USER MOD reduce.3.24.130724 H: found=0, std=0, add=598, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 601 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 371 SER OG : rot 180:sc= 0 USER MOD Single : A 372 MET CE :methyl 160:sc= 0 (180deg=-0.199) USER MOD Single : A 394 SER OG : rot 60:sc= 1.23 USER MOD Single : A 397 SER OG : rot 180:sc= 0 USER MOD Single : A 399 HIS : no HD1:sc= -1.29 X(o=-1.3,f=-1.4) USER MOD Single : A 403 GLN : amide:sc= -0.797 K(o=-0.8,f=-1.8) USER MOD Single : A 407 MET CE :methyl -139:sc= -0.309 (180deg=-1.42) USER MOD Single : A 408 SER OG : rot 180:sc= 0 USER MOD Single : A 409 GLN : amide:sc= -0.244 K(o=-0.24,f=-2.3!) USER MOD Single : A 411 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.109) USER MOD Single : A 415 SER OG : rot 175:sc= -1.18 USER MOD Single : A 417 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 419 THR OG1 : rot 180:sc= 0 USER MOD Single : A 420 SER OG : rot 180:sc= 0 USER MOD Single : A 421 GLN : amide:sc= -0.0374 K(o=-0.037,f=-0.62) USER MOD Single : A 422 SER OG : rot 180:sc= 0 USER MOD Single : A 424 HIS : no HD1:sc= -0.0275 X(o=-0.027,f=0) USER MOD Single : A 427 GLN : amide:sc= -0.0157 X(o=-0.016,f=0) USER MOD Single : A 428 LYS NZ :NH3+ -148:sc= -0.0889 (180deg=-0.746) USER MOD Single : A 429 THR OG1 : rot 180:sc= -0.132 USER MOD Single : A 430 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 431 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 364 16.355 -6.389 -30.958 1.00 0.00 N ATOM 2 CA GLY A 364 15.876 -6.638 -29.609 1.00 0.00 C ATOM 3 C GLY A 364 14.483 -6.039 -29.402 1.00 0.00 C ATOM 4 O GLY A 364 14.057 -5.172 -30.163 1.00 0.00 O ATOM 0 HA2 GLY A 364 15.845 -7.711 -29.423 1.00 0.00 H new ATOM 0 HA3 GLY A 364 16.571 -6.209 -28.887 1.00 0.00 H new ATOM 8 N PRO A 365 13.795 -6.539 -28.341 1.00 0.00 N ATOM 9 CA PRO A 365 12.459 -6.063 -28.024 1.00 0.00 C ATOM 10 C PRO A 365 12.509 -4.675 -27.382 1.00 0.00 C ATOM 11 O PRO A 365 13.583 -4.093 -27.236 1.00 0.00 O ATOM 12 CB PRO A 365 11.871 -7.122 -27.105 1.00 0.00 C ATOM 13 CG PRO A 365 13.055 -7.911 -26.569 1.00 0.00 C ATOM 14 CD PRO A 365 14.268 -7.566 -27.418 1.00 0.00 C ATOM 0 HA PRO A 365 11.837 -5.934 -28.910 1.00 0.00 H new ATOM 0 HB2 PRO A 365 11.306 -6.665 -26.293 1.00 0.00 H new ATOM 0 HB3 PRO A 365 11.182 -7.770 -27.646 1.00 0.00 H new ATOM 0 HG2 PRO A 365 13.238 -7.662 -25.524 1.00 0.00 H new ATOM 0 HG3 PRO A 365 12.851 -8.981 -26.611 1.00 0.00 H new ATOM 0 HD2 PRO A 365 15.090 -7.198 -26.803 1.00 0.00 H new ATOM 0 HD3 PRO A 365 14.638 -8.440 -27.954 1.00 0.00 H new ATOM 22 N LEU A 366 11.334 -4.185 -27.016 1.00 0.00 N ATOM 23 CA LEU A 366 11.230 -2.876 -26.393 1.00 0.00 C ATOM 24 C LEU A 366 11.206 -3.040 -24.872 1.00 0.00 C ATOM 25 O LEU A 366 11.229 -2.054 -24.137 1.00 0.00 O ATOM 26 CB LEU A 366 10.026 -2.112 -26.948 1.00 0.00 C ATOM 27 CG LEU A 366 10.345 -0.853 -27.757 1.00 0.00 C ATOM 28 CD1 LEU A 366 9.489 -0.783 -29.022 1.00 0.00 C ATOM 29 CD2 LEU A 366 10.201 0.403 -26.896 1.00 0.00 C ATOM 0 H LEU A 366 10.446 -4.671 -27.139 1.00 0.00 H new ATOM 0 HA LEU A 366 12.102 -2.269 -26.635 1.00 0.00 H new ATOM 0 HB2 LEU A 366 9.451 -2.789 -27.579 1.00 0.00 H new ATOM 0 HB3 LEU A 366 9.383 -1.831 -26.114 1.00 0.00 H new ATOM 0 HG LEU A 366 11.386 -0.906 -28.076 1.00 0.00 H new ATOM 0 HD11 LEU A 366 9.736 0.121 -29.579 1.00 0.00 H new ATOM 0 HD12 LEU A 366 9.686 -1.657 -29.643 1.00 0.00 H new ATOM 0 HD13 LEU A 366 8.434 -0.764 -28.747 1.00 0.00 H new ATOM 0 HD21 LEU A 366 10.433 1.283 -27.495 1.00 0.00 H new ATOM 0 HD22 LEU A 366 9.178 0.475 -26.526 1.00 0.00 H new ATOM 0 HD23 LEU A 366 10.889 0.347 -26.052 1.00 0.00 H new ATOM 41 N VAL A 367 11.162 -4.294 -24.445 1.00 0.00 N ATOM 42 CA VAL A 367 11.134 -4.600 -23.025 1.00 0.00 C ATOM 43 C VAL A 367 12.527 -4.376 -22.433 1.00 0.00 C ATOM 44 O VAL A 367 13.523 -4.395 -23.155 1.00 0.00 O ATOM 45 CB VAL A 367 10.613 -6.021 -22.806 1.00 0.00 C ATOM 46 CG1 VAL A 367 9.323 -6.259 -23.593 1.00 0.00 C ATOM 47 CG2 VAL A 367 11.677 -7.058 -23.171 1.00 0.00 C ATOM 0 H VAL A 367 11.145 -5.109 -25.058 1.00 0.00 H new ATOM 0 HA VAL A 367 10.447 -3.933 -22.504 1.00 0.00 H new ATOM 0 HB VAL A 367 10.385 -6.134 -21.746 1.00 0.00 H new ATOM 0 HG11 VAL A 367 8.974 -7.277 -23.420 1.00 0.00 H new ATOM 0 HG12 VAL A 367 8.561 -5.553 -23.264 1.00 0.00 H new ATOM 0 HG13 VAL A 367 9.514 -6.117 -24.657 1.00 0.00 H new ATOM 0 HG21 VAL A 367 11.280 -8.060 -23.006 1.00 0.00 H new ATOM 0 HG22 VAL A 367 11.951 -6.944 -24.220 1.00 0.00 H new ATOM 0 HG23 VAL A 367 12.559 -6.910 -22.548 1.00 0.00 H new ATOM 57 N PRO A 368 12.554 -4.165 -21.090 1.00 0.00 N ATOM 58 CA PRO A 368 13.808 -3.939 -20.392 1.00 0.00 C ATOM 59 C PRO A 368 14.593 -5.243 -20.238 1.00 0.00 C ATOM 60 O PRO A 368 14.133 -6.174 -19.579 1.00 0.00 O ATOM 61 CB PRO A 368 13.412 -3.323 -19.060 1.00 0.00 C ATOM 62 CG PRO A 368 11.941 -3.654 -18.869 1.00 0.00 C ATOM 63 CD PRO A 368 11.395 -4.137 -20.203 1.00 0.00 C ATOM 0 HA PRO A 368 14.479 -3.276 -20.938 1.00 0.00 H new ATOM 0 HB2 PRO A 368 14.013 -3.731 -18.247 1.00 0.00 H new ATOM 0 HB3 PRO A 368 13.572 -2.245 -19.065 1.00 0.00 H new ATOM 0 HG2 PRO A 368 11.819 -4.422 -18.106 1.00 0.00 H new ATOM 0 HG3 PRO A 368 11.393 -2.776 -18.528 1.00 0.00 H new ATOM 0 HD2 PRO A 368 10.943 -5.124 -20.111 1.00 0.00 H new ATOM 0 HD3 PRO A 368 10.623 -3.467 -20.581 1.00 0.00 H new ATOM 71 N ARG A 369 15.765 -5.268 -20.856 1.00 0.00 N ATOM 72 CA ARG A 369 16.618 -6.443 -20.795 1.00 0.00 C ATOM 73 C ARG A 369 18.081 -6.047 -21.003 1.00 0.00 C ATOM 74 O ARG A 369 18.402 -5.308 -21.933 1.00 0.00 O ATOM 75 CB ARG A 369 16.218 -7.469 -21.857 1.00 0.00 C ATOM 76 CG ARG A 369 15.284 -8.529 -21.271 1.00 0.00 C ATOM 77 CD ARG A 369 16.058 -9.524 -20.404 1.00 0.00 C ATOM 78 NE ARG A 369 15.302 -10.791 -20.289 1.00 0.00 N ATOM 79 CZ ARG A 369 15.365 -11.788 -21.182 1.00 0.00 C ATOM 80 NH1 ARG A 369 16.150 -11.671 -22.262 1.00 0.00 N ATOM 81 NH2 ARG A 369 14.643 -12.901 -20.996 1.00 0.00 N ATOM 0 H ARG A 369 16.144 -4.494 -21.401 1.00 0.00 H new ATOM 0 HA ARG A 369 16.496 -6.892 -19.809 1.00 0.00 H new ATOM 0 HB2 ARG A 369 15.725 -6.964 -22.688 1.00 0.00 H new ATOM 0 HB3 ARG A 369 17.111 -7.948 -22.259 1.00 0.00 H new ATOM 0 HG2 ARG A 369 14.510 -8.047 -20.674 1.00 0.00 H new ATOM 0 HG3 ARG A 369 14.779 -9.060 -22.078 1.00 0.00 H new ATOM 0 HD2 ARG A 369 17.038 -9.714 -20.841 1.00 0.00 H new ATOM 0 HD3 ARG A 369 16.227 -9.101 -19.414 1.00 0.00 H new ATOM 0 HE ARG A 369 14.695 -10.913 -19.479 1.00 0.00 H new ATOM 0 HH11 ARG A 369 16.699 -10.823 -22.404 1.00 0.00 H new ATOM 0 HH12 ARG A 369 16.198 -12.430 -22.942 1.00 0.00 H new ATOM 0 HH21 ARG A 369 14.045 -12.990 -20.174 1.00 0.00 H new ATOM 0 HH22 ARG A 369 14.691 -13.660 -21.676 1.00 0.00 H new ATOM 95 N GLY A 370 18.930 -6.557 -20.123 1.00 0.00 N ATOM 96 CA GLY A 370 20.351 -6.267 -20.198 1.00 0.00 C ATOM 97 C GLY A 370 20.618 -4.776 -19.983 1.00 0.00 C ATOM 98 O GLY A 370 19.929 -4.125 -19.198 1.00 0.00 O ATOM 0 H GLY A 370 18.660 -7.170 -19.354 1.00 0.00 H new ATOM 0 HA2 GLY A 370 20.885 -6.848 -19.446 1.00 0.00 H new ATOM 0 HA3 GLY A 370 20.737 -6.573 -21.170 1.00 0.00 H new ATOM 102 N SER A 371 21.620 -4.278 -20.693 1.00 0.00 N ATOM 103 CA SER A 371 21.986 -2.875 -20.589 1.00 0.00 C ATOM 104 C SER A 371 20.736 -1.999 -20.684 1.00 0.00 C ATOM 105 O SER A 371 20.479 -1.180 -19.803 1.00 0.00 O ATOM 106 CB SER A 371 22.990 -2.487 -21.676 1.00 0.00 C ATOM 107 OG SER A 371 24.102 -3.377 -21.719 1.00 0.00 O ATOM 0 H SER A 371 22.190 -4.821 -21.342 1.00 0.00 H new ATOM 0 HA SER A 371 22.460 -2.716 -19.620 1.00 0.00 H new ATOM 0 HB2 SER A 371 22.491 -2.483 -22.645 1.00 0.00 H new ATOM 0 HB3 SER A 371 23.345 -1.472 -21.496 1.00 0.00 H new ATOM 0 HG SER A 371 24.719 -3.096 -22.427 1.00 0.00 H new ATOM 113 N MET A 372 19.990 -2.202 -21.760 1.00 0.00 N ATOM 114 CA MET A 372 18.773 -1.441 -21.982 1.00 0.00 C ATOM 115 C MET A 372 17.939 -1.356 -20.702 1.00 0.00 C ATOM 116 O MET A 372 17.163 -0.418 -20.523 1.00 0.00 O ATOM 117 CB MET A 372 17.948 -2.106 -23.085 1.00 0.00 C ATOM 118 CG MET A 372 16.917 -1.133 -23.662 1.00 0.00 C ATOM 119 SD MET A 372 15.300 -1.888 -23.664 1.00 0.00 S ATOM 120 CE MET A 372 14.372 -0.629 -24.525 1.00 0.00 C ATOM 0 H MET A 372 20.205 -2.883 -22.488 1.00 0.00 H new ATOM 0 HA MET A 372 19.049 -0.430 -22.282 1.00 0.00 H new ATOM 0 HB2 MET A 372 18.609 -2.454 -23.879 1.00 0.00 H new ATOM 0 HB3 MET A 372 17.441 -2.984 -22.685 1.00 0.00 H new ATOM 0 HG2 MET A 372 16.899 -0.217 -23.072 1.00 0.00 H new ATOM 0 HG3 MET A 372 17.198 -0.852 -24.677 1.00 0.00 H new ATOM 0 HE1 MET A 372 13.456 -1.063 -24.926 1.00 0.00 H new ATOM 0 HE2 MET A 372 14.120 0.175 -23.833 1.00 0.00 H new ATOM 0 HE3 MET A 372 14.972 -0.229 -25.342 1.00 0.00 H new ATOM 130 N ALA A 373 18.128 -2.347 -19.844 1.00 0.00 N ATOM 131 CA ALA A 373 17.403 -2.396 -18.585 1.00 0.00 C ATOM 132 C ALA A 373 18.194 -1.642 -17.516 1.00 0.00 C ATOM 133 O ALA A 373 17.636 -0.822 -16.788 1.00 0.00 O ATOM 134 CB ALA A 373 17.146 -3.855 -18.200 1.00 0.00 C ATOM 0 H ALA A 373 18.773 -3.123 -19.995 1.00 0.00 H new ATOM 0 HA ALA A 373 16.433 -1.909 -18.682 1.00 0.00 H new ATOM 0 HB1 ALA A 373 16.602 -3.892 -17.256 1.00 0.00 H new ATOM 0 HB2 ALA A 373 16.555 -4.338 -18.978 1.00 0.00 H new ATOM 0 HB3 ALA A 373 18.097 -4.376 -18.091 1.00 0.00 H new ATOM 140 N LEU A 374 19.483 -1.945 -17.454 1.00 0.00 N ATOM 141 CA LEU A 374 20.357 -1.305 -16.486 1.00 0.00 C ATOM 142 C LEU A 374 20.072 0.198 -16.463 1.00 0.00 C ATOM 143 O LEU A 374 20.030 0.809 -15.396 1.00 0.00 O ATOM 144 CB LEU A 374 21.819 -1.650 -16.775 1.00 0.00 C ATOM 145 CG LEU A 374 22.599 -0.625 -17.601 1.00 0.00 C ATOM 146 CD1 LEU A 374 22.966 0.596 -16.755 1.00 0.00 C ATOM 147 CD2 LEU A 374 23.829 -1.265 -18.248 1.00 0.00 C ATOM 0 H LEU A 374 19.943 -2.626 -18.059 1.00 0.00 H new ATOM 0 HA LEU A 374 20.157 -1.682 -15.483 1.00 0.00 H new ATOM 0 HB2 LEU A 374 22.334 -1.789 -15.824 1.00 0.00 H new ATOM 0 HB3 LEU A 374 21.850 -2.607 -17.297 1.00 0.00 H new ATOM 0 HG LEU A 374 21.955 -0.275 -18.408 1.00 0.00 H new ATOM 0 HD11 LEU A 374 23.520 1.309 -17.366 1.00 0.00 H new ATOM 0 HD12 LEU A 374 22.056 1.067 -16.382 1.00 0.00 H new ATOM 0 HD13 LEU A 374 23.584 0.283 -15.913 1.00 0.00 H new ATOM 0 HD21 LEU A 374 24.366 -0.515 -18.829 1.00 0.00 H new ATOM 0 HD22 LEU A 374 24.484 -1.660 -17.472 1.00 0.00 H new ATOM 0 HD23 LEU A 374 23.514 -2.076 -18.904 1.00 0.00 H new ATOM 159 N ILE A 375 19.884 0.750 -17.652 1.00 0.00 N ATOM 160 CA ILE A 375 19.604 2.170 -17.782 1.00 0.00 C ATOM 161 C ILE A 375 18.242 2.477 -17.156 1.00 0.00 C ATOM 162 O ILE A 375 18.107 3.430 -16.391 1.00 0.00 O ATOM 163 CB ILE A 375 19.722 2.608 -19.243 1.00 0.00 C ATOM 164 CG1 ILE A 375 21.080 2.212 -19.827 1.00 0.00 C ATOM 165 CG2 ILE A 375 19.450 4.107 -19.390 1.00 0.00 C ATOM 166 CD1 ILE A 375 20.910 1.267 -21.018 1.00 0.00 C ATOM 0 H ILE A 375 19.920 0.240 -18.534 1.00 0.00 H new ATOM 0 HA ILE A 375 20.345 2.755 -17.237 1.00 0.00 H new ATOM 0 HB ILE A 375 18.959 2.084 -19.819 1.00 0.00 H new ATOM 0 HG12 ILE A 375 21.619 3.106 -20.141 1.00 0.00 H new ATOM 0 HG13 ILE A 375 21.684 1.729 -19.058 1.00 0.00 H new ATOM 0 HG21 ILE A 375 19.540 4.392 -20.438 1.00 0.00 H new ATOM 0 HG22 ILE A 375 18.443 4.330 -19.039 1.00 0.00 H new ATOM 0 HG23 ILE A 375 20.173 4.668 -18.798 1.00 0.00 H new ATOM 0 HD11 ILE A 375 21.890 1.001 -21.414 1.00 0.00 H new ATOM 0 HD12 ILE A 375 20.392 0.364 -20.695 1.00 0.00 H new ATOM 0 HD13 ILE A 375 20.327 1.762 -21.795 1.00 0.00 H new ATOM 178 N VAL A 376 17.267 1.651 -17.505 1.00 0.00 N ATOM 179 CA VAL A 376 15.920 1.821 -16.987 1.00 0.00 C ATOM 180 C VAL A 376 15.944 1.686 -15.463 1.00 0.00 C ATOM 181 O VAL A 376 15.505 2.587 -14.749 1.00 0.00 O ATOM 182 CB VAL A 376 14.970 0.829 -17.661 1.00 0.00 C ATOM 183 CG1 VAL A 376 13.633 0.762 -16.921 1.00 0.00 C ATOM 184 CG2 VAL A 376 14.765 1.182 -19.135 1.00 0.00 C ATOM 0 H VAL A 376 17.383 0.862 -18.141 1.00 0.00 H new ATOM 0 HA VAL A 376 15.544 2.818 -17.219 1.00 0.00 H new ATOM 0 HB VAL A 376 15.428 -0.159 -17.614 1.00 0.00 H new ATOM 0 HG11 VAL A 376 12.976 0.050 -17.420 1.00 0.00 H new ATOM 0 HG12 VAL A 376 13.802 0.441 -15.893 1.00 0.00 H new ATOM 0 HG13 VAL A 376 13.167 1.747 -16.921 1.00 0.00 H new ATOM 0 HG21 VAL A 376 14.086 0.461 -19.591 1.00 0.00 H new ATOM 0 HG22 VAL A 376 14.339 2.182 -19.214 1.00 0.00 H new ATOM 0 HG23 VAL A 376 15.724 1.154 -19.653 1.00 0.00 H new ATOM 194 N LEU A 377 16.461 0.554 -15.009 1.00 0.00 N ATOM 195 CA LEU A 377 16.547 0.289 -13.583 1.00 0.00 C ATOM 196 C LEU A 377 16.975 1.566 -12.857 1.00 0.00 C ATOM 197 O LEU A 377 16.247 2.072 -12.004 1.00 0.00 O ATOM 198 CB LEU A 377 17.463 -0.907 -13.315 1.00 0.00 C ATOM 199 CG LEU A 377 16.824 -2.289 -13.469 1.00 0.00 C ATOM 200 CD1 LEU A 377 15.916 -2.609 -12.280 1.00 0.00 C ATOM 201 CD2 LEU A 377 16.084 -2.405 -14.803 1.00 0.00 C ATOM 0 H LEU A 377 16.825 -0.191 -15.604 1.00 0.00 H new ATOM 0 HA LEU A 377 15.571 0.008 -13.188 1.00 0.00 H new ATOM 0 HB2 LEU A 377 18.315 -0.845 -13.992 1.00 0.00 H new ATOM 0 HB3 LEU A 377 17.854 -0.820 -12.301 1.00 0.00 H new ATOM 0 HG LEU A 377 17.619 -3.034 -13.476 1.00 0.00 H new ATOM 0 HD11 LEU A 377 15.475 -3.597 -12.415 1.00 0.00 H new ATOM 0 HD12 LEU A 377 16.502 -2.596 -11.361 1.00 0.00 H new ATOM 0 HD13 LEU A 377 15.124 -1.863 -12.216 1.00 0.00 H new ATOM 0 HD21 LEU A 377 15.639 -3.397 -14.887 1.00 0.00 H new ATOM 0 HD22 LEU A 377 15.299 -1.650 -14.851 1.00 0.00 H new ATOM 0 HD23 LEU A 377 16.786 -2.251 -15.623 1.00 0.00 H new ATOM 213 N GLY A 378 18.153 2.049 -13.221 1.00 0.00 N ATOM 214 CA GLY A 378 18.686 3.257 -12.615 1.00 0.00 C ATOM 215 C GLY A 378 17.652 4.385 -12.639 1.00 0.00 C ATOM 216 O GLY A 378 17.485 5.100 -11.652 1.00 0.00 O ATOM 0 H GLY A 378 18.754 1.626 -13.928 1.00 0.00 H new ATOM 0 HA2 GLY A 378 18.982 3.052 -11.586 1.00 0.00 H new ATOM 0 HA3 GLY A 378 19.584 3.570 -13.148 1.00 0.00 H new ATOM 220 N GLY A 379 16.985 4.509 -13.777 1.00 0.00 N ATOM 221 CA GLY A 379 15.972 5.537 -13.942 1.00 0.00 C ATOM 222 C GLY A 379 14.712 5.199 -13.142 1.00 0.00 C ATOM 223 O GLY A 379 13.852 6.056 -12.941 1.00 0.00 O ATOM 0 H GLY A 379 17.126 3.914 -14.594 1.00 0.00 H new ATOM 0 HA2 GLY A 379 16.368 6.498 -13.615 1.00 0.00 H new ATOM 0 HA3 GLY A 379 15.720 5.639 -14.998 1.00 0.00 H new ATOM 227 N VAL A 380 14.643 3.950 -12.708 1.00 0.00 N ATOM 228 CA VAL A 380 13.503 3.488 -11.934 1.00 0.00 C ATOM 229 C VAL A 380 13.831 3.583 -10.443 1.00 0.00 C ATOM 230 O VAL A 380 12.997 4.010 -9.646 1.00 0.00 O ATOM 231 CB VAL A 380 13.111 2.075 -12.371 1.00 0.00 C ATOM 232 CG1 VAL A 380 12.042 1.491 -11.446 1.00 0.00 C ATOM 233 CG2 VAL A 380 12.643 2.062 -13.828 1.00 0.00 C ATOM 0 H VAL A 380 15.358 3.243 -12.877 1.00 0.00 H new ATOM 0 HA VAL A 380 12.636 4.123 -12.117 1.00 0.00 H new ATOM 0 HB VAL A 380 13.997 1.444 -12.298 1.00 0.00 H new ATOM 0 HG11 VAL A 380 11.782 0.486 -11.779 1.00 0.00 H new ATOM 0 HG12 VAL A 380 12.427 1.447 -10.427 1.00 0.00 H new ATOM 0 HG13 VAL A 380 11.154 2.123 -11.471 1.00 0.00 H new ATOM 0 HG21 VAL A 380 12.370 1.046 -14.114 1.00 0.00 H new ATOM 0 HG22 VAL A 380 11.777 2.715 -13.938 1.00 0.00 H new ATOM 0 HG23 VAL A 380 13.448 2.416 -14.472 1.00 0.00 H new ATOM 243 N ALA A 381 15.048 3.179 -10.111 1.00 0.00 N ATOM 244 CA ALA A 381 15.497 3.214 -8.729 1.00 0.00 C ATOM 245 C ALA A 381 15.002 4.502 -8.069 1.00 0.00 C ATOM 246 O ALA A 381 14.272 4.456 -7.080 1.00 0.00 O ATOM 247 CB ALA A 381 17.021 3.083 -8.684 1.00 0.00 C ATOM 0 H ALA A 381 15.737 2.826 -10.775 1.00 0.00 H new ATOM 0 HA ALA A 381 15.081 2.376 -8.169 1.00 0.00 H new ATOM 0 HB1 ALA A 381 17.358 3.109 -7.648 1.00 0.00 H new ATOM 0 HB2 ALA A 381 17.319 2.138 -9.139 1.00 0.00 H new ATOM 0 HB3 ALA A 381 17.474 3.908 -9.234 1.00 0.00 H new ATOM 253 N GLY A 382 15.419 5.621 -8.642 1.00 0.00 N ATOM 254 CA GLY A 382 15.028 6.920 -8.121 1.00 0.00 C ATOM 255 C GLY A 382 13.509 7.011 -7.962 1.00 0.00 C ATOM 256 O GLY A 382 13.013 7.359 -6.891 1.00 0.00 O ATOM 0 H GLY A 382 16.024 5.655 -9.462 1.00 0.00 H new ATOM 0 HA2 GLY A 382 15.509 7.089 -7.158 1.00 0.00 H new ATOM 0 HA3 GLY A 382 15.375 7.705 -8.793 1.00 0.00 H new ATOM 260 N LEU A 383 12.812 6.693 -9.043 1.00 0.00 N ATOM 261 CA LEU A 383 11.360 6.734 -9.037 1.00 0.00 C ATOM 262 C LEU A 383 10.834 5.866 -7.893 1.00 0.00 C ATOM 263 O LEU A 383 9.950 6.284 -7.146 1.00 0.00 O ATOM 264 CB LEU A 383 10.807 6.345 -10.409 1.00 0.00 C ATOM 265 CG LEU A 383 10.284 7.494 -11.273 1.00 0.00 C ATOM 266 CD1 LEU A 383 9.414 8.447 -10.450 1.00 0.00 C ATOM 267 CD2 LEU A 383 11.434 8.225 -11.968 1.00 0.00 C ATOM 0 H LEU A 383 13.227 6.406 -9.930 