USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 732 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 430 CYS SG : rot 61:sc= -0.597 USER MOD Set 1.2: A 434 GLN : amide:sc= -9.56! C(o=-10!,f=-11!) USER MOD Set 2.1: A 390 THR OG1 : rot -53:sc= 0.00266 USER MOD Set 2.2: A 401 SER OG : rot -150:sc= 0.00334 USER MOD Set 3.1: A 371 LYS NZ :NH3+ -173:sc= -2.4 (180deg=-0.519) USER MOD Set 3.2: A 424 GLN : amide:sc= -4.35 K(o=-6.8,f=1.7) USER MOD Single : A 354 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 355 MET CE :methyl -140:sc= -2.84! (180deg=-4.35!) USER MOD Single : A 364 TYR OH : rot 180:sc= 0 USER MOD Single : A 367 GLN : amide:sc= -0.169 K(o=-0.17,f=-2!) USER MOD Single : A 369 THR OG1 : rot -74:sc= -0.995 USER MOD Single : A 372 MET CE :methyl 165:sc= -0.139 (180deg=-0.547) USER MOD Single : A 373 CYS SG : rot 180:sc= 0 USER MOD Single : A 378 CYS SG : rot -54:sc= 1.15 USER MOD Single : A 382 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 385 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 388 TYR OH : rot -49:sc= -2.8! USER MOD Single : A 392 GLN : amide:sc=-0.000291 K(o=-0.00029,f=-1.3) USER MOD Single : A 394 THR OG1 : rot 180:sc= 0 USER MOD Single : A 398 MET CE :methyl 178:sc= -0.23 (180deg=-0.232) USER MOD Single : A 400 CYS SG : rot -106:sc= 0.0327 USER MOD Single : A 404 THR OG1 : rot 180:sc= -0.722 USER MOD Single : A 408 GLN : amide:sc= -2.58 K(o=-2.6,f=-1.4) USER MOD Single : A 409 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 410 TYR OH : rot 180:sc= -0.0896 USER MOD Single : A 411 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 412 SER OG : rot 159:sc= 0.87 USER MOD Single : A 413 THR OG1 : rot 180:sc= 0 USER MOD Single : A 417 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 SER OG : rot 180:sc= -0.131 USER MOD Single : A 419 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 420 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0137) USER MOD Single : A 425 THR OG1 : rot 180:sc= 0.0028 USER MOD Single : A 433 SER OG : rot 87:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 84 N ILE A 352 -2.162 4.463 15.111 1.00 0.00 N ATOM 85 CA ILE A 352 -2.008 4.234 13.680 1.00 0.00 C ATOM 86 C ILE A 352 -0.551 3.961 13.321 1.00 0.00 C ATOM 87 O ILE A 352 0.334 4.760 13.627 1.00 0.00 O ATOM 88 CB ILE A 352 -2.510 5.437 12.860 1.00 0.00 C ATOM 89 CG1 ILE A 352 -3.932 5.813 13.283 1.00 0.00 C ATOM 90 CG2 ILE A 352 -2.460 5.122 11.372 1.00 0.00 C ATOM 91 CD1 ILE A 352 -4.288 7.254 12.992 1.00 0.00 C ATOM 0 HA ILE A 352 -2.611 3.360 13.434 1.00 0.00 H new ATOM 0 HB ILE A 352 -1.857 6.288 13.054 1.00 0.00 H new ATOM 0 HG12 ILE A 352 -4.639 5.162 12.770 1.00 0.00 H new ATOM 0 HG13 ILE A 352 -4.046 5.628 14.351 1.00 0.00 H new ATOM 0 HG21 ILE A 352 -2.818 5.982 10.806 1.00 0.00 H new ATOM 0 HG22 ILE A 352 -1.433 4.898 11.082 1.00 0.00 H new ATOM 0 HG23 ILE A 352 -3.093 4.260 11.161 1.00 0.00 H new ATOM 0 HD11 ILE A 352 -5.310 7.449 13.318 1.00 0.00 H new ATOM 0 HD12 ILE A 352 -3.604 7.913 13.527 1.00 0.00 H new ATOM 0 HD13 ILE A 352 -4.207 7.440 11.921 1.00 0.00 H new ATOM 103 N ILE A 353 -0.310 2.829 12.668 1.00 0.00 N ATOM 104 CA ILE A 353 1.039 2.452 12.265 1.00 0.00 C ATOM 105 C ILE A 353 1.502 3.271 11.064 1.00 0.00 C ATOM 106 O ILE A 353 1.106 3.007 9.929 1.00 0.00 O ATOM 107 CB ILE A 353 1.124 0.955 11.915 1.00 0.00 C ATOM 108 CG1 ILE A 353 0.717 0.103 13.119 1.00 0.00 C ATOM 109 CG2 ILE A 353 2.530 0.597 11.457 1.00 0.00 C ATOM 110 CD1 ILE A 353 0.283 -1.298 12.750 1.00 0.00 C ATOM 0 H ILE A 353 -1.032 2.157 12.407 1.00 0.00 H new ATOM 0 HA ILE A 353 1.691 2.655 13.114 1.00 0.00 H new ATOM 0 HB ILE A 353 0.433 0.749 11.098 1.00 0.00 H new ATOM 0 HG12 ILE A 353 1.556 0.044 13.812 1.00 0.00 H new ATOM 0 HG13 ILE A 353 -0.097 0.600 13.646 1.00 0.00 H new ATOM 0 HG21 ILE A 353 2.574 -0.464 11.213 1.00 0.00 H new ATOM 0 HG22 ILE A 353 2.785 1.183 10.574 1.00 0.00 H new ATOM 0 HG23 ILE A 353 3.239 0.816 12.255 1.00 0.00 H new ATOM 0 HD11 ILE A 353 0.009 -1.844 13.653 1.00 0.00 H new ATOM 0 HD12 ILE A 353 -0.576 -1.248 12.081 1.00 0.00 H new ATOM 0 HD13 ILE A 353 1.103 -1.813 12.249 1.00 0.00 H new ATOM 122 N LYS A 354 2.345 4.265 11.323 1.00 0.00 N ATOM 123 CA LYS A 354 2.866 5.121 10.264 1.00 0.00 C ATOM 124 C LYS A 354 4.194 4.587 9.736 1.00 0.00 C ATOM 125 O LYS A 354 5.060 4.176 10.509 1.00 0.00 O ATOM 126 CB LYS A 354 3.049 6.550 10.780 1.00 0.00 C ATOM 127 CG LYS A 354 1.821 7.425 10.594 1.00 0.00 C ATOM 128 CD LYS A 354 0.672 6.967 11.476 1.00 0.00 C ATOM 129 CE LYS A 354 0.711 7.642 12.838 1.00 0.00 C ATOM 130 NZ LYS A 354 0.011 8.957 12.826 1.00 0.00 N ATOM 0 H LYS A 354 2.682 4.498 12.257 1.00 0.00 H new ATOM 0 HA LYS A 354 2.145 5.125 9.446 1.00 0.00 H new ATOM 0 HB2 LYS A 354 3.303 6.515 11.839 1.00 0.00 H new ATOM 0 HB3 LYS A 354 3.893 7.008 10.265 1.00 0.00 H new ATOM 0 HG2 LYS A 354 2.071 8.460 10.829 1.00 0.00 H new ATOM 0 HG3 LYS A 354 1.511 7.401 9.549 1.00 0.00 H new ATOM 0 HD2 LYS A 354 -0.276 7.190 10.986 1.00 0.00 H new ATOM 0 HD3 LYS A 354 0.719 5.885 11.603 1.00 0.00 H new ATOM 0 HE2 LYS A 354 0.248 6.991 13.579 1.00 0.00 H new ATOM 0 HE3 LYS A 354 1.748 7.785 13.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 354 0.060 9.385 13.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 354 0.468 9.587 12.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 354 -0.985 8.818 12.560 1.00 0.00 H new ATOM 144 N MET A 355 4.348 4.596 8.416 1.00 0.00 N ATOM 145 CA MET A 355 5.571 4.114 7.786 1.00 0.00 C ATOM 146 C MET A 355 5.876 4.903 6.516 1.00 0.00 C ATOM 147 O MET A 355 4.967 5.392 5.846 1.00 0.00 O ATOM 148 CB MET A 355 5.450 2.625 7.459 1.00 0.00 C ATOM 149 CG MET A 355 6.783 1.956 7.168 1.00 0.00 C ATOM 150 SD MET A 355 6.793 0.207 7.609 1.00 0.00 S ATOM 151 CE MET A 355 5.304 -0.357 6.789 1.00 0.00 C ATOM 0 H MET A 355 3.641 4.932 7.762 1.00 0.00 H new ATOM 0 HA MET A 355 6.392 4.258 8.488 1.00 0.00 H new ATOM 0 HB2 MET A 355 4.972 2.115 8.296 1.00 0.00 H new ATOM 0 HB3 MET A 355 4.796 2.503 6.596 1.00 0.00 H new ATOM 0 HG2 MET A 355 7.014 2.061 6.108 1.00 0.00 H new ATOM 0 HG3 MET A 355 7.571 2.470 7.718 1.00 0.00 H new ATOM 0 HE1 MET A 355 4.781 -1.066 7.431 1.00 0.00 H new ATOM 0 HE2 MET A 355 4.655 0.495 6.586 1.00 0.00 H new ATOM 0 HE3 MET A 355 5.568 -0.844 5.850 1.00 0.00 H new ATOM 161 N ALA A 356 7.159 5.022 6.193 1.00 0.00 N ATOM 162 CA ALA A 356 7.582 5.750 5.003 1.00 0.00 C ATOM 163 C ALA A 356 7.489 4.871 3.760 1.00 0.00 C ATOM 164 O ALA A 356 8.319 3.986 3.551 1.00 0.00 O ATOM 165 CB ALA A 356 9.001 6.270 5.179 1.00 0.00 C ATOM 0 H ALA A 356 7.924 4.624 6.738 1.00 0.00 H new ATOM 0 HA ALA A 356 6.910 6.598 4.868 1.00 0.00 H new ATOM 0 HB1 ALA A 356 9.304 6.812 4.283 1.00 0.00 H new ATOM 0 HB2 ALA A 356 9.039 6.940 6.038 1.00 0.00 H new ATOM 0 HB3 ALA A 356 9.678 5.432 5.342 1.00 0.00 H new ATOM 171 N ILE A 357 6.475 5.121 2.939 1.00 0.00 N ATOM 172 CA ILE A 357 6.274 4.352 1.717 1.00 0.00 C ATOM 173 C ILE A 357 5.705 5.226 0.604 1.00 0.00 C ATOM 174 O ILE A 357 4.862 6.089 0.849 1.00 0.00 O ATOM 175 CB ILE A 357 5.330 3.159 1.951 1.00 0.00 C ATOM 176 CG1 ILE A 357 5.839 2.296 3.108 1.00 0.00 C ATOM 177 CG2 ILE A 357 5.199 2.330 0.682 1.00 0.00 C ATOM 178 CD1 ILE A 357 4.848 1.248 3.561 1.00 0.00 C ATOM 0 H ILE A 357 5.780 5.850 3.098 1.00 0.00 H new ATOM 0 HA ILE A 357 7.252 3.977 1.417 1.00 0.00 H new ATOM 0 HB ILE A 357 4.344 3.542 2.215 1.00 0.00 H new ATOM 0 HG12 ILE A 357 6.763 1.804 2.804 1.00 0.00 H new ATOM 0 HG13 ILE A 357 6.084 2.941 3.952 1.00 0.00 H new ATOM 0 HG21 ILE A 357 4.528 1.490 0.864 1.00 0.00 H new ATOM 0 HG22 ILE A 357 4.795 2.951 -0.118 1.00 0.00 H new ATOM 0 HG23 ILE A 357 6.180 1.954 0.390 1.00 0.00 H new ATOM 0 HD11 ILE A 357 5.276 0.674 4.383 1.00 0.00 H new ATOM 0 HD12 ILE A 357 3.932 1.734 3.896 1.00 0.00 H new ATOM 0 HD13 ILE A 357 4.621 0.579 2.731 1.00 0.00 H new ATOM 190 N ARG A 358 6.170 4.996 -0.619 1.00 0.00 N ATOM 191 CA ARG A 358 5.707 5.762 -1.769 1.00 0.00 C ATOM 192 C ARG A 358 5.383 4.840 -2.942 1.00 0.00 C ATOM 193 O ARG A 358 6.279 4.260 -3.555 1.00 0.00 O ATOM 194 CB ARG A 358 6.766 6.784 -2.188 1.00 0.00 C ATOM 195 CG ARG A 358 8.139 6.177 -2.422 1.00 0.00 C ATOM 196 CD ARG A 358 9.238 7.221 -2.300 1.00 0.00 C ATOM 197 NE ARG A 358 8.933 8.429 -3.062 1.00 0.00 N ATOM 198 CZ ARG A 358 9.021 8.504 -4.386 1.00 0.00 C ATOM 199 NH1 ARG A 358 9.404 7.448 -5.089 1.00 0.00 N ATOM 200 NH2 ARG A 358 8.726 9.639 -5.008 1.00 0.00 N ATOM 0 H ARG A 358 6.867 4.285 -0.839 1.00 0.00 H new ATOM 0 HA ARG A 358 4.797 6.289 -1.480 1.00 0.00 H new ATOM 0 HB2 ARG A 358 6.438 7.281 -3.101 1.00 0.00 H new ATOM 0 HB3 ARG A 358 6.844 7.551 -1.417 1.00 0.00 H new ATOM 0 HG2 ARG A 358 8.313 5.378 -1.701 1.00 0.00 H new ATOM 0 HG3 ARG A 358 8.174 5.725 -3.413 1.00 0.00 H new ATOM 0 HD2 ARG A 358 9.377 7.480 -1.250 1.00 0.00 H new ATOM 0 HD3 ARG A 358 10.179 6.799 -2.651 1.00 0.00 H new ATOM 0 HE ARG A 358 8.636 9.260 -2.550 1.00 0.00 H new ATOM 0 HH11 ARG A 358 9.632 6.575 -4.614 1.00 0.00 H new ATOM 0 HH12 ARG A 358 9.471 7.509 -6.105 1.00 0.00 H new ATOM 0 HH21 ARG A 358 8.432 10.454 -4.470 1.00 0.00 H new ATOM 0 HH22 ARG A 358 8.794 9.696 -6.024 1.00 0.00 H new ATOM 214 N PHE A 359 4.096 4.708 -3.246 1.00 0.00 N ATOM 215 CA PHE A 359 3.654 3.856 -4.343 1.00 0.00 C ATOM 216 C PHE A 359 4.591 3.980 -5.541 1.00 0.00 C ATOM 217 O PHE A 359 4.830 5.078 -6.044 1.00 0.00 O ATOM 218 CB PHE A 359 2.227 4.222 -4.758 1.00 0.00 C ATOM 219 CG PHE A 359 1.840 3.689 -6.108 1.00 0.00 C ATOM 220 CD1 PHE A 359 1.739 2.325 -6.326 1.00 0.00 C ATOM 221 CD2 PHE A 359 1.577 4.554 -7.159 1.00 0.00 C ATOM 222 CE1 PHE A 359 1.382 1.832 -7.567 1.00 0.00 C ATOM 223 CE2 PHE A 359 1.220 4.066 -8.402 1.00 0.00 C ATOM 224 CZ PHE A 359 1.124 2.704 -8.607 1.00 0.00 C ATOM 0 H PHE A 359 3.341 5.180 -2.748 1.00 0.00 H new ATOM 0 HA PHE A 359 3.671 2.823 -3.996 1.00 0.00 H new ATOM 0 HB2 PHE A 359 1.531 3.839 -4.012 1.00 0.00 H new ATOM 0 HB3 PHE A 359 2.125 5.307 -4.762 1.00 0.00 H new ATOM 0 HD1 PHE A 359 1.942 1.639 -5.517 1.00 0.00 H new ATOM 0 HD2 PHE A 359 1.652 5.620 -7.005 1.00 0.00 H new ATOM 0 HE1 PHE A 359 1.305 0.766 -7.723 1.00 0.00 H new ATOM 0 HE2 PHE A 359 1.016 4.750 -9.213 1.00 0.00 H new ATOM 0 HZ PHE A 359 0.848 2.321 -9.578 1.00 0.00 H new ATOM 234 N ASP A 360 5.119 2.847 -5.991 1.00 0.00 N ATOM 235 CA ASP A 360 6.030 2.828 -7.130 