.248 1.454 5.332 1.00 0.00 H new ATOM 0 HG22 VAL A 381 2.016 0.220 4.071 1.00 0.00 H new ATOM 0 HG23 VAL A 381 2.600 -0.255 5.684 1.00 0.00 H new ATOM 751 N ARG A 382 7.124 -0.698 3.611 1.00 0.00 N ATOM 752 CA ARG A 382 8.346 -0.715 2.803 1.00 0.00 C ATOM 753 C ARG A 382 8.363 -1.907 1.850 1.00 0.00 C ATOM 754 O ARG A 382 8.396 -1.701 0.634 1.00 0.00 O ATOM 755 CB ARG A 382 9.599 -0.704 3.701 1.00 0.00 C ATOM 756 CG ARG A 382 9.734 0.632 4.443 1.00 0.00 C ATOM 757 CD ARG A 382 10.997 0.737 5.309 1.00 0.00 C ATOM 758 NE ARG A 382 10.941 1.970 6.108 1.00 0.00 N ATOM 759 CZ ARG A 382 11.586 3.127 5.917 1.00 0.00 C ATOM 760 NH1 ARG A 382 12.648 3.237 5.126 1.00 0.00 N ATOM 761 NH2 ARG A 382 11.154 4.210 6.537 1.00 0.00 N ATOM 0 H ARG A 382 7.267 -0.860 4.608 1.00 0.00 H new ATOM 0 HA ARG A 382 8.358 0.191 2.197 1.00 0.00 H new ATOM 0 HB2 ARG A 382 9.541 -1.520 4.422 1.00 0.00 H new ATOM 0 HB3 ARG A 382 10.487 -0.878 3.094 1.00 0.00 H new ATOM 0 HG2 ARG A 382 9.736 1.443 3.714 1.00 0.00 H new ATOM 0 HG3 ARG A 382 8.858 0.775 5.076 1.00 0.00 H new ATOM 0 HD2 ARG A 382 11.075 -0.131 5.964 1.00 0.00 H new ATOM 0 HD3 ARG A 382 11.885 0.740 4.677 1.00 0.00 H new ATOM 0 HE ARG A 382 10.325 1.939 6.921 1.00 0.00 H new ATOM 0 HH11 ARG A 382 13.004 2.418 4.633 1.00 0.00 H new ATOM 0 HH12 ARG A 382 13.107 4.141 5.011 1.00 0.00 H new ATOM 0 HH21 ARG A 382 10.341 4.156 7.150 1.00 0.00 H new ATOM 0 HH22 ARG A 382 11.634 5.100 6.403 1.00 0.00 H new ATOM 775 N ALA A 383 8.335 -3.139 2.364 1.00 0.00 N ATOM 776 CA ALA A 383 8.432 -4.296 1.481 1.00 0.00 C ATOM 777 C ALA A 383 7.112 -4.571 0.751 1.00 0.00 C ATOM 778 O ALA A 383 7.114 -5.226 -0.287 1.00 0.00 O ATOM 779 CB ALA A 383 8.831 -5.514 2.309 1.00 0.00 C ATOM 0 H ALA A 383 8.249 -3.355 3.357 1.00 0.00 H new ATOM 0 HA ALA A 383 9.185 -4.087 0.721 1.00 0.00 H new ATOM 0 HB1 ALA A 383 8.907 -6.386 1.660 1.00 0.00 H new ATOM 0 HB2 ALA A 383 9.794 -5.331 2.785 1.00 0.00 H new ATOM 0 HB3 ALA A 383 8.077 -5.696 3.075 1.00 0.00 H new ATOM 785 N LEU A 384 6.021 -3.928 1.162 1.00 0.00 N ATOM 786 CA LEU A 384 4.699 -3.986 0.563 1.00 0.00 C ATOM 787 C LEU A 384 4.758 -3.289 -0.778 1.00 0.00 C ATOM 788 O LEU A 384 4.340 -3.853 -1.781 1.00 0.00 O ATOM 789 CB LEU A 384 3.718 -3.257 1.497 1.00 0.00 C ATOM 790 CG LEU A 384 2.236 -3.203 1.101 1.00 0.00 C ATOM 791 CD1 LEU A 384 1.670 -4.625 1.126 1.00 0.00 C ATOM 792 CD2 LEU A 384 1.492 -2.355 2.133 1.00 0.00 C ATOM 0 H LEU A 384 6.044 -3.314 1.976 1.00 0.00 H new ATOM 0 HA LEU A 384 4.370 -5.016 0.423 1.00 0.00 H new ATOM 0 HB2 LEU A 384 3.782 -3.727 2.478 1.00 0.00 H new ATOM 0 HB3 LEU A 384 4.069 -2.231 1.611 1.00 0.00 H new ATOM 0 HG LEU A 384 2.122 -2.774 0.106 1.00 0.00 H new ATOM 0 HD11 LEU A 384 0.617 -4.602 0.846 1.00 0.00 H new ATOM 0 HD12 LEU A 384 2.219 -5.248 0.420 1.00 0.00 H new ATOM 0 HD13 LEU A 384 1.770 -5.039 2.129 1.00 0.00 H new ATOM 0 HD21 LEU A 384 0.436 -2.304 1.869 1.00 0.00 H new ATOM 0 HD22 LEU A 384 1.598 -2.806 3.119 1.00 0.00 H new ATOM 0 HD23 LEU A 384 1.911 -1.349 2.147 1.00 0.00 H new ATOM 804 N LEU A 385 5.290 -2.066 -0.813 1.00 0.00 N ATOM 805 CA LEU A 385 5.291 -1.264 -2.029 1.00 0.00 C ATOM 806 C LEU A 385 6.409 -1.714 -2.971 1.00 0.00 C ATOM 807 O LEU A 385 6.321 -1.449 -4.173 1.00 0.00 O ATOM 808 CB LEU A 385 5.409 0.236 -1.677 1.00 0.00 C ATOM 809 CG LEU A 385 4.298 0.730 -0.720 1.00 0.00 C ATOM 810 CD1 LEU A 385 4.652 2.131 -0.219 1.00 0.00 C ATOM 811 CD2 LEU A 385 2.908 0.714 -1.363 1.00 0.00 C ATOM 0 H LEU A 385 5.725 -1.612 -0.010 1.00 0.00 H new ATOM 0 HA LEU A 385 4.346 -1.412 -2.552 1.00 0.00 H new ATOM 0 HB2 LEU A 385 6.381 0.419 -1.219 1.00 0.00 H new ATOM 0 HB3 LEU A 385 5.374 0.821 -2.596 1.00 0.00 H new ATOM 0 HG LEU A 385 4.248 0.037 0.120 1.00 0.00 H new ATOM 0 HD11 