1.00 0.00 H new ATOM 0 HA LEU A 383 11.009 7.749 -8.854 1.00 0.00 H new ATOM 0 HB2 LEU A 383 11.592 5.829 -10.962 1.00 0.00 H new ATOM 0 HB3 LEU A 383 9.998 5.630 -10.263 1.00 0.00 H new ATOM 0 HG LEU A 383 9.651 7.073 -12.054 1.00 0.00 H new ATOM 0 HD11 LEU A 383 9.055 9.255 -11.088 1.00 0.00 H new ATOM 0 HD12 LEU A 383 8.563 7.902 -10.042 1.00 0.00 H new ATOM 0 HD13 LEU A 383 10.003 8.864 -9.634 1.00 0.00 H new ATOM 0 HD21 LEU A 383 11.035 9.037 -12.576 1.00 0.00 H new ATOM 0 HD22 LEU A 383 12.112 8.633 -11.218 1.00 0.00 H new ATOM 0 HD23 LEU A 383 11.976 7.527 -12.606 1.00 0.00 H new ATOM 279 N LEU A 384 11.399 4.671 -7.791 1.00 0.00 N ATOM 280 CA LEU A 384 10.998 3.740 -6.750 1.00 0.00 C ATOM 281 C LEU A 384 11.128 4.420 -5.386 1.00 0.00 C ATOM 282 O LEU A 384 10.329 4.171 -4.485 1.00 0.00 O ATOM 283 CB LEU A 384 11.788 2.435 -6.865 1.00 0.00 C ATOM 284 CG LEU A 384 11.370 1.496 -7.998 1.00 0.00 C ATOM 285 CD1 LEU A 384 12.439 0.431 -8.251 1.00 0.00 C ATOM 286 CD2 LEU A 384 9.999 0.875 -7.718 1.00 0.00 C ATOM 0 H LEU A 384 12.131 4.327 -8.412 1.00 0.00 H new ATOM 0 HA LEU A 384 9.951 3.463 -6.869 1.00 0.00 H new ATOM 0 HB2 LEU A 384 12.842 2.682 -6.994 1.00 0.00 H new ATOM 0 HB3 LEU A 384 11.700 1.896 -5.922 1.00 0.00 H new ATOM 0 HG LEU A 384 11.278 2.084 -8.911 1.00 0.00 H new ATOM 0 HD11 LEU A 384 12.116 -0.223 -9.061 1.00 0.00 H new ATOM 0 HD12 LEU A 384 13.376 0.915 -8.526 1.00 0.00 H new ATOM 0 HD13 LEU A 384 12.587 -0.158 -7.346 1.00 0.00 H new ATOM 0 HD21 LEU A 384 9.726 0.212 -8.539 1.00 0.00 H new ATOM 0 HD22 LEU A 384 10.040 0.305 -6.790 1.00 0.00 H new ATOM 0 HD23 LEU A 384 9.254 1.665 -7.626 1.00 0.00 H new ATOM 298 N LEU A 385 12.143 5.265 -5.276 1.00 0.00 N ATOM 299 CA LEU A 385 12.389 5.982 -4.036 1.00 0.00 C ATOM 300 C LEU A 385 11.139 6.780 -3.658 1.00 0.00 C ATOM 301 O LEU A 385 10.577 6.586 -2.581 1.00 0.00 O ATOM 302 CB LEU A 385 13.652 6.837 -4.153 1.00 0.00 C ATOM 303 CG LEU A 385 14.428 7.068 -2.855 1.00 0.00 C ATOM 304 CD1 LEU A 385 15.499 5.993 -2.658 1.00 0.00 C ATOM 305 CD2 LEU A 385 15.018 8.479 -2.813 1.00 0.00 C ATOM 0 H LEU A 385 12.804 5.469 -6.025 1.00 0.00 H new ATOM 0 HA LEU A 385 12.580 5.282 -3.222 1.00 0.00 H new ATOM 0 HB2 LEU A 385 14.320 6.366 -4.874 1.00 0.00 H new ATOM 0 HB3 LEU A 385 13.373 7.807 -4.564 1.00 0.00 H new ATOM 0 HG LEU A 385 13.731 6.985 -2.021 1.00 0.00 H new ATOM 0 HD11 LEU A 385 16.036 6.181 -1.728 1.00 0.00 H new ATOM 0 HD12 LEU A 385 15.026 5.012 -2.612 1.00 0.00 H new ATOM 0 HD13 LEU A 385 16.199 6.020 -3.493 1.00 0.00 H new ATOM 0 HD21 LEU A 385 15.565 8.617 -1.880 1.00 0.00 H new ATOM 0 HD22 LEU A 385 15.697 8.615 -3.655 1.00 0.00 H new ATOM 0 HD23 LEU A 385 14.213 9.212 -2.874 1.00 0.00 H new ATOM 317 N PHE A 386 10.741 7.661 -4.564 1.00 0.00 N ATOM 318 CA PHE A 386 9.569 8.489 -4.338 1.00 0.00 C ATOM 319 C PHE A 386 8.319 7.629 -4.141 1.00 0.00 C ATOM 320 O PHE A 386 7.477 7.933 -3.298 1.00 0.00 O ATOM 321 CB PHE A 386 9.386 9.355 -5.586 1.00 0.00 C ATOM 322 CG PHE A 386 10.461 10.430 -5.760 1.00 0.00 C ATOM 323 CD1 PHE A 386 10.285 11.663 -5.213 1.00 0.00 C ATOM 324 CD2 PHE A 386 11.592 10.153 -6.463 1.00 0.00 C ATOM 325 CE1 PHE A 386 11.283 12.660 -5.375 1.00 0.00 C ATOM 326 CE2 PHE A 386 12.590 11.151 -6.625 1.00 0.00 C ATOM 327 CZ PHE A 386 12.414 12.383 -6.077 1.00 0.00 C ATOM 0 H PHE A 386 11.210 7.819 -5.456 1.00 0.00 H new ATOM 0 HA PHE A 386 9.707 9.092 -3.441 1.00 0.00 H new ATOM 0 HB2 PHE A 386 9.385 8.711 -6.466 1.00 0.00 H new ATOM 0 HB3 PHE A 386 8.409 9.836 -5.542 1.00 0.00 H new ATOM 0 HD1 PHE A 386 9.387 11.884 -4.656 1.00 0.00 H new ATOM 0 HD2 PHE A 386 11.731 9.174 -6.898 1.00 0.00 H new ATOM 0 HE1 PHE A 386 11.144 13.639 -4.940 1.00 0.00 H new ATOM 0 HE2 PHE A 386 13.488 10.931 -7.183 1.00 0.00 H new ATOM 0 HZ PHE A 386 13.173 13.142 -6.199 1.00 0.00 H new ATOM 337 N ILE A 387 8.238 6.570 -4.934 1.00 0.00 N ATOM 338 CA ILE A 387 7.106 5.663 -4.858 1.00 0.00 C ATOM 339 C ILE A 387 7.073 5.010 -3.475 1.00 0.00 C ATOM 340 O ILE A 387 6.006 4.856 -2.883 1.00 0.00 O ATOM 341 CB ILE A 387 7.145 4.658 -6.011 1.00 0.00 C ATOM 342 CG1 ILE A 387 6.601 5.280 -7.299 1.00 0.00 C ATOM 343 CG2 ILE A 387 6.409 3.370 -5.641 1.00 0.00 C ATOM 344 CD1 ILE A 387 7.459 4.886 -8.503 1.00 0.00 C ATOM 0 H ILE A 387 8.938 6.320 -5.632 1.00 0.00 H new ATOM 0 HA ILE A 387 6.171 6.211 -4.975 1.00 0.00 H new ATOM 0 HB ILE A 387 8.185 4.392 -6.197 1.00 0.00 H new ATOM 0 HG12 ILE A 387 5.573 4.954 -7.458 1.00 0.00 H new ATOM 0 HG13 ILE A 387 6.580 6.366 -7.202 1.00 0.00 H new ATOM 0 HG21 ILE A 387 6.452 2.673 -6.478 1.00 0.00 H new ATOM 0 HG22 ILE A 387 6.881 2.919 -4.768 1.00 0.00 H new ATOM 0 HG23 ILE A 387 5.368 3.599 -5.412 1.00 0.00 H new ATOM 0 HD11 ILE A 387 7.051 5.341 -9.405 1.00 0.00 H new ATOM 0 HD12 ILE A 387 8.481 5.234 -8.351 1.00 0.00 H new ATOM 0 HD13 ILE A 387 7.458 3.801 -8.611 1.00 0.00 H new ATOM 356 N GLY A 388 8.254 4.645 -3.000 1.00 0.00 N ATOM 357 CA GLY A 388 8.374 4.012 -1.697 1.00 0.00 C ATOM 358 C GLY A 388 8.246 5.042 -0.574 1.00 0.00 C ATOM 359 O GLY A 388 7.809 4.713 0.528 1.00 0.00 O ATOM 0 H GLY A 388 9.137 4.775 -3.494 1.00 0.00 H new ATOM 0 HA2 GLY A 388 7.602 3.250 -1.586 1.00 0.00 H new ATOM 0 HA3 GLY A 388 9.336 3.505 -1.622 1.00 0.00 H new ATOM 363 N LEU A 389 8.634 6.269 -0.891 1.00 0.00 N ATOM 364 CA LEU A 389 8.567 7.349 0.078 1.00 0.00 C ATOM 365 C LEU A 389 7.122 7.837 0.193 1.00 0.00 C ATOM 366 O LEU A 389 6.596 7.977 1.296 1.00 0.00 O ATOM 367 CB LEU A 389 9.562 8.454 -0.282 1.00 0.00 C ATOM 368 CG LEU A 389 8.974 9.690 -0.965 1.00 0.00 C ATOM 369 CD1 LEU A 389 8.068 10.467 -0.007 1.00 0.00 C ATOM 370 CD2 LEU A 389 10.079 10.572 -1.549 1.00 0.00 C ATOM 0 H LEU A 389 8.996 6.539 -1.806 1.00 0.00 H new ATOM 0 HA LEU A 389 8.863 6.994 1.065 1.00 0.00 H new ATOM 0 HB2 LEU A 389 10.066 8.773 0.630 1.00 0.00 H new ATOM 0 HB3 LEU A 389 10.324 8.030 -0.936 1.00 0.00 H new ATOM 0 HG LEU A 389 8.354 9.357 -1.797 1.00 0.00 H new ATOM 0 HD11 LEU A 389 7.663 11.341 -0.517 1.00 0.00 H new ATOM 0 HD12 LEU A 389 7.249 9.826 0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 389 8.646 10.788 0.860 1.00 0.00 H new ATOM 0 HD21 LEU A 389 9.634 11.444 -2.029 1.00 0.00 H new ATOM 0 HD22 LEU A 389 10.745 10.898 -0.750 1.00 0.00 H new ATOM 0 HD23 LEU A 389 10.647 10.004 -2.285 1.00 0.00 H new ATOM 382 N GLY A 390 6.520 8.083 -0.962 1.00 0.00 N ATOM 383 CA GLY A 390 5.146 8.553 -1.004 1.00 0.00 C ATOM 384 C GLY A 390 4.221 7.614 -0.226 1.00 0.00 C ATOM 385 O GLY A 390 3.367 8.068 0.533 1.00 0.00 O ATOM 0 H GLY A 390 6.959 7.966 -1.875 1.00 0.00 H new ATOM 0 HA2 GLY A 390 5.088 9.557 -0.583 1.00 0.00 H new ATOM 0 HA3 GLY A 390 4.813 8.622 -2.040 1.00 0.00 H new ATOM 389 N ILE A 391 4.424 6.323 -0.442 1.00 0.00 N ATOM 390 CA ILE A 391 3.619 5.317 0.230 1.00 0.00 C ATOM 391 C ILE A 391 4.005 5.266 1.709 1.00 0.00 C ATOM 392 O ILE A 391 3.174 5.521 2.580 1.00 0.00 O ATOM 393 CB ILE A 391 3.741 3.969 -0.484 1.00 0.00 C ATOM 394 CG1 ILE A 391 3.128 4.033 -1.885 1.00 0.00 C ATOM 395 CG2 ILE A 391 3.132 2.846 0.357 1.00 0.00 C ATOM 396 CD1 ILE A 391 1.626 4.313 -1.813 1.00 0.00 C ATOM 0 H ILE A 391 5.134 5.950 -1.073 1.00 0.00 H new ATOM 0 HA ILE A 391 2.563 5.582 0.185 1.00 0.00 H new ATOM 0 HB ILE A 391 4.800 3.742 -0.606 1.00 0.00 H new ATOM 0 HG12 ILE A 391 3.620 4.813 -2.466 1.00 0.00 H new ATOM 0 HG13 ILE A 391 3.302 3.091 -2.405 1.00 0.00 H new ATOM 0 HG21 ILE A 391 3.232 1.899 -0.173 1.00 0.00 H new ATOM 0 HG22 ILE A 391 3.653 2.783 1.312 1.00 0.00 H new ATOM 0 HG23 ILE A 391 2.076 3.054 0.532 1.00 0.00 H new ATOM 0 HD11 ILE A 391 1.215 4.354 -2.822 1.00 0.00 H new ATOM 0 HD12 ILE A 391 1.134 3.518 -1.252 1.00 0.00 H new ATOM 0 HD13 ILE A 391 1.457 5.267 -1.314 1.00 0.00 H new ATOM 408 N PHE A 392 5.265 4.934 1.949 1.00 0.00 N ATOM 409 CA PHE A 392 5.771 4.847 3.308 1.00 0.00 C ATOM 410 C PHE A 392 5.298 6.036 4.146 1.00 0.00 C ATOM 411 O PHE A 392 4.766 5.856 5.241 1.00 0.00 O ATOM 412 CB PHE A 392 7.298 4.875 3.220 1.00 0.00 C ATOM 413 CG PHE A 392 8.000 4.859 4.579 1.00 0.00 C ATOM 414 CD1 PHE A 392 7.664 3.923 5.507 1.00 0.00 C ATOM 415 CD2 PHE A 392 8.961 5.780 4.859 1.00 0.00 C ATOM 416 CE1 PHE A 392 8.316 3.908 6.768 1.00 0.00 C ATOM 417 CE2 PHE A 392 9.613 5.765 6.121 1.00 0.00 C ATOM 418 CZ PHE A 392 9.277 4.829 7.048 1.00 