USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 707 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 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 140:sc= -4.45! (180deg=-7.51!) USER MOD Single : A 21 ASN : amide:sc= -3.73! C(o=-3.7!,f=-3.4!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot -134:sc= 0.723 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 89:sc= 1.25 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 84:sc= -3.51! USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.366 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.592 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -37:sc= 1.17 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -108:sc= -0.597 (180deg=-1.78) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N LEU A 5 9.998 -7.320 -6.858 1.00 0.00 N ATOM 76 CA LEU A 5 11.145 -7.334 -7.758 1.00 0.00 C ATOM 77 C LEU A 5 11.369 -8.728 -8.334 1.00 0.00 C ATOM 78 O LEU A 5 11.255 -9.730 -7.627 1.00 0.00 O ATOM 79 CB LEU A 5 12.402 -6.866 -7.021 1.00 0.00 C ATOM 80 CG LEU A 5 12.641 -5.356 -6.993 1.00 0.00 C ATOM 81 CD1 LEU A 5 13.031 -4.852 -8.374 1.00 0.00 C ATOM 82 CD2 LEU A 5 11.403 -4.629 -6.489 1.00 0.00 C ATOM 0 HA LEU A 5 10.938 -6.650 -8.581 1.00 0.00 H new ATOM 0 HB2 LEU A 5 12.351 -7.225 -5.993 1.00 0.00 H new ATOM 0 HB3 LEU A 5 13.267 -7.342 -7.482 1.00 0.00 H new ATOM 0 HG LEU A 5 13.463 -5.150 -6.307 1.00 0.00 H new ATOM 0 HD11 LEU A 5 13.197 -3.775 -8.335 1.00 0.00 H new ATOM 0 HD12 LEU A 5 13.946 -5.349 -8.698 1.00 0.00 H new ATOM 0 HD13 LEU A 5 12.230 -5.070 -9.080 1.00 0.00 H new ATOM 0 HD21 LEU A 5 11.592 -3.556 -6.476 1.00 0.00 H new ATOM 0 HD22 LEU A 5 10.562 -4.842 -7.149 1.00 0.00 H new ATOM 0 HD23 LEU A 5 11.167 -4.968 -5.480 1.00 0.00 H new ATOM 94 N LYS A 6 11.690 -8.786 -9.622 1.00 0.00 N ATOM 95 CA LYS A 6 11.934 -10.057 -10.294 1.00 0.00 C ATOM 96 C LYS A 6 13.301 -10.061 -10.969 1.00 0.00 C ATOM 97 O LYS A 6 13.692 -9.086 -11.611 1.00 0.00 O ATOM 98 CB LYS A 6 10.841 -10.327 -11.331 1.00 0.00 C ATOM 99 CG LYS A 6 10.998 -9.517 -12.606 1.00 0.00 C ATOM 100 CD LYS A 6 9.675 -9.365 -13.338 1.00 0.00 C ATOM 101 CE LYS A 6 8.779 -8.339 -12.662 1.00 0.00 C ATOM 102 NZ LYS A 6 7.730 -7.825 -13.586 1.00 0.00 N ATOM 0 H LYS A 6 11.787 -7.967 -10.222 1.00 0.00 H new ATOM 0 HA LYS A 6 11.917 -10.846 -9.542 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.844 -11.388 -11.582 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.870 -10.107 -10.888 1.00 0.00 H new ATOM 0 HG2 LYS A 6 11.397 -8.532 -12.365 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.723 -10.003 -13.260 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.861 -9.064 -14.369 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.165 -10.328 -13.374 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.306 -8.789 -11.789 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.386 -7.508 -12.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 7.140 -7.128 -13.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 8.181 -7.373 -14.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 7.135 -8.614 -13.909 1.00 0.00 H new ATOM 116 N VAL A 7 14.025 -11.166 -10.821 1.00 0.00 N ATOM 117 CA VAL A 7 15.349 -11.299 -11.419 1.00 0.00 C ATOM 118 C VAL A 7 15.391 -12.457 -12.410 1.00 0.00 C ATOM 119 O VAL A 7 15.067 -13.594 -12.068 1.00 0.00 O ATOM 120 CB VAL A 7 16.430 -11.518 -10.344 1.00 0.00 C ATOM 121 CG1 VAL A 7 16.649 -10.247 -9.539 1.00 0.00 C ATOM 122 CG2 VAL A 7 16.050 -12.677 -9.435 1.00 0.00 C ATOM 0 H VAL A 7 13.717 -11.982 -10.292 1.00 0.00 H new ATOM 0 HA VAL A 7 15.554 -10.367 -11.946 1.00 0.00 H new ATOM 0 HB VAL A 7 17.367 -11.769 -10.842 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.416 -10.422 -8.785 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.970 -9.446 -10.204 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.718 -9.961 -9.050 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.825 -12.818 -8.681 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.102 -12.458 -8.944 1.00 0.00 H new ATOM 0 HG23 VAL A 7 15.951 -13.587 -10.027 1.00 0.00 H new ATOM 132 N LYS A 8 15.792 -12.160 -13.641 1.00 0.00 N ATOM 133 CA LYS A 8 15.878 -13.175 -14.684 1.00 0.00 C ATOM 134 C LYS A 8 17.177 -13.037 -15.472 1.00 0.00 C ATOM 135 O LYS A 8 17.762 -11.955 -15.539 1.00 0.00 O ATOM 136 CB LYS A 8 14.681 -13.066 -15.632 1.00 0.00 C ATOM 137 CG LYS A 8 14.550 -11.704 -16.291 1.00 0.00 C ATOM 138 CD LYS A 8 15.214 -11.680 -17.658 1.00 0.00 C ATOM 139 CE LYS A 8 14.223 -12.007 -18.765 1.00 0.00 C ATOM 140 NZ LYS A 8 14.812 -11.796 -20.116 1.00 0.00 N ATOM 0 H LYS A 8 16.063 -11.224 -13.941 1.00 0.00 H new ATOM 0 HA LYS A 8 15.866 -14.154 -14.204 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.771 -13.828 -16.406 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.768 -13.281 -15.077 1.00 0.00 H new ATOM 0 HG2 LYS A 8 13.495 -11.448 -16.393 1.00 0.00 H new ATOM 0 HG3 LYS A 8 15.002 -10.945 -15.653 1.00 0.00 H new ATOM 0 HD2 LYS A 8 15.648 -10.696 -17.836 1.00 0.00 H new ATOM 0 HD3 LYS A 8 16.034 -12.398 -17.678 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.899 -13.043 -18.668 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.336 -11.384 -18.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.106 -12.030 -20.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 15.098 -10.801 -20.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.644 -12.409 -20.232 1.00 0.00 H new ATOM 154 N VAL A 9 17.623 -14.138 -16.067 1.00 0.00 N ATOM 155 CA VAL A 9 18.852 -14.139 -16.852 1.00 0.00 C ATOM 156 C VAL A 9 18.669 -13.375 -18.159 1.00 0.00 C ATOM 157 O VAL A 9 17.676 -13.558 -18.862 1.00 0.00 O ATOM 158 CB VAL A 9 19.314 -15.573 -17.169 1.00 0.00 C ATOM 159 CG1 VAL A 9 20.651 -15.555 -17.895 1.00 0.00 C ATOM 160 CG2 VAL A 9 19.402 -16.399 -15.894 1.00 0.00 C ATOM 0 H VAL A 9 17.152 -15.041 -16.021 1.00 0.00 H new ATOM 0 HA VAL A 9 19.614 -13.645 -16.249 1.00 0.00 H new ATOM 0 HB VAL A 9 18.577 -16.037 -17.825 1.00 0.00 H new ATOM 0 HG11 VAL A 9 20.962 -16.577 -18.111 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.551 -15.002 -18.829 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.400 -15.073 -17.266 1.00 0.00 H new ATOM 0 HG21 VAL A 9 19.730 -17.410 -16.137 1.00 0.00 H new ATOM 0 HG22 VAL A 9 20.117 -15.940 -15.212 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.422 -16.440 -15.419 1.00 0.00 H new ATOM 170 N GLU A 10 19.635 -12.519 -18.478 1.00 0.00 N ATOM 171 CA GLU A 10 19.580 -11.727 -19.701 1.00 0.00 C ATOM 172 C GLU A 10 20.732 -12.088 -20.635 1.00 0.00 C ATOM 173 O GLU A 10 20.644 -11.898 -21.849 1.00 0.00 O ATOM 174 CB GLU A 10 19.626 -10.234 -19.371 1.00 0.00 C ATOM 175 CG GLU A 10 20.892 -9.810 -18.646 1.00 0.00 C ATOM 176 CD GLU A 10 21.251 -8.358 -18.900 1.00 0.00 C ATOM 177 OE1 GLU A 10 20.328 -7.554 -19.148 1.00 0.00 O ATOM 178 OE2 GLU A 10 22.454 -8.027 -18.850 1.00 0.00 O ATOM 0 H GLU A 10 20.464 -12.357 -17.907 1.00 0.00 H new ATOM 0 HA GLU A 10 18.641 -11.951 -20.206 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.538 -9.663 -20.295 1.00 0.00 H new ATOM 0 HB3 GLU A 10 18.763 -9.980 -18.756 1.00 0.00 H new ATOM 0 HG2 GLU A 10 20.763 -9.967 -17.575 1.00 0.00 H new ATOM 0 HG3 GLU A 10 21.718 -10.446 -18.964 1.00 0.00 H new ATOM 185 N ASP A 11 21.810 -12.609 -20.061 1.00 0.00 N ATOM 186 CA ASP A 11 22.980 -12.997 -20.841 1.00 0.00 C ATOM 187 C ASP A 11 23.962 -13.793 -19.988 1.00 0.00 C ATOM 188 O ASP A 11 24.561 -13.261 -19.053 1.00 0.00 O ATOM 189 CB ASP A 11 23.670 -11.759 -21.415 1.00 0.00 C ATOM 190 CG ASP A 11 23.604 -11.709 -22.929 1.00 0.00 C ATOM 191 OD1 ASP A 11 23.680 -12.783 -23.562 1.00 0.00 O ATOM 192 OD2 ASP A 11 23.477 -10.596 -23.481 1.00 0.00 O ATOM 0 H ASP A 11 21.899 -12.773 -19.058 1.00 0.00 H new ATOM 0 HA ASP A 11 22.645 -13.630 -21.663 1.00 0.00 H new ATOM 0 HB2 ASP A 11 23.204 -10.863 -21.004 1.00 0.00 H new ATOM 0 HB3 ASP A 11 24.713 -11.749 -21.099 1.00 0.00 H new ATOM 197 N PHE A 12 24.123 -15.071 -20.315 1.00 0.00 N ATOM 198 CA PHE A 12 25.031 -15.941 -19.578 1.00 0.00 C ATOM 199 C PHE A 12 26.289 -16.230 -20.392 1.00 0.00 C ATOM 200 O PHE A 12 26.292 -16.101 -21.616 1.00 0.00 O ATOM 201 CB PHE A 12 24.332 -17.253 -19.215 1.00 0.00 C ATOM 202 CG PHE A 12 23.944 -18.076 -20.410 1.00 0.00 C ATOM 203 CD1 PHE A 12 22.744 -17.850 -21.063 1.00 0.00 C ATOM 204 CD2 PHE A 12 24.780 -19.076 -20.880 1.00 0.00 C ATOM 205 CE1 PHE A 12 22.384 -18.605 -22.164 1.00 0.00 C ATOM 206 CE2 PHE A 12 24.426 -19.834 -21.980 1.00 0.00 C ATOM 207 CZ PHE A 12 23.226 -19.599 -22.622 1.00 0.00 C ATOM 0 H PHE A 12 23.636 -15.527 -21.086 1.00 0.00 H new ATOM 0 HA PHE A 12 25.323 -15.427 -18.662 1.00 0.00 H new ATOM 0 HB2 PHE A 12 24.991 -17.842 -18.577 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.439 -17.030 -18.632 1.00 0.00 H new ATOM 0 HD1 PHE A 12 22.081 -17.075 -20.708 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.719 -19.265 -20.381 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.446 -18.418 -22.665 1.00 0.00 H new ATOM 0 HE2 PHE A 12 25.087 -20.610 -22.337 1.00 0.00 H new ATOM 0 HZ PHE A 12 22.947 -20.192 -23.481 1.00 0.00 H new ATOM 217 N GLY A 13 27.356 -16.621 -19.703 1.00 0.00 N ATOM 218 CA GLY A 13 28.606 -16.922 -20.377 1.00 0.00 C ATOM 219 C GLY A 13 29.630 -17.544 -19.450 1.00 0.00 C ATOM 220 O GLY A 13 29.628 -17.284 -18.246 1.00 0.00 O ATOM 0 H GLY A 13 27.378 -16.735 -18.690 1.00 0.00 H new ATOM 0 HA2 GLY A 13 28.413 -17.601 -21.208 1.00 0.00 H new ATOM 0 HA3 GLY A 13 29.015 -16.006 -20.803 1.00 0.00 H new ATOM 224 N PHE A 14 30.508 -18.370 -20.009 1.00 0.00 N ATOM 225 CA PHE A 14 31.542 -19.034 -19.223 1.00 0.00 C ATOM 226 C PHE A 14 32.932 -18.590 -19.668 1.00 0.00 C ATOM 227 O PHE A 14 33.192 -18.428 -20.861 1.00 0.00 O ATOM 228 CB PHE A 14 31.413 -20.553 -19.352 1.00 0.00 C ATOM 229 CG PHE A 14 29.998 -21.046 -19.252 1.00 0.00 C ATOM 230 CD1 PHE A 14 29.144 -20.549 -18.281 1.00 0.00 C ATOM 231 CD2 PHE A 14 29.521 -22.006 -20.130 1.00 0.00 C ATOM 232 CE1 PHE A 14 27.841 -21.000 -18.186 1.00 0.00 C ATOM 233 CE2 PHE A 14 28.219 -22.461 -20.041 1.00 0.00 C ATOM 234 CZ PHE A 14 27.378 -21.958 -19.067 1.00 0.00 C ATOM 0 H PHE A 14 30.524 -18.596 -21.004 1.00 0.00 H new ATOM 0 HA PHE A 14 31.407 -18.752 -18.179 1.00 0.00 H new ATOM 0 HB2 PHE A 14 31.831 -20.865 -20.309 1.00 0.00 H new ATOM 0 HB3 PHE A 14 32.010 -21.028 -18.573 1.00 0.00 H new ATOM 0 HD1 PHE A 14 29.501 -19.800 -17.590 1.00 0.00 H new ATOM 0 HD2 