LEU A 385 3.872 2.484 0.456 1.00 0.00 H new ATOM 0 HD12 LEU A 385 5.604 2.098 0.312 1.00 0.00 H new ATOM 0 HD13 LEU A 385 4.733 2.811 -1.067 1.00 0.00 H new ATOM 0 HD21 LEU A 385 2.170 1.071 -0.644 1.00 0.00 H new ATOM 0 HD22 LEU A 385 2.905 1.363 -2.239 1.00 0.00 H new ATOM 0 HD23 LEU A 385 2.658 -0.303 -1.665 1.00 0.00 H new ATOM 823 N ALA A 386 7.432 -2.413 -2.463 1.00 0.00 N ATOM 824 CA ALA A 386 8.388 -3.098 -3.327 1.00 0.00 C ATOM 825 C ALA A 386 7.787 -4.375 -3.937 1.00 0.00 C ATOM 826 O ALA A 386 7.946 -4.603 -5.134 1.00 0.00 O ATOM 827 CB ALA A 386 9.636 -3.449 -2.509 1.00 0.00 C ATOM 0 H ALA A 386 7.614 -2.516 -1.465 1.00 0.00 H new ATOM 0 HA ALA A 386 8.650 -2.432 -4.149 1.00 0.00 H new ATOM 0 HB1 ALA A 386 10.357 -3.961 -3.146 1.00 0.00 H new ATOM 0 HB2 ALA A 386 10.083 -2.535 -2.117 1.00 0.00 H new ATOM 0 HB3 ALA A 386 9.357 -4.100 -1.681 1.00 0.00 H new ATOM 833 N SER A 387 7.040 -5.162 -3.159 1.00 0.00 N ATOM 834 CA SER A 387 6.628 -6.513 -3.536 1.00 0.00 C ATOM 835 C SER A 387 5.309 -6.497 -4.297 1.00 0.00 C ATOM 836 O SER A 387 5.212 -7.126 -5.348 1.00 0.00 O ATOM 837 CB SER A 387 6.566 -7.432 -2.318 1.00 0.00 C ATOM 838 OG SER A 387 7.823 -7.451 -1.678 1.00 0.00 O ATOM 0 H SER A 387 6.702 -4.875 -2.241 1.00 0.00 H new ATOM 0 HA SER A 387 7.385 -6.916 -4.209 1.00 0.00 H new ATOM 0 HB2 SER A 387 5.799 -7.085 -1.626 1.00 0.00 H new ATOM 0 HB3 SER A 387 6.287 -8.440 -2.624 1.00 0.00 H new ATOM 0 HG SER A 387 7.883 -6.698 -1.053 1.00 0.00 H new ATOM 844 N TRP A 388 4.288 -5.788 -3.797 1.00 0.00 N ATOM 845 CA TRP A 388 3.066 -5.557 -4.563 1.00 0.00 C ATOM 846 C TRP A 388 3.415 -4.954 -5.925 1.00 0.00 C ATOM 847 O TRP A 388 2.779 -5.279 -6.924 1.00 0.00 O ATOM 848 CB TRP A 388 2.112 -4.633 -3.792 1.00 0.00 C ATOM 849 CG TRP A 388 0.815 -4.345 -4.486 1.00 0.00 C ATOM 850 CD1 TRP A 388 -0.166 -5.242 -4.734 1.00 0.00 C ATOM 851 CD2 TRP A 388 0.351 -3.082 -5.051 1.00 0.00 C ATOM 852 NE1 TRP A 388 -1.187 -4.635 -5.437 1.00 0.00 N ATOM 853 CE2 TRP A 388 -0.923 -3.307 -5.650 1.00 0.00 C ATOM 854 CE3 TRP A 388 0.876 -1.773 -5.140 1.00 0.00 C ATOM 855 CZ2 TRP A 388 -1.659 -2.295 -6.273 1.00 0.00 C ATOM 856 CZ3 TRP A 388 0.137 -0.758 -5.780 1.00 0.00 C ATOM 857 CH2 TRP A 388 -1.123 -1.005 -6.310 1.00 0.00 C ATOM 0 H TRP A 388 4.288 -5.367 -2.868 1.00 0.00 H new ATOM 0 HA TRP A 388 2.561 -6.511 -4.718 1.00 0.00 H new ATOM 0 HB2 TRP A 388 1.897 -5.084 -2.823 1.00 0.00 H new ATOM 0 HB3 TRP A 388 2.621 -3.689 -3.598 1.00 0.00 H new ATOM 0 HD1 TRP A 388 -0.153 -6.278 -4.428 1.00 0.00 H new ATOM 0 HE1 TRP A 388 -2.029 -5.113 -5.757 1.00 0.00 H new ATOM 0 HE3 TRP A 388 1.844 -1.550 -4.717 1.00 0.00 H new ATOM 0 HZ2 TRP A 388 -2.621 -2.506 -6.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 388 0.559 0.233 -5.860 1.00 0.00 H new ATOM 0 HH2 TRP A 388 -1.690 -0.198 -6.752 1.00 0.00 H new ATOM 868 N GLY A 389 4.471 -4.135 -5.976 1.00 0.00 N ATOM 869 CA GLY A 389 4.968 -3.524 -7.191 1.00 0.00 C ATOM 870 C GLY A 389 5.581 -4.504 -8.200 1.00 0.00 C ATOM 871 O GLY A 389 5.934 -4.078 -9.298 1.00 0.00 O ATOM 0 H GLY A 389 5.009 -3.879 -5.148 1.00 0.00 H new ATOM 0 HA2 GLY A 389 4.149 -2.992 -7.675 1.00 0.00 H new ATOM 0 HA3 GLY A 389 5.719 -2.780 -6.926 1.00 0.00 H new ATOM 875 N ALA A 390 5.703 -5.799 -7.885 1.00 0.00 N ATOM 876 CA ALA A 390 6.013 -6.815 -8.885 1.00 0.00 C ATOM 877 C ALA A 390 4.812 -7.082 -9.805 1.00 0.00 C ATOM 878 O ALA A 390 4.990 -7.601 -10.907 1.00 0.00 O ATOM 879 CB ALA A 390 6.444 -8.111 -8.191 1.00 0.00 C ATOM 0 H ALA A 390 5.590 -6.164 -6.939 1.00 0.00 H new ATOM 0 HA ALA A 390 6.830 -6.444 -9.504 1.00 0.00 H new ATOM 0 HB1 ALA A 390 6.674 -8.867 -8.942 1.00 0.00 H new ATOM 0 HB2 ALA A 390 7.329 -7.921 -7.584 1.00 0.00 H new ATOM 0 HB3 ALA A 390 5.636 -8.468 -7.553 1.00 