1.00 0.00 C ATOM 236 C ASP A 360 5.446 2.012 -8.279 1.00 0.00 C ATOM 237 O ASP A 360 5.445 0.782 -8.243 1.00 0.00 O ATOM 238 CB ASP A 360 7.385 2.252 -6.716 1.00 0.00 C ATOM 239 CG ASP A 360 8.239 3.258 -5.971 1.00 0.00 C ATOM 240 OD1 ASP A 360 8.289 4.429 -6.403 1.00 0.00 O ATOM 241 OD2 ASP A 360 8.856 2.875 -4.955 1.00 0.00 O ATOM 0 H ASP A 360 4.932 1.930 -5.585 1.00 0.00 H new ATOM 0 HA ASP A 360 6.169 3.854 -7.471 1.00 0.00 H new ATOM 0 HB2 ASP A 360 7.227 1.377 -6.086 1.00 0.00 H new ATOM 0 HB3 ASP A 360 7.919 1.913 -7.604 1.00 0.00 H new ATOM 246 N ARG A 361 4.948 2.706 -9.297 1.00 0.00 N ATOM 247 CA ARG A 361 4.359 2.047 -10.456 1.00 0.00 C ATOM 248 C ARG A 361 5.294 0.973 -11.005 1.00 0.00 C ATOM 249 O ARG A 361 4.913 -0.191 -11.131 1.00 0.00 O ATOM 250 CB ARG A 361 4.045 3.071 -11.548 1.00 0.00 C ATOM 251 CG ARG A 361 2.657 3.679 -11.432 1.00 0.00 C ATOM 252 CD ARG A 361 1.583 2.708 -11.897 1.00 0.00 C ATOM 253 NE ARG A 361 1.640 2.478 -13.338 1.00 0.00 N ATOM 254 CZ ARG A 361 1.168 1.385 -13.927 1.00 0.00 C ATOM 255 NH1 ARG A 361 0.607 0.427 -13.202 1.00 0.00 N ATOM 256 NH2 ARG A 361 1.256 1.248 -15.244 1.00 0.00 N ATOM 0 H ARG A 361 4.941 3.725 -9.342 1.00 0.00 H new ATOM 0 HA ARG A 361 3.432 1.570 -10.138 1.00 0.00 H new ATOM 0 HB2 ARG A 361 4.786 3.869 -11.510 1.00 0.00 H new ATOM 0 HB3 ARG A 361 4.142 2.592 -12.522 1.00 0.00 H new ATOM 0 HG2 ARG A 361 2.468 3.963 -10.397 1.00 0.00 H new ATOM 0 HG3 ARG A 361 2.607 4.591 -12.027 1.00 0.00 H new ATOM 0 HD2 ARG A 361 1.701 1.759 -11.374 1.00 0.00 H new ATOM 0 HD3 ARG A 361 0.601 3.099 -11.631 1.00 0.00 H new ATOM 0 HE ARG A 361 2.066 3.196 -13.924 1.00 0.00 H new ATOM 0 HH11 ARG A 361 0.537 0.528 -12.189 1.00 0.00 H new ATOM 0 HH12 ARG A 361 0.245 -0.411 -13.657 1.00 0.00 H new ATOM 0 HH21 ARG A 361 1.687 1.983 -15.806 1.00 0.00 H new ATOM 0 HH22 ARG A 361 0.893 0.408 -15.695 1.00 0.00 H new ATOM 270 N ARG A 362 6.520 1.372 -11.329 1.00 0.00 N ATOM 271 CA ARG A 362 7.508 0.445 -11.866 1.00 0.00 C ATOM 272 C ARG A 362 7.597 -0.812 -11.006 1.00 0.00 C ATOM 273 O ARG A 362 7.998 -1.874 -11.482 1.00 0.00 O ATOM 274 CB ARG A 362 8.880 1.119 -11.945 1.00 0.00 C ATOM 275 CG ARG A 362 9.688 1.008 -10.663 1.00 0.00 C ATOM 276 CD ARG A 362 11.119 1.481 -10.864 1.00 0.00 C ATOM 277 NE ARG A 362 12.002 0.394 -11.277 1.00 0.00 N ATOM 278 CZ ARG A 362 13.319 0.520 -11.392 1.00 0.00 C ATOM 279 NH1 ARG A 362 13.903 1.681 -11.127 1.00 0.00 N ATOM 280 NH2 ARG A 362 14.056 -0.516 -11.773 1.00 0.00 N ATOM 0 H ARG A 362 6.852 2.331 -11.229 1.00 0.00 H new ATOM 0 HA ARG A 362 7.193 0.157 -12.869 1.00 0.00 H new ATOM 0 HB2 ARG A 362 9.448 0.673 -12.762 1.00 0.00 H new ATOM 0 HB3 ARG A 362 8.744 2.173 -12.189 1.00 0.00 H new ATOM 0 HG2 ARG A 362 9.214 1.601 -9.881 1.00 0.00 H new ATOM 0 HG3 ARG A 362 9.690 -0.027 -10.322 1.00 0.00 H new ATOM 0 HD2 ARG A 362 11.138 2.269 -11.617 1.00 0.00 H new ATOM 0 HD3 ARG A 362 11.490 1.917 -9.937 1.00 0.00 H new ATOM 0 HE ARG A 362 11.584 -0.512 -11.489 1.00 0.00 H new ATOM 0 HH11 ARG A 362 13.340 2.480 -10.834 1.00 0.00 H new ATOM 0 HH12 ARG A 362 14.915 1.775 -11.216 1.00 0.00 H new ATOM 0 HH21 ARG A 362 13.611 -1.411 -11.978 1.00 0.00 H new ATOM 0 HH22 ARG A 362 15.067 -0.418 -11.861 1.00 0.00 H new ATOM 294 N ALA A 363 7.220 -0.684 -9.738 1.00 0.00 N ATOM 295 CA ALA A 363 7.255 -1.810 -8.813 1.00 0.00 C ATOM 296 C ALA A 363 6.294 -2.910 -9.251 1.00 0.00 C ATOM 297 O ALA A 363 6.589 -4.097 -9.110 1.00 0.00 O ATOM 298 CB ALA A 363 6.922 -1.345 -7.403 1.00 0.00 C ATOM 0 H ALA A 363 6.887 0.188 -9.328 1.00 0.00 H new ATOM 0 HA ALA A 363 8.264 -2.222 -8.819 1.00 0.00 H new ATOM 0 HB1 ALA A 363 6.952 -2.196 -6.723 1.00 0.00 H new ATOM 0 HB2 ALA A 363 7.651 -0.600 -7.084 1.00 0.00 H new ATOM 0 HB3 ALA A 363 5.925 -0.906 -7.391 1.00 0.00 H new ATOM 304 N TYR A 364 5.144 -2.509 -9.781 1.00 0.00 N ATOM 305 CA TYR A 364 4.138 -3.461 -10.236 1.00 0.00 C ATOM 306 C TYR A 364 3.735 -3.179 -11.680 1.00 0.00 C ATOM 307 O TYR A 364 3.662 -2.031 -12.119 1.00 0.00 O ATOM 308 CB TYR A 364 2.907 -3.405 -9.331 1.00 0.00 C ATOM 309 CG TYR A 364 3.229 -3.545 -7.860 1.00 0.00 C ATOM 310 CD1 TYR A 364 3.695 -2.461 -7.126 1.00 0.00 C ATOM 311 CD2 TYR A 364 3.068 -4.759 -7.205 1.00 0.00 C ATOM 312 CE1 TYR A 364 3.992 -2.584 -5.782 1.00 0.00 C ATOM 313 CE2 TYR A 364 3.361 -4.891 -5.862 1.00 0.00 C ATOM 314 CZ TYR A 364 3.822 -3.800 -5.155 1.00 0.00 C ATOM 315 OH TYR A 364 4.116 -3.927 -3.816 1.00 0.00 O ATOM 0 H TYR A 364 4.885 -1.530 -9.906 1.00 0.00 H new ATOM 0 HA TYR A 364 4.571 -4.460 -10.187 1.00 0.00 H new ATOM 0 HB2 TYR A 364 2.391 -2.459 -9.493 1.00 0.00 H new ATOM 0 HB3 TYR A 364 2.217 -4.198 -9.620 1.00 0.00 H new ATOM 0 HD1 TYR A 364 3.827 -1.507 -7.614 1.00 0.00 H new ATOM 0 HD2 TYR A 364 2.707 -5.615 -7.756 1.00 0.00 H new ATOM 0 HE1 TYR A 364 4.355 -1.732 -5.226 1.00 0.00 H new ATOM 0 HE2 TYR A 364 3.230 -5.843 -5.368 1.00 0.00 H new ATOM 0 HH TYR A 364 3.940 -4.847 -3.528 1.00 0.00 H new ATOM 325 N PRO A 365 3.467 -4.252 -12.438 1.00 0.00 N ATOM 326 CA PRO A 365 3.065 -4.148 -13.844 1.00 0.00 C ATOM 327 C PRO A 365 1.667 -3.562 -14.006 1.00 0.00 C ATOM 328 O PRO A 365 0.897 -3.458 -13.051 1.00 0.00 O ATOM 329 CB PRO A 365 3.096 -5.599 -14.331 1.00 0.00 C ATOM 330 CG PRO A 365 2.886 -6.415 -13.103 1.00 0.00 C ATOM 331 CD PRO A 365 3.534 -5.651 -11.982 1.00 0.00 C ATOM 0 HA PRO A 365 3.719 -3.481 -14.406 1.00 0.00 H new ATOM 0 HB2 PRO A 365 2.316 -5.786 -15.069 1.00 0.00 H new ATOM 0 HB3 PRO A 365 4.048 -5.837 -14.806 1.00 0.00 H new ATOM 0 HG2 PRO A 365 1.824 -6.564 -12.911 1.00 0.00 H new ATOM 0 HG3 PRO A 365 3.332 -7.404 -13.210 1.00 0.00 H new ATOM 0 HD2 PRO A 365 3.004 -5.792 -11.040 1.00 0.00 H new ATOM 0 HD3 PRO A 365 4.563 -5.972 -11.820 1.00 0.00 H new ATOM 339 N PRO A 366 1.328 -3.169 -15.243 1.00 0.00 N ATOM 340 CA PRO A 366 0.020 -2.587 -15.558 1.00 0.00 C ATOM 341 C PRO A 366 -1.106 -3.611 -15.470 1.00 0.00 C ATOM 342 O PRO A 366 -2.279 -3.271 -15.624 1.00 0.00 O ATOM 343 CB PRO A 366 0.187 -2.099 -17.000 1.00 0.00 C ATOM 344 CG PRO A 366 1.263 -2.959 -17.568 1.00 0.00 C ATOM 345 CD PRO A 366 2.196 -3.262 -16.429 1.00 0.00 C ATOM 0 HA PRO A 366 -0.256 -1.800 -14.856 1.00 0.00 H new ATOM 0 HB2 PRO A 366 -0.741 -2.202 -17.563 1.00 0.00 H new ATOM 0 HB3 PRO A 366 0.464 -1.045 -17.032 1.00 0.00 H new ATOM 0 HG2 PRO A 366 0.849 -3.876 -17.988 1.00 0.00 H new ATOM 0 HG3 PRO A 366 1.786 -2.447 -18.375 1.00 0.00 H new ATOM 0 HD2 PRO A 366 2.640 -4.253 -16.526 1.00 0.00 H new ATOM 0 HD3 PRO A 366 3.018 -2.548 -16.382 1.00 0.00 H new ATOM 353 N GLN A 367 -0.742 -4.865 -15.220 1.00 0.00 N ATOM 354 CA GLN A 367 -1.723 -5.938 -15.111 1.00 0.00 C ATOM 355 C GLN A 367 -1.924 -6.346 -13.655 1.00 0.00 C ATOM 356 O GLN A 367 -2.786 -7.169 -13.344 1.00 0.00 O ATOM 357 CB GLN A 367 -1.281 -7.147 -15.936 1.00 0.00 C ATOM 358 CG GLN A 367 -0.046 -7.841 -15.385 1.00 0.00 C ATOM 359 CD GLN A 367 0.769 -8.527 -16.464 1.00 0.00 C ATOM 360 OE1 GLN A 367 0.720 -8.143 -17.633 1.00 0.00 O ATOM 361 NE2 GLN A 367 1.525 -9.547 -16.077 1.00 0.00 N ATOM 0 H GLN A 367 0.225 -5.162 -15.089 1.00 0.00 H new ATOM 0 HA GLN A 367 -2.672 -5.570 -15.500 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -2.100 -7.864 -15.982 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -1.081 -6.825 -16.958 1.00 0.00 H new ATOM 0 HG2 GLN A 367 0.579 -7.109 -14.873 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -0.349 -8.577 -14.641 1.00 0.00 H new ATOM 0 HE21 GLN A 367 1.535 -9.831 -15.098 1.00 0.00 H new ATOM 0 HE22 GLN A 367 2.096 -10.046 -16.759 1.00 0.00 H new ATOM 370 N ILE A 368 -1.122 -5.767 -12.767 1.00 0.00 N ATOM 371 CA ILE A 368 -1.213 -6.071 -11.345 1.00 0.00 C ATOM 372 C ILE A 368 -1.172 -4.797 -10.507 1.00 0.00 C ATOM 373 O ILE A 368 -0.469 -3.843 -10.841 1.00 0.00 O ATOM 374 CB ILE A 368 -0.074 -7.005 -10.895 1.00 0.00 C ATOM 375 CG1 ILE A 368 0.090 -8.159 -11.886 1.00 0.00 C ATOM 376 CG2 ILE A 368 -0.347 -7.537 -9.496 1.00 0.00 C ATOM 377 CD1 ILE A 368 1.285 -9.039 -11.596 1.00 0.00 C ATOM 0 H ILE A 368 -0.403 -5.085 -13.008 1.00 0.00 H new ATOM 0 HA ILE A 368 -2.167 -6.575 -11.190 1.00 0.00 H new ATOM 0 HB ILE A 368 0.855 -6.436 -10.872 1.00 0.00 H new ATOM 0 HG12 ILE A 368 -0.813 -8.770 -11.872 1.00 0.00 H new ATOM 0 HG13 ILE A 368 0.184 -7.752 -12.893 1.00 0.00 H new ATOM 0 HG21 ILE A 368 0.467 -8.196 -9.192 1.00 0.00 H new ATOM 0 HG22 ILE A 368 -0.420 -6.703 -8.797 1.00 0.00 H new ATOM 0 HG23 ILE A 368 -1.284 -8.094 -9.495 1.00 0.00 H new ATOM 0 HD11 ILE A 368 1.339 -9.836 -12.338 1.00 0.00 H new ATOM 0 HD12 ILE A 368 2.196 -8.442 -11.638 1.00 0.00 H new ATOM 0 HD13 ILE A 368 1.183 -9.475 -10.602 1.00 0.00 H new ATOM 389 N THR A 369 -1.929 -4.790 -9.414 1.00 0.00 N ATOM 390 CA THR A 369 -1.979 -3.634 -8.527 1.00 0.00 C ATOM 391 C THR A 369 -1.782 -4.048 -7.073 1.00 0.00 C ATOM 392 O THR A 369 -2.131 -5.156 -6.665 1.00 0.00 O ATOM 393 CB THR A 369 -3.318 -2.883 -8.658 1.00 0.00 C ATOM 394 OG1 THR A 369 -4.404 -3.816 -8.661 1.00 0.00 O ATOM 395 CG2 THR A 369 -3.350 -2.054 -9.933 1.00 0.00 C ATOM 0 H THR A 369 -2.516 -5.572 -9.122 1.00 0.00 H new ATOM 0 HA THR A 369 -1.168 -2.970 -8.826 1.00 0.00 H new ATOM 0 HB THR A 369 -3.419 -2.212 -7.805 1.00 0.00 H new ATOM 0 HG1 THR A 369 -4.435 -4.279 -9.524 1.00 0.00 H new ATOM 0 HG21 THR A 369 -4.305 -1.533 -10.004 1.00 0.00 H new ATOM 0 HG22 THR A 369 -2.539 -1.326 -9.914 1.00 0.00 H new ATOM 0 HG23 THR A 369 -3.229 -2.709 -10.796 1.00 0.00 H new ATOM 403 N PRO A 370 -1.209 -3.139 -6.271 1.00 0.00 N ATOM 404 CA PRO A 370 -0.953 -3.387 -4.849 1.00 0.00 C ATOM 405 C PRO A 370 -2.239 -3.444 -4.030 1.00 0.00 C ATOM 406 O PRO A 370 -2.275 -4.038 -2.953 1.00 0.00 O ATOM 407 CB PRO A 370 -0.103 -2.186 -4.427 1.00 0.00 C ATOM 408 CG PRO A 370 -0.467 -1.108 -5.388 1.00 0.00 C ATOM 409 CD PRO A 370 -0.768 -1.798 -6.690 1.00 0.00 C ATOM 0 HA PRO A 370 -0.468 -4.349 -4.684 1.00 0.00 H new ATOM 0 HB2 PRO A 370 -0.318 -1.890 -3.400 1.00 0.00 H new ATOM 0 HB3 PRO A 370 0.961 -2.417 -4.476 1.00 0.00 H new ATOM 0 HG2 PRO A 370 -1.332 -0.546 -5.035 1.00 0.00 H new ATOM 0 HG3 PRO A 370 0.350 -0.396 -5.504 1.00 0.00 H new ATOM 0 HD2 PRO A 370 -1.544 -1.277 -7.251 1.00 0.00 H new ATOM 0 HD3 PRO A 370 0.112 -1.846 -7.332 1.00 0.00 H new ATOM 417 N LYS A 371 -3.293 -2.823 -4.549 1.00 0.00 N ATOM 418 CA LYS A 371 -4.582 -2.804 -3.867 1.00 0.00 C ATOM 419 C LYS A 371 -5.275 -4.158 -3.977 1.00 0.00 C ATOM 420 O LYS A 371 -5.926 -4.610 -3.035 1.00 0.00 O ATOM 421 CB LYS A 371 -5.477 -1.711 -4.456 1.00 0.00 C ATOM 422 CG LYS A 371 -4.873 -0.320 -4.374 1.00 0.00 C ATOM 423 CD LYS A 371 -5.948 0.748 -4.251 1.00 0.00 C ATOM 424 CE LYS A 371 -6.765 0.865 -5.528 1.00 0.00 C ATOM 425 NZ LYS A 371 -5.906 1.139 -6.714 1.00 0.00 N ATOM 0 H LYS A 371 -3.280 -2.326 -5.440 1.00 0.00 H new ATOM 0 HA LYS A 371 -4.405 -2.591 -2.813 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.685 -1.947 -5.500 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -6.433 -1.714 -3.932 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.203 -0.263 -3.516 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.271 -0.131 -5.263 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.607 0.508 -3.417 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -5.484 1.708 -4.025 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -7.322 -0.058 -5.689 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.498 1.664 -5.