USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 842 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 22 TYR OH : rot 150:sc= -0.303 USER MOD Set 1.2: B 52 GLN : amide:sc= -0.706 K(o=-1,f=-3) USER MOD Set 2.1: A 22 TYR OH : rot 0:sc= -1.51 USER MOD Set 2.2: A 52 GLN : amide:sc= -0.912 K(o=-2.4,f=-1.5) USER MOD Set 3.1: A 13 CYS SG : rot -60:sc= -5 USER MOD Set 3.2: A 27 MET CE :methyl -177:sc= -1.59 (180deg=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -2.12 K(o=-2.1,f=-1) USER MOD Single : A 15 LYS NZ :NH3+ -143:sc= -2.79! (180deg=-4.74!) USER MOD Single : A 19 LYS NZ :NH3+ -165:sc= -0.0327 (180deg=-0.335) USER MOD Single : A 30 MET CE :methyl -157:sc= -3.4! (180deg=-5.6!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -0.806 K(o=-0.81,f=-5.9!) USER MOD Single : A 45 SER OG : rot -67:sc= 0.58 USER MOD Single : A 53 TYR OH : rot 12:sc= -0.0386 USER MOD Single : A 56 ASN : amide:sc= -3.74! C(o=-3.7!,f=-3.9!) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 CYS SG : rot 66:sc= -1.63 USER MOD Single : B 14 GLN : amide:sc= -3.92! K(o=-3.9!,f=-2.8) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ -161:sc= -0.159 (180deg=-0.833) USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 30 MET CE :methyl 180:sc= -3.16! (180deg=-3.16!) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 151:sc= -0.142 (180deg=-0.859) USER MOD Single : B 40 ASN : amide:sc= -3.68! C(o=-3.7!,f=-16!) USER MOD Single : B 45 SER OG : rot -73:sc= -0.395 USER MOD Single : B 53 TYR OH : rot 147:sc= 0.6 USER MOD Single : B 56 ASN : amide:sc= -2.56! C(o=-2.6!,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 106 N PHE A 9 44.321 22.890 17.922 1.00 44.59 N ATOM 107 CA PHE A 9 42.856 23.115 17.873 1.00 42.14 C ATOM 108 C PHE A 9 42.579 24.607 17.710 1.00 41.09 C ATOM 109 O PHE A 9 41.980 25.038 16.745 1.00 40.10 O ATOM 110 CB PHE A 9 42.217 22.600 19.175 1.00 39.48 C ATOM 111 CG PHE A 9 40.790 22.226 18.908 1.00 35.93 C ATOM 112 CD1 PHE A 9 39.795 23.196 19.020 1.00 33.89 C ATOM 113 CD2 PHE A 9 40.465 20.919 18.535 1.00 34.84 C ATOM 114 CE1 PHE A 9 38.471 22.860 18.760 1.00 31.72 C ATOM 115 CE2 PHE A 9 39.137 20.586 18.272 1.00 33.98 C ATOM 116 CZ PHE A 9 38.143 21.561 18.387 1.00 33.09 C ATOM 0 HA PHE A 9 42.428 22.577 17.027 1.00 42.14 H new ATOM 0 HB2 PHE A 9 42.768 21.737 19.548 1.00 39.48 H new ATOM 0 HB3 PHE A 9 42.266 23.368 19.947 1.00 39.48 H new ATOM 0 HD1 PHE A 9 40.052 24.205 19.308 1.00 33.89 H new ATOM 0 HD2 PHE A 9 41.239 20.170 18.451 1.00 34.84 H new ATOM 0 HE1 PHE A 9 37.697 23.608 18.848 1.00 31.72 H new ATOM 0 HE2 PHE A 9 38.878 19.579 17.981 1.00 33.98 H new ATOM 0 HZ PHE A 9 37.114 21.304 18.185 1.00 33.09 H new ATOM 126 N LEU A 10 43.020 25.398 18.642 1.00 40.61 N ATOM 127 CA LEU A 10 42.789 26.861 18.530 1.00 40.95 C ATOM 128 C LEU A 10 43.476 27.357 17.264 1.00 41.08 C ATOM 129 O LEU A 10 43.059 28.318 16.649 1.00 37.24 O ATOM 130 CB LEU A 10 43.372 27.576 19.747 1.00 41.66 C ATOM 131 CG LEU A 10 42.959 26.843 21.023 1.00 43.24 C ATOM 132 CD1 LEU A 10 43.521 27.585 22.221 1.00 42.19 C ATOM 133 CD2 LEU A 10 41.435 26.805 21.140 1.00 41.41 C ATOM 0 H LEU A 10 43.528 25.097 19.474 1.00 40.61 H new ATOM 0 HA LEU A 10 41.720 27.068 18.485 1.00 40.95 H new ATOM 0 HB2 LEU A 10 44.459 27.613 19.673 1.00 41.66 H new ATOM 0 HB3 LEU A 10 43.020 28.607 19.778 1.00 41.66 H new ATOM 0 HG LEU A 10 43.344 25.824 20.989 1.00 43.24 H new ATOM 0 HD11 LEU A 10 43.232 27.070 23.137 1.00 42.19 H new ATOM 0 HD12 LEU A 10 44.608 27.618 22.151 1.00 42.19 H new ATOM 0 HD13 LEU A 10 43.127 28.601 22.237 1.00 42.19 H new ATOM 0 HD21 LEU A 10 41.153 26.280 22.053 1.00 41.41 H new ATOM 0 HD22 LEU A 10 41.047 27.823 21.172 1.00 41.41 H new ATOM 0 HD23 LEU A 10 41.017 26.284 20.278 1.00 41.41 H new ATOM 145 N ASP A 11 44.525 26.697 16.860 1.00 41.30 N ATOM 146 CA ASP A 11 45.228 27.120 15.623 1.00 41.83 C ATOM 147 C ASP A 11 44.283 26.895 14.438 1.00 40.90 C ATOM 148 O ASP A 11 44.045 27.791 13.654 1.00 39.80 O ATOM 149 CB ASP A 11 46.520 26.300 15.454 1.00 44.60 C ATOM 150 CG ASP A 11 47.537 27.066 14.598 1.00 47.53 C ATOM 151 OD1 ASP A 11 47.261 28.202 14.247 1.00 48.56 O ATOM 152 OD2 ASP A 11 48.578 26.500 14.307 1.00 48.01 O ATOM 0 H ASP A 11 44.923 25.886 17.333 1.00 41.30 H new ATOM 0 HA ASP A 11 45.502 28.174 15.677 1.00 41.83 H new ATOM 0 HB2 ASP A 11 46.950 26.083 16.432 1.00 44.60 H new ATOM 0 HB3 ASP A 11 46.291 25.342 14.987 1.00 44.60 H new ATOM 157 N TYR A 12 43.711 25.719 14.310 1.00 39.29 N ATOM 158 CA TYR A 12 42.761 25.496 13.181 1.00 38.27 C ATOM 159 C TYR A 12 41.694 26.573 13.248 1.00 34.82 C ATOM 160 O TYR A 12 41.395 27.231 12.273 1.00 33.76 O ATOM 161 CB TYR A 12 42.044 24.149 13.300 1.00 42.68 C ATOM 162 CG TYR A 12 42.995 22.963 13.270 1.00 45.94 C ATOM 163 CD1 TYR A 12 44.073 22.896 12.367 1.00 47.36 C ATOM 164 CD2 TYR A 12 42.763 21.899 14.147 1.00 48.31 C ATOM 165 CE1 TYR A 12 44.903 21.767 12.357 1.00 48.74 C ATOM 166 CE2 TYR A 12 43.587 20.783 14.135 1.00 49.78 C ATOM 167 CZ TYR A 12 44.659 20.710 13.241 1.00 49.89 C ATOM 168 OH TYR A 12 45.476 19.598 13.231 1.00 52.12 O ATOM 0 H TYR A 12 43.859 24.921 14.927 1.00 39.29 H new ATOM 0 HA TYR A 12 43.328 25.518 12.250 1.00 38.27 H new ATOM 0 HB2 TYR A 12 41.475 24.128 14.230 1.00 42.68 H new ATOM 0 HB3 TYR A 12 41.327 24.053 12.485 1.00 42.68 H new ATOM 0 HD1 TYR A 12 44.260 23.712 11.684 1.00 47.36 H new ATOM 0 HD2 TYR A 12 41.936 21.946 14.839 1.00 48.31 H new ATOM 0 HE1 TYR A 12 45.732 21.713 11.667 1.00 48.74 H new ATOM 0 HE2 TYR A 12 43.400 19.968 14.819 1.00 49.78 H new ATOM 0 HH TYR A 12 45.168 18.960 13.908 1.00 52.12 H new ATOM 178 N CYS A 13 41.116 26.757 14.405 1.00 32.26 N ATOM 179 CA CYS A 13 40.066 27.797 14.553 1.00 30.43 C ATOM 180 C CYS A 13 40.564 29.076 13.895 1.00 30.74 C ATOM 181 O CYS A 13 39.993 29.551 12.942 1.00 28.86 O ATOM 182 CB CYS A 13 39.791 28.044 16.041 1.00 30.34 C ATOM 183 SG CYS A 13 38.878 29.595 16.248 1.00 24.58 S ATOM 0 H CYS A 13 41.328 26.230 15.252 1.00 32.26 H new ATOM 0 HA CYS A 13 39.141 27.471 14.078 1.00 30.43 H new ATOM 0 HB2 CYS A 13 39.217 27.216 16.456 1.00 30.34 H new ATOM 0 HB3 CYS A 13 40.731 28.088 16.591 1.00 30.34 H new ATOM 0 HG CYS A 13 39.582 30.580 15.774 1.00 24.58 H new ATOM 189 N GLN A 14 41.643 29.617 14.387 1.00 32.92 N ATOM 190 CA GLN A 14 42.199 30.863 13.791 1.00 34.93 C ATOM 191 C GLN A 14 42.204 30.752 12.259 1.00 35.74 C ATOM 192 O GLN A 14 41.898 31.697 11.566 1.00 35.15 O ATOM 193 CB GLN A 14 43.626 31.083 14.316 1.00 36.23 C ATOM 194 CG GLN A 14 44.003 32.568 14.231 1.00 40.72 C ATOM 195 CD GLN A 14 44.328 32.938 12.786 1.00 42.88 C ATOM 196 OE1 GLN A 14 43.958 33.997 12.319 1.00 45.84 O ATOM 197 NE2 GLN A 14 45.008 32.106 12.053 1.00 44.23 N ATOM 0 H GLN A 14 42.166 29.247 15.181 1.00 32.92 H new ATOM 0 HA GLN A 14 41.579 31.713 14.075 1.00 34.93 H new ATOM 0 HB2 GLN A 14 43.697 30.741 15.349 1.00 36.23 H new ATOM 0 HB3 GLN A 14 44.330 30.488 13.734 1.00 36.23 H new ATOM 0 HG2 GLN A 14 43.181 33.183 14.597 1.00 40.72 H new ATOM 0 HG3 GLN A 14 44.862 32.772 14.870 1.00 40.72 H new ATOM 0 HE21 GLN A 14 45.319 31.217 12.445 1.00 44.23 H new ATOM 0 HE22 GLN A 14 45.231 32.343 11.086 1.00 44.23 H new ATOM 206 N LYS A 15 42.521 29.606 11.719 1.00 35.66 N ATOM 207 CA LYS A 15 42.499 29.469 10.233 1.00 36.27 C ATOM 208 C LYS A 15 41.030 29.490 9.802 1.00 34.97 C ATOM 209 O LYS A 15 40.602 30.342 9.054 1.00 34.84 O ATOM 210 CB LYS A 15 43.148 28.130 9.816 1.00 40.22 C ATOM 211 CG LYS A 15 44.639 28.300 9.519 1.00 44.18 C ATOM 212 CD LYS A 15 45.431 28.500 10.831 1.00 47.52 C ATOM 213 CE LYS A 15 46.196 27.220 11.203 1.00 50.10 C ATOM 214 NZ LYS A 15 45.345 26.024 10.943 1.00 50.42 N ATOM 0 H LYS A 15 42.791 28.768 12.234 1.00 35.66 H new ATOM 0 HA LYS A 15 43.057 30.278 9.761 1.00 36.27 H new ATOM 0 HB2 LYS A 15 43.015 27.397 10.611 1.00 40.22 H new ATOM 0 HB3 LYS A 15 42.642 27.738 8.934 1.00 40.22 H new ATOM 0 HG2 LYS A 15 45.013 27.423 8.991 1.00 44.18 H new ATOM 0 HG3 LYS A 15 44.790 29.156 8.862 1.00 44.18 H new ATOM 0 HD2 LYS A 15 46.131 29.328 10.717 1.00 47.52 H new ATOM 0 HD3 LYS A 15 44.748 28.769 11.637 1.00 47.52 H new ATOM 0 HE2 LYS A 15 47.116 27.155 10.623 1.00 50.10 H new ATOM 0 HE3 LYS A 15 46.483 27.251 12.254 1.00 50.10 H new ATOM 0 HZ1 LYS A 15 45.511 25.312 11.683 1.00 50.42 H new ATOM 0 HZ2 LYS A 15 44.343 26.303 10.949 1.00 50.42 H new ATOM 0 HZ3 LYS A 15 45.586 25.621 10.015 1.00 50.42 H new ATOM 228 N LEU A 16 40.241 28.574 10.299 1.00 31.52 N ATOM 229 CA LEU A 16 38.793 28.569 9.942 1.00 30.64 C ATOM 230 C LEU A 16 38.266 29.987 10.163 1.00 29.20 C ATOM 231 O LEU A 16 37.474 30.512 9.406 1.00 30.83 O ATOM 232 CB LEU A 16 38.065 27.571 10.858 1.00 29.49 C ATOM 233 CG LEU A 16 36.773 27.058 10.197 1.00 29.11 C ATOM 234 CD1 LEU A 16 37.099 26.254 8.923 1.00 29.81 C ATOM 235 CD2 LEU A 16 36.019 26.164 11.202 1.00 25.98 C ATOM 0 H LEU A 16 40.536 27.832 10.934 1.00 31.52 H new ATOM 0 HA LEU A 16 38.631 28.271 8.906 1.00 30.64 H new ATOM 0 HB2 LEU A 16 38.722 26.731 11.081 1.00 29.49 H new ATOM 0 HB3 LEU A 16 37.827 28.050 11.808 1.00 29.49 H new ATOM 0 HG LEU A 16 36.151 27.908 9.915 1.00 29.11 H new ATOM 0 HD11 LEU A 16 36.173 25.900 8.470 1.00 29.81 H new ATOM 0 HD12 LEU A 16 37.628 26.892 8.216 1.00 29.81 H new ATOM 0 HD13 LEU A 16 37.726 25.401 9.182 1.00 29.81 H new ATOM 0 HD21 LEU A 16 35.101 25.795 10.744 1.00 25.98 H new ATOM 0 HD22 LEU A 16 36.649 25.320 11.483 1.00 25.98 H new ATOM 0 HD23 LEU A 16 35.772 26.744 12.091 1.00 25.98 H new ATOM 247 N LEU A 17 38.755 30.605 11.194 1.00 27.96 N ATOM 248 CA LEU A 17 38.373 32.003 11.513 1.00 28.93 C ATOM 249 C LEU A 17 38.858 32.906 10.371 1.00 30.06 C ATOM 250 O LEU A 17 38.175 33.817 9.947 1.00 30.41 O ATOM 251 CB LEU A 17 39.078 32.402 12.821 1.00 24.89 C ATOM 252 CG LEU A 17 38.343 33.568 13.517 1.00 25.03 C ATOM 253 CD1 LEU A 17 37.236 33.024 14.445 1.00 21.31 C ATOM 254 CD2 LEU A 17 39.340 34.390 14.357 1.00 20.22 C ATOM 0 H LEU A 17 39.420 30.189 11.846 1.00 27.96 H new ATOM 0 HA LEU A 17 37.293 32.102 11.627 1.00 28.93 H new ATOM 0 HB2 LEU A 17 39.120 31.543 13.491 1.00 24.89 H new ATOM 0 HB3 LEU A 17 40.107 32.692 12.609 1.00 24.89 H new ATOM 0 HG LEU A 17 37.896 34.201 12.750 1.00 25.03 H new ATOM 0 HD11 LEU A 17 36.726 33.856 14.929 1.00 21.31 H new ATOM 0 HD12 LEU A 17 36.518 32.451 13.858 1.00 21.31 H new ATOM 0 HD13 LEU A 17 37.681 32.380 15.204 1.00 21.31 H new ATOM 0 HD21 LEU A 17 38.814 35.211 14.845 1.00 20.22 H new ATOM 0 HD22 LEU A 17 39.794 33.749 15.113 1.00 20.22 H new ATOM 0 HD23 LEU A 17 40.118 34.792 13.708 1.00 20.22 H new ATOM 266 N GLU A 18 40.044 32.649 9.876 1.00 32.20 N ATOM 267 CA GLU A 18 40.596 33.477 8.766 1.00 35.35 C ATOM 268 C GLU A 18 39.944 33.041 7.447 1.00 35.74 C ATOM 269 O GLU A 18 39.561 33.857 6.633 1.00 35.74 O ATOM 270 CB GLU A 18 42.145 33.316 8.733 1.00 37.07 C ATOM 271 CG GLU A 18 42.616 32.361 7.621 1.00 39.76 C ATOM 272 CD GLU A 18 44.127 32.156 7.739 1.00 41.67 C ATOM 273 OE1 GLU A 18 44.713 32.729 8.643 1.00 43.93 O ATOM 274 OE2 GLU A 18 44.672 31.429 6.926 1.00 43.25 O ATOM 0 H GLU A 18 40.654 31.897 10.197 1.00 32.20 H new ATOM 0 HA GLU A 18 40.373 34.533 8.918 1.00 35.35 H new ATOM 0 HB2 GLU A 18 42.605 34.293 8.587 1.00 37.07 H new ATOM 0 HB3 GLU A 18 42.489 32.943 9.698 1.00 37.07 H new ATOM 0 HG2 GLU A 18 42.100 31.405 7.704 1.00 39.76 H new ATOM 0 HG3 GLU A 18 42.368 32.773 6.643 1.00 39.76 H new ATOM 281 N LYS A 19 39.808 31.759 7.237 1.00 37.19 N ATOM 282 CA LYS A 19 39.174 31.274 5.982 1.00 36.85 C ATOM 283 C LYS A 19 37.844 32.003 5.780 1.00 36.69 C ATOM 284 O LYS A 19 37.567 32.539 4.725 1.00 36.88 O ATOM 285 CB LYS A 19 38.939 29.773 6.082 1.00 36.86 C ATOM 286 CG LYS A 19 38.869 29.185 4.672 1.00 40.15 C ATOM 287 CD LYS A 19 38.315 27.785 4.765 1.00 41.50 C ATOM 288 CE LYS A 19 38.369 27.107 3.396 1.00 44.93 C ATOM 289 NZ LYS A 19 37.537 27.874 2.427 1.00 44.88 N ATOM 0 H LYS A 19 40.109 31.028 7.882 1.00 37.19 H new ATOM 0 HA LYS A 19 39.827 31.474 5.132 1.00 36.85 H new ATOM 0 HB2 LYS A 19 39.744 29.303 6.646 1.00 36.86 H new ATOM 0 HB3 LYS A 19 38.013 29.572 6.620 1.00 36.86 H new ATOM 0 HG2 LYS A 19 38.235 29.802 4.035 1.00 40.15 H new ATOM 0 HG3 LYS A 19 39.860 29.171 4.218 1.00 40.15 