0.00 H new ATOM 885 N GLN A 391 3.589 -6.761 -9.371 1.00 0.00 N ATOM 886 CA GLN A 391 2.405 -6.840 -10.211 1.00 0.00 C ATOM 887 C GLN A 391 2.418 -5.589 -11.092 1.00 0.00 C ATOM 888 O GLN A 391 2.345 -4.484 -10.569 1.00 0.00 O ATOM 889 CB GLN A 391 1.148 -6.937 -9.314 1.00 0.00 C ATOM 890 CG GLN A 391 1.145 -8.227 -8.490 1.00 0.00 C ATOM 891 CD GLN A 391 -0.195 -8.436 -7.796 1.00 0.00 C ATOM 892 OE1 GLN A 391 -0.852 -9.445 -8.006 1.00 0.00 O ATOM 893 NE2 GLN A 391 -0.626 -7.514 -6.951 1.00 0.00 N ATOM 0 H GLN A 391 3.399 -6.439 -8.422 1.00 0.00 H new ATOM 0 HA GLN A 391 2.394 -7.725 -10.847 1.00 0.00 H new ATOM 0 HB2 GLN A 391 1.110 -6.077 -8.645 1.00 0.00 H new ATOM 0 HB3 GLN A 391 0.253 -6.898 -9.935 1.00 0.00 H new ATOM 0 HG2 GLN A 391 1.357 -9.076 -9.139 1.00 0.00 H new ATOM 0 HG3 GLN A 391 1.940 -8.188 -7.746 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -0.069 -6.676 -6.783 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -1.515 -7.641 -6.467 1.00 0.00 H new ATOM 902 N ASP A 392 2.484 -5.721 -12.422 1.00 0.00 N ATOM 903 CA ASP A 392 2.581 -4.555 -13.323 1.00 0.00 C ATOM 904 C ASP A 392 1.391 -3.595 -13.159 1.00 0.00 C ATOM 905 O ASP A 392 1.522 -2.373 -13.284 1.00 0.00 O ATOM 906 CB ASP A 392 2.685 -5.001 -14.789 1.00 0.00 C ATOM 907 CG ASP A 392 2.749 -3.772 -15.701 1.00 0.00 C ATOM 908 OD1 ASP A 392 3.815 -3.123 -15.767 1.00 0.00 O ATOM 909 OD2 ASP A 392 1.697 -3.348 -16.232 1.00 0.00 O ATOM 0 H ASP A 392 2.472 -6.621 -12.903 1.00 0.00 H new ATOM 0 HA ASP A 392 3.488 -4.019 -13.044 1.00 0.00 H new ATOM 0 HB2 ASP A 392 3.574 -5.616 -14.929 1.00 0.00 H new ATOM 0 HB3 ASP A 392 1.826 -5.617 -15.053 1.00 0.00 H new ATOM 914 N SER A 393 0.231 -4.145 -12.804 1.00 0.00 N ATOM 915 CA SER A 393 -1.004 -3.428 -12.540 1.00 0.00 C ATOM 916 C SER A 393 -0.952 -2.579 -11.262 1.00 0.00 C ATOM 917 O SER A 393 -1.922 -1.882 -10.978 1.00 0.00 O ATOM 918 CB SER A 393 -2.137 -4.466 -12.482 1.00 0.00 C ATOM 919 OG SER A 393 -1.748 -5.635 -11.772 1.00 0.00 O ATOM 0 H SER A 393 0.128 -5.153 -12.688 1.00 0.00 H new ATOM 0 HA SER A 393 -1.176 -2.710 -13.342 1.00 0.00 H new ATOM 0 HB2 SER A 393 -3.011 -4.024 -12.003 1.00 0.00 H new ATOM 0 HB3 SER A 393 -2.433 -4.738 -13.495 1.00 0.00 H new ATOM 0 HG SER A 393 -2.494 -6.271 -11.755 1.00 0.00 H new ATOM 925 N ALA A 394 0.135 -2.621 -10.485 1.00 0.00 N ATOM 926 CA ALA A 394 0.325 -1.882 -9.244 1.00 0.00 C ATOM 927 C ALA A 394 0.604 -0.392 -9.498 1.00 0.00 C ATOM 928 O ALA A 394 1.596 0.161 -9.010 1.00 0.00 O ATOM 929 CB ALA A 394 1.460 -2.550 -8.458 1.00 0.00 C ATOM 0 H ALA A 394 0.941 -3.200 -10.720 1.00 0.00 H new ATOM 0 HA ALA A 394 -0.594 -1.913 -8.658 1.00 0.00 H new ATOM 0 HB1 ALA A 394 1.621 -2.013 -7.523 1.00 0.00 H new ATOM 0 HB2 ALA A 394 1.193 -3.584 -8.241 1.00 0.00 H new ATOM 0 HB3 ALA A 394 2.375 -2.528 -9.050 1.00 0.00 H new ATOM 935 N THR A 395 -0.234 0.282 -10.284 1.00 0.00 N ATOM 936 CA THR A 395 -0.090 1.710 -10.517 1.00 0.00 C ATOM 937 C THR A 395 -0.417 2.480 -9.232 1.00 0.00 C ATOM 938 O THR A 395 -0.876 1.903 -8.237 1.00 0.00 O ATOM 939 CB THR A 395 -0.908 2.150 -11.742 1.00 0.00 C ATOM 940 OG1 THR A 395 -2.291 2.052 -11.513 1.00 0.00 O ATOM 941 CG2 THR A 395 -0.559 1.339 -12.999 1.00 0.00 C ATOM 0 H THR A 395 -1.022 -0.145 -10.771 1.00 0.00 H new ATOM 0 HA THR A 395 0.945 1.947 -10.764 1.00 0.00 H new ATOM 0 HB THR A 395 -0.642 3.194 -11.909 1.00 0.00 H new ATOM 0 HG1 THR A 395 -2.707 2.930 -11.641 1.00 0.00 H new ATOM 0 HG21 THR A 395 -1.163 1.688 -13.836 1.00 0.00 H new ATOM 0 HG22 THR A 395 0.497 1.469 -13.235 1.00 0.00 H new ATOM 0 HG23 THR A 395 -0.763 0.283 -12.819 1.00 0.00 H new ATOM 949 N LEU A 396 -0.192 3.799 -9.223 1.00 0.00 N ATOM 950 CA LEU A 396 -0.674 4.608 -8.105 1.00 0.00 C ATOM 951 C LEU A 396 -2.198 4.459 -8.028 1.00 0.00 C ATOM 952 O LEU A 396 -2.738 4.279 -6.939 1.00 0.00 O ATOM 953 CB LEU A 396 -0.236 6.081 -8.249 1.00 0.00 C ATOM 954 CG LEU A 396 -0.097 6.911 -6.947 1.00 0.00 C ATOM 955 CD1 LEU A 396 -1.215 6.720 -5.916 1.00 0.00 C ATOM 956 CD2 LEU A 396 1.252 6.687 -6.245 1.00 0.00 C ATOM 0 H LEU A 396 0.304 4.312 -9.952 1.00 0.00 H new ATOM 0 HA LEU A 396 -0.234 4.257 -7.171 1.00 0.00 H new ATOM 0 HB2 LEU A 396 0.724 6.099 -8.765 1.00 0.00 H new ATOM 0 HB3 LEU A 396 -0.954 6.585 -8.896 1.00 0.00 H new ATOM 0 HG LEU A 396 -0.171 7.934 -7.315 1.00 0.00 H new ATOM 0 HD11 LEU A 396 -1.018 7.346 -5.046 1.00 0.00 H new ATOM 0 HD12 LEU A 396 -2.170 7.003 -6.358 1.00 0.00 H new ATOM 0 HD13 LEU A 396 -1.253 5.675 -5.610 1.00 0.00 H new ATOM 0 HD21 LEU A 396 1.296 7.292 -5.339 1.00 0.00 H new ATOM 0 HD22 LEU A 396 1.355 5.634 -5.983 1.00 0.00 H new ATOM 0 HD23 LEU A 396 2.063 6.976 -6.914 1.00 0.00 H new ATOM 968 N ASP A 397 -2.872 4.403 -9.182 1.00 0.00 N ATOM 969 CA ASP A 397 -4.331 4.414 -9.309 1.00 0.00 C ATOM 970 C ASP A 397 -4.933 3.122 -8.762 1.00 0.00 C ATOM 971 O ASP A 397 -6.081 3.115 -8.319 1.00 0.00 O ATOM 972 CB ASP A 397 -4.791 4.532 -10.781 1.00 0.00 C ATOM 973 CG ASP A 397 -3.808 5.248 -11.700 1.00 0.00 C ATOM 974 OD1 ASP A 397 -2.775 4.599 -11.998 1.00 0.00 O ATOM 975 OD2 ASP A 397 -4.057 6.418 -12.048 1.00 0.00 O ATOM 0 H ASP A 397 -2.399 4.347 -10.084 1.00 0.00 H new ATOM 0 HA ASP A 397 -4.671 5.282 -8.744 1.00 0.00 H new ATOM 0 HB2 ASP A 397 -4.970 3.531 -11.173 1.00 0.00 H new ATOM 0 HB3 ASP A 397 -5.744 5.060 -10.808 1.00 0.00 H new ATOM 980 N ALA A 398 -4.133 2.058 -8.679 1.00 0.00 N ATOM 981 CA ALA A 398 -4.572 0.757 -8.210 1.00 0.00 C ATOM 982 C ALA A 398 -4.645 0.792 -6.691 1.00 0.00 C ATOM 983 O ALA A 398 -5.663 0.411 -6.114 1.00 0.00 O ATOM 984 CB ALA A 398 -3.567 -0.316 -8.655 1.00 0.00 C ATOM 0 H ALA A 398 -3.148 2.084 -8.942 1.00 0.00 H new ATOM 0 HA ALA A 398 -5.551 0.519 -8.625 1.00 0.00 H new ATOM 0 HB1 ALA A 398 -3.898 -1.293 -8.302 1.00 0.00 H new ATOM 0 HB2 ALA A 398 -3.503 -0.326 -9.743 1.00 0.00 H new ATOM 0 HB3 ALA A 398 -2.586 -0.092 -8.236 1.00 0.00 H new ATOM 990 N LEU A 399 -3.586 1.279 -6.039 1.00 0.00 N ATOM 991 CA LEU A 399 -3.563 1.381 -4.587 1.00 0.00 C ATOM 992 C LEU A 399 -4.573 2.428 -4.147 1.00 0.00 C ATOM 993 O LEU A 399 -5.301 2.231 -3.178 1.00 0.00 O ATOM 994 CB LEU A 399 -2.145 1.713 -4.103 1.00 0.00 C ATOM 995 CG LEU A 399 -1.948 1.365 -2.617 1.00 0.00 C ATOM 996 CD1 LEU A 399 -0.518 0.887 -2.340 1.00 0.00 C ATOM 997 CD2 LEU A 399 -2.267 2.557 -1.713 1.00 0.00 C ATOM 0 H LEU A 399 -2.736 1.607 -6.498 1.00 0.00 H new ATOM 0 HA LEU A 399 -3.841 0.427 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 399 -1.419 1.165 -4.703 1.00 0.00 H new ATOM 0 HB3 LEU A 399 -1.949 2.774 -4.256 1.00 0.00 H new ATOM 0 HG LEU A 399 -2.643 0.556 -2.391 1.00 0.00 H new ATOM 0 HD11 LEU A 399 -0.412 0.649 -1.281 1.00 0.00 H new ATOM 0 HD12 LEU A 399 -0.310 -0.003 -2.934 1.00 0.00 H new ATOM 0 HD13 LEU A 399 0.187 1.674 -2.607 1.00 0.00 H new ATOM 0 HD21 LEU A 399 -2.117 2.274 -0.671 1.00 0.00 H new ATOM 0 HD22 LEU A 399 -1.608 3.389 -1.962 1.00 0.00 H new ATOM 0 HD23 LEU A 399 -3.304 2.859 -1.861 1.00 0.00 H new ATOM 1009 N LEU A 400 -4.650 3.525 -4.897 1.00 0.00 N ATOM 1010 CA LEU A 400 -5.557 4.625 -4.667 1.00 0.00 C ATOM 1011 C LEU A 400 -7.002 4.127 -4.704 1.00 0.00 C ATOM 1012 O LEU A 400 -7.778 4.426 -3.802 1.00 0.00 O ATOM 1013 CB LEU A 400 -5.254 5.667 -5.759 1.00 0.00 C ATOM 1014 CG LEU A 400 -6.281 6.788 -5.966 1.00 0.00 C ATOM 1015 CD1 LEU A 400 -5.561 8.068 -6.417 1.00 0.00 C ATOM 1016 CD2 LEU A 400 -7.369 6.476 -7.006 1.00 0.00 C ATOM 0 H LEU A 400 -4.054 3.668 -5.712 1.00 0.00 H new ATOM 0 HA LEU A 400 -5.425 5.077 -3.684 1.00 0.00 H new