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -6.507 1.329 -7.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -5.306 1.967 -6.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -5.305 0.312 -6.906 1.00 0.00 H new ATOM 439 N MET A 372 -5.130 -4.801 -5.131 1.00 0.00 N ATOM 440 CA MET A 372 -5.740 -6.105 -5.361 1.00 0.00 C ATOM 441 C MET A 372 -5.040 -7.185 -4.542 1.00 0.00 C ATOM 442 O MET A 372 -5.677 -8.123 -4.061 1.00 0.00 O ATOM 443 CB MET A 372 -5.687 -6.461 -6.848 1.00 0.00 C ATOM 444 CG MET A 372 -6.544 -5.558 -7.720 1.00 0.00 C ATOM 445 SD MET A 372 -6.315 -5.871 -9.481 1.00 0.00 S ATOM 446 CE MET A 372 -6.768 -7.601 -9.579 1.00 0.00 C ATOM 0 H MET A 372 -4.595 -4.440 -5.921 1.00 0.00 H new ATOM 0 HA MET A 372 -6.782 -6.052 -5.044 1.00 0.00 H new ATOM 0 HB2 MET A 372 -4.653 -6.407 -7.189 1.00 0.00 H new ATOM 0 HB3 MET A 372 -6.012 -7.493 -6.978 1.00 0.00 H new ATOM 0 HG2 MET A 372 -7.594 -5.701 -7.463 1.00 0.00 H new ATOM 0 HG3 MET A 372 -6.302 -4.517 -7.506 1.00 0.00 H new ATOM 0 HE1 MET A 372 -6.936 -7.875 -10.621 1.00 0.00 H new ATOM 0 HE2 MET A 372 -5.964 -8.212 -9.169 1.00 0.00 H new ATOM 0 HE3 MET A 372 -7.680 -7.771 -9.007 1.00 0.00 H new ATOM 456 N CYS A 373 -3.728 -7.047 -4.389 1.00 0.00 N ATOM 457 CA CYS A 373 -2.941 -8.012 -3.629 1.00 0.00 C ATOM 458 C CYS A 373 -3.437 -8.104 -2.189 1.00 0.00 C ATOM 459 O CYS A 373 -3.504 -9.190 -1.613 1.00 0.00 O ATOM 460 CB CYS A 373 -1.462 -7.624 -3.649 1.00 0.00 C ATOM 461 SG CYS A 373 -0.564 -8.212 -5.104 1.00 0.00 S ATOM 0 H CYS A 373 -3.187 -6.277 -4.781 1.00 0.00 H new ATOM 0 HA CYS A 373 -3.058 -8.989 -4.097 1.00 0.00 H new ATOM 0 HB2 CYS A 373 -1.382 -6.538 -3.600 1.00 0.00 H new ATOM 0 HB3 CYS A 373 -0.981 -8.020 -2.754 1.00 0.00 H new ATOM 0 HG CYS A 373 0.677 -7.832 -5.031 1.00 0.00 H new ATOM 467 N LEU A 374 -3.781 -6.958 -1.614 1.00 0.00 N ATOM 468 CA LEU A 374 -4.269 -6.908 -0.240 1.00 0.00 C ATOM 469 C LEU A 374 -5.558 -7.710 -0.090 1.00 0.00 C ATOM 470 O LEU A 374 -5.629 -8.647 0.705 1.00 0.00 O ATOM 471 CB LEU A 374 -4.505 -5.458 0.186 1.00 0.00 C ATOM 472 CG LEU A 374 -5.136 -5.257 1.564 1.00 0.00 C ATOM 473 CD1 LEU A 374 -4.272 -5.888 2.645 1.00 0.00 C ATOM 474 CD2 LEU A 374 -5.347 -3.776 1.844 1.00 0.00 C ATOM 0 H LEU A 374 -3.731 -6.051 -2.077 1.00 0.00 H new ATOM 0 HA LEU A 374 -3.510 -7.351 0.405 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -3.549 -4.935 0.167 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -5.144 -4.982 -0.557 1.00 0.00 H new ATOM 0 HG LEU A 374 -6.108 -5.750 1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -4.738 -5.735 3.619 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -4.173 -6.957 2.454 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.285 -5.426 2.638 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -5.797 -3.652 2.829 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -4.387 -3.260 1.816 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -6.008 -3.353 1.088 1.00 0.00 H new ATOM 486 N LEU A 375 -6.573 -7.337 -0.861 1.00 0.00 N ATOM 487 CA LEU A 375 -7.860 -8.023 -0.816 1.00 0.00 C ATOM 488 C LEU A 375 -7.680 -9.529 -0.974 1.00 0.00 C ATOM 489 O LEU A 375 -8.243 -10.314 -0.212 1.00 0.00 O ATOM 490 CB LEU A 375 -8.782 -7.490 -1.914 1.00 0.00 C ATOM 491 CG LEU A 375 -9.677 -6.312 -1.526 1.00 0.00 C ATOM 492 CD1 LEU A 375 -8.925 -5.344 -0.627 1.00 0.00 C ATOM 493 CD2 LEU A 375 -10.190 -5.600 -2.769 1.00 0.00 C ATOM 0 H LEU A 375 -6.530 -6.564 -1.525 1.00 0.00 H new ATOM 0 HA LEU A 375 -8.313 -7.830 0.156 1.00 0.00 H new ATOM 0 HB2 LEU A 375 -8.167 -7.189 -2.762 1.00 0.00 H new ATOM 0 HB3 LEU A 375 -9.418 -8.307 -2.255 1.00 0.00 H new ATOM 0 HG LEU A 375 -10.534 -6.698 -0.973 1.00 0.00 H new ATOM 0 HD11 LEU A 375 -9.578 -4.512 -0.361 1.00 0.00 H new ATOM 0 HD12 LEU A 375 -8.608 -5.860 0.279 1.00 0.00 H new ATOM 0 HD13 LEU A 375 -8.049 -4.964 -1.153 1.00 0.00 H new ATOM 0 HD21 LEU A 375 -10.825 -4.765 -2.474 1.00 0.00 H new ATOM 0 HD22 LEU A 375 -9.346 -5.227 -3.349 1.00 0.00 H new ATOM 0 HD23 LEU A 375 -10.767 -6.298 -3.376 1.00 0.00 H new ATOM 505 N GLU A 376 -6.889 -9.924 -1.967 1.00 0.00 N ATOM 506 CA GLU A 376 -6.634 -11.337 -2.223 1.00 0.00 C ATOM 507 C GLU A 376 -6.049 -12.017 -0.989 1.00 0.00 C ATOM 508 O GLU A 376 -6.154 -13.233 -0.829 1.00 0.00 O ATOM 509 CB GLU A 376 -5.680 -11.499 -3.409 1.00 0.00 C ATOM 510 CG GLU A 376 -6.314 -11.170 -4.750 1.00 0.00 C ATOM 511 CD GLU A 376 -7.311 -12.221 -5.198 1.00 0.00 C ATOM 512 OE1 GLU A 376 -6.929 -13.408 -5.268 1.00 0.00 O ATOM 513 OE2 GLU A 376 -8.472 -11.857 -5.478 1.00 0.00 O ATOM 0 H GLU A 376 -6.414 -9.287 -2.606 1.00 0.00 H new ATOM 0 HA GLU A 376 -7.585 -11.814 -2.462 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -4.814 -10.855 -3.258 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -5.314 -12.525 -3.432 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -6.815 -10.204 -4.683 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -5.532 -11.072 -5.503 1.00 0.00 H new ATOM 520 N TRP A 377 -5.432 -11.223 -0.121 1.00 0.00 N ATOM 521 CA TRP A 377 -4.830 -11.748 1.100 1.00 0.00 C ATOM 522 C TRP A 377 -5.849 -11.800 2.232 1.00 0.00 C ATOM 523 O TRP A 377 -5.754 -12.641 3.127 1.00 0.00 O ATOM 524 CB TRP A 377 -3.634 -10.888 1.513 1.00 0.00 C ATOM 525 CG TRP A 377 -3.072 -11.257 2.852 1.00 0.00 C ATOM 526 CD1 TRP A 377 -2.124 -12.205 3.111 1.00 0.00 C ATOM 527 CD2 TRP A 377 -3.425 -10.685 4.117 1.00 0.00 C ATOM 528 NE1 TRP A 377 -1.866 -12.257 4.459 1.00 0.00 N ATOM 529 CE2 TRP A 377 -2.651 -11.334 5.098 1.00 0.00 C ATOM 530 CE3 TRP A 377 -4.318 -9.687 4.515 1.00 0.00 C ATOM 531 CZ2 TRP A 377 -2.745 -11.016 6.451 1.00 0.00 C ATOM 532 CZ3 TRP A 377 -4.411 -9.373 5.858 1.00 0.00 C ATOM 533 CH2 TRP A 377 -3.628 -10.035 6.812 1.00 0.00 C ATOM 0 H TRP A 377 -5.335 -10.215 -0.240 1.00 0.00 H new ATOM 0 HA TRP A 377 -4.488 -12.763 0.899 1.00 0.00 H new ATOM 0 HB2 TRP A 377 -2.851 -10.981 0.760 1.00 0.00 H new ATOM 0 HB3 TRP A 377 -3.937 -9.841 1.530 1.00 0.00 H new ATOM 0 HD1 TRP A 377 -1.647 -12.823 2.365 1.00 0.00 H new ATOM 0 HE1 TRP A 377 -1.198 -12.882 4.911 1.00 0.00 H new ATOM 0 HE3 TRP A 377 -4.925 -9.170 3.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 377 -2.143 -11.525 7.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 377 -5.099 -8.604 6.177 1.00 0.00 H new ATOM 0 HH2 TRP A 377 -3.723 -9.766 7.854 1.00 0.00 H new ATOM 544 N CYS A 378 -6.824 -10.899 2.186 1.00 0.00 N ATOM 545 CA CYS A 378 -7.862 -10.842 3.209 1.00 0.00 C ATOM 546 C CYS A 378 -8.841 -12.002 3.055 1.00 0.00 C ATOM 547 O CYS A 378 -9.616 -12.298 3.965 1.00 0.00 O ATOM 548 CB CYS A 378 -8.612 -9.512 3.132 1.00 0.00 C ATOM 549 SG CYS A 378 -10.002 -9.515 1.976 1.00 0.00 S ATOM 0 H CYS A 378 -6.917 -10.198 1.451 1.00 0.00 H new ATOM 0 HA CYS A 378 -7.381 -10.923 4.184 1.00 0.00 H new ATOM 0 HB2 CYS A 378 -8.980 -9.257 4.126 1.00 0.00 H new ATOM 0 HB3 CYS A 378 -7.912 -8.729 2.840 1.00 0.00 H new ATOM 0 HG CYS A 378 -9.593 -9.911 0.807 1.00 0.00 H new ATOM 555 N ARG A 379 -8.801 -12.653 1.898 1.00 0.00 N ATOM 556 CA ARG A 379 -9.686 -13.778 1.623 1.00 0.00 C ATOM 557 C ARG A 379 -9.220 -15.030 2.361 1.00 0.00 C ATOM 558 O ARG A 379 -10.033 -15.793 2.884 1.00 0.00 O ATOM 559 CB ARG A 379 -9.746 -14.053 0.119 1.00 0.00 C ATOM 560 CG ARG A 379 -10.765 -13.197 -0.616 1.00 0.00 C ATOM 561 CD ARG A 379 -10.639 -13.352 -2.123 1.00 0.00 C ATOM 562 NE ARG A 379 -11.226 -14.604 -2.596 1.00 0.00 N ATOM 563 CZ ARG A 379 -10.576 -15.762 -2.607 1.00 0.00 C ATOM 564 NH1 ARG A 379 -9.325 -15.828 -2.174 1.00 0.00 N ATOM 565 NH2 ARG A 379 -11.178 -16.857 -3.052 1.00 0.00 N ATOM 0 H ARG A 379 -8.165 -12.421 1.135 1.00 0.00 H new ATOM 0 HA ARG A 379 -10.683 -13.517 1.978 1.00 0.00 H new ATOM 0 HB2 ARG A 379 -8.760 -13.881 -0.313 1.00 0.00 H new ATOM 0 HB3 ARG A 379 -9.985 -15.105 -0.040 1.00 0.00 H new ATOM 0 HG2 ARG A 379 -11.771 -13.477 -0.303 1.00 0.00 H new ATOM 0 HG3 ARG A 379 -10.627 -12.151 -0.344 1.00 0.00 H new ATOM 0 HD2 ARG A 379 -11.130 -12.513 -2.616 1.00 0.00 H new ATOM 0 HD3 ARG A 379 -9.587 -13.316 -2.404 1.00 0.00 H new ATOM 0 HE ARG A 379 -12.187 -14.587 -2.936 1.00 0.00 H new ATOM 0 HH11 ARG A 379 -8.859 -14.988 -1.831 1.00 0.00 H new ATOM 0 HH12 ARG A 379 -8.828 -16.719 -2.184 1.00 0.00 H new ATOM 0 HH21 ARG A 379 -12.141 -16.810 -3.386 1.00 0.00 H new ATOM 0 HH22 ARG A 379 -10.678 -17.746 -3.060 1.00 0.00 H new ATOM 579 N ARG A 380 -7.907 -15.234 2.399 1.00 0.00 N ATOM 580 CA ARG A 380 -7.333 -16.393 3.071 1.00 0.00 C ATOM 581 C ARG A 380 -7.388 -16.225 4.587 1.00 0.00 C ATOM 582 O ARG A 380 -7.688 -17.171 5.315 1.00 0.00 O ATOM 583 CB ARG A 380 -5.886 -16.604 2.623 1.00 0.00 C ATOM 584 CG ARG A 380 -4.881 -15.764 3.393 1.00 0.00 C ATOM 585 CD ARG A 380 -3.451 -16.127 3.025 1.00 0.00 C ATOM 586 NE ARG A 380 -3.144 -17.522 3.332 1.00 0.00 N ATOM 587 CZ ARG A 380 -3.397 -18.530 2.505 1.00 0.00 C ATOM 588 NH1 ARG A 380 -3.957 -18.299 1.325 1.00 0.00 N ATOM 589 NH2 ARG A 380 -3.088 -19.771 2.857 1.00 0.00 N ATOM 0 H ARG A 380 -7.221 -14.611 1.972 1.00 0.00 H new ATOM 0 HA ARG A 380 -7.922 -17.269 2.798 1.00 0.00 H new ATOM 0 HB2 ARG A 380 -5.629 -17.657 2.737 1.00 0.00 H new ATOM 0 HB3 ARG A 380 -5.805 -16.369 1.562 1.00 0.00 H new ATOM 0 HG2 ARG A 380 -5.054 -14.708 3.186 1.00 0.00 H new ATOM 0 HG3 ARG A 380 -5.030 -15.908 4.463 1.00 0.00 H new ATOM 