H new ATOM 0 HD2 LYS A 19 38.888 27.206 5.489 1.00 41.50 H new ATOM 0 HD3 LYS A 19 37.286 27.816 5.124 1.00 41.50 H new ATOM 0 HE2 LYS A 19 39.400 27.055 3.045 1.00 44.93 H new ATOM 0 HE3 LYS A 19 38.006 26.082 3.472 1.00 44.93 H new ATOM 0 HZ1 LYS A 19 37.364 27.293 1.582 1.00 44.88 H new ATOM 0 HZ2 LYS A 19 36.628 28.121 2.869 1.00 44.88 H new ATOM 0 HZ3 LYS A 19 38.037 28.744 2.153 1.00 44.88 H new ATOM 303 N PHE A 20 37.024 32.028 6.795 1.00 34.99 N ATOM 304 CA PHE A 20 35.712 32.719 6.696 1.00 34.93 C ATOM 305 C PHE A 20 35.867 34.155 7.202 1.00 34.32 C ATOM 306 O PHE A 20 34.930 34.928 7.210 1.00 35.01 O ATOM 307 CB PHE A 20 34.710 31.975 7.571 1.00 34.20 C ATOM 308 CG PHE A 20 34.311 30.685 6.899 1.00 33.79 C ATOM 309 CD1 PHE A 20 35.085 29.536 7.089 1.00 32.30 C ATOM 310 CD2 PHE A 20 33.176 30.640 6.083 1.00 34.75 C ATOM 311 CE1 PHE A 20 34.724 28.339 6.462 1.00 34.86 C ATOM 312 CE2 PHE A 20 32.817 29.444 5.453 1.00 35.66 C ATOM 313 CZ PHE A 20 33.591 28.293 5.643 1.00 35.69 C ATOM 0 H PHE A 20 37.212 31.593 7.698 1.00 34.99 H new ATOM 0 HA PHE A 20 35.365 32.735 5.663 1.00 34.93 H new ATOM 0 HB2 PHE A 20 35.148 31.768 8.547 1.00 34.20 H new ATOM 0 HB3 PHE A 20 33.830 32.595 7.742 1.00 34.20 H new ATOM 0 HD1 PHE A 20 35.961 29.573 7.720 1.00 32.30 H new ATOM 0 HD2 PHE A 20 32.578 31.528 5.940 1.00 34.75 H new ATOM 0 HE1 PHE A 20 35.320 27.451 6.610 1.00 34.86 H new ATOM 0 HE2 PHE A 20 31.943 29.408 4.820 1.00 35.66 H new ATOM 0 HZ PHE A 20 33.313 27.369 5.157 1.00 35.69 H new ATOM 323 N ARG A 21 37.052 34.510 7.622 1.00 34.35 N ATOM 324 CA ARG A 21 37.298 35.892 8.128 1.00 34.08 C ATOM 325 C ARG A 21 36.324 36.221 9.263 1.00 33.06 C ATOM 326 O ARG A 21 35.852 37.336 9.375 1.00 31.60 O ATOM 327 CB ARG A 21 37.108 36.903 6.988 1.00 37.64 C ATOM 328 CG ARG A 21 38.036 36.557 5.805 1.00 41.19 C ATOM 329 CD ARG A 21 39.437 37.165 6.025 1.00 45.12 C ATOM 330 NE ARG A 21 39.497 38.549 5.439 1.00 48.87 N ATOM 331 CZ ARG A 21 39.282 38.772 4.169 1.00 50.17 C ATOM 332 NH1 ARG A 21 39.130 37.776 3.339 1.00 52.38 N ATOM 333 NH2 ARG A 21 39.254 39.997 3.721 1.00 50.69 N ATOM 0 H ARG A 21 37.867 33.897 7.636 1.00 34.35 H new ATOM 0 HA ARG A 21 38.319 35.950 8.504 1.00 34.08 H new ATOM 0 HB2 ARG A 21 36.069 36.898 6.658 1.00 37.64 H new ATOM 0 HB3 ARG A 21 37.324 37.910 7.346 1.00 37.64 H new ATOM 0 HG2 ARG A 21 38.114 35.475 5.700 1.00 41.19 H new ATOM 0 HG3 ARG A 21 37.609 36.937 4.877 1.00 41.19 H new ATOM 0 HD2 ARG A 21 39.662 37.203 7.091 1.00 45.12 H new ATOM 0 HD3 ARG A 21 40.194 36.532 5.561 1.00 45.12 H new ATOM 0 HE ARG A 21 39.712 39.337 6.051 1.00 48.87 H new ATOM 0 HH11 ARG A 21 39.179 36.816 3.680 1.00 52.38 H new ATOM 0 HH12 ARG A 21 38.963 37.958 2.349 1.00 52.38 H new ATOM 0 HH21 ARG A 21 39.400 40.778 4.361 1.00 50.69 H new ATOM 0 HH22 ARG A 21 39.086 40.174 2.731 1.00 50.69 H new ATOM 347 N TYR A 22 36.012 35.274 10.108 1.00 30.22 N ATOM 348 CA TYR A 22 35.069 35.568 11.220 1.00 29.11 C ATOM 349 C TYR A 22 35.781 36.453 12.274 1.00 27.15 C ATOM 350 O TYR A 22 36.981 36.348 12.431 1.00 25.96 O ATOM 351 CB TYR A 22 34.653 34.247 11.884 1.00 27.09 C ATOM 352 CG TYR A 22 33.553 33.554 11.090 1.00 27.40 C ATOM 353 CD1 TYR A 22 32.329 34.198 10.834 1.00 26.95 C ATOM 354 CD2 TYR A 22 33.760 32.253 10.611 1.00 25.13 C ATOM 355 CE1 TYR A 22 31.329 33.543 10.106 1.00 26.07 C ATOM 356 CE2 TYR A 22 32.758 31.601 9.883 1.00 24.89 C ATOM 357 CZ TYR A 22 31.544 32.246 9.631 1.00 24.53 C ATOM 358 OH TYR A 22 30.557 31.603 8.912 1.00 21.93 O ATOM 0 H TYR A 22 36.367 34.318 10.075 1.00 30.22 H new ATOM 0 HA TYR A 22 34.193 36.086 10.831 1.00 29.11 H new ATOM 0 HB2 TYR A 22 35.518 33.589 11.963 1.00 27.09 H new ATOM 0 HB3 TYR A 22 34.306 34.441 12.899 1.00 27.09 H new ATOM 0 HD1 TYR A 22 32.160 35.200 11.200 1.00 26.95 H new ATOM 0 HD2 TYR A 22 34.697 31.752 10.805 1.00 25.13 H new ATOM 0 HE1 TYR A 22 30.390 34.040 9.911 1.00 26.07 H new ATOM 0 HE2 TYR A 22 32.923 30.599 9.516 1.00 24.89 H new ATOM 0 HH TYR A 22 29.778 32.192 8.826 1.00 21.93 H new ATOM 368 N PRO A 23 35.035 37.279 12.993 1.00 25.95 N ATOM 369 CA PRO A 23 35.626 38.132 14.046 1.00 26.49 C ATOM 370 C PRO A 23 36.394 37.262 15.056 1.00 26.35 C ATOM 371 O PRO A 23 36.378 36.055 14.984 1.00 24.48 O ATOM 372 CB PRO A 23 34.419 38.832 14.720 1.00 27.06 C ATOM 373 CG PRO A 23 33.139 38.402 13.948 1.00 29.61 C ATOM 374 CD PRO A 23 33.576 37.439 12.820 1.00 27.83 C ATOM 0 HA PRO A 23 36.338 38.856 13.649 1.00 26.49 H new ATOM 0 HB2 PRO A 23 34.348 38.547 15.770 1.00 27.06 H new ATOM 0 HB3 PRO A 23 34.539 39.915 14.691 1.00 27.06 H new ATOM 0 HG2 PRO A 23 32.434 37.911 14.619 1.00 29.61 H new ATOM 0 HG3 PRO A 23 32.631 39.273 13.533 1.00 29.61 H new ATOM 0 HD2 PRO A 23 33.062 36.481 12.899 1.00 27.83 H new ATOM 0 HD3 PRO A 23 33.338 37.848 11.838 1.00 27.83 H new ATOM 382 N TRP A 24 37.055 37.879 15.996 1.00 23.75 N ATOM 383 CA TRP A 24 37.824 37.109 17.023 1.00 24.21 C ATOM 384 C TRP A 24 36.873 36.591 18.102 1.00 24.68 C ATOM 385 O TRP A 24 37.230 35.756 18.909 1.00 22.18 O ATOM 386 CB TRP A 24 38.867 38.032 17.654 1.00 24.39 C ATOM 387 CG TRP A 24 39.683 37.294 18.674 1.00 26.00 C ATOM 388 CD1 TRP A 24 39.691 37.572 19.999 1.00 27.56 C ATOM 389 CD2 TRP A 24 40.619 36.187 18.485 1.00 24.99 C ATOM 390 NE1 TRP A 24 40.573 36.714 20.632 1.00 24.44 N ATOM 391 CE2 TRP A 24 41.170 35.844 19.744 1.00 27.17 C ATOM 392 CE3 TRP A 24 41.044 35.452 17.359 1.00 27.07 C ATOM 393 CZ2 TRP A 24 42.108 34.819 19.879 1.00 26.88 C ATOM 394 CZ3 TRP A 24 41.985 34.420 17.497 1.00 28.86 C ATOM 395 CH2 TRP A 24 42.519 34.107 18.753 1.00 27.85 C ATOM 0 H TRP A 24 37.098 38.893 16.100 1.00 23.75 H new ATOM 0 HA TRP A 24 38.319 36.260 16.552 1.00 24.21 H new ATOM 0 HB2 TRP A 24 39.521 38.433 16.879 1.00 24.39 H new ATOM 0 HB3 TRP A 24 38.371 38.881 18.124 1.00 24.39 H new ATOM 0 HD1 TRP A 24 39.104 38.339 20.483 1.00 27.56 H new ATOM 0 HE1 TRP A 24 40.759 36.724 21.635 1.00 24.44 H new ATOM 0 HE3 TRP A 24 40.643 35.685 16.384 1.00 27.07 H new ATOM 0 HZ2 TRP A 24 42.513 34.579 20.851 1.00 26.88 H new ATOM 0 HZ3 TRP A 24 42.300 33.863 16.627 1.00 28.86 H new ATOM 0 HH2 TRP A 24 43.248 33.316 18.849 1.00 27.85 H new ATOM 406 N GLU A 25 35.672 37.097 18.137 1.00 21.18 N ATOM 407 CA GLU A 25 34.700 36.657 19.179 1.00 25.10 C ATOM 408 C GLU A 25 34.016 35.333 18.781 1.00 23.53 C ATOM 409 O GLU A 25 33.355 34.719 19.593 1.00 22.15 O ATOM 410 CB GLU A 25 33.669 37.773 19.418 1.00 30.80 C ATOM 411 CG GLU A 25 32.664 37.872 18.246 1.00 38.77 C ATOM 412 CD GLU A 25 32.416 39.341 17.874 1.00 43.31 C ATOM 413 OE1 GLU A 25 33.326 39.959 17.346 1.00 45.94 O ATOM 414 OE2 GLU A 25 31.322 39.818 18.125 1.00 46.36 O ATOM 0 H GLU A 25 35.320 37.799 17.487 1.00 21.18 H new ATOM 0 HA GLU A 25 35.236 36.469 20.109 1.00 25.10 H new ATOM 0 HB2 GLU A 25 33.131 37.581 20.346 1.00 30.80 H new ATOM 0 HB3 GLU A 25 34.184 38.726 19.540 1.00 30.80 H new ATOM 0 HG2 GLU A 25 33.050 37.332 17.381 1.00 38.77 H new ATOM 0 HG3 GLU A 25 31.723 37.397 18.525 1.00 38.77 H new ATOM 421 N LEU A 26 34.162 34.878 17.552 1.00 21.26 N ATOM 422 CA LEU A 26 33.512 33.581 17.146 1.00 20.65 C ATOM 423 C LEU A 26 34.484 32.421 17.298 1.00 20.00 C ATOM 424 O LEU A 26 34.271 31.351 16.765 1.00 16.59 O ATOM 425 CB LEU A 26 33.043 33.655 15.697 1.00 23.25 C ATOM 426 CG LEU A 26 32.217 34.926 15.471 1.00 26.24 C ATOM 427 CD1 LEU A 26 31.459 34.800 14.155 1.00 29.07 C ATOM 428 CD2 LEU A 26 31.207 35.122 16.609 1.00 26.56 C ATOM 0 H LEU A 26 34.698 35.343 16.819 1.00 21.26 H new ATOM 0 HA LEU A 26 32.655 33.416 17.799 1.00 20.65 H new ATOM 0 HB2 LEU A 26 33.904 33.648 15.028 1.00 23.25 H new ATOM 0 HB3 LEU A 26 32.445 32.776 15.456 1.00 23.25 H new ATOM 0 HG LEU A 26 32.891 35.782 15.443 1.00 26.24 H new ATOM 0 HD11 LEU A 26 30.869 35.701 13.987 1.00 29.07 H new ATOM 0 HD12 LEU A 26 32.168 34.674 13.337 1.00 29.07 H new ATOM 0 HD13 LEU A 26 30.797 33.935 14.198 1.00 29.07 H new ATOM 0 HD21 LEU A 26 30.630 36.029 16.431 1.00 26.56 H new ATOM 0 HD22 LEU A 26 30.534 34.266 16.649 1.00 26.56 H new ATOM 0 HD23 LEU A 26 31.739 35.210 17.556 1.00 26.56 H new ATOM 440 N MET A 27 35.528 32.598 18.052 1.00 18.56 N ATOM 441 CA MET A 27 36.459 31.472 18.256 1.00 17.95 C ATOM 442 C MET A 27 35.692 30.299 18.917 1.00 17.26 C ATOM 443 O MET A 27 35.891 29.167 18.521 1.00 15.06 O ATOM 444 CB MET A 27 37.645 31.911 19.139 1.00 20.02 C ATOM 445 CG MET A 27 38.762 32.555 18.309 1.00 18.07 C ATOM 446 SD MET A 27 40.304 32.373 19.222 1.00 11.26 S ATOM 447 CE MET A 27 40.749 30.752 18.572 1.00 20.89 C ATOM 0 H MET A 27 35.771 33.466 18.529 1.00 18.56 H new ATOM 0 HA MET A 27 36.858 31.147 17.295 1.00 17.95 H new ATOM 0 HB2 MET A 27 37.296 32.619 19.891 1.00 20.02 H new ATOM 0 HB3 MET A 27 38.040 31.047 19.673 1.00 20.02 H new ATOM 0 HG2 MET A 27 38.837 32.075 17.333 1.00 18.07 H new ATOM 0 HG3 MET A 27 38.546 33.608 18.131 1.00 18.07 H new ATOM 0 HE1 MET A 27 41.666 30.408 19.050 1.00 20.89 H new ATOM 0 HE2 MET A 27 39.946 30.045 18.777 1.00 20.89 H new ATOM 0 HE3 MET A 27 40.905 30.822 17.495 1.00 20.89 H new ATOM 457 N PRO A 28 34.824 30.571 19.893 1.00 16.29 N ATOM 458 CA PRO A 28 34.054 29.492 20.544 1.00 17.09 C ATOM 459 C PRO A 28 33.239 28.741 19.485 1.00 15.81 C ATOM 460 O PRO A 28 33.079 27.548 19.554 1.00 16.73 O ATOM 461 CB PRO A 28 33.151 30.218 21.572 1.00 16.95 C ATOM 462 CG PRO A 28 33.710 31.653 21.705 1.00 18.75 C ATOM 463 CD PRO A 28 34.530 31.921 20.434 1.00 16.75 C ATOM 0 HA PRO A 28 34.678 28.746 21.036 1.00 17.09 H new ATOM 0 HB2 PRO A 28 32.114 30.234 21.235 1.00 16.95 H new ATOM 0 HB3 PRO A 28 33.166 29.704 22.533 1.00 16.95 H new ATOM 0 HG2 PRO A 28 32.901 32.377 21.805 1.00 18.75 H new ATOM 0 HG3 PRO A 28 34.332 31.746 22.595 1.00 18.75 H new ATOM 0 HD2 PRO A 28 33.969 32.522 19.719 1.00 16.75 H new ATOM 0 HD3 PRO A 28 35.446 32.467 20.660 1.00 16.75 H new ATOM 471 N LEU A 29 32.741 29.425 18.493 1.00 15.35 N ATOM 472 CA LEU A 29 31.963 28.720 17.435 1.00 15.54 C ATOM 473 C LEU A 29 32.940 27.970 16.530 1.00 15.13 C ATOM 474 O LEU A 29 32.811 26.780 16.322 1.00 14.57 O ATOM 475 CB LEU A 29 31.151 29.734 16.629 1.00 15.26 C ATOM 476 CG LEU A 29 30.374 30.639 17.594 1.00 13.96 C ATOM 477 CD1 LEU A 29 29.479 31.587 16.791 1.00 15.02 C ATOM 478 CD2 LEU A 29 29.504 29.779 18.528 1.00 15.96 C ATOM 0 H LEU A 29 32.837 30.433 18.369 1.00 15.35 H new ATOM 0 HA LEU A 29 31.270 28.010 17.886 1.00 15.54 H new ATOM 0 HB2 LEU A 29 31.813 30.333 16.003 1.00 15.26 H new ATOM 0 HB3 LEU A 29 30.462 29.217 15.961 1.00 15.26 H new ATOM 0 HG LEU A 29 31.078 31.218 18.192 1.00 13.96 H new ATOM 0 HD11 LEU A 29 28.926 32.231 17.474 1.00 15.02 H new ATOM 0 HD12 LEU A 29 30.096 32.200 16.134 1.00 15.02 H new ATOM 0 HD13 LEU A 29 28.778 31.006 16.193 1.00 15.02 H new ATOM 0 HD21 LEU A 29 28.954 30.426 19.211 1.00 15.96 H new ATOM 0 HD22 LEU A 29 28.800 29.196 17.935 1.00 15.96 H new ATOM 0 HD23 LEU A 29 30.141 29.105 19.100 1.00 15.96 H new ATOM 490 N MET A 30 33.941 28.638 16.018 1.00 15.06 N ATOM 491 CA MET A 30 34.935 27.930 15.168 1.00 12.45 C ATOM 492 C MET A 30 35.462 26.745 15.977 1.00 12.90 C ATOM 493 O MET A 30 35.689 25.667 15.466 1.00 14.81 O ATOM 494 CB MET A 30 36.097 28.881 14.842 1.00 15.01 C ATOM 495 CG MET A 30 35.776 29.703 13.596 1.00 12.65 C ATOM 496 SD MET A 30 34.280 30.692 13.880 1.00 8.44 S ATOM 497 CE MET A 30 33.205 29.921 12.640 1.00 27.75 C ATOM 0 H MET A 30 34.110 29.635 16.152 1.00 15.06 H new ATOM 0 HA MET A 30 34.481 27.595 14.236 1.00 12.45 H new ATOM 0 HB2 MET A 30 36.280 29.545 15.687 1.00 15.01 H new ATOM 0 HB3 MET A 30 37.011 28.308 14.683 1.00 15.01 H new ATOM 0 HG2 MET A 30 36.614 30.356 13.354 1.00 12.65 H new ATOM 0 HG3 MET A 30 35.630 29.043 12.741 1.00 12.65 H new ATOM 0 HE1 MET A 30 32.410 30.615 12.365 1.00 27.75 H new ATOM 0 HE2 MET A 30 33.791 29.672 11.755 1.00 27.75 H new ATOM 0 HE3 MET A 30 32.767 29.012 13.053 1.00 27.75 H new ATOM 507 N TYR A 31 35.651 26.960 17.248 1.00 13.07 N ATOM 508 CA TYR A 31 36.158 25.880 18.132 1.00 15.35 C ATOM 509 C TYR A 31 35.209 24.674 18.077 1.00 16.32 C ATOM 510 O TYR A 31 35.616 23.562 17.805 1.00 15.86 O ATOM 511 CB TYR A 31 36.239 26.410 19.567 1.00 14.82 C ATOM 512 CG TYR A 31 36.589 25.285 20.509 1.00 17.46 C ATOM 513 CD1 TYR A 31 