ATOM 0 HB2 LEU A 400 -4.294 6.128 -5.528 1.00 0.00 H new ATOM 0 HB3 LEU A 400 -5.135 5.139 -6.705 1.00 0.00 H new ATOM 0 HG LEU A 400 -6.777 6.904 -5.002 1.00 0.00 H new ATOM 0 HD11 LEU A 400 -6.291 8.864 -6.564 1.00 0.00 H new ATOM 0 HD12 LEU A 400 -4.844 8.370 -5.654 1.00 0.00 H new ATOM 0 HD13 LEU A 400 -5.036 7.880 -7.354 1.00 0.00 H new ATOM 0 HD21 LEU A 400 -8.050 7.324 -7.086 1.00 0.00 H new ATOM 0 HD22 LEU A 400 -6.904 6.291 -7.974 1.00 0.00 H new ATOM 0 HD23 LEU A 400 -7.926 5.592 -6.696 1.00 0.00 H new ATOM 1028 N ALA A 401 -7.391 3.352 -5.718 1.00 0.00 N ATOM 1029 CA ALA A 401 -8.738 2.806 -5.800 1.00 0.00 C ATOM 1030 C ALA A 401 -8.965 1.757 -4.712 1.00 0.00 C ATOM 1031 O ALA A 401 -10.068 1.667 -4.179 1.00 0.00 O ATOM 1032 CB ALA A 401 -8.938 2.166 -7.169 1.00 0.00 C ATOM 0 H ALA A 401 -6.785 3.090 -6.496 1.00 0.00 H new ATOM 0 HA ALA A 401 -9.453 3.616 -5.656 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -9.946 1.756 -7.235 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -8.801 2.918 -7.946 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -8.211 1.366 -7.306 1.00 0.00 H new ATOM 1038 N ALA A 402 -7.971 0.924 -4.402 1.00 0.00 N ATOM 1039 CA ALA A 402 -8.103 -0.043 -3.326 1.00 0.00 C ATOM 1040 C ALA A 402 -8.372 0.666 -1.990 1.00 0.00 C ATOM 1041 O ALA A 402 -9.282 0.272 -1.269 1.00 0.00 O ATOM 1042 CB ALA A 402 -6.887 -0.959 -3.301 1.00 0.00 C ATOM 0 H ALA A 402 -7.071 0.904 -4.882 1.00 0.00 H new ATOM 0 HA ALA A 402 -8.969 -0.680 -3.502 1.00 0.00 H new ATOM 0 HB1 ALA A 402 -6.992 -1.682 -2.492 1.00 0.00 H new ATOM 0 HB2 ALA A 402 -6.810 -1.487 -4.251 1.00 0.00 H new ATOM 0 HB3 ALA A 402 -5.987 -0.365 -3.142 1.00 0.00 H new ATOM 1048 N LEU A 403 -7.680 1.769 -1.691 1.00 0.00 N ATOM 1049 CA LEU A 403 -8.017 2.631 -0.554 1.00 0.00 C ATOM 1050 C LEU A 403 -9.420 3.221 -0.672 1.00 0.00 C ATOM 1051 O LEU A 403 -10.155 3.349 0.309 1.00 0.00 O ATOM 1052 CB LEU A 403 -7.047 3.810 -0.485 1.00 0.00 C ATOM 1053 CG LEU A 403 -5.651 3.518 0.057 1.00 0.00 C ATOM 1054 CD1 LEU A 403 -4.776 4.734 -0.284 1.00 0.00 C ATOM 1055 CD2 LEU A 403 -5.738 3.266 1.565 1.00 0.00 C ATOM 0 H LEU A 403 -6.874 2.089 -2.228 1.00 0.00 H new ATOM 0 HA LEU A 403 -7.957 2.003 0.335 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -6.943 4.224 -1.488 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -7.497 4.585 0.135 1.00 0.00 H new ATOM 0 HG LEU A 403 -5.212 2.625 -0.388 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -3.764 4.569 0.086 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -4.749 4.871 -1.365 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -5.193 5.625 0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.743 3.057 1.957 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -6.144 4.149 2.059 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -6.389 2.413 1.754 1.00 0.00 H new ATOM 1067 N ARG A 404 -9.795 3.629 -1.880 1.00 0.00 N ATOM 1068 CA ARG A 404 -11.089 4.224 -2.168 1.00 0.00 C ATOM 1069 C ARG A 404 -12.222 3.246 -1.827 1.00 0.00 C ATOM 1070 O ARG A 404 -13.285 3.724 -1.437 1.00 0.00 O ATOM 1071 CB ARG A 404 -11.048 4.700 -3.634 1.00 0.00 C ATOM 1072 CG ARG A 404 -12.208 5.491 -4.203 1.00 0.00 C ATOM 1073 CD ARG A 404 -12.427 6.796 -3.459 1.00 0.00 C ATOM 1074 NE ARG A 404 -11.315 7.774 -3.452 1.00 0.00 N ATOM 1075 CZ ARG A 404 -10.960 8.636 -4.415 1.00 0.00 C ATOM 1076 NH1 ARG A 404 -11.319 8.439 -5.683 1.00 0.00 N ATOM 1077 NH2 ARG A 404 -10.251 9.704 -4.094 1.00 0.00 N ATOM 0 H ARG A 404 -9.194 3.552 -2.700 1.00 0.00 H new ATOM 0 HA ARG A 404 -11.300 5.092 -1.544 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -10.151 5.308 -3.753 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -10.920 3.816 -4.259 1.00 0.00 H new ATOM 0 HG2 ARG A 404 -12.021 