USER MOD reduce.3.24.130724 H: found=0, std=0, add=629, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 630 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 368 MET CE :methyl 144:sc= -0.445 (180deg=-2.36!) USER MOD Single : A 369 ASN : amide:sc= -3.82! C(o=-3.8!,f=-13!) USER MOD Single : A 371 LYS NZ :NH3+ -156:sc= -0.398 (180deg=-2.04!) USER MOD Single : A 373 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot 180:sc= 0 USER MOD Single : A 382 SER OG : rot -25:sc= 0.0725 USER MOD Single : A 386 HIS : no HD1:sc= -6.88! C(o=-6.9!,f=-6.8!) USER MOD Single : A 387 TYR OH : rot -15:sc= -3.4! USER MOD Single : A 389 THR OG1 : rot 140:sc= -1.52! USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 394 THR OG1 : rot -100:sc= -1.77! USER MOD Single : A 399 ASN : amide:sc= -0.405 K(o=-0.4,f=-1.9!) USER MOD Single : A 400 SER OG : rot 6:sc= -0.327 USER MOD Single : A 404 CYS SG : rot -77:sc= -3.07 USER MOD Single : A 410 THR OG1 : rot 180:sc= 0 USER MOD Single : A 414 THR OG1 : rot -20:sc= 0.793 USER MOD Single : A 419 ASN : amide:sc= -2.29! C(o=-2.3!,f=-3.8!) USER MOD Single : A 421 LYS NZ :NH3+ 157:sc= -2.34! (180deg=-3.75!) USER MOD Single : A 430 ASN : amide:sc= -3.33! C(o=-3.3!,f=-6.3!) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl 157:sc= -0.108 (180deg=-1.19) USER MOD Single : A 441 TYR OH : rot 139:sc= -2.13! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.0187 K(o=-0.019,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 40 N ASP A 367 -8.014 -6.876 7.090 1.00 0.00 N ATOM 41 CA ASP A 367 -9.179 -6.163 6.580 1.00 0.00 C ATOM 42 C ASP A 367 -9.694 -6.812 5.301 1.00 0.00 C ATOM 43 O ASP A 367 -9.242 -7.891 4.916 1.00 0.00 O ATOM 44 CB ASP A 367 -8.833 -4.695 6.322 1.00 0.00 C ATOM 45 CG ASP A 367 -9.038 -3.830 7.551 1.00 0.00 C ATOM 46 OD1 ASP A 367 -8.434 -4.137 8.599 1.00 0.00 O ATOM 47 OD2 ASP A 367 -9.801 -2.845 7.463 1.00 0.00 O ATOM 0 HA ASP A 367 -9.965 -6.214 7.333 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.795 -4.620 5.997 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.450 -4.316 5.507 1.00 0.00 H new ATOM 52 N MET A 368 -10.644 -6.151 4.648 1.00 0.00 N ATOM 53 CA MET A 368 -11.221 -6.671 3.414 1.00 0.00 C ATOM 54 C MET A 368 -10.819 -5.817 2.217 1.00 0.00 C ATOM 55 O MET A 368 -10.515 -6.339 1.144 1.00 0.00 O ATOM 56 CB MET A 368 -12.746 -6.729 3.523 1.00 0.00 C ATOM 57 CG MET A 368 -13.242 -7.645 4.630 1.00 0.00 C ATOM 58 SD MET A 368 -13.424 -9.356 4.089 1.00 0.00 S ATOM 59 CE MET A 368 -11.759 -9.967 4.337 1.00 0.00 C ATOM 0 H MET A 368 -11.030 -5.257 4.952 1.00 0.00 H new ATOM 0 HA MET A 368 -10.834 -7.679 3.262 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.128 -5.723 3.697 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.157 -7.067 2.572 1.00 0.00 H new ATOM 0 HG2 MET A 368 -12.546 -7.605 5.468 1.00 0.00 H new ATOM 0 HG3 MET A 368 -14.202 -7.280 4.995 1.00 0.00 H new ATOM 0 HE1 MET A 368 -11.798 -11.003 4.675 1.00 0.00 H new ATOM 0 HE2 MET A 368 -11.208 -9.912 3.398 1.00 0.00 H new ATOM 0 HE3 MET A 368 -11.256 -9.359 5.089 1.00 0.00 H new ATOM 69 N ASN A 369 -10.817 -4.504 2.407 1.00 0.00 N ATOM 70 CA ASN A 369 -10.452 -3.585 1.340 1.00 0.00 C ATOM 71 C ASN A 369 -9.313 -2.678 1.774 1.00 0.00 C ATOM 72 O ASN A 369 -9.523 -1.514 2.118 1.00 0.00 O ATOM 73 CB ASN A 369 -11.662 -2.744 0.951 1.00 0.00 C ATOM 74 CG ASN A 369 -12.375 -3.284 -0.273 1.00 0.00 C ATOM 75 OD1 ASN A 369 -11.981 -3.009 -1.406 1.00 0.00 O ATOM 76 ND2 ASN A 369 -13.433 -4.056 -0.051 1.00 0.00 N ATOM 0 H ASN A 369 -11.064 -4.053 3.288 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.120 -4.167 0.480 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.360 -2.708 1.788 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.342 -1.720 0.759 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -13.953 -4.446 -0.837 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -13.725 -4.258 0.905 1.00 0.00 H new ATOM 83 N ALA A 370 -8.104 -3.219 1.740 1.00 0.00 N ATOM 84 CA ALA A 370 -6.916 -2.463 2.112 1.00 0.00 C ATOM 85 C ALA A 370 -6.439 -1.608 0.951 1.00 0.00 C ATOM 86 O ALA A 370 -6.356 -0.393 1.062 1.00 0.00 O ATOM 87 CB ALA A 370 -5.804 -3.379 2.587 1.00 0.00 C ATOM 0 H ALA A 370 -7.919 -4.182 1.458 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.187 -1.807 2.940 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -4.932 -2.783 2.857 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.143 -3.941 3.457 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.537 -4.072 1.789 1.00 0.00 H new ATOM 93 N LYS A 371 -6.137 -2.252 -0.172 1.00 0.00 N ATOM 94 CA LYS A 371 -5.687 -1.533 -1.362 1.00 0.00 C ATOM 95 C LYS A 371 -6.781 -0.580 -1.816 1.00 0.00 C ATOM 96 O LYS A 371 -6.521 0.476 -2.385 1.00 0.00 O ATOM 97 CB LYS A 371 -5.344 -2.511 -2.485 1.00 0.00 C ATOM 98 CG LYS A 371 -6.487 -3.444 -2.854 1.00 0.00 C ATOM 99 CD LYS A 371 -6.276 -4.835 -2.276 1.00 0.00 C ATOM 100 CE LYS A 371 -6.687 -5.921 -3.258 1.00 0.00 C ATOM 101 NZ LYS A 371 -7.710 -5.443 -4.228 1.00 0.00 N ATOM 0 H LYS A 371 -6.195 -3.264 -0.284 1.00 0.00 H new ATOM 0 HA LYS A 371 -4.788 -0.968 -1.117 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.048 -1.946 -3.369 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.482 -3.107 -2.185 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.427 -3.034 -2.485 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -6.571 -3.508 -3.939 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -5.227 -4.963 -2.010 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.853 -4.938 -1.357 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -5.808 -6.269 -3.801 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.081 -6.776 -2.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -8.249 -6.254 -4.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.358 -4.783 -3.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -7.239 -4.957 -5.018 1.00 0.00 H new ATOM 115 N ARG A 372 -8.006 -0.970 -1.516 1.00 0.00 N ATOM 116 CA ARG A 372 -9.161 -0.158 -1.847 1.00 0.00 C ATOM 117 C ARG A 372 -9.207 1.037 -0.912 1.00 0.00 C ATOM 118 O ARG A 372 -9.184 2.188 -1.348 1.00 0.00 O ATOM 119 CB ARG A 372 -10.462 -0.954 -1.743 1.00 0.00 C ATOM 120 CG ARG A 372 -11.706 -0.077 -1.694 1.00 0.00 C ATOM 121 CD ARG A 372 -12.478 -0.138 -3.000 1.00 0.00 C ATOM 122 NE ARG A 372 -13.640 0.742 -2.982 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.707 0.569 -3.752 1.00 0.00 C ATOM 124 NH1 ARG A 372 -14.767 -0.463 -4.582 1.00 0.00 N ATOM 125 NH2 ARG A 372 -15.718 1.425 -3.688 1.00 0.00 N ATOM 0 H ARG A 372 -8.227 -1.846 -1.043 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.065 0.174 -2.881 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.536 -1.629 -2.596 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.429 -1.575 -0.848 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.348 -0.399 -0.874 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.418 0.954 -1.487 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -11.822 0.143 -3.824 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -12.801 -1.163 -3.184 1.00 0.00 H new ATOM 0 HE ARG A 372 -13.633 1.536 -2.341 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -13.993 -1.125 -4.629 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -15.588 -0.595 -5.173 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -15.676 2.217 -3.047 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.538 1.291 -4.280 1.00 0.00 H new ATOM 139 N GLN A 373 -9.264 0.748 0.380 1.00 0.00 N ATOM 140 CA GLN A 373 -9.308 1.787 1.397 1.00 0.00 C ATOM 141 C GLN A 373 -8.100 2.708 1.274 1.00 0.00 C ATOM 142 O GLN A 373 -8.207 3.920 1.440 1.00 0.00 O ATOM 143 CB GLN A 373 -9.348 1.142 2.779 1.00 0.00 C ATOM 144 CG GLN A 373 -9.546 2.133 3.906 1.00 0.00 C ATOM 145 CD GLN A 373 -10.628 1.702 4.878 1.00 0.00 C ATOM 146 OE1 GLN A 373 -10.391 0.887 5.770 1.00 0.00 O ATOM 147 NE2 GLN A 373 -11.825 2.251 4.708 1.00 0.00 N ATOM 0 H GLN A 373 -9.281 -0.203 0.749 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.206 2.388 1.255 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.154 0.409 2.805 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.418 0.598 2.944 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.607 2.257 4.445 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.805 3.106 3.488 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -11.976 2.922 3.955 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -12.594 2.002 5.330 1.00 0.00 H new ATOM 156 N LEU A 374 -6.955 2.112 0.974 1.00 0.00 N ATOM 157 CA LEU A 374 -5.712 2.842 0.809 1.00 0.00 C ATOM 158 C LEU A 374 -5.771 3.687 -0.457 1.00 0.00 C ATOM 159 O LEU A 374 -5.694 4.913 -0.398 1.00 0.00 O ATOM 160 CB LEU A 374 -4.541 1.861 0.753 1.00 0.00 C ATOM 161 CG LEU A 374 -3.154 2.500 0.790 1.00 0.00 C ATOM 162 CD1 LEU A 374 -2.710 2.914 -0.602 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.145 3.690 1.737 1.00 0.00 C ATOM 0 H LEU A 374 -6.864 1.105 0.838 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.566 3.508 1.660 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.627 1.169 1.591 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.627 1.270 -0.159 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.445 1.759 1.160 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -1.720 3.366 -0.549 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -2.674 2.037 -1.248 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.417 3.636 -1.010 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.150 4.135 1.753 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.868 4.431 1.397 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.410 3.358 2.741 1.00 0.00 H new ATOM 175 N TYR A 375 -5.931 3.025 -1.600 1.00 0.00 N ATOM 176 CA TYR A 375 -6.027 3.733 -2.876 1.00 0.00 C ATOM 177 C TYR A 375 -6.910 4.950 -2.697 1.00 0.00 C ATOM 178 O TYR A 375 -6.719 5.991 -3.325 1.00 0.00 O ATOM 179 CB TYR A 375 -6.618 2.827 -3.949 1.00 0.00 C ATOM 180 CG TYR A 375 -6.367 3.303 -5.363 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.207 3.993 -5.694 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.294 3.060 -6.371 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.978 4.428 -6.985 1.00 0.00 C ATOM 184 CE2 TYR A 375 -7.072 3.491 -7.665 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.913 4.174 -7.966 1.00 0.00 C ATOM 186 OH TYR A 375 -5.688 4.608 -9.253 1.00 0.00 O ATOM 0 H TYR A 375 -5.997 2.010 -1.671 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.029 4.036 -3.192 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.202 1.826 -3.834 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.693 2.746 -3.789 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.472 4.193 -4.929 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.203 2.525 -6.138 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -4.072 4.964 -7.225 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.802 3.294 -8.436 1.00 0.00 H new ATOM 0 HH TYR A 375 -6.442 4.348 -9.822 1.00 0.00 H new ATOM 196 N SER A 376 -7.872 4.790 -1.810 1.00 0.00 N ATOM 197 CA SER A 376 -8.810 5.851 -1.488 1.00 0.00 C ATOM 198 C SER A 376 -8.163 6.848 -0.528 1.00 0.00 C ATOM 199 O SER A 376 -8.212 8.059 -0.740 1.00 0.00 O ATOM 200 CB SER A 376 -10.076 5.258 -0.864 1.00 0.00 C ATOM 201 OG SER A 376 -10.803 6.243 -0.151 1.00 0.00 O ATOM 0 H SER A 376 -8.027 3.925 -1.293 1.00 0.00 H new ATOM 0 HA SER A 376 -9.083 6.375 -2.404 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.705 4.832 -1.646 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.807 4.443 -0.192 1.00 0.00 H new ATOM 0 HG SER A 376 -11.608 5.839 0.236 1.00 0.00 H new ATOM 207 N LEU A 377 -7.567 6.315 0.533 1.00 0.00 N ATOM 208 CA LEU A 377 -6.913 7.125 1.549 1.00 0.00 C ATOM 209 C LEU A 377 -5.733 7.893 0.968 1.00 0.00 C ATOM 210 O LEU A 377 -5.717 9.124 0.979 1.00 0.00 O ATOM 211 CB LEU A 377 -6.436 6.237 2.699 1.00 0.00 C ATOM 212 CG LEU A 377 -7.420 6.098 3.861 1.00 0.00 C ATOM 213 CD1 LEU A 377 -8.046 4.713 3.869 1.00 0.00 C ATOM 214 CD2 LEU A 377 -6.721 6.372 5.180 1.00 0.00 C ATOM 0 H LEU A 377 -7.525 5.312 0.711 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.639 7.847 1.923 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.220 5.244 2.305 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.498 6.639 3.083 1.00 0.00 H new ATOM 0 HG LEU A 377 -8.215 6.832 3.730 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -8.743 4.634 4.703 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -8.580 4.550 2.933 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -7.264 3.961 3.977 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.434 6.269 5.998 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -5.908 5.659 5.316 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -6.318 7.385 5.175 1.00 0.00 H new ATOM 226 N ILE A 378 -4.737 7.161 0.481 1.00 0.00 N ATOM 227 CA ILE A 378 -3.547 7.783 -0.081 1.00 0.00 C ATOM 228 C ILE A 378 -3.576 7.774 -1.606 1.00 0.00 C ATOM 229 O ILE A 378 -3.279 8.783 -2.245 1.00 0.00 O ATOM 230 CB ILE A 378 -2.306 7.005 0.395 1.00 0.00 C ATOM 231 CG1 ILE A 378 -2.064 7.245 1.881 1.00 0.00 C ATOM 232 CG2 ILE A 378 -1.083 7.377 -0.416 1.00 0.00 C ATOM 233 CD1 ILE A 378 -0.956 6.392 2.462 1.00 0.00 C ATOM 0 H ILE A 378 -4.731 6.141 0.465 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.513 8.819 0.255 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.494 5.942 0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -1.820 8.296 2.035 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -2.987 7.048 2.427 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.223 6.812 -0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -1.258 7.143 -1.466 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -0.886 8.444 -0.309 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -0.841 6.617 3.522 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.206 5.338 2.340 1.00 0.00 H new ATOM 0 HD13 ILE A 378 -0.022 6.606 1.942 1.00 0.00 H new ATOM 245 N GLY A 379 -3.898 6.618 -2.176 1.00 0.00 N ATOM 246 CA GLY A 379 -3.927 6.471 -3.620 1.00 0.00 C ATOM 247 C GLY A 379 -4.250 7.758 -4.356 1.00 0.00 C ATOM 248 O GLY A 379 -5.042 8.574 -3.886 1.00 0.00 O ATOM 0 H GLY A 379 -4.141 5.773 -1.659 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.959 6.102 -3.959 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -4.667 5.715 -3.885 1.00 0.00 H new ATOM 252 N TYR A 380 -3.628 7.929 -5.520 1.00 0.00 N ATOM 253 CA TYR A 380 -3.840 9.112 -6.345 1.00 0.00 C ATOM 254 C TYR A 380 -3.277 8.888 -7.746 1.00 0.00 C ATOM 255 O TYR A 380 -2.814 7.793 -8.069 1.00 0.00 O ATOM 256 CB TYR A 380 -3.184 10.340 -5.706 1.00 0.00 C ATOM 257 CG TYR A 380 -4.046 11.018 -4.666 1.00 0.00 C ATOM 258 CD1 TYR A 380 -5.274 11.571 -5.004 1.00 0.00 C ATOM 259 CD2 TYR A 380 -3.626 11.107 -3.345 1.00 0.00 C ATOM 260 CE1 TYR A 380 -6.062 12.195 -4.054 1.00 0.00 C ATOM 261 CE2 TYR A 380 -4.408 11.728 -2.389 1.00 0.00 C ATOM 262 CZ TYR A 380 -5.624 12.270 -2.750 1.00 0.00 C ATOM 263 OH TYR A 380 -6.406 12.890 -1.802 1.00 0.00 O ATOM 0 H TYR A 380 -2.969 7.257 -5.914 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.913 9.290 -6.419 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -2.243 10.040 -5.245 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.941 11.059 -6.488 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.619 11.513 -6.026 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.674 10.684 -3.060 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -7.015 12.621 -4.333 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -4.069 11.788 -1.365 1.00 0.00 H new ATOM 0 HH TYR A 380 -5.955 12.857 -0.933 1.00 0.00 H new ATOM 273 N ALA A 381 -3.320 9.926 -8.574 1.00 0.00 N ATOM 274 CA ALA A 381 -2.815 9.837 -9.939 1.00 0.00 C ATOM 275 C ALA A 381 -1.302 10.031 -9.984 1.00 0.00 C ATOM 276 O ALA A 381 -0.594 9.299 -10.676 1.00 0.00 O ATOM 277 CB ALA A 381 -3.500 10.851 -10.845 1.00 0.00 C ATOM 0 H ALA A 381 -3.700 10.839 -8.324 1.00 0.00 H new ATOM 0 HA ALA A 381 -3.044 8.836 -10.304 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -3.103 10.762 -11.856 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -4.573 10.661 -10.858 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -3.314 11.858 -10.470 1.00 0.00 H new ATOM 283 N SER A 382 -0.814 11.024 -9.249 1.00 0.00 N ATOM 284 CA SER A 382 0.616 11.319 -9.215 1.00 0.00 C ATOM 285 C SER A 382 1.322 10.520 -8.122 1.00 0.00 C ATOM 286 O SER A 382 2.550 10.425 -8.109 1.00 0.00 O ATOM 287 CB SER A 382 0.841 12.815 -8.994 1.00 0.00 C ATOM 288 OG SER A 382 2.219 13.110 -8.847 1.00 0.00 O ATOM 0 H SER A 382 -1.386 11.638 -8.669 1.00 0.00 H new ATOM 0 HA SER A 382 1.040 11.028 -10.176 1.00 0.00 H new ATOM 0 HB2 SER A 382 0.434 13.375 -9.836 1.00 0.00 H new ATOM 0 HB3 SER A 382 0.300 13.139 -8.105 1.00 0.00 H new ATOM 0 HG SER A 382 2.690 12.317 -8.517 1.00 0.00 H new ATOM 294 N LEU A 383 0.547 9.950 -7.206 1.00 0.00 N ATOM 295 CA LEU A 383 1.110 9.167 -6.112 1.00 0.00 C ATOM 296 C LEU A 383 1.496 7.765 -6.576 1.00 0.00 C ATOM 297 O LEU A 383 2.220 7.049 -5.885 1.00 0.00 O ATOM 298 CB LEU A 383 0.104 9.073 -4.969 1.00 0.00 C ATOM 299 CG LEU A 383 0.425 8.020 -3.913 1.00 0.00 C ATOM 300 CD1 LEU A 383 0.280 8.607 -2.523 1.00 0.00 C ATOM 301 CD2 LEU A 383 -0.476 6.807 -4.078 1.00 0.00 C ATOM 0 H LEU A 383 -0.471 10.015 -7.199 1.00 0.00 H new ATOM 0 HA LEU A 383 2.012 9.671 -5.765 1.00 0.00 H new ATOM 0 HB2 LEU A 383 0.038 10.046 -4.482 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -0.879 8.859 -5.387 1.00 0.00 H new ATOM 0 HG LEU A 383 1.458 7.699 -4.047 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.512 7.844 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 383 0.967 9.446 -2.409 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -0.743 8.954 -2.379 1.00 0.00 H new ATOM 0 HD21 LEU A 383 -0.232 6.067 -3.316 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -1.517 7.110 -3.970 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.325 6.373 -5.067 1.00 0.00 H new ATOM 313 N ARG A 384 1.017 7.395 -7.758 1.00 0.00 N ATOM 314 CA ARG A 384 1.300 6.090 -8.355 1.00 0.00 C ATOM 315 C ARG A 384 1.666 5.025 -7.320 1.00 0.00 C ATOM 316 O ARG A 384 2.764 4.469 -7.368 1.00 0.00 O ATOM 317 CB ARG A 384 2.436 6.215 -9.371 1.00 0.00 C ATOM 318 CG ARG A 384 2.279 5.298 -10.572 1.00 0.00 C ATOM 319 CD ARG A 384 2.650 3.863 -10.230 1.00 0.00 C ATOM 320 NE ARG A 384 2.456 2.963 -11.363 1.00 0.00 N ATOM 321 CZ ARG A 384 3.027 1.766 -11.459 1.00 0.00 C ATOM 322 NH1 ARG A 384 3.824 1.331 -10.493 1.00 0.00 N ATOM 323 NH2 ARG A 384 2.802 1.004 -12.521 1.00 0.00 N ATOM 0 H ARG A 384 0.420 7.990 -8.332 1.00 0.00 H new ATOM 0 HA ARG A 384 0.381 5.767 -8.845 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.491 7.247 -9.717 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.381 5.993 -8.876 1.00 0.00 H new ATOM 0 HG2 ARG A 384 1.249 5.334 -10.926 