USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 624 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 2 LYS NZ :NH3+ 161:sc= -0.0595 (180deg=-0.423) USER MOD Single : A 3 SER OG : rot 110:sc= 0 USER MOD Single : A 9 ASN : amide:sc=-0.000994 X(o=-0.00099,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 58:sc= 1.27 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 31 MET CE :methyl 180:sc= -0.105 (180deg=-0.105) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= -0.0493 K(o=-0.049,f=-1.1) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.223 K(o=-0.22,f=-3.4!) USER MOD Single : A 43 GLN : amide:sc= 0.0263 K(o=0.026,f=-2.2!) USER MOD Single : A 46 ASN : amide:sc= 0.283 K(o=0.28,f=-9.4!) USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 49 SER OG : rot -135:sc= 1.93 USER MOD Single : A 56 CYS SG : rot 180:sc= -0.0932 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0.165 K(o=0.17,f=-3.9!) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.301 X(o=-0.3,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 16:sc= 0.364 USER MOD Single : A 73 SER OG : rot 180:sc= -0.0213 USER MOD Single : A 74 SER OG : rot 180:sc= -0.264 USER MOD Single : A 75 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 18.327 32.304 14.169 1.00 0.00 N ATOM 2 CA PRO A 1 18.817 33.501 14.886 1.00 0.00 C ATOM 3 C PRO A 1 20.267 33.336 15.345 1.00 0.00 C ATOM 4 O PRO A 1 20.813 32.238 15.227 1.00 0.00 O ATOM 5 CB PRO A 1 17.848 33.739 16.063 1.00 0.00 C ATOM 6 CG PRO A 1 16.715 32.734 15.836 1.00 0.00 C ATOM 7 CD PRO A 1 16.878 32.372 14.369 1.00 0.00 C ATOM 0 H2 PRO A 1 18.722 31.445 14.553 1.00 0.00 H new ATOM 0 H3 PRO A 1 18.573 32.329 13.180 1.00 0.00 H new ATOM 0 HA PRO A 1 18.830 34.370 14.228 1.00 0.00 H new ATOM 0 HB2 PRO A 1 18.340 33.573 17.022 1.00 0.00 H new ATOM 0 HB3 PRO A 1 17.475 34.763 16.069 1.00 0.00 H new ATOM 0 HG2 PRO A 1 16.813 31.861 16.482 1.00 0.00 H new ATOM 0 HG3 PRO A 1 15.738 33.173 16.039 1.00 0.00 H new ATOM 0 HD2 PRO A 1 16.400 31.420 14.139 1.00 0.00 H new ATOM 0 HD3 PRO A 1 16.422 33.121 13.722 1.00 0.00 H new ATOM 15 N LYS A 2 20.864 34.388 15.925 1.00 0.00 N ATOM 16 CA LYS A 2 22.129 34.282 16.678 1.00 0.00 C ATOM 17 C LYS A 2 21.960 34.485 18.188 1.00 0.00 C ATOM 18 O LYS A 2 21.137 35.277 18.653 1.00 0.00 O ATOM 19 CB LYS A 2 23.258 35.125 16.056 1.00 0.00 C ATOM 20 CG LYS A 2 23.299 36.612 16.436 1.00 0.00 C ATOM 21 CD LYS A 2 22.048 37.387 15.997 1.00 0.00 C ATOM 22 CE LYS A 2 22.215 38.905 16.111 1.00 0.00 C ATOM 23 NZ LYS A 2 23.311 39.398 15.252 1.00 0.00 N ATOM 0 H LYS A 2 20.487 35.335 15.887 1.00 0.00 H new ATOM 0 HA LYS A 2 22.452 33.246 16.580 1.00 0.00 H new ATOM 0 HB2 LYS A 2 24.211 34.676 16.336 1.00 0.00 H new ATOM 0 HB3 LYS A 2 23.178 35.053 14.971 1.00 0.00 H new ATOM 0 HG2 LYS A 2 23.412 36.701 17.517 1.00 0.00 H new ATOM 0 HG3 LYS A 2 24.179 37.071 15.985 1.00 0.00 H new ATOM 0 HD2 LYS A 2 21.811 37.129 14.965 1.00 0.00 H new ATOM 0 HD3 LYS A 2 21.200 37.073 16.606 1.00 0.00 H new ATOM 0 HE2 LYS A 2 21.283 39.396 15.830 1.00 0.00 H new ATOM 0 HE3 LYS A 2 22.417 39.172 17.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 23.198 40.420 15.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 24.224 39.216 15.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 23.283 38.905 14.337 1.00 0.00 H new ATOM 37 N SER A 3 22.755 33.738 18.941 1.00 0.00 N ATOM 38 CA SER A 3 22.720 33.571 20.395 1.00 0.00 C ATOM 39 C SER A 3 24.128 33.273 20.919 1.00 0.00 C ATOM 40 O SER A 3 25.014 32.966 20.121 1.00 0.00 O ATOM 41 CB SER A 3 21.786 32.402 20.729 1.00 0.00 C ATOM 42 OG SER A 3 21.154 32.669 21.951 1.00 0.00 O ATOM 0 H SER A 3 23.503 33.187 18.521 1.00 0.00 H new ATOM 0 HA SER A 3 22.358 34.485 20.865 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.045 32.273 19.940 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.351 31.472 20.791 1.00 0.00 H new ATOM 0 HG SER A 3 20.205 32.855 21.795 1.00 0.00 H new ATOM 48 N ARG A 4 24.367 33.343 22.231 1.00 0.00 N ATOM 49 CA ARG A 4 25.704 33.226 22.846 1.00 0.00 C ATOM 50 C ARG A 4 25.689 32.341 24.096 1.00 0.00 C ATOM 51 O ARG A 4 24.934 32.588 25.033 1.00 0.00 O ATOM 52 CB ARG A 4 26.217 34.630 23.206 1.00 0.00 C ATOM 53 CG ARG A 4 26.668 35.478 22.005 1.00 0.00 C ATOM 54 CD ARG A 4 26.946 36.924 22.437 1.00 0.00 C ATOM 55 NE ARG A 4 28.024 36.993 23.440 1.00 0.00 N ATOM 56 CZ ARG A 4 28.031 37.643 24.587 1.00 0.00 C ATOM 57 NH1 ARG A 4 27.094 38.451 24.985 1.00 0.00 N ATOM 58 NH2 ARG A 4 29.022 37.457 25.396 1.00 0.00 N ATOM 0 H ARG A 4 23.624 33.486 22.915 1.00 0.00 H new ATOM 0 HA ARG A 4 26.368 32.753 22.123 1.00 0.00 H new ATOM 0 HB2 ARG A 4 25.429 35.165 23.735 1.00 0.00 H new ATOM 0 HB3 ARG A 4 27.054 34.530 23.897 1.00 0.00 H new ATOM 0 HG2 ARG A 4 27.566 35.045 21.565 1.00 0.00 H new ATOM 0 HG3 ARG A 4 25.897 35.465 21.234 1.00 0.00 H new ATOM 0 HD2 ARG A 4 27.221 37.518 21.565 1.00 0.00 H new ATOM 0 HD3 ARG A 4 26.037 37.363 22.848 1.00 0.00 H new ATOM 0 HE ARG A 4 28.872 36.472 23.219 1.00 0.00 H new ATOM 0 HH11 ARG A 4 26.280 38.618 24.394 1.00 0.00 H new ATOM 0 HH12 ARG A 4 27.173 38.918 25.889 1.00 0.00 H new ATOM 0 HH21 ARG A 4 29.776 36.819 25.141 1.00 0.00 H new ATOM 0 HH22 ARG A 4 29.050 37.948 26.289 1.00 0.00 H new ATOM 72 N LEU A 5 26.580 31.353 24.123 1.00 0.00 N ATOM 73 CA LEU A 5 26.790 30.396 25.209 1.00 0.00 C ATOM 74 C LEU A 5 28.223 30.531 25.751 1.00 0.00 C ATOM 75 O LEU A 5 29.187 30.492 24.983 1.00 0.00 O ATOM 76 CB LEU A 5 26.472 28.994 24.645 1.00 0.00 C ATOM 77 CG LEU A 5 26.444 27.852 25.675 1.00 0.00 C ATOM 78 CD1 LEU A 5 25.718 26.630 25.115 1.00 0.00 C ATOM 79 CD2 LEU A 5 27.854 27.398 26.051 1.00 0.00 C ATOM 0 H LEU A 5 27.213 31.188 23.341 1.00 0.00 H new ATOM 0 HA LEU A 5 26.134 30.583 26.060 1.00 0.00 H new ATOM 0 HB2 LEU A 5 25.503 29.034 24.147 1.00 0.00 H new ATOM 0 HB3 LEU A 5 27.212 28.753 23.882 1.00 0.00 H new ATOM 0 HG LEU A 5 25.928 28.245 26.551 1.00 0.00 H new ATOM 0 HD11 LEU A 5 25.712 25.836 25.862 1.00 0.00 H new ATOM 0 HD12 LEU A 5 24.692 26.900 24.864 1.00 0.00 H new ATOM 0 HD13 LEU A 5 26.231 26.281 24.219 1.00 0.00 H new ATOM 0 HD21 LEU A 5 27.794 26.590 26.780 1.00 0.00 H new ATOM 0 HD22 LEU A 5 28.372 27.044 25.160 1.00 0.00 H new ATOM 0 HD23 LEU A 5 28.403 28.235 26.481 1.00 0.00 H new ATOM 91 N PHE A 6 28.362 30.669 27.071 1.00 0.00 N ATOM 92 CA PHE A 6 29.646 30.746 27.784 1.00 0.00 C ATOM 93 C PHE A 6 29.867 29.500 28.652 1.00 0.00 C ATOM 94 O PHE A 6 28.941 29.060 29.339 1.00 0.00 O ATOM 95 CB PHE A 6 29.627 32.013 28.652 1.00 0.00 C ATOM 96 CG PHE A 6 30.906 32.385 29.383 1.00 0.00 C ATOM 97 CD1 PHE A 6 31.325 31.663 30.520 1.00 0.00 C ATOM 98 CD2 PHE A 6 31.630 33.524 28.983 1.00 0.00 C ATOM 99 CE1 PHE A 6 32.482 32.051 31.220 1.00 0.00 C ATOM 100 CE2 PHE A 6 32.767 33.930 29.703 1.00 0.00 C ATOM 101 CZ PHE A 6 33.203 33.185 30.810 1.00 0.00 C ATOM 0 H PHE A 6 27.559 30.733 27.697 1.00 0.00 H new ATOM 0 HA PHE A 6 30.467 30.790 27.069 1.00 0.00 H new ATOM 0 HB2 PHE A 6 29.348 32.852 28.015 1.00 0.00 H new ATOM 0 HB3 PHE A 6 28.837 31.900 29.394 1.00 0.00 H new ATOM 0 HD1 PHE A 6 30.755 30.809 30.855 1.00 0.00 H new ATOM 0 HD2 PHE A 6 31.311 34.088 28.119 1.00 0.00 H new ATOM 0 HE1 PHE A 6 32.816 31.477 32.072 1.00 0.00 H new ATOM 0 HE2 PHE A 6 33.306 34.817 29.404 1.00 0.00 H new ATOM 0 HZ PHE A 6 34.092 33.483 31.346 1.00 0.00 H new ATOM 111 N ILE A 7 31.098 28.975 28.689 1.00 0.00 N ATOM 112 CA ILE A 7 31.505 27.845 29.541 1.00 0.00 C ATOM 113 C ILE A 7 32.860 28.127 30.208 1.00 0.00 C ATOM 114 O ILE A 7 33.786 28.607 29.558 1.00 0.00 O ATOM 115 CB ILE A 7 31.595 26.510 28.751 1.00 0.00 C ATOM 116 CG1 ILE A 7 30.568 26.367 27.606 1.00 0.00 C ATOM 117 CG2 ILE A 7 31.426 25.345 29.744 1.00 0.00 C ATOM 118 CD1 ILE A 7 30.725 25.101 26.749 1.00 0.00 C ATOM 0 H ILE A 7 31.860 29.332 28.113 1.00 0.00 H new ATOM 0 HA ILE A 7 30.732 27.738 30.302 1.00 0.00 H new ATOM 0 HB ILE A 7 32.572 26.498 28.268 1.00 0.00 H new ATOM 0 HG12 ILE A 7 29.565 26.376 28.034 1.00 0.00 H new ATOM 0 HG13 ILE A 7 30.646 27.239 26.957 1.00 0.00 H new ATOM 0 HG21 ILE A 7 31.486 24.398 29.208 1.00 0.00 H new ATOM 0 HG22 ILE A 7 32.216 25.388 30.494 1.00 0.00 H new ATOM 0 HG23 ILE A 7 30.456 25.423 30.235 1.00 0.00 H new ATOM 0 HD11 ILE A 7 29.960 25.090 25.973 1.00 0.00 H new ATOM 0 HD12 ILE A 7 31.712 25.095 26.286 1.00 0.00 H new ATOM 0 HD13 ILE A 7 30.615 24.219 27.380 1.00 0.00 H new ATOM 130 N GLY A 8 33.007 27.752 31.479 1.00 0.00 N ATOM 131 CA GLY A 8 34.278 27.615 32.195 1.00 0.00 C ATOM 132 C GLY A 8 34.475 26.201 32.740 1.00 0.00 C ATOM 133 O GLY A 8 33.508 25.473 32.958 1.00 0.00 O ATOM 0 H GLY A 8 32.205 27.524 32.067 1.00 0.00 H new ATOM 0 HA2 GLY A 8 35.101 27.864 31.525 1.00 0.00 H new ATOM 0 HA3 GLY A 8 34.310 28.329 33.018 1.00 0.00 H new ATOM 137 N ASN A 9 35.730 25.809 32.957 1.00 0.00 N ATOM 138 CA ASN A 9 