35.581 24.434 20.982 1.00 20.04 C ATOM 514 CD2 TYR A 31 37.917 25.095 20.919 1.00 19.91 C ATOM 515 CE1 TYR A 31 35.896 23.395 21.860 1.00 21.64 C ATOM 516 CE2 TYR A 31 38.231 24.052 21.794 1.00 22.38 C ATOM 517 CZ TYR A 31 37.222 23.202 22.267 1.00 23.93 C ATOM 518 OH TYR A 31 37.534 22.176 23.135 1.00 30.09 O ATOM 0 H TYR A 31 35.473 27.849 17.715 1.00 13.07 H new ATOM 0 HA TYR A 31 37.147 25.566 17.799 1.00 15.35 H new ATOM 0 HB2 TYR A 31 36.990 27.197 19.632 1.00 14.82 H new ATOM 0 HB3 TYR A 31 35.286 26.854 19.855 1.00 14.82 H new ATOM 0 HD1 TYR A 31 34.559 24.582 20.667 1.00 20.04 H new ATOM 0 HD2 TYR A 31 38.694 25.753 20.559 1.00 19.91 H new ATOM 0 HE1 TYR A 31 35.118 22.741 22.225 1.00 21.64 H new ATOM 0 HE2 TYR A 31 39.254 23.900 22.107 1.00 22.38 H new ATOM 0 HH TYR A 31 38.497 22.181 23.315 1.00 30.09 H new ATOM 528 N VAL A 32 33.947 24.881 18.344 1.00 16.31 N ATOM 529 CA VAL A 32 32.980 23.743 18.322 1.00 13.79 C ATOM 530 C VAL A 32 32.931 23.101 16.933 1.00 15.33 C ATOM 531 O VAL A 32 33.092 21.905 16.794 1.00 15.78 O ATOM 532 CB VAL A 32 31.583 24.246 18.690 1.00 15.68 C ATOM 533 CG1 VAL A 32 30.610 23.065 18.696 1.00 14.40 C ATOM 534 CG2 VAL A 32 31.612 24.893 20.079 1.00 13.96 C ATOM 0 H VAL A 32 33.543 25.788 18.576 1.00 16.31 H new ATOM 0 HA VAL A 32 33.310 22.998 19.046 1.00 13.79 H new ATOM 0 HB VAL A 32 31.259 24.987 17.959 1.00 15.68 H new ATOM 0 HG11 VAL A 32 29.612 23.417 18.958 1.00 14.40 H new ATOM 0 HG12 VAL A 32 30.586 22.608 17.707 1.00 14.40 H new ATOM 0 HG13 VAL A 32 30.938 22.327 19.428 1.00 14.40 H new ATOM 0 HG21 VAL A 32 30.614 25.249 20.335 1.00 13.96 H new ATOM 0 HG22 VAL A 32 31.935 24.158 20.816 1.00 13.96 H new ATOM 0 HG23 VAL A 32 32.307 25.733 20.075 1.00 13.96 H new ATOM 544 N ILE A 33 32.695 23.878 15.906 1.00 13.65 N ATOM 545 CA ILE A 33 32.622 23.306 14.529 1.00 13.17 C ATOM 546 C ILE A 33 33.761 22.295 14.318 1.00 15.24 C ATOM 547 O ILE A 33 33.543 21.169 13.915 1.00 15.62 O ATOM 548 CB ILE A 33 32.717 24.470 13.529 1.00 15.80 C ATOM 549 CG1 ILE A 33 31.365 25.214 13.520 1.00 14.63 C ATOM 550 CG2 ILE A 33 33.029 23.941 12.127 1.00 15.09 C ATOM 551 CD1 ILE A 33 31.473 26.575 12.812 1.00 15.66 C ATOM 0 H ILE A 33 32.550 24.886 15.963 1.00 13.65 H new ATOM 0 HA ILE A 33 31.683 22.774 14.380 1.00 13.17 H new ATOM 0 HB ILE A 33 33.518 25.147 13.825 1.00 15.80 H new ATOM 0 HG12 ILE A 33 30.615 24.601 13.020 1.00 14.63 H new ATOM 0 HG13 ILE A 33 31.024 25.362 14.545 1.00 14.63 H new ATOM 0 HG21 ILE A 33 33.093 24.776 11.429 1.00 15.09 H new ATOM 0 HG22 ILE A 33 33.979 23.407 12.143 1.00 15.09 H new ATOM 0 HG23 ILE A 33 32.237 23.263 11.809 1.00 15.09 H new ATOM 0 HD11 ILE A 33 30.502 27.070 12.825 1.00 15.66 H new ATOM 0 HD12 ILE A 33 32.204 27.197 13.328 1.00 15.66 H new ATOM 0 HD13 ILE A 33 31.789 26.424 11.780 1.00 15.66 H new ATOM 563 N LEU A 34 34.963 22.690 14.602 1.00 16.71 N ATOM 564 CA LEU A 34 36.137 21.778 14.448 1.00 19.71 C ATOM 565 C LEU A 34 35.959 20.554 15.370 1.00 20.61 C ATOM 566 O LEU A 34 36.239 19.436 14.987 1.00 22.08 O ATOM 567 CB LEU A 34 37.402 22.594 14.858 1.00 19.59 C ATOM 568 CG LEU A 34 38.361 23.042 13.678 1.00 26.84 C ATOM 569 CD1 LEU A 34 37.832 22.757 12.265 1.00 24.93 C ATOM 570 CD2 LEU A 34 38.633 24.554 13.784 1.00 27.25 C ATOM 0 H LEU A 34 35.193 23.624 14.942 1.00 16.71 H new ATOM 0 HA LEU A 34 36.233 21.417 13.424 1.00 19.71 H new ATOM 0 HB2 LEU A 34 37.075 23.487 15.391 1.00 19.59 H new ATOM 0 HB3 LEU A 34 37.981 21.996 15.562 1.00 19.59 H new ATOM 0 HG LEU A 34 39.263 22.443 13.803 1.00 26.84 H new ATOM 0 HD11 LEU A 34 38.559 23.099 11.528 1.00 24.93 H new ATOM 0 HD12 LEU A 34 37.672 21.685 12.146 1.00 24.93 H new ATOM 0 HD13 LEU A 34 36.889 23.284 12.116 1.00 24.93 H new ATOM 0 HD21 LEU A 34 39.292 24.863 12.973 1.00 27.25 H new ATOM 0 HD22 LEU A 34 37.692 25.099 13.714 1.00 27.25 H new ATOM 0 HD23 LEU A 34 39.108 24.772 14.741 1.00 27.25 H new ATOM 582 N LYS A 35 35.508 20.759 16.574 1.00 19.14 N ATOM 583 CA LYS A 35 35.326 19.608 17.516 1.00 20.97 C ATOM 584 C LYS A 35 34.502 18.519 16.845 1.00 22.25 C ATOM 585 O LYS A 35 34.642 17.346 17.130 1.00 22.80 O ATOM 586 CB LYS A 35 34.586 20.086 18.771 1.00 22.98 C ATOM 587 CG LYS A 35 34.578 18.969 19.816 1.00 26.83 C ATOM 588 CD LYS A 35 33.775 19.417 21.040 1.00 29.91 C ATOM 589 CE LYS A 35 33.925 18.382 22.156 1.00 33.36 C ATOM 590 NZ LYS A 35 33.200 18.851 23.371 1.00 35.88 N ATOM 0 H LYS A 35 35.256 21.672 16.952 1.00 19.14 H new ATOM 0 HA LYS A 35 36.305 19.213 17.788 1.00 20.97 H new ATOM 0 HB2 LYS A 35 35.071 20.974 19.176 1.00 22.98 H new ATOM 0 HB3 LYS A 35 33.564 20.369 18.518 1.00 22.98 H new ATOM 0 HG2 LYS A 35 34.141 18.064 19.393 1.00 26.83 H new ATOM 0 HG3 LYS A 35 35.599 18.723 20.108 1.00 26.83 H new ATOM 0 HD2 LYS A 35 34.127 20.390 21.383 1.00 29.91 H new ATOM 0 HD3 LYS A 35 32.724 19.533 20.776 1.00 29.91 H new ATOM 0 HE2 LYS A 35 33.527 17.421 21.831 1.00 33.36 H new ATOM 0 HE3 LYS A 35 34.980 18.229 22.385 1.00 33.36 H new ATOM 0 HZ1 LYS A 35 33.302 18.147 24.130 1.00 35.88 H new ATOM 0 HZ2 LYS A 35 33.599 19.759 23.685 1.00 35.88 H new ATOM 0 HZ3 LYS A 35 32.192 18.975 23.147 1.00 35.88 H new ATOM 604 N ASP A 36 33.629 18.905 15.971 1.00 20.87 N ATOM 605 CA ASP A 36 32.760 17.920 15.281 1.00 18.89 C ATOM 606 C ASP A 36 33.449 17.385 14.028 1.00 17.97 C ATOM 607 O ASP A 36 33.436 16.202 13.752 1.00 19.23 O ATOM 608 CB ASP A 36 31.472 18.638 14.902 1.00 16.73 C ATOM 609 CG ASP A 36 31.028 19.497 16.090 1.00 19.06 C ATOM 610 OD1 ASP A 36 30.864 18.946 17.165 1.00 17.75 O ATOM 611 OD2 ASP A 36 30.861 20.691 15.902 1.00 14.84 O ATOM 0 H ASP A 36 33.476 19.876 15.699 1.00 20.87 H new ATOM 0 HA ASP A 36 32.554 17.072 15.934 1.00 18.89 H new ATOM 0 HB2 ASP A 36 31.630 19.261 14.022 1.00 16.73 H new ATOM 0 HB3 ASP A 36 30.697 17.916 14.646 1.00 16.73 H new ATOM 616 N ALA A 37 34.029 18.256 13.257 1.00 19.53 N ATOM 617 CA ALA A 37 34.701 17.823 12.003 1.00 20.29 C ATOM 618 C ALA A 37 36.074 17.235 12.307 1.00 23.93 C ATOM 619 O ALA A 37 37.013 17.420 11.559 1.00 23.82 O ATOM 620 CB ALA A 37 34.866 19.037 11.102 1.00 19.16 C ATOM 0 H ALA A 37 34.067 19.258 13.442 1.00 19.53 H new ATOM 0 HA ALA A 37 34.096 17.059 11.514 1.00 20.29 H new ATOM 0 HB1 ALA A 37 35.358 18.739 10.176 1.00 19.16 H new ATOM 0 HB2 ALA A 37 33.886 19.457 10.874 1.00 19.16 H new ATOM 0 HB3 ALA A 37 35.473 19.787 11.610 1.00 19.16 H new ATOM 626 N ASP A 38 36.213 16.539 13.392 1.00 25.04 N ATOM 627 CA ASP A 38 37.542 15.966 13.713 1.00 29.02 C ATOM 628 C ASP A 38 38.564 17.102 13.735 1.00 30.09 C ATOM 629 O ASP A 38 39.757 16.884 13.779 1.00 29.56 O ATOM 630 CB ASP A 38 37.921 14.937 12.639 1.00 31.78 C ATOM 631 CG ASP A 38 38.979 13.976 13.190 1.00 34.21 C ATOM 632 OD1 ASP A 38 39.734 14.389 14.055 1.00 39.08 O ATOM 633 OD2 ASP A 38 39.016 12.844 12.736 1.00 37.98 O ATOM 0 H ASP A 38 35.473 16.343 14.066 1.00 25.04 H new ATOM 0 HA ASP A 38 37.521 15.471 14.684 1.00 29.02 H new ATOM 0 HB2 ASP A 38 37.037 14.380 12.328 1.00 31.78 H new ATOM 0 HB3 ASP A 38 38.304 15.446 11.754 1.00 31.78 H new ATOM 638 N ALA A 39 38.085 18.317 13.704 1.00 30.33 N ATOM 639 CA ALA A 39 38.986 19.499 13.723 1.00 32.12 C ATOM 640 C ALA A 39 39.637 19.689 12.348 1.00 33.86 C ATOM 641 O ALA A 39 40.555 20.469 12.192 1.00 34.96 O ATOM 642 CB ALA A 39 40.054 19.308 14.805 1.00 32.67 C ATOM 0 H ALA A 39 37.091 18.541 13.666 1.00 30.33 H new ATOM 0 HA ALA A 39 38.407 20.394 13.952 1.00 32.12 H new ATOM 0 HB1 ALA A 39 40.716 20.174 14.820 1.00 32.67 H new ATOM 0 HB2 ALA A 39 39.572 19.202 15.777 1.00 32.67 H new ATOM 0 HB3 ALA A 39 40.635 18.411 14.589 1.00 32.67 H new ATOM 648 N ASN A 40 39.164 18.995 11.346 1.00 33.92 N ATOM 649 CA ASN A 40 39.756 19.158 9.984 1.00 34.20 C ATOM 650 C ASN A 40 39.071 20.330 9.279 1.00 34.98 C ATOM 651 O ASN A 40 37.950 20.222 8.822 1.00 32.10 O ATOM 652 CB ASN A 40 39.542 17.883 9.166 1.00 33.87 C ATOM 653 CG ASN A 40 40.427 17.924 7.919 1.00 32.69 C ATOM 654 OD1 ASN A 40 40.559 18.954 7.287 1.00 34.27 O ATOM 655 ND2 ASN A 40 41.044 16.840 7.536 1.00 33.64 N ATOM 0 H ASN A 40 38.397 18.325 11.410 1.00 33.92 H new ATOM 0 HA ASN A 40 40.825 19.350 10.075 1.00 34.20 H new ATOM 0 HB2 ASN A 40 39.783 17.007 9.768 1.00 33.87 H new ATOM 0 HB3 ASN A 40 38.494 17.794 8.879 1.00 33.87 H new ATOM 0 HD21 ASN A 40 41.637 16.857 6.706 1.00 33.64 H new ATOM 0 HD22 ASN A 40 40.933 15.976 8.066 1.00 33.64 H new ATOM 662 N ILE A 41 39.734 21.448 9.189 1.00 35.49 N ATOM 663 CA ILE A 41 39.124 22.632 8.517 1.00 37.55 C ATOM 664 C ILE A 41 38.498 22.203 7.191 1.00 36.60 C ATOM 665 O ILE A 41 37.359 22.515 6.905 1.00 34.64 O ATOM 666 CB ILE A 41 40.222 23.685 8.275 1.00 39.67 C ATOM 667 CG1 ILE A 41 40.600 24.283 9.651 1.00 42.22 C ATOM 668 CG2 ILE A 41 39.740 24.785 7.274 1.00 40.78 C ATOM 669 CD1 ILE A 41 41.604 25.442 9.523 1.00 44.19 C ATOM 0 H ILE A 41 40.676 21.595 9.553 1.00 35.49 H new ATOM 0 HA ILE A 41 38.344 23.060 9.146 1.00 37.55 H new ATOM 0 HB ILE A 41 41.098 23.226 7.817 1.00 39.67 H new ATOM 0 HG12 ILE A 41 39.699 24.638 10.151 1.00 42.22 H new ATOM 0 HG13 ILE A 41 41.027 23.502 10.280 1.00 42.22 H new ATOM 0 HG21 ILE A 41 40.536 25.514 7.123 1.00 40.78 H new ATOM 0 HG22 ILE A 41 39.486 24.323 6.320 1.00 40.78 H new ATOM 0 HG23 ILE A 41 38.861 25.286 7.680 1.00 40.78 H new ATOM 0 HD11 ILE A 41 41.840 25.830 10.514 1.00 44.19 H new ATOM 0 HD12 ILE A 41 42.516 25.082 9.048 1.00 44.19 H new ATOM 0 HD13 ILE A 41 41.168 26.236 8.917 1.00 44.19 H new ATOM 681 N GLU A 42 39.228 21.501 6.379 1.00 37.01 N ATOM 682 CA GLU A 42 38.670 21.067 5.072 1.00 36.07 C ATOM 683 C GLU A 42 37.279 20.467 5.277 1.00 33.02 C ATOM 684 O GLU A 42 36.334 20.832 4.609 1.00 31.66 O ATOM 685 CB GLU A 42 39.602 20.025 4.455 1.00 40.46 C ATOM 686 CG GLU A 42 40.990 20.642 4.268 1.00 45.44 C ATOM 687 CD GLU A 42 41.913 19.629 3.588 1.00 49.08 C ATOM 688 OE1 GLU A 42 41.547 19.138 2.532 1.00 51.71 O ATOM 689 OE2 GLU A 42 42.971 19.362 4.133 1.00 50.84 O ATOM 0 H GLU A 42 40.188 21.208 6.562 1.00 37.01 H new ATOM 0 HA GLU A 42 38.587 21.924 4.404 1.00 36.07 H new ATOM 0 HB2 GLU A 42 39.664 19.148 5.099 1.00 40.46 H new ATOM 0 HB3 GLU A 42 39.208 19.689 3.496 1.00 40.46 H new ATOM 0 HG2 GLU A 42 40.919 21.547 3.665 1.00 45.44 H new ATOM 0 HG3 GLU A 42 41.402 20.934 5.234 1.00 45.44 H new ATOM 696 N GLU A 43 37.142 19.559 6.198 1.00 29.75 N ATOM 697 CA GLU A 43 35.805 18.950 6.443 1.00 27.99 C ATOM 698 C GLU A 43 34.929 19.945 7.204 1.00 25.26 C ATOM 699 O GLU A 43 33.769 20.121 6.895 1.00 22.77 O ATOM 700 CB GLU A 43 35.962 17.672 7.271 1.00 30.94 C ATOM 701 CG GLU A 43 34.624 16.930 7.333 1.00 33.24 C ATOM 702 CD GLU A 43 34.288 16.364 5.953 1.00 37.98 C ATOM 703 OE1 GLU A 43 35.150 15.729 5.368 1.00 43.17 O ATOM 704 OE2 GLU A 43 33.173 16.574 5.505 1.00 38.40 O ATOM 0 H GLU A 43 37.895 19.211 6.792 1.00 29.75 H new ATOM 0 HA GLU A 43 35.339 18.704 5.489 1.00 27.99 H new ATOM 0 HB2 GLU A 43 36.724 17.031 6.828 1.00 30.94 H new ATOM 0 HB3 GLU A 43 36.299 17.919 8.278 1.00 30.94 H new ATOM 0 HG2 GLU A 43 34.677 16.124 8.065 1.00 33.24 H new ATOM 0 HG3 GLU A 43 33.836 17.607 7.661 1.00 33.24 H new ATOM 711 N ALA A 44 35.472 20.598 8.198 1.00 22.98 N ATOM 712 CA ALA A 44 34.657 21.576 8.972 1.00 23.88 C ATOM 713 C ALA A 44 34.175 22.689 8.035 1.00 22.87 C ATOM 714 O ALA A 44 33.062 23.161 8.141 1.00 22.85 O ATOM 715 CB ALA A 44 35.497 22.156 10.135 1.00 22.28 C ATOM 0 H ALA A 44 36.439 20.496 8.505 1.00 22.98 H new ATOM 0 HA ALA A 44 33.787 21.077 9.398 1.00 23.88 H new ATOM 0 HB1 ALA A 44 34.896 22.870 10.697 1.00 22.28 H new ATOM 0 HB2 ALA A 44 35.811 21.348 10.795 1.00 22.28 H new ATOM 0 HB3 ALA A 44 36.376 22.659 9.733 1.00 22.28 H new ATOM 721 N SER A 45 35.002 23.108 7.122 1.00 25.55 N ATOM 722 CA SER A 45 34.587 24.189 6.185 1.00 26.34 C ATOM 723 C SER A 45 33.376 23.732 5.366 1.00 26.21 C ATOM 724 O SER A 45 32.412 24.455 5.215 1.00 23.95 O ATOM 725 CB SER A 45 35.747 24.514 5.248 1.00 29.82 C ATOM 726 OG SER A 45 35.779 23.564 4.190 1.00 33.07 O ATOM 0 H SER A 45 35.947 22.750 6.983 1.00 25.55 H new ATOM 0 HA SER A 45 34.315 25.078 6.754 1.00 26.34 H new ATOM 0 HB2 SER A 45 35.633 25.520 4.845 1.00 29.82 H new ATOM 0 HB3 SER A 45 36.689 24.496 5.797 1.00 29.82 H new ATOM 0 HG SER