1.00 0.00 H new ATOM 0 HG3 ARG A 384 2.909 5.653 -11.387 1.00 0.00 H new ATOM 0 HD2 ARG A 384 3.691 3.824 -9.910 1.00 0.00 H new ATOM 0 HD3 ARG A 384 2.046 3.523 -9.389 1.00 0.00 H new ATOM 0 HE ARG A 384 1.849 3.269 -12.123 1.00 0.00 H new ATOM 0 HH11 ARG A 384 4.000 1.915 -9.675 1.00 0.00 H new ATOM 0 HH12 ARG A 384 4.262 0.413 -10.568 1.00 0.00 H new ATOM 0 HH21 ARG A 384 2.190 1.336 -13.266 1.00 0.00 H new ATOM 0 HH22 ARG A 384 3.241 0.086 -12.592 1.00 0.00 H new ATOM 337 N LEU A 385 0.747 4.712 -6.408 1.00 0.00 N ATOM 338 CA LEU A 385 1.009 3.681 -5.415 1.00 0.00 C ATOM 339 C LEU A 385 1.004 2.318 -6.096 1.00 0.00 C ATOM 340 O LEU A 385 0.346 2.138 -7.120 1.00 0.00 O ATOM 341 CB LEU A 385 -0.021 3.740 -4.283 1.00 0.00 C ATOM 342 CG LEU A 385 -1.473 3.915 -4.720 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.799 3.024 -5.907 1.00 0.00 C ATOM 344 CD2 LEU A 385 -2.397 3.615 -3.556 1.00 0.00 C ATOM 0 H LEU A 385 -0.171 5.152 -6.339 1.00 0.00 H new ATOM 0 HA LEU A 385 1.989 3.850 -4.968 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.056 2.823 -3.698 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.242 4.564 -3.620 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.619 4.949 -5.034 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.840 3.170 -6.196 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.150 3.281 -6.744 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.641 1.981 -5.633 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.433 3.741 -3.872 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.241 2.589 -3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -2.182 4.299 -2.735 1.00 0.00 H new ATOM 356 N HIS A 386 1.746 1.359 -5.549 1.00 0.00 N ATOM 357 CA HIS A 386 1.816 0.029 -6.144 1.00 0.00 C ATOM 358 C HIS A 386 2.135 -1.023 -5.086 1.00 0.00 C ATOM 359 O HIS A 386 2.493 -0.691 -3.957 1.00 0.00 O ATOM 360 CB HIS A 386 2.878 0.006 -7.247 1.00 0.00 C ATOM 361 CG HIS A 386 3.307 -1.372 -7.648 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.301 -2.071 -6.994 1.00 0.00 N ATOM 363 CD2 HIS A 386 2.880 -2.178 -8.649 1.00 0.00 C ATOM 364 CE1 HIS A 386 4.465 -3.246 -7.575 1.00 0.00 C ATOM 365 NE2 HIS A 386 3.615 -3.336 -8.580 1.00 0.00 N ATOM 0 H HIS A 386 2.302 1.477 -4.702 1.00 0.00 H new ATOM 0 HA HIS A 386 0.844 -0.207 -6.577 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.489 0.524 -8.123 1.00 0.00 H new ATOM 0 HB3 HIS A 386 3.751 0.564 -6.909 1.00 0.00 H new ATOM 0 HD2 HIS A 386 2.106 -1.952 -9.367 1.00 0.00 H new ATOM 0 HE1 HIS A 386 5.174 -4.004 -7.278 1.00 0.00 H new ATOM 0 HE2 HIS A 386 3.519 -4.136 -9.205 1.00 0.00 H new ATOM 374 N TYR A 387 1.999 -2.292 -5.458 1.00 0.00 N ATOM 375 CA TYR A 387 2.271 -3.389 -4.536 1.00 0.00 C ATOM 376 C TYR A 387 3.343 -4.320 -5.095 1.00 0.00 C ATOM 377 O TYR A 387 3.163 -4.942 -6.141 1.00 0.00 O ATOM 378 CB TYR A 387 0.981 -4.162 -4.250 1.00 0.00 C ATOM 379 CG TYR A 387 -0.177 -3.261 -3.880 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.932 -2.632 -4.862 1.00 0.00 C ATOM 381 CD2 TYR A 387 -0.508 -3.028 -2.550 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.984 -1.800 -4.531 1.00 0.00 C ATOM 383 CE2 TYR A 387 -1.556 -2.197 -2.212 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.291 -1.585 -3.204 1.00 0.00 C ATOM 385 OH TYR A 387 -3.337 -0.756 -2.869 1.00 0.00 O ATOM 0 H TYR A 387 1.703 -2.586 -6.389 1.00 0.00 H new ATOM 0 HA TYR A 387 2.647 -2.971 -3.602 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.712 -4.748 -5.129 1.00 0.00 H new ATOM 0 HB3 TYR A 387 1.159 -4.868 -3.439 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -0.692 -2.796 -5.902 1.00 0.00 H new ATOM 0 HD2 TYR A 387 0.065 -3.505 -1.769 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.563 -1.321 -5.307 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -1.800 -2.027 -1.174 1.00 0.00 H new ATOM 0 HH TYR A 387 -3.596 -0.224 -3.650 1.00 0.00 H new ATOM 395 N VAL A 388 4.459 -4.396 -4.381 1.00 0.00 N ATOM 396 CA VAL A 388 5.583 -5.234 -4.782 1.00 0.00 C ATOM 397 C VAL A 388 5.663 -6.490 -3.926 1.00 0.00 C ATOM 398 O VAL A 388 5.731 -6.406 -2.703 1.00 0.00 O ATOM 399 CB VAL A 388 6.904 -4.465 -4.646 1.00 0.00 C ATOM 400 CG1 VAL A 388 7.000 -3.839 -3.263 1.00 0.00 C ATOM 401 CG2 VAL A 388 8.088 -5.381 -4.909 1.00 0.00 C ATOM 0 H VAL A 388 4.611 -3.882 -3.513 1.00 0.00 H new ATOM 0 HA VAL A 388 5.423 -5.516 -5.823 1.00 0.00 H new ATOM 0 HB VAL A 388 6.926 -3.669 -5.390 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.940 -3.295 -3.174 1.00 0.00 H new ATOM 0 HG12 VAL A 388 6.167 -3.151 -3.117 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.961 -4.622 -2.506 1.00 0.00 H new ATOM 0 HG21 VAL A 388 9.015 -4.816 -4.808 1.00 0.00 H new ATOM 0 HG22 VAL A 388 8.081 -6.200 -4.189 1.00 0.00 H new ATOM 0 HG23 VAL A 388 8.018 -5.785 -5.919 1.00 0.00 H new ATOM 411 N THR A 389 5.661 -7.653 -4.567 1.00 0.00 N ATOM 412 CA THR A 389 5.737 -8.916 -3.842 1.00 0.00 C ATOM 413 C THR A 389 7.182 -9.374 -3.668 1.00 0.00 C ATOM 414 O THR A 389 7.903 -9.580 -4.644 1.00 0.00 O ATOM 415 CB THR A 389 4.944 -10.028 -4.551 1.00 0.00 C ATOM 416 OG1 THR A 389 3.585 -9.635 -4.785 1.00 0.00 O ATOM 417 CG2 THR A 389 4.942 -11.304 -3.720 1.00 0.00 C ATOM 0 H THR A 389 5.608 -7.748 -5.581 1.00 0.00 H new ATOM 0 HA THR A 389 5.296 -8.734 -2.862 1.00 0.00 H new ATOM 0 HB THR A 389 5.436 -10.208 -5.507 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.303 -9.944 -5.671 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.376 -12.076 -4.241 1.00 0.00 H new ATOM 0 HG22 THR A 389 5.967 -11.643 -3.572 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.482 -11.107 -2.752 1.00 0.00 H new ATOM 425 N VAL A 390 7.590 -9.544 -2.415 1.00 0.00 N ATOM 426 CA VAL A 390 8.940 -9.995 -2.099 1.00 0.00 C ATOM 427 C VAL A 390 8.981 -11.514 -2.020 1.00 0.00 C ATOM 428 O VAL A 390 9.890 -12.154 -2.549 1.00 0.00 O ATOM 429 CB VAL A 390 9.451 -9.414 -0.762 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.722 -8.613 -0.979 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.389 -8.556 -0.089 1.00 0.00 C ATOM 0 H VAL A 390 7.002 -9.375 -1.599 1.00 0.00 H new ATOM 0 HA VAL A 390 9.589 -9.638 -2.899 1.00 0.00 H new ATOM 0 HB VAL A 390 9.675 -10.250 -0.100 1.00 0.00 H new ATOM 0 HG11 VAL A 390 11.066 -8.212 -0.026 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.492 -9.259 -1.400 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.521 -7.792 -1.667 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.780 -8.162 0.849 1.00 0.00 H new ATOM 0 HG22 VAL A 390 8.120 -7.729 -0.746 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.505 -9.162 0.112 1.00 0.00 H new ATOM 441 N LYS A 391 7.980 -12.082 -1.359 1.00 0.00 N ATOM 442 CA LYS A 391 7.881 -13.527 -1.212 1.00 0.00 C ATOM 443 C LYS A 391 6.434 -13.986 -1.368 1.00 0.00 C ATOM 444 O LYS A 391 5.498 -13.202 -1.199 1.00 0.00 O ATOM 445 CB LYS A 391 8.470 -13.978 0.138 1.00 0.00 C ATOM 446 CG LYS A 391 7.452 -14.447 1.168 1.00 0.00 C ATOM 447 CD LYS A 391 8.094 -15.356 2.202 1.00 0.00 C ATOM 448 CE LYS A 391 8.418 -16.721 1.613 1.00 0.00 C ATOM 449 NZ LYS A 391 9.634 -17.320 2.230 1.00 0.00 N ATOM 0 H LYS A 391 7.223 -11.561 -0.915 1.00 0.00 H new ATOM 0 HA LYS A 391 8.466 -13.996 -2.003 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.177 -14.788 -0.045 1.00 0.00 H new ATOM 0 HB3 LYS A 391 9.037 -13.150 0.563 1.00 0.00 H new ATOM 0 HG2 LYS A 391 7.009 -13.584 1.664 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.642 -14.977 0.667 1.00 0.00 H new ATOM 0 HD2 LYS A 391 9.007 -14.894 2.579 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.422 -15.475 3.052 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.570 -17.390 1.760 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.566 -16.626 0.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.819 -18.249 1.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 10.449 -16.695 2.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 9.484 -17.435 3.253 1.00 0.00 H new ATOM 463 N LYS A 392 6.264 -15.258 -1.697 1.00 0.00 N ATOM 464 CA LYS A 392 4.940 -15.838 -1.888 1.00 0.00 C ATOM 465 C LYS A 392 4.861 -17.213 -1.240 1.00 0.00 C ATOM 466 O LYS A 392 5.871 -17.759 -0.797 1.00 0.00 O ATOM 467 CB LYS A 392 4.621 -15.952 -3.381 1.00 0.00 C ATOM 468 CG LYS A 392 5.785 -15.577 -4.286 1.00 0.00 C ATOM 469 CD LYS A 392 6.818 -16.690 -4.357 1.00 0.00 C ATOM 470 CE LYS A 392 8.089 -16.228 -5.051 1.00 0.00 C ATOM 471 NZ LYS A 392 8.240 -16.845 -6.397 1.00 0.00 N ATOM 0 H LYS A 392 7.032 -15.914 -1.839 1.00 0.00 H new ATOM 0 HA LYS A 392 4.208 -15.183 -1.415 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.316 -16.975 -3.601 1.00 0.00 H new ATOM 0 HB3 LYS A 392 3.771 -15.310 -3.612 1.00 0.00 H new ATOM 0 HG2 LYS A 392 5.413 -15.360 -5.287 1.00 0.00 H new ATOM 0 HG3 LYS A 392 6.255 -14.666 -3.916 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.056 -17.032 -3.350 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.400 -17.542 -4.892 1.00 0.00 H new ATOM 0 HE2 LYS A 392 8.076 -15.142 -5.148 1.00 0.00 H new ATOM 0 HE3 LYS A 392 8.952 -16.482 -4.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 9.118 -16.505 -6.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 8.278 -17.880 -6.