36.192 24.562 33.589 1.00 0.00 C ATOM 139 C ASN A 9 35.835 23.211 32.922 1.00 0.00 C ATOM 140 O ASN A 9 36.512 22.214 33.172 1.00 0.00 O ATOM 141 CB ASN A 9 35.874 24.605 35.096 1.00 0.00 C ATOM 142 CG ASN A 9 36.936 23.865 35.882 1.00 0.00 C ATOM 143 OD1 ASN A 9 36.713 22.785 36.413 1.00 0.00 O ATOM 144 ND2 ASN A 9 38.120 24.421 35.950 1.00 0.00 N ATOM 0 H ASN A 9 36.515 26.397 32.676 1.00 0.00 H new ATOM 0 HA ASN A 9 37.269 24.559 33.420 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.819 25.640 35.433 1.00 0.00 H new ATOM 0 HB3 ASN A 9 34.898 24.157 35.281 1.00 0.00 H new ATOM 0 HD21 ASN A 9 38.875 23.953 36.452 1.00 0.00 H new ATOM 0 HD22 ASN A 9 38.287 25.322 35.501 1.00 0.00 H new ATOM 151 N LEU A 10 34.854 23.166 32.018 1.00 0.00 N ATOM 152 CA LEU A 10 34.524 22.006 31.178 1.00 0.00 C ATOM 153 C LEU A 10 35.388 21.886 29.895 1.00 0.00 C ATOM 154 O LEU A 10 35.906 20.788 29.657 1.00 0.00 O ATOM 155 CB LEU A 10 32.998 22.020 30.945 1.00 0.00 C ATOM 156 CG LEU A 10 32.389 20.863 30.122 1.00 0.00 C ATOM 157 CD1 LEU A 10 30.883 20.793 30.397 1.00 0.00 C ATOM 158 CD2 LEU A 10 32.542 21.052 28.607 1.00 0.00 C ATOM 0 H LEU A 10 34.244 23.964 31.842 1.00 0.00 H new ATOM 0 HA LEU A 10 34.789 21.085 31.697 1.00 0.00 H new ATOM 0 HB2 LEU A 10 32.510 22.032 31.919 1.00 0.00 H new ATOM 0 HB3 LEU A 10 32.743 22.956 30.448 1.00 0.00 H new ATOM 0 HG LEU A 10 32.922 19.961 30.422 1.00 0.00 H new ATOM 0 HD11 LEU A 10 30.445 19.979 29.820 1.00 0.00 H new ATOM 0 HD12 LEU A 10 30.715 20.616 31.459 1.00 0.00 H new ATOM 0 HD13 LEU A 10 30.416 21.735 30.108 1.00 0.00 H new ATOM 0 HD21 LEU A 10 32.094 20.205 28.088 1.00 0.00 H new ATOM 0 HD22 LEU A 10 32.041 21.971 28.303 1.00 0.00 H new ATOM 0 HD23 LEU A 10 33.600 21.114 28.353 1.00 0.00 H new ATOM 170 N PRO A 11 35.610 22.941 29.070 1.00 0.00 N ATOM 171 CA PRO A 11 36.253 22.830 27.745 1.00 0.00 C ATOM 172 C PRO A 11 37.799 22.799 27.794 1.00 0.00 C ATOM 173 O PRO A 11 38.485 23.372 26.943 1.00 0.00 O ATOM 174 CB PRO A 11 35.682 23.999 26.933 1.00 0.00 C ATOM 175 CG PRO A 11 35.555 25.083 27.997 1.00 0.00 C ATOM 176 CD PRO A 11 35.093 24.299 29.224 1.00 0.00 C ATOM 0 HA PRO A 11 36.028 21.872 27.277 1.00 0.00 H new ATOM 0 HB2 PRO A 11 36.347 24.297 26.122 1.00 0.00 H new ATOM 0 HB3 PRO A 11 34.720 23.753 26.483 1.00 0.00 H new ATOM 0 HG2 PRO A 11 36.504 25.589 28.174 1.00 0.00 H new ATOM 0 HG3 PRO A 11 34.834 25.848 27.711 1.00 0.00 H new ATOM 0 HD2 PRO A 11 35.469 24.755 30.140 1.00 0.00 H new ATOM 0 HD3 PRO A 11 34.005 24.294 29.294 1.00 0.00 H new ATOM 184 N LEU A 12 38.357 22.170 28.830 1.00 0.00 N ATOM 185 CA LEU A 12 39.797 22.098 29.114 1.00 0.00 C ATOM 186 C LEU A 12 40.439 20.855 28.470 1.00 0.00 C ATOM 187 O LEU A 12 41.579 20.912 28.001 1.00 0.00 O ATOM 188 CB LEU A 12 39.998 22.115 30.641 1.00 0.00 C ATOM 189 CG LEU A 12 39.921 23.491 31.326 1.00 0.00 C ATOM 190 CD1 LEU A 12 38.626 24.243 31.027 1.00 0.00 C ATOM 191 CD2 LEU A 12 40.030 23.302 32.839 1.00 0.00 C ATOM 0 H LEU A 12 37.797 21.675 29.525 1.00 0.00 H new ATOM 0 HA LEU A 12 40.297 22.961 28.675 1.00 0.00 H new ATOM 0 HB2 LEU A 12 39.247 21.466 31.092 1.00 0.00 H new ATOM 0 HB3 LEU A 12 40.971 21.677 30.862 1.00 0.00 H new ATOM 0 HG LEU A 12 40.744 24.086 30.931 1.00 0.00 H new ATOM 0 HD11 LEU A 12 38.637 25.204 31.540 1.00 0.00 H new ATOM 0 HD12 LEU A 12 38.540 24.406 29.953 1.00 0.00 H new ATOM 0 HD13 LEU A 12 37.776 23.656 31.374 1.00 0.00 H new ATOM 0 HD21 LEU A 12 39.976 24.273 33.332 1.00 0.00 H new ATOM 0 HD22 LEU A 12 39.211 22.673 33.187 1.00 0.00 H new ATOM 0 HD23 LEU A 12 40.981 22.826 33.079 1.00 0.00 H new ATOM 203 N LYS A 13 39.677 19.757 28.364 1.00 0.00 N ATOM 204 CA LYS A 13 39.971 18.630 27.469 1.00 0.00 C ATOM 205 C LYS A 13 39.880 19.093 26.011 1.00 0.00 C ATOM 206 O LYS A 13 39.086 19.986 25.696 1.00 0.00 O ATOM 207 CB LYS A 13 38.994 17.469 27.759 1.00 0.00 C ATOM 208 CG LYS A 13 39.409 16.120 27.148 1.00 0.00 C ATOM 209 CD LYS A 13 40.579 15.470 27.902 1.00 0.00 C ATOM 210 CE LYS A 13 41.213 14.331 27.103 1.00 0.00 C ATOM 211 NZ LYS A 13 40.352 13.132 27.026 1.00 0.00 N ATOM 0 H LYS A 13 38.824 19.626 28.908 1.00 0.00 H new ATOM 0 HA LYS A 13 40.984 18.269 27.644 1.00 0.00 H new ATOM 0 HB2 LYS A 13 38.900 17.351 28.838 1.00 0.00 H new ATOM 0 HB3 LYS A 13 38.008 17.737 27.380 1.00 0.00 H new ATOM 0 HG2 LYS A 13 38.555 15.443 27.155 1.00 0.00 H new ATOM 0 HG3 LYS A 13 39.690 16.268 26.105 1.00 0.00 H new ATOM 0 HD2 LYS A 13 41.335 16.225 28.119 1.00 0.00 H new ATOM 0 HD3 LYS A 13 40.226 15.088 28.860 1.00 0.00 H new ATOM 0 HE2 LYS A 13 41.432 14.680 26.094 1.00 0.00 H new ATOM 0 HE3 LYS A 13 42.165 14.060 27.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 40.833 12.394 26.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 40.163 12.778 27.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 39.453 13.379 26.565 1.00 0.00 H new ATOM 225 N ASN A 14 40.673 18.497 25.124 1.00 0.00 N ATOM 226 CA ASN A 14 40.741 18.854 23.702 1.00 0.00 C ATOM 227 C ASN A 14 39.358 18.917 23.038 1.00 0.00 C ATOM 228 O ASN A 14 38.536 18.018 23.230 1.00 0.00 O ATOM 229 CB ASN A 14 41.633 17.841 22.968 1.00 0.00 C ATOM 230 CG ASN A 14 43.110 18.043 23.226 1.00 0.00 C ATOM 231 OD1 ASN A 14 43.529 18.805 24.089 1.00 0.00 O ATOM 232 ND2 ASN A 14 43.943 17.355 22.496 1.00 0.00 N ATOM 0 H ASN A 14 41.302 17.735 25.376 1.00 0.00 H new ATOM 0 HA ASN A 14 41.167 19.855 23.634 1.00 0.00 H new ATOM 0 HB2 ASN A 14 41.353 16.833 23.274 1.00 0.00 H new ATOM 0 HB3 ASN A 14 41.446 17.913 21.897 1.00 0.00 H new ATOM 0 HD21 ASN A 14 44.948 17.450 22.642 1.00 0.00 H new ATOM 0 HD22 ASN A 14 43.590 16.722 21.779 1.00 0.00 H new ATOM 239 N VAL A 15 39.106 19.974 22.265 1.00 0.00 N ATOM 240 CA VAL A 15 37.816 20.251 21.625 1.00 0.00 C ATOM 241 C VAL A 15 38.009 20.913 20.258 1.00 0.00 C ATOM 242 O VAL A 15 38.869 21.778 20.072 1.00 0.00 O ATOM 243 CB VAL A 15 36.923 21.094 22.566 1.00 0.00 C ATOM 244 CG1 VAL A 15 37.342 22.565 22.678 1.00 0.00 C ATOM 245 CG2 VAL A 15 35.446 21.037 22.164 1.00 0.00 C ATOM 0 H VAL A 15 39.812 20.681 22.060 1.00 0.00 H new ATOM 0 HA VAL A 15 37.303 19.307 21.443 1.00 0.00 H new ATOM 0 HB VAL A 15 37.062 20.632 23.543 1.00 0.00 H new ATOM 0 HG11 VAL A 15 36.665 23.085 23.356 1.00 0.00 H new ATOM 0 HG12 VAL A 15 38.360 22.625 23.064 1.00 0.00 H new ATOM 0 HG13 VAL A 15 37.299 23.031 21.694 1.00 0.00 H new ATOM 0 HG21 VAL A 15 34.858 21.643 22.853 1.00 0.00 H new ATOM 0 HG22 VAL A 15 35.329 21.422 21.151 1.00 0.00 H new ATOM 0 HG23 VAL A 15 35.098 20.005 22.202 1.00 0.00 H new ATOM 255 N SER A 16 37.180 20.516 19.300 1.00 0.00 N ATOM 256 CA SER A 16 37.025 21.139 17.984 1.00 0.00 C ATOM 257 C SER A 16 35.527 21.250 17.663 1.00 0.00 C ATOM 258 O SER A 16 34.693 20.752 18.426 1.00 0.00 O ATOM 259 CB SER A 16 37.788 20.323 16.934 1.00 0.00 C ATOM 260 OG SER A 16 39.185 20.348 17.194 1.00 0.00 O ATOM 0 H SER A 16 36.566 19.711 19.423 1.00 0.00 H new ATOM 0 HA SER A 16 37.447 22.144 17.978 1.00 0.00 H new ATOM 0 HB2 SER A 16 37.431 19.293 16.937 1.00 0.00 H new ATOM 0 HB3 SER A 16 37.591 20.725 15.940 1.00 0.00 H new ATOM 0 HG SER A 16 39.654 19.820 16.514 1.00 0.00 H new ATOM 266 N LYS A 17 35.154 21.927 16.568 1.00 0.00 N ATOM 267 CA LYS A 17 33.747 22.249 16.258 1.00 0.00 C ATOM 268 C LYS A 17 32.810 21.041 16.282 1.00 0.00 C ATOM 269 O LYS A 17 31.714 21.153 16.817 1.00 0.00 O ATOM 270 CB LYS A 17 33.650 23.022 14.931 1.00 0.00 C ATOM 271 CG LYS A 17 34.062 22.198 13.698 1.00 0.00 C ATOM 272 CD LYS A 17 34.249 23.080 12.462 1.00 0.00 C ATOM 273 CE LYS A 17 32.922 23.634 11.947 1.00 0.00 C ATOM 274 NZ LYS A 17 33.143 24.521 10.789 1.00 0.00 N ATOM 0 H LYS A 17 35.816 22.268 15.871 1.00 0.00 H new ATOM 0 HA LYS A 17 33.395 22.891 17.066 1.00 0.00 H new ATOM 0 HB2 LYS A 17 32.625 23.369 14.798 1.00 0.00 H new ATOM 0 HB3 LYS A 17 34.282 23.908 14.991 1.00 0.00 H new ATOM 0 HG2 LYS A 17 34.990 21.667 13.909 1.00 0.00 H new ATOM 0 HG3 LYS A 17 33.302 21.443 13.495 1.00 0.00 H new ATOM 0 HD2 LYS A 17 34.917 23.906 12.704 1.00 0.00 H new ATOM 0 HD3 LYS A 17 34.731 22.502 11.674 1.00 0.00 H new ATOM 0 HE2 LYS A 17 32.265 22.812 11.662 1.00 0.00 H new ATOM 0 HE3 LYS A 17 32.418 24.184 12.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 32.230 24.888 10.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 33.752 25.315 11.