PHE A 14 30.174 -22.403 -20.893 1.00 0.00 H new ATOM 0 HE1 PHE A 14 27.186 -20.604 -17.424 1.00 0.00 H new ATOM 0 HE2 PHE A 14 27.859 -23.209 -20.732 1.00 0.00 H new ATOM 0 HZ PHE A 14 26.361 -22.313 -18.995 1.00 0.00 H new ATOM 244 N ARG A 15 33.822 -18.395 -18.701 1.00 0.00 N ATOM 245 CA ARG A 15 35.186 -17.969 -18.991 1.00 0.00 C ATOM 246 C ARG A 15 36.187 -19.059 -18.621 1.00 0.00 C ATOM 247 O ARG A 15 36.585 -19.181 -17.463 1.00 0.00 O ATOM 248 CB ARG A 15 35.513 -16.681 -18.232 1.00 0.00 C ATOM 249 CG ARG A 15 36.209 -15.632 -19.084 1.00 0.00 C ATOM 250 CD ARG A 15 37.542 -16.139 -19.613 1.00 0.00 C ATOM 251 NE ARG A 15 37.420 -16.700 -20.955 1.00 0.00 N ATOM 252 CZ ARG A 15 37.375 -15.963 -22.059 1.00 0.00 C ATOM 253 NH1 ARG A 15 37.441 -14.641 -21.980 1.00 0.00 N ATOM 254 NH2 ARG A 15 37.263 -16.547 -23.245 1.00 0.00 N ATOM 0 H ARG A 15 33.623 -18.525 -17.709 1.00 0.00 H new ATOM 0 HA ARG A 15 35.261 -17.780 -20.062 1.00 0.00 H new ATOM 0 HB2 ARG A 15 34.590 -16.260 -17.834 1.00 0.00 H new ATOM 0 HB3 ARG A 15 36.147 -16.923 -17.379 1.00 0.00 H new ATOM 0 HG2 ARG A 15 35.566 -15.355 -19.920 1.00 0.00 H new ATOM 0 HG3 ARG A 15 36.370 -14.730 -18.493 1.00 0.00 H new ATOM 0 HD2 ARG A 15 38.262 -15.321 -19.626 1.00 0.00 H new ATOM 0 HD3 ARG A 15 37.935 -16.898 -18.937 1.00 0.00 H new ATOM 0 HE ARG A 15 37.366 -17.714 -21.050 1.00 0.00 H new ATOM 0 HH11 ARG A 15 37.527 -14.188 -21.070 1.00 0.00 H new ATOM 0 HH12 ARG A 15 37.406 -14.077 -22.829 1.00 0.00 H new ATOM 0 HH21 ARG A 15 37.211 -17.564 -23.310 1.00 0.00 H new ATOM 0 HH22 ARG A 15 37.229 -15.979 -24.092 1.00 0.00 H new ATOM 268 N GLU A 16 36.589 -19.848 -19.612 1.00 0.00 N ATOM 269 CA GLU A 16 37.543 -20.928 -19.389 1.00 0.00 C ATOM 270 C GLU A 16 38.862 -20.386 -18.847 1.00 0.00 C ATOM 271 O GLU A 16 39.609 -21.097 -18.175 1.00 0.00 O ATOM 272 CB GLU A 16 37.790 -21.696 -20.689 1.00 0.00 C ATOM 273 CG GLU A 16 38.559 -20.900 -21.730 1.00 0.00 C ATOM 274 CD GLU A 16 38.575 -21.577 -23.087 1.00 0.00 C ATOM 275 OE1 GLU A 16 39.405 -22.489 -23.284 1.00 0.00 O ATOM 276 OE2 GLU A 16 37.759 -21.194 -23.951 1.00 0.00 O ATOM 0 H GLU A 16 36.269 -19.760 -20.577 1.00 0.00 H new ATOM 0 HA GLU A 16 37.118 -21.607 -18.649 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.341 -22.609 -20.463 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.831 -21.998 -21.110 1.00 0.00 H new ATOM 0 HG2 GLU A 16 38.113 -19.910 -21.827 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.584 -20.756 -21.388 1.00 0.00 H new ATOM 283 N ASP A 17 39.142 -19.121 -19.144 1.00 0.00 N ATOM 284 CA ASP A 17 40.370 -18.482 -18.687 1.00 0.00 C ATOM 285 C ASP A 17 40.338 -18.260 -17.178 1.00 0.00 C ATOM 286 O ASP A 17 41.381 -18.186 -16.529 1.00 0.00 O ATOM 287 CB ASP A 17 40.575 -17.149 -19.407 1.00 0.00 C ATOM 288 CG ASP A 17 42.041 -16.801 -19.575 1.00 0.00 C ATOM 289 OD1 ASP A 17 42.833 -17.709 -19.904 1.00 0.00 O ATOM 290 OD2 ASP A 17 42.397 -15.620 -19.378 1.00 0.00 O ATOM 0 H ASP A 17 38.535 -18.518 -19.699 1.00 0.00 H new ATOM 0 HA ASP A 17 41.204 -19.144 -18.921 1.00 0.00 H new ATOM 0 HB2 ASP A 17 40.100 -17.192 -20.387 1.00 0.00 H new ATOM 0 HB3 ASP A 17 40.078 -16.357 -18.847 1.00 0.00 H new ATOM 295 N MET A 18 39.134 -18.152 -16.626 1.00 0.00 N ATOM 296 CA MET A 18 38.966 -17.938 -15.194 1.00 0.00 C ATOM 297 C MET A 18 38.580 -19.236 -14.491 1.00 0.00 C ATOM 298 O MET A 18 38.825 -19.403 -13.298 1.00 0.00 O ATOM 299 CB MET A 18 37.901 -16.870 -14.937 1.00 0.00 C ATOM 300 CG MET A 18 38.381 -15.454 -15.216 1.00 0.00 C ATOM 301 SD MET A 18 37.459 -14.213 -14.288 1.00 0.00 S ATOM 302 CE MET A 18 35.868 -14.292 -15.107 1.00 0.00 C ATOM 0 H MET A 18 38.260 -18.209 -17.149 1.00 0.00 H new ATOM 0 HA MET A 18 39.919 -17.596 -14.790 1.00 0.00 H new ATOM 0 HB2 MET A 18 37.031 -17.079 -15.559 1.00 0.00 H new ATOM 0 HB3 MET A 18 37.574 -16.936 -13.899 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.439 -15.377 -14.966 1.00 0.00 H new ATOM 0 HG3 MET A 18 38.290 -15.247 -16.282 1.00 0.00 H new ATOM 0 HE1 MET A 18 35.073 -14.214 -14.366 1.00 0.00 H new ATOM 0 HE2 MET A 18 35.783 -13.470 -15.817 1.00 0.00 H new ATOM 0 HE3 MET A 18 35.778 -15.240 -15.637 1.00 0.00 H new ATOM 312 N GLY A 19 37.975 -20.152 -15.241 1.00 0.00 N ATOM 313 CA GLY A 19 37.564 -21.423 -14.672 1.00 0.00 C ATOM 314 C GLY A 19 36.240 -21.330 -13.942 1.00 0.00 C ATOM 315 O GLY A 19 35.877 -22.229 -13.182 1.00 0.00 O ATOM 0 H GLY A 19 37.762 -20.037 -16.232 1.00 0.00 H new ATOM 0 HA2 GLY A 19 37.486 -22.165 -15.467 1.00 0.00 H new ATOM 0 HA3 GLY A 19 38.332 -21.774 -13.982 1.00 0.00 H new ATOM 319 N LEU A 20 35.515 -20.240 -14.169 1.00 0.00 N ATOM 320 CA LEU A 20 34.222 -20.033 -13.526 1.00 0.00 C ATOM 321 C LEU A 20 33.170 -19.604 -14.543 1.00 0.00 C ATOM 322 O LEU A 20 33.489 -19.308 -15.694 1.00 0.00 O ATOM 323 CB LEU A 20 34.343 -18.978 -12.424 1.00 0.00 C ATOM 324 CG LEU A 20 35.207 -17.760 -12.753 1.00 0.00 C ATOM 325 CD1 LEU A 20 34.519 -16.881 -13.787 1.00 0.00 C ATOM 326 CD2 LEU A 20 35.510 -16.964 -11.492 1.00 0.00 C ATOM 0 H LEU A 20 35.801 -19.486 -14.794 1.00 0.00 H new ATOM 0 HA LEU A 20 33.908 -20.978 -13.084 1.00 0.00 H new ATOM 0 HB2 LEU A 20 33.342 -18.630 -12.170 1.00 0.00 H new ATOM 0 HB3 LEU A 20 34.750 -19.457 -11.533 1.00 0.00 H new ATOM 0 HG LEU A 20 36.150 -18.111 -13.173 1.00 0.00 H new ATOM 0 HD11 LEU A 20 35.149 -16.019 -14.009 1.00 0.00 H new ATOM 0 HD12 LEU A 20 34.354 -17.454 -14.699 1.00 0.00 H new ATOM 0 HD13 LEU A 20 33.561 -16.539 -13.395 1.00 0.00 H new ATOM 0 HD21 LEU A 20 36.126 -16.101 -11.746 1.00 0.00 H new ATOM 0 HD22 LEU A 20 34.577 -16.624 -11.043 1.00 0.00 H new ATOM 0 HD23 LEU A 20 36.045 -17.596 -10.783 1.00 0.00 H new ATOM 338 N ASN A 21 31.914 -19.572 -14.110 1.00 0.00 N ATOM 339 CA ASN A 21 30.814 -19.177 -14.982 1.00 0.00 C ATOM 340 C ASN A 21 30.162 -17.889 -14.488 1.00 0.00 C ATOM 341 O ASN A 21 30.026 -17.673 -13.284 1.00 0.00 O ATOM 342 CB ASN A 21 29.771 -20.294 -15.058 1.00 0.00 C ATOM 343 CG ASN A 21 29.285 -20.725 -13.688 1.00 0.00 C ATOM 344 OD1 ASN A 21 28.692 -19.937 -12.951 1.00 0.00 O ATOM 345 ND2 ASN A 21 29.534 -21.982 -13.341 1.00 0.00 N ATOM 0 H ASN A 21 31.633 -19.815 -13.160 1.00 0.00 H new ATOM 0 HA ASN A 21 31.219 -18.998 -15.978 1.00 0.00 H new ATOM 0 HB2 ASN A 21 28.922 -19.955 -15.652 1.00 0.00 H new ATOM 0 HB3 ASN A 21 30.199 -21.153 -15.575 1.00 0.00 H new ATOM 0 HD21 ASN A 21 29.230 -22.330 -12.431 1.00 0.00 H new ATOM 0 HD22 ASN A 21 30.029 -22.600 -13.984 1.00 0.00 H new ATOM 352 N TYR A 22 29.761 -17.039 -15.426 1.00 0.00 N ATOM 353 CA TYR A 22 29.125 -15.771 -15.087 1.00 0.00 C ATOM 354 C TYR A 22 27.790 -15.621 -15.809 1.00 0.00 C ATOM 355 O TYR A 22 27.569 -16.220 -16.861 1.00 0.00 O ATOM 356 CB TYR A 22 30.046 -14.603 -15.445 1.00 0.00 C ATOM 357 CG TYR A 22 30.141 -14.341 -16.931 1.00 0.00 C ATOM 358 CD1 TYR A 22 29.206 -13.541 -17.577 1.00 0.00 C ATOM 359 CD2 TYR A 22 31.166 -14.894 -17.690 1.00 0.00 C ATOM 360 CE1 TYR A 22 29.289 -13.299 -18.934 1.00 0.00 C ATOM 361 CE2 TYR A 22 31.257 -14.656 -19.047 1.00 0.00 C ATOM 362 CZ TYR A 22 30.316 -13.859 -19.665 1.00 0.00 C ATOM 363 OH TYR A 22 30.403 -13.621 -21.018 1.00 0.00 O ATOM 0 H TYR A 22 29.865 -17.204 -16.427 1.00 0.00 H new ATOM 0 HA TYR A 22 28.939 -15.762 -14.013 1.00 0.00 H new ATOM 0 HB2 TYR A 22 29.686 -13.702 -14.948 1.00 0.00 H new ATOM 0 HB3 TYR A 22 31.044 -14.805 -15.056 1.00 0.00 H new ATOM 0 HD1 TYR A 22 28.401 -13.101 -17.008 1.00 0.00 H new ATOM 0 HD2 TYR A 22 31.904 -15.520 -17.210 1.00 0.00 H new ATOM 0 HE1 TYR A 22 28.554 -12.675 -19.420 1.00 0.00 H new ATOM 0 HE2 TYR A 22 32.061 -15.092 -19.622 1.00 0.00 H new ATOM 0 HH TYR A 22 31.184 -14.088 -21.383 1.00 0.00 H new ATOM 373 N VAL A 23 26.902 -14.815 -15.235 1.00 0.00 N ATOM 374 CA VAL A 23 25.588 -14.584 -15.824 1.00 0.00 C ATOM 375 C VAL A 23 25.051 -13.208 -15.444 1.00 0.00 C ATOM 376 O VAL A 23 25.186 -12.772 -14.301 1.00 0.00 O ATOM 377 CB VAL A 23 24.577 -15.658 -15.380 1.00 0.00 C ATOM 378 CG1 VAL A 23 24.591 -15.813 -13.867 1.00 0.00 C ATOM 379 CG2 VAL A 23 23.181 -15.312 -15.876 1.00 0.00 C ATOM 0 H VAL A 23 27.068 -14.312 -14.364 1.00 0.00 H new ATOM 0 HA VAL A 23 25.711 -14.638 -16.906 1.00 0.00 H new ATOM 0 HB VAL A 23 24.869 -16.611 -15.821 1.00 0.00 H new ATOM 0 HG11 VAL A 23 23.870 -16.576 -13.573 1.00 0.00 H new ATOM 0 HG12 VAL A 23 25.588 -16.110 -13.541 1.00 0.00 H new ATOM 0 HG13 VAL A 23 24.325 -14.864 -13.402 1.00 0.00 H new ATOM 0 HG21 VAL A 23 22.479 -16.081 -15.553 1.00 0.00 H new ATOM 0 HG22 VAL A 23 22.877 -14.349 -15.466 1.00 0.00 H new ATOM 0 HG23 VAL A 23 23.185 -15.258 -16.965 1.00 0.00 H new ATOM 389 N ARG A 24 24.440 -12.530 -16.410 1.00 0.00 N ATOM 390 CA ARG A 24 23.882 -11.204 -16.177 1.00 0.00 C ATOM 391 C ARG A 24 22.380 -11.282 -15.923 1.00 0.00 C ATOM 392 O ARG A 24 21.638 -11.879 -16.704 1.00 0.00 O ATOM 393 CB ARG A 24 24.160 -10.293 -17.374 1.00 0.00 C ATOM 394 CG ARG A 24 25.554 -9.687 -17.367 1.00 0.00 C ATOM 395 CD ARG A 24 26.624 -10.748 -17.570 1.00 0.00 C ATOM 396 NE ARG A 24 27.777 -10.230 -18.303 1.00 0.00 N ATOM 397 CZ ARG A 24 27.802 -10.081 -19.623 1.00 0.00 C ATOM 398 NH1 ARG A 24 26.743 -10.409 -20.350 1.00 0.00 N ATOM 399 NH2 ARG A 24 28.887 -9.604 -20.217 1.00 0.00 N ATOM 0 H ARG A 24 24.319 -12.877 -17.361 1.00 0.00 H new ATOM 0 HA ARG A 24 24.361 -10.787 -15.291 1.00 0.00 H new ATOM 0 HB2 ARG A 24 24.026 -10.863 -18.293 1.00 0.00 H new ATOM 0 HB3 ARG A 24 23.424 -9.489 -17.387 1.00 0.00 H new ATOM 0 HG2 ARG A 24 25.630 -8.937 -18.154 1.00 0.00 H new ATOM 0 HG3 ARG A 24 25.724 -9.174 -16.421 1.00 0.00 H new ATOM 0 HD2 ARG A 24 26.950 -11.124 -16.600 1.00 0.00 H new ATOM 0 HD3 ARG A 24 26.199 -11.592 -18.113 1.00 0.00 H new ATOM 0 HE ARG A 24 28.608 -9.969 -17.772 1.00 0.00 H new ATOM 0 HH11 ARG A 24 25.907 -10.777 -19.896 1.00 0.00 H new ATOM 0 HH12 ARG A 24 26.764 -10.294 -21.363 1.00 0.00 H new ATOM 0 HH21 ARG A 24 29.704 -9.351 -19.661 1.00 0.00 H new ATOM 0 HH22 ARG A 24 28.905 -9.490 -21.230 1.00 0.00 H new ATOM 413 N TYR A 25 21.938 -10.677 -14.826 1.00 0.00 N ATOM 414 CA TYR A 25 20.525 -10.681 -14.467 1.00 0.00 C ATOM 415 C TYR A 25 19.887 -9.324 -14.750 1.00 0.00 C ATOM 416 O TYR A 25 20.563 -8.295 -14.748 1.00 0.00 O ATOM 417 CB TYR A 25 20.353 -11.039 -12.990 1.00 0.00 C ATOM 418 CG TYR A 25 20.893 -12.405 -12.632 1.00 0.00 C ATOM 419 CD1 TYR A 25 20.265 -13.562 -13.078 1.00 0.00 C ATOM 420 CD2 TYR A 25 22.033 -12.540 -11.849 1.00 0.00 C ATOM 421 CE1 TYR A 25 20.755 -14.812 -12.753 1.00 0.00 C ATOM 422 CE2 TYR A 25 22.531 -13.786 -11.519 1.00 0.00 C ATOM 423 CZ TYR A 25 21.888 -14.918 -11.973 1.00 0.00 C ATOM 424 OH TYR A 25 22.380 -16.162 -11.648 1.00 0.00 O ATOM 0 H TYR A 25 22.538 -10.177 -14.170 1.00 0.00 H new ATOM 0 HA TYR A 25 20.024 -11.433 -15.077 1.00 0.00 H new ATOM 0 HB2 TYR A 25 20.856 -10.288 -12.382 1.00 0.00 H new ATOM 0 HB3 TYR A 25 19.294 -10.998 -12.736 1.00 0.00 H new ATOM 0 HD1 TYR A 25 19.378 -13.482 -13.689 1.00 0.00 H new ATOM 0 HD2 TYR A 25 22.539 -11.655 -11.492 1.00 0.00 H new ATOM 0 HE1 TYR A 25 20.254 -15.701 -13.107 1.00 0.00 H new ATOM 0 HE2 TYR A 25 23.418 -13.873 -10.909 1.00 0.00 H new ATOM 0 HH TYR A 25 22.593 -16.190 -10.692 1.00 0.00 H new ATOM 434 N ARG A 26 18.580 -9.331 -14.993 1.00 0.00 N ATOM 435 CA ARG A 26 17.850 -8.102 -15.279 1.00 0.00 C ATOM 436 C ARG A 26 16.955 -7.716 -14.104 1.00 0.00 C ATOM 437 O ARG A 26 15.992 -8.414 -13.789 1.00 0.00 O ATOM 438 CB ARG A 26 17.006 -8.267 -16.544 1.00 0.00 C ATOM 439 CG ARG A 26 16.635 -6.949 -17.204 1.00 0.00 C ATOM 440 CD ARG A 26 15.275 -6.454 -16.735 1.00 0.00 C ATOM 441 NE ARG A 26 14.201 -7.369 -17.110 1.00 0.00 N ATOM 442 CZ ARG A 26 13.730 -7.482 -18.348 1.00 0.00 C ATOM 443 NH1 ARG A 26 14.238 -6.742 -19.324 1.00 0.00 N ATOM 444 NH2 ARG A 26 12.750 -8.338 -18.611 1.00 0.00 N ATOM 0 H ARG A 26 18.006 -10.174 -14.997 1.00 0.00 H new ATOM 0 HA ARG A 26 18.577 -7.306 -15.437 1.00 0.00 H new ATOM 0 HB2 ARG A 26 17.554 -8.880 -17.259 1.00 0.00 H new ATOM 0 HB3 ARG A 26 16.093 -8.808 -16.294 1.00 0.00 H new ATOM 0 HG2 ARG A 26 17.394 -6.201 -16.976 1.00 0.00 H new ATOM 0 HG3 ARG A 26 16.625 -7.073 -18.287 1.00 0.00 H new ATOM 0 HD2 ARG A 26 15.287 -6.333 -15.652 1.00 0.00 H new ATOM 0 HD3 ARG A 26 15.080 -5.471 -17.163 1.00 0.00 H new ATOM 0 HE ARG A 26 13.790 -7.954 -16.382 1.00 0.00 H new ATOM 0 HH11 ARG A 26 14.992 -6.084 -19.126 1.00 0.00 H new ATOM 0 HH12 ARG A 26 13.875 -6.831 -20.273 1.00 0.00 H new ATOM 0 HH21 ARG A 26 12.358 -8.910 -17.863 1.00 0.00 H new ATOM 0 HH22 ARG A 26 12.389 -8.424 -19.561 1.00 0.00 H new ATOM 458 N VAL A 27 17.281 -6.600 -13.460 1.00 0.00 N ATOM 459 CA VAL A 27 16.507 -6.120 -12.321 1.00 0.00 C ATOM 460 C VAL A 27 15.980 -4.712 -12.569 1.00 0.00 C ATOM 461 O VAL A 27 16.753 -3.770 -12.745 1.00 0.00 O ATOM 462 CB VAL A 27 17.348 -6.122 -11.031 1.00 0.00 C ATOM 463 CG1 VAL A 27 16.542 -5.565 -9.867 1.00 0.00 C ATOM 464 CG2 VAL A 27 17.846 -7.526 -10.722 1.00 0.00 C ATOM 0 H VAL A 27 18.076 -6.011 -13.708 1.00 0.00 H new ATOM 0 HA VAL A 27 15.666 -6.803 -12.199 1.00 0.00 H new ATOM 0 HB VAL A 27 18.215 -5.479 -11.182 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.153 -5.574 -8.964 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.240 -4.542 -10.090 1.00 0.00 H new ATOM 0 HG13 VAL A 27 15.655 -6.179 -9.712 1.00 0.00 H new ATOM 0 HG21 VAL A 27 18.438 -7.509 -9.807 1.00 0.00 H new ATOM 0 HG22 VAL A 27 16.994 -8.193 -10.590 1.00 0.00 H new ATOM 0 HG23 VAL A 27 18.463 -7.883 -11.547 1.00 0.00 H new ATOM 474 N SER A 28 14.658 -4.575 -12.581 1.00 0.00 N ATOM 475 CA SER A 28 14.025 -3.281 -12.810 1.00 0.00 C ATOM 476 C SER A 28 13.270 -2.818 -11.569 1.00 0.00 C ATOM 477 O SER A 28 12.552 -3.594 -10.940 1.00 0.00 O ATOM 478 CB SER A 28 13.070 -3.361 -14.003 1.00 0.00 C ATOM 479 OG SER A 28 12.610 -4.686 -14.200 1.00 0.00 O ATOM 0 H SER A 28 14.004 -5.344 -12.435 1.00 0.00 H new ATOM 0 HA SER A 28 14.808 -2.555 -13.029 1.00 0.00 H new ATOM 0 HB2 SER A 28 12.220 -2.699 -13.838 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.577 -3.011 -14.902 1.00 0.00 H new ATOM 0 HG SER A 28 12.000 -4.710 -14.967 1.00 0.00 H new ATOM 485 N GLY A 29 13.437 -1.545 -11.221 1.00 0.00 N ATOM 486 CA GLY A 29 12.766 -0.999 -10.057 1.00 0.00 C ATOM 487 C GLY A 29 13.736 -0.426 -9.043 1.00 0.00 C ATOM 488 O GLY A 29 13.430 -0.351 -7.852 1.00 0.00 O ATOM 0 H GLY A 29 14.026 -0.882 -11.726 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.074 -0.219 -10.373 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.171 -1.781 -9.585 1.00 0.00 H new ATOM 492 N LEU A 30 14.911 -0.021 -9.514 1.00 0.00 N ATOM 493 CA LEU A 30 15.931 0.547 -8.640 1.00 0.00 C ATOM 494 C LEU A 30 16.300 1.960 -9.081 1.00 0.00 C ATOM 495 O LEU A 30 15.924 2.400 -10.167 1.00 0.00 O ATOM 496 CB LEU A 30 17.178 -0.340 -8.636 1.00 0.00 C ATOM 497 CG LEU A 30 17.621 -0.882 -9.995 1.00 0.00 C ATOM 498 CD1 LEU A 30 16.710 -2.016 -10.440 1.00 0.00 C ATOM 499 CD2 LEU A 30 17.637 0.230 -11.033 1.00 0.00 C ATOM 0 H LEU A 30 15.180 -0.076 -10.496 1.00 0.00 H new ATOM 0 HA LEU A 30 15.524 0.596 -7.630 1.00 0.00 H new ATOM 0 HB2 LEU A 30 18.003 0.230 -8.208 1.00 0.00 H new ATOM 0 HB3 LEU A 30 16.996 -1.185 -7.972 1.00 0.00 H new ATOM 0 HG LEU A 30 18.633 -1.274 -9.896 1.00 0.00 H new ATOM 0 HD11 LEU A 30 17.041 -2.389 -11.409 1.00 0.00 H new ATOM 0 HD12 LEU A 30 16.749 -2.823 -9.708 1.00 0.00 H new ATOM 0 HD13 LEU A 30 15.687 -1.650 -10.522 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.955 -0.174 -11.994 1.00 0.00 H new ATOM 0 HD22 LEU A 30 16.637 0.652 -11.130 1.00 0.00 H new ATOM 0 HD23 LEU A 30 18.331 1.010 -10.720 1.00 0.00 H new ATOM 511 N ASP A 31 17.040 2.664 -8.231 1.00 0.00 N ATOM 512 CA ASP A 31 17.463 4.027 -8.534 1.00 0.00 C ATOM 513 C ASP A 31 18.981 4.109 -8.661 1.00 0.00 C ATOM 514 O ASP A 31 19.694 3.174 -8.300 1.00 0.00 O ATOM 515 CB ASP A 31 16.977 4.987 -7.447 1.00 0.00 C ATOM 516 CG ASP A 31 15.479 4.909 -7.233 1.00 0.00 C ATOM 517 OD1 ASP A 31 14.731 4.993 -8.230 1.00 0.00 O ATOM 518 OD2 ASP A 31 15.053 4.764 -6.068 1.00 0.00 O ATOM 0 H ASP A 31 17.359 2.314 -7.328 1.00 0.00 H new ATOM 0 HA ASP A 31 17.021 4.316 -9.487 1.00 0.00 H new ATOM 0 HB2 ASP A 31 17.487 4.759 -6.511 1.00 0.00 H new ATOM 0 HB3 ASP A 31 17.250 6.007 -7.719 1.00 0.00 H new ATOM 523 N GLU A 32 19.466 5.233 -9.179 1.00 0.00 N ATOM 524 CA GLU A 32 20.899 5.435 -9.356 1.00 0.00 C ATOM 525 C GLU A 32 21.617 5.450 -8.010 1.00 0.00 C ATOM 526 O GLU A 32 22.704 4.892 -7.868 1.00 0.00 O ATOM 527 CB GLU A 32 21.164 6.744 -10.102 1.00 0.00 C ATOM 528 CG GLU A 32 20.803 6.688 -11.577 1.00 0.00 C ATOM 529 CD GLU A 32 20.537 8.060 -12.166 1.00 0.00 C ATOM 530 OE1 GLU A 32 19.983 8.916 -11.445 1.00 0.00 O ATOM 531 OE2 GLU A 32 20.881 8.277 -13.346 1.00 0.00 O ATOM 0 H GLU A 32 18.888 6.017 -9.483 1.00 0.00 H new ATOM 0 HA GLU A 32 21.286 4.604 -9.946 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.596 7.544 -9.628 1.00 0.00 H new ATOM 0 HB3 GLU A 32 22.219 7.001 -10.004 1.00 0.00 H new ATOM 0 HG2 GLU A 32 21.614 6.212 -12.128 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.919 6.063 -11.707 1.00 0.00 H new ATOM 538 N GLU A 33 21.000 6.094 -7.024 1.00 0.00 N ATOM 539 CA GLU A 33 21.580 6.183 -5.689 1.00 0.00 C ATOM 540 C GLU A 33 21.437 4.860 -4.944 1.00 0.00 C ATOM 541 O GLU A 33 22.386 4.376 -4.325 1.00 0.00 O ATOM 542 CB GLU A 33 20.912 7.305 -4.892 1.00 0.00 C ATOM 543 CG GLU A 33 21.409 7.414 -3.460 1.00 0.00 C ATOM 544 CD GLU A 33 20.821 8.605 -2.728 1.00 0.00 C ATOM 545 OE1 GLU A 33 19.609 8.580 -2.430 1.00 0.00 O ATOM 546 OE2 GLU A 33 21.575 9.562 -2.453 1.00 0.00 O ATOM 0 H GLU A 33 20.099 6.562 -7.125 1.00 0.00 H new ATOM 0 HA GLU A 33 22.641 6.406 -5.797 1.00 0.00 H new ATOM 0 HB2 GLU A 33 21.085 8.253 -5.401 1.00 0.00 H new ATOM 0 HB3 GLU A 33 19.835 7.140 -4.882 1.00 0.00 H new ATOM 0 HG2 GLU A 33 21.157 6.501 -2.921 1.00 0.00 H new ATOM 0 HG3 GLU A 33 22.496 7.494 -3.462 1.00 0.00 H new ATOM 553 N LEU A 34 20.244 4.279 -5.007 1.00 0.00 N ATOM 554 CA LEU A 34 19.974 3.011 -4.337 1.00 0.00 C ATOM 555 C LEU A 34 20.945 1.931 -4.805 1.00 0.00 C ATOM 556 O LEU A 34 21.465 1.158 -4.000 1.00 0.00 O ATOM 557 CB LEU A 34 18.534 2.568 -4.603 1.00 0.00 C ATOM 558 CG LEU A 34 17.595 2.577 -3.396 1.00 0.00 C ATOM 559 CD1 LEU A 34 18.095 1.621 -2.324 1.00 0.00 C ATOM 560 CD2 LEU A 34 17.460 3.985 -2.836 1.00 0.00 C ATOM 0 H LEU A 34 19.448 4.665 -5.515 1.00 0.00 H new ATOM 0 HA LEU A 34 20.111 3.157 -3.266 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.112 3.216 -5.371 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.556 1.559 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 34 16.611 2.242 -3.723 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.414 1.641 -1.473 1.00 0.00 H new ATOM 0 HD12 LEU A 34 18.139 0.610 -2.730 1.00 0.00 H new ATOM 0 HD13 LEU A 34 19.090 1.926 -2.000 1.00 0.00 H new ATOM 0 HD21 LEU A 34 16.788 3.972 -1.978 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.439 4.348 -2.525 1.00 0.00 H new ATOM 0 HD23 LEU A 34 17.055 4.645 -3.604 1.00 0.00 H new ATOM 572 N THR A 35 21.187 1.885 -6.111 1.00 0.00 N ATOM 573 CA THR A 35 22.096 0.902 -6.686 1.00 0.00 C ATOM 574 C THR A 35 23.449 0.928 -5.985 1.00 0.00 C ATOM 575 O THR A 35 24.042 -0.117 -5.722 1.00 0.00 O ATOM 576 CB THR A 35 22.306 1.144 -8.192 1.00 0.00 C ATOM 577 OG1 THR A 35 21.056 1.040 -8.884 1.00 0.00 O ATOM 578 CG2 THR A 35 23.295 0.142 -8.769 1.00 0.00 C ATOM 0 H THR A 35 20.766 2.518 -6.791 1.00 0.00 H new ATOM 0 HA THR A 35 21.635 -0.075 -6.544 1.00 0.00 H new ATOM 0 HB THR A 35 22.711 2.147 -8.323 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.619 1.917 -8.903 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.427 0.333 -9.834 1.00 0.00 H new ATOM 0 HG22 THR A 35 24.254 0.243 -8.261 1.00 0.00 H new ATOM 0 HG23 THR A 35 22.914 -0.869 -8.626 1.00 0.00 H new ATOM 586 N GLU A 36 23.932 2.130 -5.685 1.00 0.00 N ATOM 587 CA GLU A 36 25.216 2.291 -5.014 1.00 0.00 C ATOM 588 C GLU A 36 25.218 1.580 -3.664 1.00 0.00 C ATOM 589 O GLU A 36 26.267 1.171 -3.166 1.00 0.00 O ATOM 590 CB GLU A 36 25.533 3.776 -4.821 1.00 0.00 C ATOM 591 CG GLU A 36 25.763 4.523 -6.124 1.00 0.00 C ATOM 592 CD GLU A 36 27.196 4.994 -6.282 1.00 0.00 C ATOM 593 OE1 GLU A 36 28.112 4.151 -6.188 1.00 0.00 O ATOM 594 OE2 GLU A 36 27.400 6.207 -6.499 1.00 0.00 O ATOM 0 H GLU A 36 23.453 3.006 -5.896 1.00 0.00 H new ATOM 0 HA GLU A 36 25.984 1.841 -5.643 1.00 0.00 H new ATOM 0 HB2 GLU A 36 24.711 4.247 -4.282 1.00 0.00 H new ATOM 0 HB3 GLU A 36 26.421 3.871 -4.196 1.00 0.00 H new ATOM 0 HG2 GLU A 36 25.503 3.875 -6.961 1.00 0.00 H new ATOM 0 HG3 GLU A 36 25.095 5.383 -6.168 1.00 0.00 H new ATOM 601 N LYS A 37 24.035 1.435 -3.077 1.00 0.00 N ATOM 602 CA LYS A 37 23.898 0.773 -1.785 1.00 0.00 C ATOM 603 C LYS A 37 24.120 -0.730 -1.918 1.00 0.00 C ATOM 604 O LYS A 37 24.955 -1.308 -1.221 1.00 0.00 O ATOM 605 CB LYS A 37 22.512 1.044 -1.195 1.00 0.00 C ATOM 606 CG LYS A 37 22.125 2.513 -1.200 1.00 0.00 C ATOM 607 CD LYS A 37 22.918 3.302 -0.171 1.00 0.00 C ATOM 608 CE LYS A 37 22.513 4.768 -0.160 1.00 0.00 C ATOM 609 NZ LYS A 37 22.965 5.459 1.079 1.00 0.00 N ATOM 0 H LYS A 37 23.157 1.767 -3.476 1.00 0.00 H new ATOM 0 HA LYS A 37 24.657 1.177 -1.115 1.00 0.00 H new ATOM 0 HB2 LYS A 37 21.770 0.479 -1.759 1.00 0.00 H new ATOM 0 HB3 LYS A 37 22.484 0.673 -0.170 1.00 0.00 H new ATOM 0 HG2 LYS A 37 22.296 2.932 -2.192 1.00 0.00 H new ATOM 0 HG3 LYS A 37 21.059 2.610 -0.992 1.00 0.00 H new ATOM 0 HD2 LYS A 37 22.761 2.873 0.818 1.00 0.00 H new ATOM 0 HD3 LYS A 37 23.983 3.219 -0.389 1.00 0.00 H new ATOM 0 HE2 LYS A 37 22.937 5.269 -1.030 1.00 0.00 H new ATOM 0 HE3 LYS A 37 21.429 4.846 -0.