0 HD2 ARG A 380 -3.293 -15.947 1.962 1.00 0.00 H new ATOM 0 HD3 ARG A 380 -2.762 -15.477 3.564 1.00 0.00 H new ATOM 0 HE ARG A 380 -2.711 -17.733 4.231 1.00 0.00 H new ATOM 0 HH11 ARG A 380 -4.194 -17.346 1.051 1.00 0.00 H new ATOM 0 HH12 ARG A 380 -4.150 -19.075 0.692 1.00 0.00 H new ATOM 0 HH21 ARG A 380 -2.656 -19.951 3.763 1.00 0.00 H new ATOM 0 HH22 ARG A 380 -3.283 -20.545 2.222 1.00 0.00 H new ATOM 603 N GLU A 381 -7.097 -15.016 5.054 1.00 0.00 N ATOM 604 CA GLU A 381 -7.112 -14.725 6.483 1.00 0.00 C ATOM 605 C GLU A 381 -8.534 -14.459 6.969 1.00 0.00 C ATOM 606 O GLU A 381 -8.740 -13.936 8.064 1.00 0.00 O ATOM 607 CB GLU A 381 -6.222 -13.519 6.791 1.00 0.00 C ATOM 608 CG GLU A 381 -4.739 -13.850 6.827 1.00 0.00 C ATOM 609 CD GLU A 381 -4.356 -14.677 8.039 1.00 0.00 C ATOM 610 OE1 GLU A 381 -4.430 -14.147 9.167 1.00 0.00 O ATOM 611 OE2 GLU A 381 -3.981 -15.854 7.859 1.00 0.00 O ATOM 0 H GLU A 381 -6.848 -14.222 4.464 1.00 0.00 H new ATOM 0 HA GLU A 381 -6.724 -15.597 7.009 1.00 0.00 H new ATOM 0 HB2 GLU A 381 -6.396 -12.749 6.040 1.00 0.00 H new ATOM 0 HB3 GLU A 381 -6.515 -13.098 7.753 1.00 0.00 H new ATOM 0 HG2 GLU A 381 -4.470 -14.393 5.921 1.00 0.00 H new ATOM 0 HG3 GLU A 381 -4.164 -12.924 6.827 1.00 0.00 H new ATOM 618 N LYS A 382 -9.512 -14.824 6.147 1.00 0.00 N ATOM 619 CA LYS A 382 -10.915 -14.626 6.491 1.00 0.00 C ATOM 620 C LYS A 382 -11.144 -13.230 7.060 1.00 0.00 C ATOM 621 O LYS A 382 -12.082 -13.007 7.827 1.00 0.00 O ATOM 622 CB LYS A 382 -11.367 -15.682 7.502 1.00 0.00 C ATOM 623 CG LYS A 382 -11.457 -17.082 6.921 1.00 0.00 C ATOM 624 CD LYS A 382 -12.513 -17.913 7.630 1.00 0.00 C ATOM 625 CE LYS A 382 -13.886 -17.721 7.005 1.00 0.00 C ATOM 626 NZ LYS A 382 -14.958 -18.367 7.812 1.00 0.00 N ATOM 0 H LYS A 382 -9.359 -15.259 5.237 1.00 0.00 H new ATOM 0 HA LYS A 382 -11.505 -14.728 5.580 1.00 0.00 H new ATOM 0 HB2 LYS A 382 -10.672 -15.690 8.341 1.00 0.00 H new ATOM 0 HB3 LYS A 382 -12.342 -15.399 7.899 1.00 0.00 H new ATOM 0 HG2 LYS A 382 -11.693 -17.022 5.859 1.00 0.00 H new ATOM 0 HG3 LYS A 382 -10.488 -17.575 7.005 1.00 0.00 H new ATOM 0 HD2 LYS A 382 -12.237 -18.967 7.588 1.00 0.00 H new ATOM 0 HD3 LYS A 382 -12.550 -17.635 8.683 1.00 0.00 H new ATOM 0 HE2 LYS A 382 -14.096 -16.656 6.909 1.00 0.00 H new ATOM 0 HE3 LYS A 382 -13.888 -18.138 5.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 -15.878 -18.214 7.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 -14.772 -19.388 7.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 -14.973 -17.951 8.765 1.00 0.00 H new ATOM 640 N LEU A 383 -10.283 -12.292 6.680 1.00 0.00 N ATOM 641 CA LEU A 383 -10.393 -10.916 7.152 1.00 0.00 C ATOM 642 C LEU A 383 -11.363 -10.119 6.287 1.00 0.00 C ATOM 643 O LEU A 383 -11.444 -10.302 5.072 1.00 0.00 O ATOM 644 CB LEU A 383 -9.019 -10.244 7.149 1.00 0.00 C ATOM 645 CG LEU A 383 -8.055 -10.680 8.253 1.00 0.00 C ATOM 646 CD1 LEU A 383 -6.678 -10.076 8.029 1.00 0.00 C ATOM 647 CD2 LEU A 383 -8.597 -10.286 9.620 1.00 0.00 C ATOM 0 H LEU A 383 -9.501 -12.459 6.047 1.00 0.00 H new ATOM 0 HA LEU A 383 -10.778 -10.938 8.171 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -8.546 -10.434 6.186 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -9.164 -9.166 7.226 1.00 0.00 H new ATOM 0 HG LEU A 383 -7.962 -11.766 8.220 1.00 0.00 H new ATOM 0 HD11 LEU A 383 -6.006 -10.398 8.825 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -6.287 -10.408 7.067 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -6.752 -8.989 8.034 1.00 0.00 H new ATOM 0 HD21 LEU A 383 -7.898 -10.604 10.394 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -8.720 -9.204 9.665 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -9.561 -10.768 9.782 1.00 0.00 H new ATOM 659 N PRO A 384 -12.118 -9.212 6.924 1.00 0.00 N ATOM 660 CA PRO A 384 -13.095 -8.367 6.232 1.00 0.00 C ATOM 661 C PRO A 384 -12.430 -7.328 5.335 1.00 0.00 C ATOM 662 O PRO A 384 -11.442 -6.705 5.720 1.00 0.00 O ATOM 663 CB PRO A 384 -13.847 -7.683 7.376 1.00 0.00 C ATOM 664 CG PRO A 384 -12.886 -7.683 8.514 1.00 0.00 C ATOM 665 CD PRO A 384 -12.074 -8.941 8.371 1.00 0.00 C ATOM 0 HA PRO A 384 -13.737 -8.946 5.569 1.00 0.00 H new ATOM 0 HB2 PRO A 384 -14.141 -6.669 7.106 1.00 0.00 H new ATOM 0 HB3 PRO A 384 -14.760 -8.223 7.628 1.00 0.00 H new ATOM 0 HG2 PRO A 384 -12.247 -6.801 8.485 1.00 0.00 H new ATOM 0 HG3 PRO A 384 -13.412 -7.664 9.469 1.00 0.00 H new ATOM 0 HD2 PRO A 384 -11.052 -8.802 8.723 1.00 0.00 H new ATOM 0 HD3 PRO A 384 -12.500 -9.762 8.947 1.00 0.00 H new ATOM 673 N GLN A 385 -12.979 -7.148 4.138 1.00 0.00 N ATOM 674 CA GLN A 385 -12.438 -6.184 3.187 1.00 0.00 C ATOM 675 C GLN A 385 -12.036 -4.892 3.891 1.00 0.00 C ATOM 676 O GLN A 385 -12.724 -4.405 4.788 1.00 0.00 O ATOM 677 CB GLN A 385 -13.464 -5.884 2.093 1.00 0.00 C ATOM 678 CG GLN A 385 -12.839 -5.472 0.770 1.00 0.00 C ATOM 679 CD GLN A 385 -13.848 -5.418 -0.361 1.00 0.00 C ATOM 680 OE1 GLN A 385 -14.089 -6.415 -1.041 1.00 0.00 O ATOM 681 NE2 GLN A 385 -14.444 -4.249 -0.567 1.00 0.00 N ATOM 0 H GLN A 385 -13.798 -7.657 3.804 1.00 0.00 H new ATOM 0 HA GLN A 385 -11.549 -6.621 2.732 1.00 0.00 H new ATOM 0 HB2 GLN A 385 -14.082 -6.768 1.934 1.00 0.00 H new ATOM 0 HB3 GLN A 385 -14.126 -5.089 2.436 1.00 0.00 H new ATOM 0 HG2 GLN A 385 -12.372 -4.493 0.882 1.00 0.00 H new ATOM 0 HG3 GLN A 385 -12.047 -6.175 0.512 1.00 0.00 H new ATOM 0 HE21 GLN A 385 -14.213 -3.448 0.021 1.00 0.00 H new ATOM 0 HE22 GLN A 385 -15.132 -4.152 -1.314 1.00 0.00 H new ATOM 690 N PRO A 386 -10.895 -4.322 3.476 1.00 0.00 N ATOM 691 CA PRO A 386 -10.376 -3.079 4.053 1.00 0.00 C ATOM 692 C PRO A 386 -11.228 -1.869 3.686 1.00 0.00 C ATOM 693 O PRO A 386 -12.240 -1.996 2.997 1.00 0.00 O ATOM 694 CB PRO A 386 -8.980 -2.956 3.436 1.00 0.00 C ATOM 695 CG PRO A 386 -9.064 -3.718 2.158 1.00 0.00 C ATOM 696 CD PRO A 386 -10.024 -4.847 2.411 1.00 0.00 C ATOM 0 HA PRO A 386 -10.375 -3.106 5.143 1.00 0.00 H new ATOM 0 HB2 PRO A 386 -8.716 -1.913 3.259 1.00 0.00 H new ATOM 0 HB3 PRO A 386 -8.217 -3.371 4.095 1.00 0.00 H new ATOM 0 HG2 PRO A 386 -9.416 -3.081 1.346 1.00 0.00 H new ATOM 0 HG3 PRO A 386 -8.085 -4.097 1.864 1.00 0.00 H new ATOM 0 HD2 PRO A 386 -10.592 -5.100 1.516 1.00 0.00 H new ATOM 0 HD3 PRO A 386 -9.505 -5.753 2.726 1.00 0.00 H new ATOM 704 N VAL A 387 -10.813 -0.695 4.151 1.00 0.00 N ATOM 705 CA VAL A 387 -11.538 0.539 3.871 1.00 0.00 C ATOM 706 C VAL A 387 -10.579 1.676 3.537 1.00 0.00 C ATOM 707 O VAL A 387 -9.871 2.181 4.408 1.00 0.00 O ATOM 708 CB VAL A 387 -12.417 0.957 5.064 1.00 0.00 C ATOM 709 CG1 VAL A 387 -13.128 2.269 4.770 1.00 0.00 C ATOM 710 CG2 VAL A 387 -13.418 -0.138 5.397 1.00 0.00 C ATOM 0 H VAL A 387 -9.978 -0.572 4.724 1.00 0.00 H new ATOM 0 HA VAL A 387 -12.177 0.342 3.010 1.00 0.00 H new ATOM 0 HB VAL A 387 -11.774 1.106 5.932 1.00 0.00 H new ATOM 0 HG11 VAL A 387 -13.744 2.548 5.625 1.00 0.00 H new ATOM 0 HG12 VAL A 387 -12.390 3.049 4.585 1.00 0.00 H new ATOM 0 HG13 VAL A 387 -13.760 2.151 3.890 1.00 0.00 H new ATOM 0 HG21 VAL A 387 -14.031 0.174 6.243 1.00 0.00 H new ATOM 0 HG22 VAL A 387 -14.057 -0.321 4.533 1.00 0.00 H new ATOM 0 HG23 VAL A 387 -12.884 -1.053 5.654 1.00 0.00 H new ATOM 720 N TYR A 388 -10.561 2.075 2.270 1.00 0.00 N ATOM 721 CA TYR A 388 -9.687 3.152 1.819 1.00 0.00 C ATOM 722 C TYR A 388 -10.319 4.514 2.088 1.00 0.00 C ATOM 723 O TYR A 388 -11.513 4.711 1.864 1.00 0.00 O ATOM 724 CB TYR A 388 -9.386 3.002 0.327 1.00 0.00 C ATOM 725 CG TYR A 388 -8.330 1.964 0.024 1.00 0.00 C ATOM 726 CD1 TYR A 388 -8.304 0.752 0.703 1.00 0.00 C ATOM 727 CD2 TYR A 388 -7.358 2.194 -0.941 1.00 0.00 C ATOM 728 CE1 TYR A 388 -7.340 -0.200 0.430 1.00 0.00 C ATOM 729 CE2 TYR A 388 -6.391 1.248 -1.222 1.00 0.00 C ATOM 730 CZ TYR A 388 -6.387 0.053 -0.534 1.00 0.00 C ATOM 731 OH TYR A 388 -5.425 -0.892 -0.810 1.00 0.00 O ATOM 0 H TYR A 388 -11.142 1.669 1.537 1.00 0.00 H new ATOM 0 HA TYR A 388 -8.754 3.088 2.379 1.00 0.00 H new ATOM 0 HB2 TYR A 388 -10.305 2.736 -0.196 1.00 0.00 H new ATOM 0 HB3 TYR A 388 -9.061 3.965 -0.068 1.00 0.00 H new ATOM 0 HD1 TYR A 388 -9.050 0.550 1.457 1.00 0.00 H new ATOM 0 HD2 TYR A 388 -7.358 3.129 -1.481 1.00 0.00 H new ATOM 0 HE1 TYR A 388 -7.333 -1.136 0.968 1.00 0.00 H new ATOM 0 HE2 TYR A 388 -5.643 1.443 -1.976 1.00 0.00 H new ATOM 0 HH TYR A 388 -5.020 -1.201 0.027 1.00 0.00 H new ATOM 741 N GLU A 389 -9.508 5.451 2.569 1.00 0.00 N ATOM 742 CA GLU A 389 -9.987 6.795 2.869 1.00 0.00 C ATOM 743 C GLU A 389 -8.940 7.841 2.496 1.00 0.00 C ATOM 744 O GLU A 389 -7.883 7.929 3.121 1.00 0.00 O ATOM 745 CB GLU A 389 -10.339 6.916 4.353 1.00 0.00 C ATOM 746 CG GLU A 389 -11.769 6.516 4.673 1.00 0.00 C ATOM 747 CD GLU A 389 -12.017 6.380 6.163 1.00 0.00 C ATOM 748 OE1 GLU A 389 -11.474 7.200 6.933 1.00 0.00 O ATOM 749 OE2 GLU A 389 -12.754 5.453 6.559 1.00 0.00 O ATOM 0 H GLU A 389 -8.517 5.304 2.759 1.00 0.00 H new ATOM 0 HA GLU A 389 -10.883 6.975 2.275 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -9.658 6.292 4.932 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -10.178 7.945 4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -12.451 7.260 4.261 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -11.996 5.569 4.183 1.00 0.00 H new ATOM 756 N THR A 390 -9.242 8.633 1.472 1.00 0.00 N ATOM 757 CA THR A 390 -8.329 9.672 1.014 1.00 0.00 C ATOM 758 C THR A 390 -8.860 11.060 1.354 1.00 0.00 C ATOM 759 O THR A 390 -9.979 11.416 0.984 1.00 0.00 O ATOM 760 CB THR A 390 -8.093 9.583 -0.506 1.00 0.00 C ATOM 761 OG1 THR A 390 -8.183 8.220 -0.936 1.00 0.00 O ATOM 762 CG2 THR A 390 -6.730 10.148 -0.876 1.00 0.00 C ATOM 0 H THR A 390 -10.113 8.574 0.944 1.00 0.00 H new ATOM 0 HA THR A 390 -7.383 9.511 1.531 1.00 0.00 H new ATOM 0 HB THR A 390 -8.861 10.173 -1.006 1.00 0.00 H new ATOM 0 HG1 THR A 390 -7.585 7.665 -0.393 1.00 0.00 H new ATOM 0 HG21 THR A 390 -6.586 10.074 -1.954 1.00 0.00 H new ATOM 0 HG22 THR A 390 -6.675 11.194 -0.573 1.00 0.00 H new ATOM 0 HG23 THR A 390 -5.951 9.581 -0.366 1.00 0.00 H new ATOM 770 N VAL A 391 -8.049 11.843 2.059 1.00 0.00 N ATOM 771 CA VAL A 391 -8.437 13.193 2.448 1.00 0.00 C ATOM 772 C VAL A 391 -7.542 14.234 1.785 1.00 0.00 C ATOM 773 O VAL A 391 -6.501 13.901 1.219 1.00 0.00 O ATOM 774 CB VAL A 391 -8.375 13.378 3.975 1.00 0.00 C ATOM 775 CG1 VAL A 391 -9.231 12.332 4.675 1.00 0.00 C ATOM 776 CG2 VAL A 391 -6.935 13.313 4.462 1.00 0.00 C ATOM 0 H VAL