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 33.603 23.986 10.025 1.00 0.00 H new ATOM 288 N GLU A 18 33.239 19.881 15.784 1.00 0.00 N ATOM 289 CA GLU A 18 32.387 18.687 15.765 1.00 0.00 C ATOM 290 C GLU A 18 32.114 18.107 17.163 1.00 0.00 C ATOM 291 O GLU A 18 31.017 17.610 17.408 1.00 0.00 O ATOM 292 CB GLU A 18 32.980 17.637 14.825 1.00 0.00 C ATOM 293 CG GLU A 18 32.080 16.395 14.763 1.00 0.00 C ATOM 294 CD GLU A 18 32.415 15.455 13.609 1.00 0.00 C ATOM 295 OE1 GLU A 18 33.551 15.495 13.079 1.00 0.00 O ATOM 296 OE2 GLU A 18 31.530 14.638 13.256 1.00 0.00 O ATOM 0 H GLU A 18 34.169 19.741 15.389 1.00 0.00 H new ATOM 0 HA GLU A 18 31.412 18.995 15.387 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.095 18.059 13.827 1.00 0.00 H new ATOM 0 HB3 GLU A 18 33.975 17.354 15.169 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.164 15.848 15.702 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.042 16.713 14.672 1.00 0.00 H new ATOM 303 N ASP A 19 33.067 18.197 18.095 1.00 0.00 N ATOM 304 CA ASP A 19 32.920 17.668 19.455 1.00 0.00 C ATOM 305 C ASP A 19 31.791 18.381 20.205 1.00 0.00 C ATOM 306 O ASP A 19 30.837 17.757 20.670 1.00 0.00 O ATOM 307 CB ASP A 19 34.234 17.850 20.223 1.00 0.00 C ATOM 308 CG ASP A 19 35.400 17.121 19.573 1.00 0.00 C ATOM 309 OD1 ASP A 19 36.045 17.682 18.659 1.00 0.00 O ATOM 310 OD2 ASP A 19 35.727 16.002 20.015 1.00 0.00 O ATOM 0 H ASP A 19 33.969 18.642 17.926 1.00 0.00 H new ATOM 0 HA ASP A 19 32.673 16.609 19.384 1.00 0.00 H new ATOM 0 HB2 ASP A 19 34.467 18.913 20.289 1.00 0.00 H new ATOM 0 HB3 ASP A 19 34.107 17.487 21.243 1.00 0.00 H new ATOM 315 N LEU A 20 31.856 19.714 20.248 1.00 0.00 N ATOM 316 CA LEU A 20 30.800 20.538 20.834 1.00 0.00 C ATOM 317 C LEU A 20 29.502 20.465 20.014 1.00 0.00 C ATOM 318 O LEU A 20 28.415 20.473 20.589 1.00 0.00 O ATOM 319 CB LEU A 20 31.326 21.957 21.104 1.00 0.00 C ATOM 320 CG LEU A 20 31.848 22.716 19.870 1.00 0.00 C ATOM 321 CD1 LEU A 20 30.734 23.480 19.145 1.00 0.00 C ATOM 322 CD2 LEU A 20 32.930 23.702 20.305 1.00 0.00 C ATOM 0 H LEU A 20 32.641 20.250 19.878 1.00 0.00 H new ATOM 0 HA LEU A 20 30.518 20.138 21.808 1.00 0.00 H new ATOM 0 HB2 LEU A 20 30.526 22.542 21.557 1.00 0.00 H new ATOM 0 HB3 LEU A 20 32.130 21.894 21.837 1.00 0.00 H new ATOM 0 HG LEU A 20 32.252 21.979 19.176 1.00 0.00 H new ATOM 0 HD11 LEU A 20 31.151 23.999 18.282 1.00 0.00 H new ATOM 0 HD12 LEU A 20 29.969 22.779 18.812 1.00 0.00 H new ATOM 0 HD13 LEU A 20 30.289 24.206 19.825 1.00 0.00 H new ATOM 0 HD21 LEU A 20 33.302 24.241 19.434 1.00 0.00 H new ATOM 0 HD22 LEU A 20 32.511 24.411 21.019 1.00 0.00 H new ATOM 0 HD23 LEU A 20 33.751 23.158 20.773 1.00 0.00 H new ATOM 334 N PHE A 21 29.586 20.317 18.687 1.00 0.00 N ATOM 335 CA PHE A 21 28.410 20.157 17.835 1.00 0.00 C ATOM 336 C PHE A 21 27.639 18.882 18.188 1.00 0.00 C ATOM 337 O PHE A 21 26.426 18.954 18.377 1.00 0.00 O ATOM 338 CB PHE A 21 28.829 20.181 16.361 1.00 0.00 C ATOM 339 CG PHE A 21 27.699 20.043 15.368 1.00 0.00 C ATOM 340 CD1 PHE A 21 27.214 18.769 15.016 1.00 0.00 C ATOM 341 CD2 PHE A 21 27.151 21.193 14.770 1.00 0.00 C ATOM 342 CE1 PHE A 21 26.163 18.651 14.092 1.00 0.00 C ATOM 343 CE2 PHE A 21 26.088 21.074 13.860 1.00 0.00 C ATOM 344 CZ PHE A 21 25.587 19.803 13.537 1.00 0.00 C ATOM 0 H PHE A 21 30.470 20.305 18.178 1.00 0.00 H new ATOM 0 HA PHE A 21 27.732 20.992 18.010 1.00 0.00 H new ATOM 0 HB2 PHE A 21 29.352 21.117 16.164 1.00 0.00 H new ATOM 0 HB3 PHE A 21 29.542 19.375 16.190 1.00 0.00 H new ATOM 0 HD1 PHE A 21 27.649 17.884 15.456 1.00 0.00 H new ATOM 0 HD2 PHE A 21 27.548 22.168 15.011 1.00 0.00 H new ATOM 0 HE1 PHE A 21 25.799 17.674 13.809 1.00 0.00 H new ATOM 0 HE2 PHE A 21 25.658 21.957 13.410 1.00 0.00 H new ATOM 0 HZ PHE A 21 24.753 19.712 12.857 1.00 0.00 H new ATOM 354 N ARG A 22 28.297 17.723 18.326 1.00 0.00 N ATOM 355 CA ARG A 22 27.611 16.449 18.617 1.00 0.00 C ATOM 356 C ARG A 22 27.162 16.325 20.075 1.00 0.00 C ATOM 357 O ARG A 22 26.072 15.804 20.318 1.00 0.00 O ATOM 358 CB ARG A 22 28.451 15.255 18.131 1.00 0.00 C ATOM 359 CG ARG A 22 29.682 14.977 19.002 1.00 0.00 C ATOM 360 CD ARG A 22 30.614 13.957 18.355 1.00 0.00 C ATOM 361 NE ARG A 22 31.779 13.727 19.221 1.00 0.00 N ATOM 362 CZ ARG A 22 32.982 13.339 18.853 1.00 0.00 C ATOM 363 NH1 ARG A 22 33.246 12.997 17.626 1.00 0.00 N ATOM 364 NH2 ARG A 22 33.937 13.301 19.734 1.00 0.00 N ATOM 0 H ARG A 22 29.310 17.638 18.241 1.00 0.00 H new ATOM 0 HA ARG A 22 26.682 16.441 18.048 1.00 0.00 H new ATOM 0 HB2 ARG A 22 27.823 14.364 18.109 1.00 0.00 H new ATOM 0 HB3 ARG A 22 28.775 15.442 17.107 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.224 15.907 19.173 1.00 0.00 H new ATOM 0 HG3 ARG A 22 29.362 14.610 19.977 1.00 0.00 H new ATOM 0 HD2 ARG A 22 30.083 13.020 18.188 1.00 0.00 H new ATOM 0 HD3 ARG A 22 30.940 14.317 17.379 1.00 0.00 H new ATOM 0 HE ARG A 22 31.640 13.886 20.219 1.00 0.00 H new ATOM 0 HH11 ARG A 22 32.511 13.025 16.919 1.00 0.00 H new ATOM 0 HH12 ARG A 22 34.188 12.701 17.371 1.00 0.00 H new ATOM 0 HH21 ARG A 22 33.751 13.570 20.700 1.00 0.00 H new ATOM 0 HH22 ARG A 22 34.873 13.002 19.459 1.00 0.00 H new ATOM 378 N ILE A 23 27.924 16.856 21.041 1.00 0.00 N ATOM 379 CA ILE A 23 27.506 16.824 22.456 1.00 0.00 C ATOM 380 C ILE A 23 26.364 17.805 22.762 1.00 0.00 C ATOM 381 O ILE A 23 25.573 17.513 23.657 1.00 0.00 O ATOM 382 CB ILE A 23 28.682 16.958 23.453 1.00 0.00 C ATOM 383 CG1 ILE A 23 29.359 18.341 23.431 1.00 0.00 C ATOM 384 CG2 ILE A 23 29.708 15.832 23.258 1.00 0.00 C ATOM 385 CD1 ILE A 23 28.982 19.199 24.642 1.00 0.00 C ATOM 0 H ILE A 23 28.823 17.308 20.875 1.00 0.00 H new ATOM 0 HA ILE A 23 27.104 15.823 22.611 1.00 0.00 H new ATOM 0 HB ILE A 23 28.243 16.859 24.446 1.00 0.00 H new ATOM 0 HG12 ILE A 23 30.441 18.212 23.404 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.078 18.865 22.517 1.00 0.00 H new ATOM 0 HG21 ILE A 23 30.522 15.954 23.973 1.00 0.00 H new ATOM 0 HG22 ILE A 23 29.225 14.868 23.418 1.00 0.00 H new ATOM 0 HG23 ILE A 23 30.106 15.874 22.244 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.487 20.163 24.576 1.00 0.00 H new ATOM 0 HD12 ILE A 23 27.903 19.354 24.656 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.287 18.691 25.557 1.00 0.00 H new ATOM 397 N PHE A 24 26.212 18.904 22.004 1.00 0.00 N ATOM 398 CA PHE A 24 25.087 19.843 22.148 1.00 0.00 C ATOM 399 C PHE A 24 23.945 19.667 21.129 1.00 0.00 C ATOM 400 O PHE A 24 22.853 20.160 21.399 1.00 0.00 O ATOM 401 CB PHE A 24 25.584 21.297 22.143 1.00 0.00 C ATOM 402 CG PHE A 24 26.429 21.713 23.337 1.00 0.00 C ATOM 403 CD1 PHE A 24 25.924 21.575 24.645 1.00 0.00 C ATOM 404 CD2 PHE A 24 27.688 22.313 23.143 1.00 0.00 C ATOM 405 CE1 PHE A 24 26.663 22.048 25.743 1.00 0.00 C ATOM 406 CE2 PHE A 24 28.441 22.756 24.246 1.00 0.00 C ATOM 407 CZ PHE A 24 27.926 22.629 25.546 1.00 0.00 C ATOM 0 H PHE A 24 26.870 19.167 21.270 1.00 0.00 H new ATOM 0 HA PHE A 24 24.648 19.597 23.115 1.00 0.00 H new ATOM 0 HB2 PHE A 24 26.166 21.459 21.236 1.00 0.00 H new ATOM 0 HB3 PHE A 24 24.718 21.957 22.087 1.00 0.00 H new ATOM 0 HD1 PHE A 24 24.965 21.104 24.805 1.00 0.00 H new ATOM 0 HD2 PHE A 24 28.077 22.434 22.143 1.00 0.00 H new ATOM 0 HE1 PHE A 24 26.258 21.964 26.741 1.00 0.00 H new ATOM 0 HE2 PHE A 24 29.416 23.194 24.092 1.00 0.00 H new ATOM 0 HZ PHE A 24 28.500 22.977 26.392 1.00 0.00 H new ATOM 417 N SER A 25 24.128 18.955 20.008 1.00 0.00 N ATOM 418 CA SER A 25 23.112 18.809 18.938 1.00 0.00 C ATOM 419 C SER A 25 21.687 18.486 19.420 1.00 0.00 C ATOM 420 O SER A 25 20.766 19.178 18.988 1.00 0.00 O ATOM 421 CB SER A 25 23.523 17.749 17.905 1.00 0.00 C ATOM 422 OG SER A 25 24.357 18.321 16.917 1.00 0.00 O ATOM 0 H SER A 25 24.995 18.455 19.810 1.00 0.00 H new ATOM 0 HA SER A 25 23.079 19.802 18.489 1.00 0.00 H new ATOM 0 HB2 SER A 25 24.045 16.931 18.402 1.00 0.00 H new ATOM 0 HB3 SER A 25 22.635 17.323 17.438 1.00 0.00 H new ATOM 0 HG SER A 25 25.146 18.716 17.344 1.00 0.00 H new ATOM 428 N PRO A 26 21.443 17.509 20.316 1.00 0.00 N ATOM 429 CA PRO A 26 20.083 17.240 20.791 1.00 0.00 C ATOM 430 C PRO A 26 19.565 18.274 21.806 1.00 0.00 C ATOM 431 O PRO A 26 18.359 18.358 22.029 1.00 0.00 O ATOM 432 CB PRO A 26 20.140 15.831 21.382 1.00 0.00 C ATOM 433 CG PRO A 26 21.584 15.701 21.851 1.00 0.00 C ATOM 434 CD PRO A 26 22.371 16.503 20.820 1.00 0.00 C ATOM 0 HA PRO A 26 19.369 17.315 19.971 1.00 0.00 H new ATOM 0 HB2 PRO A 26 19.438 15.713 22.207 1.00 0.00 H new ATOM 0 HB3 PRO A 26 19.889 15.074 20.639 1.00 0.00 H new ATOM 0 HG2 PRO A 26 21.716 16.101 22.856 1.00 0.00 H new ATOM 0 HG3 PRO A 26 21.904 14.659 21.878 1.00 0.00 H new ATOM 0 HD2 PRO A 26 23.247 16.969 21.271 1.00 0.00 H new ATOM 0 HD3 PRO A 26 22.730 15.862 20.015 1.00 0.00 H new ATOM 442 N TYR A 27 20.444 19.064 22.426 1.00 0.00 N ATOM 443 CA TYR A 27 20.094 20.079 23.426 1.00 0.00 C ATOM 444 C TYR A 27 19.749 21.436 22.796 1.00 0.00 C ATOM 445 O TYR A 27 18.882 22.144 23.314 1.00 0.00 O ATOM 446 CB TYR A 27 21.255 20.258 24.415 1.00 0.00 C ATOM 447 CG TYR A 27 21.666 19.021 25.195 1.00 0.00 C ATOM 448 CD1 TYR A 27 22.522 18.061 24.624 1.00 0.00 C ATOM 449 CD2 TYR A 27 21.213 18.848 26.515 1.00 0.00 C ATOM 450 CE1 TYR A 27 22.914 16.927 25.363 1.00 0.00 C ATOM 451 CE2 TYR A 27 21.617 17.723 27.261 1.00 0.00 C ATOM 452 CZ TYR A 27 22.476 16.762 26.691 1.00 0.00 C ATOM 453 OH TYR A 27 22.875 15.683 27.416 1.00 0.00 O ATOM 0 H TYR A 