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 22.670 6.456 1.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 22.540 4.998 1.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 24.001 5.407 1.147 1.00 0.00 H new ATOM 623 N LEU A 38 23.370 -1.357 -2.817 1.00 0.00 N ATOM 624 CA LEU A 38 23.486 -2.794 -3.042 1.00 0.00 C ATOM 625 C LEU A 38 24.856 -3.146 -3.614 1.00 0.00 C ATOM 626 O LEU A 38 25.531 -4.051 -3.121 1.00 0.00 O ATOM 627 CB LEU A 38 22.386 -3.272 -3.992 1.00 0.00 C ATOM 628 CG LEU A 38 20.968 -2.800 -3.668 1.00 0.00 C ATOM 629 CD1 LEU A 38 20.800 -2.605 -2.170 1.00 0.00 C ATOM 630 CD2 LEU A 38 20.652 -1.512 -4.415 1.00 0.00 C ATOM 0 H LEU A 38 22.675 -0.893 -3.402 1.00 0.00 H new ATOM 0 HA LEU A 38 23.373 -3.298 -2.082 1.00 0.00 H new ATOM 0 HB2 LEU A 38 22.636 -2.942 -5.000 1.00 0.00 H new ATOM 0 HB3 LEU A 38 22.391 -4.362 -4.003 1.00 0.00 H new ATOM 0 HG LEU A 38 20.266 -3.567 -3.994 1.00 0.00 H new ATOM 0 HD11 LEU A 38 19.785 -2.269 -1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 38 20.984 -3.549 -1.657 1.00 0.00 H new ATOM 0 HD13 LEU A 38 21.510 -1.857 -1.819 1.00 0.00 H new ATOM 0 HD21 LEU A 38 19.639 -1.190 -4.173 1.00 0.00 H new ATOM 0 HD22 LEU A 38 21.359 -0.737 -4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 38 20.731 -1.685 -5.488 1.00 0.00 H new ATOM 642 N ILE A 39 25.261 -2.424 -4.653 1.00 0.00 N ATOM 643 CA ILE A 39 26.552 -2.659 -5.289 1.00 0.00 C ATOM 644 C ILE A 39 27.685 -2.594 -4.271 1.00 0.00 C ATOM 645 O ILE A 39 28.725 -3.229 -4.445 1.00 0.00 O ATOM 646 CB ILE A 39 26.822 -1.636 -6.408 1.00 0.00 C ATOM 647 CG1 ILE A 39 27.872 -2.177 -7.380 1.00 0.00 C ATOM 648 CG2 ILE A 39 27.275 -0.310 -5.815 1.00 0.00 C ATOM 649 CD1 ILE A 39 28.294 -1.175 -8.432 1.00 0.00 C ATOM 0 H ILE A 39 24.714 -1.672 -5.072 1.00 0.00 H new ATOM 0 HA ILE A 39 26.514 -3.658 -5.723 1.00 0.00 H new ATOM 0 HB ILE A 39 25.896 -1.468 -6.958 1.00 0.00 H new ATOM 0 HG12 ILE A 39 28.750 -2.491 -6.816 1.00 0.00 H new ATOM 0 HG13 ILE A 39 27.476 -3.065 -7.873 1.00 0.00 H new ATOM 0 HG21 ILE A 39 27.462 0.403 -6.618 1.00 0.00 H new ATOM 0 HG22 ILE A 39 26.497 0.079 -5.158 1.00 0.00 H new ATOM 0 HG23 ILE A 39 28.191 -0.461 -5.243 1.00 0.00 H new ATOM 0 HD11 ILE A 39 29.040 -1.627 -9.086 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.426 -0.879 -9.021 1.00 0.00 H new ATOM 0 HD13 ILE A 39 28.720 -0.297 -7.948 1.00 0.00 H new ATOM 661 N GLU A 40 27.476 -1.823 -3.208 1.00 0.00 N ATOM 662 CA GLU A 40 28.482 -1.677 -2.162 1.00 0.00 C ATOM 663 C GLU A 40 28.491 -2.894 -1.243 1.00 0.00 C ATOM 664 O GLU A 40 29.513 -3.223 -0.641 1.00 0.00 O ATOM 665 CB GLU A 40 28.219 -0.409 -1.346 1.00 0.00 C ATOM 666 CG GLU A 40 29.124 0.753 -1.719 1.00 0.00 C ATOM 667 CD GLU A 40 30.466 0.696 -1.017 1.00 0.00 C ATOM 668 OE1 GLU A 40 30.481 0.534 0.221 1.00 0.00 O ATOM 669 OE2 GLU A 40 31.502 0.814 -1.705 1.00 0.00 O ATOM 0 H GLU A 40 26.621 -1.291 -3.049 1.00 0.00 H new ATOM 0 HA GLU A 40 29.459 -1.597 -2.640 1.00 0.00 H new ATOM 0 HB2 GLU A 40 27.180 -0.108 -1.483 1.00 0.00 H new ATOM 0 HB3 GLU A 40 28.349 -0.635 -0.288 1.00 0.00 H new ATOM 0 HG2 GLU A 40 29.282 0.754 -2.797 1.00 0.00 H new ATOM 0 HG3 GLU A 40 28.627 1.690 -1.469 1.00 0.00 H new ATOM 676 N ARG A 41 27.345 -3.559 -1.139 1.00 0.00 N ATOM 677 CA ARG A 41 27.220 -4.739 -0.292 1.00 0.00 C ATOM 678 C ARG A 41 27.442 -6.015 -1.100 1.00 0.00 C ATOM 679 O ARG A 41 27.702 -7.080 -0.540 1.00 0.00 O ATOM 680 CB ARG A 41 25.841 -4.775 0.369 1.00 0.00 C ATOM 681 CG ARG A 41 25.537 -3.546 1.210 1.00 0.00 C ATOM 682 CD ARG A 41 26.009 -3.722 2.645 1.00 0.00 C ATOM 683 NE ARG A 41 25.195 -2.960 3.587 1.00 0.00 N ATOM 684 CZ ARG A 41 25.238 -3.132 4.903 1.00 0.00 C ATOM 685 NH1 ARG A 41 26.053 -4.035 5.431 1.00 0.00 N ATOM 686 NH2 ARG A 41 24.466 -2.399 5.696 1.00 0.00 N ATOM 0 H ARG A 41 26.490 -3.301 -1.631 1.00 0.00 H new ATOM 0 HA ARG A 41 27.985 -4.682 0.482 1.00 0.00 H new ATOM 0 HB2 ARG A 41 25.079 -4.873 -0.404 1.00 0.00 H new ATOM 0 HB3 ARG A 41 25.772 -5.662 0.999 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.022 -2.674 0.771 1.00 0.00 H new ATOM 0 HG3 ARG A 41 24.464 -3.353 1.200 1.00 0.00 H new ATOM 0 HD2 ARG A 41 25.976 -4.779 2.910 1.00 0.00 H new ATOM 0 HD3 ARG A 41 27.049 -3.405 2.726 1.00 0.00 H new ATOM 0 HE ARG A 41 24.558 -2.256 3.214 1.00 0.00 H new ATOM 0 HH11 ARG A 41 26.649 -4.600 4.826 1.00 0.00 H new ATOM 0 HH12 ARG A 41 26.084 -4.165 6.442 1.00 0.00 H new ATOM 0 HH21 ARG A 41 23.838 -1.702 5.295 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.500 -2.533 6.707 1.00 0.00 H new ATOM 700 N LEU A 42 27.336 -5.899 -2.419 1.00 0.00 N ATOM 701 CA LEU A 42 27.525 -7.042 -3.305 1.00 0.00 C ATOM 702 C LEU A 42 28.887 -6.983 -3.988 1.00 0.00 C ATOM 703 O LEU A 42 29.408 -8.001 -4.445 1.00 0.00 O ATOM 704 CB LEU A 42 26.416 -7.085 -4.358 1.00 0.00 C ATOM 705 CG LEU A 42 25.018 -7.434 -3.847 1.00 0.00 C ATOM 706 CD1 LEU A 42 24.026 -7.489 -4.999 1.00 0.00 C ATOM 707 CD2 LEU A 42 25.040 -8.758 -3.096 1.00 0.00 C ATOM 0 H LEU A 42 27.120 -5.025 -2.899 1.00 0.00 H new ATOM 0 HA LEU A 42 27.481 -7.949 -2.701 1.00 0.00 H new ATOM 0 HB2 LEU A 42 26.370 -6.112 -4.848 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.694 -7.813 -5.120 1.00 0.00 H new ATOM 0 HG LEU A 42 24.699 -6.653 -3.157 1.00 0.00 H new ATOM 0 HD11 LEU A 42 23.037 -7.739 -4.616 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.989 -6.519 -5.494 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.341 -8.249 -5.714 1.00 0.00 H new ATOM 0 HD21 LEU A 42 24.037 -8.991 -2.739 1.00 0.00 H new ATOM 0 HD22 LEU A 42 25.380 -9.549 -3.764 1.00 0.00 H new ATOM 0 HD23 LEU A 42 25.719 -8.683 -2.246 1.00 0.00 H new ATOM 719 N ASP A 43 29.461 -5.787 -4.050 1.00 0.00 N ATOM 720 CA ASP A 43 30.765 -5.596 -4.673 1.00 0.00 C ATOM 721 C ASP A 43 30.776 -6.152 -6.094 1.00 0.00 C ATOM 722 O ASP A 43 31.821 -6.552 -6.606 1.00 0.00 O ATOM 723 CB ASP A 43 31.856 -6.270 -3.840 1.00 0.00 C ATOM 724 CG ASP A 43 33.199 -5.578 -3.974 1.00 0.00 C ATOM 725 OD1 ASP A 43 33.225 -4.330 -3.974 1.00 0.00 O ATOM 726 OD2 ASP A 43 34.223 -6.285 -4.080 1.00 0.00 O ATOM 0 H ASP A 43 29.044 -4.935 -3.676 1.00 0.00 H new ATOM 0 HA ASP A 43 30.964 -4.525 -4.720 1.00 0.00 H new ATOM 0 HB2 ASP A 43 31.557 -6.276 -2.792 1.00 0.00 H new ATOM 0 HB3 ASP A 43 31.954 -7.311 -4.149 1.00 0.00 H new ATOM 731 N GLU A 44 29.605 -6.175 -6.723 1.00 0.00 N ATOM 732 CA GLU A 44 29.480 -6.684 -8.084 1.00 0.00 C ATOM 733 C GLU A 44 29.483 -5.541 -9.095 1.00 0.00 C ATOM 734 O GLU A 44 29.674 -4.379 -8.734 1.00 0.00 O ATOM 735 CB GLU A 44 28.197 -7.505 -8.229 1.00 0.00 C ATOM 736 CG GLU A 44 26.928 -6.680 -8.094 1.00 0.00 C ATOM 737 CD GLU A 44 25.738 -7.508 -7.650 1.00 0.00 C ATOM 738 OE1 GLU A 44 25.951 -8.634 -7.153 1.00 0.00 O ATOM 739 OE2 GLU A 44 24.594 -7.030 -7.801 1.00 0.00 O ATOM 0 H GLU A 44 28.731 -5.848 -6.313 1.00 0.00 H new ATOM 0 HA GLU A 44 30.338 -7.326 -8.285 1.00 0.00 H new ATOM 0 HB2 GLU A 44 28.199 -7.997 -9.202 1.00 0.00 H new ATOM 0 HB3 GLU A 44 28.191 -8.291 -7.474 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.096 -5.877 -7.376 1.00 0.00 H new ATOM 0 HG3 GLU A 44 26.702 -6.209 -9.051 1.00 0.00 H new ATOM 746 N ASP A 45 29.272 -5.880 -10.362 1.00 0.00 N ATOM 747 CA ASP A 45 29.250 -4.883 -11.426 1.00 0.00 C ATOM 748 C ASP A 45 27.816 -4.543 -11.823 1.00 0.00 C ATOM 749 O ASP A 45 27.157 -5.307 -12.529 1.00 0.00 O ATOM 750 CB ASP A 45 30.022 -5.390 -12.645 1.00 0.00 C ATOM 751 CG ASP A 45 31.127 -4.441 -13.066 1.00 0.00 C ATOM 752 OD1 ASP A 45 30.833 -3.474 -13.800 1.00 0.00 O ATOM 753 OD2 ASP A 45 32.287 -4.664 -12.660 1.00 0.00 O ATOM 0 H ASP A 45 29.114 -6.837 -10.677 1.00 0.00 H new ATOM 0 HA ASP A 45 29.729 -3.978 -11.052 1.00 0.00 H new ATOM 0 HB2 ASP A 45 30.452 -6.366 -12.419 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.331 -5.530 -13.476 1.00 0.00 H new ATOM 758 N THR A 46 27.338 -3.391 -11.362 1.00 0.00 N ATOM 759 CA THR A 46 25.982 -2.951 -11.666 1.00 0.00 C ATOM 760 C THR A 46 25.991 -1.769 -12.629 1.00 0.00 C ATOM 761 O THR A 46 26.855 -0.898 -12.548 1.00 0.00 O ATOM 762 CB THR A 46 25.221 -2.551 -10.388 1.00 0.00 C ATOM 763 OG1 THR A 46 25.775 -1.348 -9.844 1.00 0.00 O ATOM 764 CG2 THR A 46 25.288 -3.661 -9.350 1.00 0.00 C ATOM 0 H THR A 46 27.870 -2.746 -10.777 1.00 0.00 H new ATOM 0 HA THR A 46 25.474 -3.794 -12.134 1.00 0.00 H new ATOM 0 HB THR A 46 24.177 -2.383 -10.651 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.382 -0.573 -10.297 1.00 0.00 H new ATOM 0 HG21 THR A 46 24.744 -3.356 -8.456 1.00 0.00 H new ATOM 0 HG22 THR A 46 24.839 -4.567 -9.757 1.00 0.00 H new ATOM 0 HG23 THR A 46 26.329 -3.856 -9.092 1.00 0.00 H new ATOM 772 N GLU A 47 25.022 -1.746 -13.540 1.00 0.00 N ATOM 773 CA GLU A 47 24.920 -0.670 -14.519 1.00 0.00 C ATOM 774 C GLU A 47 23.478 -0.497 -14.988 1.00 0.00 C ATOM 775 O GLU A 47 22.749 -1.473 -15.162 1.00 0.00 O ATOM 776 CB GLU A 47 25.827 -0.953 -15.718 1.00 0.00 C ATOM 777 CG GLU A 47 27.240 -0.419 -15.551 1.00 0.00 C ATOM 778 CD GLU A 47 27.963 -0.259 -16.875 1.00 0.00 C ATOM 779 OE1 GLU A 47 28.239 -1.288 -17.527 1.00 0.00 O ATOM 780 OE2 GLU A 47 28.252 0.894 -17.258 1.00 0.00 O ATOM 0 H GLU A 47 24.298 -2.460 -13.620 1.00 0.00 H new ATOM 0 HA GLU A 47 25.242 0.254 -14.040 1.00 0.00 H new ATOM 0 HB2 GLU A 47 25.871 -2.029 -15.883 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.384 -0.511 -16.611 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.203 0.545 -15.043 1.00 0.00 H new ATOM 0 HG3 GLU A 47 27.807 -1.095 -14.911 1.00 0.00 H new ATOM 787 N ARG A 48 23.074 0.753 -15.190 1.00 0.00 N ATOM 788 CA ARG A 48 21.720 1.055 -15.637 1.00 0.00 C ATOM 789 C ARG A 48 21.616 0.963 -17.157 1.00 0.00 C ATOM 790 O ARG A 48 22.404 1.572 -17.881 1.00 0.00 O ATOM 791 CB ARG A 48 21.306 2.452 -15.171 