A 391 -7.119 11.565 2.372 1.00 0.00 H new ATOM 0 HA VAL A 391 -9.465 13.335 2.114 1.00 0.00 H new ATOM 0 HB VAL A 391 -8.773 14.363 4.220 1.00 0.00 H new ATOM 0 HG11 VAL A 391 -9.175 12.478 5.754 1.00 0.00 H new ATOM 0 HG12 VAL A 391 -10.266 12.431 4.349 1.00 0.00 H new ATOM 0 HG13 VAL A 391 -8.866 11.336 4.425 1.00 0.00 H new ATOM 0 HG21 VAL A 391 -6.910 13.446 5.544 1.00 0.00 H new ATOM 0 HG22 VAL A 391 -6.508 12.344 4.206 1.00 0.00 H new ATOM 0 HG23 VAL A 391 -6.354 14.103 3.986 1.00 0.00 H new ATOM 786 N GLN A 392 -7.954 15.495 1.859 1.00 0.00 N ATOM 787 CA GLN A 392 -7.189 16.585 1.266 1.00 0.00 C ATOM 788 C GLN A 392 -6.782 17.605 2.325 1.00 0.00 C ATOM 789 O GLN A 392 -7.632 18.200 2.986 1.00 0.00 O ATOM 790 CB GLN A 392 -8.004 17.271 0.168 1.00 0.00 C ATOM 791 CG GLN A 392 -7.215 18.301 -0.623 1.00 0.00 C ATOM 792 CD GLN A 392 -8.093 19.137 -1.533 1.00 0.00 C ATOM 793 OE1 GLN A 392 -9.318 19.128 -1.411 1.00 0.00 O ATOM 794 NE2 GLN A 392 -7.470 19.866 -2.451 1.00 0.00 N ATOM 0 H GLN A 392 -8.814 15.787 2.324 1.00 0.00 H new ATOM 0 HA GLN A 392 -6.285 16.163 0.828 1.00 0.00 H new ATOM 0 HB2 GLN A 392 -8.385 16.513 -0.517 1.00 0.00 H new ATOM 0 HB3 GLN A 392 -8.869 17.757 0.619 1.00 0.00 H new ATOM 0 HG2 GLN A 392 -6.686 18.957 0.068 1.00 0.00 H new ATOM 0 HG3 GLN A 392 -6.459 17.793 -1.221 1.00 0.00 H new ATOM 0 HE21 GLN A 392 -6.452 19.843 -2.516 1.00 0.00 H new ATOM 0 HE22 GLN A 392 -8.009 20.449 -3.091 1.00 0.00 H new ATOM 803 N ARG A 393 -5.477 17.800 2.481 1.00 0.00 N ATOM 804 CA ARG A 393 -4.957 18.746 3.461 1.00 0.00 C ATOM 805 C ARG A 393 -5.041 20.176 2.933 1.00 0.00 C ATOM 806 O ARG A 393 -5.464 20.408 1.800 1.00 0.00 O ATOM 807 CB ARG A 393 -3.508 18.405 3.812 1.00 0.00 C ATOM 808 CG ARG A 393 -2.568 18.434 2.618 1.00 0.00 C ATOM 809 CD ARG A 393 -1.290 17.658 2.896 1.00 0.00 C ATOM 810 NE ARG A 393 -0.742 17.960 4.215 1.00 0.00 N ATOM 811 CZ ARG A 393 0.523 17.738 4.554 1.00 0.00 C ATOM 812 NH1 ARG A 393 1.366 17.215 3.675 1.00 0.00 N ATOM 813 NH2 ARG A 393 0.947 18.040 5.775 1.00 0.00 N ATOM 0 H ARG A 393 -4.760 17.315 1.941 1.00 0.00 H new ATOM 0 HA ARG A 393 -5.568 18.672 4.361 1.00 0.00 H new ATOM 0 HB2 ARG A 393 -3.150 19.109 4.563 1.00 0.00 H new ATOM 0 HB3 ARG A 393 -3.476 17.414 4.264 1.00 0.00 H new ATOM 0 HG2 ARG A 393 -3.070 18.011 1.748 1.00 0.00 H new ATOM 0 HG3 ARG A 393 -2.322 19.467 2.373 1.00 0.00 H new ATOM 0 HD2 ARG A 393 -1.492 16.589 2.823 1.00 0.00 H new ATOM 0 HD3 ARG A 393 -0.549 17.895 2.133 1.00 0.00 H new ATOM 0 HE ARG A 393 -1.365 18.364 4.915 1.00 0.00 H new ATOM 0 HH11 ARG A 393 1.044 16.982 2.736 1.00 0.00 H new ATOM 0 HH12 ARG A 393 2.337 17.046 3.938 1.00 0.00 H new ATOM 0 HH21 ARG A 393 0.301 18.443 6.454 1.00 0.00 H new ATOM 0 HH22 ARG A 393 1.919 17.869 6.034 1.00 0.00 H new ATOM 827 N THR A 394 -4.635 21.132 3.763 1.00 0.00 N ATOM 828 CA THR A 394 -4.665 22.538 3.382 1.00 0.00 C ATOM 829 C THR A 394 -3.257 23.114 3.292 1.00 0.00 C ATOM 830 O THR A 394 -3.028 24.117 2.616 1.00 0.00 O ATOM 831 CB THR A 394 -5.486 23.374 4.383 1.00 0.00 C ATOM 832 OG1 THR A 394 -6.695 22.685 4.720 1.00 0.00 O ATOM 833 CG2 THR A 394 -5.818 24.740 3.803 1.00 0.00 C ATOM 0 H THR A 394 -4.281 20.957 4.704 1.00 0.00 H new ATOM 0 HA THR A 394 -5.139 22.589 2.402 1.00 0.00 H new ATOM 0 HB THR A 394 -4.887 23.516 5.282 1.00 0.00 H new ATOM 0 HG1 THR A 394 -7.210 23.222 5.358 1.00 0.00 H new ATOM 0 HG21 THR A 394 -6.398 25.312 4.528 1.00 0.00 H new ATOM 0 HG22 THR A 394 -4.895 25.273 3.575 1.00 0.00 H new ATOM 0 HG23 THR A 394 -6.400 24.616 2.890 1.00 0.00 H new ATOM 841 N ILE A 395 -2.315 22.472 3.976 1.00 0.00 N ATOM 842 CA ILE A 395 -0.928 22.920 3.971 1.00 0.00 C ATOM 843 C ILE A 395 -0.278 22.678 2.613 1.00 0.00 C ATOM 844 O ILE A 395 0.320 23.583 2.029 1.00 0.00 O ATOM 845 CB ILE A 395 -0.102 22.208 5.058 1.00 0.00 C ATOM 846 CG1 ILE A 395 1.344 22.709 5.041 1.00 0.00 C ATOM 847 CG2 ILE A 395 -0.149 20.701 4.855 1.00 0.00 C ATOM 848 CD1 ILE A 395 1.561 23.956 5.869 1.00 0.00 C ATOM 0 H ILE A 395 -2.488 21.640 4.540 1.00 0.00 H new ATOM 0 HA ILE A 395 -0.941 23.990 4.180 1.00 0.00 H new ATOM 0 HB ILE A 395 -0.534 22.438 6.032 1.00 0.00 H new ATOM 0 HG12 ILE A 395 1.998 21.919 5.410 1.00 0.00 H new ATOM 0 HG13 ILE A 395 1.638 22.911 4.011 1.00 0.00 H new ATOM 0 HG21 ILE A 395 0.439 20.211 5.631 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -1.182 20.358 4.912 1.00 0.00 H new ATOM 0 HG23 ILE A 395 0.262 20.453 3.877 1.00 0.00 H new ATOM 0 HD11 ILE A 395 2.608 24.254 5.811 1.00 0.00 H new ATOM 0 HD12 ILE A 395 0.933 24.761 5.486 1.00 0.00 H new ATOM 0 HD13 ILE A 395 1.299 23.753 6.907 1.00 0.00 H new ATOM 860 N ASP A 396 -0.400 21.453 2.115 1.00 0.00 N ATOM 861 CA ASP A 396 0.174 21.092 0.824 1.00 0.00 C ATOM 862 C ASP A 396 -0.908 20.601 -0.133 1.00 0.00 C ATOM 863 O ASP A 396 -0.610 20.009 -1.171 1.00 0.00 O ATOM 864 CB ASP A 396 1.243 20.013 1.001 1.00 0.00 C ATOM 865 CG ASP A 396 2.272 20.028 -0.113 1.00 0.00 C ATOM 866 OD1 ASP A 396 2.857 21.103 -0.366 1.00 0.00 O ATOM 867 OD2 ASP A 396 2.492 18.966 -0.732 1.00 0.00 O ATOM 0 H ASP A 396 -0.891 20.693 2.586 1.00 0.00 H new ATOM 0 HA ASP A 396 0.635 21.983 0.397 1.00 0.00 H new ATOM 0 HB2 ASP A 396 1.745 20.157 1.958 1.00 0.00 H new ATOM 0 HB3 ASP A 396 0.765 19.034 1.036 1.00 0.00 H new ATOM 872 N ARG A 397 -2.163 20.851 0.223 1.00 0.00 N ATOM 873 CA ARG A 397 -3.290 20.433 -0.603 1.00 0.00 C ATOM 874 C ARG A 397 -3.005 19.091 -1.272 1.00 0.00 C ATOM 875 O ARG A 397 -3.477 18.824 -2.377 1.00 0.00 O ATOM 876 CB ARG A 397 -3.590 21.491 -1.667 1.00 0.00 C ATOM 877 CG ARG A 397 -3.802 22.884 -1.097 1.00 0.00 C ATOM 878 CD ARG A 397 -5.249 23.103 -0.684 1.00 0.00 C ATOM 879 NE ARG A 397 -6.125 23.289 -1.837 1.00 0.00 N ATOM 880 CZ ARG A 397 -7.365 23.758 -1.750 1.00 0.00 C ATOM 881 NH1 ARG A 397 -7.871 24.088 -0.570 1.00 0.00 N ATOM 882 NH2 ARG A 397 -8.100 23.899 -2.845 1.00 0.00 N ATOM 0 H ARG A 397 -2.426 21.341 1.078 1.00 0.00 H new ATOM 0 HA ARG A 397 -4.160 20.320 0.044 1.00 0.00 H new ATOM 0 HB2 ARG A 397 -2.766 21.521 -2.380 1.00 0.00 H new ATOM 0 HB3 ARG A 397 -4.481 21.195 -2.221 1.00 0.00 H new ATOM 0 HG2 ARG A 397 -3.151 23.029 -0.235 1.00 0.00 H new ATOM 0 HG3 ARG A 397 -3.518 23.629 -1.840 1.00 0.00 H new ATOM 0 HD2 ARG A 397 -5.593 22.248 -0.102 1.00 0.00 H new ATOM 0 HD3 ARG A 397 -5.313 23.977 -0.036 1.00 0.00 H new ATOM 0 HE ARG A 397 -5.765 23.046 -2.760 1.00 0.00 H new ATOM 0 HH11 ARG A 397 -7.308 23.982 0.274 1.00 0.00 H new ATOM 0 HH12 ARG A 397 -8.823 24.448 -0.506 1.00 0.00 H new ATOM 0 HH21 ARG A 397 -7.713 23.647 -3.755 1.00 0.00 H new ATOM 0 HH22 ARG A 397 -9.052 24.259 -2.777 1.00 0.00 H new ATOM 896 N MET A 398 -2.230 18.251 -0.594 1.00 0.00 N ATOM 897 CA MET A 398 -1.883 16.936 -1.122 1.00 0.00 C ATOM 898 C MET A 398 -2.919 15.895 -0.713 1.00 0.00 C ATOM 899 O MET A 398 -3.714 16.121 0.200 1.00 0.00 O ATOM 900 CB MET A 398 -0.497 16.515 -0.629 1.00 0.00 C ATOM 901 CG MET A 398 0.244 15.610 -1.601 1.00 0.00 C ATOM 902 SD MET A 398 0.544 16.400 -3.194 1.00 0.00 S ATOM 903 CE MET A 398 2.244 15.924 -3.493 1.00 0.00 C ATOM 0 H MET A 398 -1.830 18.457 0.322 1.00 0.00 H new ATOM 0 HA MET A 398 -1.870 17.001 -2.210 1.00 0.00 H new ATOM 0 HB2 MET A 398 0.102 17.408 -0.447 1.00 0.00 H new ATOM 0 HB3 MET A 398 -0.601 16.001 0.327 1.00 0.00 H new ATOM 0 HG2 MET A 398 1.196 15.314 -1.162 1.00 0.00 H new ATOM 0 HG3 MET A 398 -0.333 14.698 -1.755 1.00 0.00 H new ATOM 0 HE1 MET A 398 2.565 16.308 -4.461 1.00 0.00 H new ATOM 0 HE2 MET A 398 2.880 16.337 -2.710 1.00 0.00 H new ATOM 0 HE3 MET A 398 2.323 14.837 -3.490 1.00 0.00 H new ATOM 913 N PHE A 399 -2.906 14.754 -1.394 1.00 0.00 N ATOM 914 CA PHE A 399 -3.846 13.678 -1.102 1.00 0.00 C ATOM 915 C PHE A 399 -3.146 12.522 -0.394 1.00 0.00 C ATOM 916 O PHE A 399 -1.999 12.195 -0.700 1.00 0.00 O ATOM 917 CB PHE A 399 -4.501 13.180 -2.392 1.00 0.00 C ATOM 918 CG PHE A 399 -5.378 14.205 -3.053 1.00 0.00 C ATOM 919 CD1 PHE A 399 -6.571 14.596 -2.468 1.00 0.00 C ATOM 920 CD2 PHE A 399 -5.009 14.776 -4.260 1.00 0.00 C ATOM 921 CE1 PHE A 399 -7.380 15.539 -3.074 1.00 0.00 C ATOM 922 CE2 PHE A 399 -5.813 15.720 -4.871 1.00 0.00 C ATOM 923 CZ PHE A 399 -7.001 16.100 -4.278 1.00 0.00 C ATOM 0 H PHE A 399 -2.255 14.551 -2.152 1.00 0.00 H new ATOM 0 HA PHE A 399 -4.617 14.072 -0.440 1.00 0.00 H new ATOM 0 HB2 PHE A 399 -3.722 12.874 -3.091 1.00 0.00 H new ATOM 0 HB3 PHE A 399 -5.095 12.294 -2.170 1.00 0.00 H new ATOM 0 HD1 PHE A 399 -6.873 14.159 -1.528 1.00 0.00 H new ATOM 0 HD2 PHE A 399 -4.082 14.480 -4.729 1.00 0.00 H new ATOM 0 HE1 PHE A 399 -8.307 15.837 -2.607 1.00 0.00 H new ATOM 0 HE2 PHE A 399 -5.513 16.160 -5.811 1.00 0.00 H new ATOM 0 HZ PHE A 399 -7.633 16.835 -4.755 1.00 0.00 H new ATOM 933 N CYS A 400 -3.845 11.907 0.554 1.00 0.00 N ATOM 934 CA CYS A 400 -3.291 10.787 1.307 1.00 0.00 C ATOM 935 C CYS A 400 -4.384 9.793 1.686 1.00 0.00 C ATOM 936 O CYS A 400 -5.388 10.161 2.297 1.00 0.00 O ATOM 937 CB CYS A 400 -2.585 11.292 2.567 1.00 0.00 C ATOM 938 SG CYS A 400 -3.702 11.969 3.817 1.00 0.00 S ATOM 0 H CYS A 400 -4.796 12.165 0.819 1.00 0.00 H new ATOM 0 HA CYS A 400 -2.566 10.278 0.672 1.00 0.00 H new ATOM 0 HB2 CYS A 400 -2.019 10.471 3.007 1.00 0.00 H new ATOM 0 HB3 CYS A 400 -1.865 12.060 2.284 1.00 0.00 H new ATOM 0 HG CYS A 400 -3.607 13.265 3.827 1.00 0.00 H new ATOM 944 N SER A 401 -4.183 8.532 1.318 1.00 0.00 N ATOM 945 CA SER A 401 -5.154 7.485 1.615 1.00 0.00 C ATOM 946 C SER A 401 -4.768 6.729 2.883 1.00 0.00 C ATOM 947 O SER A 401 -3.598 6.686 3.261 1.00 0.00 O ATOM 948 CB SER A 401 -5.261 6.511 0.440 1.00 0.00 C ATOM 949 OG SER A 401 -6.469 5.774 0.497 1.00 0.00 O ATOM 0 H SER A 401 -3.357 8.210 0.814 1.00 0.00 H new ATOM 0 HA SER A 401 -6.123 7.958 1.776 1.00 0.00 H new ATOM 0 HB2 SER A 401 -5.212 7.062 -0.499 1.00 0.00 H new ATOM 0 HB3 SER A 401 -4.413 5.826 0.453 1.00 0.00 H new ATOM 0 HG SER A 401 -6.335 4.893 0.088 1.00 0.00 H new ATOM 955 N VAL A 402 -5.762 6.135 3.535 1.00 0.00 N ATOM 956 CA VAL A 402 -5.528 5.380 4.760 1.00 0.00 C ATOM 957 C VAL A 402 -6.393 4.125 4.806 1.00 0.00 C ATOM 958 O VAL A 402 -7.620 4.206 4.870 1.00 0.00 O ATOM 959 CB VAL A 402 -5.815 6.233 6.010 1.00 0.00 C ATOM 960 CG1 VAL A 402 -5.536 5.438 7.276 1.00 0.00 C ATOM 961 CG2 VAL A 402 -4.992 7.512 5.981 1.00 0.00 C ATOM 0 H VAL A 402 -6.737 6.162 3.236 1.00 0.00 H new ATOM 0 HA VAL A 402 -4.476 5.094 4.758 1.00 0.00 H new ATOM 0 HB VAL A 402 -6.870 6.506 6.008 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -5.745 6.058 8.148 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -6.173 4.554 7.298 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -4.490 5.132 7.290 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -5.207 8.103 6.871 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.931 7.262 5.959 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -5.247 8.089 5.092 1.00 0.00 H new ATOM 971 N VAL A 403 -5.746 2.965 4.774 1.00 0.00 N ATOM 972 CA VAL A 403 -6.455 1.692 4.813 1.00 0.00 C ATOM 973 C VAL A 403 -6.602 1.188 6.244 1.00 0.00 C ATOM 974 O VAL A 403 -5.801 1.523 7.118 1.00 0.00 O ATOM 975 CB VAL A 403 -5.733 0.620 3.975 1.00 0.00 C ATOM 976 CG1 VAL A 403 -4.399 0.256 4.608 1.00 0.00 C ATOM 977 CG2 VAL A 403 -6.611 -0.612 3.815 1.00 0.00 C ATOM 0 H VAL A 403 -4.731 2.880 4.721 1.00 0.00 H new ATOM 0 HA VAL A 403 -7.444 1.868 4.389 1.00 0.00 H new ATOM 0 HB VAL A 403 -5.537 1.029 2.984 1.00 0.00 H new ATOM 0 HG11 VAL A 403 -3.904 -0.503 4.002 1.00 0.00 H new ATOM 0 HG12 VAL A 403 -3.769 1.144 4.665 1.00 0.00 H new ATOM 0 HG13 VAL A 403 -4.567 -0.134 5.612 1.00 0.00 H new ATOM 0 HG21 VAL A 403 -6.085 -1.359 3.220 1.00 0.00 H new ATOM 0 HG22 VAL A 403 -6.840 -1.026 4.797 1.00 0.00 H new ATOM 0 HG23 VAL A 403 -7.538 -0.335 3.313 1.00 0.00 H new ATOM 987 N THR A 404 -7.631 0.379 6.479 1.00 0.00 N ATOM 988 CA THR A 404 -7.883 -0.171 7.805 1.00 0.00 C ATOM 989 C THR A 404 -8.230 -1.653 7.728 1.00 0.00 C ATOM 990 O THR A 404 -9.211 -2.039 7.092 1.00 0.00 O ATOM 991 CB THR A 404 -9.028 0.577 8.515 1.00 0.00 C ATOM 992 OG1 THR A 404 -8.682 1.956 8.684 1.00 0.00 O ATOM 993 CG2 THR A 404 -9.323 -0.047 9.870 1.00 0.00 C ATOM 0 H THR A 404 -8.303 0.090 5.768 1.00 0.00 H new ATOM 0 HA THR A 404 -6.965 -0.045 8.380 1.00 0.00 H new ATOM 0 HB THR A 404 -9.922 0.501 7.895 1.00 0.00 H new ATOM 0 HG1 THR A 404 -9.416 2.424 9.134 1.00 0.00 H new ATOM 0 HG21 THR A 404 -10.135 0.498 10.352 1.00 0.00 H new ATOM 0 HG22 THR A 404 -9.615 -1.089 9.735 1.00 0.00 H new ATOM 0 HG23 THR A 404 -8.431 0.002 10.495 1.00 0.00 H new ATOM 1001 N VAL A 405 -7.420 -2.481 8.380 1.00 0.00 N ATOM 1002 CA VAL A 405 -7.642 -3.921 8.387 1.00 0.00 C ATOM 1003 C VAL A 405 -7.423 -4.505 9.779 1.00 0.00 C ATOM 1004 O VAL A 405 -6.526 -4.080 10.507 1.00 0.00 O ATOM 1005 CB VAL A 405 -6.713 -4.638 7.390 1.00 0.00 C ATOM 1006 CG1 VAL A 405 -6.992 -6.133 7.379 1.00 0.00 C ATOM 1007 CG2 VAL A 405 -6.870 -4.047 5.997 1.00 0.00 C ATOM 0 H VAL A 405 -6.603 -2.178 8.911 1.00 0.00 H new ATOM 0 HA VAL A 405 -8.678 -4.082 8.087 1.00 0.00 H new ATOM 0 HB VAL A 405 -5.682 -4.489 7.709 1.00 0.00 H new ATOM 0 HG11 VAL A 405 -6.326 -6.622 6.668 1.00 0.00 H new ATOM 0 HG12 VAL A 405 -6.824 -6.542 8.375 1.00 0.00 H new ATOM 0 HG13 VAL A 405 -8.027 -6.308 7.085 1.00 0.00 H new ATOM 0 HG21 VAL A 405 -6.206 -4.565 5.305 1.00 0.00 H new ATOM 0 HG22 VAL A 405 -7.902 -4.164 5.666 1.00 0.00 H new ATOM 0 HG23 VAL A 405 -6.614 -2.988 6.020 1.00 0.00 H new ATOM 1017 N ALA A 406 -8.249 -5.481 10.142 1.00 0.00 N ATOM 1018 CA ALA A 406 -8.144 -6.125 11.446 1.00 0.00 C ATOM 1019 C ALA A 406 -8.100 -5.091 12.566 1.00 0.00 C ATOM 1020 O ALA A 406 -7.330 -5.226 13.516 1.00 0.00 O ATOM 1021 CB ALA A 406 -6.910 -7.014 11.497 1.00 0.00 C ATOM 0 H ALA A 406 -8.998 -5.843 9.552 1.00 0.00 H new ATOM 0 HA ALA A 406 -9.030 -6.743 11.592 1.00 0.00 H new ATOM 0 HB1 ALA A 406 -6.844 -7.489 12.476 1.00 0.00 H new ATOM 0 HB2 ALA A 406 -6.982 -7.781 10.726 1.00 0.00 H new ATOM 0 HB3 ALA A 406 -6.019 -6.410 11.326 1.00 0.00 H new ATOM 1027 N GLU A 407 -8.932 -4.061 12.448 1.00 0.00 N ATOM 1028 CA GLU A 407 -8.986 -3.005 13.451 1.00 0.00 C ATOM 1029 C GLU A 407 -7.642 -2.291 13.563 1.00 0.00 C ATOM 1030 O GLU A 407 -7.272 -1.806 14.632 1.00 0.00 O ATOM 1031 CB GLU A 407 -9.383 -3.582 14.811 1.00 0.00 C ATOM 1032 CG GLU A 407 -10.728 -4.290 14.803 1.00 0.00 C ATOM 1033 CD GLU A 407 -11.408 -4.267 16.158 1.00 0.00 C ATOM 1034 OE1 GLU A 407 -10.827 -4.806 17.123 1.00 0.00 O ATOM 1035 OE2 GLU A 407 -12.521 -3.709 16.253 1.00 0.00 O ATOM 0 H GLU A 407 -9.577 -3.936 11.668 1.00 0.00 H new ATOM 0 HA GLU A 407 -9.738 -2.281 13.138 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -8.615 -4.283 15.137 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -9.411 -2.776 15.544 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -11.378 -3.818 14.066 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -10.588 -5.324 14.489 1.00 0.00 H new ATOM 1042 N GLN A 408 -6.916 -2.232 12.451 1.00 0.00 N ATOM 1043 CA GLN A 408 -5.612 -1.579 12.424 1.00 0.00 C ATOM 1044 C GLN A 408 -5.495 -0.647 11.222 1.00 0.00 C ATOM 1045 O GLN A 408 -5.632 -1.075 10.076 1.00 0.00 O ATOM 1046 CB GLN A 408 -4.496 -2.623 12.386 1.00 0.00 C ATOM 1047 CG GLN A 408 -3.100 -2.021 12.358 1.00 0.00 C ATOM 1048 CD GLN A 408 -2.824 -1.132 13.555 1.00 0.00 C ATOM 1049 OE1 GLN A 408 -3.044 -1.528 14.700 1.00 0.00 O ATOM 1050 NE2 GLN A 408 -2.340 0.077 13.296 1.00 0.00 N ATOM 0 H GLN A 408 -7.208 -2.628 11.558 1.00 0.00 H new ATOM 0 HA GLN A 408 -5.512 -0.985 13.332 1.00 0.00 H new ATOM 0 HB2 GLN A 408 -4.586 -3.271 13.258 1.00 0.00 H new ATOM 0 HB3 GLN A 408 -4.629 -3.253 11.506 1.00 0.00 H new ATOM 0 HG2 GLN A 408 -2.363 -2.823 12.328 1.00 0.00 H new ATOM 0 HG3 GLN A 408 -2.977 -1.441 11.443 1.00 0.00 H new ATOM 0 HE21 GLN A 408 -2.173 0.364 12.331 1.00 0.00 H new ATOM 0 HE22 GLN A 408 -2.135 0.719 14.062 1.00 0.00 H new ATOM 1059 N LYS A 409 -5.241 0.629 11.492 1.00 0.00 N ATOM 1060 CA LYS A 409 -5.104 1.622 10.433 1.00 0.00 C ATOM 1061 C LYS A 409 -3.657 1.719 9.962 1.00 0.00 C ATOM 1062 O LYS A 409 -2.725 1.623 10.762 1.00 0.00 O ATOM 1063 CB LYS A 409 -5.584 2.990 10.924 1.00 0.00 C ATOM 1064 CG LYS A 409 -7.097 3.122 10.972 1.00 0.00 C ATOM 1065 CD LYS A 409 -7.533 4.165 11.988 1.00 0.00 C ATOM 1066 CE LYS A 409 -7.712 3.556 13.370 1.00 0.00 C ATOM 1067 NZ LYS A 409 -8.546 4.418 14.252 1.00 0.00 N ATOM 0 H LYS A 409 -5.126 1.000 12.435 1.00 0.00 H new ATOM 0 HA LYS A 409 -5.721 1.307 9.592 1.00 0.00 H new ATOM 0 HB2 LYS A 409 -5.180 3.172 11.920 1.00 0.00 H new ATOM 0 HB3 LYS A 409 -5.181 3.763 10.270 1.00 0.00 H new ATOM 0 HG2 LYS A 409 -7.471 3.395 9.985 1.00 0.00 H new ATOM 0 HG3 LYS A 409 -7.540 2.159 11.225 1.00 0.00 H new ATOM 0 HD2 LYS A 409 -6.791 4.962 12.034 1.00 0.00 H new ATOM 0 HD3 LYS A 409 -8.470 4.619 11.665 1.00 0.00 H new ATOM 0 HE2 LYS A 409 -8.177 2.574 13.277 1.00 0.00 H new ATOM 0 HE3 LYS A 409 -6.735 3.404 13.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 409 -8.644 3.968 15.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 409 -8.090 5.346 14.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 409 -9.487 4.542 13.827 1.00 0.00 H new ATOM 1081 N TYR A 410 -3.475 1.912 8.660 1.00 0.00 N ATOM 1082 CA TYR A 410 -2.140 2.021 8.083 1.00 0.00 C ATOM 1083 C TYR A 410 -2.031 3.256 7.194 1.00 0.00 C ATOM 1084 O TYR A 410 -2.536 3.272 6.072 1.00 0.00 O ATOM 1085 CB TYR A 410 -1.808 0.765 7.275 1.00 0.00 C ATOM 1086 CG TYR A 410 -2.067 -0.523 8.022 1.00 0.00 C ATOM 1087 CD1 TYR A 410 -3.326 -1.111 8.018 1.00 0.00 C ATOM 1088 CD2 TYR A 410 -1.052 -1.153 8.733 1.00 0.00 C ATOM 1089 CE1 TYR A 410 -3.567 -2.287 8.701 1.00 0.00 C ATOM 1090 CE2 TYR A 410 -1.284 -2.330 9.417 1.00 0.00 C ATOM 1091 CZ TYR A 410 -2.543 -2.893 9.399 1.00 0.00 C ATOM 1092 OH TYR A 410 -2.779 -4.066 10.079 1.00 0.00 O ATOM 0 H TYR A 410 -4.235 1.996 7.985 1.00 0.00 H new ATOM 0 HA TYR A 410 -1.424 2.119 8.899 1.00 0.00 H new ATOM 0 HB2 TYR A 410 -2.397 0.768 6.358 1.00 0.00 H new ATOM 0 HB3 TYR A 410 -0.759 0.800 6.981 1.00 0.00 H new ATOM 0 HD1 TYR A 410 -4.130 -0.640 7.471 1.00 0.00 H new ATOM 0 HD2 TYR A 410 -0.065 -0.714 8.751 1.00 0.00 H new ATOM 0 HE1 TYR A 410 -4.552 -2.730 8.689 1.00 0.00 H new ATOM 0 HE2 TYR A 410 -0.484 -2.807 9.963 1.00 0.00 H new ATOM 0 HH TYR A 410 -1.954 -4.362 10.517 1.00 0.00 H new ATOM 1102 N GLN A 411 -1.367 4.287 7.705 1.00 0.00 N ATOM 1103 CA GLN A 411 -1.190 5.527 6.958 1.00 0.00 C ATOM 1104 C GLN A 411 0.285 5.780 6.664 1.00 0.00 C ATOM 1105 O GLN A 411 1.147 5.533 7.507 1.00 0.00 O ATOM 1106 CB GLN A 411 -1.777 6.705 7.738 1.00 0.00 C ATOM 1107 CG GLN A 411 -1.473 8.058 7.116 1.00 0.00 C ATOM 1108 CD GLN A 411 -1.685 9.206 8.083 1.00 0.00 C ATOM 1109 OE1 GLN A 411 -0.791 9.557 8.853 1.00 0.00 O ATOM 1110 NE2 GLN A 411 -2.873 9.799 8.048 1.00 0.00 N ATOM 0 H GLN A 411 -0.943 4.289 8.633 1.00 0.00 H new ATOM 0 HA GLN A 411 -1.718 5.429 6.010 1.00 0.00 H new ATOM 0 HB2 GLN A 411 -2.858 6.581 7.808 1.00 0.00 H new ATOM 0 HB3 GLN A 411 -1.387 6.686 8.756 1.00 0.00 H new ATOM 0 HG2 GLN A 411 -0.441 8.069 6.766 1.00 0.00 H new ATOM 0 HG3 GLN A 411 -2.108 8.203 6.242 1.00 0.00 H new ATOM 0 HE21 GLN A 411 -3.585 9.476 7.394 1.00 0.00 H new ATOM 0 HE22 GLN A 411 -3.073 10.578 8.676 1.00 0.00 H new ATOM 1119 N SER A 412 0.567 6.275 5.463 1.00 0.00 N ATOM 1120 CA SER A 412 1.939 6.558 5.057 1.00 0.00 C ATOM 1121 C SER A 412 2.325 7.991 5.409 1.00 0.00 C ATOM 1122 O SER A 412 1.478 8.883 5.452 1.00 0.00 O ATOM 1123 CB SER A 412 2.105 6.328 3.553 1.00 0.00 C ATOM 1124 OG SER A 412 3.386 6.744 3.112 1.00 0.00 O ATOM 0 H SER A 412 -0.135 6.488 4.755 1.00 0.00 H new ATOM 0 HA SER A 412 2.599 5.879 5.597 1.00 0.00 H new ATOM 0 HB2 SER A 412 1.964 5.271 3.326 1.00 0.00 H new ATOM 0 HB3 SER A 412 1.334 6.876 3.011 1.00 0.00 H new ATOM 0 HG SER A 412 3.604 6.295 2.269 1.00 0.00 H new ATOM 1130 N THR A 413 3.613 8.205 5.662 1.00 0.00 N ATOM 1131 CA THR A 413 4.114 9.528 6.013 1.00 0.00 C ATOM 1132 C THR A 413 4.488 10.322 4.766 1.00 0.00 C ATOM 1133 O THR A 413 5.123 11.374 4.855 1.00 0.00 O ATOM 1134 CB THR A 413 5.342 9.437 6.938 1.00 0.00 C ATOM 1135 OG1 THR A 413 6.406 8.748 6.273 1.00 0.00 O ATOM 1136 CG2 THR A 413 4.993 8.715 8.231 1.00 0.00 C ATOM 0 H THR A 413 4.328 7.478 5.630 1.00 0.00 H new ATOM 0 HA THR A 413 3.310 10.041 6.540 1.00 0.00 H new ATOM 0 HB THR A 413 5.662 10.450 7.181 1.00 0.00 H new ATOM 0 HG1 THR A 413 7.184 8.696 6.867 1.00 0.00 H new ATOM 0 HG21 THR A 413 5.876 8.663 8.868 1.00 0.00 H new ATOM 0 HG22 THR A 413 4.203 9.258 8.749 1.00 0.00 H new ATOM 0 HG23 THR A 413 4.650 7.706 8.003 1.00 0.00 H new ATOM 1144 N LEU A 414 4.092 9.813 3.605 1.00 0.00 N ATOM 1145 CA LEU A 414 4.386 10.476 2.339 1.00 0.00 