USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 953 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: A 101 GLN :FLIP amide:sc= -0.499 F(o=-1.3,f=-0.44) USER MOD Set 1.2: A 125 CYS SG : rot 133:sc= 0.061 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -145:sc= 1.07 USER MOD Single : A 15 THR OG1 : rot 100:sc= 1.23 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot -29:sc= -2.63! USER MOD Single : A 33 MET CE :methyl 156:sc= -3.28! (180deg=-4.36!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 TYR OH : rot 129:sc= 1.11 USER MOD Single : A 39 GLN : amide:sc= -0.35 X(o=-0.35,f=-0.35) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.163 X(o=-0.16,f=-0.31) USER MOD Single : A 47 SER OG : rot 180:sc= 0.793 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 169:sc= -0.0496 (180deg=-0.371) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.00227 USER MOD Single : A 58 GLN :FLIP amide:sc= -0.155 F(o=-1.1,f=-0.15) USER MOD Single : A 59 GLN : amide:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= -0.61 USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.705 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.445 X(o=-0.44,f=-0.32) USER MOD Single : A 80 SER OG : rot 180:sc= 0.0134 USER MOD Single : A 88 GLN : amide:sc= -0.41 X(o=-0.41,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 97:sc= 1.21 USER MOD Single : A 106 ASN : amide:sc= 0.296 K(o=0.3,f=-1.1) USER MOD Single : A 108 GLN : amide:sc= 0.223 X(o=0.22,f=0) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 81 N ILE A 6 5.745 -2.251 -12.578 1.00 43.34 N ATOM 82 CA ILE A 6 7.165 -2.575 -12.626 1.00 65.24 C ATOM 83 C ILE A 6 7.892 -2.046 -11.394 1.00 61.44 C ATOM 84 O ILE A 6 8.909 -2.599 -10.977 1.00 4.44 O ATOM 85 CB ILE A 6 7.832 -1.998 -13.889 1.00 24.20 C ATOM 86 CG1 ILE A 6 7.506 -0.510 -14.030 1.00 30.01 C ATOM 87 CG2 ILE A 6 7.381 -2.764 -15.123 1.00 62.35 C ATOM 88 CD1 ILE A 6 8.295 0.181 -15.120 1.00 3.24 C ATOM 0 HA ILE A 6 7.240 -3.662 -12.650 1.00 65.24 H new ATOM 0 HB ILE A 6 8.912 -2.106 -13.793 1.00 24.20 H new ATOM 0 HG12 ILE A 6 6.442 -0.398 -14.236 1.00 30.01 H new ATOM 0 HG13 ILE A 6 7.701 -0.012 -13.080 1.00 30.01 H new ATOM 0 HG21 ILE A 6 7.861 -2.344 -16.007 1.00 62.35 H new ATOM 0 HG22 ILE A 6 7.660 -3.813 -15.022 1.00 62.35 H new ATOM 0 HG23 ILE A 6 6.299 -2.684 -15.225 1.00 62.35 H new ATOM 0 HD11 ILE A 6 8.012 1.233 -15.163 1.00 3.24 H new ATOM 0 HD12 ILE A 6 9.361 0.100 -14.905 1.00 3.24 H new ATOM 0 HD13 ILE A 6 8.082 -0.291 -16.079 1.00 3.24 H new ATOM 100 N ALA A 7 7.362 -0.974 -10.816 1.00 55.12 N ATOM 101 CA ALA A 7 7.957 -0.372 -9.629 1.00 61.54 C ATOM 102 C ALA A 7 8.117 -1.400 -8.514 1.00 73.34 C ATOM 103 O ALA A 7 9.096 -1.376 -7.770 1.00 61.43 O ATOM 104 CB ALA A 7 7.113 0.800 -9.152 1.00 44.21 C ATOM 0 H ALA A 7 6.521 -0.504 -11.150 1.00 55.12 H new ATOM 0 HA ALA A 7 8.949 -0.006 -9.895 1.00 61.54 H new ATOM 0 HB1 ALA A 7 7.569 1.240 -8.265 1.00 44.21 H new ATOM 0 HB2 ALA A 7 7.054 1.551 -9.940 1.00 44.21 H new ATOM 0 HB3 ALA A 7 6.110 0.451 -8.908 1.00 44.21 H new ATOM 110 N GLY A 8 7.146 -2.303 -8.404 1.00 3.30 N ATOM 111 CA GLY A 8 7.198 -3.326 -7.376 1.00 43.11 C ATOM 112 C GLY A 8 8.169 -4.440 -7.715 1.00 50.43 C ATOM 113 O GLY A 8 8.811 -5.003 -6.829 1.00 21.53 O ATOM 0 H GLY A 8 6.325 -2.344 -9.008 1.00 3.30 H new ATOM 0 HA2 GLY A 8 7.488 -2.871 -6.429 1.00 43.11 H new ATOM 0 HA3 GLY A 8 6.202 -3.746 -7.235 1.00 43.11 H new ATOM 117 N ILE A 9 8.275 -4.759 -9.001 1.00 3.52 N ATOM 118 CA ILE A 9 9.174 -5.813 -9.454 1.00 2.30 C ATOM 119 C ILE A 9 10.625 -5.343 -9.438 1.00 52.20 C ATOM 120 O ILE A 9 11.544 -6.138 -9.240 1.00 4.13 O ATOM 121 CB ILE A 9 8.815 -6.286 -10.875 1.00 24.21 C ATOM 122 CG1 ILE A 9 7.417 -6.907 -10.891 1.00 51.22 C ATOM 123 CG2 ILE A 9 9.849 -7.283 -11.378 1.00 10.12 C ATOM 124 CD1 ILE A 9 6.310 -5.897 -11.102 1.00 23.21 C ATOM 0 H ILE A 9 7.750 -4.303 -9.747 1.00 3.52 H new ATOM 0 HA ILE A 9 9.057 -6.647 -8.762 1.00 2.30 H new ATOM 0 HB ILE A 9 8.817 -5.423 -11.541 1.00 24.21 H new ATOM 0 HG12 ILE A 9 7.370 -7.656 -11.681 1.00 51.22 H new ATOM 0 HG13 ILE A 9 7.248 -7.427 -9.948 1.00 51.22 H new ATOM 0 HG21 ILE A 9 9.582 -7.608 -12.383 1.00 10.12 H new ATOM 0 HG22 ILE A 9 10.831 -6.810 -11.399 1.00 10.12 H new ATOM 0 HG23 ILE A 9 9.876 -8.146 -10.713 1.00 10.12 H new ATOM 0 HD11 ILE A 9 5.347 -6.407 -11.102 1.00 23.21 H new ATOM 0 HD12 ILE A 9 6.331 -5.161 -10.298 1.00 23.21 H new ATOM 0 HD13 ILE A 9 6.454 -5.394 -12.058 1.00 23.21 H new ATOM 136 N LEU A 10 10.823 -4.046 -9.646 1.00 51.23 N ATOM 137 CA LEU A 10 12.162 -3.468 -9.654 1.00 65.10 C ATOM 138 C LEU A 10 12.613 -3.120 -8.239 1.00 45.21 C ATOM 139 O LEU A 10 13.809 -3.102 -7.943 1.00 53.50 O ATOM 140 CB LEU A 10 12.195 -2.217 -10.534 1.00 73.42 C ATOM 141 CG LEU A 10 12.023 -0.882 -9.809 1.00 51.04 C ATOM 142 CD1 LEU A 10 13.365 -0.367 -9.313 1.00 62.41 C ATOM 143 CD2 LEU A 10 11.363 0.140 -10.724 1.00 32.14 C ATOM 0 H LEU A 10 10.073 -3.375 -9.811 1.00 51.23 H new ATOM 0 HA LEU A 10 12.848 -4.210 -10.063 1.00 65.10 H new ATOM 0 HB2 LEU A 10 13.145 -2.198 -11.068 1.00 73.42 H new ATOM 0 HB3 LEU A 10 11.409 -2.304 -11.284 1.00 73.42 H new ATOM 0 HG LEU A 10 11.376 -1.040 -8.946 1.00 51.04 H new ATOM 0 HD11 LEU A 10 13.223 0.584 -8.800 1.00 62.41 H new ATOM 0 HD12 LEU A 10 13.800 -1.090 -8.623 1.00 62.41 H new ATOM 0 HD13 LEU A 10 14.036 -0.225 -10.160 1.00 62.41 H new ATOM 0 HD21 LEU A 10 11.248 1.084 -10.192 1.00 32.14 H new ATOM 0 HD22 LEU A 10 11.985 0.294 -11.606 1.00 32.14 H new ATOM 0 HD23 LEU A 10 10.383 -0.225 -11.030 1.00 32.14 H new ATOM 155 N THR A 11 11.649 -2.846 -7.366 1.00 54.45 N ATOM 156 CA THR A 11 11.946 -2.499 -5.982 1.00 72.14 C ATOM 157 C THR A 11 12.038 -3.746 -5.111 1.00 33.50 C ATOM 158 O THR A 11 12.641 -3.723 -4.038 1.00 15.40 O ATOM 159 CB THR A 11 10.878 -1.556 -5.398 1.00 14.23 C ATOM 160 OG1 THR A 11 11.377 -0.924 -4.214 1.00 21.24 O ATOM 161 CG2 THR A 11 9.602 -2.318 -5.072 1.00 61.23 C ATOM 0 H THR A 11 10.655 -2.858 -7.593 1.00 54.45 H new ATOM 0 HA THR A 11 12.909 -1.988 -5.983 1.00 72.14 H new ATOM 0 HB THR A 11 10.648 -0.797 -6.146 1.00 14.23 H new ATOM 0 HG1 THR A 11 10.692 -0.325 -3.850 1.00 21.24 H new ATOM 0 HG21 THR A 11 8.863 -1.631 -4.661 1.00 61.23 H new ATOM 0 HG22 THR A 11 9.208 -2.774 -5.980 1.00 61.23 H new ATOM 0 HG23 THR A 11 9.820 -3.096 -4.341 1.00 61.23 H new ATOM 169 N SER A 12 11.437 -4.836 -5.579 1.00 53.44 N ATOM 170 CA SER A 12 11.448 -6.093 -4.841 1.00 4.35 C ATOM 171 C SER A 12 12.721 -6.882 -5.132 1.00 21.22 C ATOM 172 O SER A 12 13.564 -7.071 -4.254 1.00 60.10 O ATOM 173 CB SER A 12 10.221 -6.932 -5.200 1.00 53.33 C ATOM 174 OG SER A 12 10.193 -8.139 -4.459 1.00 61.22 O ATOM 0 H SER A 12 10.936 -4.873 -6.467 1.00 53.44 H new ATOM 0 HA SER A 12 11.420 -5.861 -3.776 1.00 4.35 H new ATOM 0 HB2 SER A 12 9.315 -6.359 -5.002 1.00 53.33 H new ATOM 0 HB3 SER A 12 10.230 -7.157 -6.267 1.00 53.33 H new ATOM 0 HG SER A 12 9.398 -8.656 -4.706 1.00 61.22 H new ATOM 180 N THR A 13 12.854 -7.342 -6.372 1.00 71.21 N ATOM 181 CA THR A 13 14.022 -8.112 -6.781 1.00 32.33 C ATOM 182 C THR A 13 14.660 -7.520 -8.032 1.00 25.31 C ATOM 183 O THR A 13 13.967 -7.014 -8.914 1.00 71.11 O ATOM 184 CB THR A 13 13.658 -9.584 -7.051 1.00 75.34 C ATOM 185 OG1 THR A 13 14.746 -10.246 -7.706 1.00 10.05 O ATOM 186 CG2 THR A 13 12.407 -9.683 -7.912 1.00 12.24 C ATOM 0 H THR A 13 12.167 -7.194 -7.111 1.00 71.21 H new ATOM 0 HA THR A 13 14.735 -8.067 -5.957 1.00 32.33 H new ATOM 0 HB THR A 13 13.462 -10.068 -6.094 1.00 75.34 H new ATOM 0 HG1 THR A 13 14.394 -10.908 -8.337 1.00 10.05 H new ATOM 0 HG21 THR A 13 12.169 -10.732 -8.089 1.00 12.24 H new ATOM 0 HG22 THR A 13 11.573 -9.204 -7.399 1.00 12.24 H new ATOM 0 HG23 THR A 13 12.581 -9.184 -8.865 1.00 12.24 H new ATOM 194 N ARG A 14 15.986 -7.588 -8.103 1.00 11.15 N ATOM 195 CA ARG A 14 16.718 -7.058 -9.246 1.00 50.34 C ATOM 196 C ARG A 14 17.450 -8.173 -9.988 1.00 1.35 C ATOM 197 O ARG A 14 18.486 -8.660 -9.533 1.00 72.01 O ATOM 198 CB ARG A 14 17.717 -5.992 -8.791 1.00 32.45 C ATOM 199 CG ARG A 14 18.517 -6.394 -7.562 1.00 15.52 C ATOM 200 CD ARG A 14 19.457 -5.282 -7.122 1.00 34.12 C ATOM 201 NE ARG A 14 19.729 -5.331 -5.688 1.00 20.41 N ATOM 202 CZ ARG A 14 18.845 -4.984 -4.759 1.00 52.05 C ATOM 203 NH1 ARG A 14 17.638 -4.565 -5.113 1.00 14.32 N ATOM 204 NH2 ARG A 14 19.167 -5.056 -3.474 1.00 62.23 N ATOM 0 H ARG A 14 16.575 -8.005 -7.382 1.00 11.15 H new ATOM 0 HA ARG A 14 15.998 -6.604 -9.927 1.00 50.34 H new ATOM 0 HB2 ARG A 14 18.405 -5.778 -9.609 1.00 32.45 H new ATOM 0 HB3 ARG A 14 17.179 -5.069 -8.578 1.00 32.45 H new ATOM 0 HG2 ARG A 14 17.836 -6.640 -6.747 1.00 15.52 H new ATOM 0 HG3 ARG A 14 19.092 -7.294 -7.779 1.00 15.52 H new ATOM 0 HD2 ARG A 14 20.395 -5.361 -7.672 1.00 34.12 H new ATOM 0 HD3 ARG A 14 19.020 -4.316 -7.375 1.00 34.12 H new ATOM 0 HE ARG A 14 20.649 -5.649 -5.383 1.00 20.41 H new ATOM 0 HH11 ARG A 14 17.387 -4.509 -6.100 1.00 14.32 H new ATOM 0 HH12 ARG A 14 16.961 -4.299 -4.398 1.00 14.32 H new ATOM 0 HH21 ARG A 14 20.095 -5.378 -3.198 1.00 62.23 H new ATOM 0 HH22 ARG A 14 18.487 -4.789 -2.762 1.00 62.23 H new ATOM 218 N THR A 15 16.905 -8.573 -11.132 1.00 34.31 N ATOM 219 CA THR A 15 17.504 -9.631 -11.935 1.00 71.32 C ATOM 220 C THR A 15 17.433 -9.300 -13.422 1.00 21.35 C ATOM 221 O THR A 15 16.399 -8.854 -13.919 1.00 33.41 O ATOM 222 CB THR A 15 16.811 -10.985 -11.689 1.00 10.23 C ATOM 223 OG1 THR A 15 16.980 -11.380 -10.323 1.00 20.11 O ATOM 224 CG2 THR A 15 17.377 -12.058 -12.606 1.00 44.23 C ATOM 0 H THR A 15 16.049 -8.180 -11.523 1.00 34.31 H new ATOM 0 HA THR A 15 18.548 -9.705 -11.631 1.00 71.32 H new ATOM 0 HB THR A 15 15.749 -10.869 -11.905 1.00 10.23 H new ATOM 0 HG1 THR A 15 16.165 -11.172 -9.819 1.00 20.11 H new ATOM 0 HG21 THR A 15 16.872 -13.005 -12.413 1.00 44.23 H new ATOM 0 HG22 THR A 15 17.221 -11.768 -13.645 1.00 44.23 H new ATOM 0 HG23 THR A 15 18.445 -12.172 -12.418 1.00 44.23 H new ATOM 232 N ILE A 16 18.538 -9.522 -14.125 1.00 41.24 N ATOM 233 CA ILE A 16 18.600 -9.248 -15.556 1.00 34.42 C ATOM 234 C ILE A 16 19.110 -10.462 -16.326 1.00 53.40 C ATOM 235 O ILE A 16 20.147 -11.032 -15.989 1.00 74.32 O ATOM 236 CB ILE A 16 19.508 -8.042 -15.860 1.00 31.31 C ATOM 237 CG1 ILE A 16 19.116 -6.848 -14.987 1.00 24.43 C ATOM 238 CG2 ILE A 16 19.427 -7.676 -17.334 1.00 75.44 C ATOM 239 CD1 ILE A 16 19.904 -6.758 -13.699 1.00 4.43 C ATOM 0 H ILE A 16 19.402 -9.891 -13.728 1.00 41.24 H new ATOM 0 HA ILE A 16 17.584 -9.017 -15.878 1.00 34.42 H new ATOM 0 HB ILE A 16 20.538 -8.314 -15.630 1.00 31.31 H new ATOM 0 HG12 ILE A 16 19.259 -5.929 -15.556 1.00 24.43 H new ATOM 0 HG13 ILE A 16 18.054 -6.914 -14.750 1.00 24.43 H new ATOM 0 HG21 ILE A 16 20.074 -6.822 -17.533 1.00 75.44 H new ATOM 0 HG22 ILE A 16 19.750 -8.524 -17.938 1.00 75.44 H new ATOM 0 HG23 ILE A 16 18.399 -7.419 -17.589 1.00 75.44 H new ATOM 0 HD11 ILE A 16 19.574 -5.889 -13.130 1.00 4.43 H new ATOM 0 HD12 ILE A 16 19.742 -7.660 -13.109 1.00 4.43 H new ATOM 0 HD13 ILE A 16 20.965 -6.660 -13.928 1.00 4.43 H new ATOM 251 N ALA A 17 18.374 -10.849 -17.363 1.00 25.30 N ATOM 252 CA ALA A 17 18.754 -11.992 -18.184 1.00 22.30 C ATOM 253 C ALA A 17 18.929 -11.586 -19.643 1.00 61.03 C ATOM 254 O ALA A 17 18.152 -10.792 -20.175 1.00 33.11 O ATOM 255 CB ALA A 17 17.716 -13.098 -18.063 1.00 13.44 C ATOM 0 H ALA A 17 17.512 -10.388 -17.654 1.00 25.30 H new ATOM 0 HA ALA A 17 19.711 -12.366 -17.821 1.00 22.30 H new ATOM 0 HB1 ALA A 17 18.013 -13.945 -18.681 1.00 13.44 H new ATOM 0 HB2 ALA A 17 17.643 -13.416 -17.023 1.00 13.44 H new ATOM 0 HB3 ALA A 17 16.748 -12.726 -18.398 1.00 13.44 H new ATOM 261 N LEU A 18 19.954 -12.134 -20.286 1.00 62.13 N ATOM 262 CA LEU A 18 20.232 -11.828 -21.685 1.00 72.24 C ATOM 263 C LEU A 18 19.868 -13.006 -22.583 1.00 72.41 C ATOM 264 O LEU A 18 20.183 -14.156 -22.275 1.00 11.11 O ATOM 265 CB LEU A 18 21.708 -11.471 -21.867 1.00 21.23 C ATOM 266 CG LEU A 18 22.052 -10.646 -23.107 1.00 72.34 C ATOM 267 CD1 LEU A 18 22.192 -9.175 -22.748 1.00 60.24 C ATOM 268 CD2 LEU A 18 23.328 -11.163 -23.755 1.00 22.22 C ATOM 0 H LEU A 18 20.607 -12.793 -19.861 1.00 62.13 H new ATOM 0 HA LEU A 18 19.620 -10.973 -21.972 1.00 72.24 H new ATOM 0 HB2 LEU A 18 22.039 -10.921 -20.986 1.00 21.23 H new ATOM 0 HB3 LEU A 18 22.283 -12.396 -21.900 1.00 21.23 H new ATOM 0 HG LEU A 18 21.238 -10.747 -23.824 1.00 72.34 H new ATOM 0 HD11 LEU A 18 22.437 -8.604 -23.643 1.00 60.24 H new ATOM 0 HD12 LEU A 18 21.253 -8.811 -22.331 1.00 60.24 H new ATOM 0 HD13 LEU A 18 22.987 -9.054 -22.012 1.00 60.24 H new ATOM 0 HD21 LEU A 18 23.557 -10.564 -24.636 1.00 22.22 H new ATOM 0 HD22 LEU A 18 24.151 -11.093 -23.044 1.00 22.22 H new ATOM 0 HD23 LEU A 18 23.191 -12.203 -24.050 1.00 22.22 H new ATOM 280 N VAL A 19 19.204 -12.712 -23.697 1.00 31.54 N ATOM 281 CA VAL A 19 18.800 -13.747 -24.641 1.00 52.13 C ATOM 282 C VAL A 19 19.707 -13.756 -25.867 1.00 35.31 C ATOM 283 O VAL A 19 19.914 -12.726 -26.507 1.00 32.23 O ATOM 284 CB VAL A 19 17.341 -13.552 -25.097 1.00 24.22 C ATOM 285 CG1 VAL A 19 16.950 -14.621 -26.106 1.00 50.33 C ATOM 286 CG2 VAL A 19 16.403 -13.569 -23.900 1.00 0.14 C ATOM 0 H VAL A 19 18.935 -11.766 -23.967 1.00 31.54 H new ATOM 0 HA VAL A 19 18.886 -14.701 -24.121 1.00 52.13 H new ATOM 0 HB VAL A 19 17.257 -12.580 -25.582 1.00 24.22 H new ATOM 0 HG11 VAL A 19 15.917 -14.467 -26.417 1.00 50.33 H new ATOM 0 HG12 VAL A 19 17.604 -14.557 -26.976 1.00 50.33 H new ATOM 0 HG13 VAL A 19 17.049 -15.606 -25.649 1.00 50.33 H new ATOM 0 HG21 VAL A 19 15.377 -13.430 -24.240 1.00 0.14 H new ATOM 0 HG22 VAL A 19 16.488 -14.526 -23.385 1.00 0.14 H new ATOM 0 HG23 VAL A 19 16.671 -12.763 -23.216 1.00 0.14 H new ATOM 296 N GLY A 20 20.245 -14.929 -26.189 1.00 41.40 N ATOM 297 CA GLY A 20 21.124 -15.051 -27.338 1.00 15.23 C ATOM 298 C GLY A 20 22.501 -14.475 -27.078 1.00 4.13 C ATOM 299 O GLY A 20 22.928 -13.539 -27.754 1.00 20.24 O ATOM 0 H GLY A 20 20.088 -15.796 -25.675 1.00 41.40 H new ATOM 0 HA2 GLY A 20 21.219 -16.102 -27.609 1.00 15.23 H new ATOM 0 HA3 GLY A 20 20.675 -14.541 -28.191 1.00 15.23 H new ATOM 303 N ALA A 21 23.199 -15.034 -26.094 1.00 73.02 N ATOM 304 CA ALA A 21 24.536 -14.570 -25.747 1.00 23.43 C ATOM 305 C ALA A 21 25.600 -15.313 -26.548 1.00 21.53 C ATOM 306 O ALA A 21 25.744 -16.530 -26.428 1.00 75.23 O ATOM 307 CB ALA A 21 24.782 -14.739 -24.255 1.00 24.12 C ATOM 0 H ALA A 21 22.860 -15.809 -25.524 1.00 73.02 H new ATOM 0 HA ALA A 21 24.603 -13.511 -25.998 1.00 23.43 H new ATOM 0 HB1 ALA A 21 25.784 -14.388 -24.010 1.00 24.12 H new ATOM 0 HB2 ALA A 21 24.048 -14.158 -23.697 1.00 24.12 H new ATOM 0 HB3 ALA A 21 24.690 -15.792 -23.988 1.00 24.12 H new ATOM 313 N