1.00 0.00 C ATOM 792 CG ARG A 48 21.655 2.738 -13.719 1.00 0.00 C ATOM 793 CD ARG A 48 22.867 3.649 -13.606 1.00 0.00 C ATOM 794 NE ARG A 48 23.034 4.173 -12.253 1.00 0.00 N ATOM 795 CZ ARG A 48 24.171 4.688 -11.799 1.00 0.00 C ATOM 796 NH1 ARG A 48 25.236 4.747 -12.586 1.00 0.00 N ATOM 797 NH2 ARG A 48 24.244 5.145 -10.556 1.00 0.00 N ATOM 0 H ARG A 48 23.665 1.573 -15.051 1.00 0.00 H new ATOM 0 HA ARG A 48 21.047 0.318 -15.198 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.789 3.195 -15.805 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.231 2.567 -15.307 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.802 3.202 -13.223 1.00 0.00 H new ATOM 0 HG3 ARG A 48 21.854 1.800 -13.200 1.00 0.00 H new ATOM 0 HD2 ARG A 48 23.762 3.098 -13.894 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.764 4.478 -14.306 1.00 0.00 H new ATOM 0 HE ARG A 48 22.233 4.142 -11.622 1.00 0.00 H new ATOM 0 HH11 ARG A 48 25.183 4.396 -13.542 1.00 0.00 H new ATOM 0 HH12 ARG A 48 26.108 5.143 -12.235 1.00 0.00 H new ATOM 0 HH21 ARG A 48 23.426 5.101 -9.948 1.00 0.00 H new ATOM 0 HH22 ARG A 48 25.118 5.540 -10.208 1.00 0.00 H new ATOM 811 N ASP A 49 20.640 0.198 -17.632 1.00 0.00 N ATOM 812 CA ASP A 49 20.432 0.027 -19.065 1.00 0.00 C ATOM 813 C ASP A 49 18.944 -0.049 -19.393 1.00 0.00 C ATOM 814 O ASP A 49 18.270 -1.019 -19.044 1.00 0.00 O ATOM 815 CB ASP A 49 21.141 -1.236 -19.558 1.00 0.00 C ATOM 816 CG ASP A 49 21.559 -1.136 -21.011 1.00 0.00 C ATOM 817 OD1 ASP A 49 22.405 -0.274 -21.327 1.00 0.00 O ATOM 818 OD2 ASP A 49 21.039 -1.919 -21.834 1.00 0.00 O ATOM 0 H ASP A 49 19.980 -0.314 -17.046 1.00 0.00 H new ATOM 0 HA ASP A 49 20.854 0.893 -19.574 1.00 0.00 H new ATOM 0 HB2 ASP A 49 22.021 -1.419 -18.942 1.00 0.00 H new ATOM 0 HB3 ASP A 49 20.480 -2.093 -19.432 1.00 0.00 H new ATOM 823 N ASP A 50 18.438 0.979 -20.065 1.00 0.00 N ATOM 824 CA ASP A 50 17.030 1.029 -20.440 1.00 0.00 C ATOM 825 C ASP A 50 16.135 0.928 -19.209 1.00 0.00 C ATOM 826 O ASP A 50 14.986 0.499 -19.297 1.00 0.00 O ATOM 827 CB ASP A 50 16.700 -0.100 -21.419 1.00 0.00 C ATOM 828 CG ASP A 50 17.246 0.162 -22.809 1.00 0.00 C ATOM 829 OD1 ASP A 50 17.453 1.344 -23.152 1.00 0.00 O ATOM 830 OD2 ASP A 50 17.465 -0.816 -23.555 1.00 0.00 O ATOM 0 H ASP A 50 18.982 1.789 -20.361 1.00 0.00 H new ATOM 0 HA ASP A 50 16.843 1.987 -20.925 1.00 0.00 H new ATOM 0 HB2 ASP A 50 17.110 -1.036 -21.041 1.00 0.00 H new ATOM 0 HB3 ASP A 50 15.619 -0.225 -21.474 1.00 0.00 H new ATOM 835 N GLY A 51 16.672 1.327 -18.059 1.00 0.00 N ATOM 836 CA GLY A 51 15.909 1.272 -16.826 1.00 0.00 C ATOM 837 C GLY A 51 16.166 0.001 -16.041 1.00 0.00 C ATOM 838 O GLY A 51 15.860 -0.075 -14.851 1.00 0.00 O ATOM 0 H GLY A 51 17.621 1.687 -17.960 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.160 2.134 -16.208 1.00 0.00 H new ATOM 0 HA3 GLY A 51 14.846 1.344 -17.057 1.00 0.00 H new ATOM 842 N ASP A 52 16.728 -1.001 -16.708 1.00 0.00 N ATOM 843 CA ASP A 52 17.026 -2.276 -16.066 1.00 0.00 C ATOM 844 C ASP A 52 18.398 -2.242 -15.400 1.00 0.00 C ATOM 845 O ASP A 52 19.171 -1.303 -15.595 1.00 0.00 O ATOM 846 CB ASP A 52 16.968 -3.412 -17.088 1.00 0.00 C ATOM 847 CG ASP A 52 15.880 -3.205 -18.123 1.00 0.00 C ATOM 848 OD1 ASP A 52 14.771 -2.777 -17.741 1.00 0.00 O ATOM 849 OD2 ASP A 52 16.138 -3.471 -19.316 1.00 0.00 O ATOM 0 H ASP A 52 16.987 -0.955 -17.694 1.00 0.00 H new ATOM 0 HA ASP A 52 16.274 -2.452 -15.297 1.00 0.00 H new ATOM 0 HB2 ASP A 52 17.932 -3.495 -17.590 1.00 0.00 H new ATOM 0 HB3 ASP A 52 16.797 -4.355 -16.569 1.00 0.00 H new ATOM 854 N LEU A 53 18.694 -3.271 -14.614 1.00 0.00 N ATOM 855 CA LEU A 53 19.973 -3.359 -13.919 1.00 0.00 C ATOM 856 C LEU A 53 20.668 -4.683 -14.222 1.00 0.00 C ATOM 857 O LEU A 53 20.053 -5.747 -14.157 1.00 0.00 O ATOM 858 CB LEU A 53 19.767 -3.213 -12.410 1.00 0.00 C ATOM 859 CG LEU A 53 20.947 -2.643 -11.623 1.00 0.00 C ATOM 860 CD1 LEU A 53 22.141 -3.583 -11.696 1.00 0.00 C ATOM 861 CD2 LEU A 53 21.320 -1.263 -12.145 1.00 0.00 C ATOM 0 H LEU A 53 18.066 -4.056 -14.442 1.00 0.00 H new ATOM 0 HA LEU A 53 20.607 -2.547 -14.274 1.00 0.00 H new ATOM 0 HB2 LEU A 53 18.901 -2.573 -12.242 1.00 0.00 H new ATOM 0 HB3 LEU A 53 19.523 -4.193 -12.000 1.00 0.00 H new ATOM 0 HG LEU A 53 20.650 -2.546 -10.579 1.00 0.00 H new ATOM 0 HD11 LEU A 53 22.972 -3.161 -11.130 1.00 0.00 H new ATOM 0 HD12 LEU A 53 21.869 -4.550 -11.274 1.00 0.00 H new ATOM 0 HD13 LEU A 53 22.439 -3.712 -12.736 1.00 0.00 H new ATOM 0 HD21 LEU A 53 22.162 -0.873 -11.573 1.00 0.00 H new ATOM 0 HD22 LEU A 53 21.598 -1.335 -13.197 1.00 0.00 H new ATOM 0 HD23 LEU A 53 20.468 -0.592 -12.040 1.00 0.00 H new ATOM 873 N ILE A 54 21.953 -4.608 -14.552 1.00 0.00 N ATOM 874 CA ILE A 54 22.732 -5.801 -14.863 1.00 0.00 C ATOM 875 C ILE A 54 23.549 -6.252 -13.657 1.00 0.00 C ATOM 876 O ILE A 54 24.139 -5.433 -12.952 1.00 0.00 O ATOM 877 CB ILE A 54 23.682 -5.559 -16.051 1.00 0.00 C ATOM 878 CG1 ILE A 54 22.958 -4.800 -17.164 1.00 0.00 C ATOM 879 CG2 ILE A 54 24.226 -6.881 -16.571 1.00 0.00 C ATOM 880 CD1 ILE A 54 21.703 -5.490 -17.650 1.00 0.00 C ATOM 0 H ILE A 54 22.477 -3.735 -14.611 1.00 0.00 H new ATOM 0 HA ILE A 54 22.021 -6.582 -15.131 1.00 0.00 H new ATOM 0 HB ILE A 54 24.521 -4.952 -15.709 1.00 0.00 H new ATOM 0 HG12 ILE A 54 22.699 -3.804 -16.804 1.00 0.00 H new ATOM 0 HG13 ILE A 54 23.639 -4.668 -18.005 1.00 0.00 H new ATOM 0 HG21 ILE A 54 24.896 -6.694 -17.410 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.773 -7.387 -15.776 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.399 -7.511 -16.900 1.00 0.00 H new ATOM 0 HD11 ILE A 54 21.243 -4.895 -18.439 1.00 0.00 H new ATOM 0 HD12 ILE A 54 21.957 -6.475 -18.041 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.003 -5.598 -16.821 1.00 0.00 H new ATOM 892 N ILE A 55 23.579 -7.561 -13.427 1.00 0.00 N ATOM 893 CA ILE A 55 24.326 -8.122 -12.308 1.00 0.00 C ATOM 894 C ILE A 55 25.084 -9.377 -12.727 1.00 0.00 C ATOM 895 O ILE A 55 24.481 -10.397 -13.064 1.00 0.00 O ATOM 896 CB ILE A 55 23.399 -8.466 -11.128 1.00 0.00 C ATOM 897 CG1 ILE A 55 22.549 -7.252 -10.748 1.00 0.00 C ATOM 898 CG2 ILE A 55 24.214 -8.942 -9.935 1.00 0.00 C ATOM 899 CD1 ILE A 55 21.472 -7.562 -9.732 1.00 0.00 C ATOM 0 H ILE A 55 23.095 -8.252 -14.000 1.00 0.00 H new ATOM 0 HA ILE A 55 25.037 -7.360 -11.990 1.00 0.00 H new ATOM 0 HB ILE A 55 22.732 -9.272 -11.433 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.200 -6.474 -10.350 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.083 -6.849 -11.647 1.00 0.00 H new ATOM 0 HG21 ILE A 55 23.544 -9.181 -9.109 1.00 0.00 H new ATOM 0 HG22 ILE A 55 24.780 -9.831 -10.213 1.00 0.00 H new ATOM 0 HG23 ILE A 55 24.903 -8.155 -9.627 1.00 0.00 H new ATOM 0 HD11 ILE A 55 20.909 -6.655 -9.510 1.00 0.00 H new ATOM 0 HD12 ILE A 55 20.798 -8.318 -10.135 1.00 0.00 H new ATOM 0 HD13 ILE A 55 21.932 -7.937 -8.817 1.00 0.00 H new ATOM 911 N THR A 56 26.411 -9.297 -12.703 1.00 0.00 N ATOM 912 CA THR A 56 27.252 -10.427 -13.079 1.00 0.00 C ATOM 913 C THR A 56 27.976 -11.001 -11.867 1.00 0.00 C ATOM 914 O THR A 56 28.780 -10.320 -11.232 1.00 0.00 O ATOM 915 CB THR A 56 28.292 -10.023 -14.141 1.00 0.00 C ATOM 916 OG1 THR A 56 27.695 -9.147 -15.104 1.00 0.00 O ATOM 917 CG2 THR A 56 28.853 -11.250 -14.843 1.00 0.00 C ATOM 0 H THR A 56 26.926 -8.461 -12.427 1.00 0.00 H new ATOM 0 HA THR A 56 26.592 -11.187 -13.497 1.00 0.00 H new ATOM 0 HB THR A 56 29.109 -9.506 -13.639 1.00 0.00 H new ATOM 0 HG1 THR A 56 28.363 -8.894 -15.774 1.00 0.00 H new ATOM 0 HG21 THR A 56 29.585 -10.940 -15.588 1.00 0.00 H new ATOM 0 HG22 THR A 56 29.333 -11.900 -14.111 1.00 0.00 H new ATOM 0 HG23 THR A 56 28.043 -11.791 -15.333 1.00 0.00 H new ATOM 925 N VAL A 57 27.686 -12.260 -11.552 1.00 0.00 N ATOM 926 CA VAL A 57 28.311 -12.927 -10.416 1.00 0.00 C ATOM 927 C VAL A 57 28.850 -14.297 -10.813 1.00 0.00 C ATOM 928 O VAL A 57 28.089 -15.193 -11.177 1.00 0.00 O ATOM 929 CB VAL A 57 27.321 -13.095 -9.249 1.00 0.00 C ATOM 930 CG1 VAL A 57 27.010 -11.748 -8.614 1.00 0.00 C ATOM 931 CG2 VAL A 57 26.046 -13.776 -9.726 1.00 0.00 C ATOM 0 H VAL A 57 27.022 -12.838 -12.068 1.00 0.00 H new ATOM 0 HA VAL A 57 29.137 -12.294 -10.092 1.00 0.00 H new ATOM 0 HB VAL A 57 27.783 -13.729 -8.492 1.00 0.00 H new ATOM 0 HG11 VAL A 57 26.309 -11.887 -7.791 1.00 0.00 H new ATOM 0 HG12 VAL A 57 27.930 -11.303 -8.235 1.00 0.00 H new ATOM 0 HG13 VAL A 57 26.568 -11.088 -9.360 1.00 0.00 H new ATOM 0 HG21 VAL A 57 25.357 -13.887 -8.888 1.00 0.00 H new ATOM 0 HG22 VAL A 57 25.579 -13.170 -10.502 1.00 0.00 H new ATOM 0 HG23 VAL A 57 26.288 -14.759 -10.129 1.00 0.00 H new ATOM 941 N PHE A 58 30.167 -14.452 -10.738 1.00 0.00 N ATOM 942 CA PHE A 58 30.809 -15.714 -11.089 1.00 0.00 C ATOM 943 C PHE A 58 31.591 -16.275 -9.905 1.00 0.00 C ATOM 944 O PHE A 58 32.152 -15.525 -9.106 1.00 0.00 O ATOM 945 CB PHE A 58 31.744 -15.519 -12.285 1.00 0.00 C ATOM 946 CG PHE A 58 32.628 -14.310 -12.165 1.00 0.00 C ATOM 947 CD1 PHE A 58 33.672 -14.287 -11.255 1.00 0.00 C ATOM 948 CD2 PHE A 58 32.413 -13.197 -12.961 1.00 0.00 C ATOM 949 CE1 PHE A 58 34.487 -13.177 -11.142 1.00 0.00 C ATOM 950 CE2 PHE A 58 33.225 -12.084 -12.853 1.00 0.00 C ATOM 951 CZ PHE A 58 34.263 -12.073 -11.941 1.00 0.00 C ATOM 0 H PHE A 58 30.811 -13.720 -10.438 1.00 0.00 H new ATOM 0 HA PHE A 58 30.029 -16.427 -11.357 1.00 0.00 H new ATOM 0 HB2 PHE A 58 32.368 -16.406 -12.396 1.00 0.00 H new ATOM 0 HB3 PHE A 58 31.147 -15.434 -13.193 1.00 0.00 H new ATOM 0 HD1 PHE A 58 33.851 -15.147 -10.626 1.00 0.00 H new ATOM 0 HD2 PHE A 58 31.602 -13.199 -13.674 1.00 0.00 H new ATOM 0 HE1 PHE A 58 35.299 -13.173 -10.429 1.00 0.00 H new ATOM 0 HE2 PHE A 58 33.048 -11.223 -13.481 1.00 0.00 H new ATOM 0 HZ PHE A 58 34.897 -11.203 -11.853 1.00 0.00 H new ATOM 961 N TYR A 59 31.622 -17.599 -9.798 1.00 0.00 N ATOM 962 CA TYR A 59 32.331 -18.261 -8.710 1.00 0.00 C ATOM 963 C TYR A 59 32.944 -19.577 -9.181 1.00 0.00 C ATOM 964 O TYR A 59 32.317 -20.338 -9.917 1.00 0.00 O ATOM 965 CB TYR A 59 31.383 -18.519 -7.538 1.00 0.00 C ATOM 966 CG TYR A 59 30.509 -17.333 -7.194 1.00 0.00 C ATOM 967 CD1 TYR A 59 29.324 -17.097 -7.879 1.00 0.00 C ATOM 968 CD2 TYR A 59 30.869 -16.450 -6.184 1.00 0.00 C ATOM 969 CE1 TYR A 59 28.523 -16.015 -7.569 1.00 0.00 C ATOM 970 CE2 TYR A 59 30.074 -15.366 -5.865 1.00 0.00 C ATOM 971 CZ TYR A 59 28.902 -15.153 -6.561 1.00 0.00 C ATOM 972 OH TYR A 59 28.106 -14.075 -6.248 1.00 0.00 O ATOM 0 H TYR A 59 31.164 -18.234 -10.452 1.00 0.00 H new ATOM 0 HA TYR A 59 33.135 -17.603 -8.381 1.00 0.00 H new ATOM 0 HB2 TYR A 59 30.747 -19.371 -7.777 1.00 0.00 H new ATOM 0 HB3 TYR A 59 31.969 -18.794 -6.661 1.00 0.00 H new ATOM 0 HD1 TYR A 59 29.024 -17.771 -8.668 1.00 0.00 H new ATOM 0 HD2 TYR A 59 31.787 -16.614 -5.638 1.00 0.00 H new ATOM 0 HE1 TYR A 59 27.605 -15.845 -8.113 1.00 0.00 H new ATOM 0 HE2 TYR A 59 30.368 -14.690 -5.076 1.00 0.00 H new ATOM 0 HH TYR A 59 28.515 -13.568 -5.515 1.00 0.00 H new ATOM 982 N GLU A 60 34.175 -19.836 -8.750 1.00 0.00 N ATOM 983 CA GLU A 60 34.873 -21.059 -9.127 1.00 0.00 C ATOM 984 C GLU A 60 34.666 -22.150 -8.080 1.00 0.00 C ATOM 985 O GLU A 60 33.945 -21.956 -7.101 1.00 0.00 O ATOM 986 CB GLU A 60 36.368 -20.785 -9.304 1.00 0.00 C ATOM 987 CG GLU A 60 37.109 -20.578 -7.994 1.00 0.00 C ATOM 988 CD GLU A 60 38.083 -19.418 -8.051 1.00 0.00 C ATOM 989 OE1 GLU A 60 37.631 -18.272 -8.254 1.00 0.00 O ATOM 990 OE2 GLU A 60 39.299 -19.657 -7.893 1.00 0.00 O ATOM 0 H GLU A 60 34.708 -19.216 -8.140 1.00 0.00 H new ATOM 0 HA GLU A 60 34.459 -21.405 -10.074 1.00 0.00 H new ATOM 0 HB2 GLU A 60 36.821 -21.620 -9.840 1.00 0.00 H new ATOM 0 HB3 GLU A 60 36.495 -19.900 -9.927 1.00 0.00 H new ATOM 0 HG2 GLU A 60 36.387 -20.402 -7.197 1.00 0.00 H new ATOM 0 HG3 GLU A 60 37.650 -21.489 -7.739 1.00 0.00 H new ATOM 997 N ARG A 61 35.302 -23.296 -8.294 1.00 0.00 N ATOM 998 CA ARG A 61 35.187 -24.419 -7.371 1.00 0.00 C ATOM 999 C ARG A 61 35.344 -23.952 -5.926 1.00 0.00 C ATOM 1000 O ARG A 61 34.716 -24.495 -5.018 1.00 0.00 O ATOM 1001 CB ARG A 61 36.239 -25.482 -7.692 1.00 0.00 C ATOM 1002 CG ARG A 61 35.693 -26.657 -8.487 1.00 0.00 C ATOM 1003 CD ARG A 61 36.791 -27.353 -9.276 1.00 0.00 C ATOM 1004 NE ARG A 61 36.337 -28.619 -9.846 1.00 0.00 N ATOM 1005 CZ ARG A 61 37.082 -29.373 -10.647 1.00 0.00 C ATOM 1006 NH1 ARG A 61 38.309 -28.991 -10.971 1.00 0.00 N ATOM 1007 NH2 ARG A 61 36.599 -30.513 -11.125 1.00 0.00 N ATOM 0 H ARG A 61 35.903 -23.472 -9.099 1.00 0.00 H new ATOM 0 HA ARG A 61 34.195 -24.854 -7.489 1.00 0.00 H new ATOM 0 HB2 ARG A 61 37.051 -25.020 -8.254 1.00 0.00 H new ATOM 0 HB3 ARG A 61 36.666 -25.852 -6.760 1.00 0.00 H new ATOM 0 HG2 ARG A 61 35.223 -27.369 -7.809 1.00 0.00 H new ATOM 0 HG3 ARG A 61 34.918 -26.308 -9.170 1.00 0.00 H new ATOM 0 HD2 ARG A 61 37.134 -26.697 -10.076 1.00 0.00 H new ATOM 0 HD3 ARG A 61 37.646 -27.535 -8.625 1.00 0.00 H new ATOM 0 HE ARG A 61 35.397 -28.942 -9.617 1.00 0.00 H new ATOM 0 HH11 ARG A 61 38.684 -28.116 -10.605 1.00 0.00 H new ATOM 0 HH12 ARG A 61 38.878 -29.572 -11.586 1.00 0.00 H new ATOM 0 HH21 ARG A 61 35.655 -30.811 -10.877 1.00 0.00 H new ATOM 0 HH22 ARG A 61 37.171 -31.091 -11.740 1.00 0.00 H new ATOM 1021 N GLU A 62 36.187 -22.945 -5.723 1.00 0.00 N ATOM 1022 CA GLU A 62 36.427 -22.407 -4.389 1.00 0.00 C ATOM 1023 C GLU A 62 35.114 -22.025 -3.712 1.00 0.00 C ATOM 1024 O GLU A 62 34.953 -22.197 -2.504 1.00 0.00 O ATOM 1025 CB GLU A 62 37.349 -21.188 -4.465 1.00 0.00 C ATOM 1026 CG GLU A 62 38.782 -21.530 -4.835 1.00 0.00 C ATOM 1027 CD GLU A 62 39.405 -22.536 -3.887 1.00 0.00 C ATOM 1028 OE1 GLU A 62 39.903 -22.116 -2.821 1.00 0.00 O ATOM 1029 OE2 GLU A 62 39.394 -23.742 -4.209 1.00 0.00 O ATOM 0 H GLU A 62 36.715 -22.485 -6.465 1.00 0.00 H new ATOM 0 HA GLU A 62 36.910 -23.182 -3.794 1.00 0.00 H new ATOM 0 HB2 GLU A 62 36.951 -20.487 -5.199 1.00 0.00 H new ATOM 0 HB3 GLU A 62 37.343 -20.678 -3.502 1.00 0.00 H new ATOM 0 HG2 GLU A 62 38.806 -21.929 -5.849 1.00 0.00 H new ATOM 0 HG3 GLU A 62 39.380 -20.619 -4.836 1.00 0.00 H new ATOM 1036 N TYR A 63 34.179 -21.505 -4.499 1.00 0.00 N ATOM 1037 CA TYR A 63 32.881 -21.096 -3.976 1.00 0.00 C ATOM 1038 C TYR A 63 31.753 -21.875 -4.646 1.00 0.00 C ATOM 1039 O TYR A 63 30.580 -21.522 -4.523 1.00 0.00 O ATOM 1040 CB TYR A 63 32.673 -19.595 -4.188 1.00 0.00 C ATOM 1041 CG TYR A 63 32.950 -18.766 -2.954 1.00 0.00 C ATOM 1042 CD1 TYR A 63 34.240 -18.641 -2.452 1.00 0.00 C ATOM 1043 CD2 TYR A 63 31.923 -18.108 -2.289 1.00 0.00 C ATOM 1044 CE1 TYR A 63 34.498 -17.885 -1.325 1.00 0.00 C ATOM 1045 CE2 TYR A 63 32.171 -17.349 -1.163 1.00 0.00 C ATOM 1046 CZ TYR A 63 33.461 -17.241 -0.684 1.00 0.00 C ATOM 1047 OH TYR A 63 33.712 -16.487 0.439 1.00 0.00 O ATOM 0 H TYR A 63 34.296 -21.357 -5.501 1.00 0.00 H new ATOM 0 HA TYR A 63 32.864 -21.313 -2.908 1.00 0.00 H new ATOM 0 HB2 TYR A 63 33.322 -19.257 -4.996 1.00 0.00 H new ATOM 0 HB3 TYR A 63 31.646 -19.421 -4.510 1.00 0.00 H new ATOM 0 HD1 TYR A 63 35.055 -19.144 -2.952 1.00 0.00 H new ATOM 0 HD2 TYR A 63 30.912 -18.192 -2.660 1.00 0.00 H new ATOM 0 HE1 TYR A 63 35.506 -17.799 -0.948 1.00 0.00 H new ATOM 0 HE2 TYR A 63 31.361 -16.843 -0.660 1.00 0.00 H new ATOM 0 HH TYR A 63 32.874 -16.100 0.767 1.00 0.00 H new ATOM 1057 N PHE A 64 32.118 -22.940 -5.353 1.00 0.00 N ATOM 1058 CA PHE A 64 31.138 -23.771 -6.043 1.00 0.00 C ATOM 1059 C PHE A 64 30.476 -23.001 -7.181 1.00 0.00 C ATOM 1060 O PHE A 64 29.589 -22.173 -6.971 1.00 0.00 O ATOM 1061 CB PHE A 64 30.074 -24.265 -5.060 1.00 0.00 C ATOM 1062 CG PHE A 64 29.988 -25.762 -4.972 1.00 0.00 C ATOM 1063 CD1 PHE A 64 30.870 -26.474 -4.176 1.00 0.00 C ATOM 1064 CD2 PHE A 64 29.025 -26.456 -5.686 1.00 0.00 C ATOM 1065 CE1 PHE A 64 30.793 -27.852 -4.092 1.00 0.00 C ATOM 1066 CE2 PHE A 64 28.943 -27.834 -5.607 1.00 0.00 C ATOM 1067 CZ PHE A 64 29.829 -28.532 -4.810 1.00 0.00 C ATOM 0 H PHE A 64 33.084 -23.248 -5.463 1.00 0.00 H new ATOM 0 HA PHE A 64 31.660 -24.630 -6.465 1.00 0.00 H new ATOM 0 HB2 PHE A 64 30.290 -23.863 -4.070 1.00 0.00 H new ATOM 0 HB3 PHE A 64 29.103 -23.870 -5.359 1.00 0.00 H new ATOM 0 HD1 PHE A 64 31.627 -25.947 -3.614 1.00 0.00 H new ATOM 0 HD2 PHE A 64 28.330 -25.915 -6.311 1.00 0.00 H new ATOM 0 HE1 PHE A 64 31.485 -28.395 -3.466 1.00 0.00 H new ATOM 0 HE2 PHE A 64 28.187 -28.364 -6.168 1.00 0.00 H new ATOM 0 HZ PHE A 64 29.768 -29.609 -4.748 1.00 0.00 H new ATOM 1077 N PRO A 65 30.916 -23.278 -8.417 1.00 0.00 N ATOM 1078 CA PRO A 65 30.380 -22.623 -9.614 1.00 0.00 C ATOM 1079 C PRO A 65 28.950 -23.054 -9.921 1.00 0.00 C ATOM 1080 O PRO A 65 28.520 -24.138 -9.527 1.00 0.00 O ATOM 1081 CB PRO A 65 31.327 -23.084 -10.725 1.00 0.00 C ATOM 1082 CG PRO A 65 31.881 -24.378 -10.238 1.00 0.00 C ATOM 1083 CD PRO A 65 31.970 -24.254 -8.742 1.00 0.00 C ATOM 0 HA PRO A 65 30.331 -21.540 -9.498 1.00 0.00 H new ATOM 0 HB2 PRO A 65 30.797 -23.210 -11.669 1.00 0.00 H new ATOM 0 HB3 PRO A 65 32.118 -22.355 -10.898 1.00 0.00 H new ATOM 0 HG2 PRO A 65 31.237 -25.210 -10.523 1.00 0.00 H new ATOM 0 HG3 PRO A 65 32.862 -24.571 -10.673 1.00 0.00 H new ATOM 0 HD2 PRO A 65 31.798 -25.211 -8.249 1.00 0.00 H new ATOM 0 HD3 PRO A 65 32.953 -23.904 -8.426 1.00 0.00 H new ATOM 1091 N PHE A 66 28.217 -22.199 -10.626 1.00 0.00 N ATOM 1092 CA PHE A 66 26.835 -22.491 -10.985 1.00 0.00 C ATOM 1093 C PHE A 66 26.770 -23.368 -12.232 1.00 0.00 C ATOM 1094 O PHE A 66 26.946 -22.888 -13.351 1.00 0.00 O ATOM 1095 CB PHE A 66 26.060 -21.193 -11.220 1.00 0.00 C ATOM 1096 CG PHE A 66 26.180 -20.210 -10.090 1.00 0.00 C ATOM 1097 CD1 PHE A 66 26.079 -20.632 -8.774 1.00 0.00 C ATOM 1098 CD2 PHE A 66 26.394 -18.865 -10.344 1.00 0.00 C ATOM 1099 CE1 PHE A 66 26.190 -19.730 -7.732 1.00 0.00 C ATOM 1100 CE2 PHE A 66 26.505 -17.959 -9.306 1.00 0.00 C ATOM 1101 CZ PHE A 66 26.402 -18.392 -7.999 1.00 0.00 C ATOM 0 H PHE A 66 28.558 -21.298 -10.960 1.00 0.00 H new ATOM 0 HA PHE A 66 26.379 -23.033 -10.157 1.00 0.00 H new ATOM 0 HB2 PHE A 66 26.419 -20.726 -12.137 1.00 0.00 H new ATOM 0 HB3 PHE A 66 25.007 -21.430 -11.374 1.00 0.00 H new ATOM 0 HD1 PHE A 66 25.912 -21.677 -8.560 1.00 0.00 H new ATOM 0 HD2 PHE A 66 26.475 -18.521 -11.364 1.00 0.00 H new ATOM 0 HE1 PHE A 66 26.111 -20.072 -6.710 1.00 0.00 H new ATOM 0 HE2 PHE A 66 26.672 -16.913 -9.517 1.00 0.00 H new ATOM 0 HZ PHE A 66 26.487 -17.685 -7.187 1.00 0.00 H new ATOM 1111 N GLY A 67 26.518 -24.658 -12.029 1.00 0.00 N ATOM 1112 CA GLY A 67 26.436 -25.582 -13.146 1.00 0.00 C ATOM 1113 C GLY A 67 25.879 -26.932 -12.741 1.00 0.00 C ATOM 1114 O GLY A 67 26.422 -27.596 -11.858 1.00 0.00 O ATOM 0 H GLY A 67 26.369 -25.079 -11.112 1.00 0.00 H new ATOM 0 HA2 GLY A 67 25.806 -25.151 -13.925 1.00 0.00 H new ATOM 0 HA3 GLY A 67 27.428 -25.716 -13.576 1.00 0.00 H new ATOM 1118 N SER A 68 24.791 -27.339 -13.386 1.00 0.00 N ATOM 1119 CA SER A 68 24.156 -28.617 -13.084 1.00 0.00 C ATOM 1120 C SER A 68 23.604 -29.262 -14.351 1.00 0.00 C ATOM 1121 O SER A 68 22.776 -30.171 -14.288 1.00 0.00 O ATOM 1122 CB SER A 68 23.032 -28.424 -12.065 1.00 0.00 C ATOM 1123 OG SER A 68 22.391 -29.654 -11.774 1.00 0.00 O ATOM 0 H SER A 68 24.330 -26.803 -14.121 1.00 0.00 H new ATOM 0 HA SER A 68 24.911 -29.279 -12.660 1.00 0.00 H new ATOM 0 HB2 SER A 68 23.437 -27.996 -11.148 1.00 0.00 H new ATOM 0 HB3 SER A 68 22.303 -27.713 -12.453 1.00 0.00 H new ATOM 0 HG SER A 68 22.341 -30.197 -12.588 1.00 0.00 H new ATOM 1129 N GLU A 69 24.069 -28.785 -15.502 1.00 0.00 N ATOM 1130 CA GLU A 69 23.621 -29.315 -16.784 1.00 0.00 C ATOM 1131 C GLU A 69 23.898 -30.812 -16.882 1.00 0.00 C ATOM 1132 O GLU A 69 23.264 -31.521 -17.661 1.00 0.00 O ATOM 1133 CB GLU A 69 24.313 -28.580 -17.935 1.00 0.00 C ATOM 1134 CG GLU A 69 25.826 -28.717 -17.921 1.00 0.00 C ATOM 1135 CD GLU A 69 26.514 -27.531 -17.274 1.00 0.00 C ATOM 1136 OE1 GLU A 69 25.904 -26.908 -16.379 1.00 0.00 O ATOM 1137 OE2 GLU A 69 27.660 -27.224 -17.663 1.00 0.00 O ATOM 0 H GLU A 69 24.755 -28.033 -15.572 1.00 0.00 H new ATOM 0 HA GLU A 69 22.545 -29.158 -16.856 1.00 0.00 H new ATOM 0 HB2 GLU A 69 23.931 -28.962 -18.881 1.00 0.00 H new ATOM 0 HB3 GLU A 69 24.052 -27.523 -17.889 1.00 0.00 H new ATOM 0 HG2 GLU A 69 26.100 -29.627 -17.387 1.00 0.00 H new ATOM 0 HG3 GLU A 69 26.186 -28.828 -18.944 1.00 0.00 H new ATOM 1144 N GLU A 70 24.852 -31.284 -16.085 1.00 0.00 N ATOM 1145 CA GLU A 70 25.215 -32.696 -16.083 1.00 0.00 C ATOM 1146 C GLU A 70 24.045 -33.558 -15.617 1.00 0.00 C ATOM 1147 O GLU A 70 23.964 -34.742 -15.944 1.00 0.00 O ATOM 1148 CB GLU A 70 26.428 -32.933 -15.181 1.00 0.00 C ATOM 1149 CG GLU A 70 27.737 -32.446 -15.780 1.00 0.00 C ATOM 1150 CD GLU A 70 28.832 -32.291 -14.743 1.00 0.00 C ATOM 1151 OE1 GLU A 70 28.509 -31.941 -13.588 1.00 0.00 O ATOM 1152 OE2 GLU A 70 30.011 -32.518 -15.085 1.00 0.00 O ATOM 0 H GLU A 70 25.387 -30.710 -15.433 1.00 0.00 H new ATOM 0 HA GLU A 70 25.470 -32.980 -17.104 1.00 0.00 H new ATOM 0 HB2 GLU A 70 26.265 -32.430 -14.228 1.00 0.00 H new ATOM 0 HB3 GLU A 70 26.510 -33.999 -14.969 1.00 0.00 H new ATOM 0 HG2 GLU A 70 28.065 -33.148 -16.547 1.00 0.00 