A 45 36.006 22.681 4.550 1.00 33.07 H new ATOM 732 N ARG A 46 33.416 22.542 4.830 1.00 26.25 N ATOM 733 CA ARG A 46 32.263 22.055 4.018 1.00 26.19 C ATOM 734 C ARG A 46 30.962 22.254 4.800 1.00 24.78 C ATOM 735 O ARG A 46 29.940 22.598 4.239 1.00 20.51 O ATOM 736 CB ARG A 46 32.448 20.566 3.690 1.00 30.93 C ATOM 737 CG ARG A 46 33.584 20.388 2.670 1.00 37.66 C ATOM 738 CD ARG A 46 33.457 19.025 1.982 1.00 43.41 C ATOM 739 NE ARG A 46 32.993 18.008 2.967 1.00 47.39 N ATOM 740 CZ ARG A 46 32.530 16.862 2.550 1.00 49.82 C ATOM 741 NH1 ARG A 46 32.473 16.608 1.271 1.00 51.10 N ATOM 742 NH2 ARG A 46 32.124 15.969 3.411 1.00 51.02 N ATOM 0 H ARG A 46 34.194 21.888 4.918 1.00 26.25 H new ATOM 0 HA ARG A 46 32.215 22.622 3.088 1.00 26.19 H new ATOM 0 HB2 ARG A 46 32.675 20.011 4.600 1.00 30.93 H new ATOM 0 HB3 ARG A 46 31.521 20.156 3.289 1.00 30.93 H new ATOM 0 HG2 ARG A 46 33.546 21.185 1.927 1.00 37.66 H new ATOM 0 HG3 ARG A 46 34.549 20.464 3.170 1.00 37.66 H new ATOM 0 HD2 ARG A 46 32.753 19.090 1.152 1.00 43.41 H new ATOM 0 HD3 ARG A 46 34.418 18.727 1.562 1.00 43.41 H new ATOM 0 HE ARG A 46 33.037 18.208 3.966 1.00 47.39 H new ATOM 0 HH11 ARG A 46 32.790 17.306 0.598 1.00 51.10 H new ATOM 0 HH12 ARG A 46 32.111 15.712 0.945 1.00 51.10 H new ATOM 0 HH21 ARG A 46 32.169 16.167 4.411 1.00 51.02 H new ATOM 0 HH22 ARG A 46 31.762 15.073 3.084 1.00 51.02 H new ATOM 756 N ARG A 47 30.987 22.050 6.087 1.00 20.40 N ATOM 757 CA ARG A 47 29.744 22.239 6.891 1.00 20.79 C ATOM 758 C ARG A 47 29.369 23.717 6.880 1.00 20.46 C ATOM 759 O ARG A 47 28.316 24.096 6.407 1.00 20.27 O ATOM 760 CB ARG A 47 29.985 21.773 8.328 1.00 18.12 C ATOM 761 CG ARG A 47 30.710 20.425 8.305 1.00 19.83 C ATOM 762 CD ARG A 47 30.897 19.893 9.732 1.00 24.63 C ATOM 763 NE ARG A 47 31.003 18.408 9.684 1.00 25.15 N ATOM 764 CZ ARG A 47 31.425 17.749 10.726 1.00 28.72 C ATOM 765 NH1 ARG A 47 31.724 18.388 11.821 1.00 25.84 N ATOM 766 NH2 ARG A 47 31.547 16.451 10.673 1.00 22.33 N ATOM 0 H ARG A 47 31.810 21.762 6.617 1.00 20.40 H new ATOM 0 HA ARG A 47 28.932 21.652 6.462 1.00 20.79 H new ATOM 0 HB2 ARG A 47 30.580 22.510 8.867 1.00 18.12 H new ATOM 0 HB3 ARG A 47 29.036 21.680 8.857 1.00 18.12 H new ATOM 0 HG2 ARG A 47 30.139 19.708 7.715 1.00 19.83 H new ATOM 0 HG3 ARG A 47 31.681 20.535 7.821 1.00 19.83 H new ATOM 0 HD2 ARG A 47 31.795 20.321 10.179 1.00 24.63 H new ATOM 0 HD3 ARG A 47 30.056 20.191 10.358 1.00 24.63 H new ATOM 0 HE ARG A 47 30.745 17.906 8.834 1.00 25.15 H new ATOM 0 HH11 ARG A 47 31.628 19.403 11.862 1.00 25.84 H new ATOM 0 HH12 ARG A 47 32.054 17.874 12.638 1.00 25.84 H new ATOM 0 HH21 ARG A 47 31.312 15.951 9.815 1.00 22.33 H new ATOM 0 HH22 ARG A 47 31.877 15.936 11.489 1.00 22.33 H new ATOM 780 N ILE A 48 30.237 24.560 7.370 1.00 19.14 N ATOM 781 CA ILE A 48 29.954 26.025 7.359 1.00 21.78 C ATOM 782 C ILE A 48 29.465 26.398 5.969 1.00 25.27 C ATOM 783 O ILE A 48 28.387 26.924 5.788 1.00 23.94 O ATOM 784 CB ILE A 48 31.239 26.781 7.671 1.00 20.97 C ATOM 785 CG1 ILE A 48 31.819 26.219 8.967 1.00 21.08 C ATOM 786 CG2 ILE A 48 30.923 28.270 7.831 1.00 21.08 C ATOM 787 CD1 ILE A 48 33.033 27.042 9.417 1.00 19.82 C ATOM 0 H ILE A 48 31.133 24.297 7.779 1.00 19.14 H new ATOM 0 HA ILE A 48 29.200 26.280 8.103 1.00 21.78 H new ATOM 0 HB ILE A 48 31.962 26.664 6.864 1.00 20.97 H new ATOM 0 HG12 ILE A 48 31.057 26.228 9.747 1.00 21.08 H new ATOM 0 HG13 ILE A 48 32.112 25.179 8.820 1.00 21.08 H new ATOM 0 HG21 ILE A 48 31.840 28.815 8.054 1.00 21.08 H new ATOM 0 HG22 ILE A 48 30.491 28.652 6.906 1.00 21.08 H new ATOM 0 HG23 ILE A 48 30.213 28.406 8.647 1.00 21.08 H new ATOM 0 HD11 ILE A 48 33.432 26.626 10.342 1.00 19.82 H new ATOM 0 HD12 ILE A 48 33.801 27.010 8.644 1.00 19.82 H new ATOM 0 HD13 ILE A 48 32.730 28.075 9.585 1.00 19.82 H new ATOM 799 N GLU A 49 30.255 26.091 4.985 1.00 26.87 N ATOM 800 CA GLU A 49 29.867 26.383 3.579 1.00 31.21 C ATOM 801 C GLU A 49 28.421 25.974 3.350 1.00 31.88 C ATOM 802 O GLU A 49 27.566 26.790 3.066 1.00 31.73 O ATOM 803 CB GLU A 49 30.725 25.528 2.665 1.00 32.85 C ATOM 804 CG GLU A 49 32.124 26.133 2.517 1.00 36.76 C ATOM 805 CD GLU A 49 32.846 25.465 1.346 1.00 40.40 C ATOM 806 OE1 GLU A 49 32.295 25.469 0.257 1.00 40.28 O ATOM 807 OE2 GLU A 49 33.936 24.961 1.558 1.00 43.41 O ATOM 0 H GLU A 49 31.165 25.644 5.094 1.00 26.87 H new ATOM 0 HA GLU A 49 29.996 27.447 3.380 1.00 31.21 H new ATOM 0 HB2 GLU A 49 30.800 24.518 3.068 1.00 32.85 H new ATOM 0 HB3 GLU A 49 30.253 25.446 1.686 1.00 32.85 H new ATOM 0 HG2 GLU A 49 32.051 27.207 2.348 1.00 36.76 H new ATOM 0 HG3 GLU A 49 32.692 25.992 3.437 1.00 36.76 H new ATOM 814 N GLU A 50 28.140 24.704 3.492 1.00 32.05 N ATOM 815 CA GLU A 50 26.747 24.231 3.305 1.00 30.33 C ATOM 816 C GLU A 50 25.880 25.124 4.163 1.00 29.99 C ATOM 817 O GLU A 50 24.855 25.584 3.756 1.00 26.76 O ATOM 818 CB GLU A 50 26.642 22.761 3.761 1.00 33.38 C ATOM 819 CG GLU A 50 25.519 22.045 3.001 1.00 33.45 C ATOM 820 CD GLU A 50 25.520 20.561 3.370 1.00 36.89 C ATOM 821 OE1 GLU A 50 25.141 20.248 4.487 1.00 35.55 O ATOM 822 OE2 GLU A 50 25.900 19.762 2.530 1.00 36.13 O ATOM 0 H GLU A 50 28.818 23.980 3.729 1.00 32.05 H new ATOM 0 HA GLU A 50 26.433 24.277 2.262 1.00 30.33 H new ATOM 0 HB2 GLU A 50 27.590 22.251 3.588 1.00 33.38 H new ATOM 0 HB3 GLU A 50 26.449 22.719 4.833 1.00 33.38 H new ATOM 0 HG2 GLU A 50 24.556 22.492 3.248 1.00 33.45 H new ATOM 0 HG3 GLU A 50 25.659 22.164 1.927 1.00 33.45 H new ATOM 829 N GLY A 51 26.350 25.403 5.332 1.00 0.00 N ATOM 830 CA GLY A 51 25.617 26.296 6.260 1.00 0.00 C ATOM 831 C GLY A 51 25.372 27.659 5.595 1.00 0.00 C ATOM 832 O GLY A 51 24.257 28.100 5.416 1.00 0.00 O ATOM 0 H GLY A 51 27.232 25.043 5.696 1.00 0.00 H new ATOM 0 HA2 GLY A 51 24.666 25.842 6.539 1.00 0.00 H new ATOM 0 HA3 GLY A 51 26.189 26.428 7.178 1.00 0.00 H new ATOM 836 N GLN A 52 26.426 28.340 5.237 1.00 29.60 N ATOM 837 CA GLN A 52 26.272 29.681 4.592 1.00 32.81 C ATOM 838 C GLN A 52 25.259 29.555 3.469 1.00 33.63 C ATOM 839 O GLN A 52 24.315 30.314 3.361 1.00 32.37 O ATOM 840 CB GLN A 52 27.610 30.134 3.996 1.00 32.81 C ATOM 841 CG GLN A 52 28.734 30.029 5.045 1.00 34.44 C ATOM 842 CD GLN A 52 28.862 31.334 5.833 1.00 35.84 C ATOM 843 OE1 GLN A 52 27.893 32.042 6.027 1.00 36.29 O ATOM 844 NE2 GLN A 52 30.031 31.680 6.298 1.00 38.34 N ATOM 0 H GLN A 52 27.389 28.028 5.362 1.00 29.60 H new ATOM 0 HA GLN A 52 25.944 30.409 5.334 1.00 32.81 H new ATOM 0 HB2 GLN A 52 27.855 29.520 3.130 1.00 32.81 H new ATOM 0 HB3 GLN A 52 27.528 31.162 3.644 1.00 32.81 H new ATOM 0 HG2 GLN A 52 28.525 29.205 5.728 1.00 34.44 H new ATOM 0 HG3 GLN A 52 29.679 29.802 4.551 1.00 34.44 H new ATOM 0 HE21 GLN A 52 30.842 31.084 6.134 1.00 38.34 H new ATOM 0 HE22 GLN A 52 30.134 32.547 6.826 1.00 38.34 H new ATOM 853 N TYR A 53 25.454 28.577 2.644 1.00 34.79 N ATOM 854 CA TYR A 53 24.518 28.343 1.522 1.00 37.88 C ATOM 855 C TYR A 53 23.172 27.930 2.110 1.00 39.97 C ATOM 856 O TYR A 53 22.131 28.421 1.736 1.00 39.08 O ATOM 857 CB TYR A 53 25.076 27.210 0.647 1.00 39.97 C ATOM 858 CG TYR A 53 23.968 26.596 -0.179 1.00 42.20 C ATOM 859 CD1 TYR A 53 23.118 25.645 0.390 1.00 42.61 C ATOM 860 CD2 TYR A 53 23.794 26.986 -1.500 1.00 42.58 C ATOM 861 CE1 TYR A 53 22.093 25.084 -0.366 1.00 45.45 C ATOM 862 CE2 TYR A 53 22.765 26.426 -2.268 1.00 44.68 C ATOM 863 CZ TYR A 53 21.912 25.472 -1.699 1.00 45.19 C ATOM 864 OH TYR A 53 20.896 24.917 -2.449 1.00 49.10 O ATOM 0 H TYR A 53 26.232 27.920 2.699 1.00 34.79 H new ATOM 0 HA TYR A 53 24.398 29.241 0.916 1.00 37.88 H new ATOM 0 HB2 TYR A 53 25.857 27.597 -0.008 1.00 39.97 H new ATOM 0 HB3 TYR A 53 25.536 26.448 1.276 1.00 39.97 H new ATOM 0 HD1 TYR A 53 23.256 25.345 1.418 1.00 42.61 H new ATOM 0 HD2 TYR A 53 24.453 27.722 -1.936 1.00 42.58 H new ATOM 0 HE1 TYR A 53 21.437 24.349 0.076 1.00 45.45 H new ATOM 0 HE2 TYR A 53 22.630 26.729 -3.296 1.00 44.68 H new ATOM 0 HH TYR A 53 20.287 24.424 -1.861 1.00 49.10 H new ATOM 874 N VAL A 54 23.209 27.016 3.026 1.00 39.04 N ATOM 875 CA VAL A 54 21.966 26.522 3.665 1.00 40.51 C ATOM 876 C VAL A 54 21.153 27.728 4.151 1.00 40.89 C ATOM 877 O VAL A 54 20.063 27.989 3.684 1.00 40.52 O ATOM 878 CB VAL A 54 22.407 25.645 4.840 1.00 40.89 C ATOM 879 CG1 VAL A 54 21.341 25.555 5.905 1.00 41.12 C ATOM 880 CG2 VAL A 54 22.816 24.220 4.373 1.00 40.75 C ATOM 0 H VAL A 54 24.066 26.580 3.367 1.00 39.04 H new ATOM 0 HA VAL A 54 21.341 25.949 2.980 1.00 40.51 H new ATOM 0 HB VAL A 54 23.282 26.128 5.274 1.00 40.89 H new ATOM 0 HG11 VAL A 54 21.694 24.924 6.721 1.00 41.12 H new ATOM 0 HG12 VAL A 54 21.123 26.552 6.286 1.00 41.12 H new ATOM 0 HG13 VAL A 54 20.436 25.124 5.478 1.00 41.12 H new ATOM 0 HG21 VAL A 54 23.123 23.628 5.236 1.00 40.75 H new ATOM 0 HG22 VAL A 54 21.968 23.739 3.886 1.00 40.75 H new ATOM 0 HG23 VAL A 54 23.645 24.292 3.669 1.00 40.75 H new ATOM 890 N VAL A 55 21.687 28.464 5.083 1.00 40.66 N ATOM 891 CA VAL A 55 20.965 29.657 5.601 1.00 41.79 C ATOM 892 C VAL A 55 20.635 30.576 4.426 1.00 43.19 C ATOM 893 O VAL A 55 19.489 30.890 4.174 1.00 42.93 O ATOM 894 CB VAL A 55 21.865 30.388 6.608 1.00 40.93 C ATOM 895 CG1 VAL A 55 21.092 31.532 7.279 1.00 40.61 C ATOM 896 CG2 VAL A 55 22.332 29.393 7.674 1.00 41.17 C ATOM 0 H VAL A 55 22.597 28.290 5.510 1.00 40.66 H new ATOM 0 HA VAL A 55 20.042 29.360 6.099 1.00 41.79 H new ATOM 0 HB VAL A 55 22.725 30.805 6.084 1.00 40.93 H new ATOM 0 HG11 VAL A 55 21.742 32.042 7.990 1.00 40.61 H new ATOM 0 HG12 VAL A 55 20.758 32.240 6.520 1.00 40.61 H new ATOM 0 HG13 VAL A 55 20.226 31.128 7.803 1.00 40.61 H new ATOM 0 HG21 VAL A 55 22.972 29.904 8.393 1.00 41.17 H new ATOM 0 HG22 VAL A 55 21.466 28.979 8.189 1.00 41.17 H new ATOM 0 HG23 VAL A 55 22.892 28.587 7.199 1.00 41.17 H new ATOM 906 N ASN A 56 21.629 31.000 3.694 1.00 43.65 N ATOM 907 CA ASN A 56 21.365 31.887 2.525 1.00 46.57 C ATOM 908 C ASN A 56 20.257 31.261 1.673 1.00 47.19 C ATOM 909 O ASN A 56 19.309 31.916 1.287 1.00 46.87 O ATOM 910 CB ASN A 56 22.640 32.026 1.690 1.00 46.25 C ATOM 911 CG ASN A 56 23.715 32.739 2.511 1.00 46.74 C ATOM 912 OD1 ASN A 56 23.411 33.590 3.323 1.00 46.94 O ATOM 913 ND2 ASN A 56 24.970 32.426 2.333 1.00 47.06 N ATOM 0 H ASN A 56 22.610 30.771 3.854 1.00 43.65 H new ATOM 0 HA ASN A 56 21.055 32.874 2.869 1.00 46.57 H new ATOM 0 HB2 ASN A 56 22.995 31.042 1.383 1.00 46.25 H new ATOM 0 HB3 ASN A 56 22.431 32.588 0.779 1.00 46.25 H new ATOM 0 HD21 ASN A 56 25.695 32.896 2.876 1.00 47.06 H new ATOM 0 HD22 ASN A 56 25.226 31.712 1.651 1.00 47.06 H new ATOM 920 N GLU A 57 20.367 29.991 1.391 1.00 49.43 N ATOM 921 CA GLU A 57 19.322 29.307 0.579 1.00 51.03 C ATOM 922 C GLU A 57 17.965 29.503 1.255 1.00 51.99 C ATOM 923 O GLU A 57 17.032 30.003 0.659 1.00 52.02 O ATOM 924 CB GLU A 57 19.643 27.811 0.489 1.00 52.77 C ATOM 925 CG GLU A 57 18.646 27.116 -0.440 1.00 54.20 C ATOM 926 CD GLU A 57 18.905 25.609 -0.431 1.00 56.33 C ATOM 927 OE1 GLU A 57 19.265 25.095 0.615 1.00 57.76 O ATOM 928 OE2 GLU A 57 18.736 24.993 -1.471 1.00 57.66 O ATOM 0 H GLU A 57 21.140 29.396 1.690 1.00 49.43 H new ATOM 0 HA GLU A 57 19.297 29.728 -0.426 1.00 51.03 H new ATOM 0 HB2 GLU A 57 20.658 27.670 0.117 1.00 52.77 H new ATOM 0 HB3 GLU A 57 19.602 27.362 1.481 1.00 52.77 H new ATOM 0 HG2 GLU A 57 17.626 27.322 -0.116 1.00 54.20 H new ATOM 0 HG3 GLU A 57 18.744 27.506 -1.453 1.00 54.20 H new ATOM 935 N TYR A 58 17.849 29.121 2.500 1.00 53.12 N ATOM 936 CA TYR A 58 16.551 29.298 3.209 1.00 54.13 C ATOM 937 C TYR A 58 16.091 30.737 3.033 1.00 54.38 C ATOM 938 O TYR A 58 14.917 31.040 3.048 1.00 55.12 O ATOM 939 CB TYR A 58 16.725 29.003 4.699 1.00 54.54 C ATOM 940 CG TYR A 58 15.370 28.882 5.348 1.00 55.20 C ATOM 941 CD1 TYR A 58 14.724 30.014 5.866 1.00 55.64 C ATOM 942 CD2 TYR A 58 14.764 27.629 5.435 1.00 55.36 C ATOM 943 CE1 TYR A 58 13.469 29.884 6.473 1.00 56.15 C ATOM 944 CE2 TYR A 58 13.513 27.498 6.040 1.00 55.93 C ATOM 945 CZ TYR A 58 12.863 28.625 6.561 1.00 56.20 C ATOM 946 OH TYR A 58 11.626 28.494 7.159 1.00 58.01 O ATOM 0 H TYR A 58 18.594 28.696 3.053 1.00 53.12 H new ATOM 0 HA TYR A 58 15.812 28.612 2.795 1.00 54.13 H new ATOM 0 HB2 TYR A 58 17.289 28.080 4.835 1.00 54.54 H new ATOM 0 HB3 TYR A 58 17.298 29.799 5.174 1.00 54.54 H new ATOM 0 HD1 TYR A 58 15.194 