SER A 22 26.343 -14.574 -27.365 1.00 4.15 N ATOM 314 CA SER A 22 27.392 -15.164 -28.189 1.00 15.01 C ATOM 315 C SER A 22 28.720 -14.445 -27.976 1.00 10.33 C ATOM 316 O SER A 22 28.827 -13.551 -27.136 1.00 53.30 O ATOM 317 CB SER A 22 27.000 -15.108 -29.667 1.00 13.13 C ATOM 318 OG SER A 22 26.459 -13.842 -30.003 1.00 41.13 O ATOM 0 H SER A 22 26.238 -13.565 -27.474 1.00 4.15 H new ATOM 0 HA SER A 22 27.511 -16.206 -27.891 1.00 15.01 H new ATOM 0 HB2 SER A 22 27.874 -15.310 -30.286 1.00 13.13 H new ATOM 0 HB3 SER A 22 26.270 -15.888 -29.883 1.00 13.13 H new ATOM 0 HG SER A 22 26.218 -13.831 -30.953 1.00 41.13 H new ATOM 324 N ASP A 23 29.730 -14.842 -28.742 1.00 11.32 N ATOM 325 CA ASP A 23 31.052 -14.235 -28.639 1.00 22.32 C ATOM 326 C ASP A 23 31.204 -13.090 -29.635 1.00 71.22 C ATOM 327 O ASP A 23 32.235 -12.960 -30.296 1.00 11.45 O ATOM 328 CB ASP A 23 32.138 -15.285 -28.880 1.00 3.11 C ATOM 329 CG ASP A 23 33.528 -14.758 -28.583 1.00 25.22 C ATOM 330 OD1 ASP A 23 33.842 -14.549 -27.392 1.00 22.30 O ATOM 331 OD2 ASP A 23 34.303 -14.556 -29.541 1.00 1.21 O ATOM 0 H ASP A 23 29.659 -15.581 -29.441 1.00 11.32 H new ATOM 0 HA ASP A 23 31.163 -13.833 -27.632 1.00 22.32 H new ATOM 0 HB2 ASP A 23 31.942 -16.157 -28.255 1.00 3.11 H new ATOM 0 HB3 ASP A 23 32.093 -15.619 -29.917 1.00 3.11 H new ATOM 336 N LYS A 24 30.170 -12.263 -29.740 1.00 14.33 N ATOM 337 CA LYS A 24 30.186 -11.128 -30.655 1.00 45.11 C ATOM 338 C LYS A 24 30.268 -9.812 -29.888 1.00 41.35 C ATOM 339 O LYS A 24 29.261 -9.152 -29.631 1.00 50.12 O ATOM 340 CB LYS A 24 28.936 -11.140 -31.538 1.00 3.43 C ATOM 341 CG LYS A 24 29.015 -12.124 -32.691 1.00 63.52 C ATOM 342 CD LYS A 24 29.983 -11.652 -33.763 1.00 3.32 C ATOM 343 CE LYS A 24 29.891 -12.510 -35.015 1.00 61.11 C ATOM 344 NZ LYS A 24 28.770 -12.085 -35.898 1.00 15.14 N ATOM 0 H LYS A 24 29.309 -12.358 -29.202 1.00 14.33 H new ATOM 0 HA LYS A 24 31.070 -11.215 -31.287 1.00 45.11 H new ATOM 0 HB2 LYS A 24 28.069 -11.383 -30.923 1.00 3.43 H new ATOM 0 HB3 LYS A 24 28.773 -10.139 -31.937 1.00 3.43 H new ATOM 0 HG2 LYS A 24 29.331 -13.098 -32.318 1.00 63.52 H new ATOM 0 HG3 LYS A 24 28.024 -12.255 -33.127 1.00 63.52 H new ATOM 0 HD2 LYS A 24 29.769 -10.614 -34.016 1.00 3.32 H new ATOM 0 HD3 LYS A 24 31.001 -11.682 -33.374 1.00 3.32 H new ATOM 0 HE2 LYS A 24 30.830 -12.450 -35.566 1.00 61.11 H new ATOM 0 HE3 LYS A 24 29.754 -13.553 -34.731 1.00 61.11 H new ATOM 0 HZ1 LYS A 24 28.741 -12.694 -36.740 1.00 15.14 H new ATOM 0 HZ2 LYS A 24 27.871 -12.166 -35.381 1.00 15.14 H new ATOM 0 HZ3 LYS A 24 28.914 -11.097 -36.190 1.00 15.14 H new ATOM 358 N PRO A 25 31.495 -9.418 -29.515 1.00 70.33 N ATOM 359 CA PRO A 25 31.737 -8.177 -28.775 1.00 0.43 C ATOM 360 C PRO A 25 31.492 -6.936 -29.627 1.00 32.21 C ATOM 361 O PRO A 25 31.538 -5.811 -29.130 1.00 11.22 O ATOM 362 CB PRO A 25 33.215 -8.276 -28.388 1.00 72.43 C ATOM 363 CG PRO A 25 33.815 -9.172 -29.416 1.00 45.23 C ATOM 364 CD PRO A 25 32.740 -10.155 -29.788 1.00 63.21 C ATOM 0 HA PRO A 25 31.065 -8.074 -27.923 1.00 0.43 H new ATOM 0 HB2 PRO A 25 33.692 -7.296 -28.390 1.00 72.43 H new ATOM 0 HB3 PRO A 25 33.335 -8.687 -27.386 1.00 72.43 H new ATOM 0 HG2 PRO A 25 34.142 -8.603 -30.287 1.00 45.23 H new ATOM 0 HG3 PRO A 25 34.693 -9.684 -29.022 1.00 45.23 H new ATOM 0 HD2 PRO A 25 32.811 -10.451 -30.835 1.00 63.21 H new ATOM 0 HD3 PRO A 25 32.806 -11.067 -29.194 1.00 63.21 H new ATOM 372 N ASP A 26 31.231 -7.149 -30.912 1.00 32.11 N ATOM 373 CA ASP A 26 30.977 -6.048 -31.833 1.00 55.33 C ATOM 374 C ASP A 26 29.478 -5.834 -32.025 1.00 22.50 C ATOM 375 O ASP A 26 29.041 -5.322 -33.055 1.00 41.43 O ATOM 376 CB ASP A 26 31.642 -6.320 -33.183 1.00 44.31 C ATOM 377 CG ASP A 26 30.976 -7.452 -33.940 1.00 11.23 C ATOM 378 OD1 ASP A 26 31.206 -8.624 -33.577 1.00 24.13 O ATOM 379 OD2 ASP A 26 30.224 -7.166 -34.895 1.00 44.45 O ATOM 0 H ASP A 26 31.190 -8.074 -31.339 1.00 32.11 H new ATOM 0 HA ASP A 26 31.403 -5.142 -31.402 1.00 55.33 H new ATOM 0 HB2 ASP A 26 31.611 -5.414 -33.789 1.00 44.31 H new ATOM 0 HB3 ASP A 26 32.693 -6.562 -33.025 1.00 44.31 H new ATOM 384 N ARG A 27 28.697 -6.232 -31.027 1.00 35.54 N ATOM 385 CA ARG A 27 27.247 -6.087 -31.086 1.00 61.04 C ATOM 386 C ARG A 27 26.713 -5.434 -29.815 1.00 3.30 C ATOM 387 O ARG A 27 27.368 -5.422 -28.772 1.00 54.41 O ATOM 388 CB ARG A 27 26.584 -7.451 -31.289 1.00 3.13 C ATOM 389 CG ARG A 27 26.411 -7.833 -32.750 1.00 31.14 C ATOM 390 CD ARG A 27 25.472 -9.019 -32.907 1.00 64.14 C ATOM 391 NE ARG A 27 25.537 -9.594 -34.248 1.00 44.25 N ATOM 392 CZ ARG A 27 24.904 -10.707 -34.603 1.00 5.34 C ATOM 393 NH1 ARG A 27 24.163 -11.361 -33.720 1.00 13.03 N ATOM 394 NH2 ARG A 27 25.013 -11.167 -35.842 1.00 55.04 N ATOM 0 H ARG A 27 29.044 -6.658 -30.167 1.00 35.54 H new ATOM 0 HA ARG A 27 27.006 -5.444 -31.933 1.00 61.04 H new ATOM 0 HB2 ARG A 27 27.182 -8.214 -30.791 1.00 3.13 H new ATOM 0 HB3 ARG A 27 25.607 -7.446 -30.805 1.00 3.13 H new ATOM 0 HG2 ARG A 27 26.020 -6.981 -33.306 1.00 31.14 H new ATOM 0 HG3 ARG A 27 27.382 -8.076 -33.181 1.00 31.14 H new ATOM 0 HD2 ARG A 27 25.727 -9.783 -32.172 1.00 64.14 H new ATOM 0 HD3 ARG A 27 24.450 -8.703 -32.697 1.00 64.14 H new ATOM 0 HE ARG A 27 26.099 -9.115 -34.951 1.00 44.25 H new ATOM 0 HH11 ARG A 27 24.078 -11.010 -32.766 1.00 13.03 H new ATOM 0 HH12 ARG A 27 23.678 -12.215 -33.994 1.00 13.03 H new ATOM 0 HH21 ARG A 27 25.583 -10.666 -36.524 1.00 55.04 H new ATOM 0 HH22 ARG A 27 24.527 -12.022 -36.113 1.00 55.04 H new ATOM 408 N PRO A 28 25.496 -4.877 -29.902 1.00 3.53 N ATOM 409 CA PRO A 28 24.848 -4.211 -28.768 1.00 33.00 C ATOM 410 C PRO A 28 24.427 -5.195 -27.681 1.00 44.15 C ATOM 411 O PRO A 28 24.126 -4.799 -26.555 1.00 65.33 O ATOM 412 CB PRO A 28 23.618 -3.554 -29.399 1.00 12.41 C ATOM 413 CG PRO A 28 23.327 -4.375 -30.607 1.00 71.21 C ATOM 414 CD PRO A 28 24.660 -4.854 -31.113 1.00 55.32 C ATOM 0 HA PRO A 28 25.517 -3.508 -28.272 1.00 33.00 H new ATOM 0 HB2 PRO A 28 22.774 -3.551 -28.710 1.00 12.41 H new ATOM 0 HB3 PRO A 28 23.816 -2.516 -29.665 1.00 12.41 H new ATOM 0 HG2 PRO A 28 22.678 -5.215 -30.361 1.00 71.21 H new ATOM 0 HG3 PRO A 28 22.811 -3.785 -31.365 1.00 71.21 H new ATOM 0 HD2 PRO A 28 24.586 -5.841 -31.569 1.00 55.32 H new ATOM 0 HD3 PRO A 28 25.067 -4.183 -31.870 1.00 55.32 H new ATOM 422 N SER A 29 24.409 -6.478 -28.027 1.00 23.45 N ATOM 423 CA SER A 29 24.022 -7.519 -27.081 1.00 5.22 C ATOM 424 C SER A 29 25.157 -7.816 -26.105 1.00 45.44 C ATOM 425 O SER A 29 24.923 -8.241 -24.974 1.00 64.20 O ATOM 426 CB SER A 29 23.629 -8.795 -27.827 1.00 62.10 C ATOM 427 OG SER A 29 22.621 -9.504 -27.128 1.00 21.50 O ATOM 0 H SER A 29 24.658 -6.822 -28.955 1.00 23.45 H new ATOM 0 HA SER A 29 23.163 -7.159 -26.514 1.00 5.22 H new ATOM 0 HB2 SER A 29 23.274 -8.541 -28.826 1.00 62.10 H new ATOM 0 HB3 SER A 29 24.505 -9.431 -27.952 1.00 62.10 H new ATOM 0 HG SER A 29 22.386 -10.315 -27.626 1.00 21.50 H new ATOM 433 N TYR A 30 26.387 -7.588 -26.552 1.00 65.13 N ATOM 434 CA TYR A 30 27.560 -7.833 -25.721 1.00 41.01 C ATOM 435 C TYR A 30 27.894 -6.608 -24.876 1.00 45.40 C ATOM 436 O TYR A 30 28.165 -6.719 -23.680 1.00 65.53 O ATOM 437 CB TYR A 30 28.760 -8.208 -26.593 1.00 12.12 C ATOM 438 CG TYR A 30 29.792 -9.048 -25.874 1.00 53.51 C ATOM 439 CD1 TYR A 30 30.428 -8.574 -24.733 1.00 64.42 C ATOM 440 CD2 TYR A 30 30.131 -10.313 -26.336 1.00 72.12 