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 7.429 -16.582 -6.993 1.00 0.00 H new ATOM 485 N PRO A 393 3.657 -17.798 -1.183 1.00 0.00 N ATOM 486 CA PRO A 393 3.461 -19.123 -0.595 1.00 0.00 C ATOM 487 C PRO A 393 4.161 -20.201 -1.412 1.00 0.00 C ATOM 488 O PRO A 393 4.035 -20.246 -2.635 1.00 0.00 O ATOM 489 CB PRO A 393 1.943 -19.316 -0.637 1.00 0.00 C ATOM 490 CG PRO A 393 1.472 -18.406 -1.718 1.00 0.00 C ATOM 491 CD PRO A 393 2.403 -17.226 -1.698 1.00 0.00 C ATOM 0 HA PRO A 393 3.875 -19.198 0.410 1.00 0.00 H new ATOM 0 HB2 PRO A 393 1.682 -20.352 -0.851 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.486 -19.063 0.320 1.00 0.00 H new ATOM 0 HG2 PRO A 393 1.495 -18.905 -2.687 1.00 0.00 H new ATOM 0 HG3 PRO A 393 0.442 -18.094 -1.545 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.533 -16.799 -2.692 1.00 0.00 H new ATOM 0 HD3 PRO A 393 2.030 -16.429 -1.055 1.00 0.00 H new ATOM 499 N THR A 394 4.905 -21.063 -0.733 1.00 0.00 N ATOM 500 CA THR A 394 5.631 -22.132 -1.400 1.00 0.00 C ATOM 501 C THR A 394 5.664 -23.392 -0.542 1.00 0.00 C ATOM 502 O THR A 394 5.571 -23.322 0.683 1.00 0.00 O ATOM 503 CB THR A 394 7.073 -21.702 -1.726 1.00 0.00 C ATOM 504 OG1 THR A 394 7.982 -22.102 -0.693 1.00 0.00 O ATOM 505 CG2 THR A 394 7.163 -20.191 -1.890 1.00 0.00 C ATOM 0 H THR A 394 5.021 -21.042 0.280 1.00 0.00 H new ATOM 0 HA THR A 394 5.104 -22.348 -2.329 1.00 0.00 H new ATOM 0 HB THR A 394 7.348 -22.193 -2.659 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.173 -21.337 -0.111 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.191 -19.911 -2.120 1.00 0.00 H new ATOM 0 HG22 THR A 394 6.510 -19.874 -2.703 1.00 0.00 H new ATOM 0 HG23 THR A 394 6.853 -19.705 -0.965 1.00 0.00 H new ATOM 513 N ALA A 395 5.795 -24.543 -1.193 1.00 0.00 N ATOM 514 CA ALA A 395 5.837 -25.817 -0.485 1.00 0.00 C ATOM 515 C ALA A 395 6.727 -25.725 0.748 1.00 0.00 C ATOM 516 O ALA A 395 6.347 -26.161 1.835 1.00 0.00 O ATOM 517 CB ALA A 395 6.315 -26.934 -1.400 1.00 0.00 C ATOM 0 H ALA A 395 5.874 -24.620 -2.207 1.00 0.00 H new ATOM 0 HA ALA A 395 4.823 -26.050 -0.161 1.00 0.00 H new ATOM 0 HB1 ALA A 395 6.337 -27.873 -0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 395 5.635 -27.027 -2.246 1.00 0.00 H new ATOM 0 HB3 ALA A 395 7.316 -26.703 -1.763 1.00 0.00 H new ATOM 523 N VAL A 396 7.913 -25.154 0.573 1.00 0.00 N ATOM 524 CA VAL A 396 8.857 -25.003 1.670 1.00 0.00 C ATOM 525 C VAL A 396 8.380 -23.948 2.663 1.00 0.00 C ATOM 526 O VAL A 396 8.564 -24.090 3.872 1.00 0.00 O ATOM 527 CB VAL A 396 10.260 -24.626 1.148 1.00 0.00 C ATOM 528 CG1 VAL A 396 10.547 -25.335 -0.167 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.404 -23.116 0.987 1.00 0.00 C ATOM 0 H VAL A 396 8.243 -24.788 -0.320 1.00 0.00 H new ATOM 0 HA VAL A 396 8.918 -25.965 2.180 1.00 0.00 H new ATOM 0 HB VAL A 396 10.992 -24.953 1.887 1.00 0.00 H new ATOM 0 HG11 VAL A 396 11.540 -25.058 -0.521 1.00 0.00 H new ATOM 0 HG12 VAL A 396 10.504 -26.414 -0.016 1.00 0.00 H new ATOM 0 HG13 VAL A 396 9.803 -25.042 -0.908 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.403 -22.883 0.618 1.00 0.00 H new ATOM 0 HG22 VAL A 396 9.661 -22.753 0.277 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.251 -22.631 1.951 1.00 0.00 H new ATOM 539 N ASP A 397 7.771 -22.888 2.142 1.00 0.00 N ATOM 540 CA ASP A 397 7.273 -21.805 2.981 1.00 0.00 C ATOM 541 C ASP A 397 6.026 -21.167 2.373 1.00 0.00 C ATOM 542 O ASP A 397 6.115 -20.408 1.408 1.00 0.00 O ATOM 543 CB ASP A 397 8.356 -20.743 3.175 1.00 0.00 C ATOM 544 CG ASP A 397 9.377 -21.142 4.221 1.00 0.00 C ATOM 545 OD1 ASP A 397 9.016 -21.190 5.416 1.00 0.00 O ATOM 546 OD2 ASP A 397 10.540 -21.406 3.847 1.00 0.00 O ATOM 0 H ASP A 397 7.611 -22.756 1.143 1.00 0.00 H new ATOM 0 HA ASP A 397 7.006 -22.227 3.950 1.00 0.00 H new ATOM 0 HB2 ASP A 397 8.862 -20.567 2.226 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.890 -19.802 3.467 1.00 0.00 H new ATOM 551 N PRO A 398 4.845 -21.464 2.936 1.00 0.00 N ATOM 552 CA PRO A 398 3.576 -20.918 2.452 1.00 0.00 C ATOM 553 C PRO A 398 3.330 -19.492 2.941 1.00 0.00 C ATOM 554 O PRO A 398 2.228 -19.159 3.374 1.00 0.00 O ATOM 555 CB PRO A 398 2.547 -21.870 3.052 1.00 0.00 C ATOM 556 CG PRO A 398 3.165 -22.328 4.329 1.00 0.00 C ATOM 557 CD PRO A 398 4.654 -22.362 4.091 1.00 0.00 C ATOM 0 HA PRO A 398 3.544 -20.852 1.365 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.596 -21.367 3.229 1.00 0.00 H new ATOM 0 HB3 PRO A 398 2.345 -22.708 2.385 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.917 -21.650 5.146 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.793 -23.314 4.609 1.00 0.00 H new ATOM 0 HD2 PRO A 398 5.207 -22.015 4.964 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.002 -23.372 3.875 1.00 0.00 H new ATOM 565 N ASN A 399 4.363 -18.657 2.872 1.00 0.00 N ATOM 566 CA ASN A 399 4.253 -17.271 3.313 1.00 0.00 C ATOM 567 C ASN A 399 4.578 -16.297 2.184 1.00 0.00 C ATOM 568 O ASN A 399 5.407 -16.583 1.319 1.00 0.00 O ATOM 569 CB ASN A 399 5.184 -17.016 4.499 1.00 0.00 C ATOM 570 CG ASN A 399 5.449 -18.271 5.308 1.00 0.00 C ATOM 571 OD1 ASN A 399 6.478 -18.925 5.141 1.00 0.00 O ATOM 572 ND2 ASN A 399 4.518 -18.613 6.191 1.00 0.00 N ATOM 0 H ASN A 399 5.283 -18.916 2.516 1.00 0.00 H new ATOM 0 HA ASN A 399 3.220 -17.104 3.620 1.00 0.00 H new ATOM 0 HB2 ASN A 399 6.130 -16.616 4.135 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.744 -16.257 5.146 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.641 -19.448 6.764 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.680 -18.041 6.296 1.00 0.00 H new ATOM 579 N SER A 400 3.918 -15.144 2.207 1.00 0.00 N ATOM 580 CA SER A 400 4.126 -14.112 1.198 1.00 0.00 C ATOM 581 C SER A 400 4.435 -12.768 1.852 1.00 0.00 C ATOM 582 O SER A 400 4.094 -12.535 3.012 1.00 0.00 O ATOM 583 CB SER A 400 2.892 -13.983 0.302 1.00 0.00 C ATOM 584 OG SER A 400 3.185 -13.238 -0.868 1.00 0.00 O ATOM 0 H SER A 400 3.230 -14.900 2.919 1.00 0.00 H new ATOM 0 HA SER A 400 4.979 -14.406 0.587 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.535 -14.975 0.025 1.00 0.00 H new ATOM 0 HB3 SER A 400 2.087 -13.497 0.854 1.00 0.00 H new ATOM 0 HG SER A 400 4.145 -13.042 -0.899 1.00 0.00 H new ATOM 590 N ILE A 401 5.074 -11.887 1.094 1.00 0.00 N ATOM 591 CA ILE A 401 5.422 -10.554 1.579 1.00 0.00 C ATOM 592 C ILE A 401 5.247 -9.536 0.463 1.00 0.00 C ATOM 593 O ILE A 401 5.594 -9.816 -0.683 1.00 0.00 O ATOM 594 CB ILE A 401 6.882 -10.487 2.081 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.092 -11.424 3.271 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.242 -9.059 2.461 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.332 -12.282 3.154 1.00 0.00 C ATOM 0 H ILE A 401 5.364 -12.072 0.134 1.00 0.00 H new ATOM 0 HA ILE A 401 4.757 -10.329 2.413 1.00 0.00 H new ATOM 0 HB ILE A 401 7.538 -10.812 1.273 1.00 0.00 H new ATOM 0 HG12 ILE A 401 7.155 -10.831 4.183 1.00 0.00 H new ATOM 0 HG13 ILE A 401 6.221 -12.071 3.372 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.273 -9.025 2.813 1.00 0.00 H new ATOM 0 HG22 ILE A 401 7.135 -8.413 1.590 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.577 -8.714 3.253 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.417 -12.921 4.033 1.00 0.00 H new ATOM 0 HD12 ILE A 401 8.263 -12.902 2.260 1.00 0.00 H new ATOM 0 HD13 ILE A 401 9.212 -11.642 3.084 1.00 0.00 H new ATOM 609 N VAL A 402 4.715 -8.356 0.773 1.00 0.00 N ATOM 610 CA VAL A 402 4.522 -7.332 -0.241 1.00 0.00 C ATOM 611 C VAL A 402 4.745 -5.941 0.345 1.00 0.00 C ATOM 612 O VAL A 402 4.486 -5.702 1.524 1.00 0.00 O ATOM 613 CB VAL A 402 3.110 -7.401 -0.852 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.851 -6.197 -1.744 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.923 -8.697 -1.625 1.00 0.00 C ATOM 0 H VAL A 402 4.413 -8.090 1.710 1.00 0.00 H new ATOM 0 HA VAL A 402 5.254 -7.519 -1.027 1.00 0.00 H new ATOM 0 HB VAL A 402 2.384 -7.383 -0.039 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.848 -6.265 -2.166 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.936 -5.283 -1.156 1.00 0.00 H new ATOM 0 HG13 VAL A 402 3.583 -6.178 -2.551 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.919 -8.726 -2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.658 -8.751 -2.428 1.00 0.00 H new ATOM 0 HG23 VAL A 402 3.058 -9.544 -0.953 1.00 0.00 H new ATOM 625 N GLU A 403 5.228 -5.030 -0.488 1.00 0.00 N ATOM 626 CA GLU A 403 5.491 -3.659 -0.063 1.00 0.00 C ATOM 627 C GLU A 403 4.728 -2.663 -0.929 1.00 0.00 C ATOM 628 O GLU A 403 4.913 -2.615 -2.145 1.00 0.00 O ATOM 629 CB GLU A 403 6.991 -3.359 -0.129 1.00 0.00 C ATOM 630 CG GLU A 403 7.871 -4.590 0.016 1.00 0.00 C ATOM 631 CD GLU A 403 9.232 -4.411 -0.627 1.00 0.00 C ATOM 632 OE1 GLU A 403 9.416 -3.418 -1.362 1.00 0.00 O ATOM 633 OE2 GLU A 403 10.114 -5.264 -0.397 1.00 0.00 O ATOM 0 H GLU A 403 5.447 -5.215 -1.467 1.00 0.00 H new ATOM 0 HA GLU A 403 5.150 -3.556 0.967 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.214 -2.875 -1.080 1.00 0.00 H new ATOM 0 HB3 GLU A 403 7.245 -2.648 0.657 1.00 0.00 H new ATOM 0 HG2 GLU A 403 8.000 -4.818 1.074 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.370 -5.446 -0.435 1.00 0.00 H new ATOM 640 N CYS A 404 3.869 -1.866 -0.301 1.00 0.00 N ATOM 641 CA CYS A 404 3.090 -0.878 -1.026 1.00 0.00 C ATOM 642 C CYS A 404 3.917 0.375 -1.299 1.00 0.00 C ATOM 643 O CYS A 404 4.052 1.236 -0.430 1.00 0.00 O ATOM 644 CB CYS A 404 1.858 -0.496 -0.208 1.00 0.00 C ATOM 645 SG CYS A 404 0.661 -1.834 -0.002 1.00 0.00 S ATOM 0 H CYS A 404 3.698 -1.887 0.704 1.00 0.00 H new ATOM 0 HA CYS A 404 2.787 -1.313 -1.979 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.180 -0.157 0.777 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.364 