30.984 5.797 1.00 55.64 H new ATOM 0 HD2 TYR A 58 15.263 26.759 5.034 1.00 55.36 H new ATOM 0 HE1 TYR A 58 12.969 30.754 6.873 1.00 56.15 H new ATOM 0 HE2 TYR A 58 13.045 26.527 6.107 1.00 55.93 H new ATOM 0 HH TYR A 58 11.349 27.554 7.135 1.00 58.01 H new ATOM 1151 N ASP B 7 13.097 22.818 9.029 1.00 55.77 N ATOM 1152 CA ASP B 7 12.569 24.012 9.750 1.00 53.95 C ATOM 1153 C ASP B 7 12.955 23.939 11.227 1.00 52.49 C ATOM 1154 O ASP B 7 13.591 24.831 11.754 1.00 51.89 O ATOM 1155 CB ASP B 7 11.050 24.042 9.620 1.00 54.63 C ATOM 1156 CG ASP B 7 10.664 24.458 8.200 1.00 55.27 C ATOM 1157 OD1 ASP B 7 11.094 23.793 7.272 1.00 55.55 O ATOM 1158 OD2 ASP B 7 9.945 25.433 8.065 1.00 56.33 O ATOM 0 HA ASP B 7 12.994 24.917 9.316 1.00 53.95 H new ATOM 0 HB2 ASP B 7 10.636 23.059 9.847 1.00 54.63 H new ATOM 0 HB3 ASP B 7 10.627 24.741 10.342 1.00 54.63 H new ATOM 1163 N VAL B 8 12.601 22.874 11.897 1.00 50.38 N ATOM 1164 CA VAL B 8 12.980 22.738 13.340 1.00 48.45 C ATOM 1165 C VAL B 8 14.471 23.043 13.450 1.00 46.36 C ATOM 1166 O VAL B 8 14.918 23.800 14.288 1.00 44.84 O ATOM 1167 CB VAL B 8 12.729 21.287 13.831 1.00 48.63 C ATOM 1168 CG1 VAL B 8 11.429 21.215 14.628 1.00 48.83 C ATOM 1169 CG2 VAL B 8 12.644 20.344 12.631 1.00 47.55 C ATOM 0 H VAL B 8 12.068 22.094 11.512 1.00 50.38 H new ATOM 0 HA VAL B 8 12.385 23.419 13.948 1.00 48.45 H new ATOM 0 HB VAL B 8 13.556 20.987 14.474 1.00 48.63 H new ATOM 0 HG11 VAL B 8 11.266 20.192 14.966 1.00 48.83 H new ATOM 0 HG12 VAL B 8 11.495 21.876 15.492 1.00 48.83 H new ATOM 0 HG13 VAL B 8 10.597 21.525 13.996 1.00 48.83 H new ATOM 0 HG21 VAL B 8 12.468 19.326 12.980 1.00 47.55 H new ATOM 0 HG22 VAL B 8 11.824 20.653 11.983 1.00 47.55 H new ATOM 0 HG23 VAL B 8 13.580 20.379 12.073 1.00 47.55 H new ATOM 1179 N PHE B 9 15.234 22.439 12.588 1.00 44.57 N ATOM 1180 CA PHE B 9 16.701 22.656 12.596 1.00 42.68 C ATOM 1181 C PHE B 9 16.981 24.155 12.659 1.00 41.92 C ATOM 1182 O PHE B 9 17.620 24.642 13.571 1.00 40.56 O ATOM 1183 CB PHE B 9 17.314 22.057 11.316 1.00 41.99 C ATOM 1184 CG PHE B 9 18.753 21.711 11.575 1.00 41.32 C ATOM 1185 CD1 PHE B 9 19.730 22.704 11.480 1.00 41.38 C ATOM 1186 CD2 PHE B 9 19.108 20.404 11.923 1.00 41.88 C ATOM 1187 CE1 PHE B 9 21.063 22.392 11.732 1.00 39.40 C ATOM 1188 CE2 PHE B 9 20.444 20.094 12.176 1.00 39.39 C ATOM 1189 CZ PHE B 9 21.419 21.092 12.080 1.00 40.84 C ATOM 0 H PHE B 9 14.899 21.797 11.870 1.00 44.57 H new ATOM 0 HA PHE B 9 17.146 22.168 13.463 1.00 42.68 H new ATOM 0 HB2 PHE B 9 16.761 21.167 11.016 1.00 41.99 H new ATOM 0 HB3 PHE B 9 17.241 22.770 10.495 1.00 41.99 H new ATOM 0 HD1 PHE B 9 19.452 23.712 11.211 1.00 41.38 H new ATOM 0 HD2 PHE B 9 18.351 19.638 11.996 1.00 41.88 H new ATOM 0 HE1 PHE B 9 21.821 23.158 11.658 1.00 39.40 H new ATOM 0 HE2 PHE B 9 20.725 19.086 12.445 1.00 39.39 H new ATOM 0 HZ PHE B 9 22.454 20.853 12.277 1.00 40.84 H new ATOM 1199 N LEU B 10 16.489 24.892 11.706 1.00 41.09 N ATOM 1200 CA LEU B 10 16.711 26.361 11.727 1.00 41.50 C ATOM 1201 C LEU B 10 16.040 26.925 12.974 1.00 41.09 C ATOM 1202 O LEU B 10 16.517 27.862 13.581 1.00 38.55 O ATOM 1203 CB LEU B 10 16.107 26.994 10.474 1.00 42.71 C ATOM 1204 CG LEU B 10 16.562 26.214 9.236 1.00 43.61 C ATOM 1205 CD1 LEU B 10 16.105 26.951 7.984 1.00 44.50 C ATOM 1206 CD2 LEU B 10 18.090 26.100 9.218 1.00 43.61 C ATOM 0 H LEU B 10 15.945 24.543 10.917 1.00 41.09 H new ATOM 0 HA LEU B 10 17.778 26.583 11.744 1.00 41.50 H new ATOM 0 HB2 LEU B 10 15.019 26.989 10.540 1.00 42.71 H new ATOM 0 HB3 LEU B 10 16.417 28.036 10.395 1.00 42.71 H new ATOM 0 HG LEU B 10 16.127 25.215 9.264 1.00 43.61 H new ATOM 0 HD11 LEU B 10 16.426 26.400 7.100 1.00 44.50 H new ATOM 0 HD12 LEU B 10 15.018 27.032 7.986 1.00 44.50 H new ATOM 0 HD13 LEU B 10 16.543 27.949 7.969 1.00 44.50 H new ATOM 0 HD21 LEU B 10 18.403 25.544 8.334 1.00 43.61 H new ATOM 0 HD22 LEU B 10 18.529 27.097 9.194 1.00 43.61 H new ATOM 0 HD23 LEU B 10 18.426 25.577 10.113 1.00 43.61 H new ATOM 1218 N ASP B 11 14.943 26.343 13.375 1.00 41.28 N ATOM 1219 CA ASP B 11 14.260 26.833 14.601 1.00 41.44 C ATOM 1220 C ASP B 11 15.236 26.699 15.771 1.00 39.86 C ATOM 1221 O ASP B 11 15.484 27.646 16.490 1.00 37.26 O ATOM 1222 CB ASP B 11 12.997 26.003 14.871 1.00 44.23 C ATOM 1223 CG ASP B 11 12.047 26.788 15.780 1.00 46.87 C ATOM 1224 OD1 ASP B 11 11.846 27.963 15.521 1.00 48.41 O ATOM 1225 OD2 ASP B 11 11.538 26.201 16.721 1.00 49.31 O ATOM 0 H ASP B 11 14.494 25.555 12.909 1.00 41.28 H new ATOM 0 HA ASP B 11 13.961 27.874 14.475 1.00 41.44 H new ATOM 0 HB2 ASP B 11 12.500 25.763 13.931 1.00 44.23 H new ATOM 0 HB3 ASP B 11 13.266 25.057 15.340 1.00 44.23 H new ATOM 1230 N TYR B 12 15.818 25.537 15.959 1.00 39.23 N ATOM 1231 CA TYR B 12 16.794 25.398 17.074 1.00 38.08 C ATOM 1232 C TYR B 12 17.874 26.445 16.868 1.00 34.01 C ATOM 1233 O TYR B 12 18.253 27.156 17.774 1.00 32.49 O ATOM 1234 CB TYR B 12 17.474 24.023 17.075 1.00 42.28 C ATOM 1235 CG TYR B 12 16.479 22.877 17.093 1.00 47.31 C ATOM 1236 CD1 TYR B 12 15.319 22.916 17.888 1.00 49.49 C ATOM 1237 CD2 TYR B 12 16.747 21.745 16.316 1.00 48.65 C ATOM 1238 CE1 TYR B 12 14.441 21.824 17.894 1.00 50.83 C ATOM 1239 CE2 TYR B 12 15.874 20.663 16.323 1.00 51.34 C ATOM 1240 CZ TYR B 12 14.720 20.696 17.111 1.00 50.67 C ATOM 1241 OH TYR B 12 13.855 19.621 17.116 1.00 52.32 O ATOM 0 H TYR B 12 15.661 24.699 15.399 1.00 39.23 H new ATOM 0 HA TYR B 12 16.262 25.519 18.017 1.00 38.08 H new ATOM 0 HB2 TYR B 12 18.107 23.935 16.192 1.00 42.28 H new ATOM 0 HB3 TYR B 12 18.127 23.946 17.945 1.00 42.28 H new ATOM 0 HD1 TYR B 12 15.106 23.785 18.492 1.00 49.49 H new ATOM 0 HD2 TYR B 12 17.638 21.711 15.707 1.00 48.65 H new ATOM 0 HE1 TYR B 12 13.549 21.852 18.502 1.00 50.83 H new ATOM 0 HE2 TYR B 12 16.088 19.794 15.718 1.00 51.34 H new ATOM 0 HH TYR B 12 14.196 18.924 16.518 1.00 52.32 H new ATOM 1251 N CYS B 13 18.373 26.558 15.670 1.00 32.32 N ATOM 1252 CA CYS B 13 19.414 27.575 15.413 1.00 29.00 C ATOM 1253 C CYS B 13 18.897 28.908 15.932 1.00 29.81 C ATOM 1254 O CYS B 13 19.436 29.469 16.856 1.00 24.62 O ATOM 1255 CB CYS B 13 19.686 27.668 13.913 1.00 28.41 C ATOM 1256 SG CYS B 13 19.929 26.004 13.245 1.00 23.95 S ATOM 0 H CYS B 13 18.104 25.992 14.866 1.00 32.32 H new ATOM 0 HA CYS B 13 20.344 27.308 15.914 1.00 29.00 H new ATOM 0 HB2 CYS B 13 18.851 28.156 13.410 1.00 28.41 H new ATOM 0 HB3 CYS B 13 20.570 28.279 13.729 1.00 28.41 H new ATOM 0 HG CYS B 13 18.817 25.336 13.329 1.00 23.95 H new ATOM 1262 N GLN B 14 17.825 29.396 15.368 1.00 29.76 N ATOM 1263 CA GLN B 14 17.247 30.683 15.845 1.00 32.34 C ATOM 1264 C GLN B 14 17.174 30.668 17.376 1.00 33.14 C ATOM 1265 O GLN B 14 17.382 31.672 18.023 1.00 33.29 O ATOM 1266 CB GLN B 14 15.845 30.860 15.249 1.00 34.56 C ATOM 1267 CG GLN B 14 15.429 32.334 15.303 1.00 39.08 C ATOM 1268 CD GLN B 14 15.050 32.709 16.736 1.00 41.02 C ATOM 1269 OE1 GLN B 14 14.008 32.318 17.225 1.00 42.67 O ATOM 1270 NE2 GLN B 14 15.857 33.457 17.436 1.00 42.20 N ATOM 0 H GLN B 14 17.324 28.957 14.596 1.00 29.76 H new ATOM 0 HA GLN B 14 17.876 31.515 15.527 1.00 32.34 H new ATOM 0 HB2 GLN B 14 15.834 30.509 14.217 1.00 34.56 H new ATOM 0 HB3 GLN B 14 15.128 30.252 15.801 1.00 34.56 H new ATOM 0 HG2 GLN B 14 16.246 32.966 14.955 1.00 39.08 H new ATOM 0 HG3 GLN B 14 14.585 32.509 14.636 1.00 39.08 H new ATOM 0 HE21 GLN B 14 16.732 33.786 17.027 1.00 42.20 H new ATOM 0 HE22 GLN B 14 15.614 33.713 18.393 1.00 42.20 H new ATOM 1279 N LYS B 15 16.905 29.533 17.964 1.00 31.48 N ATOM 1280 CA LYS B 15 16.859 29.473 19.450 1.00 31.70 C ATOM 1281 C LYS B 15 18.300 29.506 19.958 1.00 30.74 C ATOM 1282 O LYS B 15 18.696 30.397 20.677 1.00 30.57 O ATOM 1283 CB LYS B 15 16.178 28.173 19.892 1.00 35.91 C ATOM 1284 CG LYS B 15 14.703 28.141 19.402 1.00 40.53 C ATOM 1285 CD LYS B 15 13.739 28.030 20.589 1.00 42.80 C ATOM 1286 CE LYS B 15 13.748 26.595 21.118 1.00 45.27 C ATOM 1287 NZ LYS B 15 12.897 26.508 22.338 1.00 48.21 N ATOM 0 H LYS B 15 16.717 28.653 17.483 1.00 31.48 H new ATOM 0 HA LYS B 15 16.293 30.313 19.854 1.00 31.70 H new ATOM 0 HB2 LYS B 15 16.720 27.316 19.491 1.00 35.91 H new ATOM 0 HB3 LYS B 15 16.209 28.090 20.978 1.00 35.91 H new ATOM 0 HG2 LYS B 15 14.484 29.044 18.833 1.00 40.53 H new ATOM 0 HG3 LYS B 15 14.557 27.297 18.728 1.00 40.53 H new ATOM 0 HD2 LYS B 15 14.035 28.722 21.378 1.00 42.80 H new ATOM 0 HD3 LYS B 15 12.731 28.309 20.281 1.00 42.80 H new ATOM 0 HE2 LYS B 15 13.377 25.912 20.354 1.00 45.27 H new ATOM 0 HE3 LYS B 15 14.768 26.289 21.351 1.00 45.27 H new ATOM 0 HZ1 LYS B 15 12.904 25.532 22.697 1.00 48.21 H new ATOM 0 HZ2 LYS B 15 13.270 27.148 23.068 1.00 48.21 H new ATOM 0 HZ3 LYS B 15 11.922 26.783 22.102 1.00 48.21 H new ATOM 1301 N LEU B 16 19.108 28.562 19.554 1.00 26.59 N ATOM 1302 CA LEU B 16 20.537 28.575 19.986 1.00 27.03 C ATOM 1303 C LEU B 16 21.082 29.974 19.705 1.00 24.17 C ATOM 1304 O LEU B 16 21.860 30.531 20.453 1.00 23.26 O ATOM 1305 CB LEU B 16 21.309 27.523 19.171 1.00 28.15 C ATOM 1306 CG LEU B 16 22.570 27.065 19.925 1.00 28.00 C ATOM 1307 CD1 LEU B 16 22.191 26.371 21.247 1.00 30.50 C ATOM 1308 CD2 LEU B 16 23.359 26.092 19.031 1.00 26.29 C ATOM 0 H LEU B 16 18.843 27.786 18.947 1.00 26.59 H new ATOM 0 HA LEU B 16 20.641 28.339 21.045 1.00 27.03 H new ATOM 0 HB2 LEU B 16 20.666 26.665 18.974 1.00 28.15 H new ATOM 0 HB3 LEU B 16 21.589 27.940 18.204 1.00 28.15 H new ATOM 0 HG LEU B 16 23.183 27.935 20.161 1.00 28.00 H new ATOM 0 HD11 LEU B 16 23.097 26.055 21.765 1.00 30.50 H new ATOM 0 HD12 LEU B 16 21.637 27.067 21.877 1.00 30.50 H new ATOM 0 HD13 LEU B 16 21.571 25.500 21.036 1.00 30.50 H new ATOM 0 HD21 LEU B 16 24.255 25.761 19.556 1.00 26.29 H new ATOM 0 HD22 LEU B 16 22.737 25.229 18.795 1.00 26.29 H new ATOM 0 HD23 LEU B 16 23.645 26.596 18.108 1.00 26.29 H new ATOM 1320 N LEU B 17 20.622 30.542 18.632 1.00 23.83 N ATOM 1321 CA LEU B 17 21.026 31.920 18.251 1.00 25.91 C ATOM 1322 C LEU B 17 20.509 32.875 19.334 1.00 28.74 C ATOM 1323 O LEU B 17 21.145 33.849 19.682 1.00 29.35 O ATOM 1324 CB LEU B 17 20.365 32.255 16.905 1.00 23.53 C ATOM 1325 CG LEU B 17 21.065 33.452 16.215 1.00 23.31 C ATOM 1326 CD1 LEU B 17 22.209 32.965 15.292 1.00 16.92 C ATOM 1327 CD2 LEU B 17 20.040 34.237 15.375 1.00 19.75 C ATOM 0 H LEU B 17 19.967 30.099 17.987 1.00 23.83 H new ATOM 0 HA LEU B 17 22.108 32.010 18.161 1.00 25.91 H new ATOM 0 HB2 LEU B 17 20.403 31.383 16.252 1.00 23.53 H new ATOM 0 HB3 LEU B 17 19.312 32.489 17.063 1.00 23.53 H new ATOM 0 HG LEU B 17 21.486 34.094 16.989 1.00 23.31 H new ATOM 0 HD11 LEU B 17 22.685 33.824 14.819 1.00 16.92 H new ATOM 0 HD12 LEU B 17 22.946 32.421 15.882 1.00 16.92 H new ATOM 0 HD13 LEU B 17 21.802 32.307 14.524 1.00 16.92 H new ATOM 0 HD21 LEU B 17 20.535 35.079 14.891 1.00 19.75 H new ATOM 0 HD22 LEU B 17 19.613 33.581 14.616 1.00 19.75 H new ATOM 0 HD23 LEU B 17 19.246 34.607 16.023 1.00 19.75 H new ATOM 1339 N GLU B 18 19.345 32.585 19.864 1.00 30.66 N ATOM 1340 CA GLU B 18 18.756 33.452 20.927 1.00 33.61 C ATOM 1341 C GLU B 18 19.388 33.088 22.279 1.00 34.68 C ATOM 1342 O GLU B 18 19.727 33.947 23.067 1.00 34.80 O ATOM 1343 CB GLU B 18 17.210 33.260 20.938 1.00 35.91 C ATOM 1344 CG GLU B 18 16.733 32.376 22.108 1.00 37.64 C ATOM 1345 CD GLU B 18 15.229 32.132 21.974 1.00 40.24 C ATOM 1346 OE1 GLU B 18 14.603 32.828 21.191 1.00 40.89 O ATOM 1347 OE2 GLU B 18 14.728 31.254 22.657 1.00 40.39 O ATOM 0 H GLU B 18 18.776 31.780 19.603 1.00 30.66 H new ATOM 0 HA GLU B 18 18.964 34.504 20.731 1.00 33.61 H new ATOM 0 HB2 GLU B 18 16.727 34.235 21.003 1.00 35.91 H new ATOM 0 HB3 GLU B 18 16.896 32.811 19.996 1.00 35.91 H new ATOM 0 HG2 GLU B 18 17.269 31.427 22.104 1.00 37.64 H new ATOM 0 HG3 GLU B 18 16.951 32.862 23.059 1.00 37.64 H new ATOM 1354 N LYS B 19 19.551 31.822 22.548 1.00 34.95 N ATOM 1355 CA LYS B 19 20.163 31.410 23.839 1.00 36.04 C ATOM 1356 C LYS B 19 21.473 32.173 24.037 1.00 35.87 C ATOM 1357 O LYS B 19 21.758 32.682 25.103 1.00 36.90 O ATOM 1358 CB LYS B 19 20.430 29.915 23.814 1.00 36.58 C ATOM 1359 CG LYS B 19 20.577 29.413 25.246 1.00 39.52 C ATOM 1360 CD LYS B 19 20.976 27.961 25.194 1.00 41.12 C ATOM 1361 CE LYS B 19 21.038 27.384 26.607 1.00 43.76 C ATOM 1362 NZ LYS B 19 21.649 28.384 27.527 1.00 45.38 N ATOM 0 H LYS B 19 19.286 