5.701 -5.256 1.00 0.00 H new ATOM 0 HG3 ARG A 404 -13.116 4.889 -4.154 1.00 0.00 H new ATOM 0 HD2 ARG A 404 -13.302 7.285 -3.887 1.00 0.00 H new ATOM 0 HD3 ARG A 404 -12.671 6.556 -2.424 1.00 0.00 H new ATOM 0 HE ARG A 404 -10.746 7.794 -2.606 1.00 0.00 H new ATOM 0 HH11 ARG A 404 -11.874 7.621 -5.935 1.00 0.00 H new ATOM 0 HH12 ARG A 404 -11.039 9.106 -6.402 1.00 0.00 H new ATOM 0 HH21 ARG A 404 -9.981 9.864 -3.124 1.00 0.00 H new ATOM 0 HH22 ARG A 404 -9.974 10.368 -4.817 1.00 0.00 H new ATOM 1091 N ARG A 405 -12.009 1.920 -1.899 1.00 0.00 N ATOM 1092 CA ARG A 405 -12.981 0.890 -1.510 1.00 0.00 C ATOM 1093 C ARG A 405 -13.380 1.106 -0.053 1.00 0.00 C ATOM 1094 O ARG A 405 -14.555 1.195 0.284 1.00 0.00 O ATOM 1095 CB ARG A 405 -12.352 -0.517 -1.579 1.00 0.00 C ATOM 1096 CG ARG A 405 -11.790 -0.958 -2.933 1.00 0.00 C ATOM 1097 CD ARG A 405 -12.585 -2.052 -3.656 1.00 0.00 C ATOM 1098 NE ARG A 405 -12.188 -3.393 -3.201 1.00 0.00 N ATOM 1099 CZ ARG A 405 -11.151 -4.125 -3.628 1.00 0.00 C ATOM 1100 NH1 ARG A 405 -10.300 -3.658 -4.540 1.00 0.00 N ATOM 1101 NH2 ARG A 405 -10.930 -5.331 -3.132 1.00 0.00 N ATOM 0 H ARG A 405 -11.131 1.528 -2.239 1.00 0.00 H new ATOM 0 HA ARG A 405 -13.831 0.963 -2.189 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -11.547 -0.565 -0.846 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -13.107 -1.241 -1.272 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -11.732 -0.086 -3.584 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -10.770 -1.313 -2.785 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -13.651 -1.907 -3.479 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -12.426 -1.969 -4.731 1.00 0.00 H new ATOM 0 HE ARG A 405 -12.770 -3.814 -2.477 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -10.431 -2.724 -4.929 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -9.517 -4.234 -4.850 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -11.552 -5.711 -2.418 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -10.138 -5.881 -3.463 1.00 0.00 H new ATOM 1115 N ILE A 406 -12.368 1.237 0.801 1.00 0.00 N ATOM 1116 CA ILE A 406 -12.443 1.251 2.259 1.00 0.00 C ATOM 1117 C ILE A 406 -12.671 2.672 2.781 1.00 0.00 C ATOM 1118 O ILE A 406 -12.485 2.950 3.971 1.00 0.00 O ATOM 1119 CB ILE A 406 -11.210 0.545 2.850 1.00 0.00 C ATOM 1120 CG1 ILE A 406 -9.891 1.021 2.221 1.00 0.00 C ATOM 1121 CG2 ILE A 406 -11.398 -0.959 2.630 1.00 0.00 C ATOM 1122 CD1 ILE A 406 -8.704 0.193 2.664 1.00 0.00 C ATOM 0 H ILE A 406 -11.409 1.343 0.470 1.00 0.00 H new ATOM 0 HA ILE A 406 -13.311 0.684 2.596 1.00 0.00 H new ATOM 0 HB ILE A 406 -11.136 0.787 3.910 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -9.974 0.978 1.135 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -9.721 2.064 2.487 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -10.541 -1.496 3.037 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -12.306 -1.290 3.134 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -11.480 -1.163 1.562 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -7.799 0.572 2.190 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -8.600 0.256 3.747 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -8.857 -0.847 2.374 1.00 0.00 H new ATOM 1134 N GLN A 407 -13.074 3.582 1.884 1.00 0.00 N ATOM 1135 CA GLN A 407 -13.278 4.997 2.131 1.00 0.00 C ATOM 1136 C GLN A 407 -12.032 5.646 2.748 1.00 0.00 C ATOM 1137 O GLN A 407 -12.137 6.734 3.309 1.00 0.00 O ATOM 1138 CB GLN A 407 -14.607 5.190 2.898 1.00 0.00 C ATOM 1139 CG GLN A 407 -15.150 6.633 2.947 1.00 0.00 C ATOM 1140 CD GLN A 407 -14.761 7.437 4.196 1.00 0.00 C ATOM 1141 OE1 GLN A 407 -14.729 6.926 5.313 1.00 0.00 O ATOM 1142 NE2 GLN A 407 -14.481 8.723 4.051 1.00 0.00 N ATOM 0 H GLN A 407 -13.275 3.326 