H new ATOM 0 HG3 GLU A 70 27.572 -31.489 -16.274 1.00 0.00 H new ATOM 1159 N SER A 71 23.142 -32.955 -14.852 1.00 0.00 N ATOM 1160 CA SER A 71 21.978 -33.667 -14.337 1.00 0.00 C ATOM 1161 C SER A 71 20.749 -33.394 -15.198 1.00 0.00 C ATOM 1162 O SER A 71 20.122 -34.317 -15.717 1.00 0.00 O ATOM 1163 CB SER A 71 21.702 -33.257 -12.889 1.00 0.00 C ATOM 1164 OG SER A 71 20.649 -34.025 -12.333 1.00 0.00 O ATOM 0 H SER A 71 23.193 -31.975 -14.575 1.00 0.00 H new ATOM 0 HA SER A 71 22.193 -34.735 -14.370 1.00 0.00 H new ATOM 0 HB2 SER A 71 22.605 -33.387 -12.293 1.00 0.00 H new ATOM 0 HB3 SER A 71 21.444 -32.199 -12.850 1.00 0.00 H new ATOM 0 HG SER A 71 20.493 -33.745 -11.407 1.00 0.00 H new ATOM 1170 N LYS A 72 20.409 -32.117 -15.345 1.00 0.00 N ATOM 1171 CA LYS A 72 19.256 -31.719 -16.143 1.00 0.00 C ATOM 1172 C LYS A 72 19.445 -32.110 -17.605 1.00 0.00 C ATOM 1173 O LYS A 72 18.510 -32.567 -18.262 1.00 0.00 O ATOM 1174 CB LYS A 72 19.031 -30.209 -16.033 1.00 0.00 C ATOM 1175 CG LYS A 72 17.720 -29.837 -15.362 1.00 0.00 C ATOM 1176 CD LYS A 72 17.130 -28.569 -15.956 1.00 0.00 C ATOM 1177 CE LYS A 72 15.621 -28.675 -16.108 1.00 0.00 C ATOM 1178 NZ LYS A 72 14.902 -28.029 -14.975 1.00 0.00 N ATOM 0 H LYS A 72 20.916 -31.340 -14.921 1.00 0.00 H new ATOM 0 HA LYS A 72 18.380 -32.240 -15.756 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.855 -29.767 -15.472 1.00 0.00 H new ATOM 0 HB3 LYS A 72 19.055 -29.773 -17.032 1.00 0.00 H new ATOM 0 HG2 LYS A 72 17.009 -30.656 -15.471 1.00 0.00 H new ATOM 0 HG3 LYS A 72 17.884 -29.697 -14.293 1.00 0.00 H new ATOM 0 HD2 LYS A 72 17.374 -27.719 -15.318 1.00 0.00 H new ATOM 0 HD3 LYS A 72 17.582 -28.377 -16.929 1.00 0.00 H new ATOM 0 HE2 LYS A 72 15.317 -28.208 -17.045 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.335 -29.725 -16.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 13.876 -28.123 -15.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 15.173 -28.491 -14.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.155 -27.021 -14.933 1.00 0.00 H new ATOM 1192 N VAL A 73 20.662 -31.930 -18.109 1.00 0.00 N ATOM 1193 CA VAL A 73 20.975 -32.267 -19.493 1.00 0.00 C ATOM 1194 C VAL A 73 20.224 -31.360 -20.462 1.00 0.00 C ATOM 1195 O VAL A 73 19.546 -31.834 -21.374 1.00 0.00 O ATOM 1196 CB VAL A 73 20.627 -33.734 -19.805 1.00 0.00 C ATOM 1197 CG1 VAL A 73 21.238 -34.157 -21.133 1.00 0.00 C ATOM 1198 CG2 VAL A 73 21.096 -34.644 -18.680 1.00 0.00 C ATOM 0 H VAL A 73 21.448 -31.552 -17.579 1.00 0.00 H new ATOM 0 HA VAL A 73 22.048 -32.121 -19.621 1.00 0.00 H new ATOM 0 HB VAL A 73 19.544 -33.823 -19.886 1.00 0.00 H new ATOM 0 HG11 VAL A 73 20.981 -35.197 -21.337 1.00 0.00 H new ATOM 0 HG12 VAL A 73 20.849 -33.524 -21.931 1.00 0.00 H new ATOM 0 HG13 VAL A 73 22.322 -34.054 -21.084 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.842 -35.677 -18.918 1.00 0.00 H new ATOM 0 HG22 VAL A 73 22.176 -34.553 -18.565 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.607 -34.355 -17.750 1.00 0.00 H new ATOM 1208 N LYS A 74 20.350 -30.053 -20.259 1.00 0.00 N ATOM 1209 CA LYS A 74 19.686 -29.078 -21.115 1.00 0.00 C ATOM 1210 C LYS A 74 20.004 -27.655 -20.667 1.00 0.00 C ATOM 1211 O LYS A 74 20.288 -27.412 -19.495 1.00 0.00 O ATOM 1212 CB LYS A 74 18.172 -29.303 -21.100 1.00 0.00 C ATOM 1213 CG LYS A 74 17.607 -29.731 -22.443 1.00 0.00 C ATOM 1214 CD LYS A 74 16.316 -28.998 -22.765 1.00 0.00 C ATOM 1215 CE LYS A 74 15.871 -29.253 -24.197 1.00 0.00 C ATOM 1216 NZ LYS A 74 14.393 -29.145 -24.346 1.00 0.00 N ATOM 0 H LYS A 74 20.907 -29.644 -19.508 1.00 0.00 H new ATOM 0 HA LYS A 74 20.057 -29.211 -22.131 1.00 0.00 H new ATOM 0 HB2 LYS A 74 17.934 -30.063 -20.356 1.00 0.00 H new ATOM 0 HB3 LYS A 74 17.680 -28.383 -20.785 1.00 0.00 H new ATOM 0 HG2 LYS A 74 18.341 -29.538 -23.225 1.00 0.00 H new ATOM 0 HG3 LYS A 74 17.424 -30.806 -22.436 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.533 -29.319 -22.077 1.00 0.00 H new ATOM 0 HD3 LYS A 74 16.456 -27.928 -22.612 1.00 0.00 H new ATOM 0 HE2 LYS A 74 16.356 -28.538 -24.861 1.00 0.00 H new ATOM 0 HE3 LYS A 74 16.196 -30.246 -24.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.130 -29.325 -25.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 13.930 -29.845 -23.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.086 -28.189 -24.075 1.00 0.00 H new ATOM 1230 N MET A 75 19.952 -26.718 -21.608 1.00 0.00 N ATOM 1231 CA MET A 75 20.232 -25.318 -21.309 1.00 0.00 C ATOM 1232 C MET A 75 19.354 -24.821 -20.164 1.00 0.00 C ATOM 1233 O MET A 75 19.731 -23.906 -19.434 1.00 0.00 O ATOM 1234 CB MET A 75 20.008 -24.454 -22.551 1.00 0.00 C ATOM 1235 CG MET A 75 21.110 -24.586 -23.590 1.00 0.00 C ATOM 1236 SD MET A 75 21.216 -23.151 -24.676 1.00 0.00 S ATOM 1237 CE MET A 75 21.290 -23.945 -26.280 1.00 0.00 C ATOM 0 H MET A 75 19.719 -26.902 -22.584 1.00 0.00 H new ATOM 0 HA MET A 75 21.276 -25.239 -21.004 1.00 0.00 H new ATOM 0 HB2 MET A 75 19.056 -24.727 -23.006 1.00 0.00 H new ATOM 0 HB3 MET A 75 19.929 -23.410 -22.248 1.00 0.00 H new ATOM 0 HG2 MET A 75 22.066 -24.726 -23.085 1.00 0.00 H new ATOM 0 HG3 MET A 75 20.933 -25.479 -24.190 1.00 0.00 H new ATOM 0 HE1 MET A 75 21.358 -23.186 -27.059 1.00 0.00 H new ATOM 0 HE2 MET A 75 22.166 -24.592 -26.326 1.00 0.00 H new ATOM 0 HE3 MET A 75 20.390 -24.541 -26.433 1.00 0.00 H new ATOM 1247 N ALA A 76 18.183 -25.431 -20.015 1.00 0.00 N ATOM 1248 CA ALA A 76 17.253 -25.051 -18.959 1.00 0.00 C ATOM 1249 C ALA A 76 17.946 -25.025 -17.601 1.00 0.00 C ATOM 1250 O ALA A 76 17.571 -24.255 -16.716 1.00 0.00 O ATOM 1251 CB ALA A 76 16.068 -26.005 -18.930 1.00 0.00 C ATOM 0 H ALA A 76 17.856 -26.190 -20.612 1.00 0.00 H new ATOM 0 HA ALA A 76 16.891 -24.045 -19.173 1.00 0.00 H new ATOM 0 HB1 ALA A 76 15.382 -25.709 -18.136 1.00 0.00 H new ATOM 0 HB2 ALA A 76 15.550 -25.971 -19.889 1.00 0.00 H new ATOM 0 HB3 ALA A 76 16.422 -27.019 -18.744 1.00 0.00 H new ATOM 1257 N ASP A 77 18.958 -25.871 -17.442 1.00 0.00 N ATOM 1258 CA ASP A 77 19.704 -25.944 -16.191 1.00 0.00 C ATOM 1259 C ASP A 77 20.435 -24.634 -15.916 1.00 0.00 C ATOM 1260 O ASP A 77 20.500 -24.175 -14.775 1.00 0.00 O ATOM 1261 CB ASP A 77 20.704 -27.101 -16.236 1.00 0.00 C ATOM 1262 CG ASP A 77 21.340 -27.369 -14.886 1.00 0.00 C ATOM 1263 OD1 ASP A 77 22.392 -26.762 -14.595 1.00 0.00 O ATOM 1264 OD2 ASP A 77 20.787 -28.187 -14.121 1.00 0.00 O ATOM 0 H ASP A 77 19.281 -26.516 -18.164 1.00 0.00 H new ATOM 0 HA ASP A 77 18.994 -26.119 -15.383 1.00 0.00 H new ATOM 0 HB2 ASP A 77 20.197 -28.002 -16.581 1.00 0.00 H new ATOM 0 HB3 ASP A 77 21.484 -26.875 -16.963 1.00 0.00 H new ATOM 1269 N PHE A 78 20.984 -24.036 -16.969 1.00 0.00 N ATOM 1270 CA PHE A 78 21.712 -22.779 -16.841 1.00 0.00 C ATOM 1271 C PHE A 78 20.777 -21.650 -16.415 1.00 0.00 C ATOM 1272 O PHE A 78 21.042 -20.945 -15.441 1.00 0.00 O ATOM 1273 CB PHE A 78 22.392 -22.422 -18.164 1.00 0.00 C ATOM 1274 CG PHE A 78 23.475 -23.385 -18.560 1.00 0.00 C ATOM 1275 CD1 PHE A 78 24.505 -23.687 -17.685 1.00 0.00 C ATOM 1276 CD2 PHE A 78 23.462 -23.987 -19.808 1.00 0.00 C ATOM 1277 CE1 PHE A 78 25.503 -24.572 -18.047 1.00 0.00 C ATOM 1278 CE2 PHE A 78 24.458 -24.873 -20.176 1.00 0.00 C ATOM 1279 CZ PHE A 78 25.479 -25.166 -19.294 1.00 0.00 C ATOM 0 H PHE A 78 20.938 -24.402 -17.920 1.00 0.00 H new ATOM 0 HA PHE A 78 22.474 -22.906 -16.072 1.00 0.00 H new ATOM 0 HB2 PHE A 78 21.640 -22.389 -18.952 1.00 0.00 H new ATOM 0 HB3 PHE A 78 22.817 -21.421 -18.087 1.00 0.00 H new ATOM 0 HD1 PHE A 78 24.529 -23.226 -16.709 1.00 0.00 H new ATOM 0 HD2 PHE A 78 22.665 -23.762 -20.501 1.00 0.00 H new ATOM 0 HE1 PHE A 78 26.301 -24.799 -17.356 1.00 0.00 H new ATOM 0 HE2 PHE A 78 24.437 -25.335 -21.152 1.00 0.00 H new ATOM 0 HZ PHE A 78 26.258 -25.858 -19.578 1.00 0.00 H new ATOM 1289 N ILE A 79 19.684 -21.486 -17.152 1.00 0.00 N ATOM 1290 CA ILE A 79 18.710 -20.444 -16.852 1.00 0.00 C ATOM 1291 C ILE A 79 18.019 -20.705 -15.518 1.00 0.00 C ATOM 1292 O ILE A 79 17.687 -19.774 -14.786 1.00 0.00 O ATOM 1293 CB ILE A 79 17.644 -20.334 -17.957 1.00 0.00 C ATOM 1294 CG1 ILE A 79 16.520 -19.392 -17.520 1.00 0.00 C ATOM 1295 CG2 ILE A 79 17.088 -21.710 -18.295 1.00 0.00 C ATOM 1296 CD1 ILE A 79 15.320 -20.110 -16.944 1.00 0.00 C ATOM 0 H ILE A 79 19.451 -22.061 -17.961 1.00 0.00 H new ATOM 0 HA ILE A 79 19.260 -19.505 -16.796 1.00 0.00 H new ATOM 0 HB ILE A 79 18.110 -19.922 -18.852 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.909 -18.696 -16.776 1.00 0.00 H new ATOM 0 HG13 ILE A 79 16.201 -18.798 -18.376 1.00 0.00 H new ATOM 0 HG21 ILE A 79 16.335 -21.616 -19.078 1.00 0.00 H new ATOM 0 HG22 ILE A 79 17.896 -22.353 -18.644 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.634 -22.147 -17.406 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.563 -19.380 -16.656 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.906 -20.786 -17.693 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.624 -20.682 -16.068 1.00 0.00 H new ATOM 1308 N ALA A 80 17.808 -21.980 -15.207 1.00 0.00 N ATOM 1309 CA ALA A 80 17.160 -22.365 -13.960 1.00 0.00 C ATOM 1310 C ALA A 80 18.080 -22.127 -12.767 1.00 0.00 C ATOM 1311 O ALA A 80 17.676 -21.528 -11.770 1.00 0.00 O ATOM 1312 CB ALA A 80 16.733 -23.824 -14.015 1.00 0.00 C ATOM 0 H ALA A 80 18.077 -22.764 -15.802 1.00 0.00 H new ATOM 0 HA ALA A 80 16.274 -21.743 -13.833 1.00 0.00 H new ATOM 0 HB1 ALA A 80 16.250 -24.097 -13.077 1.00 0.00 H new ATOM 0 HB2 ALA A 80 16.033 -23.968 -14.838 1.00 0.00 H new ATOM 0 HB3 ALA A 80 17.609 -24.454 -14.170 1.00 0.00 H new ATOM 1318 N ARG A 81 19.318 -22.598 -12.876 1.00 0.00 N ATOM 1319 CA ARG A 81 20.294 -22.438 -11.806 1.00 0.00 C ATOM 1320 C ARG A 81 20.651 -20.967 -11.612 1.00 0.00 C ATOM 1321 O ARG A 81 20.936 -20.530 -10.497 1.00 0.00 O ATOM 1322 CB ARG A 81 21.558 -23.243 -12.114 1.00 0.00 C ATOM 1323 CG ARG A 81 22.571 -23.243 -10.981 1.00 0.00 C ATOM 1324 CD ARG A 81 23.351 -24.548 -10.931 1.00 0.00 C ATOM 1325 NE ARG A 81 24.075 -24.705 -9.672 1.00 0.00 N ATOM 1326 CZ ARG A 81 23.487 -24.998 -8.518 1.00 0.00 C ATOM 1327 NH1 ARG A 81 22.172 -25.164 -8.463 1.00 0.00 N ATOM 1328 NH2 ARG A 81 24.214 -25.124 -7.415 1.00 0.00 N ATOM 0 H ARG A 81 19.669 -23.094 -13.696 1.00 0.00 H new ATOM 0 HA ARG A 81 19.849 -22.812 -10.884 1.00 0.00 H new ATOM 0 HB2 ARG A 81 21.277 -24.272 -12.339 1.00 0.00 H new ATOM 0 HB3 ARG A 81 22.028 -22.837 -13.010 1.00 0.00 H new ATOM 0 HG2 ARG A 81 23.262 -22.410 -11.109 1.00 0.00 H new ATOM 0 HG3 ARG A 81 22.057 -23.088 -10.032 1.00 0.00 H new ATOM 