27 21.446 19.015 22.243 1.00 0.00 H new ATOM 0 HA TYR A 27 19.204 19.722 23.944 1.00 0.00 H new ATOM 0 HB2 TYR A 27 22.123 20.620 23.863 1.00 0.00 H new ATOM 0 HB3 TYR A 27 20.982 21.037 25.127 1.00 0.00 H new ATOM 0 HD1 TYR A 27 22.880 18.194 23.614 1.00 0.00 H new ATOM 0 HD2 TYR A 27 20.554 19.580 26.958 1.00 0.00 H new ATOM 0 HE1 TYR A 27 23.552 16.183 24.910 1.00 0.00 H new ATOM 0 HE2 TYR A 27 21.267 17.596 28.275 1.00 0.00 H new ATOM 0 HH TYR A 27 22.481 15.727 28.312 1.00 0.00 H new ATOM 463 N GLY A 28 20.412 21.796 21.690 1.00 0.00 N ATOM 464 CA GLY A 28 20.241 23.091 21.039 1.00 0.00 C ATOM 465 C GLY A 28 20.686 23.158 19.575 1.00 0.00 C ATOM 466 O GLY A 28 21.237 22.212 19.007 1.00 0.00 O ATOM 0 H GLY A 28 21.086 21.189 21.222 1.00 0.00 H new ATOM 0 HA2 GLY A 28 19.188 23.369 21.094 1.00 0.00 H new ATOM 0 HA3 GLY A 28 20.798 23.838 21.604 1.00 0.00 H new ATOM 470 N HIS A 29 20.398 24.296 18.940 1.00 0.00 N ATOM 471 CA HIS A 29 20.394 24.444 17.479 1.00 0.00 C ATOM 472 C HIS A 29 21.701 24.974 16.866 1.00 0.00 C ATOM 473 O HIS A 29 21.860 24.799 15.664 1.00 0.00 O ATOM 474 CB HIS A 29 19.151 25.244 17.057 1.00 0.00 C ATOM 475 CG HIS A 29 17.851 24.583 17.448 1.00 0.00 C ATOM 476 ND1 HIS A 29 16.974 25.041 18.434 1.00 0.00 N ATOM 477 CD2 HIS A 29 17.341 23.441 16.906 1.00 0.00 C ATOM 478 CE1 HIS A 29 15.952 24.168 18.458 1.00 0.00 C ATOM 479 NE2 HIS A 29 16.152 23.192 17.555 1.00 0.00 N ATOM 0 H HIS A 29 20.157 25.156 19.433 1.00 0.00 H new ATOM 0 HA HIS A 29 20.336 23.441 17.057 1.00 0.00 H new ATOM 0 HB2 HIS A 29 19.196 26.235 17.508 1.00 0.00 H new ATOM 0 HB3 HIS A 29 19.168 25.384 15.976 1.00 0.00 H new ATOM 0 HD2 HIS A 29 17.783 22.847 16.120 1.00 0.00 H new ATOM 0 HE1 HIS A 29 15.093 24.240 19.109 1.00 0.00 H new ATOM 0 HE2 HIS A 29 15.530 22.403 17.381 1.00 0.00 H new ATOM 487 N ILE A 30 22.631 25.518 17.674 1.00 0.00 N ATOM 488 CA ILE A 30 24.061 25.817 17.373 1.00 0.00 C ATOM 489 C ILE A 30 24.345 26.759 16.167 1.00 0.00 C ATOM 490 O ILE A 30 23.559 26.856 15.231 1.00 0.00 O ATOM 491 CB ILE A 30 24.873 24.489 17.385 1.00 0.00 C ATOM 492 CG1 ILE A 30 26.224 24.543 18.141 1.00 0.00 C ATOM 493 CG2 ILE A 30 25.024 23.831 16.006 1.00 0.00 C ATOM 494 CD1 ILE A 30 27.442 25.169 17.445 1.00 0.00 C ATOM 0 H ILE A 30 22.393 25.784 18.630 1.00 0.00 H new ATOM 0 HA ILE A 30 24.424 26.456 18.178 1.00 0.00 H new ATOM 0 HB ILE A 30 24.235 23.835 17.979 1.00 0.00 H new ATOM 0 HG12 ILE A 30 26.060 25.088 19.070 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.490 23.522 18.414 1.00 0.00 H new ATOM 0 HG21 ILE A 30 25.602 22.912 16.103 1.00 0.00 H new ATOM 0 HG22 ILE A 30 24.038 23.599 15.604 1.00 0.00 H new ATOM 0 HG23 ILE A 30 25.539 24.514 15.331 1.00 0.00 H new ATOM 0 HD11 ILE A 30 28.304 25.126 18.111 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.662 24.617 16.531 1.00 0.00 H new ATOM 0 HD13 ILE A 30 27.226 26.208 17.198 1.00 0.00 H new ATOM 506 N MET A 31 25.461 27.503 16.184 1.00 0.00 N ATOM 507 CA MET A 31 25.920 28.341 15.059 1.00 0.00 C ATOM 508 C MET A 31 27.427 28.225 14.776 1.00 0.00 C ATOM 509 O MET A 31 27.805 27.682 13.740 1.00 0.00 O ATOM 510 CB MET A 31 25.506 29.819 15.247 1.00 0.00 C ATOM 511 CG MET A 31 24.100 30.103 14.721 1.00 0.00 C ATOM 512 SD MET A 31 24.012 29.987 12.916 1.00 0.00 S ATOM 513 CE MET A 31 22.361 29.281 12.746 1.00 0.00 C ATOM 0 H MET A 31 26.082 27.542 16.992 1.00 0.00 H new ATOM 0 HA MET A 31 25.414 27.947 14.177 1.00 0.00 H new ATOM 0 HB2 MET A 31 25.553 30.075 16.306 1.00 0.00 H new ATOM 0 HB3 MET A 31 26.220 30.462 14.732 1.00 0.00 H new ATOM 0 HG2 MET A 31 23.398 29.396 15.164 1.00 0.00 H new ATOM 0 HG3 MET A 31 23.790 31.100 15.035 1.00 0.00 H new ATOM 0 HE1 MET A 31 22.133 29.139 11.690 1.00 0.00 H new ATOM 0 HE2 MET A 31 22.322 28.320 13.259 1.00 0.00 H new ATOM 0 HE3 MET A 31 21.629 29.957 13.187 1.00 0.00 H new ATOM 523 N GLN A 32 28.293 28.761 15.641 1.00 0.00 N ATOM 524 CA GLN A 32 29.733 28.933 15.369 1.00 0.00 C ATOM 525 C GLN A 32 30.552 28.950 16.673 1.00 0.00 C ATOM 526 O GLN A 32 29.998 29.219 17.738 1.00 0.00 O ATOM 527 CB GLN A 32 29.977 30.207 14.519 1.00 0.00 C ATOM 528 CG GLN A 32 29.466 31.481 15.208 1.00 0.00 C ATOM 529 CD GLN A 32 29.637 32.773 14.424 1.00 0.00 C ATOM 530 OE1 GLN A 32 28.681 33.357 13.926 1.00 0.00 O ATOM 531 NE2 GLN A 32 30.823 33.328 14.370 1.00 0.00 N ATOM 0 H GLN A 32 28.015 29.094 16.564 1.00 0.00 H new ATOM 0 HA GLN A 32 30.076 28.075 14.790 1.00 0.00 H new ATOM 0 HB2 GLN A 32 31.044 30.308 14.320 1.00 0.00 H new ATOM 0 HB3 GLN A 32 29.482 30.096 13.554 1.00 0.00 H new ATOM 0 HG2 GLN A 32 28.407 31.351 15.430 1.00 0.00 H new ATOM 0 HG3 GLN A 32 29.982 31.587 16.163 1.00 0.00 H new ATOM 0 HE21 GLN A 32 31.627 32.853 14.780 1.00 0.00 H new ATOM 0 HE22 GLN A 32 30.942 34.235 13.918 1.00 0.00 H new ATOM 540 N ILE A 33 31.855 28.660 16.613 1.00 0.00 N ATOM 541 CA ILE A 33 32.706 28.485 17.810 1.00 0.00 C ATOM 542 C ILE A 33 33.687 29.638 18.054 1.00 0.00 C ATOM 543 O ILE A 33 34.131 30.289 17.107 1.00 0.00 O ATOM 544 CB ILE A 33 33.444 27.126 17.783 1.00 0.00 C ATOM 545 CG1 ILE A 33 34.578 27.026 16.733 1.00 0.00 C ATOM 546 CG2 ILE A 33 32.416 26.002 17.593 1.00 0.00 C ATOM 547 CD1 ILE A 33 35.553 25.874 17.017 1.00 0.00 C ATOM 0 H ILE A 33 32.358 28.538 15.734 1.00 0.00 H new ATOM 0 HA ILE A 33 32.019 28.496 18.656 1.00 0.00 H new ATOM 0 HB ILE A 33 33.951 27.026 18.743 1.00 0.00 H new ATOM 0 HG12 ILE A 33 34.140 26.890 15.744 1.00 0.00 H new ATOM 0 HG13 ILE A 33 35.130 27.966 16.711 1.00 0.00 H new ATOM 0 HG21 ILE A 33 32.928 25.040 17.573 1.00 0.00 H new ATOM 0 HG22 ILE A 33 31.704 26.017 18.418 1.00 0.00 H new ATOM 0 HG23 ILE A 33 31.885 26.150 16.653 1.00 0.00 H new ATOM 0 HD11 ILE A 33 36.326 25.853 16.248 1.00 0.00 H new ATOM 0 HD12 ILE A 33 36.016 26.021 17.993 1.00 0.00 H new ATOM 0 HD13 ILE A 33 35.011 24.929 17.011 1.00 0.00 H new ATOM 559 N ASN A 34 34.086 29.841 19.315 1.00 0.00 N ATOM 560 CA ASN A 34 35.240 30.655 19.699 1.00 0.00 C ATOM 561 C ASN A 34 35.800 30.235 21.082 1.00 0.00 C ATOM 562 O ASN A 34 35.342 30.710 22.121 1.00 0.00 O ATOM 563 CB ASN A 34 34.817 32.138 19.679 1.00 0.00 C ATOM 564 CG ASN A 34 35.975 33.049 20.022 1.00 0.00 C ATOM 565 OD1 ASN A 34 37.137 32.667 19.945 1.00 0.00 O ATOM 566 ND2 ASN A 34 35.707 34.265 20.421 1.00 0.00 N ATOM 0 H ASN A 34 33.602 29.433 20.115 1.00 0.00 H new ATOM 0 HA ASN A 34 36.050 30.500 18.987 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.431 32.394 18.692 1.00 0.00 H new ATOM 0 HB3 ASN A 34 34.006 32.296 20.390 1.00 0.00 H new ATOM 0 HD21 ASN A 34 36.466 34.899 20.669 1.00 0.00 H new ATOM 0 HD22 ASN A 34 34.739 34.579 20.484 1.00 0.00 H new ATOM 573 N ILE A 35 36.792 29.336 21.122 1.00 0.00 N ATOM 574 CA ILE A 35 37.316 28.747 22.372 1.00 0.00 C ATOM 575 C ILE A 35 38.785 29.138 22.628 1.00 0.00 C ATOM 576 O ILE A 35 39.623 29.118 21.717 1.00 0.00 O ATOM 577 CB ILE A 35 37.047 27.220 22.398 1.00 0.00 C ATOM 578 CG1 ILE A 35 35.520 26.970 22.286 1.00 0.00 C ATOM 579 CG2 ILE A 35 37.599 26.565 23.678 1.00 0.00 C ATOM 580 CD1 ILE A 35 35.066 25.515 22.432 1.00 0.00 C ATOM 0 H ILE A 35 37.260 28.991 20.284 1.00 0.00 H new ATOM 0 HA ILE A 35 36.774 29.171 23.217 1.00 0.00 H new ATOM 0 HB ILE A 35 37.563 26.766 21.552 1.00 0.00 H new ATOM 0 HG12 ILE A 35 35.018 27.565 23.049 1.00 0.00 H new ATOM 0 HG13 ILE A 35 35.181 27.340 21.318 1.00 0.00 H new ATOM 0 HG21 ILE A 35 37.391 25.495 23.658 1.00 0.00 H new ATOM 0 HG22 ILE A 35 38.676 26.724 23.733 1.00 0.00 H new ATOM 0 HG23 ILE A 35 37.122 27.012 24.550 1.00 0.00 H new ATOM 0 HD11 ILE A 35 33.982 25.461 22.336 1.00 0.00 H new ATOM 0 HD12 ILE A 35 35.530 24.909 21.653 1.00 0.00 H new ATOM 0 HD13 ILE A 35 35.363 25.138 23.410 1.00 0.00 H new ATOM 592 N LYS A 36 39.089 29.506 23.883 1.00 0.00 N ATOM 593 CA LYS A 36 40.415 29.911 24.379 1.00 0.00 C ATOM 594 C LYS A 36 40.479 29.813 25.911 1.00 0.00 C ATOM 595 O LYS A 36 39.498 30.148 26.577 1.00 0.00 O ATOM 596 CB LYS A 36 40.689 31.358 23.927 1.00 0.00 C ATOM 597 CG LYS A 36 42.120 31.843 24.226 1.00 0.00 C ATOM 598 CD LYS A 36 42.328 33.310 23.838 1.00 0.00 C ATOM 599 CE LYS A 36 42.138 33.539 22.336 1.00 0.00 C ATOM 600 NZ LYS A 36 42.267 34.966 21.989 1.00 0.00 N ATOM 0 H LYS A 36 38.381 29.530 24.617 1.00 0.00 H new ATOM 0 HA LYS A 36 41.173 29.243 23.971 1.00 0.00 H new ATOM 0 HB2 LYS A 36 40.506 31.435 22.855 1.00 0.00 H new ATOM 0 HB3 LYS A 36 39.980 32.023 24.420 1.00 0.00 H new ATOM 0 HG2 LYS A 36 42.330 31.717 25.288 1.00 0.00 H new ATOM 0 HG3 LYS A 36 42.833 31.221 23.684 1.00 0.00 H new ATOM 0 HD2 LYS A 36 41.626 33.934 24.391 1.00 0.00 H new ATOM 0 HD3 LYS A 36 43.331 33.623 24.128 1.00 0.00 H new ATOM 0 HE2 LYS A 36 42.877 32.960 21.782 1.00 0.00 H new ATOM 0 HE3 LYS A 36 41.156 33.176 22.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 42.133 35.088 20.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 41.546 35.514 22.