C ATOM 441 CE1 TYR A 30 31.372 -9.338 -24.074 1.00 3.55 C ATOM 442 CE2 TYR A 30 31.072 -11.084 -25.682 1.00 43.31 C ATOM 443 CZ TYR A 30 31.690 -10.592 -24.552 1.00 4.44 C ATOM 444 OH TYR A 30 32.630 -11.356 -23.898 1.00 50.40 O ATOM 0 H TYR A 30 26.598 -7.234 -27.485 1.00 65.13 H new ATOM 0 HA TYR A 30 27.333 -8.663 -25.052 1.00 41.01 H new ATOM 0 HB2 TYR A 30 28.406 -8.753 -27.468 1.00 12.12 H new ATOM 0 HB3 TYR A 30 29.234 -7.296 -26.955 1.00 12.12 H new ATOM 0 HD1 TYR A 30 30.181 -7.593 -24.355 1.00 64.42 H new ATOM 0 HD2 TYR A 30 29.650 -10.701 -27.222 1.00 72.12 H new ATOM 0 HE1 TYR A 30 31.858 -8.955 -23.189 1.00 3.55 H new ATOM 0 HE2 TYR A 30 31.322 -12.067 -26.054 1.00 43.31 H new ATOM 0 HH TYR A 30 33.278 -10.769 -23.455 1.00 50.40 H new ATOM 454 N ARG A 31 27.872 -5.438 -25.507 1.00 24.11 N ATOM 455 CA ARG A 31 28.173 -4.191 -24.815 1.00 4.24 C ATOM 456 C ARG A 31 27.305 -4.037 -23.569 1.00 62.02 C ATOM 457 O ARG A 31 27.732 -3.460 -22.569 1.00 64.11 O ATOM 458 CB ARG A 31 27.958 -2.999 -25.749 1.00 65.14 C ATOM 459 CG ARG A 31 26.495 -2.651 -25.966 1.00 72.33 C ATOM 460 CD ARG A 31 26.338 -1.450 -26.885 1.00 71.14 C ATOM 461 NE ARG A 31 26.918 -0.240 -26.309 1.00 25.30 N ATOM 462 CZ ARG A 31 27.111 0.881 -26.995 1.00 3.05 C ATOM 463 NH1 ARG A 31 26.771 0.946 -28.274 1.00 42.34 N ATOM 464 NH2 ARG A 31 27.645 1.940 -26.400 1.00 0.32 N ATOM 0 H ARG A 31 27.649 -5.328 -26.496 1.00 24.11 H new ATOM 0 HA ARG A 31 29.218 -4.219 -24.508 1.00 4.24 H new ATOM 0 HB2 ARG A 31 28.472 -2.130 -25.339 1.00 65.14 H new ATOM 0 HB3 ARG A 31 28.418 -3.216 -26.713 1.00 65.14 H new ATOM 0 HG2 ARG A 31 25.976 -3.508 -26.394 1.00 72.33 H new ATOM 0 HG3 ARG A 31 26.024 -2.440 -25.006 1.00 72.33 H new ATOM 0 HD2 ARG A 31 26.816 -1.661 -27.842 1.00 71.14 H new ATOM 0 HD3 ARG A 31 25.280 -1.284 -27.087 1.00 71.14 H new ATOM 0 HE ARG A 31 27.190 -0.256 -25.326 1.00 25.30 H new ATOM 0 HH11 ARG A 31 26.360 0.134 -28.734 1.00 42.34 H new ATOM 0 HH12 ARG A 31 26.920 1.808 -28.798 1.00 42.34 H new ATOM 0 HH21 ARG A 31 27.907 1.893 -25.415 1.00 0.32 H new ATOM 0 HH22 ARG A 31 27.793 2.801 -26.927 1.00 0.32 H new ATOM 478 N VAL A 32 26.084 -4.557 -23.638 1.00 13.33 N ATOM 479 CA VAL A 32 25.155 -4.478 -22.516 1.00 43.12 C ATOM 480 C VAL A 32 25.507 -5.498 -21.439 1.00 1.41 C ATOM 481 O VAL A 32 25.378 -5.225 -20.246 1.00 3.51 O ATOM 482 CB VAL A 32 23.703 -4.710 -22.973 1.00 33.23 C ATOM 483 CG1 VAL A 32 22.756 -4.670 -21.783 1.00 30.12 C ATOM 484 CG2 VAL A 32 23.302 -3.680 -24.018 1.00 61.42 C ATOM 0 H VAL A 32 25.715 -5.037 -24.458 1.00 13.33 H new ATOM 0 HA VAL A 32 25.242 -3.473 -22.103 1.00 43.12 H new ATOM 0 HB VAL A 32 23.637 -5.699 -23.427 1.00 33.23 H new ATOM 0 HG11 VAL A 32 21.734 -4.836 -22.125 1.00 30.12 H new ATOM 0 HG12 VAL A 32 23.032 -5.449 -21.072 1.00 30.12 H new ATOM 0 HG13 VAL A 32 22.822 -3.696 -21.298 1.00 30.12 H new ATOM 0 HG21 VAL A 32 22.273 -3.859 -24.329 1.00 61.42 H new ATOM 0 HG22 VAL A 32 23.383 -2.680 -23.593 1.00 61.42 H new ATOM 0 HG23 VAL A 32 23.962 -3.762 -24.882 1.00 61.42 H new ATOM 494 N MET A 33 25.953 -6.674 -21.868 1.00 55.12 N ATOM 495 CA MET A 33 26.325 -7.735 -20.939 1.00 40.34 C ATOM 496 C MET A 33 27.410 -7.260 -19.978 1.00 40.43 C ATOM 497 O MET A 33 27.221 -7.262 -18.762 1.00 31.33 O ATOM 498 CB MET A 33 26.810 -8.966 -21.706 1.00 64.25 C ATOM 499 CG MET A 33 26.502 -10.279 -21.005 1.00 63.34 C ATOM 500 SD MET A 33 27.192 -11.705 -21.867 1.00 25.23 S ATOM 501 CE MET A 33 27.950 -12.589 -20.505 1.00 44.34 C ATOM 0 H MET A 33 26.066 -6.916 -22.852 1.00 55.12 H new ATOM 0 HA MET A 33 25.442 -8.002 -20.359 1.00 40.34 H new ATOM 0 HB2 MET A 33 26.349 -8.974 -22.693 1.00 64.25 H new ATOM 0 HB3 MET A 33 27.887 -8.888 -21.858 1.00 64.25 H new ATOM 0 HG2 MET A 33 26.898 -10.246 -19.990 1.00 63.34 H new ATOM 0 HG3 MET A 33 25.422 -10.397 -20.922 1.00 63.34 H new ATOM 0 HE1 MET A 33 28.037 -13.645 -20.760 1.00 44.34 H new ATOM 0 HE2 MET A 33 28.941 -12.179 -20.312 1.00 44.34 H new ATOM 0 HE3 MET A 33 27.333 -12.481 -19.613 1.00 44.34 H new ATOM 511 N LYS A 34 28.547 -6.852 -20.532 1.00 23.45 N ATOM 512 CA LYS A 34 29.663 -6.373 -19.724 1.00 70.32 C ATOM 513 C LYS A 34 29.306 -5.066 -19.024 1.00 42.34 C ATOM 514 O LYS A 34 29.887 -4.723 -17.994 1.00 60.32 O ATOM 515 CB LYS A 34 30.903 -6.174 -20.598 1.00 64.42 C ATOM 516 CG LYS A 34 32.078 -5.561 -19.856 1.00 42.03 C ATOM 517 CD LYS A 34 32.122 -4.052 -20.032 1.00 65.31 C ATOM 518 CE LYS A 34 33.549 -3.527 -19.981 1.00 11.24 C ATOM 519 NZ LYS A 34 33.601 -2.106 -19.539 1.00 12.33 N ATOM 0 H LYS A 34 28.720 -6.843 -21.537 1.00 23.45 H new ATOM 0 HA LYS A 34 29.878 -7.124 -18.964 1.00 70.32 H new ATOM 0 HB2 LYS A 34 31.206 -7.137 -21.009 1.00 64.42 H new ATOM 0 HB3 LYS A 34 30.644 -5.535 -21.442 1.00 64.42 H new ATOM 0 HG2 LYS A 34 32.006 -5.803 -18.796 1.00 42.03 H new ATOM 0 HG3 LYS A 34 33.008 -5.998 -20.220 1.00 42.03 H new ATOM 0 HD2 LYS A 34 31.668 -3.782 -20.985 1.00 65.31 H new ATOM 0 HD3 LYS A 34 31.530 -3.576 -19.251 1.00 65.31 H new ATOM 0 HE2 LYS A 34 34.138 -4.141 -19.300 1.00 11.24 H new ATOM 0 HE3 LYS A 34 34.005 -3.618 -20.967 1.00 11.24 H new ATOM 0 HZ1 LYS A 34 34.590 -1.785 -19.517 1.00 12.33 H new ATOM 0 HZ2 LYS A 34 33.060 -1.516 -20.203 1.00 12.33 H new ATOM 0 HZ3 LYS A 34 33.189 -2.023 -18.588 1.00 12.33 H new ATOM 533 N TYR A 35 28.348 -4.340 -19.589 1.00 75.33 N ATOM 534 CA TYR A 35 27.914 -3.070 -19.020 1.00 2.02 C ATOM 535 C TYR A 35 27.186 -3.286 -17.696 1.00 64.25 C ATOM 536 O TYR A 35 27.513 -2.663 -16.685 1.00 51.14 O ATOM 537 CB TYR A 35 27.003 -2.332 -20.001 1.00 54.43 C ATOM 538 CG TYR A 35 25.936 -1.498 -19.327 1.00 61.14 C ATOM 539 CD1 TYR A 35 26.265 -0.335 -18.643 1.00 12.30 C ATOM 540 CD2 TYR A 35 24.599 -1.874 -19.376 1.00 42.01 C ATOM 541 CE1 TYR A 35 25.294 0.429 -18.025 1.00 53.22 C ATOM 542 CE2 TYR A 35 23.621 -1.115 -18.762 1.00 61.45 C ATOM 543 CZ TYR A 35 23.973 0.035 -18.088 1.00 24.01 C ATOM 544 OH TYR A 35 23.003 0.794 -17.475 1.00 71.01 O ATOM 0 H TYR A 35 27.857 -4.610 -20.441 1.00 75.33 H new ATOM 0 HA TYR A 35 28.800 -2.464 -18.832 1.00 2.02 H new ATOM 0 HB2 TYR A 35 27.612 -1.686 -20.633 1.00 54.43 H new ATOM 0 HB3 TYR A 35 26.524 -3.059 -20.656 1.00 54.43 H new ATOM 0 HD1 TYR A 35 27.298 -0.023 -18.593 1.00 12.30 H new ATOM 0 HD2 TYR A 35 24.320 -2.774 -19.903 1.00 42.01 H new ATOM 0 HE1 TYR A 35 25.567 1.330 -17.495 1.00 53.22 H new ATOM 0 HE2 TYR A 35 22.586 -1.421 -18.810 1.00 61.45 H new ATOM 0 HH TYR A 35 22.283 0.983 -18.113 1.00 71.01 H new ATOM 554 N LEU A 36 26.199 -4.174 -17.711 1.00 34.24 N ATOM 555 CA LEU A 36 25.423 -4.475 -16.512 1.00 61.22 C ATOM 556 C LEU A 36 26.267 -5.236 -15.495 1.00 33.53 C ATOM 557 O LEU A 36 26.077 -5.096 -14.286 1.00 22.13 O ATOM 558 CB LEU A 36 24.182 -5.292 -16.876 1.00 11.13 C ATOM 559 CG LEU A 36 23.115 -4.564 -17.695 1.00 4.25 C ATOM 560 CD1 LEU A 36 22.048 -5.538 -18.167 1.00 74.10 C ATOM 561 CD2 LEU A 36 22.492 -3.440 -16.879 1.00 72.42 C ATOM 0 H LEU A 36 25.917 -4.698 -18.539 1.00 34.24 H new ATOM 0 HA LEU A 36 25.111 -3.532 -16.064 1.00 61.22 H new ATOM 0 HB2 LEU A 36 24.502 -6.172 -17.434 1.00 11.13 H new ATOM 0 HB3 LEU A 36 23.723 -5.649 -15.954 1.00 11.13 H new ATOM 0 HG LEU A 36 23.592 -4.128 -18.573 1.00 4.25 H new ATOM 0 HD11 LEU A 36 21.297 -5.002 -18.748 1.00 74.10 H new ATOM 0 HD12 LEU A 36 22.507 -6.307 -18.788 1.00 74.10 H new ATOM 0 HD13 LEU A 36 21.574 -6.004 -17.304 1.00 74.10 H new ATOM 0 HD21 LEU A 36 21.735 -2.933 -17.477 1.00 72.42 H new ATOM 0 HD22 LEU A 36 22.029 -3.854 -15.983 1.00 72.42 H new ATOM 0 HD23 LEU A 36 23.265 -2.727 -16.592 1.00 72.42 H new ATOM 573 N LEU A 37 27.200 -6.041 -15.991 1.00 72.13 N ATOM 574 CA LEU A 37 28.075 -6.824 -15.126 1.00 2.54 C ATOM 575 C LEU A 37 29.024 -5.917 -14.347 1.00 55.15 C ATOM 576 O LEU A 37 29.192 -6.070 -13.138 1.00 33.14 O ATOM 577 CB LEU A 37 28.877 -7.829 -15.953 1.00 63.32 C ATOM 578 CG LEU A 37 28.210 -9.184 -16.195 1.00 54.50 C ATOM 579 CD1 LEU A 37 29.087 -10.062 -17.074 1.00 13.31 C ATOM 580 CD2 LEU A 37 27.913 -9.876 -14.873 1.00 5.13 C ATOM 0 H LEU A 37 27.370 -6.169 -16.989 1.00 72.13 H new ATOM 0 HA LEU A 37 27.451 -7.365 -14.414 1.00 2.54 H new ATOM 0 HB2 LEU A 37 29.099 -7.378 -16.920 1.00 63.32 H new ATOM 0 HB3 LEU A 37 29.831 -8.000 -15.454 1.00 63.32 H new ATOM 0 HG LEU A 37 27.266 -9.015 -16.713 1.00 54.50 H new ATOM 0 HD11 LEU A 37 28.596 -11.022 -17.235 1.00 13.31 H new ATOM 0 HD12 LEU A 37 29.248 -9.571 -18.034 1.00 13.31 H new ATOM 0 HD13 LEU A 37 30.047 -10.224 -16.584 1.00 13.31 H new ATOM 0 HD21 LEU A 37 27.439 -10.838 -15.065 1.00 5.13 H new ATOM 0 HD22 LEU A 37 28.843 -10.032 -14.327 1.00 5.13 H new ATOM 0 HD23 LEU A 37 27.244 -9.254 -14.279 1.00 5.13 H new ATOM 592 N ASP A 38 29.639 -4.972 -15.049 1.00 51.24 N ATOM 593 CA ASP A 38 30.568 -4.038 -14.424 1.00 50.32 C ATOM 594 C ASP A 38 29.834 -3.093 -13.478 1.00 10.14 C ATOM 595 O ASP A 38 30.312 -2.804 -12.381 1.00 34.43 O ATOM 596 CB ASP A 38 31.312 -3.234 -15.492 1.00 11.34 C ATOM 597 CG ASP A 38 32.535 -2.530 -14.938 1.00 42.52 C ATOM 598 OD1 ASP A 38 33.346 -3.194 -14.259 1.00 42.22 O ATOM 599 OD2 ASP A 38 32.682 -1.314 -15.185 1.00 30.41 O ATOM 0 H ASP A 38 29.511 -4.832 -16.051 1.00 51.24 H new ATOM 0 HA ASP A 38 31.290 -4.614 -13.845 1.00 50.32 H new ATOM 0 HB2 ASP A 38 31.615 -3.901 -16.300 1.00 11.34 H new ATOM 0 HB3 ASP A 38 30.636 -2.496 -15.924 1.00 11.34 H new ATOM 604 N GLN A 39 28.672 -2.614 -13.911 1.00 20.55 N ATOM 605 CA GLN A 39 27.874 -1.701 -13.102 1.00 13.22 C ATOM 606 C GLN A 39 27.547 -2.318 -11.746 1.00 10.21 C ATOM 607 O GLN A 39 27.310 -1.607 -10.770 1.00 54.13 O ATOM 608 CB GLN A 39 26.581 -1.335 -13.834 1.00 3.13 C ATOM 609 CG GLN A 39 26.682 -0.050 -14.640 1.00 35.10 C ATOM 610 CD GLN A 39 27.032 1.151 -13.783 1.00 74.44 C ATOM 611 OE1 GLN A 39 26.326 1.472 -12.827 1.00 23.05 O ATOM 612 NE2 GLN A 39 28.126 1.822 -14.123 1.00 61.40 N ATOM 0 H GLN A 39 28.263 -2.843 -14.817 1.00 20.55 H new ATOM 0 HA GLN A 39 28.459 -0.796 -12.937 1.00 13.22 H new ATOM 0 HB2 GLN A 39 26.307 -2.152 -14.501 1.00 3.13 H new ATOM 0 HB3 GLN A 39 25.776 -1.235 -13.105 1.00 3.13 H new ATOM 0 HG2 GLN A 39 27.438 -0.171 -15.416 1.00 35.10 H new ATOM 0 HG3 GLN A 39 25.734 0.133 -15.145 1.00 35.10 H new ATOM 0 HE21 GLN A 39 28.681 1.520 -14.923 1.00 61.40 H new ATOM 0 HE22 GLN A 39 28.411 2.640 -13.584 1.00 61.40 H new ATOM 621 N GLY A 40 27.536 -3.646 -11.693 1.00 24.35 N ATOM 622 CA GLY A 40 27.237 -4.337 -10.452 1.00 0.44 C ATOM 623 C GLY A 40 25.819 -4.871 -10.413 1.00 62.30 C ATOM 624 O GLY A 40 25.084 -4.631 -9.455 1.00 73.42 O ATOM 0 H GLY A 40 27.729 -4.256 -12.487 1.00 24.35 H new ATOM 0 HA2 GLY A 40 27.937 -5.163 -10.322 1.00 0.44 H new ATOM 0 HA3 GLY A 40 27.389 -3.656 -9.615 1.00 0.44 H new ATOM 628 N TYR A 41 25.434 -5.596 -11.457 1.00 74.31 N ATOM 629 CA TYR A 41 24.093 -6.163 -11.541 1.00 12.02 C ATOM 630 C TYR A 41 24.152 -7.671 -11.762 1.00 74.33 C ATOM 631 O TYR A 41 25.229 -8.267 -11.779 1.00 45.32 O ATOM 632 CB TYR A 41 23.306 -5.500 -12.673 1.00 21.31 C ATOM 633 CG TYR A 41 22.846 -4.097 -12.350 1.00 3.41 C ATOM 634 CD1 TYR A 41 23.709 -3.015 -12.476 1.00 25.32 C ATOM 635 CD2 TYR A 41 21.548 -3.852 -11.920 1.00 11.33 C ATOM 636 CE1 TYR A 41 23.294 -1.731 -12.181 1.00 33.30 C ATOM 637 CE2 TYR A 41 21.123 -2.571 -11.624 1.00 40.11 C ATOM 638 CZ TYR A 41 22.000 -1.514 -11.756 1.00 33.22 C ATOM 639 OH TYR A 41 21.581 -0.236 -11.462 1.00 63.55 O ATOM 0 H TYR A 41 26.031 -5.805 -12.257 1.00 74.31 H new ATOM 0 HA TYR A 41 23.586 -5.973 -10.595 1.00 12.02 H new ATOM 0 HB2 TYR A 41 23.927 -5.473 -13.568 1.00 21.31 H new ATOM 0 HB3 TYR A 41 22.436 -6.114 -12.907 1.00 21.31 H new ATOM 0 HD1 TYR A 41 24.722 -3.181 -12.811 1.00 25.32 H new ATOM 0 HD2 TYR A 41 20.859 -4.677 -11.815 1.00 11.33 H new ATOM 0 HE1 TYR A 41 23.979 -0.902 -12.283 1.00 33.30 H new ATOM 0 HE2 TYR A 41 20.110 -2.398 -11.291 1.00 40.11 H new ATOM 0 HH TYR A 41 20.643 -0.256 -11.178 1.00 63.55 H new ATOM 649 N HIS A 42 22.984 -8.284 -11.933 1.00 2.24 N ATOM 650 CA HIS A 42 22.901 -9.723 -12.155 1.00 22.04 C ATOM 651 C HIS A 42 22.549 -10.029 -13.607 1.00 73.12 C ATOM 652 O HIS A 42 21.444 -9.736 -14.064 1.00 13.43 O ATOM 653 CB HIS A 42 21.860 -10.345 -11.223 1.00 44.11 C ATOM 654 CG HIS A 42 22.136 -11.779 -10.890 1.00 14.12 C ATOM 655 ND1 HIS A 42 23.398 -12.258 -10.612 1.00 4.03 N ATOM 656 CD2 HIS A 42 21.302 -12.840 -10.789 1.00 74.22 C ATOM 657 CE1 HIS A 42 23.329 -13.552 -10.356 1.00 65.22 C ATOM 658 NE2 HIS A 42 22.068 -13.930 -10.457 1.00 31.22 N ATOM 0 H HIS A 42 22.083 -7.806 -11.922 1.00 2.24 H new ATOM 0 HA HIS A 42 23.877 -10.156 -11.937 1.00 22.04 H new ATOM 0 HB2 HIS A 42 21.820 -9.767 -10.300 1.00 44.11 H new ATOM 0 HB3 HIS A 42 20.877 -10.271 -11.688 1.00 44.11 H new ATOM 0 HD2 HIS A 42 20.233 -12.831 -10.941 1.00 74.22 H new ATOM 0 HE1 HIS A 42 24.162 -14.192 -10.106 1.00 65.22 H new ATOM 0 HE2 HIS A 42 21.720 -14.878 -10.312 1.00 31.22 H new ATOM 666 N VAL A 43 23.496 -10.620 -14.329 1.00 75.20 N ATOM 667 CA VAL A 43 23.285 -10.966 -15.730 1.00 30.44 C ATOM 668 C VAL A 43 23.132 -12.473 -15.906 1.00 54.23 C ATOM 669 O VAL A 43 23.942 -13.252 -15.405 1.00 22.43 O ATOM 670 CB VAL A 43 24.448 -10.473 -16.611 1.00 10.03 C ATOM 671 CG1 VAL A 43 24.166 -10.761 -18.077 1.00 42.35 C ATOM 672 CG2 VAL A 43 24.692 -8.988 -16.387 1.00 62.15 C ATOM 0 H VAL A 43 24.416 -10.869 -13.967 1.00 75.20 H new ATOM 0 HA VAL A 43 22.366 -10.471 -16.044 1.00 30.44 H new ATOM 0 HB VAL A 43 25.351 -11.013 -16.327 1.00 10.03 H new ATOM 0 HG11 VAL A 43 24.999 -10.406 -18.684 1.00 42.35 H new ATOM 0 HG12 VAL A 43 24.045 -11.835 -18.220 1.00 42.35 H new ATOM 0 HG13 VAL A 43 23.252 -10.249 -18.379 1.00 42.35 H new ATOM 0 HG21 VAL A 43 25.517 -8.656 -17.017 1.00 62.15 H new ATOM 0 HG22 VAL A 43 23.792 -8.429 -16.643 1.00 62.15 H new ATOM 0 HG23 VAL A 43 24.942 -8.814 -15.340 1.00 62.15 H new ATOM 682 N ILE A 44 22.088 -12.876 -16.623 1.00 15.44 N ATOM 683 CA ILE A 44 21.829 -14.289 -16.867 1.00 30.21 C ATOM 684 C ILE A 44 21.662 -14.568 -18.357 1.00 13.03 C ATOM 685 O ILE A 44 20.553 -14.754 -18.858 1.00 72.41 O ATOM 686 CB ILE A 44 20.569 -14.768 -16.122 1.00 30.01 C ATOM 687 CG1 ILE A 44 20.610 -14.314 -14.661 1.00 51.44 C ATOM 688 CG2 ILE A 44 20.446 -16.282 -16.208 1.00 0.00 C ATOM 689 CD1 ILE A 44 19.397 -14.736 -13.863 1.00 14.11 C ATOM 0 H ILE A 44 21.408 -12.243 -17.045 1.00 15.44 H new ATOM 0 HA ILE A 44 22.693 -14.837 -16.492 1.00 30.21 H new ATOM 0 HB ILE A 44 19.694 -14.324 -16.597 1.00 30.01 H new ATOM 0 HG12 ILE A 44 21.505 -14.719 -14.188 1.00 51.44 H new ATOM 0 HG13 ILE A 44 20.696 -13.228 -14.629 1.00 51.44 H new ATOM 0 HG21 ILE A 44 19.551 -16.605 -15.677 1.00 0.00 H