0 HD2 ARG A 81 22.665 -25.385 -11.062 1.00 0.00 H new ATOM 0 HD3 ARG A 81 24.056 -24.581 -11.761 1.00 0.00 H new ATOM 0 HE ARG A 81 25.088 -24.583 -9.680 1.00 0.00 H new ATOM 0 HH11 ARG A 81 21.610 -25.067 -9.309 1.00 0.00 H new ATOM 0 HH12 ARG A 81 21.723 -25.389 -7.575 1.00 0.00 H new ATOM 0 HH21 ARG A 81 25.225 -24.996 -7.453 1.00 0.00 H new ATOM 0 HH22 ARG A 81 23.762 -25.349 -6.529 1.00 0.00 H new ATOM 1342 N GLU A 82 20.633 -20.209 -12.704 1.00 0.00 N ATOM 1343 CA GLU A 82 20.956 -18.788 -12.653 1.00 0.00 C ATOM 1344 C GLU A 82 19.817 -17.994 -12.019 1.00 0.00 C ATOM 1345 O GLU A 82 20.041 -17.166 -11.137 1.00 0.00 O ATOM 1346 CB GLU A 82 21.242 -18.257 -14.059 1.00 0.00 C ATOM 1347 CG GLU A 82 22.583 -18.704 -14.617 1.00 0.00 C ATOM 1348 CD GLU A 82 22.678 -18.525 -16.120 1.00 0.00 C ATOM 1349 OE1 GLU A 82 21.619 -18.442 -16.776 1.00 0.00 O ATOM 1350 OE2 GLU A 82 23.812 -18.468 -16.640 1.00 0.00 O ATOM 0 H GLU A 82 20.398 -20.555 -13.634 1.00 0.00 H new ATOM 0 HA GLU A 82 21.848 -18.666 -12.038 1.00 0.00 H new ATOM 0 HB2 GLU A 82 20.450 -18.587 -14.731 1.00 0.00 H new ATOM 0 HB3 GLU A 82 21.211 -17.168 -14.040 1.00 0.00 H new ATOM 0 HG2 GLU A 82 23.380 -18.137 -14.136 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.744 -19.753 -14.369 1.00 0.00 H new ATOM 1357 N GLU A 83 18.597 -18.253 -12.477 1.00 0.00 N ATOM 1358 CA GLU A 83 17.423 -17.561 -11.956 1.00 0.00 C ATOM 1359 C GLU A 83 17.236 -17.852 -10.470 1.00 0.00 C ATOM 1360 O GLU A 83 17.120 -16.934 -9.657 1.00 0.00 O ATOM 1361 CB GLU A 83 16.172 -17.979 -12.731 1.00 0.00 C ATOM 1362 CG GLU A 83 16.037 -17.299 -14.083 1.00 0.00 C ATOM 1363 CD GLU A 83 14.711 -17.595 -14.756 1.00 0.00 C ATOM 1364 OE1 GLU A 83 13.880 -18.298 -14.143 1.00 0.00 O ATOM 1365 OE2 GLU A 83 14.504 -17.124 -15.893 1.00 0.00 O ATOM 0 H GLU A 83 18.395 -18.936 -13.207 1.00 0.00 H new ATOM 0 HA GLU A 83 17.578 -16.489 -12.082 1.00 0.00 H new ATOM 0 HB2 GLU A 83 16.190 -19.059 -12.877 1.00 0.00 H new ATOM 0 HB3 GLU A 83 15.291 -17.753 -12.131 1.00 0.00 H new ATOM 0 HG2 GLU A 83 16.143 -16.222 -13.956 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.850 -17.625 -14.732 1.00 0.00 H new ATOM 1372 N ILE A 84 17.207 -19.134 -10.123 1.00 0.00 N ATOM 1373 CA ILE A 84 17.034 -19.546 -8.736 1.00 0.00 C ATOM 1374 C ILE A 84 18.160 -19.009 -7.859 1.00 0.00 C ATOM 1375 O ILE A 84 17.958 -18.724 -6.679 1.00 0.00 O ATOM 1376 CB ILE A 84 16.984 -21.080 -8.606 1.00 0.00 C ATOM 1377 CG1 ILE A 84 18.343 -21.688 -8.961 1.00 0.00 C ATOM 1378 CG2 ILE A 84 15.892 -21.652 -9.497 1.00 0.00 C ATOM 1379 CD1 ILE A 84 19.190 -22.022 -7.753 1.00 0.00 C ATOM 0 H ILE A 84 17.301 -19.905 -10.784 1.00 0.00 H new ATOM 0 HA ILE A 84 16.084 -19.130 -8.399 1.00 0.00 H new ATOM 0 HB ILE A 84 16.752 -21.335 -7.572 1.00 0.00 H new ATOM 0 HG12 ILE A 84 18.185 -22.594 -9.545 1.00 0.00 H new ATOM 0 HG13 ILE A 84 18.889 -20.990 -9.596 1.00 0.00 H new ATOM 0 HG21 ILE A 84 15.869 -22.737 -9.394 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.928 -21.239 -9.201 1.00 0.00 H new ATOM 0 HG23 ILE A 84 16.095 -21.390 -10.535 1.00 0.00 H new ATOM 0 HD11 ILE A 84 20.138 -22.449 -8.080 1.00 0.00 H new ATOM 0 HD12 ILE A 84 19.379 -21.115 -7.179 1.00 0.00 H new ATOM 0 HD13 ILE A 84 18.664 -22.744 -7.128 1.00 0.00 H new ATOM 1391 N GLU A 85 19.345 -18.871 -8.445 1.00 0.00 N ATOM 1392 CA GLU A 85 20.503 -18.367 -7.716 1.00 0.00 C ATOM 1393 C GLU A 85 20.254 -16.947 -7.214 1.00 0.00 C ATOM 1394 O GLU A 85 20.575 -16.616 -6.073 1.00 0.00 O ATOM 1395 CB GLU A 85 21.746 -18.394 -8.607 1.00 0.00 C ATOM 1396 CG GLU A 85 22.955 -17.714 -7.987 1.00 0.00 C ATOM 1397 CD GLU A 85 22.970 -16.217 -8.227 1.00 0.00 C ATOM 1398 OE1 GLU A 85 22.203 -15.747 -9.094 1.00 0.00 O ATOM 1399 OE2 GLU A 85 23.748 -15.515 -7.548 1.00 0.00 O ATOM 0 H GLU A 85 19.528 -19.101 -9.422 1.00 0.00 H new ATOM 0 HA GLU A 85 20.668 -19.015 -6.855 1.00 0.00 H new ATOM 0 HB2 GLU A 85 21.998 -19.430 -8.832 1.00 0.00 H new ATOM 0 HB3 GLU A 85 21.514 -17.909 -9.555 1.00 0.00 H new ATOM 0 HG2 GLU A 85 22.965 -17.906 -6.914 1.00 0.00 H new ATOM 0 HG3 GLU A 85 23.864 -18.153 -8.398 1.00 0.00 H new ATOM 1406 N MET A 86 19.681 -16.114 -8.076 1.00 0.00 N ATOM 1407 CA MET A 86 19.388 -14.730 -7.720 1.00 0.00 C ATOM 1408 C MET A 86 18.142 -14.646 -6.845 1.00 0.00 C ATOM 1409 O MET A 86 18.134 -13.958 -5.824 1.00 0.00 O ATOM 1410 CB MET A 86 19.197 -13.886 -8.982 1.00 0.00 C ATOM 1411 CG MET A 86 19.304 -12.390 -8.735 1.00 0.00 C ATOM 1412 SD MET A 86 21.001 -11.853 -8.447 1.00 0.00 S ATOM 1413 CE MET A 86 21.022 -11.742 -6.659 1.00 0.00 C ATOM 0 H MET A 86 19.410 -16.372 -9.025 1.00 0.00 H new ATOM 0 HA MET A 86 20.234 -14.339 -7.155 1.00 0.00 H new ATOM 0 HB2 MET A 86 19.943 -14.178 -9.721 1.00 0.00 H new ATOM 0 HB3 MET A 86 18.220 -14.106 -9.412 1.00 0.00 H new ATOM 0 HG2 MET A 86 18.898 -11.854 -9.593 1.00 0.00 H new ATOM 0 HG3 MET A 86 18.692 -12.123 -7.874 1.00 0.00 H new ATOM 0 HE1 MET A 86 21.044 -10.694 -6.360 1.00 0.00 H new ATOM 0 HE2 MET A 86 20.128 -12.216 -6.254 1.00 0.00 H new ATOM 0 HE3 MET A 86 21.907 -12.248 -6.273 1.00 0.00 H new ATOM 1423 N MET A 87 17.090 -15.349 -7.251 1.00 0.00 N ATOM 1424 CA MET A 87 15.838 -15.353 -6.502 1.00 0.00 C ATOM 1425 C MET A 87 16.057 -15.861 -5.081 1.00 0.00 C ATOM 1426 O MET A 87 15.587 -15.258 -4.116 1.00 0.00 O ATOM 1427 CB MET A 87 14.797 -16.221 -7.212 1.00 0.00 C ATOM 1428 CG MET A 87 14.615 -15.874 -8.681 1.00 0.00 C ATOM 1429 SD MET A 87 12.974 -15.221 -9.042 1.00 0.00 S ATOM 1430 CE MET A 87 12.078 -16.732 -9.390 1.00 0.00 C ATOM 0 H MET A 87 17.079 -15.923 -8.094 1.00 0.00 H new ATOM 0 HA MET A 87 15.471 -14.328 -6.450 1.00 0.00 H new ATOM 0 HB2 MET A 87 15.091 -17.267 -7.128 1.00 0.00 H new ATOM 0 HB3 MET A 87 13.840 -16.117 -6.701 1.00 0.00 H new ATOM 0 HG2 MET A 87 15.366 -15.140 -8.973 1.00 0.00 H new ATOM 0 HG3 MET A 87 14.788 -16.765 -9.285 1.00 0.00 H new ATOM 0 HE1 MET A 87 11.042 -16.493 -9.632 1.00 0.00 H new ATOM 0 HE2 MET A 87 12.540 -17.242 -10.235 1.00 0.00 H new ATOM 0 HE3 MET A 87 12.106 -17.381 -8.515 1.00 0.00 H new ATOM 1440 N VAL A 88 16.773 -16.975 -4.958 1.00 0.00 N ATOM 1441 CA VAL A 88 17.055 -17.563 -3.655 1.00 0.00 C ATOM 1442 C VAL A 88 18.020 -16.694 -2.856 1.00 0.00 C ATOM 1443 O VAL A 88 17.884 -16.552 -1.641 1.00 0.00 O ATOM 1444 CB VAL A 88 17.649 -18.977 -3.794 1.00 0.00 C ATOM 1445 CG1 VAL A 88 18.116 -19.495 -2.442 1.00 0.00 C ATOM 1446 CG2 VAL A 88 16.633 -19.923 -4.415 1.00 0.00 C ATOM 0 H VAL A 88 17.168 -17.488 -5.746 1.00 0.00 H new ATOM 0 HA VAL A 88 16.105 -17.627 -3.125 1.00 0.00 H new ATOM 0 HB VAL A 88 18.514 -18.926 -4.455 1.00 0.00 H new ATOM 0 HG11 VAL A 88 18.533 -20.495 -2.560 1.00 0.00 H new ATOM 0 HG12 VAL A 88 18.880 -18.829 -2.041 1.00 0.00 H new ATOM 0 HG13 VAL A 88 17.271 -19.533 -1.755 1.00 0.00 H new ATOM 0 HG21 VAL A 88 17.070 -20.918 -4.506 1.00 0.00 H new ATOM 0 HG22 VAL A 88 15.747 -19.972 -3.782 1.00 0.00 H new ATOM 0 HG23 VAL A 88 16.353 -19.558 -5.403 1.00 0.00 H new ATOM 1456 N PHE A 89 18.994 -16.112 -3.548 1.00 0.00 N ATOM 1457 CA PHE A 89 19.983 -15.256 -2.903 1.00 0.00 C ATOM 1458 C PHE A 89 19.307 -14.108 -2.159 1.00 0.00 C ATOM 1459 O PHE A 89 19.530 -13.911 -0.964 1.00 0.00 O ATOM 1460 CB PHE A 89 20.961 -14.700 -3.941 1.00 0.00 C ATOM 1461 CG PHE A 89 21.890 -13.656 -3.390 1.00 0.00 C ATOM 1462 CD1 PHE A 89 23.089 -14.019 -2.799 1.00 0.00 C ATOM 1463 CD2 PHE A 89 21.563 -12.312 -3.463 1.00 0.00 C ATOM 1464 CE1 PHE A 89 23.946 -13.060 -2.292 1.00 0.00 C ATOM 1465 CE2 PHE A 89 22.416 -11.349 -2.958 1.00 0.00 C ATOM 1466 CZ PHE A 89 23.608 -11.724 -2.370 1.00 0.00 C ATOM 0 H PHE A 89 19.120 -16.217 -4.555 1.00 0.00 H new ATOM 0 HA PHE A 89 20.533 -15.859 -2.181 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.551 -15.521 -4.349 1.00 0.00 H new ATOM 0 HB3 PHE A 89 20.396 -14.272 -4.768 1.00 0.00 H new ATOM 0 HD1 PHE A 89 23.357 -15.063 -2.734 1.00 0.00 H new ATOM 0 HD2 PHE A 89 20.631 -12.013 -3.920 1.00 0.00 H new ATOM 0 HE1 PHE A 89 24.879 -13.356 -1.835 1.00 0.00 H new ATOM 0 HE2 PHE A 89 22.151 -10.304 -3.023 1.00 0.00 H new ATOM 0 HZ PHE A 89 24.275 -10.973 -1.972 1.00 0.00 H new ATOM 1476 N LEU A 90 18.479 -13.354 -2.874 1.00 0.00 N ATOM 1477 CA LEU A 90 17.770 -12.224 -2.284 1.00 0.00 C ATOM 1478 C LEU A 90 16.733 -12.702 -1.272 1.00 0.00 C ATOM 1479 O LEU A 90 16.476 -12.035 -0.270 1.00 0.00 O ATOM 1480 CB LEU A 90 17.090 -11.397 -3.375 1.00 0.00 C ATOM 1481 CG LEU A 90 16.140 -12.157 -4.301 1.00 0.00 C ATOM 1482 CD1 LEU A 90 14.745 -12.220 -3.700 1.00 0.00 C ATOM 1483 CD2 LEU A 90 16.102 -11.507 -5.677 1.00 0.00 C ATOM 0 H LEU A 90 18.282 -13.505 -3.863 1.00 0.00 H new ATOM 0 HA LEU A 90 18.498 -11.600 -1.765 1.00 0.00 H new ATOM 0 HB2 LEU A 90 16.532 -10.591 -2.897 1.00 0.00 H new ATOM 0 HB3 LEU A 90 17.864 -10.931 -3.985 1.00 0.00 H new ATOM 0 HG LEU A 90 16.511 -13.176 -4.413 1.00 0.00 H new ATOM 0 HD11 LEU A 90 14.083 -12.765 -4.373 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.786 -12.732 -2.739 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.365 -11.209 -3.557 1.00 0.00 H new ATOM 0 HD21 LEU A 90 15.421 -12.061 -6.323 1.00 0.00 H new ATOM 0 HD22 LEU A 90 15.756 -10.477 -5.584 1.00 0.00 H new ATOM 0 HD23 LEU A 90 17.102 -11.516 -6.111 1.00 0.00 H new ATOM 1495 N SER A 91 16.143 -13.863 -1.539 1.00 0.00 N ATOM 1496 CA SER A 91 15.133 -14.429 -0.653 1.00 0.00 C ATOM 1497 C SER A 91 15.743 -14.807 0.694 1.00 0.00 C ATOM 1498 O SER A 91 15.138 -14.591 1.744 1.00 0.00 O ATOM 1499 CB SER A 91 14.491 -15.659 -1.297 1.00 0.00 C ATOM 1500 OG SER A 91 13.822 -16.450 -0.331 1.00 0.00 O ATOM 0 H SER A 91 16.347 -14.430 -2.362 1.00 0.00 H new ATOM 0 HA SER A 91 14.366 -13.673 -0.486 1.00 0.00 H new ATOM 0 HB2 SER A 91 13.785 -15.344 -2.066 1.00 0.00 H new ATOM 0 HB3 SER A 91 15.257 -16.255 -1.793 1.00 0.00 H new ATOM 0 HG SER A 91 13.419 -17.229 -0.768 1.00 0.00 H new ATOM 1506 N SER A 92 16.946 -15.372 0.655 1.00 0.00 N ATOM 1507 CA SER A 92 17.637 -15.783 1.871 1.00 0.00 C ATOM 1508 C SER A 92 18.061 -14.569 2.692 1.00 0.00 C ATOM 1509 O SER A 92 18.113 -14.624 3.921 1.00 0.00 O ATOM 1510 CB SER A 92 18.862 -16.632 1.524 1.00 0.00 C ATOM 1511 OG SER A 92 19.290 -17.389 2.642 1.00 0.00 O ATOM 0 H SER A 92 17.462 -15.555 -0.206 1.00 0.00 H new ATOM 0 HA SER A 92 16.947 -16.380 2.468 1.00 0.00 H new ATOM 0 HB2 SER A 92 18.622 -17.301 0.698 1.00 0.00 H new ATOM 0 HB3 SER A 92 19.672 -15.986 1.186 1.00 0.00 H new ATOM 0 HG SER A 92 20.073 -17.924 2.394 1.00 0.00 H new