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 43.213 35.304 22.257 1.00 0.00 H new ATOM 614 N ASN A 37 41.653 29.475 26.454 1.00 0.00 N ATOM 615 CA ASN A 37 41.960 29.379 27.891 1.00 0.00 C ATOM 616 C ASN A 37 41.136 28.274 28.600 1.00 0.00 C ATOM 617 O ASN A 37 40.539 27.417 27.945 1.00 0.00 O ATOM 618 CB ASN A 37 41.823 30.799 28.488 1.00 0.00 C ATOM 619 CG ASN A 37 42.481 31.012 29.833 1.00 0.00 C ATOM 620 OD1 ASN A 37 43.155 30.155 30.385 1.00 0.00 O ATOM 621 ND2 ASN A 37 42.226 32.143 30.431 1.00 0.00 N ATOM 0 H ASN A 37 42.461 29.248 25.874 1.00 0.00 H new ATOM 0 HA ASN A 37 42.984 29.045 28.055 1.00 0.00 H new ATOM 0 HB2 ASN A 37 42.245 31.513 27.781 1.00 0.00 H new ATOM 0 HB3 ASN A 37 40.763 31.033 28.582 1.00 0.00 H new ATOM 0 HD21 ASN A 37 42.590 32.318 31.368 1.00 0.00 H new ATOM 0 HD22 ASN A 37 41.662 32.852 29.962 1.00 0.00 H new ATOM 628 N ALA A 38 41.063 28.281 29.935 1.00 0.00 N ATOM 629 CA ALA A 38 40.216 27.402 30.756 1.00 0.00 C ATOM 630 C ALA A 38 38.697 27.715 30.654 1.00 0.00 C ATOM 631 O ALA A 38 37.926 27.519 31.602 1.00 0.00 O ATOM 632 CB ALA A 38 40.747 27.438 32.193 1.00 0.00 C ATOM 0 H ALA A 38 41.615 28.926 30.500 1.00 0.00 H new ATOM 0 HA ALA A 38 40.284 26.386 30.368 1.00 0.00 H new ATOM 0 HB1 ALA A 38 40.135 26.793 32.823 1.00 0.00 H new ATOM 0 HB2 ALA A 38 41.779 27.087 32.208 1.00 0.00 H new ATOM 0 HB3 ALA A 38 40.706 28.460 32.571 1.00 0.00 H new ATOM 638 N PHE A 39 38.277 28.219 29.494 1.00 0.00 N ATOM 639 CA PHE A 39 36.945 28.693 29.146 1.00 0.00 C ATOM 640 C PHE A 39 36.654 28.381 27.670 1.00 0.00 C ATOM 641 O PHE A 39 37.510 27.887 26.934 1.00 0.00 O ATOM 642 CB PHE A 39 36.856 30.206 29.429 1.00 0.00 C ATOM 643 CG PHE A 39 37.075 30.573 30.885 1.00 0.00 C ATOM 644 CD1 PHE A 39 36.004 30.509 31.796 1.00 0.00 C ATOM 645 CD2 PHE A 39 38.355 30.945 31.340 1.00 0.00 C ATOM 646 CE1 PHE A 39 36.217 30.777 33.161 1.00 0.00 C ATOM 647 CE2 PHE A 39 38.567 31.219 32.702 1.00 0.00 C ATOM 648 CZ PHE A 39 37.502 31.127 33.614 1.00 0.00 C ATOM 0 H PHE A 39 38.919 28.313 28.707 1.00 0.00 H new ATOM 0 HA PHE A 39 36.194 28.184 29.751 1.00 0.00 H new ATOM 0 HB2 PHE A 39 37.596 30.724 28.819 1.00 0.00 H new ATOM 0 HB3 PHE A 39 35.876 30.567 29.117 1.00 0.00 H new ATOM 0 HD1 PHE A 39 35.015 30.253 31.446 1.00 0.00 H new ATOM 0 HD2 PHE A 39 39.175 31.020 30.641 1.00 0.00 H new ATOM 0 HE1 PHE A 39 35.396 30.714 33.859 1.00 0.00 H new ATOM 0 HE2 PHE A 39 39.550 31.501 33.048 1.00 0.00 H new ATOM 0 HZ PHE A 39 37.670 31.325 34.662 1.00 0.00 H new ATOM 658 N GLY A 40 35.431 28.648 27.225 1.00 0.00 N ATOM 659 CA GLY A 40 35.040 28.525 25.828 1.00 0.00 C ATOM 660 C GLY A 40 33.723 29.229 25.546 1.00 0.00 C ATOM 661 O GLY A 40 32.814 29.213 26.378 1.00 0.00 O ATOM 0 H GLY A 40 34.674 28.960 27.834 1.00 0.00 H new ATOM 0 HA2 GLY A 40 35.820 28.946 25.194 1.00 0.00 H new ATOM 0 HA3 GLY A 40 34.952 27.470 25.567 1.00 0.00 H new ATOM 665 N PHE A 41 33.626 29.842 24.369 1.00 0.00 N ATOM 666 CA PHE A 41 32.437 30.547 23.908 1.00 0.00 C ATOM 667 C PHE A 41 31.921 29.866 22.639 1.00 0.00 C ATOM 668 O PHE A 41 32.693 29.407 21.792 1.00 0.00 O ATOM 669 CB PHE A 41 32.739 32.047 23.711 1.00 0.00 C ATOM 670 CG PHE A 41 33.748 32.637 24.691 1.00 0.00 C ATOM 671 CD1 PHE A 41 33.563 32.497 26.081 1.00 0.00 C ATOM 672 CD2 PHE A 41 34.927 33.240 24.209 1.00 0.00 C ATOM 673 CE1 PHE A 41 34.569 32.910 26.974 1.00 0.00 C ATOM 674 CE2 PHE A 41 35.919 33.680 25.104 1.00 0.00 C ATOM 675 CZ PHE A 41 35.746 33.502 26.488 1.00 0.00 C ATOM 0 H PHE A 41 34.391 29.862 23.695 1.00 0.00 H new ATOM 0 HA PHE A 41 31.648 30.496 24.658 1.00 0.00 H new ATOM 0 HB2 PHE A 41 33.110 32.197 22.697 1.00 0.00 H new ATOM 0 HB3 PHE A 41 31.806 32.604 23.795 1.00 0.00 H new ATOM 0 HD1 PHE A 41 32.646 32.071 26.462 1.00 0.00 H new ATOM 0 HD2 PHE A 41 35.070 33.365 23.146 1.00 0.00 H new ATOM 0 HE1 PHE A 41 34.435 32.771 28.037 1.00 0.00 H new ATOM 0 HE2 PHE A 41 36.813 34.154 24.728 1.00 0.00 H new ATOM 0 HZ PHE A 41 36.516 33.820 27.175 1.00 0.00 H new ATOM 685 N ILE A 42 30.603 29.753 22.518 1.00 0.00 N ATOM 686 CA ILE A 42 29.951 29.151 21.356 1.00 0.00 C ATOM 687 C ILE A 42 28.730 30.002 21.039 1.00 0.00 C ATOM 688 O ILE A 42 27.864 30.201 21.890 1.00 0.00 O ATOM 689 CB ILE A 42 29.561 27.672 21.613 1.00 0.00 C ATOM 690 CG1 ILE A 42 30.720 26.810 22.171 1.00 0.00 C ATOM 691 CG2 ILE A 42 29.045 27.059 20.296 1.00 0.00 C ATOM 692 CD1 ILE A 42 30.269 25.441 22.694 1.00 0.00 C ATOM 0 H ILE A 42 29.949 30.079 23.230 1.00 0.00 H new ATOM 0 HA ILE A 42 30.636 29.131 20.508 1.00 0.00 H new ATOM 0 HB ILE A 42 28.787 27.673 22.380 1.00 0.00 H new ATOM 0 HG12 ILE A 42 31.463 26.664 21.387 1.00 0.00 H new ATOM 0 HG13 ILE A 42 31.211 27.354 22.978 1.00 0.00 H new ATOM 0 HG21 ILE A 42 28.767 26.018 20.463 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.174 27.616 19.952 1.00 0.00 H new ATOM 0 HG23 ILE A 42 29.829 27.108 19.540 1.00 0.00 H new ATOM 0 HD11 ILE A 42 31.133 24.892 23.069 1.00 0.00 H new ATOM 0 HD12 ILE A 42 29.549 25.579 23.500 1.00 0.00 H new ATOM 0 HD13 ILE A 42 29.805 24.877 21.885 1.00 0.00 H new ATOM 704 N GLN A 43 28.633 30.508 19.819 1.00 0.00 N ATOM 705 CA GLN A 43 27.407 31.123 19.344 1.00 0.00 C ATOM 706 C GLN A 43 26.435 30.044 18.866 1.00 0.00 C ATOM 707 O GLN A 43 26.812 29.030 18.275 1.00 0.00 O ATOM 708 CB GLN A 43 27.674 32.176 18.270 1.00 0.00 C ATOM 709 CG GLN A 43 28.387 33.437 18.783 1.00 0.00 C ATOM 710 CD GLN A 43 29.897 33.316 18.997 1.00 0.00 C ATOM 711 OE1 GLN A 43 30.554 32.349 18.655 1.00 0.00 O ATOM 712 NE2 GLN A 43 30.519 34.350 19.515 1.00 0.00 N ATOM 0 H GLN A 43 29.393 30.504 19.139 1.00 0.00 H new ATOM 0 HA GLN A 43 26.944 31.654 20.175 1.00 0.00 H new ATOM 0 HB2 GLN A 43 28.277 31.728 17.480 1.00 0.00 H new ATOM 0 HB3 GLN A 43 26.725 32.467 17.820 1.00 0.00 H new ATOM 0 HG2 GLN A 43 28.204 34.246 18.076 1.00 0.00 H new ATOM 0 HG3 GLN A 43 27.929 33.730 19.728 1.00 0.00 H new ATOM 0 HE21 GLN A 43 29.988 35.170 19.808 1.00 0.00 H new ATOM 0 HE22 GLN A 43 31.533 34.333 19.624 1.00 0.00 H new ATOM 721 N PHE A 44 25.158 30.281 19.121 1.00 0.00 N ATOM 722 CA PHE A 44 24.069 29.331 18.931 1.00 0.00 C ATOM 723 C PHE A 44 22.943 29.928 18.091 1.00 0.00 C ATOM 724 O PHE A 44 22.838 31.141 17.938 1.00 0.00 O ATOM 725 CB PHE A 44 23.554 28.883 20.306 1.00 0.00 C ATOM 726 CG PHE A 44 24.111 27.564 20.807 1.00 0.00 C ATOM 727 CD1 PHE A 44 25.454 27.465 21.214 1.00 0.00 C ATOM 728 CD2 PHE A 44 23.273 26.437 20.900 1.00 0.00 C ATOM 729 CE1 PHE A 44 25.953 26.244 21.695 1.00 0.00 C ATOM 730 CE2 PHE A 44 23.772 25.216 21.387 1.00 0.00 C ATOM 731 CZ PHE A 44 25.114 25.122 21.788 1.00 0.00 C ATOM 0 H PHE A 44 24.836 31.179 19.482 1.00 0.00 H new ATOM 0 HA PHE A 44 24.444 28.466 18.383 1.00 0.00 H new ATOM 0 HB2 PHE A 44 23.790 29.659 21.035 1.00 0.00 H new ATOM 0 HB3 PHE A 44 22.468 28.807 20.262 1.00 0.00 H new ATOM 0 HD1 PHE A 44 26.101 28.328 21.156 1.00 0.00 H new ATOM 0 HD2 PHE A 44 22.240 26.511 20.595 1.00 0.00 H new ATOM 0 HE1 PHE A 44 26.988 26.167 21.995 1.00 0.00 H new ATOM 0 HE2 PHE A 44 23.125 24.354 21.452 1.00 0.00 H new ATOM 0 HZ PHE A 44 25.501 24.188 22.168 1.00 0.00 H new ATOM 741 N ASP A 45 22.065 29.061 17.605 1.00 0.00 N ATOM 742 CA ASP A 45 20.715 29.428 17.199 1.00 0.00 C ATOM 743 C ASP A 45 19.759 29.199 18.383 1.00 0.00 C ATOM 744 O ASP A 45 19.880 28.184 19.069 1.00 0.00 O ATOM 745 CB ASP A 45 20.376 28.614 15.947 1.00 0.00 C ATOM 746 CG ASP A 45 18.988 28.864 15.371 1.00 0.00 C ATOM 747 OD1 ASP A 45 18.355 29.901 15.668 1.00 0.00 O ATOM 748 OD2 ASP A 45 18.534 28.029 14.555 1.00 0.00 O ATOM 0 H ASP A 45 22.273 28.070 17.480 1.00 0.00 H new ATOM 0 HA ASP A 45 20.620 30.482 16.938 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.117 28.834 15.178 1.00 0.00 H new ATOM 0 HB3 ASP A 45 20.468 27.554 16.185 1.00 0.00 H new ATOM 753 N ASN A 46 18.834 30.139 18.611 1.00 0.00 N ATOM 754 CA ASN A 46 17.831 30.183 19.689 1.00 0.00 C ATOM 755 C ASN A 46 18.376 30.168 21.156 1.00 0.00 C ATOM 756 O ASN A 46 19.065 29.227 21.561 1.00 0.00 O ATOM 757 CB ASN A 46 16.791 29.089 19.396 1.00 0.00 C ATOM 758 CG ASN A 46 15.697 29.016 20.434 1.00 0.00 C ATOM 759 OD1 ASN A 46 15.859 28.386 21.465 1.00 0.00 O ATOM 760 ND2 ASN A 46 14.572 29.643 20.211 1.00 0.00 N ATOM 0 H ASN A 46 18.759 30.953 18.001 1.00 0.00 H new ATOM 0 HA ASN A 46 17.368 31.169 19.669 1.00 0.00 H new ATOM 0 HB2 ASN A 46 16.344 29.273 18.419 1.00 0.00 H new ATOM 0 HB3 ASN A 46 17.294 28.124 19.339 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.823 29.607 20.902 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.444 30.168 19.346 1.00 0.00 H new ATOM 767 N PRO A 47 18.021 31.152 22.014 1.00 0.00 N ATOM 768 CA PRO A 47 18.550 31.263 23.380 1.00 0.00 C ATOM 769 C PRO A 47 17.960 30.243 24.364 1.00 0.00 C ATOM 770 O PRO A 47 18.634 29.877 25.326 1.00 0.00 