new ATOM 0 HG22 ILE A 44 20.376 -16.583 -17.253 1.00 0.00 H new ATOM 0 HG23 ILE A 44 21.323 -16.745 -15.756 1.00 0.00 H new ATOM 0 HD11 ILE A 44 19.494 -14.380 -12.837 1.00 14.11 H new ATOM 0 HD12 ILE A 44 18.500 -14.309 -14.312 1.00 14.11 H new ATOM 0 HD13 ILE A 44 19.321 -15.823 -13.864 1.00 14.11 H new ATOM 701 N PRO A 45 22.789 -14.599 -19.083 1.00 71.30 N ATOM 702 CA PRO A 45 22.794 -14.857 -20.526 1.00 71.40 C ATOM 703 C PRO A 45 22.423 -16.299 -20.858 1.00 45.35 C ATOM 704 O PRO A 45 22.848 -17.232 -20.178 1.00 24.33 O ATOM 705 CB PRO A 45 24.241 -14.570 -20.933 1.00 3.12 C ATOM 706 CG PRO A 45 25.035 -14.795 -19.692 1.00 42.14 C ATOM 707 CD PRO A 45 24.145 -14.386 -18.551 1.00 44.23 C ATOM 0 HA PRO A 45 22.060 -14.246 -21.052 1.00 71.40 H new ATOM 0 HB2 PRO A 45 24.565 -15.232 -21.736 1.00 3.12 H new ATOM 0 HB3 PRO A 45 24.355 -13.549 -21.296 1.00 3.12 H new ATOM 0 HG2 PRO A 45 25.330 -15.840 -19.602 1.00 42.14 H new ATOM 0 HG3 PRO A 45 25.952 -14.205 -19.703 1.00 42.14 H new ATOM 0 HD2 PRO A 45 24.328 -14.990 -17.662 1.00 44.23 H new ATOM 0 HD3 PRO A 45 24.307 -13.346 -18.268 1.00 44.23 H new ATOM 715 N VAL A 46 21.629 -16.473 -21.910 1.00 31.42 N ATOM 716 CA VAL A 46 21.203 -17.802 -22.334 1.00 14.35 C ATOM 717 C VAL A 46 21.393 -17.987 -23.835 1.00 30.13 C ATOM 718 O VAL A 46 20.848 -17.230 -24.638 1.00 61.21 O ATOM 719 CB VAL A 46 19.725 -18.057 -21.979 1.00 45.31 C ATOM 720 CG1 VAL A 46 19.317 -19.468 -22.374 1.00 43.32 C ATOM 721 CG2 VAL A 46 19.485 -17.819 -20.496 1.00 2.20 C ATOM 0 H VAL A 46 21.268 -15.711 -22.484 1.00 31.42 H new ATOM 0 HA VAL A 46 21.826 -18.520 -21.801 1.00 14.35 H new ATOM 0 HB VAL A 46 19.108 -17.356 -22.541 1.00 45.31 H new ATOM 0 HG11 VAL A 46 18.270 -19.630 -22.116 1.00 43.32 H new ATOM 0 HG12 VAL A 46 19.450 -19.598 -23.448 1.00 43.32 H new ATOM 0 HG13 VAL A 46 19.938 -20.189 -21.842 1.00 43.32 H new ATOM 0 HG21 VAL A 46 18.436 -18.004 -20.263 1.00 2.20 H new ATOM 0 HG22 VAL A 46 20.111 -18.495 -19.913 1.00 2.20 H new ATOM 0 HG23 VAL A 46 19.736 -16.788 -20.248 1.00 2.20 H new ATOM 731 N SER A 47 22.170 -19.000 -24.207 1.00 12.44 N ATOM 732 CA SER A 47 22.435 -19.283 -25.612 1.00 62.21 C ATOM 733 C SER A 47 22.594 -20.783 -25.843 1.00 50.11 C ATOM 734 O SER A 47 23.010 -21.532 -24.959 1.00 71.53 O ATOM 735 CB SER A 47 23.695 -18.548 -26.073 1.00 64.53 C ATOM 736 OG SER A 47 24.457 -19.349 -26.961 1.00 35.11 O ATOM 0 H SER A 47 22.626 -19.638 -23.555 1.00 12.44 H new ATOM 0 HA SER A 47 21.584 -18.931 -26.195 1.00 62.21 H new ATOM 0 HB2 SER A 47 23.417 -17.617 -26.566 1.00 64.53 H new ATOM 0 HB3 SER A 47 24.301 -18.281 -25.207 1.00 64.53 H new ATOM 0 HG SER A 47 25.255 -18.855 -27.244 1.00 35.11 H new ATOM 742 N PRO A 48 22.255 -21.232 -27.060 1.00 73.34 N ATOM 743 CA PRO A 48 22.351 -22.646 -27.438 1.00 10.43 C ATOM 744 C PRO A 48 23.796 -23.116 -27.559 1.00 44.14 C ATOM 745 O PRO A 48 24.062 -24.309 -27.710 1.00 13.24 O ATOM 746 CB PRO A 48 21.655 -22.697 -28.800 1.00 64.23 C ATOM 747 CG PRO A 48 21.793 -21.319 -29.348 1.00 45.25 C ATOM 748 CD PRO A 48 21.751 -20.395 -28.163 1.00 24.35 C ATOM 0 HA PRO A 48 21.902 -23.300 -26.690 1.00 10.43 H new ATOM 0 HB2 PRO A 48 22.122 -23.432 -29.456 1.00 64.23 H new ATOM 0 HB3 PRO A 48 20.607 -22.980 -28.699 1.00 64.23 H new ATOM 0 HG2 PRO A 48 22.729 -21.209 -29.895 1.00 45.25 H new ATOM 0 HG3 PRO A 48 20.987 -21.094 -30.046 1.00 45.25 H new ATOM 0 HD2 PRO A 48 22.375 -19.515 -28.317 1.00 24.35 H new ATOM 0 HD3 PRO A 48 20.740 -20.038 -27.967 1.00 24.35 H new ATOM 756 N LYS A 49 24.729 -22.171 -27.493 1.00 74.42 N ATOM 757 CA LYS A 49 26.148 -22.488 -27.594 1.00 62.40 C ATOM 758 C LYS A 49 26.829 -22.375 -26.234 1.00 31.33 C ATOM 759 O LYS A 49 27.756 -23.125 -25.928 1.00 62.20 O ATOM 760 CB LYS A 49 26.830 -21.555 -28.597 1.00 3.13 C ATOM 761 CG LYS A 49 28.272 -21.929 -28.893 1.00 23.25 C ATOM 762 CD LYS A 49 28.791 -21.217 -30.131 1.00 15.13 C ATOM 763 CE LYS A 49 30.097 -21.825 -30.618 1.00 34.20 C ATOM 764 NZ LYS A 49 29.866 -23.025 -31.469 1.00 21.53 N ATOM 0 H LYS A 49 24.527 -21.179 -27.370 1.00 74.42 H new ATOM 0 HA LYS A 49 26.241 -23.517 -27.943 1.00 62.40 H new ATOM 0 HB2 LYS A 49 26.264 -21.560 -29.528 1.00 3.13 H new ATOM 0 HB3 LYS A 49 26.800 -20.536 -28.211 1.00 3.13 H new ATOM 0 HG2 LYS A 49 28.898 -21.675 -28.037 1.00 23.25 H new ATOM 0 HG3 LYS A 49 28.347 -23.007 -29.034 1.00 23.25 H new ATOM 0 HD2 LYS A 49 28.045 -21.273 -30.924 1.00 15.13 H new ATOM 0 HD3 LYS A 49 28.941 -20.161 -29.908 1.00 15.13 H new ATOM 0 HE2 LYS A 49 30.656 -21.080 -31.185 1.00 34.20 H new ATOM 0 HE3 LYS A 49 30.711 -22.100 -29.761 1.00 34.20 H new ATOM 0 HZ1 LYS A 49 30.780 -23.410 -31.781 1.00 21.53 H new ATOM 0 HZ2 LYS A 49 29.355 -23.746 -30.921 1.00 21.53 H new ATOM 0 HZ3 LYS A 49 29.301 -22.758 -32.300 1.00 21.53 H new ATOM 778 N VAL A 50 26.362 -21.434 -25.420 1.00 12.04 N ATOM 779 CA VAL A 50 26.924 -21.225 -24.091 1.00 12.33 C ATOM 780 C VAL A 50 26.443 -22.294 -23.116 1.00 64.21 C ATOM 781 O VAL A 50 26.951 -22.405 -22.001 1.00 25.41 O ATOM 782 CB VAL A 50 26.552 -19.837 -23.536 1.00 44.53 C ATOM 783 CG1 VAL A 50 25.070 -19.775 -23.199 1.00 64.02 C ATOM 784 CG2 VAL A 50 27.399 -19.506 -22.317 1.00 22.45 C ATOM 0 H VAL A 50 25.596 -20.804 -25.658 1.00 12.04 H new ATOM 0 HA VAL A 50 28.007 -21.290 -24.192 1.00 12.33 H new ATOM 0 HB VAL A 50 26.756 -19.092 -24.305 1.00 44.53 H new ATOM 0 HG11 VAL A 50 24.827 -18.787 -22.808 1.00 64.02 H new ATOM 0 HG12 VAL A 50 24.484 -19.964 -24.098 1.00 64.02 H new ATOM 0 HG13 VAL A 50 24.836 -20.530 -22.448 1.00 64.02 H new ATOM 0 HG21 VAL A 50 27.123 -18.522 -21.938 1.00 22.45 H new ATOM 0 HG22 VAL A 50 27.230 -20.254 -21.542 1.00 22.45 H new ATOM 0 HG23 VAL A 50 28.453 -19.505 -22.596 1.00 22.45 H new ATOM 794 N ALA A 51 25.461 -23.080 -23.545 1.00 41.34 N ATOM 795 CA ALA A 51 24.913 -24.143 -22.712 1.00 3.42 C ATOM 796 C ALA A 51 26.013 -25.078 -22.222 1.00 4.03 C ATOM 797 O ALA A 51 26.525 -25.902 -22.979 1.00 53.52 O ATOM 798 CB ALA A 51 23.857 -24.924 -23.479 1.00 52.32 C ATOM 0 H ALA A 51 25.028 -23.000 -24.465 1.00 41.34 H new ATOM 0 HA ALA A 51 24.447 -23.684 -21.840 1.00 3.42 H new ATOM 0 HB1 ALA A 51 23.457 -25.715 -22.844 1.00 52.32 H new ATOM 0 HB2 ALA A 51 23.051 -24.252 -23.774 1.00 52.32 H new ATOM 0 HB3 ALA A 51 24.306 -25.365 -24.369 1.00 52.32 H new ATOM 804 N GLY A 52 26.374 -24.945 -20.949 1.00 10.53 N ATOM 805 CA GLY A 52 27.412 -25.784 -20.380 1.00 2.11 C ATOM 806 C GLY A 52 28.758 -25.089 -20.331 1.00 42.45 C ATOM 807 O GLY A 52 29.797 -25.737 -20.205 1.00 71.52 O ATOM 0 H GLY A 52 25.966 -24.271 -20.302 1.00 10.53 H new ATOM 0 HA2 GLY A 52 27.123 -26.081 -19.372 1.00 2.11 H new ATOM 0 HA3 GLY A 52 27.500 -26.697 -20.968 1.00 2.11 H new ATOM 811 N LYS A 53 28.742 -23.764 -20.434 1.00 1.13 N ATOM 812 CA LYS A 53 29.970 -22.978 -20.401 1.00 61.55 C ATOM 813 C LYS A 53 29.804 -21.744 -19.521 1.00 34.32 C ATOM 814 O LYS A 53 28.694 -21.413 -19.100 1.00 25.50 O ATOM 815 CB LYS A 53 30.368 -22.557 -21.818 1.00 31.40 C ATOM 816 CG LYS A 53 30.297 -23.687 -22.831 1.00 25.23 C ATOM 817 CD LYS A 53 30.731 -23.226 -24.212 1.00 53.31 C ATOM 818 CE LYS A 53 32.175 -22.750 -24.213 1.00 65.11 C ATOM 819 NZ LYS A 53 33.097 -23.774 -23.648 1.00 60.31 N ATOM 0 H LYS A 53 27.891 -23.212 -20.541 1.00 1.13 H new ATOM 0 HA LYS A 53 30.758 -23.600 -19.978 1.00 61.55 