0.917 1.00 0.00 H new ATOM 0 HA GLN A 407 -13.398 5.546 1.197 1.00 0.00 H new ATOM 0 HB2 GLN A 407 -15.364 4.552 2.442 1.00 0.00 H new ATOM 0 HB3 GLN A 407 -14.469 4.839 3.921 1.00 0.00 H new ATOM 0 HG2 GLN A 407 -14.795 7.167 2.066 1.00 0.00 H new ATOM 0 HG3 GLN A 407 -16.237 6.597 2.882 1.00 0.00 H new ATOM 0 HE21 GLN A 407 -14.507 9.149 3.125 1.00 0.00 H new ATOM 0 HE22 GLN A 407 -14.239 9.287 4.866 1.00 0.00 H new ATOM 1151 N ARG A 408 -10.836 5.056 2.590 1.00 0.00 N ATOM 1152 CA ARG A 408 -9.581 5.711 2.987 1.00 0.00 C ATOM 1153 C ARG A 408 -9.181 6.732 1.922 1.00 0.00 C ATOM 1154 O ARG A 408 -8.090 6.715 1.357 1.00 0.00 O ATOM 1155 CB ARG A 408 -8.448 4.715 3.285 1.00 0.00 C ATOM 1156 CG ARG A 408 -8.564 3.868 4.563 1.00 0.00 C ATOM 1157 CD ARG A 408 -9.106 4.605 5.795 1.00 0.00 C ATOM 1158 NE ARG A 408 -10.571 4.480 5.836 1.00 0.00 N ATOM 1159 CZ ARG A 408 -11.481 5.422 6.094 1.00 0.00 C ATOM 1160 NH1 ARG A 408 -11.156 6.662 6.444 1.00 0.00 N ATOM 1161 NH2 ARG A 408 -12.757 5.079 5.970 1.00 0.00 N ATOM 0 H ARG A 408 -10.713 4.126 2.190 1.00 0.00 H new ATOM 0 HA ARG A 408 -9.758 6.230 3.929 1.00 0.00 H new ATOM 0 HB2 ARG A 408 -8.367 4.035 2.437 1.00 0.00 H new ATOM 0 HB3 ARG A 408 -7.514 5.274 3.336 1.00 0.00 H new ATOM 0 HG2 ARG A 408 -9.212 3.016 4.356 1.00 0.00 H new ATOM 0 HG3 ARG A 408 -7.579 3.468 4.804 1.00 0.00 H new ATOM 0 HD2 ARG A 408 -8.669 4.188 6.703 1.00 0.00 H new ATOM 0 HD3 ARG A 408 -8.821 5.656 5.758 1.00 0.00 H new ATOM 0 HE ARG A 408 -10.941 3.550 5.641 1.00 0.00 H new ATOM 0 HH11 ARG A 408 -10.175 6.928 6.525 1.00 0.00 H new ATOM 0 HH12 ARG A 408 -11.888 7.347 6.631 1.00 0.00 H new ATOM 0 HH21 ARG A 408 -13.005 4.131 5.688 1.00 0.00 H new ATOM 0 HH22 ARG A 408 -13.490 5.764 6.156 1.00 0.00 H new ATOM 1175 N ALA A 409 -10.124 7.620 1.623 1.00 0.00 N ATOM 1176 CA ALA A 409 -9.952 8.755 0.750 1.00 0.00 C ATOM 1177 C ALA A 409 -9.025 9.783 1.409 1.00 0.00 C ATOM 1178 O ALA A 409 -8.384 10.552 0.715 1.00 0.00 O ATOM 1179 CB ALA A 409 -11.341 9.329 0.470 1.00 0.00 C ATOM 0 H ALA A 409 -11.068 7.557 2.005 1.00 0.00 H new ATOM 0 HA ALA A 409 -9.484 8.469 -0.192 1.00 0.00 H new ATOM 0 HB1 ALA A 409 -11.252 10.192 -0.189 1.00 0.00 H new ATOM 0 HB2 ALA A 409 -11.959 8.569 -0.008 1.00 0.00 H new ATOM 0 HB3 ALA A 409 -11.804 9.635 1.408 1.00 0.00 H new ATOM 1185 N ASP A 410 -8.885 9.734 2.733 1.00 0.00 N ATOM 1186 CA ASP A 410 -7.876 10.449 3.508 1.00 0.00 C ATOM 1187 C ASP A 410 -6.479 10.219 2.919 1.00 0.00 C ATOM 1188 O ASP A 410 -5.844 11.168 2.458 1.00 0.00 O ATOM 1189 CB ASP A 410 -7.976 10.071 5.008 1.00 0.00 C ATOM 1190 CG ASP A 410 -8.254 8.587 5.316 1.00 0.00 C ATOM 1191 OD1 ASP A 410 -7.857 7.711 4.519 1.00 0.00 O ATOM 1192 OD2 ASP A 410 -8.997 8.295 6.278 1.00 0.00 O ATOM 0 H ASP A 410 -9.500 9.169 3.319 1.00 0.00 H new ATOM 0 HA ASP A 410 -8.064 11.521 3.444 1.00 0.00 H new ATOM 0 HB2 ASP A 410 -7.043 10.354 5.496 1.00 0.00 H new ATOM 0 HB3 ASP A 410 -8.767 10.669 5.461 1.00 0.00 H new ATOM 1197 N ILE A 411 -6.004 8.975 2.870 1.00 0.00 N ATOM 1198 CA ILE A 411 -4.662 8.687 2.368 1.00 0.00 C ATOM 1199 C ILE A 411 -4.616 8.923 0.864 1.00 0.00 C ATOM 1200 O ILE A 411 -3.572 9.315 0.350 1.00 0.00 O ATOM 1201 CB ILE A 411 -4.203 7.249 2.700 1.00 0.00 C ATOM 1202 CG1 ILE A 411 -4.384 6.961 4.216 1.00 0.00 C ATOM 1203 CG2 ILE A 411 -2.750 7.029 2.229 1.00 0.00 C ATOM 1204 CD1 ILE A 411 -4.309 5.487 4.616 1.00 0.00 C ATOM 0 H ILE A 411 -6.527 8.153 3.171 1.00 0.00 H new ATOM 0 HA ILE A 411 -3.971 9.364 2.870 1.00 0.00 H new ATOM 0 HB ILE A 411 -4.828 6.537 2.161 1.00 0.00 H new ATOM 0 HG12 ILE A 411 -3.619 7.509 4.767 1.00 0.00 H new ATOM 0 HG13 ILE A 411 -5.349 7.357 4.531 1.00 0.00 H new ATOM 0 HG21 ILE A 411 -2.440 6.012 2.469 1.00 0.00 H new ATOM 0 HG22 ILE A 