O ATOM 771 CB PRO A 47 18.263 32.702 23.823 1.00 0.00 C ATOM 772 CG PRO A 47 17.001 33.054 23.044 1.00 0.00 C ATOM 773 CD PRO A 47 17.180 32.303 21.724 1.00 0.00 C ATOM 0 HA PRO A 47 19.616 31.035 23.380 1.00 0.00 H new ATOM 0 HB2 PRO A 47 18.105 32.769 24.899 1.00 0.00 H new ATOM 0 HB3 PRO A 47 19.088 33.372 23.579 1.00 0.00 H new ATOM 0 HG2 PRO A 47 16.102 32.734 23.570 1.00 0.00 H new ATOM 0 HG3 PRO A 47 16.913 34.129 22.886 1.00 0.00 H new ATOM 0 HD2 PRO A 47 16.217 31.988 21.323 1.00 0.00 H new ATOM 0 HD3 PRO A 47 17.644 32.943 20.973 1.00 0.00 H new ATOM 781 N GLN A 48 16.756 29.709 24.123 1.00 0.00 N ATOM 782 CA GLN A 48 16.241 28.580 24.915 1.00 0.00 C ATOM 783 C GLN A 48 17.117 27.334 24.703 1.00 0.00 C ATOM 784 O GLN A 48 17.453 26.618 25.645 1.00 0.00 O ATOM 785 CB GLN A 48 14.779 28.270 24.570 1.00 0.00 C ATOM 786 CG GLN A 48 13.848 29.471 24.779 1.00 0.00 C ATOM 787 CD GLN A 48 12.401 29.150 24.429 1.00 0.00 C ATOM 788 OE1 GLN A 48 12.052 28.047 24.021 1.00 0.00 O ATOM 789 NE2 GLN A 48 11.511 30.106 24.524 1.00 0.00 N ATOM 0 H GLN A 48 16.123 30.036 23.393 1.00 0.00 H new ATOM 0 HA GLN A 48 16.280 28.866 25.966 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.717 27.945 23.531 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.434 27.438 25.185 1.00 0.00 H new ATOM 0 HG2 GLN A 48 13.905 29.795 25.818 1.00 0.00 H new ATOM 0 HG3 GLN A 48 14.191 30.305 24.166 1.00 0.00 H new ATOM 0 HE21 GLN A 48 11.787 31.028 24.862 1.00 0.00 H new ATOM 0 HE22 GLN A 48 10.542 29.929 24.260 1.00 0.00 H new ATOM 798 N SER A 49 17.569 27.140 23.464 1.00 0.00 N ATOM 799 CA SER A 49 18.521 26.109 23.057 1.00 0.00 C ATOM 800 C SER A 49 19.904 26.307 23.710 1.00 0.00 C ATOM 801 O SER A 49 20.512 25.329 24.146 1.00 0.00 O ATOM 802 CB SER A 49 18.528 26.061 21.518 1.00 0.00 C ATOM 803 OG SER A 49 19.795 26.290 20.942 1.00 0.00 O ATOM 0 H SER A 49 17.268 27.723 22.683 1.00 0.00 H new ATOM 0 HA SER A 49 18.216 25.128 23.421 1.00 0.00 H new ATOM 0 HB2 SER A 49 18.164 25.086 21.194 1.00 0.00 H new ATOM 0 HB3 SER A 49 17.828 26.805 21.138 1.00 0.00 H new ATOM 0 HG SER A 49 19.706 26.916 20.193 1.00 0.00 H new ATOM 809 N VAL A 50 20.353 27.557 23.915 1.00 0.00 N ATOM 810 CA VAL A 50 21.544 27.873 24.734 1.00 0.00 C ATOM 811 C VAL A 50 21.377 27.435 26.185 1.00 0.00 C ATOM 812 O VAL A 50 22.267 26.769 26.721 1.00 0.00 O ATOM 813 CB VAL A 50 21.900 29.375 24.703 1.00 0.00 C ATOM 814 CG1 VAL A 50 22.966 29.757 25.740 1.00 0.00 C ATOM 815 CG2 VAL A 50 22.438 29.765 23.333 1.00 0.00 C ATOM 0 H VAL A 50 19.902 28.381 23.518 1.00 0.00 H new ATOM 0 HA VAL A 50 22.361 27.309 24.283 1.00 0.00 H new ATOM 0 HB VAL A 50 20.976 29.904 24.934 1.00 0.00 H new ATOM 0 HG11 VAL A 50 23.175 30.825 25.671 1.00 0.00 H new ATOM 0 HG12 VAL A 50 22.601 29.523 26.740 1.00 0.00 H new ATOM 0 HG13 VAL A 50 23.880 29.195 25.546 1.00 0.00 H new ATOM 0 HG21 VAL A 50 22.684 30.827 23.328 1.00 0.00 H new ATOM 0 HG22 VAL A 50 23.334 29.184 23.115 1.00 0.00 H new ATOM 0 HG23 VAL A 50 21.682 29.564 22.574 1.00 0.00 H new ATOM 825 N ARG A 51 20.272 27.806 26.850 1.00 0.00 N ATOM 826 CA ARG A 51 20.108 27.442 28.265 1.00 0.00 C ATOM 827 C ARG A 51 19.894 25.951 28.472 1.00 0.00 C ATOM 828 O ARG A 51 20.441 25.404 29.417 1.00 0.00 O ATOM 829 CB ARG A 51 19.145 28.346 29.043 1.00 0.00 C ATOM 830 CG ARG A 51 17.738 28.593 28.493 1.00 0.00 C ATOM 831 CD ARG A 51 16.698 27.476 28.668 1.00 0.00 C ATOM 832 NE ARG A 51 15.348 27.973 28.324 1.00 0.00 N ATOM 833 CZ ARG A 51 14.285 27.262 27.990 1.00 0.00 C ATOM 834 NH1 ARG A 51 14.299 25.968 27.886 1.00 0.00 N ATOM 835 NH2 ARG A 51 13.163 27.851 27.719 1.00 0.00 N ATOM 0 H ARG A 51 19.502 28.340 26.447 1.00 0.00 H new ATOM 0 HA ARG A 51 21.070 27.652 28.732 1.00 0.00 H new ATOM 0 HB2 ARG A 51 19.036 27.925 30.043 1.00 0.00 H new ATOM 0 HB3 ARG A 51 19.627 29.317 29.157 1.00 0.00 H new ATOM 0 HG2 ARG A 51 17.346 29.494 28.966 1.00 0.00 H new ATOM 0 HG3 ARG A 51 17.827 28.805 27.428 1.00 0.00 H new ATOM 0 HD2 ARG A 51 16.954 26.629 28.032 1.00 0.00 H new ATOM 0 HD3 ARG A 51 16.709 27.117 29.697 1.00 0.00 H new ATOM 0 HE ARG A 51 15.222 28.985 28.347 1.00 0.00 H new ATOM 0 HH11 ARG A 51 15.160 25.451 28.066 1.00 0.00 H new ATOM 0 HH12 ARG A 51 13.449 25.468 27.625 1.00 0.00 H new ATOM 0 HH21 ARG A 51 13.097 28.868 27.763 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.346 27.298 27.462 1.00 0.00 H new ATOM 849 N ASP A 52 19.221 25.256 27.563 1.00 0.00 N ATOM 850 CA ASP A 52 19.112 23.795 27.650 1.00 0.00 C ATOM 851 C ASP A 52 20.448 23.086 27.407 1.00 0.00 C ATOM 852 O ASP A 52 20.720 22.071 28.049 1.00 0.00 O ATOM 853 CB ASP A 52 18.064 23.296 26.664 1.00 0.00 C ATOM 854 CG ASP A 52 16.664 23.802 26.989 1.00 0.00 C ATOM 855 OD1 ASP A 52 16.353 24.112 28.167 1.00 0.00 O ATOM 856 OD2 ASP A 52 15.851 23.855 26.037 1.00 0.00 O ATOM 0 H ASP A 52 18.745 25.671 26.762 1.00 0.00 H new ATOM 0 HA ASP A 52 18.808 23.554 28.669 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.337 23.614 25.658 1.00 0.00 H new ATOM 0 HB3 ASP A 52 18.061 22.206 26.664 1.00 0.00 H new ATOM 861 N ALA A 53 21.309 23.640 26.545 1.00 0.00 N ATOM 862 CA ALA A 53 22.666 23.149 26.347 1.00 0.00 C ATOM 863 C ALA A 53 23.469 23.177 27.659 1.00 0.00 C ATOM 864 O ALA A 53 23.744 22.114 28.213 1.00 0.00 O ATOM 865 CB ALA A 53 23.313 23.910 25.181 1.00 0.00 C ATOM 0 H ALA A 53 21.076 24.446 25.965 1.00 0.00 H new ATOM 0 HA ALA A 53 22.651 22.097 26.063 1.00 0.00 H new ATOM 0 HB1 ALA A 53 24.329 23.546 25.028 1.00 0.00 H new ATOM 0 HB2 ALA A 53 22.730 23.750 24.274 1.00 0.00 H new ATOM 0 HB3 ALA A 53 23.340 24.975 25.412 1.00 0.00 H new ATOM 871 N ILE A 54 23.816 24.345 28.217 1.00 0.00 N ATOM 872 CA ILE A 54 24.654 24.368 29.436 1.00 0.00 C ATOM 873 C ILE A 54 23.934 23.926 30.717 1.00 0.00 C ATOM 874 O ILE A 54 24.597 23.352 31.578 1.00 0.00 O ATOM 875 CB ILE A 54 25.463 25.674 29.638 1.00 0.00 C ATOM 876 CG1 ILE A 54 24.806 26.984 29.162 1.00 0.00 C ATOM 877 CG2 ILE A 54 26.830 25.514 28.959 1.00 0.00 C ATOM 878 CD1 ILE A 54 23.488 27.278 29.874 1.00 0.00 C ATOM 0 H ILE A 54 23.543 25.262 27.862 1.00 0.00 H new ATOM 0 HA ILE A 54 25.393 23.592 29.233 1.00 0.00 H new ATOM 0 HB ILE A 54 25.534 25.793 30.719 1.00 0.00 H new ATOM 0 HG12 ILE A 54 25.496 27.812 29.327 1.00 0.00 H new ATOM 0 HG13 ILE A 54 24.629 26.927 28.088 1.00 0.00 H new ATOM 0 HG21 ILE A 54 27.412 26.426 29.093 1.00 0.00 H new ATOM 0 HG22 ILE A 54 27.363 24.675 29.407 1.00 0.00 H new ATOM 0 HG23 ILE A 54 26.688 25.327 27.895 1.00 0.00 H new ATOM 0 HD11 ILE A 54 23.072 28.213 29.498 1.00 0.00 H new ATOM 0 HD12 ILE A 54 22.785 26.466 29.687 1.00 0.00 H new ATOM 0 HD13 ILE A 54 23.665 27.365 30.946 1.00 0.00 H new ATOM 890 N GLU A 55 22.615 24.080 30.860 1.00 0.00 N ATOM 891 CA GLU A 55 21.936 23.673 32.101 1.00 0.00 C ATOM 892 C GLU A 55 21.652 22.168 32.193 1.00 0.00 C ATOM 893 O GLU A 55 21.454 21.656 33.299 1.00 0.00 O ATOM 894 CB GLU A 55 20.651 24.474 32.334 1.00 0.00 C ATOM 895 CG GLU A 55 20.941 25.973 32.503 1.00 0.00 C ATOM 896 CD GLU A 55 19.705 26.756 32.937 1.00 0.00 C ATOM 897 OE1 GLU A 55 18.596 26.567 32.380 1.00 0.00 O ATOM 898 OE2 GLU A 55 19.834 27.606 33.853 1.00 0.00 O ATOM 0 H GLU A 55 22.002 24.476 30.148 1.00 0.00 H new ATOM 0 HA GLU A 55 22.645 23.902 32.896 1.00 0.00 H new ATOM 0 HB2 GLU A 55 19.973 24.327 31.494 1.00 0.00 H new ATOM 0 HB3 GLU A 55 20.144 24.099 33.223 1.00 0.00 H new ATOM 0 HG2 GLU A 55 21.731 26.107 33.242 1.00 0.00 H new ATOM 0 HG3 GLU A 55 21.313 26.377 31.562 1.00 0.00 H new ATOM 905 N CYS A 56 21.656 21.443 31.069 1.00 0.00 N ATOM 906 CA CYS A 56 21.457 19.992 31.048 1.00 0.00 C ATOM 907 C CYS A 56 22.748 19.206 30.741 1.00 0.00 C ATOM 908 O CYS A 56 22.915 18.099 31.258 1.00 0.00 O ATOM 909 CB CYS A 56 20.307 19.683 30.087 1.00 0.00 C ATOM 910 SG CYS A 56 19.657 18.017 30.397 1.00 0.00 S ATOM 0 H CYS A 56 21.798 21.850 30.144 1.00 0.00 H new ATOM 0 HA CYS A 56 21.185 19.649 32.046 1.00 0.00 H new ATOM 0 HB2 CYS A 56 19.513 20.419 30.211 1.00 0.00 H new ATOM 0 HB3 CYS A 56 20.655 19.759 29.057 1.00 0.00 H new ATOM 0 HG CYS A 56 18.681 17.772 29.574 1.00 0.00 H new ATOM 916 N GLU A 57 23.692 19.758 29.968 1.00 0.00 N ATOM 917 CA GLU A 57 25.024 19.161 29.765 1.00 0.00 C ATOM 918 C GLU A 57 26.005 19.540 30.885 1.00 0.00 C ATOM 919 O GLU A 57 26.694 18.661 31.402 1.00 0.00 O ATOM 920 CB GLU A 57 25.575 19.576 28.389 1.00 0.00 C ATOM 921 CG GLU A 57 26.995 19.103 28.044 1.00 0.00 C ATOM 922 CD GLU A 57 27.195 17.591 28.127 1.00 0.00 C ATOM 923 OE1 GLU A 57 26.296 16.811 27.735 1.00 0.00 O ATOM 924 OE2 GLU A 57 28.267 17.164 28.619 1.00 0.00 O ATOM 0 H GLU A 57 23.556 20.634 29.463 1.00 0.00 H new ATOM 0 HA GLU A 57 24.915 18.077 29.797 1.00 0.00 H new ATOM 0 HB2 GLU A 57 24.896 19.201 27.623 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.554 20.664 28.328 1.00 0.00 H new ATOM 0 HG2 GLU A 57 27.240 