31.056 21.929 1.00 34.95 H new ATOM 0 HA LYS B 19 19.486 31.637 24.662 1.00 36.04 H new ATOM 0 HB2 LYS B 19 19.612 29.395 23.315 1.00 36.58 H new ATOM 0 HB3 LYS B 19 21.336 29.704 23.246 1.00 36.58 H new ATOM 0 HG2 LYS B 19 21.329 29.996 25.778 1.00 39.52 H new ATOM 0 HG3 LYS B 19 19.639 29.531 25.789 1.00 39.52 H new ATOM 0 HD2 LYS B 19 20.259 27.400 24.595 1.00 41.12 H new ATOM 0 HD3 LYS B 19 21.946 27.859 24.708 1.00 41.12 H new ATOM 0 HE2 LYS B 19 20.036 27.124 26.949 1.00 43.76 H new ATOM 0 HE3 LYS B 19 21.624 26.465 26.610 1.00 43.76 H new ATOM 0 HZ1 LYS B 19 21.986 27.905 28.386 1.00 45.38 H new ATOM 0 HZ2 LYS B 19 22.450 28.848 27.053 1.00 45.38 H new ATOM 0 HZ3 LYS B 19 20.938 29.098 27.785 1.00 45.38 H new ATOM 1376 N PHE B 20 22.270 32.255 23.005 1.00 35.16 N ATOM 1377 CA PHE B 20 23.565 32.979 23.092 1.00 34.19 C ATOM 1378 C PHE B 20 23.392 34.382 22.508 1.00 34.42 C ATOM 1379 O PHE B 20 24.321 35.162 22.448 1.00 33.94 O ATOM 1380 CB PHE B 20 24.594 32.211 22.272 1.00 34.18 C ATOM 1381 CG PHE B 20 24.992 30.960 23.010 1.00 32.04 C ATOM 1382 CD1 PHE B 20 24.238 29.792 22.853 1.00 31.71 C ATOM 1383 CD2 PHE B 20 26.104 30.969 23.858 1.00 34.13 C ATOM 1384 CE1 PHE B 20 24.597 28.631 23.544 1.00 31.01 C ATOM 1385 CE2 PHE B 20 26.462 29.809 24.552 1.00 33.69 C ATOM 1386 CZ PHE B 20 25.706 28.640 24.395 1.00 32.95 C ATOM 0 H PHE B 20 22.072 31.843 22.093 1.00 35.16 H new ATOM 0 HA PHE B 20 23.892 33.057 24.129 1.00 34.19 H new ATOM 0 HB2 PHE B 20 24.180 31.955 21.297 1.00 34.18 H new ATOM 0 HB3 PHE B 20 25.470 32.834 22.092 1.00 34.18 H new ATOM 0 HD1 PHE B 20 23.379 29.787 22.198 1.00 31.71 H new ATOM 0 HD2 PHE B 20 26.686 31.871 23.977 1.00 34.13 H new ATOM 0 HE1 PHE B 20 24.018 27.728 23.420 1.00 31.01 H new ATOM 0 HE2 PHE B 20 27.320 29.814 25.208 1.00 33.69 H new ATOM 0 HZ PHE B 20 25.980 27.744 24.932 1.00 32.95 H new ATOM 1396 N ARG B 21 22.203 34.700 22.074 1.00 33.90 N ATOM 1397 CA ARG B 21 21.942 36.045 21.488 1.00 35.50 C ATOM 1398 C ARG B 21 22.942 36.334 20.364 1.00 34.22 C ATOM 1399 O ARG B 21 23.364 37.458 20.180 1.00 33.41 O ATOM 1400 CB ARG B 21 22.076 37.123 22.576 1.00 38.56 C ATOM 1401 CG ARG B 21 20.849 37.103 23.508 1.00 42.96 C ATOM 1402 CD ARG B 21 19.723 37.970 22.928 1.00 46.75 C ATOM 1403 NE ARG B 21 18.425 37.569 23.541 1.00 50.46 N ATOM 1404 CZ ARG B 21 17.382 38.344 23.427 1.00 51.88 C ATOM 1405 NH1 ARG B 21 17.472 39.465 22.765 1.00 54.10 N ATOM 1406 NH2 ARG B 21 16.249 37.998 23.973 1.00 54.21 N ATOM 0 H ARG B 21 21.394 34.079 22.101 1.00 33.90 H new ATOM 0 HA ARG B 21 20.930 36.059 21.082 1.00 35.50 H new ATOM 0 HB2 ARG B 21 22.983 36.953 23.156 1.00 38.56 H new ATOM 0 HB3 ARG B 21 22.173 38.105 22.113 1.00 38.56 H new ATOM 0 HG2 ARG B 21 20.499 36.079 23.637 1.00 42.96 H new ATOM 0 HG3 ARG B 21 21.128 37.471 24.495 1.00 42.96 H new ATOM 0 HD2 ARG B 21 19.921 39.023 23.126 1.00 46.75 H new ATOM 0 HD3 ARG B 21 19.679 37.852 21.845 1.00 46.75 H new ATOM 0 HE ARG B 21 18.352 36.688 24.050 1.00 50.46 H new ATOM 0 HH11 ARG B 21 18.358 39.735 22.337 1.00 54.10 H new ATOM 0 HH12 ARG B 21 16.657 40.071 22.676 1.00 54.10 H new ATOM 0 HH21 ARG B 21 16.178 37.121 24.489 1.00 54.21 H new ATOM 0 HH22 ARG B 21 15.434 38.604 23.884 1.00 54.21 H new ATOM 1420 N TYR B 22 23.325 35.342 19.603 1.00 31.03 N ATOM 1421 CA TYR B 22 24.289 35.601 18.501 1.00 30.00 C ATOM 1422 C TYR B 22 23.573 36.423 17.398 1.00 28.60 C ATOM 1423 O TYR B 22 22.390 36.244 17.193 1.00 27.38 O ATOM 1424 CB TYR B 22 24.748 34.257 17.908 1.00 26.97 C ATOM 1425 CG TYR B 22 25.860 33.633 18.745 1.00 28.47 C ATOM 1426 CD1 TYR B 22 27.065 34.321 18.979 1.00 28.83 C ATOM 1427 CD2 TYR B 22 25.682 32.352 19.288 1.00 26.95 C ATOM 1428 CE1 TYR B 22 28.072 33.730 19.752 1.00 27.02 C ATOM 1429 CE2 TYR B 22 26.693 31.765 20.059 1.00 26.27 C ATOM 1430 CZ TYR B 22 27.886 32.455 20.291 1.00 26.46 C ATOM 1431 OH TYR B 22 28.882 31.875 21.051 1.00 23.82 O ATOM 0 H TYR B 22 23.014 34.375 19.697 1.00 31.03 H new ATOM 0 HA TYR B 22 25.151 36.151 18.879 1.00 30.00 H new ATOM 0 HB2 TYR B 22 23.902 33.572 17.855 1.00 26.97 H new ATOM 0 HB3 TYR B 22 25.099 34.408 16.887 1.00 26.97 H new ATOM 0 HD1 TYR B 22 27.213 35.306 18.562 1.00 28.83 H new ATOM 0 HD2 TYR B 22 24.761 31.816 19.111 1.00 26.95 H new ATOM 0 HE1 TYR B 22 28.995 34.261 19.932 1.00 27.02 H new ATOM 0 HE2 TYR B 22 26.551 30.778 20.475 1.00 26.27 H new ATOM 0 HH TYR B 22 28.480 31.275 21.714 1.00 23.82 H new ATOM 1441 N PRO B 23 24.293 37.284 16.697 1.00 29.13 N ATOM 1442 CA PRO B 23 23.693 38.084 15.609 1.00 28.62 C ATOM 1443 C PRO B 23 23.001 37.160 14.590 1.00 28.74 C ATOM 1444 O PRO B 23 23.053 35.955 14.698 1.00 26.54 O ATOM 1445 CB PRO B 23 24.880 38.841 14.968 1.00 29.12 C ATOM 1446 CG PRO B 23 26.160 38.462 15.765 1.00 29.87 C ATOM 1447 CD PRO B 23 25.729 37.535 16.922 1.00 29.51 C ATOM 0 HA PRO B 23 22.928 38.773 15.968 1.00 28.62 H new ATOM 0 HB2 PRO B 23 24.987 38.568 13.918 1.00 29.12 H new ATOM 0 HB3 PRO B 23 24.712 39.917 15.002 1.00 29.12 H new ATOM 0 HG2 PRO B 23 26.879 37.959 15.119 1.00 29.87 H new ATOM 0 HG3 PRO B 23 26.649 39.356 16.152 1.00 29.87 H new ATOM 0 HD2 PRO B 23 26.298 36.605 16.915 1.00 29.51 H new ATOM 0 HD3 PRO B 23 25.900 38.006 17.890 1.00 29.51 H new ATOM 1455 N TRP B 24 22.346 37.729 13.612 1.00 24.77 N ATOM 1456 CA TRP B 24 21.632 36.903 12.584 1.00 26.20 C ATOM 1457 C TRP B 24 22.609 36.372 11.529 1.00 24.23 C ATOM 1458 O TRP B 24 22.277 35.489 10.762 1.00 20.77 O ATOM 1459 CB TRP B 24 20.568 37.770 11.908 1.00 28.27 C ATOM 1460 CG TRP B 24 19.831 36.981 10.868 1.00 30.88 C ATOM 1461 CD1 TRP B 24 19.919 37.193 9.535 1.00 31.38 C ATOM 1462 CD2 TRP B 24 18.889 35.876 11.044 1.00 29.00 C ATOM 1463 NE1 TRP B 24 19.093 36.297 8.882 1.00 31.09 N ATOM 1464 CE2 TRP B 24 18.437 35.465 9.766 1.00 31.07 C ATOM 1465 CE3 TRP B 24 18.385 35.196 12.171 1.00 30.12 C ATOM 1466 CZ2 TRP B 24 17.519 34.424 9.614 1.00 31.07 C ATOM 1467 CZ3 TRP B 24 17.464 34.147 12.017 1.00 31.73 C ATOM 1468 CH2 TRP B 24 17.030 33.766 10.742 1.00 30.51 C ATOM 0 H TRP B 24 22.273 38.737 13.477 1.00 24.77 H new ATOM 0 HA TRP B 24 21.169 36.048 13.077 1.00 26.20 H new ATOM 0 HB2 TRP B 24 19.867 38.143 12.654 1.00 28.27 H new ATOM 0 HB3 TRP B 24 21.037 38.640 11.448 1.00 28.27 H new ATOM 0 HD1 TRP B 24 20.535 37.941 9.058 1.00 31.38 H new ATOM 0 HE1 TRP B 24 18.982 36.256 7.869 1.00 31.09 H new ATOM 0 HE3 TRP B 24 18.709 35.484 13.160 1.00 30.12 H new ATOM 0 HZ2 TRP B 24 17.190 34.130 8.628 1.00 31.07 H new ATOM 0 HZ3 TRP B 24 17.088 33.631 12.888 1.00 31.73 H new ATOM 0 HH2 TRP B 24 16.317 32.963 10.632 1.00 30.51 H new ATOM 1479 N GLU B 25 23.801 36.900 11.465 1.00 21.71 N ATOM 1480 CA GLU B 25 24.771 36.414 10.436 1.00 23.69 C ATOM 1481 C GLU B 25 25.447 35.115 10.904 1.00 22.17 C ATOM 1482 O GLU B 25 26.105 34.452 10.130 1.00 20.98 O ATOM 1483 CB GLU B 25 25.837 37.491 10.169 1.00 29.06 C ATOM 1484 CG GLU B 25 26.189 38.210 11.473 1.00 37.12 C ATOM 1485 CD GLU B 25 27.537 38.922 11.324 1.00 42.03 C ATOM 1486 OE1 GLU B 25 28.479 38.282 10.886 1.00 44.49 O ATOM 1487 OE2 GLU B 25 27.604 40.096 11.650 1.00 44.52 O ATOM 0 H GLU B 25 24.146 37.642 12.075 1.00 21.71 H new ATOM 0 HA GLU B 25 24.226 36.211 9.514 1.00 23.69 H new ATOM 0 HB2 GLU B 25 26.730 37.033 9.743 1.00 29.06 H new ATOM 0 HB3 GLU B 25 25.466 38.208 9.437 1.00 29.06 H new ATOM 0 HG2 GLU B 25 25.411 38.932 11.723 1.00 37.12 H new ATOM 0 HG3 GLU B 25 26.234 37.494 12.293 1.00 37.12 H new ATOM 1494 N LEU B 26 25.314 34.749 12.159 1.00 18.07 N ATOM 1495 CA LEU B 26 25.973 33.492 12.647 1.00 16.50 C ATOM 1496 C LEU B 26 25.017 32.315 12.536 1.00 16.77 C ATOM 1497 O LEU B 26 25.221 31.279 13.136 1.00 16.07 O ATOM 1498 CB LEU B 26 26.406 33.664 14.101 1.00 18.60 C ATOM 1499 CG LEU B 26 27.154 34.994 14.277 1.00 21.90 C ATOM 1500 CD1 LEU B 26 27.914 34.969 15.601 1.00 24.06 C ATOM 1501 CD2 LEU B 26 28.157 35.206 13.133 1.00 25.09 C ATOM 0 H LEU B 26 24.782 35.262 12.862 1.00 18.07 H new ATOM 0 HA LEU B 26 26.849 33.295 12.028 1.00 16.50 H new ATOM 0 HB2 LEU B 26 25.533 33.640 14.753 1.00 18.60 H new ATOM 0 HB3 LEU B 26 27.048 32.835 14.397 1.00 18.60 H new ATOM 0 HG LEU B 26 26.429 35.807 14.268 1.00 21.90 H new ATOM 0 HD11 LEU B 26 28.447 35.910 15.732 1.00 24.06 H new ATOM 0 HD12 LEU B 26 27.210 34.833 16.422 1.00 24.06 H new ATOM 0 HD13 LEU B 26 28.628 34.145 15.595 1.00 24.06 H new ATOM 0 HD21 LEU B 26 28.677 36.153 13.276 1.00 25.09 H new ATOM 0 HD22 LEU B 26 28.882 34.392 13.129 1.00 25.09 H new ATOM 0 HD23 LEU B 26 27.625 35.224 12.182 1.00 25.09 H new ATOM 1513 N MET B 27 23.990 32.449 11.753 1.00 15.51 N ATOM 1514 CA MET B 27 23.054 31.321 11.589 1.00 15.51 C ATOM 1515 C MET B 27 23.811 30.102 11.007 1.00 15.79 C ATOM 1516 O MET B 27 23.596 28.997 11.464 1.00 14.86 O ATOM 1517 CB MET B 27 21.894 31.736 10.658 1.00 16.03 C ATOM 1518 CG MET B 27 20.719 32.341 11.440 1.00 14.48 C ATOM 1519 SD MET B 27 19.210 32.003 10.515 1.00 11.00 S ATOM 1520 CE MET B 27 18.844 30.414 11.278 1.00 16.96 C ATOM 0 H MET B 27 23.762 33.290 11.223 1.00 15.51 H new ATOM 0 HA MET B 27 22.638 31.046 12.558 1.00 15.51 H new ATOM 0 HB2 MET B 27 22.256 32.461 9.928 1.00 16.03 H new ATOM 0 HB3 MET B 27 21.548 30.866 10.099 1.00 16.03 H new ATOM 0 HG2 MET B 27 20.661 31.907 12.438 1.00 14.48 H new ATOM 0 HG3 MET B 27 20.857 33.415 11.567 1.00 14.48 H new ATOM 0 HE1 MET B 27 17.928 30.007 10.849 1.00 16.96 H new ATOM 0 HE2 MET B 27 19.668 29.724 11.096 1.00 16.96 H new ATOM 0 HE3 MET B 27 18.714 30.547 12.352 1.00 16.96 H new ATOM 1530 N PRO B 28 24.680 30.310 10.023 1.00 15.25 N ATOM 1531 CA PRO B 28 25.439 29.193 9.428 1.00 16.18 C ATOM 1532 C PRO B 28 26.292 28.522 10.507 1.00 15.53 C ATOM 1533 O PRO B 28 26.675 27.385 10.380 1.00 16.52 O ATOM 1534 CB PRO B 28 26.307 29.852 8.328 1.00 16.78 C ATOM 1535 CG PRO B 28 25.752 31.282 8.134 1.00 19.84 C ATOM 1536 CD PRO B 28 24.986 31.626 9.418 1.00 17.18 C ATOM 0 HA PRO B 28 24.805 28.411 9.010 1.00 16.18 H new ATOM 0 HB2 PRO B 28 27.356 29.879 8.625 1.00 16.78 H new ATOM 0 HB3 PRO B 28 26.253 29.285 7.399 1.00 16.78 H new ATOM 0 HG2 PRO B 28 26.560 31.993 7.962 1.00 19.84 H new ATOM 0 HG3 PRO B 28 25.095 31.329 7.265 1.00 19.84 H new ATOM 0 HD2 PRO B 28 25.587 32.242 10.087 1.00 17.18 H new ATOM 0 HD3 PRO B 28 24.076 32.186 9.201 1.00 17.18 H new ATOM 1544 N LEU B 29 26.580 29.213 11.577 1.00 13.35 N ATOM 1545 CA LEU B 29 27.392 28.595 12.664 1.00 12.43 C ATOM 1546 C LEU B 29 26.455 27.842 13.607 1.00 12.94 C ATOM 1547 O LEU B 29 26.631 26.665 13.853 1.00 13.87 O ATOM 1548 CB LEU B 29 28.156 29.684 13.423 1.00 15.82 C ATOM 1549 CG LEU B 29 28.908 30.577 12.430 1.00 12.60 C ATOM 1550 CD1 LEU B 29 29.834 31.513 13.209 1.00 13.73 C ATOM 1551 CD2 LEU B 29 29.742 29.708 11.469 1.00 13.81 C ATOM 0 H LEU B 29 26.289 30.176 11.745 1.00 13.35 H new ATOM 0 HA LEU B 29 28.117 27.899 12.242 1.00 12.43 H new ATOM 0 HB2 LEU B 29 27.463 30.284 14.013 1.00 15.82 H new ATOM 0 HB3 LEU B 29 28.858 29.229 14.121 1.00 15.82 H new ATOM 0 HG LEU B 29 28.193 31.160 11.849 1.00 12.60 H new ATOM 0 HD11 LEU B 29 30.374 32.153 12.512 1.00 13.73 H new ATOM 0 HD12 LEU B 29 29.242 32.130 13.885 1.00 13.73 H new ATOM 0 HD13 LEU B 29 30.546 30.923 13.786 1.00 13.73 H new ATOM 0 HD21 LEU B 29 30.273 30.350 10.766 1.00 13.81 H new ATOM 0 HD22 LEU B 29 30.461 29.122 12.040 1.00 13.81 H new ATOM 0 HD23 LEU B 29 29.082 29.037 10.919 1.00 13.81 H new ATOM 1563 N MET B 30 25.439 28.490 14.117 1.00 13.14 N ATOM 1564 CA MET B 30 24.491 27.771 15.009 1.00 14.92 C ATOM 1565 C MET B 30 23.990 26.542 14.258 1.00 15.06 C ATOM 1566 O MET B 30 23.741 25.499 14.829 1.00 14.78 O ATOM 1567 CB MET B 30 23.295 28.669 15.334 1.00 14.70 C ATOM 1568 CG MET B 30 23.733 29.856 16.190 1.00 10.57 C ATOM 1569 SD MET B 30 24.346 29.263 17.790 1.00 7.09 S ATOM 1570 CE MET B 30 26.086 29.711 17.571 1.00 13.40 C ATOM 0 H MET B 30 25.229 29.475 13.955 1.00 13.14 H new ATOM 0 HA MET B 30 24.989 27.492 15.937 1.00 14.92 H new ATOM 0 HB2 MET B 30 22.840 29.027 14.410 1.00 14.70 H new ATOM 0 HB3 MET B 30 22.534 28.094 15.862 1.00 14.70 H new ATOM 0 HG2 MET B 30 24.513 30.419 15.677 1.00 10.57 H new ATOM 0 HG3 MET B 30 22.895 30.537 16.340 1.00 10.57 H new ATOM 0 HE1 MET B 30 26.650 29.427 18.460 1.00 13.40 H new ATOM 0 