0.00 C ATOM 0 H PHE A 392 5.951 4.722 1.224 1.00 0.00 H new ATOM 0 HA PHE A 392 5.408 3.935 3.782 1.00 0.00 H new ATOM 0 HB2 PHE A 392 7.634 4.016 2.639 1.00 0.00 H new ATOM 0 HB3 PHE A 392 7.604 5.768 2.675 1.00 0.00 H new ATOM 0 HD1 PHE A 392 6.901 3.191 5.285 1.00 0.00 H new ATOM 0 HD2 PHE A 392 9.228 6.523 4.122 1.00 0.00 H new ATOM 0 HE1 PHE A 392 8.049 3.165 7.505 1.00 0.00 H new ATOM 0 HE2 PHE A 392 10.375 6.497 6.344 1.00 0.00 H new ATOM 0 HZ PHE A 392 9.773 4.817 8.007 1.00 0.00 H new ATOM 428 N PHE A 393 5.510 7.225 3.601 1.00 0.00 N ATOM 429 CA PHE A 393 5.112 8.443 4.285 1.00 0.00 C ATOM 430 C PHE A 393 3.616 8.428 4.607 1.00 0.00 C ATOM 431 O PHE A 393 3.175 9.072 5.558 1.00 0.00 O ATOM 432 CB PHE A 393 5.406 9.606 3.336 1.00 0.00 C ATOM 433 CG PHE A 393 6.862 10.073 3.356 1.00 0.00 C ATOM 434 CD1 PHE A 393 7.868 9.162 3.452 1.00 0.00 C ATOM 435 CD2 PHE A 393 7.152 11.400 3.279 1.00 0.00 C ATOM 436 CE1 PHE A 393 9.220 9.596 3.470 1.00 0.00 C ATOM 437 CE2 PHE A 393 8.504 11.833 3.297 1.00 0.00 C ATOM 438 CZ PHE A 393 9.509 10.922 3.393 1.00 0.00 C ATOM 0 H PHE A 393 5.952 7.370 2.693 1.00 0.00 H new ATOM 0 HA PHE A 393 5.657 8.537 5.224 1.00 0.00 H new ATOM 0 HB2 PHE A 393 5.145 9.308 2.321 1.00 0.00 H new ATOM 0 HB3 PHE A 393 4.762 10.446 3.597 1.00 0.00 H new ATOM 0 HD1 PHE A 393 7.638 8.109 3.515 1.00 0.00 H new ATOM 0 HD2 PHE A 393 6.354 12.124 3.204 1.00 0.00 H new ATOM 0 HE1 PHE A 393 10.018 8.873 3.545 1.00 0.00 H new ATOM 0 HE2 PHE A 393 8.734 12.886 3.234 1.00 0.00 H new ATOM 0 HZ PHE A 393 10.537 11.252 3.408 1.00 0.00 H new ATOM 448 N SER A 394 2.876 7.686 3.795 1.00 0.00 N ATOM 449 CA SER A 394 1.439 7.579 3.981 1.00 0.00 C ATOM 450 C SER A 394 1.120 6.427 4.936 1.00 0.00 C ATOM 451 O SER A 394 -0.022 5.975 5.009 1.00 0.00 O ATOM 452 CB SER A 394 0.725 7.374 2.644 1.00 0.00 C ATOM 453 OG SER A 394 1.111 8.348 1.678 1.00 0.00 O ATOM 0 H SER A 394 3.245 7.153 3.007 1.00 0.00 H new ATOM 0 HA SER A 394 1.079 8.512 4.415 1.00 0.00 H new ATOM 0 HB2 SER A 394 0.948 6.377 2.263 1.00 0.00 H new ATOM 0 HB3 SER A 394 -0.353 7.423 2.797 1.00 0.00 H new ATOM 0 HG SER A 394 2.076 8.288 1.521 1.00 0.00 H new ATOM 459 N VAL A 395 2.149 5.984 5.644 1.00 0.00 N ATOM 460 CA VAL A 395 1.992 4.893 6.591 1.00 0.00 C ATOM 461 C VAL A 395 2.930 5.116 7.779 1.00 0.00 C ATOM 462 O VAL A 395 2.523 5.666 8.801 1.00 0.00 O ATOM 463 CB VAL A 395 2.223 3.554 5.889 1.00 0.00 C ATOM 464 CG1 VAL A 395 2.212 2.399 6.893 1.00 0.00 C ATOM 465 CG2 VAL A 395 1.191 3.329 4.782 1.00 0.00 C ATOM 0 H VAL A 395 3.095 6.361 5.581 1.00 0.00 H new ATOM 0 HA VAL A 395 0.974 4.868 6.981 1.00 0.00 H new ATOM 0 HB VAL A 395 3.209 3.585 5.425 1.00 0.00 H new ATOM 0 HG11 VAL A 395 2.378 1.459 6.368 1.00 0.00 H new ATOM 0 HG12 VAL A 395 3.002 2.549 7.628 1.00 0.00 H new ATOM 0 HG13 VAL A 395 1.247 2.366 7.399 1.00 0.00 H new ATOM 0 HG21 VAL A 395 1.378 2.370 4.299 1.00 0.00 H new ATOM 0 HG22 VAL A 395 0.190 3.329 5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 395 1.269 4.128 4.044 1.00 0.00 H new ATOM 475 N ARG A 396 4.168 4.677 7.604 1.00 0.00 N ATOM 476 CA ARG A 396 5.167 4.821 8.649 1.00 0.00 C ATOM 477 C ARG A 396 4.751 4.035 9.894 1.00 0.00 C ATOM 478 O ARG A 396 3.765 4.376 10.547 1.00 0.00 O ATOM 479 CB ARG A 396 5.363 6.292 9.025 1.00 0.00 C ATOM 480 CG ARG A 396 6.105 7.046 7.919 1.00 0.00 C ATOM 481 CD ARG A 396 7.566 7.284 8.304 1.00 0.00 C ATOM 482 NE ARG A 396 8.055 6.172 9.148 1.00 0.00 N ATOM 483 CZ ARG A 396 9.173 6.224 9.886 1.00 0.00 C ATOM 484 NH1 ARG A 396 9.923 7.334 9.887 1.00 0.00 N ATOM 485 NH2 ARG A 396 9.540 5.166 10.622 1.00 0.00 N ATOM 0 H ARG A 396 4.502 4.222 6.754 1.00 0.00 H new ATOM 0 HA ARG A 396 6.108 4.427 8.264 1.00 0.00 H new ATOM 0 HB2 ARG A 396 4.394 6.758 9.201 1.00 0.00 H new ATOM 0 HB3 ARG A 396 5.924 6.361 9.957 1.00 0.00 H new ATOM 0 HG2 ARG A 396 6.058 6.477 6.991 1.00 0.00 H new ATOM 0 HG3 ARG A 396 5.614 8.001 7.732 1.00 0.00 H new ATOM 0 HD2 ARG A 396 8.178 7.366 7.406 1.00 0.00 H new ATOM 0 HD3 ARG A 396 7.660 8.228 8.841 1.00 0.00 H new ATOM 0 HE ARG A 396 7.507 5.312 9.170 1.00 0.00 H new ATOM 0 HH11 ARG A 396 9.643 8.139 9.326 1.00 0.00 H new ATOM 0 HH12 ARG A 396 10.774 7.374 10.448 1.00 0.00 H new ATOM 0 HH21 ARG A 396 8.969 4.321 10.621 1.00 0.00 H new ATOM 0 HH22 ARG A 396 10.391 5.206 11.183 1.00 0.00 H new ATOM 499 N SER A 397 5.522 2.998 10.186 1.00 0.00 N ATOM 500 CA SER A 397 5.246 2.161 11.341 1.00 0.00 C ATOM 501 C SER A 397 3.737 1.964 11.495 1.00 0.00 C ATOM 502 O SER A 397 2.995 2.032 10.516 1.00 0.00 O ATOM 503 CB SER A 397 5.834 2.770 12.615 1.00 0.00 C ATOM 504 OG SER A 397 7.152 3.272 12.409 1.00 0.00 O ATOM 0 H SER A 397 6.338 2.718 9.642 1.00 0.00 H new ATOM 0 HA SER A 397 5.719 1.192 11.182 1.00 0.00 H new ATOM 0 HB2 SER A 397 5.189 3.577 12.962 1.00 0.00 H new ATOM 0 HB3 SER A 397 5.852 2.016 13.402 1.00 0.00 H new ATOM 0 HG SER A 397 7.491 3.654 13.245 1.00 0.00 H new ATOM 510 N ARG A 398 3.327 1.722 12.731 1.00 0.00 N ATOM 511 CA ARG A 398 1.919 1.514 13.026 1.00 0.00 C ATOM 512 C ARG A 398 1.531 2.249 14.310 1.00 0.00 C ATOM 513 O ARG A 398 2.343 2.972 14.885 1.00 0.00 O ATOM 514 CB ARG A 398 1.604 0.025 13.183 1.00 0.00 C ATOM 515 CG ARG A 398 2.154 -0.515 14.505 1.00 0.00 C ATOM 516 CD ARG A 398 2.164 -2.045 14.510 1.00 0.00 C ATOM 517 NE ARG A 398 3.489 -2.543 14.078 1.00 0.00 N ATOM 518 CZ ARG A 398 3.706 -3.772 13.589 1.00 0.00 C ATOM 519 NH1 ARG A 398 2.688 -4.635 13.468 1.00 0.00 N ATOM 520 NH2 ARG A 398 4.942 -4.138 13.222 1.00 0.00 N ATOM 0 H ARG A 398 3.945 1.665 13.540 1.00 0.00 H new ATOM 0 HA ARG A 398 1.343 1.910 12.190 1.00 0.00 H new ATOM 0 HB2 ARG A 398 0.526 -0.128 13.144 1.00 0.00 H new ATOM 0 HB3 ARG A 398 2.036 -0.531 12.351 1.00 0.00 H new ATOM 0 HG2 ARG A 398 3.166 -0.141 14.662 1.00 0.00 H new ATOM 0 HG3 ARG A 398 1.546 -0.149 15.333 1.00 0.00 H new ATOM 0 HD2 ARG A 398 1.935 -2.415 15.509 1.00 0.00 H new ATOM 0 HD3 ARG A 398 1.389 -2.424 13.844 1.00 0.00 H new ATOM 0 HE ARG A 398 4.286 -1.912 14.157 1.00 0.00 H new ATOM 0 HH11 ARG A 398 1.747 -4.357 13.748 1.00 0.00 H new ATOM 0 HH12 ARG A 398 2.854 -5.570 13.096 1.00 0.00 H new ATOM 0 HH21 ARG A 398 5.717 -3.481 13.315 1.00 0.00 H new ATOM 0 HH22 ARG A 398 5.108 -5.073 12.850 1.00 0.00 H new ATOM 534 N HIS A 399 0.290 2.039 14.722 1.00 0.00 N ATOM 535 CA HIS A 399 -0.216 2.673 15.928 1.00 0.00 C ATOM 536 C HIS A 399 0.026 4.182 15.855 1.00 0.00 C ATOM 537 O HIS A 399 0.950 4.697 16.483 1.00 0.00 O ATOM 538 CB HIS A 399 0.397 2.034 17.176 1.00 0.00 C ATOM 539 CG HIS A 399 0.153 0.548 17.288 1.00 0.00 C ATOM 540 ND1 HIS A 399 1.005 -0.302 17.971 1.00 0.00 N ATOM 541 CD2 HIS A 399 -0.857 -0.228 16.799 1.00 0.00 C ATOM 542 CE1 HIS A 399 0.521 -1.533 17.889 1.00 0.00 C ATOM 543 NE2 HIS A 399 -0.632 -1.485 17.162 1.00 0.00 N ATOM 0 H HIS A 399 -0.381 1.439 14.242 1.00 0.00 H new ATOM 0 HA HIS A 399 -1.292 2.516 16.001 1.00 0.00 H new ATOM 0 HB2 HIS A 399 1.472 2.216 17.174 1.00 0.00 H new ATOM 0 HB3 HIS A 399 -0.008 2.526 18.060 1.00 0.00 H new ATOM 0 HD2 HIS A 399 -1.696 0.121 16.216 1.00 0.00 H new ATOM 0 HE1 HIS A 399 0.962 -2.419 18.322 1.00 0.00 H new ATOM 0 HE2 HIS A 399 -1.224 -2.284 16.935 1.00 0.00 H new ATOM 552 N ARG A 400 -0.820 4.848 15.083 1.00 0.00 N ATOM 553 CA ARG A 400 -0.709 6.288 14.919 1.00 0.00 C ATOM 554 C ARG A 400 0.628 6.647 14.269 1.00 0.00 C ATOM 555 O ARG A 400 0.703 6.826 13.054 1.00 0.00 O ATOM 556 CB ARG A 400 -0.823 7.005 16.266 1.00 0.00 C ATOM 557 CG ARG A 400 -2.260 6.966 16.788 1.00 0.00 C ATOM 558 CD ARG A 400 -2.353 7.587 18.184 1.00 0.00 C ATOM 559 NE ARG A 400 -1.515 6.823 19.135 1.00 0.00 N ATOM 560 CZ ARG A 400 -0.210 7.048 19.334 1.00 0.00 C ATOM 561 NH1 ARG A 400 0.415 8.017 18.651 1.00 0.00 N ATOM 562 NH2 ARG A 400 0.471 6.305 20.218 1.00 0.00 N ATOM 0 H ARG A 400 -1.585 4.417 14.564 1.00 0.00 H new ATOM 0 HA ARG A 400 -1.527 6.613 14.276 1.00 0.00 H new ATOM 0 HB2 ARG A 400 -0.157 6.535 16.990 1.00 0.00 H new ATOM 0 HB3 ARG A 400 -0.499 8.040 16.159 1.00 0.00 H new ATOM 0 HG2 ARG A 400 -2.915 7.504 16.102 1.00 0.00 H new ATOM 0 HG3 ARG A 400 -2.611 5.935 16.821 1.00 0.00 H new ATOM 0 HD2 ARG A 400 -2.025 8.626 18.151 1.00 0.00 H new ATOM 0 HD3 ARG A 400 -3.390 7.590 18.521 1.00 0.00 H new ATOM 0 HE ARG A 400 -1.959 6.079 19.672 1.00 0.00 H new