19.435 27.035 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.700 19.588 28.719 1.00 0.00 H new ATOM 931 N SER A 58 26.088 20.817 31.283 1.00 0.00 N ATOM 932 CA SER A 58 27.073 21.295 32.270 1.00 0.00 C ATOM 933 C SER A 58 26.504 21.265 33.694 1.00 0.00 C ATOM 934 O SER A 58 26.714 20.276 34.399 1.00 0.00 O ATOM 935 CB SER A 58 27.680 22.643 31.858 1.00 0.00 C ATOM 936 OG SER A 58 28.795 22.928 32.670 1.00 0.00 O ATOM 0 H SER A 58 25.474 21.551 30.930 1.00 0.00 H new ATOM 0 HA SER A 58 27.912 20.599 32.283 1.00 0.00 H new ATOM 0 HB2 SER A 58 27.979 22.613 30.810 1.00 0.00 H new ATOM 0 HB3 SER A 58 26.935 23.433 31.955 1.00 0.00 H new ATOM 0 HG SER A 58 29.182 23.788 32.404 1.00 0.00 H new ATOM 942 N GLN A 59 25.751 22.285 34.118 1.00 0.00 N ATOM 943 CA GLN A 59 24.948 22.293 35.350 1.00 0.00 C ATOM 944 C GLN A 59 23.923 23.434 35.302 1.00 0.00 C ATOM 945 O GLN A 59 24.177 24.487 34.722 1.00 0.00 O ATOM 946 CB GLN A 59 25.845 22.436 36.598 1.00 0.00 C ATOM 947 CG GLN A 59 25.116 22.269 37.944 1.00 0.00 C ATOM 948 CD GLN A 59 24.349 20.955 38.049 1.00 0.00 C ATOM 949 OE1 GLN A 59 23.161 20.874 37.749 1.00 0.00 O ATOM 950 NE2 GLN A 59 25.007 19.889 38.433 1.00 0.00 N ATOM 0 H GLN A 59 25.680 23.159 33.597 1.00 0.00 H new ATOM 0 HA GLN A 59 24.422 21.341 35.419 1.00 0.00 H new ATOM 0 HB2 GLN A 59 26.644 21.696 36.540 1.00 0.00 H new ATOM 0 HB3 GLN A 59 26.318 23.418 36.577 1.00 0.00 H new ATOM 0 HG2 GLN A 59 25.843 22.324 38.754 1.00 0.00 H new ATOM 0 HG3 GLN A 59 24.423 23.099 38.081 1.00 0.00 H new ATOM 0 HE21 GLN A 59 25.994 19.961 38.681 1.00 0.00 H new ATOM 0 HE22 GLN A 59 24.533 18.987 38.484 1.00 0.00 H new ATOM 959 N GLU A 60 22.772 23.254 35.951 1.00 0.00 N ATOM 960 CA GLU A 60 21.683 24.242 35.975 1.00 0.00 C ATOM 961 C GLU A 60 21.913 25.412 36.963 1.00 0.00 C ATOM 962 O GLU A 60 21.088 26.323 37.077 1.00 0.00 O ATOM 963 CB GLU A 60 20.365 23.479 36.171 1.00 0.00 C ATOM 964 CG GLU A 60 19.106 24.316 35.942 1.00 0.00 C ATOM 965 CD GLU A 60 17.874 23.423 35.898 1.00 0.00 C ATOM 966 OE1 GLU A 60 17.340 23.099 36.986 1.00 0.00 O ATOM 967 OE2 GLU A 60 17.426 23.076 34.778 1.00 0.00 O ATOM 0 H GLU A 60 22.563 22.409 36.483 1.00 0.00 H new ATOM 0 HA GLU A 60 21.644 24.768 35.021 1.00 0.00 H new ATOM 0 HB2 GLU A 60 20.348 22.628 35.491 1.00 0.00 H new ATOM 0 HB3 GLU A 60 20.340 23.078 37.184 1.00 0.00 H new ATOM 0 HG2 GLU A 60 19.001 25.052 36.739 1.00 0.00 H new ATOM 0 HG3 GLU A 60 19.195 24.870 35.007 1.00 0.00 H new ATOM 974 N MET A 61 23.057 25.442 37.647 1.00 0.00 N ATOM 975 CA MET A 61 23.522 26.569 38.457 1.00 0.00 C ATOM 976 C MET A 61 25.053 26.661 38.423 1.00 0.00 C ATOM 977 O MET A 61 25.747 25.644 38.414 1.00 0.00 O ATOM 978 CB MET A 61 23.008 26.419 39.898 1.00 0.00 C ATOM 979 CG MET A 61 23.172 27.723 40.684 1.00 0.00 C ATOM 980 SD MET A 61 22.699 27.594 42.419 1.00 0.00 S ATOM 981 CE MET A 61 23.038 29.294 42.936 1.00 0.00 C ATOM 0 H MET A 61 23.707 24.656 37.653 1.00 0.00 H new ATOM 0 HA MET A 61 23.125 27.495 38.042 1.00 0.00 H new ATOM 0 HB2 MET A 61 21.957 26.130 39.884 1.00 0.00 H new ATOM 0 HB3 MET A 61 23.552 25.618 40.399 1.00 0.00 H new ATOM 0 HG2 MET A 61 24.212 28.044 40.624 1.00 0.00 H new ATOM 0 HG3 MET A 61 22.571 28.499 40.210 1.00 0.00 H new ATOM 0 HE1 MET A 61 22.802 29.406 43.994 1.00 0.00 H new ATOM 0 HE2 MET A 61 24.092 29.521 42.773 1.00 0.00 H new ATOM 0 HE3 MET A 61 22.425 29.981 42.353 1.00 0.00 H new ATOM 991 N ASN A 62 25.583 27.884 38.436 1.00 0.00 N ATOM 992 CA ASN A 62 27.016 28.171 38.540 1.00 0.00 C ATOM 993 C ASN A 62 27.567 27.993 39.976 1.00 0.00 C ATOM 994 O ASN A 62 26.826 28.104 40.960 1.00 0.00 O ATOM 995 CB ASN A 62 27.264 29.595 38.007 1.00 0.00 C ATOM 996 CG ASN A 62 26.790 30.666 38.973 1.00 0.00 C ATOM 997 OD1 ASN A 62 27.573 31.209 39.738 1.00 0.00 O ATOM 998 ND2 ASN A 62 25.524 31.005 38.980 1.00 0.00 N ATOM 0 H ASN A 62 25.012 28.727 38.373 1.00 0.00 H new ATOM 0 HA ASN A 62 27.561 27.446 37.936 1.00 0.00 H new ATOM 0 HB2 ASN A 62 28.329 29.728 37.816 1.00 0.00 H new ATOM 0 HB3 ASN A 62 26.751 29.717 37.053 1.00 0.00 H new ATOM 0 HD21 ASN A 62 25.192 31.723 39.624 1.00 0.00 H new ATOM 0 HD22 ASN A 62 24.871 30.551 38.341 1.00 0.00 H new ATOM 1005 N PHE A 63 28.878 27.783 40.103 1.00 0.00 N ATOM 1006 CA PHE A 63 29.611 27.752 41.372 1.00 0.00 C ATOM 1007 C PHE A 63 30.992 28.411 41.215 1.00 0.00 C ATOM 1008 O PHE A 63 31.776 28.026 40.338 1.00 0.00 O ATOM 1009 CB PHE A 63 29.705 26.304 41.876 1.00 0.00 C ATOM 1010 CG PHE A 63 30.028 26.176 43.354 1.00 0.00 C ATOM 1011 CD1 PHE A 63 31.319 26.468 43.833 1.00 0.00 C ATOM 1012 CD2 PHE A 63 29.030 25.771 44.261 1.00 0.00 C ATOM 1013 CE1 PHE A 63 31.604 26.371 45.204 1.00 0.00 C ATOM 1014 CE2 PHE A 63 29.316 25.676 45.635 1.00 0.00 C ATOM 1015 CZ PHE A 63 30.604 25.976 46.106 1.00 0.00 C ATOM 0 H PHE A 63 29.482 27.624 39.296 1.00 0.00 H new ATOM 0 HA PHE A 63 29.073 28.331 42.123 1.00 0.00 H new ATOM 0 HB2 PHE A 63 28.759 25.801 41.678 1.00 0.00 H new ATOM 0 HB3 PHE A 63 30.470 25.781 41.302 1.00 0.00 H new ATOM 0 HD1 PHE A 63 32.094 26.768 43.143 1.00 0.00 H new ATOM 0 HD2 PHE A 63 28.040 25.532 43.900 1.00 0.00 H new ATOM 0 HE1 PHE A 63 32.595 26.601 45.566 1.00 0.00 H new ATOM 0 HE2 PHE A 63 28.545 25.372 46.327 1.00 0.00 H new ATOM 0 HZ PHE A 63 30.825 25.903 47.161 1.00 0.00 H new ATOM 1025 N GLY A 64 31.290 29.398 42.067 1.00 0.00 N ATOM 1026 CA GLY A 64 32.496 30.228 41.977 1.00 0.00 C ATOM 1027 C GLY A 64 33.788 29.407 41.959 1.00 0.00 C ATOM 1028 O GLY A 64 33.932 28.442 42.714 1.00 0.00 O ATOM 0 H GLY A 64 30.689 29.647 42.853 1.00 0.00 H new ATOM 0 HA2 GLY A 64 32.446 30.835 41.073 1.00 0.00 H new ATOM 0 HA3 GLY A 64 32.521 30.916 42.822 1.00 0.00 H new ATOM 1032 N LYS A 65 34.710 29.748 41.049 1.00 0.00 N ATOM 1033 CA LYS A 65 35.986 29.037 40.804 1.00 0.00 C ATOM 1034 C LYS A 65 35.868 27.503 40.703 1.00 0.00 C ATOM 1035 O LYS A 65 36.805 26.785 41.067 1.00 0.00 O ATOM 1036 CB LYS A 65 37.040 29.469 41.842 1.00 0.00 C ATOM 1037 CG LYS A 65 37.284 30.984 41.851 1.00 0.00 C ATOM 1038 CD LYS A 65 38.466 31.364 42.748 1.00 0.00 C ATOM 1039 CE LYS A 65 38.146 31.137 44.228 1.00 0.00 C ATOM 1040 NZ LYS A 65 39.358 31.287 45.059 1.00 0.00 N ATOM 0 H LYS A 65 34.590 30.555 40.437 1.00 0.00 H new ATOM 0 HA LYS A 65 36.313 29.339 39.809 1.00 0.00 H new ATOM 0 HB2 LYS A 65 36.717 29.152 42.834 1.00 0.00 H new ATOM 0 HB3 LYS A 65 37.979 28.956 41.634 1.00 0.00 H new ATOM 0 HG2 LYS A 65 37.474 31.328 40.834 1.00 0.00 H new ATOM 0 HG3 LYS A 65 36.386 31.495 42.198 1.00 0.00 H new ATOM 0 HD2 LYS A 65 39.339 30.774 42.469 1.00 0.00 H new ATOM 0 HD3 LYS A 65 38.724 32.411 42.587 1.00 0.00 H new ATOM 0 HE2 LYS A 65 37.387 31.849 44.553 1.00 0.00 H new ATOM 0 HE3 LYS A 65 37.728 30.140 44.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 39.116 31.129 46.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 40.071 30.591 44.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 39.741 32.247 44.944 1.00 0.00 H new ATOM 1054 N LYS A 66 34.719 26.969 40.266 1.00 0.00 N ATOM 1055 CA LYS A 66 34.469 25.515 40.204 1.00 0.00 C ATOM 1056 C LYS A 66 33.705 25.086 38.953 1.00 0.00 C ATOM 1057 O LYS A 66 34.137 24.156 38.274 1.00 0.00 O ATOM 1058 CB LYS A 66 33.753 25.074 41.492 1.00 0.00 C ATOM 1059 CG LYS A 66 33.940 23.572 41.740 1.00 0.00 C ATOM 1060 CD LYS A 66 33.172 23.063 42.967 1.00 0.00 C ATOM 1061 CE LYS A 66 31.667 23.032 42.701 1.00 0.00 C ATOM 1062 NZ LYS A 66 30.952 22.166 43.662 1.00 0.00 N ATOM 0 H LYS A 66 33.932 27.532 39.944 1.00 0.00 H new ATOM 0 HA LYS A 66 35.432 25.010 40.131 1.00 0.00 H new ATOM 0 HB2 LYS A 66 34.143 25.637 42.340 1.00 0.00 H new ATOM 0 HB3 LYS A 66 32.690 25.304 41.418 1.00 0.00 H new ATOM 0 HG2 LYS A 66 33.611 23.021 40.859 1.00 0.00 H new ATOM 0 HG3 LYS A 66 35.001 23.361 41.870 1.00 0.00 H new ATOM 0 HD2 LYS A 66 33.519 22.063 43.228 1.00 0.00 H new ATOM 0 HD3 LYS A 66 33.380 23.706 43.822 1.00 0.00 H new ATOM 0 HE2 LYS A 66 31.268 24.045 42.759 1.00 0.00 H new ATOM 0 HE3 LYS A 66 31.485 22.675 41.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 29.935 22.174 43.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 31.314 21.194 43.