HE2 MET B 30 26.490 29.190 16.703 1.00 13.40 H new ATOM 0 HE3 MET B 30 26.168 30.787 17.418 1.00 13.40 H new ATOM 1580 N TYR B 31 23.841 26.674 12.969 1.00 13.82 N ATOM 1581 CA TYR B 31 23.356 25.537 12.144 1.00 14.24 C ATOM 1582 C TYR B 31 24.329 24.355 12.259 1.00 15.20 C ATOM 1583 O TYR B 31 23.954 23.266 12.645 1.00 15.23 O ATOM 1584 CB TYR B 31 23.254 25.983 10.682 1.00 15.18 C ATOM 1585 CG TYR B 31 22.931 24.794 9.809 1.00 19.70 C ATOM 1586 CD1 TYR B 31 23.966 23.977 9.340 1.00 21.03 C ATOM 1587 CD2 TYR B 31 21.603 24.509 9.466 1.00 22.09 C ATOM 1588 CE1 TYR B 31 23.678 22.876 8.531 1.00 22.51 C ATOM 1589 CE2 TYR B 31 21.316 23.404 8.657 1.00 25.56 C ATOM 1590 CZ TYR B 31 22.352 22.588 8.188 1.00 25.00 C ATOM 1591 OH TYR B 31 22.067 21.500 7.388 1.00 30.46 O ATOM 0 H TYR B 31 24.037 27.530 12.449 1.00 13.82 H new ATOM 0 HA TYR B 31 22.375 25.223 12.500 1.00 14.24 H new ATOM 0 HB2 TYR B 31 22.481 26.744 10.577 1.00 15.18 H new ATOM 0 HB3 TYR B 31 24.193 26.436 10.363 1.00 15.18 H new ATOM 0 HD1 TYR B 31 24.989 24.199 9.604 1.00 21.03 H new ATOM 0 HD2 TYR B 31 20.803 25.140 9.825 1.00 22.09 H new ATOM 0 HE1 TYR B 31 24.478 22.247 8.170 1.00 22.51 H new ATOM 0 HE2 TYR B 31 20.293 23.180 8.394 1.00 25.56 H new ATOM 0 HH TYR B 31 21.099 21.442 7.247 1.00 30.46 H new ATOM 1601 N VAL B 32 25.573 24.559 11.915 1.00 14.03 N ATOM 1602 CA VAL B 32 26.565 23.444 11.990 1.00 12.14 C ATOM 1603 C VAL B 32 26.619 22.880 13.411 1.00 12.91 C ATOM 1604 O VAL B 32 26.480 21.691 13.619 1.00 14.47 O ATOM 1605 CB VAL B 32 27.953 23.961 11.592 1.00 12.64 C ATOM 1606 CG1 VAL B 32 28.943 22.799 11.593 1.00 12.95 C ATOM 1607 CG2 VAL B 32 27.891 24.578 10.190 1.00 14.27 C ATOM 0 H VAL B 32 25.946 25.449 11.585 1.00 14.03 H new ATOM 0 HA VAL B 32 26.259 22.653 11.305 1.00 12.14 H new ATOM 0 HB VAL B 32 28.277 24.719 12.305 1.00 12.64 H new ATOM 0 HG11 VAL B 32 29.931 23.163 11.311 1.00 12.95 H new ATOM 0 HG12 VAL B 32 28.989 22.361 12.590 1.00 12.95 H new ATOM 0 HG13 VAL B 32 28.617 22.043 10.879 1.00 12.95 H new ATOM 0 HG21 VAL B 32 28.879 24.945 9.910 1.00 14.27 H new ATOM 0 HG22 VAL B 32 27.568 23.822 9.474 1.00 14.27 H new ATOM 0 HG23 VAL B 32 27.183 25.406 10.188 1.00 14.27 H new ATOM 1617 N ILE B 33 26.824 23.721 14.387 1.00 13.72 N ATOM 1618 CA ILE B 33 26.891 23.245 15.799 1.00 9.81 C ATOM 1619 C ILE B 33 25.774 22.222 16.066 1.00 12.06 C ATOM 1620 O ILE B 33 26.020 21.116 16.505 1.00 13.15 O ATOM 1621 CB ILE B 33 26.750 24.477 16.702 1.00 11.56 C ATOM 1622 CG1 ILE B 33 28.074 25.258 16.653 1.00 12.90 C ATOM 1623 CG2 ILE B 33 26.439 24.067 18.146 1.00 12.06 C ATOM 1624 CD1 ILE B 33 27.932 26.633 17.314 1.00 11.54 C ATOM 0 H ILE B 33 26.949 24.726 14.266 1.00 13.72 H new ATOM 0 HA ILE B 33 27.838 22.744 16.001 1.00 9.81 H new ATOM 0 HB ILE B 33 25.925 25.096 16.349 1.00 11.56 H new ATOM 0 HG12 ILE B 33 28.854 24.688 17.158 1.00 12.90 H new ATOM 0 HG13 ILE B 33 28.389 25.381 15.617 1.00 12.90 H new ATOM 0 HG21 ILE B 33 26.344 24.959 18.765 1.00 12.06 H new ATOM 0 HG22 ILE B 33 25.505 23.506 18.172 1.00 12.06 H new ATOM 0 HG23 ILE B 33 27.247 23.444 18.529 1.00 12.06 H new ATOM 0 HD11 ILE B 33 28.884 27.161 17.264 1.00 11.54 H new ATOM 0 HD12 ILE B 33 27.169 27.210 16.792 1.00 11.54 H new ATOM 0 HD13 ILE B 33 27.642 26.507 18.357 1.00 11.54 H new ATOM 1636 N LEU B 34 24.560 22.582 15.784 1.00 13.55 N ATOM 1637 CA LEU B 34 23.407 21.651 15.988 1.00 16.27 C ATOM 1638 C LEU B 34 23.631 20.375 15.150 1.00 18.00 C ATOM 1639 O LEU B 34 23.369 19.277 15.597 1.00 20.35 O ATOM 1640 CB LEU B 34 22.126 22.404 15.513 1.00 15.33 C ATOM 1641 CG LEU B 34 21.130 22.881 16.651 1.00 18.88 C ATOM 1642 CD1 LEU B 34 21.626 22.669 18.088 1.00 18.63 C ATOM 1643 CD2 LEU B 34 20.838 24.382 16.478 1.00 18.04 C ATOM 0 H LEU B 34 24.306 23.498 15.413 1.00 13.55 H new ATOM 0 HA LEU B 34 23.306 21.356 17.032 1.00 16.27 H new ATOM 0 HB2 LEU B 34 22.435 23.278 14.940 1.00 15.33 H new ATOM 0 HB3 LEU B 34 21.580 21.753 14.831 1.00 15.33 H new ATOM 0 HG LEU B 34 20.245 22.257 16.528 1.00 18.88 H new ATOM 0 HD11 LEU B 34 20.873 23.028 18.790 1.00 18.63 H new ATOM 0 HD12 LEU B 34 21.804 21.607 18.258 1.00 18.63 H new ATOM 0 HD13 LEU B 34 22.554 23.221 18.238 1.00 18.63 H new ATOM 0 HD21 LEU B 34 20.153 24.712 17.259 1.00 18.04 H new ATOM 0 HD22 LEU B 34 21.769 24.944 16.550 1.00 18.04 H new ATOM 0 HD23 LEU B 34 20.385 24.554 15.502 1.00 18.04 H new ATOM 1655 N LYS B 35 24.104 20.513 13.945 1.00 16.90 N ATOM 1656 CA LYS B 35 24.334 19.308 13.085 1.00 19.51 C ATOM 1657 C LYS B 35 25.198 18.298 13.832 1.00 18.97 C ATOM 1658 O LYS B 35 25.129 17.108 13.596 1.00 18.29 O ATOM 1659 CB LYS B 35 25.053 19.732 11.798 1.00 23.32 C ATOM 1660 CG LYS B 35 25.053 18.567 10.805 1.00 27.46 C ATOM 1661 CD LYS B 35 25.614 19.038 9.461 1.00 30.03 C ATOM 1662 CE LYS B 35 25.320 17.988 8.389 1.00 33.24 C ATOM 1663 NZ LYS B 35 23.847 17.880 8.190 1.00 34.14 N ATOM 0 H LYS B 35 24.343 21.406 13.513 1.00 16.90 H new ATOM 0 HA LYS B 35 23.374 18.853 12.840 1.00 19.51 H new ATOM 0 HB2 LYS B 35 24.556 20.597 11.360 1.00 23.32 H new ATOM 0 HB3 LYS B 35 26.076 20.032 12.023 1.00 23.32 H new ATOM 0 HG2 LYS B 35 25.654 17.745 11.193 1.00 27.46 H new ATOM 0 HG3 LYS B 35 24.040 18.187 10.675 1.00 27.46 H new ATOM 0 HD2 LYS B 35 25.167 19.992 9.183 1.00 30.03 H new ATOM 0 HD3 LYS B 35 26.689 19.201 9.541 1.00 30.03 H new ATOM 0 HE2 LYS B 35 25.805 18.263 7.452 1.00 33.24 H new ATOM 0 HE3 LYS B 35 25.729 17.023 8.688 1.00 33.24 H new ATOM 0 HZ1 LYS B 35 23.649 17.589 7.211 1.00 34.14 H new ATOM 0 HZ2 LYS B 35 23.459 17.173 8.847 1.00 34.14 H new ATOM 0 HZ3 LYS B 35 23.403 18.803 8.373 1.00 34.14 H new ATOM 1677 N ASP B 36 26.020 18.766 14.720 1.00 17.40 N ATOM 1678 CA ASP B 36 26.910 17.852 15.482 1.00 17.99 C ATOM 1679 C ASP B 36 26.199 17.343 16.735 1.00 20.53 C ATOM 1680 O ASP B 36 26.256 16.176 17.068 1.00 21.50 O ATOM 1681 CB ASP B 36 28.156 18.634 15.874 1.00 17.75 C ATOM 1682 CG ASP B 36 28.602 19.470 14.671 1.00 19.30 C ATOM 1683 OD1 ASP B 36 28.817 18.891 13.619 1.00 17.31 O ATOM 1684 OD2 ASP B 36 28.722 20.675 14.824 1.00 18.21 O ATOM 0 H ASP B 36 26.116 19.754 14.955 1.00 17.40 H new ATOM 0 HA ASP B 36 27.176 16.990 14.870 1.00 17.99 H new ATOM 0 HB2 ASP B 36 27.946 19.279 16.727 1.00 17.75 H new ATOM 0 HB3 ASP B 36 28.951 17.953 16.178 1.00 17.75 H new ATOM 1689 N ALA B 37 25.543 18.218 17.437 1.00 17.76 N ATOM 1690 CA ALA B 37 24.839 17.807 18.681 1.00 20.31 C ATOM 1691 C ALA B 37 23.502 17.158 18.332 1.00 21.98 C ATOM 1692 O ALA B 37 22.531 17.304 19.048 1.00 20.93 O ATOM 1693 CB ALA B 37 24.600 19.056 19.535 1.00 16.79 C ATOM 0 H ALA B 37 25.463 19.207 17.202 1.00 17.76 H new ATOM 0 HA ALA B 37 25.444 17.085 19.230 1.00 20.31 H new ATOM 0 HB1 ALA B 37 24.084 18.776 20.453 1.00 16.79 H new ATOM 0 HB2 ALA B 37 25.557 19.516 19.782 1.00 16.79 H new ATOM 0 HB3 ALA B 37 23.989 19.766 18.978 1.00 16.79 H new ATOM 1699 N ASP B 38 23.430 16.459 17.243 1.00 22.08 N ATOM 1700 CA ASP B 38 22.137 15.835 16.876 1.00 24.70 C ATOM 1701 C ASP B 38 21.079 16.938 16.823 1.00 27.43 C ATOM 1702 O ASP B 38 19.892 16.683 16.820 1.00 26.89 O ATOM 1703 CB ASP B 38 21.761 14.793 17.939 1.00 26.17 C ATOM 1704 CG ASP B 38 20.785 13.773 17.346 1.00 26.41 C ATOM 1705 OD1 ASP B 38 19.882 14.189 16.639 1.00 29.79 O ATOM 1706 OD2 ASP B 38 20.957 12.594 17.610 1.00 30.65 O ATOM 0 H ASP B 38 24.201 16.293 16.596 1.00 22.08 H new ATOM 0 HA ASP B 38 22.206 15.339 15.908 1.00 24.70 H new ATOM 0 HB2 ASP B 38 22.657 14.286 18.297 1.00 26.17 H new ATOM 0 HB3 ASP B 38 21.308 15.285 18.799 1.00 26.17 H new ATOM 1711 N ALA B 39 21.524 18.166 16.788 1.00 25.83 N ATOM 1712 CA ALA B 39 20.590 19.319 16.742 1.00 28.40 C ATOM 1713 C ALA B 39 19.941 19.515 18.116 1.00 30.32 C ATOM 1714 O ALA B 39 18.934 20.181 18.248 1.00 32.55 O ATOM 1715 CB ALA B 39 19.526 19.072 15.670 1.00 28.82 C ATOM 0 H ALA B 39 22.512 18.418 16.790 1.00 25.83 H new ATOM 0 HA ALA B 39 21.138 20.226 16.487 1.00 28.40 H new ATOM 0 HB1 ALA B 39 18.840 19.919 15.636 1.00 28.82 H new ATOM 0 HB2 ALA B 39 20.008 18.956 14.699 1.00 28.82 H new ATOM 0 HB3 ALA B 39 18.971 18.165 15.910 1.00 28.82 H new ATOM 1721 N ASN B 40 20.521 18.950 19.143 1.00 29.50 N ATOM 1722 CA ASN B 40 19.951 19.113 20.514 1.00 32.01 C ATOM 1723 C ASN B 40 20.598 20.334 21.175 1.00 32.47 C ATOM 1724 O ASN B 40 21.743 20.300 21.578 1.00 29.40 O ATOM 1725 CB ASN B 40 20.244 17.857 21.345 1.00 33.06 C ATOM 1726 CG ASN B 40 19.892 18.107 22.809 1.00 33.55 C ATOM 1727 OD1 ASN B 40 20.408 19.017 23.417 1.00 35.11 O ATOM 1728 ND2 ASN B 40 19.028 17.331 23.404 1.00 33.85 N ATOM 0 H ASN B 40 21.366 18.382 19.091 1.00 29.50 H new ATOM 0 HA ASN B 40 18.872 19.255 20.454 1.00 32.01 H new ATOM 0 HB2 ASN B 40 19.667 17.015 20.962 1.00 33.06 H new ATOM 0 HB3 ASN B 40 21.297 17.589 21.256 1.00 33.06 H new ATOM 0 HD21 ASN B 40 18.787 17.491 24.382 1.00 33.85 H new ATOM 0 HD22 ASN B 40 18.593 16.564 22.891 1.00 33.85 H new ATOM 1735 N ILE B 41 19.872 21.410 21.283 1.00 33.58 N ATOM 1736 CA ILE B 41 20.438 22.639 21.910 1.00 35.14 C ATOM 1737 C ILE B 41 21.101 22.288 23.245 1.00 34.57 C ATOM 1738 O ILE B 41 22.262 22.567 23.462 1.00 33.97 O ATOM 1739 CB ILE B 41 19.304 23.649 22.139 1.00 38.72 C ATOM 1740 CG1 ILE B 41 18.840 24.156 20.755 1.00 39.13 C ATOM 1741 CG2 ILE B 41 19.779 24.822 23.056 1.00 40.27 C ATOM 1742 CD1 ILE B 41 17.787 25.266 20.892 1.00 40.55 C ATOM 0 H ILE B 41 18.907 21.493 20.963 1.00 33.58 H new ATOM 0 HA ILE B 41 21.190 23.073 21.251 1.00 35.14 H new ATOM 0 HB ILE B 41 18.469 23.175 22.655 1.00 38.72 H new ATOM 0 HG12 ILE B 41 19.697 24.532 20.197 1.00 39.13 H new ATOM 0 HG13 ILE B 41 18.425 23.327 20.182 1.00 39.13 H new ATOM 0 HG21 ILE B 41 18.958 25.524 23.203 1.00 40.27 H new ATOM 0 HG22 ILE B 41 20.094 24.425 24.021 1.00 40.27 H new ATOM 0 HG23 ILE B 41 20.616 25.336 22.584 1.00 40.27 H new ATOM 0 HD11 ILE B 41 17.481 25.601 19.901 1.00 40.55 H new ATOM 0 HD12 ILE B 41 16.920 24.881 21.429 1.00 40.55 H new ATOM 0 HD13 ILE B 41 18.212 26.105 21.444 1.00 40.55 H new ATOM 1754 N GLU B 42 20.370 21.696 24.147 1.00 35.46 N ATOM 1755 CA GLU B 42 20.958 21.348 25.472 1.00 34.62 C ATOM 1756 C GLU B 42 22.326 20.690 25.284 1.00 31.10 C ATOM 1757 O GLU B 42 23.249 20.930 26.038 1.00 29.48 O ATOM 1758 CB GLU B 42 20.020 20.386 26.207 1.00 40.18 C ATOM 1759 CG GLU B 42 18.756 21.134 26.639 1.00 46.15 C ATOM 1760 CD GLU B 42 17.922 20.238 27.556 1.00 50.80 C ATOM 1761 OE1 GLU B 42 18.373 19.967 28.657 1.00 53.92 O ATOM 1762 OE2 GLU B 42 16.846 19.838 27.143 1.00 52.61 O ATOM 0 H GLU B 42 19.391 21.438 24.025 1.00 35.46 H new ATOM 0 HA GLU B 42 21.082 22.258 26.059 1.00 34.62 H new ATOM 0 HB2 GLU B 42 19.757 19.551 25.558 1.00 40.18 H new ATOM 0 HB3 GLU B 42 20.523 19.966 27.078 1.00 40.18 H new ATOM 0 HG2 GLU B 42 19.024 22.054 27.158 1.00 46.15 H new ATOM 0 HG3 GLU B 42 18.173 21.420 25.764 1.00 46.15 H new ATOM 1769 N GLU B 43 22.467 19.866 24.285 1.00 26.75 N ATOM 1770 CA GLU B 43 23.778 19.196 24.046 1.00 25.31 C ATOM 1771 C GLU B 43 24.653 20.106 23.182 1.00 22.10 C ATOM 1772 O GLU B 43 25.856 20.163 23.345 1.00 21.22 O ATOM 1773 CB GLU B 43 23.547 17.863 23.327 1.00 24.85 C ATOM 1774 CG GLU B 43 24.801 16.991 23.443 1.00 27.31 C ATOM 1775 CD GLU B 43 24.921 16.446 24.869 1.00 29.91 C ATOM 1776 OE1 GLU B 43 23.901 16.331 25.527 1.00 28.72 O ATOM 1777 OE2 GLU B 43 26.033 16.153 25.277 1.00 30.00 O ATOM 0 H GLU B 43 21.731 19.626 23.621 1.00 26.75 H new ATOM 0 HA GLU B 43 24.276 19.007 24.997 1.00 25.31 H new ATOM 0 HB2 GLU B 43 22.692 17.347 23.763 1.00 24.85 H new ATOM 0 HB3 GLU B 43 23.311 18.041 22.278 1.00 24.85 H new ATOM 0 HG2 GLU B 43 24.750 16.167 22.732 1.00 27.31 H new ATOM 0 HG3 GLU B 43 25.686 17.575 23.191 1.00 27.31 H new ATOM 1784 N ALA B 44 24.058 20.826 22.267 1.00 21.46 N ATOM 1785 CA ALA B 44 24.861 21.735 21.403 1.00 22.00 C ATOM 1786 C ALA B 44 25.340 22.921 22.248 1.00 21.74 C ATOM 1787 O ALA B 44 26.445 23.400 22.096 1.00 19.07 O ATOM 1788 CB ALA B 44 24.001 22.217 20.213 1.00 22.06 C ATOM 0 H ALA B 44 23.055 20.823 22.083 1.00 21.46 H new ATOM 0 HA ALA B 44 25.728 21.209 21.003 1.00 22.00 H new ATOM 0 HB1 ALA B 44 24.592 22.882 19.583 1.00 22.06 H new ATOM 0 HB2 ALA B 44 23.675 21.357 19.628 1.00 22.06 H new ATOM 0 HB3 ALA B 