0.348 -0.689 1.00 0.00 H new ATOM 0 HG CYS A 404 -0.020 -1.980 -1.100 1.00 0.00 H new ATOM 651 N ARG A 405 4.479 0.473 -2.501 1.00 0.00 N ATOM 652 CA ARG A 405 5.298 1.626 -2.863 1.00 0.00 C ATOM 653 C ARG A 405 4.451 2.719 -3.500 1.00 0.00 C ATOM 654 O ARG A 405 3.226 2.613 -3.566 1.00 0.00 O ATOM 655 CB ARG A 405 6.421 1.209 -3.820 1.00 0.00 C ATOM 656 CG ARG A 405 6.535 -0.294 -4.018 1.00 0.00 C ATOM 657 CD ARG A 405 7.972 -0.714 -4.278 1.00 0.00 C ATOM 658 NE ARG A 405 8.781 0.386 -4.801 1.00 0.00 N ATOM 659 CZ ARG A 405 8.925 0.647 -6.098 1.00 0.00 C ATOM 660 NH1 ARG A 405 8.298 -0.096 -7.002 1.00 0.00 N ATOM 661 NH2 ARG A 405 9.692 1.654 -6.492 1.00 0.00 N ATOM 0 H ARG A 405 4.383 -0.227 -3.236 1.00 0.00 H new ATOM 0 HA ARG A 405 5.741 2.022 -1.949 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.254 1.682 -4.788 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.369 1.588 -3.439 1.00 0.00 H new ATOM 0 HG2 ARG A 405 6.159 -0.808 -3.133 1.00 0.00 H new ATOM 0 HG3 ARG A 405 5.908 -0.600 -4.855 1.00 0.00 H new ATOM 0 HD2 ARG A 405 8.415 -1.081 -3.352 1.00 0.00 H new ATOM 0 HD3 ARG A 405 7.985 -1.542 -4.987 1.00 0.00 H new ATOM 0 HE ARG A 405 9.263 0.988 -4.133 1.00 0.00 H new ATOM 0 HH11 ARG A 405 7.704 -0.869 -6.703 1.00 0.00 H new ATOM 0 HH12 ARG A 405 8.410 0.107 -7.995 1.00 0.00 H new ATOM 0 HH21 ARG A 405 10.173 2.230 -5.801 1.00 0.00 H new ATOM 0 HH22 ARG A 405 9.802 1.853 -7.486 1.00 0.00 H new ATOM 675 N VAL A 406 5.114 3.769 -3.967 1.00 0.00 N ATOM 676 CA VAL A 406 4.425 4.887 -4.601 1.00 0.00 C ATOM 677 C VAL A 406 5.355 5.655 -5.536 1.00 0.00 C ATOM 678 O VAL A 406 6.574 5.613 -5.386 1.00 0.00 O ATOM 679 CB VAL A 406 3.841 5.852 -3.551 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.345 5.626 -3.395 1.00 0.00 C ATOM 681 CG2 VAL A 406 4.549 5.685 -2.214 1.00 0.00 C ATOM 0 H VAL A 406 6.128 3.871 -3.919 1.00 0.00 H new ATOM 0 HA VAL A 406 3.608 4.465 -5.186 1.00 0.00 H new ATOM 0 HB VAL A 406 4.002 6.873 -3.897 1.00 0.00 H new ATOM 0 HG11 VAL A 406 1.949 6.316 -2.650 1.00 0.00 H new ATOM 0 HG12 VAL A 406 1.849 5.800 -4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.164 4.601 -3.073 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.121 6.376 -1.487 1.00 0.00 H new ATOM 0 HG22 VAL A 406 4.422 4.662 -1.861 1.00 0.00 H new ATOM 0 HG23 VAL A 406 5.611 5.898 -2.336 1.00 0.00 H new ATOM 691 N GLY A 407 4.763 6.350 -6.503 1.00 0.00 N ATOM 692 CA GLY A 407 5.544 7.114 -7.458 1.00 0.00 C ATOM 693 C GLY A 407 6.722 7.825 -6.821 1.00 0.00 C ATOM 694 O GLY A 407 7.722 8.098 -7.488 1.00 0.00 O ATOM 0 H GLY A 407 3.754 6.397 -6.642 1.00 0.00 H new ATOM 0 HA2 GLY A 407 5.908 6.446 -8.239 1.00 0.00 H new ATOM 0 HA3 GLY A 407 4.900 7.849 -7.941 1.00 0.00 H new ATOM 698 N ASP A 408 6.609 8.129 -5.532 1.00 0.00 N ATOM 699 CA ASP A 408 7.675 8.816 -4.811 1.00 0.00 C ATOM 700 C ASP A 408 8.874 7.897 -4.583 1.00 0.00 C ATOM 701 O ASP A 408 9.878 8.307 -4.001 1.00 0.00 O ATOM 702 CB ASP A 408 7.157 9.339 -3.470 1.00 0.00 C ATOM 703 CG ASP A 408 6.508 10.703 -3.592 1.00 0.00 C ATOM 704 OD1 ASP A 408 5.283 10.759 -3.836 1.00 0.00 O ATOM 705 OD2 ASP A 408 7.223 11.716 -3.445 1.00 0.00 O ATOM 0 H ASP A 408 5.790 7.910 -4.965 1.00 0.00 H new ATOM 0 HA ASP A 408 8.002 9.657 -5.423 1.00 0.00 H new ATOM 0 HB2 ASP A 408 6.435 8.632 -3.062 1.00 0.00 H new ATOM 0 HB3 ASP A 408 7.984 9.395 -2.762 1.00 0.00 H new ATOM 710 N GLY A 409 8.764 6.654 -5.041 1.00 0.00 N ATOM 711 CA GLY A 409 9.848 5.705 -4.872 1.00 0.00 C ATOM 712 C GLY A 409 9.970 5.214 -3.443 1.00 0.00 C ATOM 713 O GLY A 409 10.844 4.404 -3.131 1.00 0.00 O ATOM 0 H GLY A 409 7.945 6.288 -5.525 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.688 4.853 -5.533 1.00 0.00 H new ATOM 0 HA3 GLY A 409 10.786 6.171 -5.174 1.00 0.00 H new ATOM 717 N THR A 410 9.093 5.703 -2.572 1.00 0.00 N ATOM 718 CA THR A 410 9.109 5.306 -1.172 1.00 0.00 C ATOM 719 C THR A 410 8.025 4.272 -0.883 1.00 0.00 C ATOM 720 O THR A 410 6.977 4.256 -1.529 1.00 0.00 O ATOM 721 CB THR A 410 8.905 6.518 -0.242 1.00 0.00 C ATOM 722 OG1 THR A 410 9.196 6.184 1.120 1.00 0.00 O ATOM 723 CG2 THR A 410 7.474 7.030 -0.316 1.00 0.00 C ATOM 0 H THR A 410 8.364 6.374 -2.813 1.00 0.00 H new ATOM 0 HA THR A 410 10.088 4.869 -0.978 1.00 0.00 H new ATOM 0 HB THR A 410 9.592 7.293 -0.581 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.060 6.972 1.686 1.00 0.00 H new ATOM 0 HG21 THR A 410 7.359 7.885 0.350 1.00 0.00 H new ATOM 0 HG22 THR A 410 7.249 7.333 -1.338 1.00 0.00 H new ATOM 0 HG23 THR A 410 6.788 6.239 -0.013 1.00 0.00 H new ATOM 731 N VAL A 411 8.284 3.414 0.096 1.00 0.00 N ATOM 732 CA VAL A 411 7.330 2.380 0.480 1.00 0.00 C ATOM 733 C VAL A 411 6.402 2.890 1.576 1.00 0.00 C ATOM 734 O VAL A 411 6.823 3.073 2.717 1.00 0.00 O ATOM 735 CB VAL A 411 8.048 1.112 0.978 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.043 0.014 1.283 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.073 0.638 -0.042 1.00 0.00 C ATOM 0 H VAL A 411 9.147 3.413 0.639 1.00 0.00 H new ATOM 0 HA VAL A 411 6.748 2.129 -0.407 1.00 0.00 H new ATOM 0 HB VAL A 411 8.576 1.357 1.900 1.00 0.00 H new ATOM 0 HG11 VAL A 411 7.569 -0.874 1.633 1.00 0.00 H new ATOM 0 HG12 VAL A 411 6.354 0.356 2.055 1.00 0.00 H new ATOM 0 HG13 VAL A 411 6.484 -0.229 0.379 1.00 0.00 H new ATOM 0 HG21 VAL A 411 9.569 -0.259 0.330 1.00 0.00 H new ATOM 0 HG22 VAL A 411 8.572 0.412 -0.983 1.00 0.00 H new ATOM 0 HG23 VAL A 411 9.814 1.421 -0.204 1.00 0.00 H new ATOM 747 N LEU A 412 5.143 3.131 1.223 1.00 0.00 N ATOM 748 CA LEU A 412 4.175 3.634 2.192 1.00 0.00 C ATOM 749 C LEU A 412 3.631 2.515 3.070 1.00 0.00 C ATOM 750 O LEU A 412 3.246 2.753 4.215 1.00 0.00 O ATOM 751 CB LEU A 412 3.019 4.372 1.499 1.00 0.00 C ATOM 752 CG LEU A 412 2.370 3.658 0.314 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.333 2.656 0.793 1.00 0.00 C ATOM 754 CD2 LEU A 412 1.727 4.679 -0.612 1.00 0.00 C ATOM 0 H LEU A 412 4.772 2.988 0.284 1.00 0.00 H new ATOM 0 HA LEU A 412 4.703 4.343 2.829 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.247 4.572 2.242 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.388 5.338 1.155 1.00 0.00 H new ATOM 0 HG LEU A 412 3.141 3.115 -0.232 1.00 0.00 H new ATOM 0 HD11 LEU A 412 0.883 2.159 -0.066 1.00 0.00 H new ATOM 0 HD12 LEU A 412 1.812 1.914 1.432 1.00 0.00 H new ATOM 0 HD13 LEU A 412 0.559 3.175 1.358 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.266 4.165 -1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 412 0.966 5.237 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 412 2.488 5.368 -0.979 1.00 0.00 H new ATOM 766 N GLY A 413 3.593 1.296 2.541 1.00 0.00 N ATOM 767 CA GLY A 413 3.083 0.182 3.318 1.00 0.00 C ATOM 768 C GLY A 413 3.852 -1.101 3.093 1.00 0.00 C ATOM 769 O GLY A 413 4.639 -1.210 2.155 1.00 0.00 O ATOM 0 H GLY A 413 3.903 1.061 1.598 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.119 0.439 4.377 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.035 0.020 3.065 1.00 0.00 H new ATOM 773 N THR A 414 3.611 -2.080 3.956 1.00 0.00 N ATOM 774 CA THR A 414 4.261 -3.378 3.861 1.00 0.00 C ATOM 775 C THR A 414 3.485 -4.392 4.692 1.00 0.00 C ATOM 776 O THR A 414 3.092 -4.097 5.821 1.00 0.00 O ATOM 777 CB THR A 414 5.718 -3.324 4.353 1.00 0.00 C ATOM 778 OG1 THR A 414 6.465 -2.319 3.660 1.00 0.00 O ATOM 779 CG2 THR A 414 6.407 -4.664 4.151 1.00 0.00 C ATOM 0 H THR A 414 2.962 -1.996 4.738 1.00 0.00 H new ATOM 0 HA THR A 414 4.272 -3.673 2.812 1.00 0.00 H new ATOM 0 HB THR A 414 5.686 -3.081 5.415 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.014 -2.098 2.818 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.436 -4.601 4.506 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.876 -5.434 4.711 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.404 -4.919 3.091 1.00 0.00 H new ATOM 787 N GLY A 415 3.253 -5.579 4.144 1.00 0.00 N ATOM 788 CA GLY A 415 2.509 -6.581 4.884 1.00 0.00 C ATOM 789 C GLY A 415 2.761 -7.994 4.404 1.00 0.00 C ATOM 790 O GLY A 415 3.051 -8.222 3.229 1.00 0.00 O ATOM 0 H GLY A 415 3.561 -5.863 3.214 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.772 -6.512 5.940 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.444 -6.363 4.806 1.00 0.00 H new ATOM 794 N VAL A 416 2.641 -8.946 5.323 1.00 0.00 N ATOM 795 CA VAL A 416 2.846 -10.349 5.014 1.00 0.00 C ATOM 796 C VAL A 416 1.524 -11.107 5.084 1.00 0.00 C ATOM 797 O VAL A 416 0.726 -10.899 5.997 1.00 0.00 O ATOM 798 CB VAL A 416 3.868 -10.980 5.987 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.601 -12.464 6.198 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.280 -10.760 5.477 1.00 0.00 C ATOM 0 H VAL A 416 2.400 -8.764 6.297 1.00 0.00 H new ATOM 0 HA VAL A 416 3.241 -10.419 4.001 1.00 0.00 H new ATOM 0 HB VAL A 416 3.758 -10.488 6.953 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.340 -12.872 6.888 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.603 -12.598 6.614 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.669 -12.985 5.243 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.991 -11.209 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.389 -11.222 4.496 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.476 -9.691 5.398 1.00 0.00 H new ATOM 810 N GLY A 417 1.300 -11.989 4.119 1.00 0.00 N ATOM 811 CA GLY A 417 0.073 -12.760 4.105 1.00 0.00 C ATOM 812 C GLY A 417 0.245 -14.112 3.447 1.00 0.00 C ATOM 813 O GLY A 417 1.180 -14.317 2.671 1.00 0.00 O ATOM 0 H GLY A 417 1.942 -12.184 3.350 