411 -2.690 7.182 1.151 1.00 0.00 H new ATOM 0 HG23 ILE A 411 -2.093 7.738 2.733 1.00 0.00 H new ATOM 0 HD11 ILE A 411 -4.447 5.395 5.693 1.00 0.00 H new ATOM 0 HD12 ILE A 411 -5.091 4.930 4.101 1.00 0.00 H new ATOM 0 HD13 ILE A 411 -3.335 5.084 4.340 1.00 0.00 H new ATOM 1216 N VAL A 412 -5.699 8.636 0.138 1.00 0.00 N ATOM 1217 CA VAL A 412 -5.698 8.819 -1.301 1.00 0.00 C ATOM 1218 C VAL A 412 -5.461 10.302 -1.646 1.00 0.00 C ATOM 1219 O VAL A 412 -4.628 10.632 -2.484 1.00 0.00 O ATOM 1220 CB VAL A 412 -7.048 8.391 -1.909 1.00 0.00 C ATOM 1221 CG1 VAL A 412 -7.218 8.869 -3.352 1.00 0.00 C ATOM 1222 CG2 VAL A 412 -7.208 6.879 -1.879 1.00 0.00 C ATOM 0 H VAL A 412 -6.574 8.281 0.524 1.00 0.00 H new ATOM 0 HA VAL A 412 -4.900 8.202 -1.714 1.00 0.00 H new ATOM 0 HB VAL A 412 -7.815 8.861 -1.294 1.00 0.00 H new ATOM 0 HG11 VAL A 412 -8.185 8.541 -3.732 1.00 0.00 H new ATOM 0 HG12 VAL A 412 -7.166 9.957 -3.383 1.00 0.00 H new ATOM 0 HG13 VAL A 412 -6.424 8.450 -3.970 1.00 0.00 H new ATOM 0 HG21 VAL A 412 -8.169 6.606 -2.314 1.00 0.00 H new ATOM 0 HG22 VAL A 412 -6.405 6.417 -2.454 1.00 0.00 H new ATOM 0 HG23 VAL A 412 -7.164 6.529 -0.848 1.00 0.00 H new ATOM 1232 N GLU A 413 -6.290 11.198 -1.109 1.00 0.00 N ATOM 1233 CA GLU A 413 -6.198 12.620 -1.398 1.00 0.00 C ATOM 1234 C GLU A 413 -4.833 13.166 -0.937 1.00 0.00 C ATOM 1235 O GLU A 413 -4.279 14.038 -1.602 1.00 0.00 O ATOM 1236 CB GLU A 413 -7.423 13.347 -0.817 1.00 0.00 C ATOM 1237 CG GLU A 413 -8.627 13.415 -1.788 1.00 0.00 C ATOM 1238 CD GLU A 413 -9.027 12.114 -2.522 1.00 0.00 C ATOM 1239 OE1 GLU A 413 -9.569 11.158 -1.915 1.00 0.00 O ATOM 1240 OE2 GLU A 413 -8.896 12.066 -3.769 1.00 0.00 O ATOM 0 H GLU A 413 -7.041 10.954 -0.463 1.00 0.00 H new ATOM 0 HA GLU A 413 -6.230 12.805 -2.472 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -7.734 12.842 0.098 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -7.134 14.361 -0.539 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -9.493 13.764 -1.226 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -8.410 14.173 -2.541 1.00 0.00 H new ATOM 1247 N SER A 414 -4.228 12.589 0.111 1.00 0.00 N ATOM 1248 CA SER A 414 -2.860 12.902 0.523 1.00 0.00 C ATOM 1249 C SER A 414 -1.866 12.384 -0.528 1.00 0.00 C ATOM 1250 O SER A 414 -0.986 13.112 -0.961 1.00 0.00 O ATOM 1251 CB SER A 414 -2.595 12.260 1.889 1.00 0.00 C ATOM 1252 OG SER A 414 -1.595 12.925 2.629 1.00 0.00 O ATOM 0 H SER A 414 -4.680 11.888 0.698 1.00 0.00 H new ATOM 0 HA SER A 414 -2.732 13.981 0.606 1.00 0.00 H new ATOM 0 HB2 SER A 414 -3.520 12.252 2.465 1.00 0.00 H new ATOM 0 HB3 SER A 414 -2.301 11.221 1.744 1.00 0.00 H new ATOM 0 HG SER A 414 -1.924 13.107 3.534 1.00 0.00 H new ATOM 1258 N LEU A 415 -2.062 11.178 -1.066 1.00 0.00 N ATOM 1259 CA LEU A 415 -1.260 10.619 -2.155 1.00 0.00 C ATOM 1260 C LEU A 415 -1.220 11.589 -3.339 1.00 0.00 C ATOM 1261 O LEU A 415 -0.206 11.650 -4.035 1.00 0.00 O ATOM 1262 CB LEU A 415 -1.791 9.235 -2.589 1.00 0.00 C ATOM 1263 CG LEU A 415 -1.127 8.073 -1.849 1.00 0.00 C ATOM 1264 CD1 LEU A 415 -1.995 6.803 -1.932 1.00 0.00 C ATOM 1265 CD2 LEU A 415 0.260 7.821 -2.452 1.00 0.00 C ATOM 0 H LEU A 415 -2.800 10.549 -0.749 1.00 0.00 H new ATOM 0 HA LEU A 415 -0.242 10.479 -1.790 1.00 0.00 H new ATOM 0 HB2 LEU A 415 -2.867 9.197 -2.420 1.00 0.00 H new ATOM 0 HB3 LEU A 415 -1.632 9.112 -3.660 1.00 0.00 H new ATOM 0 HG LEU A 415 -1.022 8.332 -0.795 1.00 0.00 H new ATOM 0 HD11 LEU A 415 -1.502 5.990 -1.399 1.00 0.00 H new ATOM 0 HD12 LEU A 415 -2.968 6.997 -1.480 1.00 0.00 H new ATOM 0 HD13 LEU A 415 -2.130 6.522 -2.977 1.00 0.00 H new ATOM 0 HD21 LEU A 415 0.739 6.993 -1.929 1.00 0.00 H new ATOM 0 HD22 LEU A 415 0.158 7.572 -3.508 1.00 0.00 H new ATOM 0 HD23 LEU A 415 0.870 8.718 -2.348 1.00 0.00 H new