H new ATOM 0 HB2 LYS A 53 29.716 -21.747 -22.144 1.00 31.40 H new ATOM 0 HB3 LYS A 53 31.383 -22.161 -21.799 1.00 31.40 H new ATOM 0 HG2 LYS A 53 30.933 -24.510 -22.505 1.00 25.23 H new ATOM 0 HG3 LYS A 53 29.278 -24.071 -22.878 1.00 25.23 H new ATOM 0 HD2 LYS A 53 30.616 -24.045 -24.923 1.00 53.31 H new ATOM 0 HD3 LYS A 53 30.081 -22.419 -24.548 1.00 53.31 H new ATOM 0 HE2 LYS A 53 32.478 -22.512 -25.233 1.00 65.11 H new ATOM 0 HE3 LYS A 53 32.255 -21.830 -23.633 1.00 65.11 H new ATOM 0 HZ1 LYS A 53 34.081 -23.495 -23.834 1.00 60.31 H new ATOM 0 HZ2 LYS A 53 32.946 -23.848 -22.622 1.00 60.31 H new ATOM 0 HZ3 LYS A 53 32.908 -24.695 -24.093 1.00 60.31 H new ATOM 833 N THR A 54 30.913 -21.065 -19.246 1.00 52.30 N ATOM 834 CA THR A 54 30.890 -19.867 -18.416 1.00 55.00 C ATOM 835 C THR A 54 31.286 -18.634 -19.219 1.00 42.42 C ATOM 836 O THR A 54 32.424 -18.518 -19.678 1.00 14.04 O ATOM 837 CB THR A 54 31.833 -20.003 -17.206 1.00 64.34 C ATOM 838 OG1 THR A 54 32.835 -20.991 -17.475 1.00 73.12 O ATOM 839 CG2 THR A 54 31.058 -20.387 -15.955 1.00 72.54 C ATOM 0 H THR A 54 31.839 -21.324 -19.586 1.00 52.30 H new ATOM 0 HA THR A 54 29.867 -19.751 -18.058 1.00 55.00 H new ATOM 0 HB THR A 54 32.310 -19.038 -17.035 1.00 64.34 H new ATOM 0 HG1 THR A 54 33.432 -21.071 -16.702 1.00 73.12 H new ATOM 0 HG21 THR A 54 31.746 -20.477 -15.114 1.00 72.54 H new ATOM 0 HG22 THR A 54 30.316 -19.619 -15.736 1.00 72.54 H new ATOM 0 HG23 THR A 54 30.556 -21.341 -16.117 1.00 72.54 H new ATOM 847 N LEU A 55 30.343 -17.713 -19.386 1.00 73.51 N ATOM 848 CA LEU A 55 30.594 -16.487 -20.134 1.00 43.41 C ATOM 849 C LEU A 55 30.711 -15.290 -19.195 1.00 31.41 C ATOM 850 O LEU A 55 29.732 -14.880 -18.570 1.00 72.03 O ATOM 851 CB LEU A 55 29.475 -16.246 -21.149 1.00 11.25 C ATOM 852 CG LEU A 55 29.800 -15.284 -22.292 1.00 5.03 C ATOM 853 CD1 LEU A 55 30.878 -15.869 -23.191 1.00 71.33 C ATOM 854 CD2 LEU A 55 28.547 -14.966 -23.095 1.00 24.24 C ATOM 0 H LEU A 55 29.397 -17.793 -19.013 1.00 73.51 H new ATOM 0 HA LEU A 55 31.539 -16.603 -20.665 1.00 43.41 H new ATOM 0 HB2 LEU A 55 29.189 -17.206 -21.579 1.00 11.25 H new ATOM 0 HB3 LEU A 55 28.604 -15.864 -20.616 1.00 11.25 H new ATOM 0 HG LEU A 55 30.177 -14.355 -21.864 1.00 5.03 H new ATOM 0 HD11 LEU A 55 31.096 -15.171 -23.999 1.00 71.33 H new ATOM 0 HD12 LEU A 55 31.782 -16.044 -22.608 1.00 71.33 H new ATOM 0 HD13 LEU A 55 30.529 -16.812 -23.611 1.00 71.33 H new ATOM 0 HD21 LEU A 55 28.798 -14.280 -23.904 1.00 24.24 H new ATOM 0 HD22 LEU A 55 28.139 -15.886 -23.513 1.00 24.24 H new ATOM 0 HD23 LEU A 55 27.805 -14.503 -22.444 1.00 24.24 H new ATOM 866 N LEU A 56 31.913 -14.734 -19.101 1.00 43.53 N ATOM 867 CA LEU A 56 32.158 -13.582 -18.240 1.00 1.11 C ATOM 868 C LEU A 56 31.807 -13.902 -16.790 1.00 51.44 C ATOM 869 O LEU A 56 31.542 -13.003 -15.992 1.00 63.45 O ATOM 870 CB LEU A 56 31.345 -12.379 -18.720 1.00 52.23 C ATOM 871 CG LEU A 56 31.987 -11.530 -19.818 1.00 53.21 C ATOM 872 CD1 LEU A 56 31.840 -12.207 -21.172 1.00 34.44 C ATOM 873 CD2 LEU A 56 31.370 -10.139 -19.846 1.00 51.10 C ATOM 0 H LEU A 56 32.734 -15.062 -19.610 1.00 43.53 H new ATOM 0 HA LEU A 56 33.219 -13.339 -18.293 1.00 1.11 H new ATOM 0 HB2 LEU A 56 30.382 -12.738 -19.083 1.00 52.23 H new ATOM 0 HB3 LEU A 56 31.144 -11.737 -17.863 1.00 52.23 H new ATOM 0 HG LEU A 56 33.050 -11.430 -19.598 1.00 53.21 H new ATOM 0 HD11 LEU A 56 32.303 -11.588 -21.940 1.00 34.44 H new ATOM 0 HD12 LEU A 56 32.329 -13.181 -21.147 1.00 34.44 H new ATOM 0 HD13 LEU A 56 30.782 -12.338 -21.400 1.00 34.44 H new ATOM 0 HD21 LEU A 56 31.839 -9.549 -20.633 1.00 51.10 H new ATOM 0 HD22 LEU A 56 30.301 -10.219 -20.041 1.00 51.10 H new ATOM 0 HD23 LEU A 56 31.528 -9.651 -18.884 1.00 51.10 H new ATOM 885 N GLY A 57 31.809 -15.189 -16.456 1.00 55.43 N ATOM 886 CA GLY A 57 31.491 -15.604 -15.103 1.00 34.04 C ATOM 887 C GLY A 57 30.029 -15.968 -14.936 1.00 73.21 C ATOM 888 O GLY A 57 29.617 -16.437 -13.875 1.00 53.43 O ATOM 0 H GLY A 57 32.025 -15.951 -17.098 1.00 55.43 H new ATOM 0 HA2 GLY A 57 32.108 -16.461 -14.835 1.00 34.04 H new ATOM 0 HA3 GLY A 57 31.743 -14.800 -14.411 1.00 34.04 H new ATOM 892 N GLN A 58 29.243 -15.751 -15.986 1.00 61.10 N ATOM 893 CA GLN A 58 27.818 -16.058 -15.950 1.00 1.24 C ATOM 894 C GLN A 58 27.545 -17.446 -16.520 1.00 3.15 C ATOM 895 O GLN A 58 27.990 -17.773 -17.619 1.00 71.23 O ATOM 896 CB GLN A 58 27.029 -15.008 -16.733 1.00 54.31 C ATOM 897 CG GLN A 58 27.356 -13.578 -16.335 1.00 4.25 C ATOM 898 CD GLN A 58 27.486 -13.405 -14.834 1.00 23.40 C ATOM 899 OE1 GLN A 58 28.710 -13.190 -14.366 1.00 5.03 O flip ATOM 900 NE2 GLN A 58 26.497 -13.465 -14.103 1.00 64.34 N flip ATOM 0 H GLN A 58 29.569 -15.364 -16.872 1.00 61.10 H new ATOM 0 HA GLN A 58 27.495 -16.043 -14.909 1.00 1.24 H new ATOM 0 HB2 GLN A 58 27.229 -15.135 -17.797 1.00 54.31 H new ATOM 0 HB3 GLN A 58 25.963 -15.182 -16.586 1.00 54.31 H new ATOM 0 HG2 GLN A 58 28.287 -13.276 -16.814 1.00 4.25 H new ATOM 0 HG3 GLN A 58 26.576 -12.914 -16.707 1.00 4.25 H new ATOM 0 HE21 GLN A 58 25.575 -13.632 -14.505 1.00 64.34 H new ATOM 0 HE22 GLN A 58 26.600 -13.348 -13.095 1.00 64.34 H new ATOM 909 N GLN A 59 26.812 -18.257 -15.764 1.00 23.04 N ATOM 910 CA GLN A 59 26.482 -19.610 -16.194 1.00 33.40 C ATOM 911 C GLN A 59 25.732 -19.591 -17.522 1.00 65.42 C ATOM 912 O GLN A 59 24.892 -18.725 -17.760 1.00 30.10 O ATOM 913 CB GLN A 59 25.639 -20.315 -15.130 1.00 21.25 C ATOM 914 CG GLN A 59 25.354 -21.774 -15.447 1.00 60.20 C ATOM 915 CD GLN A 59 26.512 -22.686 -15.091 1.00 14.03 C ATOM 916 OE1 GLN A 59 26.674 -23.080 -13.935 1.00 50.44 O ATOM 917 NE2 GLN A 59 27.324 -23.027 -16.084 1.00 61.30 N ATOM 0 H GLN A 59 26.436 -18.001 -14.851 1.00 23.04 H new ATOM 0 HA GLN A 59 27.414 -20.158 -16.331 1.00 33.40 H new ATOM 0 HB2 GLN A 59 26.154 -20.254 -14.171 1.00 21.25 H new ATOM 0 HB3 GLN A 59 24.693 -19.785 -15.018 1.00 21.25 H new ATOM 0 HG2 GLN A 59 24.465 -22.093 -14.903 1.00 60.20 H new ATOM 0 HG3 GLN A 59 25.131 -21.874 -16.509 1.00 60.20 H new ATOM 0 HE21 GLN A 59 27.152 -22.677 -17.027 1.00 61.30 H new ATOM 0 HE22 GLN A 59 28.120 -23.639 -15.905 1.00 61.30 H new ATOM 926 N GLY A 60 26.044 -20.554 -18.386 1.00 13.44 N ATOM 927 CA GLY A 60 25.391 -20.629 -19.680 1.00 1.44 C ATOM 928 C GLY A 60 24.196 -21.561 -19.673 1.00 13.30 C ATOM 929 O GLY A 60 24.133 -22.495 -18.874 1.00 61.51 O ATOM 0 H GLY A 60 26.737 -21.282 -18.212 1.00 13.44 H new ATOM 0 HA2 GLY A 60 25.068 -19.632 -19.979 1.00 1.44 H new ATOM 0 HA3 GLY A 60 26.109 -20.969 -20.427 1.00 1.44 H new ATOM 933 N TYR A 61 23.244 -21.306 -20.564 1.00 0.22 N ATOM 934 CA TYR A 61 22.043 -22.127 -20.655 1.00 15.23 C ATOM 935 C TYR A 61 21.585 -22.264 -22.104 1.00 20.33 C ATOM 936 O TYR A 61 21.526 -21.283 -22.843 1.00 42.35 O ATOM 937 CB TYR A 61 20.921 -21.522 -19.809 1.00 53.43 C ATOM 938 CG TYR A 61 20.921 -21.996 -18.374 1.00 2.14 C ATOM 939 CD1 TYR A 61 20.371 -23.223 -18.026 1.00 73.33 C ATOM 940 CD2 TYR A 61 21.473 -21.217 -17.364 1.00 43.53 C ATOM 941 CE1 TYR A 61 20.368 -23.660 -16.716 1.00 24.02 C ATOM 942 CE2 TYR A 61 21.477 -21.646 -16.051 1.00 52.12 C ATOM 943 CZ TYR A 61 20.923 -22.868 -15.732 1.00 33.00 C ATOM 944 OH TYR A 61 20.924 -23.300 -14.426 1.00 33.25 O ATOM 0 H TYR A 61 23.281 -20.537 -21.233 1.00 0.22 H new ATOM 0 HA TYR A 61 22.282 -23.119 -20.273 1.00 15.23 H new ATOM 0 HB2 TYR A 61 