ATOM 0 HH11 ARG A 400 -0.103 8.583 17.979 1.00 0.00 H new ATOM 0 HH12 ARG A 400 1.409 8.188 18.803 1.00 0.00 H new ATOM 0 HH21 ARG A 400 -0.005 5.568 20.739 1.00 0.00 H new ATOM 0 HH22 ARG A 400 1.465 6.476 20.370 1.00 0.00 H new ATOM 576 N ARG A 401 1.650 6.742 15.106 1.00 0.00 N ATOM 577 CA ARG A 401 2.981 7.077 14.628 1.00 0.00 C ATOM 578 C ARG A 401 2.898 8.134 13.524 1.00 0.00 C ATOM 579 O ARG A 401 3.735 8.162 12.623 1.00 0.00 O ATOM 580 CB ARG A 401 3.699 5.839 14.086 1.00 0.00 C ATOM 581 CG ARG A 401 4.458 5.114 15.199 1.00 0.00 C ATOM 582 CD ARG A 401 5.896 5.627 15.305 1.00 0.00 C ATOM 583 NE ARG A 401 5.970 6.726 16.294 1.00 0.00 N ATOM 584 CZ ARG A 401 7.096 7.383 16.604 1.00 0.00 C ATOM 585 NH1 ARG A 401 8.249 7.056 16.005 1.00 0.00 N ATOM 586 NH2 ARG A 401 7.068 8.367 17.513 1.00 0.00 N ATOM 0 H ARG A 401 1.584 6.593 16.113 1.00 0.00 H new ATOM 0 HA ARG A 401 3.547 7.471 15.472 1.00 0.00 H new ATOM 0 HB2 ARG A 401 2.974 5.162 13.635 1.00 0.00 H new ATOM 0 HB3 ARG A 401 4.394 6.133 13.299 1.00 0.00 H new ATOM 0 HG2 ARG A 401 3.945 5.260 16.149 1.00 0.00 H new ATOM 0 HG3 ARG A 401 4.464 4.042 15.002 1.00 0.00 H new ATOM 0 HD2 ARG A 401 6.560 4.815 15.601 1.00 0.00 H new ATOM 0 HD3 ARG A 401 6.238 5.979 14.332 1.00 0.00 H new ATOM 0 HE ARG A 401 5.110 7.000 16.769 1.00 0.00 H new ATOM 0 HH11 ARG A 401 8.270 6.307 15.313 1.00 0.00 H new ATOM 0 HH12 ARG A 401 9.106 7.556 16.241 1.00 0.00 H new ATOM 0 HH21 ARG A 401 6.190 8.616 17.969 1.00 0.00 H new ATOM 0 HH22 ARG A 401 7.925 8.867 17.749 1.00 0.00 H new ATOM 600 N ARG A 402 1.881 8.976 13.632 1.00 0.00 N ATOM 601 CA ARG A 402 1.678 10.032 12.654 1.00 0.00 C ATOM 602 C ARG A 402 1.413 9.432 11.272 1.00 0.00 C ATOM 603 O ARG A 402 1.883 8.337 10.966 1.00 0.00 O ATOM 604 CB ARG A 402 2.897 10.954 12.578 1.00 0.00 C ATOM 605 CG ARG A 402 3.225 11.545 13.950 1.00 0.00 C ATOM 606 CD ARG A 402 4.650 12.101 13.982 1.00 0.00 C ATOM 607 NE ARG A 402 4.647 13.470 14.544 1.00 0.00 N ATOM 608 CZ ARG A 402 5.741 14.102 14.990 1.00 0.00 C ATOM 609 NH1 ARG A 402 6.933 13.491 14.943 1.00 0.00 N ATOM 610 NH2 ARG A 402 5.643 15.344 15.483 1.00 0.00 N ATOM 0 H ARG A 402 1.189 8.949 14.381 1.00 0.00 H new ATOM 0 HA ARG A 402 0.814 10.616 12.971 1.00 0.00 H new ATOM 0 HB2 ARG A 402 3.756 10.397 12.204 1.00 0.00 H new ATOM 0 HB3 ARG A 402 2.705 11.759 11.868 1.00 0.00 H new ATOM 0 HG2 ARG A 402 2.516 12.338 14.187 1.00 0.00 H new ATOM 0 HG3 ARG A 402 3.113 10.778 14.716 1.00 0.00 H new ATOM 0 HD2 ARG A 402 5.288 11.454 14.583 1.00 0.00 H new ATOM 0 HD3 ARG A 402 5.067 12.113 12.975 1.00 0.00 H new ATOM 0 HE ARG A 402 3.756 13.964 14.595 1.00 0.00 H new ATOM 0 HH11 ARG A 402 7.007 12.545 14.568 1.00 0.00 H new ATOM 0 HH12 ARG A 402 7.766 13.972 15.282 1.00 0.00 H new ATOM 0 HH21 ARG A 402 4.736 15.808 15.519 1.00 0.00 H new ATOM 0 HH22 ARG A 402 6.476 15.825 15.823 1.00 0.00 H new ATOM 624 N GLN A 403 0.662 10.176 10.474 1.00 0.00 N ATOM 625 CA GLN A 403 0.329 9.731 9.131 1.00 0.00 C ATOM 626 C GLN A 403 -0.535 8.470 9.189 1.00 0.00 C ATOM 627 O GLN A 403 -0.380 7.568 8.366 1.00 0.00 O ATOM 628 CB GLN A 403 1.593 9.492 8.303 1.00 0.00 C ATOM 629 CG GLN A 403 2.154 10.811 7.767 1.00 0.00 C ATOM 630 CD GLN A 403 1.093 11.577 6.974 1.00 0.00 C ATOM 631 OE1 GLN A 403 0.163 11.011 6.426 1.00 0.00 O ATOM 632 NE2 GLN A 403 1.285 12.893 6.945 1.00 0.00 N ATOM 0 H GLN A 403 0.275 11.084 10.731 1.00 0.00 H new ATOM 0 HA GLN A 403 -0.243 10.518 8.640 1.00 0.00 H new ATOM 0 HB2 GLN A 403 2.345 8.995 8.916 1.00 0.00 H new ATOM 0 HB3 GLN A 403 1.367 8.824 7.472 1.00 0.00 H new ATOM 0 HG2 GLN A 403 2.506 11.424 8.597 1.00 0.00 H new ATOM 0 HG3 GLN A 403 3.016 10.612 7.130 1.00 0.00 H new ATOM 0 HE21 GLN A 403 2.086 13.302 7.426 1.00 0.00 H new ATOM 0 HE22 GLN A 403 0.631 13.493 6.442 1.00 0.00 H new ATOM 641 N ALA A 404 -1.427 8.446 10.169 1.00 0.00 N ATOM 642 CA ALA A 404 -2.315 7.310 10.345 1.00 0.00 C ATOM 643 C ALA A 404 -3.027 7.429 11.694 1.00 0.00 C ATOM 644 O ALA A 404 -2.902 6.550 12.546 1.00 0.00 O ATOM 645 CB ALA A 404 -1.515 6.011 10.221 1.00 0.00 C ATOM 0 H ALA A 404 -1.553 9.195 10.849 1.00 0.00 H new ATOM 0 HA ALA A 404 -3.079 7.297 9.568 1.00 0.00 H new ATOM 0 HB1 ALA A 404 -2.182 5.159 10.353 1.00 0.00 H new ATOM 0 HB2 ALA A 404 -1.053 5.961 9.235 1.00 0.00 H new ATOM 0 HB3 ALA A 404 -0.739 5.987 10.986 1.00 0.00 H new ATOM 651 N GLU A 405 -3.759 8.523 11.846 1.00 0.00 N ATOM 652 CA GLU A 405 -4.492 8.768 13.076 1.00 0.00 C ATOM 653 C GLU A 405 -5.982 8.948 12.780 1.00 0.00 C ATOM 654 O GLU A 405 -6.820 8.249 13.347 1.00 0.00 O ATOM 655 CB GLU A 405 -3.929 9.983 13.817 1.00 0.00 C ATOM 656 CG GLU A 405 -2.671 9.611 14.604 1.00 0.00 C ATOM 657 CD GLU A 405 -2.852 9.900 16.096 1.00 0.00 C ATOM 658 OE1 GLU A 405 -1.900 10.329 16.764 1.00 0.00 O ATOM 659 OE2 GLU A 405 -4.034 9.664 16.557 1.00 0.00 O ATOM 0 H GLU A 405 -3.860 9.250 11.137 1.00 0.00 H new ATOM 0 HA GLU A 405 -4.373 7.901 13.725 1.00 0.00 H new ATOM 0 HB2 GLU A 405 -3.695 10.773 13.103 1.00 0.00 H new ATOM 0 HB3 GLU A 405 -4.683 10.381 14.496 1.00 0.00 H new ATOM 0 HG2 GLU A 405 -2.446 8.554 14.459 1.00 0.00 H new ATOM 0 HG3 GLU A 405 -1.819 10.173 14.222 1.00 0.00 H new ATOM 667 N ARG A 406 -6.267 9.891 11.893 1.00 0.00 N ATOM 668 CA ARG A 406 -7.641 10.172 11.515 1.00 0.00 C ATOM 669 C ARG A 406 -8.030 9.355 10.281 1.00 0.00 C ATOM 670 O ARG A 406 -9.173 8.919 10.155 1.00 0.00 O ATOM 671 CB ARG A 406 -7.837 11.659 11.217 1.00 0.00 C ATOM 672 CG ARG A 406 -9.310 11.977 10.954 1.00 0.00 C ATOM 673 CD ARG A 406 -9.463 13.324 10.245 1.00 0.00 C ATOM 674 NE ARG A 406 -10.560 13.254 9.255 1.00 0.00 N ATOM 675 CZ ARG A 406 -11.861 13.320 9.569 1.00 0.00 C ATOM 676 NH1 ARG A 406 -12.235 13.458 10.848 1.00 0.00 N ATOM 677 NH2 ARG A 406 -12.788 13.247 8.604 1.00 0.00 N ATOM 0 H ARG A 406 -5.569 10.470 11.426 1.00 0.00 H new ATOM 0 HA ARG A 406 -8.279 9.895 12.354 1.00 0.00 H new ATOM 0 HB2 ARG A 406 -7.478 12.252 12.058 1.00 0.00 H new ATOM 0 HB3 ARG A 406 -7.240 11.941 10.350 1.00 0.00 H new ATOM 0 HG2 ARG A 406 -9.752 11.189 10.344 1.00 0.00 H new ATOM 0 HG3 ARG A 406 -9.856 11.995 11.897 1.00 0.00 H new ATOM 0 HD2 ARG A 406 -9.670 14.107 10.975 1.00 0.00 H new ATOM 0 HD3 ARG A 406 -8.530 13.591 9.748 1.00 0.00 H new ATOM 0 HE ARG A 406 -10.310 13.149 8.272 1.00 0.00 H new ATOM 0 HH11 ARG A 406 -11.529 13.513 11.583 1.00 0.00 H new ATOM 0 HH12 ARG A 406 -13.225 13.508 11.087 1.00 0.00 H new ATOM 0 HH21 ARG A 406 -12.503 13.141 7.630 1.00 0.00 H new ATOM 0 HH22 ARG A 406 -13.778 13.297 8.843 1.00 0.00 H new ATOM 691 N MET A 407 -7.056 9.174 9.401 1.00 0.00 N ATOM 692 CA MET A 407 -7.282 8.417 8.180 1.00 0.00 C ATOM 693 C MET A 407 -7.691 6.977 8.496 1.00 0.00 C ATOM 694 O MET A 407 -8.735 6.511 8.042 1.00 0.00 O ATOM 695 CB MET A 407 -6.005 8.413 7.338 1.00 0.00 C ATOM 696 CG MET A 407 -6.237 9.091 5.986 1.00 0.00 C ATOM 697 SD MET A 407 -7.646 8.358 5.171 1.00 0.00 S ATOM 698 CE MET A 407 -7.092 6.666 5.056 1.00 0.00 C ATOM 0 H MET A 407 -6.109 9.538 9.509 1.00 0.00 H new ATOM 0 HA MET A 407 -8.092 8.891 7.625 1.00 0.00 H new ATOM 0 HB2 MET A 407 -5.209 8.929 7.876 1.00 0.00 H new ATOM 0 HB3 MET A 407 -5.671 7.387 7.182 1.00 0.00 H new ATOM 0 HG2 MET A 407 -6.404 10.159 6.129 1.00 0.00 H new ATOM 0 HG3 MET A 407 -5.350 8.988 5.361 1.00 0.00 H new ATOM 0 HE1 MET A 407 -7.365 6.259 4.082 1.00 0.00 H new ATOM 0 HE2 MET A 407 -6.009 6.629 5.174 1.00 0.00 H new ATOM 0 HE3 MET A 407 -7.563 6.075 5.841 1.00 0.00 H new ATOM 708 N SER A 408 -6.846 6.313 9.271 1.00 0.00 N ATOM 709 CA SER A 408 -7.106 4.935 9.652 1.00 0.00 C ATOM 710 C SER A 408 -8.593 4.749 9.962 1.00 0.00 C ATOM 711 O SER A 408 -9.212 3.790 9.503 1.00 0.00 O ATOM 712 CB SER A 408 -6.258 4.528 10.859 1.00 0.00 C ATOM 713 OG SER A 408 -5.028 3.924 10.467 1.00 0.00 O ATOM 0 H SER A 408 -5.981 6.703 9.645 1.00 0.00 H new ATOM 0 HA SER A 408 -6.832 4.292 8.816 1.00 0.00 H new ATOM 0 HB2 SER A 408 -6.052 5.407 11.470 1.00 0.00 H new ATOM 0 HB3 SER A 408 -6.822 3.832 11.480 1.00 0.00 H new ATOM 0 HG SER A 408 -4.514 3.680 11.265 1.00 0.00 H new ATOM 719 N GLN A 409 -9.124 5.682 10.739 1.00 0.00 N ATOM 720 CA GLN A 409 -10.526 5.634 11.116 1.00 0.00 C ATOM 721 C GLN A 409 -11.412 5.661 9.868 1.00 0.00 C ATOM 722 O GLN A 409 -12.323 4.846 9.732 1.00 0.00 O ATOM 723 CB GLN A 409 -10.879 6.781 12.064 1.00 0.00 C ATOM 724 CG GLN A 409 -10.641 6.381 13.521 1.00 0.00 C ATOM 725 CD GLN A 409 -11.965 6.233 14.273 1.00 0.00 C ATOM 726 OE1 GLN A 409 -13.037 6.193 13.692 1.00 0.00 O ATOM 727 NE2 GLN A 409 -11.832 6.155 15.594 1.00 0.00 N ATOM 0 H GLN A 409 -8.608 6.476 11.118 1.00 0.00 H new ATOM 0 HA GLN A 409 -10.708 4.700 11.647 1.00 0.00 H new ATOM 0 HB2 GLN A 409 -10.277 7.657 11.821 1.00 0.00 H new ATOM 0 HB3 GLN A 409 -11.923 7.063 11.926 1.00 0.00 H new ATOM 0 HG2 GLN A 409 -10.091 5.441 13.558 1.00 0.00 H new ATOM 0 HG3 GLN A 409 -10.022 7.132 14.012 1.00 0.00 H new ATOM 0 HE21 GLN A 409 -10.904 6.195 16.016 1.00 0.00 H new ATOM 0 HE22 GLN A 409 -12.658 6.055 16.185 1.00 0.00 H new ATOM 736 N ILE A 410 -11.113 6.607 8.990 1.00 0.00 N ATOM 737 CA ILE A 410 -11.871 6.751 7.759 1.00 0.00 C ATOM 738 C ILE A 410 -11.632 5.527 6.872 1.00 0.00 C ATOM 739 O ILE A 410 -12.539 5.074 6.175 1.00 0.00 O ATOM 740 CB ILE A 410 -11.538 8.079 7.077 1.00 0.00 C ATOM 741 CG1 ILE A 410 -12.405 9.212 7.630 1.00 0.00 C ATOM 742 CG2 ILE A 410 -11.654 7.959 5.556 1.00 0.00 C ATOM 743 CD1 ILE A 410 -11.829 9.754 8.939 1.00 0.00 C ATOM 0 H ILE A 410 -10.356 7.281 9.107 1.00 0.00 H new ATOM 0 HA ILE A 410 -12.939 6.788 7.972 1.00 0.00 H new ATOM 0 HB ILE A 410 -10.501 8.328 7.302 1.00 0.00 H new ATOM 0 HG12 ILE A 410 -12.470 10.016 6.897 1.00 0.00 H new ATOM 0 HG13 ILE A 410 -13.419 8.850 7.797 1.00 0.00 H new ATOM 0 HG21 ILE A 410 -11.412 8.917 5.096 1.00 0.00 H new ATOM 0 HG22 ILE A 410 -10.960 7.199 5.197 1.00 0.00 H new ATOM 0 HG23 ILE A 410 -12.672 7.676 5.290 1.00 0.00 H new ATOM 0 HD11 ILE A 410 -12.464 10.558 9.311 1.00 0.00 H new ATOM 0 HD12 ILE A 410 -11.788 8.953 9.677 1.00 0.00 H new ATOM 0 HD13 ILE A 410 -10.824 10.137 8.763 1.00 0.00 H new ATOM 755 N LYS A 411 -10.407 5.026 6.927 1.00 0.00 N ATOM 756 CA LYS A 411 -10.037 3.864 6.137 1.00 0.00 C ATOM 757 C LYS A 411 -11.196 2.865 6.135 1.00 0.00 C ATOM 758 O LYS A 411 -11.839 2.657 5.107 1.00 0.00 O ATOM 759 CB LYS A 411 -8.717 3.274 6.638 1.00 0.00 C ATOM 760 CG LYS A 411 -7.870 2.759 5.472 1.00 0.00 C ATOM 761 CD LYS A 411 -6.381 3.011 5.724 1.00 0.00 C ATOM 762 CE LYS A 411 -5.714 1.782 6.343 1.00 0.00 C ATOM 763 NZ LYS A 411 -5.535 0.722 5.326 1.00 0.00 N ATOM 0 H LYS A 411 -9.658 5.404 7.507 1.00 0.00 H new ATOM 0 HA LYS A 411 -9.859 4.149 5.100 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -8.161 4.033 7.189 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -8.919 2.459 7.333 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -8.044 1.692 5.335 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -8.175 3.253 4.550 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -5.887 3.263 4.785 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -6.261 3.867 6.388 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -4.747 2.059 6.763 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -6.323 1.406 7.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -4.841 0.027 5.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -6.445 0.248 5.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -5.193 1.145 4.440 1.00 0.00 H new ATOM 777 N ARG A 412 -11.427 2.272 7.297 1.00 0.00 N ATOM 778 CA ARG A 412 -12.497 1.300 7.442 1.00 0.00 C ATOM 779 C ARG A 412 -13.825 1.900 6.979 1.00 0.00 C ATOM 780 O ARG A 412 -14.521 1.313 6.152 1.00 0.00 O ATOM 781 CB ARG A 412 -12.631 0.842 8.896 1.00 0.00 C ATOM 782 CG ARG A 412 -11.767 -0.391 9.164 1.00 0.00 C ATOM 783 CD ARG A 412 -10.278 -0.045 9.086 1.00 0.00 C ATOM 784 NE ARG A 412 -9.556 -0.656 10.224 1.00 0.00 N ATOM 785 CZ ARG A 412 -9.417 -1.977 10.403 1.00 0.00 C ATOM 786 NH1 ARG A 412 -9.950 -2.833 9.521 1.00 0.00 N ATOM 787 NH2 ARG A 412 -8.745 -2.442 11.465 1.00 0.00 N ATOM 0 H ARG A 412 -10.891 2.446 8.147 1.00 0.00 H new ATOM 0 HA ARG A 412 -12.249 0.438 6.823 1.00 0.00 H new ATOM 0 HB2 ARG A 412 -12.335 1.650 9.564 1.00 0.00 H new ATOM 0 HB3 ARG A 412 -13.674 0.614 9.115 1.00 0.00 H new ATOM 0 HG2 ARG A 412 -11.999 -0.795 10.150 1.00 0.00 H new ATOM 0 HG3 ARG A 412 -12.002 -1.169 8.437 1.00 0.00 H new ATOM 0 HD2 ARG A 412 -9.861 -0.405 8.145 1.00 0.00 H new ATOM 0 HD3 ARG A 412 -10.146 1.037 9.100 1.00 0.00 H new ATOM 0 HE ARG A 412 -9.138 -0.033 10.915 1.00 0.00 H new ATOM 0 HH11 ARG A 412 -10.462 -2.480 8.713 1.00 0.00 H new ATOM 0 HH12 ARG A 412 -9.844 -3.838 9.658 1.00 0.00 H new ATOM 0 HH21 ARG A 412 -8.339 -1.791 12.137 1.00 0.00 H new ATOM 0 HH22 ARG A 412 -8.639 -3.447 11.601 1.00 0.00 H new ATOM 801 N LEU A 413 -14.138 3.063 7.532 1.00 0.00 N ATOM 802 CA LEU A 413 -15.371 3.749 7.185 1.00 0.00 C ATOM 803 C LEU A 413 -15.619 3.615 5.681 1.00 0.00 C ATOM 804 O LEU A 413 -16.706 3.220 5.261 1.00 0.00 O ATOM 805 CB LEU A 413 -15.335 5.198 7.676 1.00 0.00 C ATOM 806 CG LEU A 413 -16.482 6.094 7.206 1.00 0.00 C ATOM 807 CD1 LEU A 413 -16.293 6.506 5.745 1.00 0.00 C ATOM 808 CD2 LEU A 413 -17.835 5.421 7.441 1.00 0.00 C ATOM 0 H LEU A 413 -13.559 3.547 8.218 1.00 0.00 H new ATOM 0 HA LEU A 413 -16.219 3.287 7.690 1.00 0.00 H new ATOM 0 HB2 LEU A 413 -15.329 5.191 8.766 1.00 0.00 H new ATOM 0 HB3 LEU A 413 -14.395 5.646 7.355 1.00 0.00 H new ATOM 0 HG LEU A 413 -16.468 7.007 7.802 1.00 0.00 H new ATOM 0 HD11 LEU A 413 -17.122 7.142 5.436 1.00 0.00 H new ATOM 0 HD12 LEU A 413 -15.356 7.054 5.640 1.00 0.00 H new ATOM 0 HD13 LEU A 413 -16.265 5.616 5.117 1.00 0.00 H new ATOM 0 HD21 LEU A 413 -18.633 6.079 7.098 1.00 0.00 H new ATOM 0 HD22 LEU A 413 -17.876 4.483 6.888 1.00 0.00 H new ATOM 0 HD23 LEU A 413 -17.962 5.221 8.505 1.00 0.00 H new ATOM 820 N LEU A 414 -14.594 3.951 4.913 1.00 0.00 N ATOM 821 CA LEU A 414 -14.687 3.873 3.465 1.00 0.00 C ATOM 822 C LEU A 414 -14.572 2.411 3.029 1.00 0.00 C ATOM 823 O LEU A 414 -15.548 1.816 2.577 1.00 0.00 O ATOM 824 CB LEU A 414 -13.653 4.793 2.811 1.00 0.00 C ATOM 825 CG LEU A 414 -13.540 6.200 3.401 1.00 0.00 C ATOM 826 CD1 LEU A 414 -12.254 6.887 2.937 1.00 0.00 C ATOM 827 CD2 LEU A 414 -14.783 7.032 3.077 1.00 0.00 C ATOM 0 H LEU A 414 -13.695 4.278 5.266 1.00 0.00 H new ATOM 0 HA LEU A 414 -15.659 4.232 3.126 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -12.676 4.314 2.876 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -13.894 4.883 1.752 1.00 0.00 H new ATOM 0 HG LEU A 414 -13.485 6.112 4.486 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -12.198 7.886 3.371 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -11.392 6.303 3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -12.254 6.963 1.850 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -14.677 8.028 3.508 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -14.894 7.115 1.996 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -15.665 6.547 3.496 1.00 0.00 H new ATOM 839 N SER A 415 -13.369 1.875 3.179 1.00 0.00 N ATOM 840 CA SER A 415 -13.114 0.494 2.806 1.00 0.00 C ATOM 841 C SER A 415 -13.841 0.161 1.502 1.00 0.00 C ATOM 842 O SER A 415 -14.424 -0.914 1.369 1.00 0.00 O ATOM 843 CB SER A 415 -13.548 -0.466 3.916 1.00 0.00 C ATOM 844 OG SER A 415 -12.543 -0.616 4.915 1.00 0.00 O ATOM 0 H SER A 415 -12.561 2.372 3.554 1.00 0.00 H new ATOM 0 HA SER A 415 -12.041 0.373 2.657 1.00 0.00 H new ATOM 0 HB2 SER A 415 -14.465 -0.097 4.376 1.00 0.00 H new ATOM 0 HB3 SER A 415 -13.778 -1.440 3.484 1.00 0.00 H new ATOM 0 HG SER A 415 -12.888 -1.171 5.645 1.00 0.00 H new ATOM 850 N GLU A 416 -13.783 1.103 0.572 1.00 0.00 N ATOM 851 CA GLU A 416 -14.429 0.923 -0.717 1.00 0.00 C ATOM 852 C GLU A 416 -13.394 0.555 -1.782 1.00 0.00 C ATOM 853 O GLU A 416 -13.752 0.223 -2.911 1.00 0.00 O ATOM 854 CB GLU A 416 -15.208 2.176 -1.120 1.00 0.00 C ATOM 855 CG GLU A 416 -16.714 1.904 -1.136 1.00 0.00 C ATOM 856 CD GLU A 416 -17.494 3.106 -0.599 1.00 0.00 C ATOM 857 OE1 GLU A 416 -17.343 4.224 -1.114 1.00 0.00 O ATOM 858 OE2 GLU A 416 -18.282 2.847 0.389 1.00 0.00 O ATOM 0 H GLU A 416 -13.298 1.993 0.686 1.00 0.00 H new ATOM 0 HA GLU A 416 -15.143 0.103 -0.632 1.00 0.00 H new ATOM 0 HB2 GLU A 416 -14.988 2.985 -0.423 1.00 0.00 H new ATOM 0 HB3 GLU A 416 -14.884 2.508 -2.106 1.00 0.00 H new ATOM 0 HG2 GLU A 416 -17.036 1.682 -2.153 1.00 0.00 H new ATOM 0 HG3 GLU A 416 -16.935 1.024 -0.532 1.00 0.00 H new ATOM 866 N LYS A 417 -12.132 0.626 -1.385 1.00 0.00 N ATOM 867 CA LYS A 417 -11.043 0.304 -2.292 1.00 0.00 C ATOM 868 C LYS A 417 -10.577 -1.130 -2.034 1.00 0.00 C ATOM 869 O LYS A 417 -10.944 -1.734 -1.027 1.00 0.00 O ATOM 870 CB LYS A 417 -9.927 1.344 -2.178 1.00 0.00 C ATOM 871 CG LYS A 417 -9.215 1.238 -0.828 1.00 0.00 C ATOM 872 CD LYS A 417 -8.105 2.285 -0.710 1.00 0.00 C ATOM 873 CE LYS A 417 -8.647 3.597 -0.142 1.00 0.00 C ATOM 874 NZ LYS A 417 -8.202 3.779 1.258 1.00 0.00 N ATOM 0 H LYS A 417 -11.839 0.902 -0.448 1.00 0.00 H new ATOM 0 HA LYS A 417 -11.383 0.347 -3.327 1.00 0.00 H new ATOM 0 HB2 LYS A 417 -9.208 1.201 -2.985 1.00 0.00 H new ATOM 0 HB3 LYS A 417 -10.344 2.344 -2.296 1.00 0.00 H new ATOM 0 HG2 LYS A 417 -9.935 1.374 -0.021 1.00 0.00 H new ATOM 0 HG3 LYS A 417 -8.792 0.240 -0.713 1.00 0.00 H new ATOM 0 HD2 LYS A 417 -7.310 1.907 -0.067 1.00 0.00 H new ATOM 0 HD3 LYS A 417 -7.663 2.464 -1.690 1.00 0.00 H new ATOM 0 HE2 LYS A 417 -8.303 4.433 -0.751 1.00 0.00 H new ATOM 0 HE3 LYS A 417 -9.736 3.597 -0.