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 31.103 22.521 44.628 1.00 0.00 H new ATOM 1076 N LEU A 67 32.612 25.771 38.613 1.00 0.00 N ATOM 1077 CA LEU A 67 31.902 25.582 37.346 1.00 0.00 C ATOM 1078 C LEU A 67 31.147 26.859 36.959 1.00 0.00 C ATOM 1079 O LEU A 67 30.258 27.310 37.679 1.00 0.00 O ATOM 1080 CB LEU A 67 30.947 24.378 37.460 1.00 0.00 C ATOM 1081 CG LEU A 67 30.327 23.967 36.111 1.00 0.00 C ATOM 1082 CD1 LEU A 67 31.379 23.429 35.137 1.00 0.00 C ATOM 1083 CD2 LEU A 67 29.288 22.877 36.343 1.00 0.00 C ATOM 0 H LEU A 67 32.191 26.479 39.214 1.00 0.00 H new ATOM 0 HA LEU A 67 32.624 25.374 36.556 1.00 0.00 H new ATOM 0 HB2 LEU A 67 31.490 23.530 37.877 1.00 0.00 H new ATOM 0 HB3 LEU A 67 30.148 24.621 38.161 1.00 0.00 H new ATOM 0 HG LEU A 67 29.874 24.857 35.675 1.00 0.00 H new ATOM 0 HD11 LEU A 67 30.898 23.151 34.199 1.00 0.00 H new ATOM 0 HD12 LEU A 67 32.127 24.199 34.947 1.00 0.00 H new ATOM 0 HD13 LEU A 67 31.862 22.553 35.570 1.00 0.00 H new ATOM 0 HD21 LEU A 67 28.848 22.585 35.389 1.00 0.00 H new ATOM 0 HD22 LEU A 67 29.765 22.012 36.803 1.00 0.00 H new ATOM 0 HD23 LEU A 67 28.506 23.254 37.003 1.00 0.00 H new ATOM 1095 N ILE A 68 31.493 27.440 35.811 1.00 0.00 N ATOM 1096 CA ILE A 68 30.943 28.717 35.345 1.00 0.00 C ATOM 1097 C ILE A 68 30.242 28.495 34.001 1.00 0.00 C ATOM 1098 O ILE A 68 30.765 27.807 33.125 1.00 0.00 O ATOM 1099 CB ILE A 68 32.032 29.822 35.299 1.00 0.00 C ATOM 1100 CG1 ILE A 68 32.710 30.069 36.674 1.00 0.00 C ATOM 1101 CG2 ILE A 68 31.414 31.155 34.837 1.00 0.00 C ATOM 1102 CD1 ILE A 68 33.940 29.192 36.958 1.00 0.00 C ATOM 0 H ILE A 68 32.172 27.033 35.168 1.00 0.00 H new ATOM 0 HA ILE A 68 30.199 29.082 36.053 1.00 0.00 H new ATOM 0 HB ILE A 68 32.789 29.467 34.600 1.00 0.00 H new ATOM 0 HG12 ILE A 68 33.007 31.116 36.733 1.00 0.00 H new ATOM 0 HG13 ILE A 68 31.974 29.902 37.460 1.00 0.00 H new ATOM 0 HG21 ILE A 68 32.186 31.924 34.808 1.00 0.00 H new ATOM 0 HG22 ILE A 68 30.987 31.032 33.842 1.00 0.00 H new ATOM 0 HG23 ILE A 68 30.631 31.454 35.534 1.00 0.00 H new ATOM 0 HD11 ILE A 68 34.343 29.438 37.940 1.00 0.00 H new ATOM 0 HD12 ILE A 68 33.650 28.141 36.937 1.00 0.00 H new ATOM 0 HD13 ILE A 68 34.700 29.374 36.198 1.00 0.00 H new ATOM 1114 N LEU A 69 29.062 29.088 33.832 1.00 0.00 N ATOM 1115 CA LEU A 69 28.329 29.141 32.568 1.00 0.00 C ATOM 1116 C LEU A 69 27.569 30.465 32.440 1.00 0.00 C ATOM 1117 O LEU A 69 27.380 31.176 33.434 1.00 0.00 O ATOM 1118 CB LEU A 69 27.441 27.886 32.375 1.00 0.00 C ATOM 1119 CG LEU A 69 26.165 27.661 33.223 1.00 0.00 C ATOM 1120 CD1 LEU A 69 26.417 27.631 34.729 1.00 0.00 C ATOM 1121 CD2 LEU A 69 25.046 28.667 32.943 1.00 0.00 C ATOM 0 H LEU A 69 28.574 29.559 34.594 1.00 0.00 H new ATOM 0 HA LEU A 69 29.042 29.118 31.744 1.00 0.00 H new ATOM 0 HB2 LEU A 69 27.133 27.873 31.329 1.00 0.00 H new ATOM 0 HB3 LEU A 69 28.081 27.018 32.529 1.00 0.00 H new ATOM 0 HG LEU A 69 25.839 26.672 32.900 1.00 0.00 H new ATOM 0 HD11 LEU A 69 25.475 27.469 35.252 1.00 0.00 H new ATOM 0 HD12 LEU A 69 27.107 26.822 34.966 1.00 0.00 H new ATOM 0 HD13 LEU A 69 26.849 28.581 35.045 1.00 0.00 H new ATOM 0 HD21 LEU A 69 24.188 28.442 33.576 1.00 0.00 H new ATOM 0 HD22 LEU A 69 25.401 29.675 33.158 1.00 0.00 H new ATOM 0 HD23 LEU A 69 24.751 28.601 31.896 1.00 0.00 H new ATOM 1133 N GLU A 70 27.130 30.803 31.230 1.00 0.00 N ATOM 1134 CA GLU A 70 26.188 31.903 30.996 1.00 0.00 C ATOM 1135 C GLU A 70 25.344 31.674 29.733 1.00 0.00 C ATOM 1136 O GLU A 70 25.865 31.233 28.705 1.00 0.00 O ATOM 1137 CB GLU A 70 26.942 33.244 30.915 1.00 0.00 C ATOM 1138 CG GLU A 70 26.013 34.444 31.068 1.00 0.00 C ATOM 1139 CD GLU A 70 26.816 35.732 31.216 1.00 0.00 C ATOM 1140 OE1 GLU A 70 27.140 36.381 30.195 1.00 0.00 O ATOM 1141 OE2 GLU A 70 27.067 36.163 32.363 1.00 0.00 O ATOM 0 H GLU A 70 27.417 30.321 30.378 1.00 0.00 H new ATOM 0 HA GLU A 70 25.500 31.937 31.841 1.00 0.00 H new ATOM 0 HB2 GLU A 70 27.704 33.277 31.693 1.00 0.00 H new ATOM 0 HB3 GLU A 70 27.460 33.309 29.958 1.00 0.00 H new ATOM 0 HG2 GLU A 70 25.358 34.516 30.200 1.00 0.00 H new ATOM 0 HG3 GLU A 70 25.373 34.306 31.940 1.00 0.00 H new ATOM 1148 N VAL A 71 24.056 32.024 29.811 1.00 0.00 N ATOM 1149 CA VAL A 71 23.166 32.223 28.654 1.00 0.00 C ATOM 1150 C VAL A 71 23.167 33.698 28.243 1.00 0.00 C ATOM 1151 O VAL A 71 23.162 34.597 29.089 1.00 0.00 O ATOM 1152 CB VAL A 71 21.743 31.675 28.919 1.00 0.00 C ATOM 1153 CG1 VAL A 71 21.107 32.193 30.216 1.00 0.00 C ATOM 1154 CG2 VAL A 71 20.770 31.974 27.769 1.00 0.00 C ATOM 0 H VAL A 71 23.588 32.182 30.703 1.00 0.00 H new ATOM 0 HA VAL A 71 23.550 31.644 27.814 1.00 0.00 H new ATOM 0 HB VAL A 71 21.899 30.600 29.010 1.00 0.00 H new ATOM 0 HG11 VAL A 71 20.112 31.764 30.330 1.00 0.00 H new ATOM 0 HG12 VAL A 71 21.726 31.904 31.065 1.00 0.00 H new ATOM 0 HG13 VAL A 71 21.031 33.280 30.175 1.00 0.00 H new ATOM 0 HG21 VAL A 71 19.788 31.567 28.008 1.00 0.00 H new ATOM 0 HG22 VAL A 71 20.692 33.052 27.629 1.00 0.00 H new ATOM 0 HG23 VAL A 71 21.139 31.515 26.852 1.00 0.00 H new ATOM 1164 N SER A 72 23.214 33.976 26.942 1.00 0.00 N ATOM 1165 CA SER A 72 23.188 35.335 26.396 1.00 0.00 C ATOM 1166 C SER A 72 22.497 35.391 25.033 1.00 0.00 C ATOM 1167 O SER A 72 22.723 34.548 24.171 1.00 0.00 O ATOM 1168 CB SER A 72 24.618 35.869 26.285 1.00 0.00 C ATOM 1169 OG SER A 72 25.070 36.281 27.560 1.00 0.00 O ATOM 0 H SER A 72 23.272 33.253 26.225 1.00 0.00 H new ATOM 0 HA SER A 72 22.611 35.960 27.078 1.00 0.00 H new ATOM 0 HB2 SER A 72 25.276 35.096 25.887 1.00 0.00 H new ATOM 0 HB3 SER A 72 24.651 36.706 25.588 1.00 0.00 H new ATOM 0 HG SER A 72 24.489 35.901 28.252 1.00 0.00 H new ATOM 1175 N SER A 73 21.691 36.427 24.819 1.00 0.00 N ATOM 1176 CA SER A 73 21.042 36.746 23.545 1.00 0.00 C ATOM 1177 C SER A 73 21.549 38.080 22.979 1.00 0.00 C ATOM 1178 O SER A 73 22.376 38.765 23.586 1.00 0.00 O ATOM 1179 CB SER A 73 19.522 36.743 23.732 1.00 0.00 C ATOM 1180 OG SER A 73 18.894 36.753 22.463 1.00 0.00 O ATOM 0 H SER A 73 21.461 37.095 25.555 1.00 0.00 H new ATOM 0 HA SER A 73 21.300 35.982 22.812 1.00 0.00 H new ATOM 0 HB2 SER A 73 19.215 35.862 24.295 1.00 0.00 H new ATOM 0 HB3 SER A 73 19.214 37.614 24.310 1.00 0.00 H new ATOM 0 HG SER A 73 17.921 36.749 22.580 1.00 0.00 H new ATOM 1186 N SER A 74 21.068 38.453 21.797 1.00 0.00 N ATOM 1187 CA SER A 74 21.340 39.727 21.124 1.00 0.00 C ATOM 1188 C SER A 74 20.152 40.122 20.242 1.00 0.00 C ATOM 1189 O SER A 74 19.331 39.270 19.893 1.00 0.00 O ATOM 1190 CB SER A 74 22.636 39.642 20.304 1.00 0.00 C ATOM 1191 OG SER A 74 22.657 38.513 19.443 1.00 0.00 O ATOM 0 H SER A 74 20.449 37.851 21.254 1.00 0.00 H new ATOM 0 HA SER A 74 21.476 40.501 21.880 1.00 0.00 H new ATOM 0 HB2 SER A 74 22.748 40.550 19.711 1.00 0.00 H new ATOM 0 HB3 SER A 74 23.489 39.596 20.981 1.00 0.00 H new ATOM 0 HG SER A 74 23.498 38.500 18.940 1.00 0.00 H new ATOM 1197 N ASN A 75 20.056 41.398 19.870 1.00 0.00 N ATOM 1198 CA ASN A 75 19.032 41.864 18.936 1.00 0.00 C ATOM 1199 C ASN A 75 19.257 41.290 17.524 1.00 0.00 C ATOM 1200 O ASN A 75 20.394 41.231 17.045 1.00 0.00 O ATOM 1201 CB ASN A 75 19.015 43.403 18.949 1.00 0.00 C ATOM 1202 CG ASN A 75 18.451 43.989 20.234 1.00 0.00 C ATOM 1203 OD1 ASN A 75 17.852 43.308 21.062 1.00 0.00 O ATOM 1204 ND2 ASN A 75 18.557 45.280 20.406 1.00 0.00 N ATOM 0 H ASN A 75 20.680 42.132 20.204 1.00 0.00 H new ATOM 0 HA ASN A 75 18.053 41.502 19.251 1.00 0.00 H new ATOM 0 HB2 ASN A 75 20.031 43.772 18.805 1.00 0.00 H new ATOM 0 HB3 ASN A 75 18.424 43.760 18.105 1.00 0.00 H new ATOM 0 HD21 ASN A 75 18.143 45.721 21.227 1.00 0.00 H new ATOM 0 HD22 ASN A 75 19.054 45.847 19.719 1.00 0.00 H new ATOM 1211 N ALA A 76 18.182 40.895 16.839 1.00 0.00 N ATOM 1212 CA ALA A 76 18.238 40.407 15.461 1.00 0.00 C ATOM 1213 C ALA A 76 18.580 41.537 14.469 1.00 0.00 C ATOM 1214 O ALA A 76 18.326 42.715 14.746 1.00 0.00 O ATOM 1215 CB ALA A 76 16.905 39.727 15.124 1.00 0.00 C ATOM 0 H ALA A 76 17.240 40.905 17.229 1.00 0.00 H new ATOM 0 HA ALA A 76 19.042 39.677 15.368 1.00 0.00 H new ATOM 0 HB1 ALA A 76 16.934 39.358 14.099 1.00 0.00 H new ATOM 0 HB2 ALA A 76 16.740 38.892 15.805 1.00 0.00 H new ATOM 0 HB3 ALA A 76 16.093 40.446 15.228 1.00 0.00 H new ATOM 1221 N ARG A 77 19.129 41.168 13.306 1.00 0.00 N ATOM 1222 CA ARG A 77 19.592 42.070 12.229 1.00 0.00 C ATOM 1223 C ARG A 77 20.602 43.116 12.705 1.00 0.00 C ATOM 1224 O ARG A 77 21.498 42.729 13.491 1.00 0.00 O ATOM 1225 CB ARG A 77 18.376 42.631 11.455 1.00 0.00 C ATOM 1226 CG ARG A 77 17.494 41.544 10.813 1.00 0.00 C ATOM 1227 CD ARG A 77 18.251 40.747 9.745 1.00 0.00 C ATOM 1228 NE ARG A 77 17.413 39.708 9.138 1.00 0.00 N ATOM 1229 CZ ARG A 77 17.696 39.014 8.060 1.00 0.00 C ATOM 1230 NH1 ARG A 77 18.722 39.230 7.300 1.00 0.00 N ATOM 1231 NH2 ARG A 77 16.916 38.053 7.683 1.00 0.00 N ATOM 0 H ARG A 77 19.272 40.185 13.073 1.00 0.00 H new ATOM 0 HA ARG A 77 20.175 41.490 11.513 1.00 0.00 H new ATOM 0 HB2 ARG A 77 17.766 43.225 12.136 1.00 0.00 H new ATOM 0 HB3 ARG A 77 18.732 43.304 10.675 1.00 0.00 H new ATOM 0 HG2 ARG A 77 17.136 40.864 11.586 1.00 0.00 H new ATOM 0 HG3 ARG A 77 16.616 42.008 10.364 1.00 0.00 H new ATOM 0 HD2 ARG A 77 18.605 41.426 8.969 1.00 0.00 H new ATOM 0 HD3 ARG A 77 19.132 40.287 10.193 1.00 0.00 H new ATOM 0 HE ARG A 77 16.525 39.505 9.597 1.00 0.00 H new ATOM 0 HH11 ARG A 77 19.374 39.981 7.525 1.00 0.00 H new ATOM 0 HH12 ARG A 77 18.878 38.649 6.477 1.00 0.00 H new ATOM 0 HH21 ARG A 77 16.079 37.833 8.224 1.00 0.00 H new ATOM 0 HH22 ARG A 77 17.138 37.515 6.845 1.00 0.00 H new TER 1245 ARG A 77