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.276 -12.899 5.128 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.699 -12.199 3.578 1.00 0.00 H new ATOM 817 N ARG A 418 -0.659 -15.039 3.751 1.00 0.00 N ATOM 818 CA ARG A 418 -0.599 -16.376 3.176 1.00 0.00 C ATOM 819 C ARG A 418 -0.271 -16.293 1.694 1.00 0.00 C ATOM 820 O ARG A 418 0.545 -17.057 1.177 1.00 0.00 O ATOM 821 CB ARG A 418 -1.926 -17.107 3.373 1.00 0.00 C ATOM 822 CG ARG A 418 -3.126 -16.315 2.893 1.00 0.00 C ATOM 823 CD ARG A 418 -4.371 -16.639 3.704 1.00 0.00 C ATOM 824 NE ARG A 418 -4.961 -17.918 3.317 1.00 0.00 N ATOM 825 CZ ARG A 418 -5.780 -18.618 4.098 1.00 0.00 C ATOM 826 NH1 ARG A 418 -6.101 -18.162 5.302 1.00 0.00 N ATOM 827 NH2 ARG A 418 -6.277 -19.773 3.676 1.00 0.00 N ATOM 0 H ARG A 418 -1.439 -14.888 4.391 1.00 0.00 H new ATOM 0 HA ARG A 418 0.186 -16.935 3.686 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -1.891 -18.058 2.841 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.052 -17.338 4.431 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -2.911 -15.249 2.965 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.309 -16.533 1.841 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.117 -16.663 4.764 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.107 -15.846 3.571 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.733 -18.295 2.397 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -5.720 -17.274 5.629 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -6.729 -18.699 5.900 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -6.032 -20.126 2.751 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -6.905 -20.308 4.276 1.00 0.00 H new ATOM 841 N ASN A 419 -0.913 -15.349 1.021 1.00 0.00 N ATOM 842 CA ASN A 419 -0.701 -15.139 -0.403 1.00 0.00 C ATOM 843 C ASN A 419 -0.373 -13.677 -0.686 1.00 0.00 C ATOM 844 O ASN A 419 -0.398 -12.838 0.215 1.00 0.00 O ATOM 845 CB ASN A 419 -1.941 -15.559 -1.195 1.00 0.00 C ATOM 846 CG ASN A 419 -1.692 -16.781 -2.055 1.00 0.00 C ATOM 847 OD1 ASN A 419 -0.704 -16.849 -2.787 1.00 0.00 O ATOM 848 ND2 ASN A 419 -2.589 -17.755 -1.970 1.00 0.00 N ATOM 0 H ASN A 419 -1.590 -14.712 1.442 1.00 0.00 H new ATOM 0 HA ASN A 419 0.143 -15.754 -0.717 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.758 -15.766 -0.503 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.261 -14.732 -1.828 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -2.475 -18.603 -2.525 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -3.393 -17.655 -1.350 1.00 0.00 H new ATOM 855 N ILE A 420 -0.068 -13.378 -1.941 1.00 0.00 N ATOM 856 CA ILE A 420 0.260 -12.019 -2.344 1.00 0.00 C ATOM 857 C ILE A 420 -0.892 -11.063 -2.039 1.00 0.00 C ATOM 858 O ILE A 420 -0.717 -9.845 -2.044 1.00 0.00 O ATOM 859 CB ILE A 420 0.625 -11.961 -3.844 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.081 -12.385 -4.032 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.395 -10.568 -4.420 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.277 -13.393 -5.143 1.00 0.00 C ATOM 0 H ILE A 420 -0.041 -14.060 -2.699 1.00 0.00 H new ATOM 0 HA ILE A 420 1.128 -11.703 -1.766 1.00 0.00 H new ATOM 0 HB ILE A 420 -0.025 -12.649 -4.384 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.684 -11.502 -4.243 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.451 -12.808 -3.098 1.00 0.00 H new ATOM 0 HG21 ILE A 420 0.662 -10.563 -5.477 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.655 -10.297 -4.309 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.014 -9.847 -3.886 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.334 -13.649 -5.220 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.701 -14.292 -4.924 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.937 -12.965 -6.086 1.00 0.00 H new ATOM 874 N LYS A 421 -2.066 -11.622 -1.763 1.00 0.00 N ATOM 875 CA LYS A 421 -3.229 -10.815 -1.444 1.00 0.00 C ATOM 876 C LYS A 421 -3.217 -10.413 0.021 1.00 0.00 C ATOM 877 O LYS A 421 -3.211 -9.230 0.347 1.00 0.00 O ATOM 878 CB LYS A 421 -4.505 -11.579 -1.770 1.00 0.00 C ATOM 879 CG LYS A 421 -5.746 -10.934 -1.204 1.00 0.00 C ATOM 880 CD LYS A 421 -5.711 -9.431 -1.397 1.00 0.00 C ATOM 881 CE LYS A 421 -5.786 -9.070 -2.868 1.00 0.00 C ATOM 882 NZ LYS A 421 -7.192 -8.905 -3.330 1.00 0.00 N ATOM 0 H LYS A 421 -2.233 -12.628 -1.755 1.00 0.00 H new ATOM 0 HA LYS A 421 -3.196 -9.909 -2.050 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.606 -11.659 -2.852 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.422 -12.594 -1.382 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.629 -11.347 -1.691 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.829 -11.166 -0.142 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.544 -8.973 -0.864 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.795 -9.027 -0.966 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -5.236 -8.145 -3.043 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -5.299 -9.847 -3.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -7.210 -8.303 -4.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.594 -9.837 -3.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -7.755 -8.460 -2.577 1.00 0.00 H new ATOM 896 N ILE A 422 -3.204 -11.397 0.902 1.00 0.00 N ATOM 897 CA ILE A 422 -3.182 -11.118 2.326 1.00 0.00 C ATOM 898 C ILE A 422 -2.034 -10.191 2.647 1.00 0.00 C ATOM 899 O ILE A 422 -2.143 -9.320 3.510 1.00 0.00 O ATOM 900 CB ILE A 422 -3.071 -12.402 3.155 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.311 -13.271 2.939 1.00 0.00 C ATOM 902 CG2 ILE A 422 -2.900 -12.070 4.631 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.533 -12.505 2.450 1.00 0.00 C ATOM 0 H ILE A 422 -3.208 -12.388 0.660 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.125 -10.638 2.589 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.192 -12.958 2.828 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.072 -14.052 2.217 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.559 -13.769 3.876 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -2.823 -12.993 5.205 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -1.994 -11.480 4.769 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -3.761 -11.498 4.977 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.368 -13.194 2.322 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -5.801 -11.742 3.181 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.306 -12.029 1.496 1.00 0.00 H new ATOM 915 N ALA A 423 -0.944 -10.356 1.915 1.00 0.00 N ATOM 916 CA ALA A 423 0.206 -9.499 2.096 1.00 0.00 C ATOM 917 C ALA A 423 -0.158 -8.109 1.600 1.00 0.00 C ATOM 918 O ALA A 423 -0.041 -7.122 2.324 1.00 0.00 O ATOM 919 CB ALA A 423 1.423 -10.038 1.360 1.00 0.00 C ATOM 0 H ALA A 423 -0.836 -11.071 1.196 1.00 0.00 H new ATOM 0 HA ALA A 423 0.471 -9.462 3.153 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.269 -9.369 1.518 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.668 -11.030 1.740 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.205 -10.102 0.294 1.00 0.00 H new ATOM 925 N GLY A 424 -0.630 -8.055 0.357 1.00 0.00 N ATOM 926 CA GLY A 424 -1.045 -6.797 -0.228 1.00 0.00 C ATOM 927 C GLY A 424 -2.071 -6.105 0.643 1.00 0.00 C ATOM 928 O GLY A 424 -1.954 -4.912 0.927 1.00 0.00 O ATOM 0 H GLY A 424 -0.732 -8.865 -0.255 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -0.178 -6.149 -0.359 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.464 -6.973 -1.219 1.00 0.00 H new ATOM 932 N ILE A 425 -3.068 -6.866 1.097 1.00 0.00 N ATOM 933 CA ILE A 425 -4.093 -6.319 1.971 1.00 0.00 C ATOM 934 C ILE A 425 -3.433 -5.710 3.201 1.00 0.00 C ATOM 935 O ILE A 425 -3.542 -4.512 3.465 1.00 0.00 O ATOM 936 CB ILE A 425 -5.092 -7.398 2.445 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.818 -8.027 1.259 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.092 -6.795 3.420 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.088 -9.502 1.434 1.00 0.00 C ATOM 0 H ILE A 425 -3.183 -7.855 0.873 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.640 -5.569 1.400 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.533 -8.183 2.954 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.764 -7.508 1.105 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.223 -7.879 0.358 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.791 -7.565 3.747 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.562 -6.395 4.284 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.641 -5.992 2.928 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.606 -9.884 0.554 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.144 -10.033 1.558 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.709 -9.656 2.316 1.00 0.00 H new ATOM 951 N ARG A 426 -2.750 -6.571 3.949 1.00 0.00 N ATOM 952 CA ARG A 426 -2.055 -6.174 5.167 1.00 0.00 C ATOM 953 C ARG A 426 -1.162 -4.959 4.938 1.00 0.00 C ATOM 954 O ARG A 426 -1.049 -4.099 5.805 1.00 0.00 O ATOM 955 CB ARG A 426 -1.218 -7.335 5.691 1.00 0.00 C ATOM 956 CG ARG A 426 -1.299 -7.508 7.198 1.00 0.00 C ATOM 957 CD ARG A 426 -0.855 -8.896 7.623 1.00 0.00 C ATOM 958 NE ARG A 426 0.552 -8.924 8.010 1.00 0.00 N ATOM 959 CZ ARG A 426 1.157 -10.001 8.499 1.00 0.00 C ATOM 960 NH1 ARG A 426 0.477 -11.128 8.658 1.00 0.00 N ATOM 961 NH2 ARG A 426 2.440 -9.950 8.830 1.00 0.00 N ATOM 0 H ARG A 426 -2.663 -7.563 3.727 1.00 0.00 H new ATOM 0 HA ARG A 426 -2.810 -5.901 5.904 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.546 -8.256 5.209 