44 23.129 22.752 20.588 1.00 22.06 H new ATOM 1794 N SER B 45 24.515 23.387 23.141 1.00 21.72 N ATOM 1795 CA SER B 45 24.915 24.532 24.003 1.00 24.00 C ATOM 1796 C SER B 45 26.123 24.130 24.849 1.00 24.30 C ATOM 1797 O SER B 45 27.092 24.856 24.950 1.00 23.27 O ATOM 1798 CB SER B 45 23.751 24.901 24.920 1.00 25.03 C ATOM 1799 OG SER B 45 23.796 24.087 26.085 1.00 28.51 O ATOM 0 H SER B 45 23.578 23.023 23.312 1.00 21.72 H new ATOM 0 HA SER B 45 25.176 25.388 23.381 1.00 24.00 H new ATOM 0 HB2 SER B 45 23.809 25.954 25.195 1.00 25.03 H new ATOM 0 HB3 SER B 45 22.804 24.760 24.400 1.00 25.03 H new ATOM 0 HG SER B 45 23.512 23.177 25.859 1.00 28.51 H new ATOM 1805 N ARG B 46 26.073 22.976 25.459 1.00 26.45 N ATOM 1806 CA ARG B 46 27.219 22.526 26.299 1.00 27.79 C ATOM 1807 C ARG B 46 28.523 22.710 25.518 1.00 26.86 C ATOM 1808 O ARG B 46 29.545 23.059 26.074 1.00 25.99 O ATOM 1809 CB ARG B 46 27.035 21.048 26.669 1.00 31.64 C ATOM 1810 CG ARG B 46 26.023 20.928 27.813 1.00 39.02 C ATOM 1811 CD ARG B 46 25.565 19.472 27.948 1.00 43.92 C ATOM 1812 NE ARG B 46 26.700 18.561 27.631 1.00 48.12 N ATOM 1813 CZ ARG B 46 26.639 17.302 27.969 1.00 50.42 C ATOM 1814 NH1 ARG B 46 25.587 16.842 28.588 1.00 52.31 N ATOM 1815 NH2 ARG B 46 27.633 16.504 27.689 1.00 52.39 N ATOM 0 H ARG B 46 25.288 22.326 25.412 1.00 26.45 H new ATOM 0 HA ARG B 46 27.260 23.119 27.212 1.00 27.79 H new ATOM 0 HB2 ARG B 46 26.688 20.486 25.802 1.00 31.64 H new ATOM 0 HB3 ARG B 46 27.990 20.616 26.968 1.00 31.64 H new ATOM 0 HG2 ARG B 46 26.473 21.266 28.746 1.00 39.02 H new ATOM 0 HG3 ARG B 46 25.165 21.573 27.622 1.00 39.02 H new ATOM 0 HD2 ARG B 46 25.207 19.285 28.960 1.00 43.92 H new ATOM 0 HD3 ARG B 46 24.731 19.278 27.274 1.00 43.92 H new ATOM 0 HE ARG B 46 27.524 18.921 27.150 1.00 48.12 H new ATOM 0 HH11 ARG B 46 24.811 17.466 28.808 1.00 52.31 H new ATOM 0 HH12 ARG B 46 25.540 15.858 28.852 1.00 52.31 H new ATOM 0 HH21 ARG B 46 28.456 16.865 27.207 1.00 52.39 H new ATOM 0 HH22 ARG B 46 27.587 15.520 27.953 1.00 52.39 H new ATOM 1829 N ARG B 47 28.495 22.492 24.231 1.00 22.86 N ATOM 1830 CA ARG B 47 29.734 22.671 23.422 1.00 20.88 C ATOM 1831 C ARG B 47 30.076 24.156 23.386 1.00 18.23 C ATOM 1832 O ARG B 47 31.117 24.580 23.848 1.00 21.17 O ATOM 1833 CB ARG B 47 29.503 22.176 21.991 1.00 19.97 C ATOM 1834 CG ARG B 47 28.928 20.754 22.006 1.00 21.43 C ATOM 1835 CD ARG B 47 28.454 20.380 20.595 1.00 22.98 C ATOM 1836 NE ARG B 47 27.560 19.176 20.659 1.00 20.54 N ATOM 1837 CZ ARG B 47 27.954 18.055 21.203 1.00 24.59 C ATOM 1838 NH1 ARG B 47 29.199 17.887 21.553 1.00 24.12 N ATOM 1839 NH2 ARG B 47 27.106 17.073 21.347 1.00 16.51 N ATOM 0 H ARG B 47 27.671 22.199 23.707 1.00 22.86 H new ATOM 0 HA ARG B 47 30.548 22.100 23.868 1.00 20.88 H new ATOM 0 HB2 ARG B 47 28.818 22.847 21.473 1.00 19.97 H new ATOM 0 HB3 ARG B 47 30.442 22.190 21.438 1.00 19.97 H new ATOM 0 HG2 ARG B 47 29.685 20.047 22.346 1.00 21.43 H new ATOM 0 HG3 ARG B 47 28.097 20.694 22.709 1.00 21.43 H new ATOM 0 HD2 ARG B 47 27.919 21.218 20.148 1.00 22.98 H new ATOM 0 HD3 ARG B 47 29.313 20.173 19.956 1.00 22.98 H new ATOM 0 HE ARG B 47 26.620 19.234 20.267 1.00 20.54 H new ATOM 0 HH11 ARG B 47 29.876 18.635 21.403 1.00 24.12 H new ATOM 0 HH12 ARG B 47 29.495 17.008 21.977 1.00 24.12 H new ATOM 0 HH21 ARG B 47 26.141 17.183 21.036 1.00 16.51 H new ATOM 0 HH22 ARG B 47 27.408 16.196 21.771 1.00 16.51 H new ATOM 1853 N ILE B 48 29.189 24.953 22.858 1.00 16.11 N ATOM 1854 CA ILE B 48 29.432 26.424 22.808 1.00 18.86 C ATOM 1855 C ILE B 48 29.891 26.874 24.182 1.00 23.26 C ATOM 1856 O ILE B 48 30.949 27.444 24.350 1.00 21.90 O ATOM 1857 CB ILE B 48 28.131 27.130 22.447 1.00 18.65 C ATOM 1858 CG1 ILE B 48 27.573 26.486 21.179 1.00 19.26 C ATOM 1859 CG2 ILE B 48 28.417 28.612 22.208 1.00 21.02 C ATOM 1860 CD1 ILE B 48 26.336 27.249 20.689 1.00 15.25 C ATOM 0 H ILE B 48 28.302 24.648 22.457 1.00 16.11 H new ATOM 0 HA ILE B 48 30.190 26.664 22.062 1.00 18.86 H new ATOM 0 HB ILE B 48 27.404 27.039 23.254 1.00 18.65 H new ATOM 0 HG12 ILE B 48 28.336 26.480 20.401 1.00 19.26 H new ATOM 0 HG13 ILE B 48 27.312 25.446 21.377 1.00 19.26 H new ATOM 0 HG21 ILE B 48 27.490 29.124 21.949 1.00 21.02 H new ATOM 0 HG22 ILE B 48 28.834 29.053 23.113 1.00 21.02 H new ATOM 0 HG23 ILE B 48 29.131 28.718 21.391 1.00 21.02 H new ATOM 0 HD11 ILE B 48 25.952 26.777 19.785 1.00 15.25 H new ATOM 0 HD12 ILE B 48 25.568 27.232 21.462 1.00 15.25 H new ATOM 0 HD13 ILE B 48 26.608 28.282 20.471 1.00 15.25 H new ATOM 1872 N GLU B 49 29.099 26.589 25.167 1.00 24.41 N ATOM 1873 CA GLU B 49 29.456 26.961 26.560 1.00 29.72 C ATOM 1874 C GLU B 49 30.909 26.609 26.826 1.00 31.01 C ATOM 1875 O GLU B 49 31.733 27.461 27.095 1.00 30.32 O ATOM 1876 CB GLU B 49 28.619 26.117 27.504 1.00 30.86 C ATOM 1877 CG GLU B 49 27.207 26.694 27.644 1.00 35.37 C ATOM 1878 CD GLU B 49 26.506 26.037 28.835 1.00 37.77 C ATOM 1879 OE1 GLU B 49 26.791 26.429 29.955 1.00 38.92 O ATOM 1880 OE2 GLU B 49 25.695 25.155 28.607 1.00 38.78 O ATOM 0 H GLU B 49 28.206 26.107 25.068 1.00 24.41 H new ATOM 0 HA GLU B 49 29.286 28.028 26.705 1.00 29.72 H new ATOM 0 HB2 GLU B 49 28.563 25.094 27.132 1.00 30.86 H new ATOM 0 HB3 GLU B 49 29.098 26.074 28.482 1.00 30.86 H new ATOM 0 HG2 GLU B 49 27.256 27.774 27.787 1.00 35.37 H new ATOM 0 HG3 GLU B 49 26.638 26.519 26.731 1.00 35.37 H new ATOM 1887 N GLU B 50 31.229 25.344 26.740 1.00 31.22 N ATOM 1888 CA GLU B 50 32.628 24.925 26.974 1.00 30.52 C ATOM 1889 C GLU B 50 33.483 25.804 26.089 1.00 30.97 C ATOM 1890 O GLU B 50 34.462 26.348 26.504 1.00 30.11 O ATOM 1891 CB GLU B 50 32.783 23.436 26.595 1.00 33.65 C ATOM 1892 CG GLU B 50 33.871 22.773 27.449 1.00 34.45 C ATOM 1893 CD GLU B 50 33.897 21.270 27.165 1.00 36.26 C ATOM 1894 OE1 GLU B 50 32.850 20.650 27.260 1.00 35.94 O ATOM 1895 OE2 GLU B 50 34.963 20.763 26.857 1.00 36.07 O ATOM 0 H GLU B 50 30.579 24.590 26.518 1.00 31.22 H new ATOM 0 HA GLU B 50 32.924 25.030 28.018 1.00 30.52 H new ATOM 0 HB2 GLU B 50 31.835 22.918 26.738 1.00 33.65 H new ATOM 0 HB3 GLU B 50 33.038 23.348 25.539 1.00 33.65 H new ATOM 0 HG2 GLU B 50 34.843 23.213 27.225 1.00 34.45 H new ATOM 0 HG3 GLU B 50 33.677 22.951 28.507 1.00 34.45 H new ATOM 1902 N GLY B 51 33.054 25.975 24.882 1.00 0.00 N ATOM 1903 CA GLY B 51 33.782 26.842 23.922 1.00 0.00 C ATOM 1904 C GLY B 51 33.983 28.249 24.505 1.00 0.00 C ATOM 1905 O GLY B 51 35.085 28.719 24.692 1.00 0.00 O ATOM 0 H GLY B 51 32.210 25.542 24.507 1.00 0.00 H new ATOM 0 HA2 GLY B 51 34.750 26.399 23.686 1.00 0.00 H new ATOM 0 HA3 GLY B 51 33.225 26.906 22.988 1.00 0.00 H new ATOM 1909 N GLN B 52 32.906 28.937 24.774 1.00 30.19 N ATOM 1910 CA GLN B 52 33.013 30.323 25.326 1.00 33.26 C ATOM 1911 C GLN B 52 33.998 30.303 26.477 1.00 34.21 C ATOM 1912 O GLN B 52 34.937 31.072 26.541 1.00 33.27 O ATOM 1913 CB GLN B 52 31.649 30.780 25.863 1.00 34.36 C ATOM 1914 CG GLN B 52 30.539 30.543 24.816 1.00 37.06 C ATOM 1915 CD GLN B 52 30.280 31.818 24.009 1.00 39.18 C ATOM 1916 OE1 GLN B 52 31.163 32.332 23.355 1.00 39.82 O ATOM 1917 NE2 GLN B 52 29.091 32.351 24.036 1.00 40.80 N ATOM 0 H GLN B 52 31.953 28.600 24.636 1.00 30.19 H new ATOM 0 HA GLN B 52 33.341 31.004 24.541 1.00 33.26 H new ATOM 0 HB2 GLN B 52 31.413 30.237 26.778 1.00 34.36 H new ATOM 0 HB3 GLN B 52 31.691 31.838 26.122 1.00 34.36 H new ATOM 0 HG2 GLN B 52 30.830 29.734 24.146 1.00 37.06 H new ATOM 0 HG3 GLN B 52 29.622 30.229 25.315 1.00 37.06 H new ATOM 0 HE21 GLN B 52 28.350 31.917 24.587 1.00 40.80 H new ATOM 0 HE22 GLN B 52 28.901 33.202 23.507 1.00 40.80 H new ATOM 1926 N TYR B 53 33.783 29.402 27.377 1.00 35.76 N ATOM 1927 CA TYR B 53 34.685 29.270 28.538 1.00 38.60 C ATOM 1928 C TYR B 53 36.052 28.834 28.022 1.00 39.68 C ATOM 1929 O TYR B 53 37.070 29.392 28.360 1.00 39.52 O ATOM 1930 CB TYR B 53 34.112 28.199 29.479 1.00 40.83 C ATOM 1931 CG TYR B 53 35.198 27.660 30.377 1.00 43.21 C ATOM 1932 CD1 TYR B 53 36.050 26.659 29.911 1.00 44.13 C ATOM 1933 CD2 TYR B 53 35.352 28.168 31.662 1.00 43.89 C ATOM 1934 CE1 TYR B 53 37.060 26.162 30.732 1.00 47.20 C ATOM 1935 CE2 TYR B 53 36.365 27.675 32.494 1.00 46.12 C ATOM 1936 CZ TYR B 53 37.222 26.669 32.028 1.00 46.20 C ATOM 1937 OH TYR B 53 38.221 26.179 32.843 1.00 48.95 O ATOM 0 H TYR B 53 33.007 28.740 27.358 1.00 35.76 H new ATOM 0 HA TYR B 53 34.777 30.212 29.078 1.00 38.60 H new ATOM 0 HB2 TYR B 53 33.310 28.625 30.082 1.00 40.83 H new ATOM 0 HB3 TYR B 53 33.676 27.388 28.896 1.00 40.83 H new ATOM 0 HD1 TYR B 53 35.927 26.268 28.912 1.00 44.13 H new ATOM 0 HD2 TYR B 53 34.690 28.943 32.019 1.00 43.89 H new ATOM 0 HE1 TYR B 53 37.718 25.386 30.369 1.00 47.20 H new ATOM 0 HE2 TYR B 53 36.485 28.069 33.492 1.00 46.12 H new ATOM 0 HH TYR B 53 38.552 26.897 33.423 1.00 48.95 H new ATOM 1947 N VAL B 54 36.058 27.833 27.202 1.00 39.35 N ATOM 1948 CA VAL B 54 37.327 27.310 26.642 1.00 40.00 C ATOM 1949 C VAL B 54 38.149 28.480 26.093 1.00 40.47 C ATOM 1950 O VAL B 54 39.219 28.788 26.579 1.00 39.23 O ATOM 1951 CB VAL B 54 36.940 26.341 25.522 1.00 40.33 C ATOM 1952 CG1 VAL B 54 38.049 26.189 24.510 1.00 40.58 C ATOM 1953 CG2 VAL B 54 36.542 24.949 26.081 1.00 39.92 C ATOM 0 H VAL B 54 35.220 27.343 26.888 1.00 39.35 H new ATOM 0 HA VAL B 54 37.930 26.800 27.393 1.00 40.00 H new ATOM 0 HB VAL B 54 36.073 26.773 25.023 1.00 40.33 H new ATOM 0 HG11 VAL B 54 37.737 25.494 23.731 1.00 40.58 H new ATOM 0 HG12 VAL B 54 38.270 27.159 24.064 1.00 40.58 H new ATOM 0 HG13 VAL B 54 38.942 25.805 25.003 1.00 40.58 H new ATOM 0 HG21 VAL B 54 36.274 24.289 25.256 1.00 39.92 H new ATOM 0 HG22 VAL B 54 37.383 24.523 26.628 1.00 39.92 H new ATOM 0 HG23 VAL B 54 35.689 25.056 26.752 1.00 39.92 H new ATOM 1963 N VAL B 55 37.647 29.128 25.082 1.00 40.13 N ATOM 1964 CA VAL B 55 38.383 30.278 24.493 1.00 42.29 C ATOM 1965 C VAL B 55 38.685 31.287 25.599 1.00 43.82 C ATOM 1966 O VAL B 55 39.821 31.652 25.830 1.00 43.78 O ATOM 1967 CB VAL B 55 37.509 30.932 23.416 1.00 41.62 C ATOM 1968 CG1 VAL B 55 38.302 32.030 22.691 1.00 42.45 C ATOM 1969 CG2 VAL B 55 37.077 29.864 22.408 1.00 41.12 C ATOM 0 H VAL B 55 36.756 28.910 24.637 1.00 40.13 H new ATOM 0 HA VAL B 55 39.317 29.940 24.043 1.00 42.29 H new ATOM 0 HB VAL B 55 36.631 31.379 23.883 1.00 41.62 H new ATOM 0 HG11 VAL B 55 37.674 32.489 21.928 1.00 42.45 H new ATOM 0 HG12 VAL B 55 38.613 32.789 23.409 1.00 42.45 H new ATOM 0 HG13 VAL B 55 39.183 31.593 22.221 1.00 42.45 H new ATOM 0 HG21 VAL B 55 36.455 30.321 21.638 1.00 41.12 H new ATOM 0 HG22 VAL B 55 37.960 29.422 21.946 1.00 41.12 H new ATOM 0 HG23 VAL B 55 36.509 29.088 22.921 1.00 41.12 H new ATOM 1979 N ASN B 56 37.674 31.740 26.281 1.00 44.48 N ATOM 1980 CA ASN B 56 37.892 32.726 27.373 1.00 47.06 C ATOM 1981 C ASN B 56 38.912 32.176 28.368 1.00 47.69 C ATOM 1982 O ASN B 56 39.678 32.919 28.950 1.00 47.82 O ATOM 1983 CB ASN B 56 36.567 32.993 28.090 1.00 46.90 C ATOM 1984 CG ASN B 56 35.553 33.561 27.095 1.00 47.81 C ATOM 1985 OD1 ASN B 56 35.923 34.049 26.046 1.00 48.43 O ATOM 1986 ND2 ASN B 56 34.281 33.517 27.382 1.00 47.03 N ATOM 0 H ASN B 56 36.702 31.469 26.129 1.00 44.48 H new ATOM 0 HA ASN B 56 38.270 33.657 26.950 1.00 47.06 H new ATOM 0 HB2 ASN B 56 36.186 32.070 28.527 1.00 46.90 H new ATOM 0 HB3 ASN B 56 36.720 33.695 28.910 1.00 46.90 H new ATOM 0 HD21 ASN B 56 33.597 33.892 26.725 1.00 47.03 H new ATOM 0 HD22 ASN B 56 33.971 33.107 28.263 1.00 47.03 H new ATOM 1993 N GLU B 57 38.940 30.886 28.578 1.00 49.57 N ATOM 1994 CA GLU B 57 39.926 30.333 29.542 1.00 51.35 C ATOM 1995 C GLU B 57 41.318 30.369 28.915 1.00 52.18 C ATOM 1996 O GLU B 57 42.280 30.743 29.552 1.00 52.13 O ATOM 1997 CB GLU B 57 39.572 28.889 29.928 1.00 52.66 C ATOM 1998 CG GLU B 57 40.260 28.536 31.259 1.00 53.83 C ATOM 1999 CD GLU B 57 39.422 29.057 32.431 1.00 55.85 C ATOM 2000 OE1 GLU B 57 38.628 29.957 32.212 1.00 57.10 O ATOM 2001 OE2 GLU B 57 39.590 28.547 33.526 1.00 56.34 O ATOM 0 H GLU B 57 38.330 30.203 28.129 1.00 49.57 H new ATOM 0 HA GLU B 57 39.907 30.942 30.446 1.00 51.35 H new ATOM 0 HB2 GLU B 57 38.492 28.780 30.024 1.00 52.66 H new ATOM 0 HB3 GLU B 57 39.894 28.202 29.145 1.00 52.66 H new ATOM 0 HG2 GLU B 57 40.383 27.456 31.340 1.00 53.83 H new ATOM 0 HG3 GLU B 57 41.258 28.974 31.290 1.00 53.83 H new