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 417 -8.579 4.675 1.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 417 -8.551 2.990 1.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 417 -7.163 3.800 1.292 1.00 0.00 H new ATOM 888 N LYS A 418 -9.775 -1.634 -2.960 1.00 0.00 N ATOM 889 CA LYS A 418 -9.255 -2.985 -2.845 1.00 0.00 C ATOM 890 C LYS A 418 -8.426 -3.101 -1.564 1.00 0.00 C ATOM 891 O LYS A 418 -7.709 -2.171 -1.198 1.00 0.00 O ATOM 892 CB LYS A 418 -8.488 -3.374 -4.111 1.00 0.00 C ATOM 893 CG LYS A 418 -8.969 -4.722 -4.652 1.00 0.00 C ATOM 894 CD LYS A 418 -8.396 -5.878 -3.831 1.00 0.00 C ATOM 895 CE LYS A 418 -7.551 -6.806 -4.706 1.00 0.00 C ATOM 896 NZ LYS A 418 -8.263 -8.080 -4.950 1.00 0.00 N ATOM 0 H LYS A 418 -9.473 -1.130 -3.794 1.00 0.00 H new ATOM 0 HA LYS A 418 -10.072 -3.701 -2.762 1.00 0.00 H new ATOM 0 HB2 LYS A 418 -8.621 -2.605 -4.872 1.00 0.00 H new ATOM 0 HB3 LYS A 418 -7.421 -3.426 -3.893 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -10.058 -4.760 -4.629 1.00 0.00 H new ATOM 0 HG3 LYS A 418 -8.669 -4.828 -5.694 1.00 0.00 H new ATOM 0 HD2 LYS A 418 -7.786 -5.484 -3.018 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -9.209 -6.443 -3.375 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -7.330 -6.319 -5.656 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -6.596 -7.004 -4.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -7.675 -8.698 -5.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -8.452 -8.552 -4.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 -9.163 -7.887 -5.434 1.00 0.00 H new ATOM 910 N THR A 419 -8.552 -4.251 -0.918 1.00 0.00 N ATOM 911 CA THR A 419 -7.824 -4.501 0.314 1.00 0.00 C ATOM 912 C THR A 419 -6.651 -5.449 0.058 1.00 0.00 C ATOM 913 O THR A 419 -6.842 -6.555 -0.446 1.00 0.00 O ATOM 914 CB THR A 419 -8.817 -5.028 1.352 1.00 0.00 C ATOM 915 OG1 THR A 419 -8.049 -5.127 2.548 1.00 0.00 O ATOM 916 CG2 THR A 419 -9.251 -6.468 1.068 1.00 0.00 C ATOM 0 H THR A 419 -9.148 -5.020 -1.225 1.00 0.00 H new ATOM 0 HA THR A 419 -7.381 -3.585 0.704 1.00 0.00 H new ATOM 0 HB THR A 419 -9.695 -4.382 1.376 1.00 0.00 H new ATOM 0 HG1 THR A 419 -8.616 -5.460 3.274 1.00 0.00 H new ATOM 0 HG21 THR A 419 -9.955 -6.793 1.834 1.00 0.00 H new ATOM 0 HG22 THR A 419 -9.730 -6.518 0.090 1.00 0.00 H new ATOM 0 HG23 THR A 419 -8.378 -7.120 1.078 1.00 0.00 H new ATOM 924 N SER A 420 -5.464 -4.982 0.416 1.00 0.00 N ATOM 925 CA SER A 420 -4.261 -5.775 0.231 1.00 0.00 C ATOM 926 C SER A 420 -4.387 -7.101 0.983 1.00 0.00 C ATOM 927 O SER A 420 -5.241 -7.244 1.857 1.00 0.00 O ATOM 928 CB SER A 420 -3.021 -5.013 0.703 1.00 0.00 C ATOM 929 OG SER A 420 -1.987 -5.015 -0.278 1.00 0.00 O ATOM 0 H SER A 420 -5.310 -4.064 0.833 1.00 0.00 H new ATOM 0 HA SER A 420 -4.146 -5.978 -0.834 1.00 0.00 H new ATOM 0 HB2 SER A 420 -3.295 -3.985 0.938 1.00 0.00 H new ATOM 0 HB3 SER A 420 -2.648 -5.462 1.624 1.00 0.00 H new ATOM 0 HG SER A 420 -1.214 -4.517 0.061 1.00 0.00 H new ATOM 935 N GLN A 421 -3.524 -8.037 0.617 1.00 0.00 N ATOM 936 CA GLN A 421 -3.529 -9.347 1.246 1.00 0.00 C ATOM 937 C GLN A 421 -3.096 -9.234 2.710 1.00 0.00 C ATOM 938 O GLN A 421 -2.121 -8.553 3.022 1.00 0.00 O ATOM 939 CB GLN A 421 -2.633 -10.325 0.484 1.00 0.00 C ATOM 940 CG GLN A 421 -3.463 -11.240 -0.418 1.00 0.00 C ATOM 941 CD GLN A 421 -2.587 -11.898 -1.486 1.00 0.00 C ATOM 942 OE1 GLN A 421 -1.715 -11.283 -2.077 1.00 0.00 O ATOM 943 NE2 GLN A 421 -2.867 -13.181 -1.700 1.00 0.00 N ATOM 0 H GLN A 421 -2.816 -7.914 -0.107 1.00 0.00 H new ATOM 0 HA GLN A 421 -4.546 -9.739 1.216 1.00 0.00 H new ATOM 0 HB2 GLN A 421 -1.913 -9.771 -0.118 1.00 0.00 H new ATOM 0 HB3 GLN A 421 -2.061 -10.926 1.191 1.00 0.00 H new ATOM 0 HG2 GLN A 421 -3.947 -12.009 0.184 1.00 0.00 H new ATOM 0 HG3 GLN A 421 -4.255 -10.664 -0.896 1.00 0.00 H new ATOM 0 HE21 GLN A 421 -3.610 -13.636 -1.170 1.00 0.00 H new ATOM 0 HE22 GLN A 421 -2.338 -13.710 -2.394 1.00 0.00 H new ATOM 952 N SER A 422 -3.844 -9.912 3.568 1.00 0.00 N ATOM 953 CA SER A 422 -3.550 -9.896 4.991 1.00 0.00 C ATOM 954 C SER A 422 -4.434 -10.910 5.719 1.00 0.00 C ATOM 955 O SER A 422 -5.545 -11.200 5.279 1.00 0.00 O ATOM 956 CB SER A 422 -3.751 -8.498 5.580 1.00 0.00 C ATOM 957 OG SER A 422 -4.998 -7.929 5.190 1.00 0.00 O ATOM 0 H SER A 422 -4.653 -10.476 3.305 1.00 0.00 H new ATOM 0 HA SER A 422 -2.504 -10.171 5.127 1.00 0.00 H new ATOM 0 HB2 SER A 422 -3.701 -8.552 6.668 1.00 0.00 H new ATOM 0 HB3 SER A 422 -2.938 -7.848 5.256 1.00 0.00 H new ATOM 0 HG SER A 422 -5.090 -7.038 5.587 1.00 0.00 H new ATOM 963 N PRO A 423 -3.893 -11.436 6.851 1.00 0.00 N ATOM 964 CA PRO A 423 -4.621 -12.412 7.644 1.00 0.00 C ATOM 965 C PRO A 423 -5.738 -11.743 8.448 1.00 0.00 C ATOM 966 O PRO A 423 -5.911 -10.527 8.383 1.00 0.00 O ATOM 967 CB PRO A 423 -3.568 -13.068 8.523 1.00 0.00 C ATOM 968 CG PRO A 423 -2.379 -12.122 8.526 1.00 0.00 C ATOM 969 CD PRO A 423 -2.580 -11.117 7.403 1.00 0.00 C ATOM 0 HA PRO A 423 -5.130 -13.156 7.031 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -3.945 -13.224 9.534 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -3.288 -14.046 8.133 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -2.300 -11.611 9.486 1.00 0.00 H new ATOM 0 HG3 PRO A 423 -1.451 -12.675 8.382 1.00 0.00 H new ATOM 0 HD2 PRO A 423 -2.545 -10.094 7.777 1.00 0.00 H new ATOM 0 HD3 PRO A 423 -1.800 -11.207 6.647 1.00 0.00 H new ATOM 977 N HIS A 424 -6.467 -12.567 9.186 1.00 0.00 N ATOM 978 CA HIS A 424 -7.562 -12.070 10.001 1.00 0.00 C ATOM 979 C HIS A 424 -8.525 -11.261 9.130 1.00 0.00 C ATOM 980 O HIS A 424 -8.263 -11.042 7.948 1.00 0.00 O ATOM 981 CB HIS A 424 -7.033 -11.274 11.196 1.00 0.00 C ATOM 982 CG HIS A 424 -6.160 -12.077 12.131 1.00 0.00 C ATOM 983 ND1 HIS A 424 -5.388 -11.495 13.121 1.00 0.00 N ATOM 984 CD2 HIS A 424 -5.947 -13.421 12.216 1.00 0.00 C ATOM 985 CE1 HIS A 424 -4.742 -12.455 13.766 1.00 0.00 C ATOM 986 NE2 HIS A 424 -5.089 -13.648 13.204 1.00 0.00 N ATOM 0 H HIS A 424 -6.321 -13.575 9.237 1.00 0.00 H new ATOM 0 HA HIS A 424 -8.120 -12.909 10.416 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -6.464 -10.420 10.828 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -7.878 -10.876 11.757 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -6.399 -14.173 11.587 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -4.060 -12.317 14.592 1.00 0.00 H new ATOM 0 HE2 HIS A 424 -4.746 -14.564 13.495 1.00 0.00 H new ATOM 995 N ARG A 425 -9.619 -10.838 9.746 1.00 0.00 N ATOM 996 CA ARG A 425 -10.621 -10.058 9.042 1.00 0.00 C ATOM 997 C ARG A 425 -11.277 -10.902 7.946 1.00 0.00 C ATOM 998 O ARG A 425 -10.728 -11.921 7.531 1.00 0.00 O ATOM 999 CB ARG A 425 -10.004 -8.808 8.412 1.00 0.00 C ATOM 1000 CG ARG A 425 -10.952 -7.612 8.525 1.00 0.00 C ATOM 1001 CD ARG A 425 -10.990 -6.817 7.218 1.00 0.00 C ATOM 1002 NE ARG A 425 -11.911 -5.666 7.352 1.00 0.00 N ATOM 1003 CZ ARG A 425 -13.241 -5.748 7.213 1.00 0.00 C ATOM 1004 NH1 ARG A 425 -13.814 -6.927 6.935 1.00 0.00 N ATOM 1005 NH2 ARG A 425 -13.998 -4.651 7.352 1.00 0.00 N ATOM 0 H ARG A 425 -9.833 -11.021 10.726 1.00 0.00 H new ATOM 0 HA ARG A 425 -11.373 -9.751 9.769 1.00 0.00 H new ATOM 0 HB2 ARG A 425 -9.060 -8.576 8.905 1.00 0.00 H new ATOM 0 HB3 ARG A 425 -9.777 -8.999 7.363 1.00 0.00 H new ATOM 0 HG2 ARG A 425 -11.955 -7.960 8.772 1.00 0.00 H new ATOM 0 HG3 ARG A 425 -10.630 -6.964 