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.177 -7.180 5.406 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -0.674 -6.760 7.685 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -2.322 -7.334 7.531 1.00 0.00 H new ATOM 0 HD2 ARG A 426 -1.468 -9.233 8.459 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -1.020 -9.596 6.804 1.00 0.00 H new ATOM 0 HE ARG A 426 1.100 -8.071 7.899 1.00 0.00 H new ATOM 0 HH11 ARG A 426 -0.510 -11.168 8.405 1.00 0.00 H new ATOM 0 HH12 ARG A 426 0.941 -11.955 9.033 1.00 0.00 H new ATOM 0 HH21 ARG A 426 2.964 -9.083 8.709 1.00 0.00 H new ATOM 0 HH22 ARG A 426 2.903 -10.778 9.205 1.00 0.00 H new ATOM 975 N ALA A 427 -0.517 -4.902 3.778 1.00 0.00 N ATOM 976 CA ALA A 427 0.373 -3.790 3.457 1.00 0.00 C ATOM 977 C ALA A 427 -0.426 -2.517 3.184 1.00 0.00 C ATOM 978 O ALA A 427 -0.291 -1.518 3.888 1.00 0.00 O ATOM 979 CB ALA A 427 1.252 -4.129 2.262 1.00 0.00 C ATOM 0 H ALA A 427 -0.592 -5.609 3.047 1.00 0.00 H new ATOM 0 HA ALA A 427 1.016 -3.615 4.319 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.907 -3.286 2.041 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.856 -5.007 2.492 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.624 -4.337 1.396 1.00 0.00 H new ATOM 985 N ALA A 428 -1.261 -2.562 2.158 1.00 0.00 N ATOM 986 CA ALA A 428 -2.074 -1.408 1.806 1.00 0.00 C ATOM 987 C ALA A 428 -2.638 -0.807 3.081 1.00 0.00 C ATOM 988 O ALA A 428 -2.498 0.386 3.348 1.00 0.00 O ATOM 989 CB ALA A 428 -3.186 -1.797 0.852 1.00 0.00 C ATOM 0 H ALA A 428 -1.393 -3.377 1.559 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.457 -0.669 1.295 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.778 -0.916 0.605 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.755 -2.212 -0.059 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.825 -2.544 1.323 1.00 0.00 H new ATOM 995 N GLU A 429 -3.239 -1.674 3.879 1.00 0.00 N ATOM 996 CA GLU A 429 -3.798 -1.299 5.165 1.00 0.00 C ATOM 997 C GLU A 429 -2.685 -0.818 6.081 1.00 0.00 C ATOM 998 O GLU A 429 -2.799 0.203 6.741 1.00 0.00 O ATOM 999 CB GLU A 429 -4.476 -2.523 5.763 1.00 0.00 C ATOM 1000 CG GLU A 429 -5.889 -2.262 6.258 1.00 0.00 C ATOM 1001 CD GLU A 429 -6.008 -2.371 7.766 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -6.187 -3.501 8.266 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -5.925 -1.327 8.445 1.00 0.00 O ATOM 0 H GLU A 429 -3.353 -2.662 3.651 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.523 -0.494 5.047 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.504 -3.314 5.013 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -3.873 -2.892 6.593 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.202 -1.266 5.944 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.571 -2.973 5.791 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.609 -1.579 6.092 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.457 -1.242 6.914 1.00 0.00 C ATOM 1012 C ASN A 430 -0.152 0.233 6.732 1.00 0.00 C ATOM 1013 O ASN A 430 -0.132 1.001 7.694 1.00 0.00 O ATOM 1014 CB ASN A 430 0.747 -2.091 6.535 1.00 0.00 C ATOM 1015 CG ASN A 430 2.027 -1.610 7.189 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.355 -0.425 7.141 1.00 0.00 O ATOM 1017 ND2 ASN A 430 2.761 -2.532 7.803 1.00 0.00 N ATOM 0 H ASN A 430 -1.505 -2.433 5.544 1.00 0.00 H new ATOM 0 HA ASN A 430 -0.682 -1.446 7.961 1.00 0.00 H new ATOM 0 HB2 ASN A 430 0.563 -3.126 6.823 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.870 -2.079 5.452 1.00 0.00 H new ATOM 0 HD21 ASN A 430 3.634 -2.268 8.259 1.00 0.00 H new ATOM 0 HD22 ASN A 430 2.451 -3.504 7.818 1.00 0.00 H new ATOM 1024 N ALA A 431 0.031 0.634 5.482 1.00 0.00 N ATOM 1025 CA ALA A 431 0.272 2.029 5.169 1.00 0.00 C ATOM 1026 C ALA A 431 -0.935 2.830 5.614 1.00 0.00 C ATOM 1027 O ALA A 431 -0.819 3.917 6.180 1.00 0.00 O ATOM 1028 CB ALA A 431 0.500 2.225 3.680 1.00 0.00 C ATOM 0 H ALA A 431 0.017 0.013 4.673 1.00 0.00 H new ATOM 0 HA ALA A 431 1.169 2.365 5.689 1.00 0.00 H new ATOM 0 HB1 ALA A 431 0.678 3.281 3.475 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.366 1.643 3.365 1.00 0.00 H new ATOM 0 HB3 ALA A 431 -0.380 1.892 3.130 1.00 0.00 H new ATOM 1034 N LEU A 432 -2.101 2.253 5.351 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.378 2.850 5.708 1.00 0.00 C ATOM 1036 C LEU A 432 -3.442 3.179 7.192 1.00 0.00 C ATOM 1037 O LEU A 432 -3.817 4.282 7.586 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.485 1.862 5.368 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.813 2.472 4.947 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.461 1.588 3.899 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -6.727 2.645 6.150 1.00 0.00 C ATOM 0 H LEU A 432 -2.186 1.352 4.881 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.498 3.779 5.150 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.134 1.215 4.565 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.658 1.227 6.237 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.637 3.459 4.520 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.413 2.022 3.595 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -5.805 1.510 3.032 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.632 0.595 4.315 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -7.672 3.083 5.829 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -6.914 1.674 6.608 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -6.251 3.303 6.877 1.00 0.00 H new ATOM 1053 N ARG A 433 -3.083 2.199 8.005 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.103 2.346 9.447 1.00 0.00 C ATOM 1055 C ARG A 433 -2.174 3.470 9.895 1.00 0.00 C ATOM 1056 O ARG A 433 -2.238 3.928 11.036 1.00 0.00 O ATOM 1057 CB ARG A 433 -2.719 1.016 10.090 1.00 0.00 C ATOM 1058 CG ARG A 433 -3.757 -0.073 9.869 1.00 0.00 C ATOM 1059 CD ARG A 433 -3.111 -1.434 9.666 1.00 0.00 C ATOM 1060 NE ARG A 433 -2.720 -2.047 10.932 1.00 0.00 N ATOM 1061 CZ ARG A 433 -2.410 -3.332 11.064 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -2.441 -4.135 10.009 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -2.069 -3.817 12.250 1.00 0.00 N ATOM 0 H ARG A 433 -2.771 1.283 7.683 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.108 2.617 9.769 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -1.762 0.686 9.685 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -2.578 1.164 11.161 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -4.429 -0.114 10.726 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -4.364 0.175 8.999 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -3.806 -2.091 9.144 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -2.233 -1.328 9.028 1.00 0.00 H new ATOM 0 HE ARG A 433 -2.683 -1.455 11.762 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -2.703 -3.766 9.095 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -2.203 -5.121 10.112 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -2.044 -3.203 13.064 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -1.832 -4.804 12.348 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.329 3.926 8.979 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.406 5.012 9.258 1.00 0.00 C ATOM 1079 C ASP A 434 -0.984 6.325 8.736 1.00 0.00 C ATOM 1080 O ASP A 434 -1.084 6.538 7.528 1.00 0.00 O ATOM 1081 CB ASP A 434 0.953 4.732 8.627 1.00 0.00 C ATOM 1082 CG ASP A 434 1.849 3.906 9.527 1.00 0.00 C ATOM 1083 OD1 ASP A 434 1.317 3.193 10.404 1.00 0.00 O ATOM 1084 OD2 ASP A 434 3.085 3.970 9.354 1.00 0.00 O ATOM 0 H ASP A 434 -1.266 3.556 8.031 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.267 5.093 10.336 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.811 4.209 7.682 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.445 5.677 8.397 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.374 7.189 9.662 1.00 0.00 N ATOM 1090 CA LYS A 435 -1.959 8.477 9.304 1.00 0.00 C ATOM 1091 C LYS A 435 -0.925 9.411 8.693 1.00 0.00 C ATOM 1092 O LYS A 435 -1.109 9.920 7.590 1.00 0.00 O ATOM 1093 CB LYS A 435 -2.603 9.141 10.519 1.00 0.00 C ATOM 1094 CG LYS A 435 -3.621 10.204 10.147 1.00 0.00 C ATOM 1095 CD LYS A 435 -5.036 9.769 10.496 1.00 0.00 C ATOM 1096 CE LYS A 435 -5.693 9.024 9.346 1.00 0.00 C ATOM 1097 NZ LYS A 435 -7.085 8.609 9.676 1.00 0.00 N ATOM 0 H LYS A 435 -1.297 7.024 10.666 1.00 0.00 H new ATOM 0 HA LYS A 435 -2.729 8.283 8.557 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.089 8.378 11.127 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -1.824 9.592 11.135 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -3.386 11.132 10.668 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -3.557 10.413 9.079 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -5.013 9.130 11.378 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -5.633 10.644 10.752 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -5.704 9.660 8.461 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -5.101 8.143 9.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -7.498 8.104 8.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -7.073 7.982 10.