C ATOM 1146 C LEU A 414 3.125 10.616 1.493 1.00 0.00 C ATOM 1147 O LEU A 414 2.557 9.623 1.038 1.00 0.00 O ATOM 1148 CB LEU A 414 5.448 9.693 1.566 1.00 0.00 C ATOM 1149 CG LEU A 414 6.763 9.437 2.303 1.00 0.00 C ATOM 1150 CD1 LEU A 414 7.648 8.493 1.505 1.00 0.00 C ATOM 1151 CD2 LEU A 414 7.487 10.749 2.574 1.00 0.00 C ATOM 0 H LEU A 414 3.567 8.944 3.514 1.00 0.00 H new ATOM 0 HA LEU A 414 4.767 11.473 2.559 1.00 0.00 H new ATOM 0 HB2 LEU A 414 5.023 8.731 1.278 1.00 0.00 H new ATOM 0 HB3 LEU A 414 5.670 10.233 0.645 1.00 0.00 H new ATOM 0 HG LEU A 414 6.535 8.966 3.259 1.00 0.00 H new ATOM 0 HD11 LEU A 414 8.579 8.323 2.046 1.00 0.00 H new ATOM 0 HD12 LEU A 414 7.132 7.543 1.363 1.00 0.00 H new ATOM 0 HD13 LEU A 414 7.868 8.935 0.533 1.00 0.00 H new ATOM 0 HD21 LEU A 414 8.421 10.548 3.099 1.00 0.00 H new ATOM 0 HD22 LEU A 414 7.702 11.248 1.629 1.00 0.00 H new ATOM 0 HD23 LEU A 414 6.857 11.392 3.188 1.00 0.00 H new ATOM 1163 N TRP A 415 2.694 11.855 1.283 1.00 0.00 N ATOM 1164 CA TRP A 415 1.501 12.125 0.489 1.00 0.00 C ATOM 1165 C TRP A 415 1.743 11.807 -0.982 1.00 0.00 C ATOM 1166 O TRP A 415 2.837 11.391 -1.365 1.00 0.00 O ATOM 1167 CB TRP A 415 1.080 13.587 0.644 1.00 0.00 C ATOM 1168 CG TRP A 415 0.664 13.940 2.040 1.00 0.00 C ATOM 1169 CD1 TRP A 415 1.465 13.993 3.145 1.00 0.00 C ATOM 1170 CD2 TRP A 415 -0.653 14.287 2.480 1.00 0.00 C ATOM 1171 NE1 TRP A 415 0.724 14.352 4.246 1.00 0.00 N ATOM 1172 CE2 TRP A 415 -0.578 14.539 3.864 1.00 0.00 C ATOM 1173 CE3 TRP A 415 -1.889 14.412 1.839 1.00 0.00 C ATOM 1174 CZ2 TRP A 415 -1.691 14.906 4.615 1.00 0.00 C ATOM 1175 CZ3 TRP A 415 -2.993 14.776 2.586 1.00 0.00 C ATOM 1176 CH2 TRP A 415 -2.888 15.021 3.962 1.00 0.00 C ATOM 0 H TRP A 415 3.153 12.688 1.651 1.00 0.00 H new ATOM 0 HA TRP A 415 0.699 11.483 0.854 1.00 0.00 H new ATOM 0 HB2 TRP A 415 1.908 14.230 0.346 1.00 0.00 H new ATOM 0 HB3 TRP A 415 0.254 13.794 -0.037 1.00 0.00 H new ATOM 0 HD1 TRP A 415 2.524 13.784 3.153 1.00 0.00 H new ATOM 0 HE1 TRP A 415 1.085 14.461 5.194 1.00 0.00 H new ATOM 0 HE3 TRP A 415 -1.979 14.227 0.779 1.00 0.00 H new ATOM 0 HZ2 TRP A 415 -1.613 15.093 5.676 1.00 0.00 H new ATOM 0 HZ3 TRP A 415 -3.953 14.873 2.101 1.00 0.00 H new ATOM 0 HH2 TRP A 415 -3.769 15.306 4.518 1.00 0.00 H new ATOM 1187 N ASP A 416 0.717 12.005 -1.803 1.00 0.00 N ATOM 1188 CA ASP A 416 0.820 11.740 -3.233 1.00 0.00 C ATOM 1189 C ASP A 416 0.278 12.913 -4.043 1.00 0.00 C ATOM 1190 O ASP A 416 -0.671 13.581 -3.632 1.00 0.00 O ATOM 1191 CB ASP A 416 0.060 10.462 -3.592 1.00 0.00 C ATOM 1192 CG ASP A 416 0.555 9.256 -2.818 1.00 0.00 C ATOM 1193 OD1 ASP A 416 0.543 9.306 -1.570 1.00 0.00 O ATOM 1194 OD2 ASP A 416 0.954 8.263 -3.460 1.00 0.00 O ATOM 0 H ASP A 416 -0.195 12.348 -1.502 1.00 0.00 H new ATOM 0 HA ASP A 416 1.874 11.608 -3.478 1.00 0.00 H new ATOM 0 HB2 ASP A 416 -1.002 10.607 -3.393 1.00 0.00 H new ATOM 0 HB3 ASP A 416 0.161 10.271 -4.660 1.00 0.00 H new ATOM 1199 N LYS A 417 0.888 13.160 -5.198 1.00 0.00 N ATOM 1200 CA LYS A 417 0.468 14.253 -6.067 1.00 0.00 C ATOM 1201 C LYS A 417 -1.027 14.174 -6.356 1.00 0.00 C ATOM 1202 O LYS A 417 -1.727 15.187 -6.337 1.00 0.00 O ATOM 1203 CB LYS A 417 1.255 14.219 -7.379 1.00 0.00 C ATOM 1204 CG LYS A 417 1.148 12.896 -8.118 1.00 0.00 C ATOM 1205 CD LYS A 417 2.224 12.763 -9.183 1.00 0.00 C ATOM 1206 CE LYS A 417 1.918 13.629 -10.396 1.00 0.00 C ATOM 1207 NZ LYS A 417 1.016 12.937 -11.357 1.00 0.00 N ATOM 0 H LYS A 417 1.675 12.618 -5.554 1.00 0.00 H new ATOM 0 HA LYS A 417 0.671 15.192 -5.553 1.00 0.00 H new ATOM 0 HB2 LYS A 417 0.898 15.018 -8.028 1.00 0.00 H new ATOM 0 HB3 LYS A 417 2.305 14.424 -7.169 1.00 0.00 H new ATOM 0 HG2 LYS A 417 1.234 12.074 -7.408 1.00 0.00 H new ATOM 0 HG3 LYS A 417 0.165 12.815 -8.581 1.00 0.00 H new ATOM 0 HD2 LYS A 417 3.189 13.049 -8.765 1.00 0.00 H new ATOM 0 HD3 LYS A 417 2.306 11.720 -9.490 1.00 0.00 H new ATOM 0 HE2 LYS A 417 1.455 14.561 -10.070 1.00 0.00 H new ATOM 0 HE3 LYS A 417 2.849 13.894 -10.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 417 0.831 13.559 -12.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 417 1.468 12.061 -11.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 417 0.118 12.707 -10.886 1.00 0.00 H new ATOM 1221 N SER A 418 -1.511 12.965 -6.622 1.00 0.00 N ATOM 1222 CA SER A 418 -2.924 12.755 -6.918 1.00 0.00 C ATOM 1223 C SER A 418 -3.558 11.814 -5.898 1.00 0.00 C ATOM 1224 O SER A 418 -2.863 11.065 -5.210 1.00 0.00 O ATOM 1225 CB SER A 418 -3.093 12.186 -8.328 1.00 0.00 C ATOM 1226 OG SER A 418 -2.881 10.785 -8.341 1.00 0.00 O ATOM 0 H SER A 418 -0.946 12.116 -6.639 1.00 0.00 H new ATOM 0 HA SER A 418 -3.429 13.719 -6.861 1.00 0.00 H new ATOM 0 HB2 SER A 418 -4.095 12.409 -8.696 1.00 0.00 H new ATOM 0 HB3 SER A 418 -2.389 12.670 -9.006 1.00 0.00 H new ATOM 0 HG SER A 418 -2.996 10.445 -9.253 1.00 0.00 H new ATOM 1232 N LYS A 419 -4.883 11.858 -5.805 1.00 0.00 N ATOM 1233 CA LYS A 419 -5.613 11.010 -4.871 1.00 0.00 C ATOM 1234 C LYS A 419 -5.551 9.548 -5.301 1.00 0.00 C ATOM 1235 O LYS A 419 -5.394 8.652 -4.471 1.00 0.00 O ATOM 1236 CB LYS A 419 -7.072 11.462 -4.774 1.00 0.00 C ATOM 1237 CG LYS A 419 -7.970 10.469 -4.057 1.00 0.00 C ATOM 1238 CD LYS A 419 -8.596 9.482 -5.027 1.00 0.00 C ATOM 1239 CE LYS A 419 -9.342 8.377 -4.295 1.00 0.00 C ATOM 1240 NZ LYS A 419 -10.638 8.856 -3.740 1.00 0.00 N ATOM 0 H LYS A 419 -5.473 12.473 -6.366 1.00 0.00 H new ATOM 0 HA LYS A 419 -5.144 11.103 -3.892 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -7.113 12.419 -4.253 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -7.459 11.629 -5.779 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -7.391 9.928 -3.309 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -8.756 11.006 -3.525 1.00 0.00 H new ATOM 0 HD2 LYS A 419 -9.282 10.008 -5.690 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -7.819 9.044 -5.654 1.00 0.00 H new ATOM 0 HE2 LYS A 419 -9.524 7.547 -4.978 1.00 0.00 H new ATOM 0 HE3 LYS A 419 -8.720 7.993 -3.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 -11.116 8.074 -3.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -10.463 9.631 -3.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -11.242 9.199 -4.514 1.00 0.00 H new ATOM 1254 N LYS A 420 -5.673 9.313 -6.603 1.00 0.00 N ATOM 1255 CA LYS A 420 -5.627 7.960 -7.144 1.00 0.00 C ATOM 1256 C LYS A 420 -4.350 7.245 -6.715 1.00 0.00 C ATOM 1257 O LYS A 420 -4.385 6.087 -6.295 1.00 0.00 O ATOM 1258 CB LYS A 420 -5.716 7.996 -8.671 1.00 0.00 C ATOM 1259 CG LYS A 420 -7.138 7.934 -9.200 1.00 0.00 C ATOM 1260 CD LYS A 420 -7.595 6.500 -9.407 1.00 0.00 C ATOM 1261 CE LYS A 420 -9.112 6.392 -9.406 1.00 0.00 C ATOM 1262 NZ LYS A 420 -9.722 7.153 -10.532 1.00 0.00 N ATOM 0 H LYS A 420 -5.805 10.043 -7.303 1.00 0.00 H new ATOM 0 HA LYS A 420 -6.481 7.409 -6.749 1.00 0.00 H new ATOM 0 HB2 LYS A 420 -5.243 8.909 -9.033 1.00 0.00 H new ATOM 0 HB3 LYS A 420 -5.149 7.159 -9.079 1.00 0.00 H new ATOM 0 HG2 LYS A 420 -7.809 8.433 -8.501 1.00 0.00 H new ATOM 0 HG3 LYS A 420 -7.200 8.476 -10.144 1.00 0.00 H new ATOM 0 HD2 LYS A 420 -7.203 6.125 -10.353 1.00 0.00 H new ATOM 0 HD3 LYS A 420 -7.184 5.869 -8.619 1.00 0.00 H new ATOM 0 HE2 LYS A 420 -9.402 5.344 -9.477 1.00 0.00 H new ATOM 0 HE3 LYS A 420 -9.502 6.767 -8.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 -10.748 6.986 -10.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 -9.538 8.169 -10.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 -9.306 6.836 -11.431 1.00 0.00 H new ATOM 1276 N LEU A 421 -3.223 7.941 -6.822 1.00 0.00 N ATOM 1277 CA LEU A 421 -1.934 7.373 -6.443 1.00 0.00 C ATOM 1278 C LEU A 421 -1.892 7.066 -4.950 1.00 0.00 C ATOM 1279 O LEU A 421 -1.488 5.978 -4.541 1.00 0.00 O ATOM 1280 CB LEU A 421 -0.803 8.335 -6.810 1.00 0.00 C ATOM 1281 CG LEU A 421 -0.594 8.587 -8.303 1.00 0.00 C ATOM 1282 CD1 LEU A 421 0.311 9.790 -8.520 1.00 0.00 C ATOM 1283 CD2 LEU A 421 -0.012 7.352 -8.976 1.00 0.00 C ATOM 0 H LEU A 421 -3.176 8.899 -7.168 1.00 0.00 H new ATOM 0 HA LEU A 421 -1.801 6.440 -6.990 1.00 0.00 H new ATOM 0 HB2 LEU A 421 -0.995 9.292 -6.324 1.00 0.00 H new ATOM 0 HB3 LEU A 421 0.127 7.947 -6.394 1.00 0.00 H new ATOM 0 HG LEU A 421 -1.563 8.801 -8.755 1.00 0.00 H new ATOM 0 HD11 LEU A 421 0.448 9.954 -9.589 1.00 0.00 H new ATOM 0 HD12 LEU A 421 -0.145 10.673 -8.073 1.00 0.00 H new ATOM 0 HD13 LEU A 421 1.279 9.606 -8.054 1.00 0.00 H new ATOM 0 HD21 LEU A 421 0.130 7.550 -10.038 1.00 0.00 H new ATOM 0 HD22 LEU A 421 0.948 7.108 -8.521 1.00 0.00 H new ATOM 0 HD23 LEU A 421 -0.697 6.513 -8.851 1.00 0.00 H new ATOM 1295 N ALA A 422 -2.314 8.032 -4.140 1.00 0.00 N ATOM 1296 CA ALA A 422 -2.328 7.863 -2.692 1.00 0.00 C ATOM 1297 C ALA A 422 -2.989 6.546 -2.300 1.00 0.00 C ATOM 1298 O ALA A 422 -2.557 5.882 -1.358 1.00 0.00 O ATOM 1299 CB ALA A 422 -3.044 9.032 -2.032 1.00 0.00 C ATOM 0 H ALA A 422 -2.651 8.939 -4.462 1.00 0.00 H new ATOM 0 HA ALA A 422 -1.296 7.839 -2.343 1.00 0.00 H new ATOM 0 HB1 ALA A 422 -3.047 8.893 -0.951 1.00 0.00 H new ATOM 0 HB2 ALA A 422 -2.528 9.960 -2.277 1.00 0.00 H new ATOM 0 HB3 ALA A 422 -4.071 9.081 -2.395 1.00 0.00 H new ATOM 1305 N GLU A 423 -4.037 6.174 -3.028 1.00 0.00 N ATOM 1306 CA GLU A 423 -4.757 4.937 -2.753 1.00 0.00 C ATOM 1307 C GLU A 423 -3.825 3.732 -2.847 1.00 0.00 C ATOM 1308 O GLU A 423 -3.912 2.804 -2.044 1.00 0.00 O ATOM 1309 CB GLU A 423 -5.923 4.771 -3.730 1.00 0.00 C ATOM 1310 CG GLU A 423 -6.906 5.930 -3.707 1.00 0.00 C ATOM 1311 CD GLU A 423 -8.291 5.529 -4.178 1.00 0.00 C ATOM 1312 OE1 GLU A 423 -8.509 5.486 -5.407 1.00 0.00 O ATOM 1313 OE2 GLU A 423 -9.155 5.260 -3.318 1.00 0.00 O ATOM 0 H GLU A 423 -4.406 6.712 -3.812 1.00 0.00 H new ATOM 0 HA GLU A 423 -5.149 4.993 -1.737 1.00 0.00 H new ATOM 0 HB2 GLU A 423 -5.527 4.661 -4.740 1.00 0.00 H new ATOM 0 HB3 GLU A 423 -6.455 3.849 -3.494 1.00 0.00 H new ATOM 0 HG2 GLU A 423 -6.971 6.326 -2.694 1.00 0.00 H new ATOM 0 HG3 GLU A 423 -6.529 6.734 -4.340 1.00 0.00 H new ATOM 1320 N GLN A 424 -2.935 3.756 -3.834 1.00 0.00 N ATOM 1321 CA GLN A 424 -1.988 2.666 -4.035 1.00 0.00 C ATOM 1322 C GLN A 424 -1.121 2.464 -2.796 1.00 0.00 C ATOM 1323 O GLN A 424 -0.994 1.349 -2.289 1.00 0.00 O ATOM 1324 CB GLN A 424 -1.104 2.948 -5.250 1.00 0.00 C ATOM 1325 CG GLN A 424 -1.888 3.278 -6.510 1.00 0.00 C ATOM 1326 CD GLN A 424 -2.220 2.047 -7.331 1.00 0.00 C ATOM 1327 OE1 GLN A 424 -1.606 