9.340 1.00 0.00 H new ATOM 0 HD2 ARG A 425 -9.989 -6.465 6.968 1.00 0.00 H new ATOM 0 HD3 ARG A 425 -11.316 -7.461 6.401 1.00 0.00 H new ATOM 0 HE ARG A 425 -11.508 -4.753 7.563 1.00 0.00 H new ATOM 0 HH11 ARG A 425 -13.238 -7.762 6.829 1.00 0.00 H new ATOM 0 HH12 ARG A 425 -14.827 -6.990 6.829 1.00 0.00 H new ATOM 0 HH21 ARG A 425 -13.562 -3.754 7.564 1.00 0.00 H new ATOM 0 HH22 ARG A 425 -15.011 -4.713 7.246 1.00 0.00 H new ATOM 1019 N PHE A 426 -12.442 -10.446 7.511 1.00 0.00 N ATOM 1020 CA PHE A 426 -13.178 -11.146 6.472 1.00 0.00 C ATOM 1021 C PHE A 426 -13.503 -12.579 6.900 1.00 0.00 C ATOM 1022 O PHE A 426 -12.631 -13.446 6.892 1.00 0.00 O ATOM 1023 CB PHE A 426 -12.277 -11.188 5.236 1.00 0.00 C ATOM 1024 CG PHE A 426 -13.013 -10.927 3.920 1.00 0.00 C ATOM 1025 CD1 PHE A 426 -13.880 -11.854 3.430 1.00 0.00 C ATOM 1026 CD2 PHE A 426 -12.801 -9.769 3.240 1.00 0.00 C ATOM 1027 CE1 PHE A 426 -14.562 -11.612 2.209 1.00 0.00 C ATOM 1028 CE2 PHE A 426 -13.484 -9.527 2.019 1.00 0.00 C ATOM 1029 CZ PHE A 426 -14.350 -10.454 1.529 1.00 0.00 C ATOM 0 H PHE A 426 -12.895 -9.601 7.859 1.00 0.00 H new ATOM 0 HA PHE A 426 -14.119 -10.633 6.273 1.00 0.00 H new ATOM 0 HB2 PHE A 426 -11.485 -10.447 5.351 1.00 0.00 H new ATOM 0 HB3 PHE A 426 -11.795 -12.164 5.183 1.00 0.00 H new ATOM 0 HD1 PHE A 426 -14.049 -12.774 3.970 1.00 0.00 H new ATOM 0 HD2 PHE A 426 -12.113 -9.033 3.629 1.00 0.00 H new ATOM 0 HE1 PHE A 426 -15.250 -12.348 1.820 1.00 0.00 H new ATOM 0 HE2 PHE A 426 -13.316 -8.607 1.479 1.00 0.00 H new ATOM 0 HZ PHE A 426 -14.869 -10.270 0.600 1.00 0.00 H new ATOM 1039 N GLN A 427 -14.761 -12.782 7.265 1.00 0.00 N ATOM 1040 CA GLN A 427 -15.212 -14.094 7.696 1.00 0.00 C ATOM 1041 C GLN A 427 -16.730 -14.098 7.887 1.00 0.00 C ATOM 1042 O GLN A 427 -17.473 -14.447 6.972 1.00 0.00 O ATOM 1043 CB GLN A 427 -14.497 -14.526 8.979 1.00 0.00 C ATOM 1044 CG GLN A 427 -15.073 -15.839 9.513 1.00 0.00 C ATOM 1045 CD GLN A 427 -14.280 -16.334 10.723 1.00 0.00 C ATOM 1046 OE1 GLN A 427 -14.101 -15.636 11.708 1.00 0.00 O ATOM 1047 NE2 GLN A 427 -13.816 -17.574 10.596 1.00 0.00 N ATOM 0 H GLN A 427 -15.481 -12.060 7.271 1.00 0.00 H new ATOM 0 HA GLN A 427 -14.961 -14.816 6.918 1.00 0.00 H new ATOM 0 HB2 GLN A 427 -13.431 -14.645 8.783 1.00 0.00 H new ATOM 0 HB3 GLN A 427 -14.597 -13.747 9.735 1.00 0.00 H new ATOM 0 HG2 GLN A 427 -16.117 -15.695 9.792 1.00 0.00 H new ATOM 0 HG3 GLN A 427 -15.054 -16.595 8.728 1.00 0.00 H new ATOM 0 HE21 GLN A 427 -14.002 -18.103 9.744 1.00 0.00 H new ATOM 0 HE22 GLN A 427 -13.274 -17.995 11.350 1.00 0.00 H new ATOM 1056 N LYS A 428 -17.145 -13.705 9.082 1.00 0.00 N ATOM 1057 CA LYS A 428 -18.561 -13.658 9.405 1.00 0.00 C ATOM 1058 C LYS A 428 -19.224 -14.963 8.960 1.00 0.00 C ATOM 1059 O LYS A 428 -18.541 -15.912 8.577 1.00 0.00 O ATOM 1060 CB LYS A 428 -19.205 -12.406 8.807 1.00 0.00 C ATOM 1061 CG LYS A 428 -18.712 -11.143 9.516 1.00 0.00 C ATOM 1062 CD LYS A 428 -17.570 -10.488 8.737 1.00 0.00 C ATOM 1063 CE LYS A 428 -16.310 -10.378 9.598 1.00 0.00 C ATOM 1064 NZ LYS A 428 -16.595 -9.627 10.840 1.00 0.00 N ATOM 0 H LYS A 428 -16.525 -13.416 9.839 1.00 0.00 H new ATOM 0 HA LYS A 428 -18.704 -13.578 10.483 1.00 0.00 H new ATOM 0 HB2 LYS A 428 -18.971 -12.345 7.744 1.00 0.00 H new ATOM 0 HB3 LYS A 428 -20.290 -12.475 8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 428 -19.535 -10.437 9.624 1.00 0.00 H new ATOM 0 HG3 LYS A 428 -18.374 -11.394 10.521 1.00 0.00 H new ATOM 0 HD2 LYS A 428 -17.353 -11.072 7.843 1.00 0.00 H new ATOM 0 HD3 LYS A 428 -17.875 -9.496 8.404 1.00 0.00 H new ATOM 0 HE2 LYS A 428 -15.943 -11.374 9.845 1.00 0.00 H new ATOM 0 HE3 LYS A 428 -15.521 -9.878 9.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 -15.746 -9.101 11.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 -17.375 -8.960 10.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 -16.865 -10.291 11.593 1.00 0.00 H new ATOM 1078 N THR A 429 -20.547 -14.970 9.026 1.00 0.00 N ATOM 1079 CA THR A 429 -21.310 -16.143 8.635 1.00 0.00 C ATOM 1080 C THR A 429 -22.749 -15.753 8.290 1.00 0.00 C ATOM 1081 O THR A 429 -23.202 -14.665 8.643 1.00 0.00 O ATOM 1082 CB THR A 429 -21.213 -17.169 9.766 1.00 0.00 C ATOM 1083 OG1 THR A 429 -21.838 -18.333 9.233 1.00 0.00 O ATOM 1084 CG2 THR A 429 -22.083 -16.797 10.969 1.00 0.00 C ATOM 0 H THR A 429 -21.110 -14.182 9.345 1.00 0.00 H new ATOM 0 HA THR A 429 -20.904 -16.596 7.731 1.00 0.00 H new ATOM 0 HB THR A 429 -20.174 -17.263 10.083 1.00 0.00 H new ATOM 0 HG1 THR A 429 -21.818 -19.050 9.901 1.00 0.00 H new ATOM 0 HG21 THR A 429 -21.978 -17.557 11.743 1.00 0.00 H new ATOM 0 HG22 THR A 429 -21.765 -15.832 11.363 1.00 0.00 H new ATOM 0 HG23 THR A 429 -23.126 -16.737 10.659 1.00 0.00 H new ATOM 1092 N HIS A 430 -23.427 -16.661 7.604 1.00 0.00 N ATOM 1093 CA HIS A 430 -24.804 -16.426 7.208 1.00 0.00 C ATOM 1094 C HIS A 430 -25.593 -17.735 7.290 1.00 0.00 C ATOM 1095 O HIS A 430 -25.104 -18.785 6.879 1.00 0.00 O ATOM 1096 CB HIS A 430 -24.868 -15.782 5.821 1.00 0.00 C ATOM 1097 CG HIS A 430 -25.994 -14.789 5.657 1.00 0.00 C ATOM 1098 ND1 HIS A 430 -27.320 -15.116 5.878 1.00 0.00 N ATOM 1099 CD2 HIS A 430 -25.976 -13.474 5.293 1.00 0.00 C ATOM 1100 CE1 HIS A 430 -28.059 -14.039 5.652 1.00 0.00 C ATOM 1101 NE2 HIS A 430 -27.225 -13.023 5.289 1.00 0.00 N ATOM 0 H HIS A 430 -23.047 -17.562 7.312 1.00 0.00 H new ATOM 0 HA HIS A 430 -25.268 -15.719 7.896 1.00 0.00 H new ATOM 0 HB2 HIS A 430 -23.922 -15.279 5.621 1.00 0.00 H new ATOM 0 HB3 HIS A 430 -24.977 -16.566 5.072 1.00 0.00 H new ATOM 0 HD2 HIS A 430 -25.096 -12.898 5.050 1.00 0.00 H new ATOM 0 HE1 HIS A 430 -29.134 -13.977 5.740 1.00 0.00 H new ATOM 0 HE2 HIS A 430 -27.513 -12.073 5.053 1.00 0.00 H new ATOM 1110 N SER A 431 -26.800 -17.628 7.826 1.00 0.00 N ATOM 1111 CA SER A 431 -27.661 -18.789 7.968 1.00 0.00 C ATOM 1112 C SER A 431 -29.092 -18.345 8.279 1.00 0.00 C ATOM 1113 O SER A 431 -29.309 -17.243 8.779 1.00 0.00 O ATOM 1114 CB SER A 431 -27.146 -19.726 9.062 1.00 0.00 C ATOM 1115 OG SER A 431 -26.290 -19.054 9.981 1.00 0.00 O ATOM 0 H SER A 431 -27.202 -16.755 8.167 1.00 0.00 H new ATOM 0 HA SER A 431 -27.654 -19.337 7.026 1.00 0.00 H new ATOM 0 HB2 SER A 431 -27.992 -20.154 9.601 1.00 0.00 H new ATOM 0 HB3 SER A 431 -26.607 -20.556 8.605 1.00 0.00 H new ATOM 0 HG SER A 431 -25.984 -19.686 10.665 1.00 0.00 H new ATOM 1121 N PRO A 432 -30.057 -19.250 7.962 1.00 0.00 N ATOM 1122 CA PRO A 432 -31.461 -18.963 8.203 1.00 0.00 C ATOM 1123 C PRO A 432 -31.796 -19.075 9.691 1.00 0.00 C ATOM 1124 O PRO A 432 -32.056 -18.070 10.350 1.00 0.00 O ATOM 1125 CB PRO A 432 -32.219 -19.963 7.346 1.00 0.00 C ATOM 1126 CG PRO A 432 -31.228 -21.069 7.020 1.00 0.00 C ATOM 1127 CD PRO A 432 -29.837 -20.566 7.368 1.00 0.00 C ATOM 0 HA PRO A 432 -31.734 -17.942 7.936 1.00 0.00 H new ATOM 0 HB2 PRO A 432 -33.084 -20.358 7.879 1.00 0.00 H new ATOM 0 HB3 PRO A 432 -32.593 -19.493 6.436 1.00 0.00 H new ATOM 0 HG2 PRO A 432 -31.461 -21.970 7.588 1.00 0.00 H new ATOM 0 HG3 PRO A 432 -31.285 -21.334 5.964 1.00 0.00 H new ATOM 0 HD2 PRO A 432 -29.336 -21.237 8.066 1.00 0.00 H new ATOM 0 HD3 PRO A 432 -29.206 -20.500 6.481 1.00 0.00 H new ATOM 1135 N ILE A 433 -31.779 -20.308 10.178 1.00 0.00 N ATOM 1136 CA ILE A 433 -32.078 -20.564 11.576 1.00 0.00 C ATOM 1137 C ILE A 433 -30.812 -21.056 12.282 1.00 0.00 C ATOM 1138 O ILE A 433 -30.872 -21.515 13.421 1.00 0.00 O ATOM 1139 CB ILE A 433 -33.264 -21.522 11.703 1.00 0.00 C ATOM 1140 CG1 ILE A 433 -33.283 -22.528 10.551 1.00 0.00 C ATOM 1141 CG2 ILE A 433 -34.582 -20.751 11.812 1.00 0.00 C ATOM 1142 CD1 ILE A 433 -32.049 -23.432 10.594 1.00 0.00 C ATOM 0 H ILE A 433 -31.563 -21.140 9.629 1.00 0.00 H new ATOM 0 HA ILE A 433 -32.385 -19.645 12.075 1.00 0.00 H new ATOM 0 HB ILE A 433 -33.146 -22.091 12.625 1.00 0.00 H new ATOM 0 HG12 ILE A 433 -34.186 -23.136 10.609 1.00 0.00 H new ATOM 0 HG13 ILE A 433 -33.317 -21.997 9.600 1.00 0.00 H new ATOM 0 HG21 ILE A 433 -35.409 -21.455 11.901 1.00 0.00 H new ATOM 0 HG22 ILE A 433 -34.556 -20.108 12.692 1.00 0.00 H new ATOM 0 HG23 ILE A 433 -34.721 -20.140 10.920 1.00 0.00 H new ATOM 0 HD11 ILE A 433 -32.086 -24.138 9.765 1.00 0.00 H new ATOM 0 HD12 ILE A 433 -31.149 -22.823 10.512 1.00 0.00 H new ATOM 0 HD13 ILE A 433 -32.032 -23.980 11.536 1.00 0.00 H new TER 1154 ILE A 433