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -7.657 9.451 9.887 1.00 0.00 H new ATOM 1111 N LYS A 436 0.136 9.670 9.435 1.00 0.00 N ATOM 1112 CA LYS A 436 1.167 10.590 8.977 1.00 0.00 C ATOM 1113 C LYS A 436 1.394 10.445 7.479 1.00 0.00 C ATOM 1114 O LYS A 436 1.352 11.430 6.746 1.00 0.00 O ATOM 1115 CB LYS A 436 2.472 10.355 9.735 1.00 0.00 C ATOM 1116 CG LYS A 436 2.827 11.478 10.696 1.00 0.00 C ATOM 1117 CD LYS A 436 2.509 11.102 12.135 1.00 0.00 C ATOM 1118 CE LYS A 436 3.762 10.701 12.895 1.00 0.00 C ATOM 1119 NZ LYS A 436 3.442 9.905 14.113 1.00 0.00 N ATOM 0 H LYS A 436 0.308 9.260 10.353 1.00 0.00 H new ATOM 0 HA LYS A 436 0.826 11.606 9.177 1.00 0.00 H new ATOM 0 HB2 LYS A 436 2.396 9.421 10.292 1.00 0.00 H new ATOM 0 HB3 LYS A 436 3.283 10.232 9.017 1.00 0.00 H new ATOM 0 HG2 LYS A 436 3.887 11.713 10.606 1.00 0.00 H new ATOM 0 HG3 LYS A 436 2.276 12.379 10.424 1.00 0.00 H new ATOM 0 HD2 LYS A 436 2.032 11.945 12.636 1.00 0.00 H new ATOM 0 HD3 LYS A 436 1.795 10.278 12.148 1.00 0.00 H new ATOM 0 HE2 LYS A 436 4.412 10.119 12.242 1.00 0.00 H new ATOM 0 HE3 LYS A 436 4.315 11.596 13.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 4.323 9.651 14.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 2.842 10.469 14.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 2.937 9.038 13.839 1.00 0.00 H new ATOM 1133 N MET A 437 1.622 9.224 7.015 1.00 0.00 N ATOM 1134 CA MET A 437 1.829 9.003 5.589 1.00 0.00 C ATOM 1135 C MET A 437 0.541 9.313 4.841 1.00 0.00 C ATOM 1136 O MET A 437 0.559 9.974 3.802 1.00 0.00 O ATOM 1137 CB MET A 437 2.287 7.573 5.287 1.00 0.00 C ATOM 1138 CG MET A 437 1.875 6.548 6.325 1.00 0.00 C ATOM 1139 SD MET A 437 2.258 4.863 5.806 1.00 0.00 S ATOM 1140 CE MET A 437 3.941 4.701 6.395 1.00 0.00 C ATOM 0 H MET A 437 1.668 8.384 7.592 1.00 0.00 H new ATOM 0 HA MET A 437 2.624 9.670 5.255 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.885 7.273 4.319 1.00 0.00 H new ATOM 0 HB3 MET A 437 3.373 7.564 5.197 1.00 0.00 H new ATOM 0 HG2 MET A 437 2.383 6.761 7.266 1.00 0.00 H new ATOM 0 HG3 MET A 437 0.805 6.634 6.514 1.00 0.00 H new ATOM 0 HE1 MET A 437 4.180 3.646 6.529 1.00 0.00 H new ATOM 0 HE2 MET A 437 4.625 5.138 5.668 1.00 0.00 H new ATOM 0 HE3 MET A 437 4.045 5.220 7.348 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.582 8.865 5.398 1.00 0.00 N ATOM 1151 CA LEU A 438 -1.882 9.136 4.801 1.00 0.00 C ATOM 1152 C LEU A 438 -1.962 10.624 4.492 1.00 0.00 C ATOM 1153 O LEU A 438 -2.060 11.042 3.337 1.00 0.00 O ATOM 1154 CB LEU A 438 -2.982 8.771 5.799 1.00 0.00 C ATOM 1155 CG LEU A 438 -3.780 7.508 5.489 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -2.871 6.414 4.951 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -4.507 7.037 6.742 1.00 0.00 C ATOM 0 H LEU A 438 -0.616 8.316 6.257 1.00 0.00 H new ATOM 0 HA LEU A 438 -2.010 8.550 3.891 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.528 8.656 6.783 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -3.677 9.608 5.864 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.517 7.738 4.719 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -3.461 5.523 4.737 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.389 6.759 4.036 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -2.110 6.175 5.694 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -5.075 6.135 6.515 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -3.780 6.821 7.525 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -5.187 7.818 7.084 1.00 0.00 H new ATOM 1169 N ASP A 439 -1.913 11.409 5.562 1.00 0.00 N ATOM 1170 CA ASP A 439 -1.967 12.862 5.494 1.00 0.00 C ATOM 1171 C ASP A 439 -0.774 13.420 4.730 1.00 0.00 C ATOM 1172 O ASP A 439 -0.804 14.546 4.249 1.00 0.00 O ATOM 1173 CB ASP A 439 -1.960 13.421 6.917 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.033 14.470 7.138 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -3.508 15.052 6.140 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -3.399 14.710 8.309 1.00 0.00 O ATOM 0 H ASP A 439 -1.834 11.048 6.513 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.877 13.155 4.970 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.104 12.605 7.625 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -0.983 13.856 7.127 1.00 0.00 H new ATOM 1181 N PHE A 440 0.274 12.618 4.630 1.00 0.00 N ATOM 1182 CA PHE A 440 1.482 13.028 3.935 1.00 0.00 C ATOM 1183 C PHE A 440 1.247 13.028 2.435 1.00 0.00 C ATOM 1184 O PHE A 440 1.389 14.056 1.771 1.00 0.00 O ATOM 1185 CB PHE A 440 2.647 12.101 4.292 1.00 0.00 C ATOM 1186 CG PHE A 440 3.929 12.441 3.585 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.043 12.272 2.213 1.00 0.00 C ATOM 1188 CD2 PHE A 440 5.017 12.931 4.288 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.218 12.586 1.558 1.00 0.00 C ATOM 1190 CE2 PHE A 440 6.196 13.248 3.637 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.296 13.074 2.271 1.00 0.00 C ATOM 0 H PHE A 440 0.312 11.677 5.023 1.00 0.00 H new ATOM 0 HA PHE A 440 1.739 14.039 4.250 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.815 12.141 5.368 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.370 11.075 4.050 1.00 0.00 H new ATOM 0 HD1 PHE A 440 3.204 11.891 1.650 1.00 0.00 H new ATOM 0 HD2 PHE A 440 4.944 13.067 5.357 1.00 0.00 H new ATOM 0 HE1 PHE A 440 5.294 12.450 0.489 1.00 0.00 H new ATOM 0 HE2 PHE A 440 7.037 13.631 4.196 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.216 13.319 1.761 1.00 0.00 H new ATOM 1201 N TYR A 441 0.871 11.871 1.909 1.00 0.00 N ATOM 1202 CA TYR A 441 0.603 11.739 0.493 1.00 0.00 C ATOM 1203 C TYR A 441 -0.529 12.666 0.092 1.00 0.00 C ATOM 1204 O TYR A 441 -0.427 13.389 -0.898 1.00 0.00 O ATOM 1205 CB TYR A 441 0.270 10.293 0.156 1.00 0.00 C ATOM 1206 CG TYR A 441 1.445 9.371 0.361 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.651 9.611 -0.284 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.357 8.277 1.209 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.738 8.784 -0.091 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.445 7.446 1.412 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.632 7.705 0.758 1.00 0.00 C ATOM 1212 OH TYR A 441 4.721 6.888 0.957 1.00 0.00 O ATOM 0 H TYR A 441 0.746 11.013 2.446 1.00 0.00 H new ATOM 0 HA TYR A 441 1.493 12.022 -0.069 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.562 9.960 0.776 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.061 10.231 -0.881 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.739 10.459 -0.947 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.427 8.071 1.718 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.668 8.982 -0.603 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.365 6.600 2.078 1.00 0.00 H new ATOM 0 HH TYR A 441 4.782 6.649 1.906 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.595 12.672 0.885 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.710 13.558 0.607 1.00 0.00 C ATOM 1224 C ALA A 442 -2.185 14.983 0.585 1.00 0.00 C ATOM 1225 O ALA A 442 -2.216 15.657 -0.445 1.00 0.00 O ATOM 1226 CB ALA A 442 -3.813 13.408 1.643 1.00 0.00 C ATOM 0 H ALA A 442 -1.707 12.083 1.710 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.147 13.301 -0.358 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.632 14.086 1.403 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.179 12.381 1.639 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.420 13.649 2.631 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.696 15.432 1.738 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.150 16.773 1.863 1.00 0.00 C ATOM 1234 C LYS A 443 -0.279 17.071 0.664 1.00 0.00 C ATOM 1235 O LYS A 443 -0.218 18.201 0.187 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.311 16.887 3.126 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.121 17.047 4.396 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.425 18.508 4.684 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.442 19.077 3.703 1.00 0.00 C ATOM 1240 NZ LYS A 443 -3.422 19.973 4.375 1.00 0.00 N ATOM 0 H LYS A 443 -1.668 14.883 2.598 1.00 0.00 H new ATOM 0 HA LYS A 443 -1.973 17.485 1.916 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.313 15.998 3.216 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.361 17.739 3.027 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.054 16.491 4.306 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -0.574 16.616 5.234 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -1.806 18.607 5.701 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.504 19.089 4.631 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -1.922 19.630 2.921 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -2.973 18.259 3.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -4.096 20.339 3.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -3.937 19.439 5.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -2.919 20.768 4.818 1.00 0.00 H new ATOM 1254 N GLN A 444 0.366 16.032 0.163 1.00 0.00 N ATOM 1255 CA GLN A 444 1.203 16.168 -1.015 1.00 0.00 C ATOM 1256 C GLN A 444 0.317 16.568 -2.190 1.00 0.00 C ATOM 1257 O GLN A 444 0.535 17.586 -2.845 1.00 0.00 O ATOM 1258 CB GLN A 444 1.923 14.851 -1.312 1.00 0.00 C ATOM 1259 CG GLN A 444 3.265 15.029 -2.003 1.00 0.00 C ATOM 1260 CD GLN A 444 3.770 13.747 -2.638 1.00 0.00 C ATOM 1261 OE1 GLN A 444 3.124 12.703 -2.553 1.00 0.00 O ATOM 1262 NE2 GLN A 444 4.932 13.821 -3.277 1.00 0.00 N ATOM 0 H GLN A 444 0.327 15.090 0.551 1.00 0.00 H new ATOM 0 HA GLN A 444 1.962 16.932 -0.846 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.075 14.312 -0.377 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.282 14.230 -1.938 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.175 15.799 -2.770 1.00 0.00 H new ATOM 0 HG3 GLN A 444 3.998 15.384 -1.279 1.00 0.00 H new ATOM 0 HE21 GLN A 444 5.433 14.708 -3.322 1.00 0.00 H new ATOM 0 HE22 GLN A 444 5.323 12.991 -3.722 1.00 0.00 H new