1.795 -8.368 1.00 0.00 O ATOM 1328 NE2 GLN A 424 -3.195 1.273 -6.869 1.00 0.00 N ATOM 0 H GLN A 424 -2.850 4.518 -4.507 1.00 0.00 H new ATOM 0 HA GLN A 424 -2.556 1.753 -4.212 1.00 0.00 H new ATOM 0 HB2 GLN A 424 -0.438 3.779 -5.019 1.00 0.00 H new ATOM 0 HB3 GLN A 424 -0.475 2.078 -5.441 1.00 0.00 H new ATOM 0 HG2 GLN A 424 -2.812 3.787 -6.235 1.00 0.00 H new ATOM 0 HG3 GLN A 424 -1.311 3.972 -7.121 1.00 0.00 H new ATOM 0 HE21 GLN A 424 -3.677 1.521 -6.005 1.00 0.00 H new ATOM 0 HE22 GLN A 424 -3.462 0.431 -7.378 1.00 0.00 H new ATOM 1337 N THR A 425 -0.525 3.549 -2.314 1.00 0.00 N ATOM 1338 CA THR A 425 0.332 3.491 -1.136 1.00 0.00 C ATOM 1339 C THR A 425 -0.329 2.698 -0.014 1.00 0.00 C ATOM 1340 O THR A 425 0.253 1.752 0.516 1.00 0.00 O ATOM 1341 CB THR A 425 0.673 4.902 -0.619 1.00 0.00 C ATOM 1342 OG1 THR A 425 1.289 5.669 -1.660 1.00 0.00 O ATOM 1343 CG2 THR A 425 1.605 4.827 0.581 1.00 0.00 C ATOM 0 H THR A 425 -0.620 4.479 -2.721 1.00 0.00 H new ATOM 0 HA THR A 425 1.252 2.991 -1.439 1.00 0.00 H new ATOM 0 HB THR A 425 -0.253 5.386 -0.311 1.00 0.00 H new ATOM 0 HG1 THR A 425 1.501 6.565 -1.324 1.00 0.00 H new ATOM 0 HG21 THR A 425 1.832 5.835 0.929 1.00 0.00 H new ATOM 0 HG22 THR A 425 1.123 4.267 1.382 1.00 0.00 H new ATOM 0 HG23 THR A 425 2.529 4.326 0.293 1.00 0.00 H new ATOM 1351 N ALA A 426 -1.548 3.089 0.342 1.00 0.00 N ATOM 1352 CA ALA A 426 -2.289 2.412 1.399 1.00 0.00 C ATOM 1353 C ALA A 426 -1.991 0.916 1.407 1.00 0.00 C ATOM 1354 O ALA A 426 -1.301 0.416 2.294 1.00 0.00 O ATOM 1355 CB ALA A 426 -3.782 2.654 1.235 1.00 0.00 C ATOM 0 H ALA A 426 -2.043 3.871 -0.086 1.00 0.00 H new ATOM 0 HA ALA A 426 -1.968 2.825 2.355 1.00 0.00 H new ATOM 0 HB1 ALA A 426 -4.323 2.143 2.031 1.00 0.00 H new ATOM 0 HB2 ALA A 426 -3.985 3.724 1.287 1.00 0.00 H new ATOM 0 HB3 ALA A 426 -4.109 2.269 0.269 1.00 0.00 H new ATOM 1361 N ALA A 427 -2.518 0.208 0.413 1.00 0.00 N ATOM 1362 CA ALA A 427 -2.307 -1.231 0.305 1.00 0.00 C ATOM 1363 C ALA A 427 -0.890 -1.610 0.720 1.00 0.00 C ATOM 1364 O ALA A 427 -0.685 -2.246 1.755 1.00 0.00 O ATOM 1365 CB ALA A 427 -2.587 -1.700 -1.115 1.00 0.00 C ATOM 0 H ALA A 427 -3.094 0.607 -0.328 1.00 0.00 H new ATOM 0 HA ALA A 427 -3.001 -1.728 0.983 1.00 0.00 H new ATOM 0 HB1 ALA A 427 -2.426 -2.776 -1.181 1.00 0.00 H new ATOM 0 HB2 ALA A 427 -3.620 -1.471 -1.377 1.00 0.00 H new ATOM 0 HB3 ALA A 427 -1.916 -1.189 -1.806 1.00 0.00 H new ATOM 1371 N ILE A 428 0.085 -1.218 -0.093 1.00 0.00 N ATOM 1372 CA ILE A 428 1.483 -1.518 0.190 1.00 0.00 C ATOM 1373 C ILE A 428 1.772 -1.429 1.685 1.00 0.00 C ATOM 1374 O ILE A 428 2.284 -2.373 2.287 1.00 0.00 O ATOM 1375 CB ILE A 428 2.427 -0.562 -0.562 1.00 0.00 C ATOM 1376 CG1 ILE A 428 2.289 -0.757 -2.073 1.00 0.00 C ATOM 1377 CG2 ILE A 428 3.867 -0.785 -0.123 1.00 0.00 C ATOM 1378 CD1 ILE A 428 2.824 0.403 -2.883 1.00 0.00 C ATOM 0 H ILE A 428 -0.068 -0.692 -0.953 1.00 0.00 H new ATOM 0 HA ILE A 428 1.663 -2.537 -0.153 1.00 0.00 H new ATOM 0 HB ILE A 428 2.149 0.464 -0.320 1.00 0.00 H new ATOM 0 HG12 ILE A 428 2.816 -1.666 -2.364 1.00 0.00 H new ATOM 0 HG13 ILE A 428 1.237 -0.906 -2.317 1.00 0.00 H new ATOM 0 HG21 ILE A 428 4.522 -0.102 -0.664 1.00 0.00 H new ATOM 0 HG22 ILE A 428 3.954 -0.600 0.948 1.00 0.00 H new ATOM 0 HG23 ILE A 428 4.158 -1.813 -0.338 1.00 0.00 H new ATOM 0 HD11 ILE A 428 2.693 0.196 -3.945 1.00 0.00 H new ATOM 0 HD12 ILE A 428 2.281 1.311 -2.621 1.00 0.00 H new ATOM 0 HD13 ILE A 428 3.884 0.539 -2.668 1.00 0.00 H new ATOM 1390 N VAL A 429 1.438 -0.288 2.280 1.00 0.00 N ATOM 1391 CA VAL A 429 1.659 -0.076 3.705 1.00 0.00 C ATOM 1392 C VAL A 429 1.073 -1.217 4.528 1.00 0.00 C ATOM 1393 O VAL A 429 1.718 -1.734 5.441 1.00 0.00 O ATOM 1394 CB VAL A 429 1.040 1.253 4.177 1.00 0.00 C ATOM 1395 CG1 VAL A 429 1.562 1.626 5.557 1.00 0.00 C ATOM 1396 CG2 VAL A 429 1.326 2.360 3.173 1.00 0.00 C ATOM 0 H VAL A 429 1.013 0.504 1.797 1.00 0.00 H new ATOM 0 HA VAL A 429 2.738 -0.040 3.856 1.00 0.00 H new ATOM 0 HB VAL A 429 -0.040 1.126 4.246 1.00 0.00 H new ATOM 0 HG11 VAL A 429 1.113 2.568 5.873 1.00 0.00 H new ATOM 0 HG12 VAL A 429 1.301 0.843 6.269 1.00 0.00 H new ATOM 0 HG13 VAL A 429 2.646 1.735 5.519 1.00 0.00 H new ATOM 0 HG21 VAL A 429 0.881 3.292 3.522 1.00 0.00 H new ATOM 0 HG22 VAL A 429 2.404 2.488 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 429 0.898 2.094 2.206 1.00 0.00 H new ATOM 1406 N CYS A 430 -0.154 -1.607 4.199 1.00 0.00 N ATOM 1407 CA CYS A 430 -0.829 -2.688 4.908 1.00 0.00 C ATOM 1408 C CYS A 430 -0.048 -3.993 4.780 1.00 0.00 C ATOM 1409 O CYS A 430 0.286 -4.629 5.780 1.00 0.00 O ATOM 1410 CB CYS A 430 -2.247 -2.874 4.367 1.00 0.00 C ATOM 1411 SG CYS A 430 -3.296 -3.931 5.393 1.00 0.00 S ATOM 0 H CYS A 430 -0.701 -1.191 3.446 1.00 0.00 H new ATOM 0 HA CYS A 430 -0.883 -2.419 5.963 1.00 0.00 H new ATOM 0 HB2 CYS A 430 -2.719 -1.896 4.271 1.00 0.00 H new ATOM 0 HB3 CYS A 430 -2.189 -3.300 3.365 1.00 0.00 H new ATOM 0 HG CYS A 430 -3.425 -3.400 6.573 1.00 0.00 H new ATOM 1417 N LEU A 431 0.238 -4.386 3.543 1.00 0.00 N ATOM 1418 CA LEU A 431 0.978 -5.616 3.284 1.00 0.00 C ATOM 1419 C LEU A 431 2.275 -5.650 4.085 1.00 0.00 C ATOM 1420 O LEU A 431 2.524 -6.589 4.842 1.00 0.00 O ATOM 1421 CB LEU A 431 1.284 -5.744 1.790 1.00 0.00 C ATOM 1422 CG LEU A 431 0.108 -5.510 0.841 1.00 0.00 C ATOM 1423 CD1 LEU A 431 0.545 -5.691 -0.604 1.00 0.00 C ATOM 1424 CD2 LEU A 431 -1.041 -6.451 1.175 1.00 0.00 C ATOM 0 H LEU A 431 -0.031 -3.871 2.705 1.00 0.00 H new ATOM 0 HA LEU A 431 0.358 -6.457 3.596 1.00 0.00 H new ATOM 0 HB2 LEU A 431 2.074 -5.036 1.539 1.00 0.00 H new ATOM 0 HB3 LEU A 431 1.681 -6.742 1.605 1.00 0.00 H new ATOM 0 HG LEU A 431 -0.239 -4.485 0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 431 -0.305 -5.521 -1.265 1.00 0.00 H new ATOM 0 HD12 LEU A 431 1.335 -4.977 -0.837 1.00 0.00 H new ATOM 0 HD13 LEU A 431 0.918 -6.705 -0.747 1.00 0.00 H new ATOM 0 HD21 LEU A 431 -1.870 -6.271 0.490 1.00 0.00 H new ATOM 0 HD22 LEU A 431 -0.706 -7.484 1.076 1.00 0.00 H new ATOM 0 HD23 LEU A 431 -1.371 -6.273 2.198 1.00 0.00 H new ATOM 1436 N ARG A 432 3.097 -4.620 3.916 1.00 0.00 N ATOM 1437 CA ARG A 432 4.368 -4.532 4.624 1.00 0.00 C ATOM 1438 C ARG A 432 4.172 -4.749 6.122 1.00 0.00 C ATOM 1439 O ARG A 432 4.938 -5.470 6.761 1.00 0.00 O ATOM 1440 CB ARG A 432 5.022 -3.171 4.376 1.00 0.00 C ATOM 1441 CG ARG A 432 5.930 -3.145 3.157 1.00 0.00 C ATOM 1442 CD ARG A 432 6.947 -2.018 3.245 1.00 0.00 C ATOM 1443 NE ARG A 432 8.078 -2.367 4.101 1.00 0.00 N ATOM 1444 CZ ARG A 432 8.842 -1.468 4.711 1.00 0.00 C ATOM 1445 NH1 ARG A 432 8.598 -0.174 4.562 1.00 0.00 N ATOM 1446 NH2 ARG A 432 9.853 -1.864 5.474 1.00 0.00 N ATOM 0 H ARG A 432 2.905 -3.834 3.294 1.00 0.00 H new ATOM 0 HA ARG A 432 5.022 -5.316 4.243 1.00 0.00 H new ATOM 0 HB2 ARG A 432 4.242 -2.419 4.254 1.00 0.00 H new ATOM 0 HB3 ARG A 432 5.601 -2.890 5.256 1.00 0.00 H new ATOM 0 HG2 ARG A 432 6.449 -4.099 3.068 1.00 0.00 H new ATOM 0 HG3 ARG A 432 5.328 -3.024 2.256 1.00 0.00 H new ATOM 0 HD2 ARG A 432 7.309 -1.778 2.245 1.00 0.00 H new ATOM 0 HD3 ARG A 432 6.462 -1.122 3.632 1.00 0.00 H new ATOM 0 HE ARG A 432 8.293 -3.355 4.238 1.00 0.00 H new ATOM 0 HH11 ARG A 432 7.821 0.134 3.977 1.00 0.00 H new ATOM 0 HH12 ARG A 432 9.187 0.513 5.032 1.00 0.00 H new ATOM 0 HH21 ARG A 432 10.044 -2.859 5.592 1.00 0.00 H new ATOM 0 HH22 ARG A 432 10.440 -1.173 5.942 1.00 0.00 H new ATOM 1460 N SER A 433 3.141 -4.119 6.676 1.00 0.00 N ATOM 1461 CA SER A 433 2.846 -4.239 8.099 1.00 0.00 C ATOM 1462 C SER A 433 2.573 -5.691 8.476 1.00 0.00 C ATOM 1463 O SER A 433 3.022 -6.167 9.519 1.00 0.00 O ATOM 1464 CB SER A 433 1.643 -3.369 8.467 1.00 0.00 C ATOM 1465 OG SER A 433 2.045 -2.048 8.783 1.00 0.00 O ATOM 0 H SER A 433 2.496 -3.520 6.161 1.00 0.00 H new ATOM 0 HA SER A 433 3.717 -3.895 8.656 1.00 0.00 H new ATOM 0 HB2 SER A 433 0.938 -3.349 7.636 1.00 0.00 H new ATOM 0 HB3 SER A 433 1.121 -3.807 9.318 1.00 0.00 H new ATOM 0 HG SER A 433 2.092 -1.515 7.962 1.00 0.00 H new ATOM 1471 N GLN A 434 1.834 -6.390 7.620 1.00 0.00 N ATOM 1472 CA GLN A 434 1.500 -7.788 7.864 1.00 0.00 C ATOM 1473 C GLN A 434 2.714 -8.684 7.640 1.00 0.00 C ATOM 1474 O GLN A 434 2.814 -9.766 8.218 1.00 0.00 O ATOM 1475 CB GLN A 434 0.352 -8.226 6.953 1.00 0.00 C ATOM 1476 CG GLN A 434 -0.897 -7.372 7.096 1.00 0.00 C ATOM 1477 CD GLN A 434 -1.895 -7.607 5.979 1.00 0.00 C ATOM 1478 OE1 GLN A 434 -1.655 -8.408 5.074 1.00 0.00 O ATOM 1479 NE2 GLN A 434 -3.023 -6.909 6.036 1.00 0.00 N ATOM 0 H GLN A 434 1.456 -6.011 6.752 1.00 0.00 H new ATOM 0 HA GLN A 434 1.186 -7.885 8.903 1.00 0.00 H new ATOM 0 HB2 GLN A 434 0.688 -8.193 5.917 1.00 0.00 H new ATOM 0 HB3 GLN A 434 0.100 -9.263 7.173 1.00 0.00 H new ATOM 0 HG2 GLN A 434 -1.372 -7.587 8.053 1.00 0.00 H new ATOM 0 HG3 GLN A 434 -0.614 -6.320 7.110 1.00 0.00 H new ATOM 0 HE21 GLN A 434 -3.181 -6.256 6.804 1.00 0.00 H new ATOM 0 HE22 GLN A 434 -3.732 -7.026 5.312 1.00 0.00 H new ATOM 1488 N GLY A 435 3.634 -8.227 6.796 1.00 0.00 N ATOM 1489 CA GLY A 435 4.828 -9.000 6.510 1.00 0.00 C ATOM 1490 C GLY A 435 4.659 -9.903 5.303 1.00 0.00 C ATOM 1491 O GLY A 435 5.225 -10.995 5.252 1.00 0.00 O ATOM 0 H GLY A 435 3.573 -7.335 6.305 1.00 0.00 H new ATOM 0 HA2 GLY A 435 5.664 -8.322 6.338 1.00 0.00 H new ATOM 0 HA3 GLY A 435 5.082 -9.605 7.380 1.00 0.00 H new ATOM 1495 N LEU A 436 3.877 -9.447 4.331 1.00 0.00 N ATOM 1496 CA LEU A 436 3.634 -10.222 3.119 1.00 0.00 C ATOM 1497 C LEU A 436 4.705 -9.942 2.069 1.00 0.00 C ATOM 1498 O LEU A 436 5.289 -8.860 2.017 1.00 0.00 O ATOM 1499 CB LEU A 436 2.251 -9.897 2.552 1.00 0.00 C ATOM 1500 CG LEU A 436 1.091 -9.935 3.548 1.00 0.00 C ATOM 1501 CD1 LEU A 436 -0.178 -9.391 2.910 1.00 0.00 C ATOM 1502 CD2 LEU A 436 0.870 -11.352 4.055 1.00 0.00 C ATOM 0 H LEU A 436 3.401 -8.545 4.358 1.00 0.00 H new ATOM 0 HA LEU A 436 3.675 -11.280 3.379 1.00 0.00 H new ATOM 0 HB2 LEU A 436 2.288 -8.903 2.106 1.00 0.00 H new ATOM 0 HB3 LEU A 436 2.036 -10.600 1.747 1.00 0.00 H new ATOM 0 HG LEU A 436 1.346 -9.302 4.398 1.00 0.00 H new ATOM 0 HD11 LEU A 436 -0.993 -9.426 3.633 1.00 0.00 H new ATOM 0 HD12 LEU A 436 -0.015 -8.360 2.597 1.00 0.00 H new ATOM 0 HD13 LEU A 436 -0.437 -9.997 2.042 1.00 0.00 H new ATOM 0 HD21 LEU A 436 0.041 -11.360 4.763 1.00 0.00 H new ATOM 0 HD22 LEU A 436 0.637 -12.007 3.215 1.00 0.00 H new ATOM 0 HD23 LEU A 436 1.774 -11.706 4.551 1.00 0.00 H new