21.012 -20.436 -19.824 1.00 53.43 H new ATOM 0 HB3 TYR A 61 19.962 -21.768 -20.264 1.00 53.43 H new ATOM 0 HD1 TYR A 61 19.938 -23.847 -18.794 1.00 73.33 H new ATOM 0 HD2 TYR A 61 21.907 -20.259 -17.610 1.00 43.53 H new ATOM 0 HE1 TYR A 61 19.934 -24.616 -16.463 1.00 24.02 H new ATOM 0 HE2 TYR A 61 21.911 -21.028 -15.279 1.00 52.12 H new ATOM 0 HH TYR A 61 21.353 -22.626 -13.859 1.00 33.25 H new ATOM 954 N ALA A 62 21.261 -23.490 -22.501 1.00 64.42 N ATOM 955 CA ALA A 62 20.806 -23.758 -23.860 1.00 4.20 C ATOM 956 C ALA A 62 19.444 -23.123 -24.118 1.00 30.15 C ATOM 957 O ALA A 62 19.148 -22.693 -25.233 1.00 2.31 O ATOM 958 CB ALA A 62 20.748 -25.257 -24.112 1.00 24.23 C ATOM 0 H ALA A 62 21.305 -24.314 -21.901 1.00 64.42 H new ATOM 0 HA ALA A 62 21.522 -23.313 -24.551 1.00 4.20 H new ATOM 0 HB1 ALA A 62 20.407 -25.442 -25.131 1.00 24.23 H new ATOM 0 HB2 ALA A 62 21.741 -25.687 -23.978 1.00 24.23 H new ATOM 0 HB3 ALA A 62 20.055 -25.718 -23.408 1.00 24.23 H new ATOM 964 N THR A 63 18.616 -23.068 -23.079 1.00 31.11 N ATOM 965 CA THR A 63 17.284 -22.488 -23.193 1.00 51.23 C ATOM 966 C THR A 63 16.844 -21.857 -21.877 1.00 41.11 C ATOM 967 O THR A 63 17.186 -22.344 -20.799 1.00 3.45 O ATOM 968 CB THR A 63 16.245 -23.544 -23.615 1.00 63.14 C ATOM 969 OG1 THR A 63 16.120 -24.542 -22.596 1.00 72.45 O ATOM 970 CG2 THR A 63 16.644 -24.200 -24.929 1.00 33.12 C ATOM 0 H THR A 63 18.845 -23.418 -22.149 1.00 31.11 H new ATOM 0 HA THR A 63 17.341 -21.717 -23.962 1.00 51.23 H new ATOM 0 HB THR A 63 15.286 -23.044 -23.753 1.00 63.14 H new ATOM 0 HG1 THR A 63 15.456 -25.209 -22.871 1.00 72.45 H new ATOM 0 HG21 THR A 63 15.896 -24.942 -25.207 1.00 33.12 H new ATOM 0 HG22 THR A 63 16.710 -23.441 -25.709 1.00 33.12 H new ATOM 0 HG23 THR A 63 17.612 -24.687 -24.813 1.00 33.12 H new ATOM 978 N LEU A 64 16.084 -20.772 -21.972 1.00 12.23 N ATOM 979 CA LEU A 64 15.596 -20.074 -20.787 1.00 52.12 C ATOM 980 C LEU A 64 14.770 -21.007 -19.907 1.00 5.22 C ATOM 981 O LEU A 64 14.760 -20.874 -18.683 1.00 53.25 O ATOM 982 CB LEU A 64 14.755 -18.863 -21.195 1.00 2.41 C ATOM 983 CG LEU A 64 15.314 -18.011 -22.335 1.00 60.03 C ATOM 984 CD1 LEU A 64 14.274 -17.837 -23.431 1.00 33.01 C ATOM 985 CD2 LEU A 64 15.774 -16.657 -21.814 1.00 70.32 C ATOM 0 H LEU A 64 15.792 -20.356 -22.857 1.00 12.23 H new ATOM 0 HA LEU A 64 16.459 -19.734 -20.215 1.00 52.12 H new ATOM 0 HB2 LEU A 64 13.764 -19.214 -21.483 1.00 2.41 H new ATOM 0 HB3 LEU A 64 14.625 -18.225 -20.321 1.00 2.41 H new ATOM 0 HG LEU A 64 16.176 -18.526 -22.759 1.00 60.03 H new ATOM 0 HD11 LEU A 64 14.690 -17.228 -24.234 1.00 33.01 H new ATOM 0 HD12 LEU A 64 13.993 -18.814 -23.825 1.00 33.01 H new ATOM 0 HD13 LEU A 64 13.392 -17.344 -23.021 1.00 33.01 H new ATOM 0 HD21 LEU A 64 16.169 -16.065 -22.639 1.00 70.32 H new ATOM 0 HD22 LEU A 64 14.930 -16.135 -21.363 1.00 70.32 H new ATOM 0 HD23 LEU A 64 16.553 -16.801 -21.065 1.00 70.32 H new ATOM 997 N ALA A 65 14.082 -21.952 -20.538 1.00 31.21 N ATOM 998 CA ALA A 65 13.257 -22.910 -19.812 1.00 23.21 C ATOM 999 C ALA A 65 14.118 -23.959 -19.116 1.00 61.34 C ATOM 1000 O ALA A 65 13.609 -24.807 -18.383 1.00 11.55 O ATOM 1001 CB ALA A 65 12.268 -23.578 -20.756 1.00 44.41 C ATOM 0 H ALA A 65 14.079 -22.075 -21.551 1.00 31.21 H new ATOM 0 HA ALA A 65 12.702 -22.367 -19.047 1.00 23.21 H new ATOM 0 HB1 ALA A 65 11.659 -24.291 -20.200 1.00 44.41 H new ATOM 0 HB2 ALA A 65 11.624 -22.821 -21.203 1.00 44.41 H new ATOM 0 HB3 ALA A 65 12.812 -24.102 -21.542 1.00 44.41 H new ATOM 1007 N ASP A 66 15.424 -23.897 -19.352 1.00 71.44 N ATOM 1008 CA ASP A 66 16.356 -24.842 -18.748 1.00 33.30 C ATOM 1009 C ASP A 66 16.945 -24.276 -17.460 1.00 42.21 C ATOM 1010 O ASP A 66 17.675 -24.962 -16.744 1.00 74.32 O ATOM 1011 CB ASP A 66 17.478 -25.184 -19.730 1.00 35.01 C ATOM 1012 CG ASP A 66 18.328 -26.346 -19.256 1.00 0.03 C ATOM 1013 OD1 ASP A 66 17.957 -27.506 -19.534 1.00 41.32 O ATOM 1014 OD2 ASP A 66 19.365 -26.096 -18.607 1.00 0.42 O ATOM 0 H ASP A 66 15.861 -23.202 -19.957 1.00 71.44 H new ATOM 0 HA ASP A 66 15.807 -25.752 -18.506 1.00 33.30 H new ATOM 0 HB2 ASP A 66 17.046 -25.426 -20.701 1.00 35.01 H new ATOM 0 HB3 ASP A 66 18.112 -24.309 -19.872 1.00 35.01 H new ATOM 1019 N VAL A 67 16.625 -23.018 -17.172 1.00 21.34 N ATOM 1020 CA VAL A 67 17.123 -22.359 -15.970 1.00 73.11 C ATOM 1021 C VAL A 67 16.182 -22.583 -14.791 1.00 45.31 C ATOM 1022 O VAL A 67 14.967 -22.418 -14.895 1.00 12.34 O ATOM 1023 CB VAL A 67 17.298 -20.845 -16.193 1.00 24.15 C ATOM 1024 CG1 VAL A 67 17.988 -20.206 -14.997 1.00 34.04 C ATOM 1025 CG2 VAL A 67 18.079 -20.582 -17.471 1.00 70.05 C ATOM 0 H VAL A 67 16.024 -22.435 -17.754 1.00 21.34 H new ATOM 0 HA VAL A 67 18.094 -22.800 -15.745 1.00 73.11 H new ATOM 0 HB VAL A 67 16.311 -20.394 -16.298 1.00 24.15 H new ATOM 0 HG11 VAL A 67 18.103 -19.136 -15.172 1.00 34.04 H new ATOM 0 HG12 VAL A 67 17.386 -20.364 -14.102 1.00 34.04 H new ATOM 0 HG13 VAL A 67 18.970 -20.659 -14.859 1.00 34.04 H new ATOM 0 HG21 VAL A 67 18.193 -19.507 -17.613 1.00 70.05 H new ATOM 0 HG22 VAL A 67 19.063 -21.045 -17.398 1.00 70.05 H new ATOM 0 HG23 VAL A 67 17.541 -21.005 -18.320 1.00 70.05 H new ATOM 1035 N PRO A 68 16.756 -22.967 -13.641 1.00 63.14 N ATOM 1036 CA PRO A 68 15.988 -23.221 -12.419 1.00 52.21 C ATOM 1037 C PRO A 68 15.414 -21.942 -11.819 1.00 3.30 C ATOM 1038 O PRO A 68 14.262 -21.911 -11.387 1.00 44.45 O ATOM 1039 CB PRO A 68 17.020 -23.839 -11.473 1.00 70.30 C ATOM 1040 CG PRO A 68 18.332 -23.324 -11.955 1.00 1.34 C ATOM 1041 CD PRO A 68 18.200 -23.183 -13.446 1.00 33.32 C ATOM 0 HA PRO A 68 15.125 -23.860 -12.606 1.00 52.21 H new ATOM 0 HB2 PRO A 68 16.835 -23.546 -10.440 1.00 70.30 H new ATOM 0 HB3 PRO A 68 16.986 -24.928 -11.507 1.00 70.30 H new ATOM 0 HG2 PRO A 68 18.569 -22.366 -11.492 1.00 1.34 H new ATOM 0 HG3 PRO A 68 19.139 -24.010 -11.698 1.00 1.34 H new ATOM 0 HD2 PRO A 68 18.786 -22.346 -13.824 1.00 33.32 H new ATOM 0 HD3 PRO A 68 18.547 -24.076 -13.966 1.00 33.32 H new ATOM 1049 N GLU A 69 16.225 -20.889 -11.796 1.00 5.33 N ATOM 1050 CA GLU A 69 15.797 -19.607 -11.248 1.00 20.23 C ATOM 1051 C GLU A 69 14.903 -18.864 -12.236 1.00 71.33 C ATOM 1052 O GLU A 69 14.973 -19.088 -13.445 1.00 24.41 O ATOM 1053 CB GLU A 69 17.012 -18.746 -10.895 1.00 71.23 C ATOM 1054 CG GLU A 69 16.654 -17.447 -10.194 1.00 41.30 C ATOM 1055 CD GLU A 69 17.684 -17.040 -9.158 1.00 30.11 C ATOM 1056 OE1 GLU A 69 18.877 -16.941 -9.515 1.00 73.11 O ATOM 1057 OE2 GLU A 69 17.298 -16.821 -7.991 1.00 31.42 O ATOM 0 H GLU A 69 17.181 -20.898 -12.150 1.00 5.33 H new ATOM 0 HA GLU A 69 15.224 -19.802 -10.342 1.00 20.23 H new ATOM 0 HB2 GLU A 69 17.681 -19.322 -10.256 1.00 71.23 H new ATOM 0 HB3 GLU A 69 17.562 -18.517 -11.808 1.00 71.23 H new ATOM 0 HG2 GLU A 69 16.556 -16.654 -10.935 1.00 41.30 H new ATOM 0 HG3 GLU A 69 15.682 -17.554 -9.712 1.00 41.30 H new ATOM 1064 N LYS A 70 14.061 -17.979 -11.714 1.00 3.22 N ATOM 1065 CA LYS A 70 13.153 -17.201 -12.548 1.00 71.10 C ATOM 1066 C LYS A 70 13.661 -15.773 -12.722 1.00 22.53 C ATOM 1067 O LYS A 70 13.975 -15.093 -11.745 1.00 41.53 O ATOM 1068 CB LYS A 70 11.752 -17.184 -11.933 1.00 53.40 C ATOM 1069 CG LYS A 70 11.142 -18.565 -11.770 1.00 33.12 C ATOM 1070 CD LYS A 70 9.623 -18.507 -11.766 1.00 64.42 C ATOM 1071 CE LYS A 70 9.089 -17.968 -10.448 1.00 62.40 C ATOM 1072 NZ LYS A 70 7.763 -17.311 -10.614 1.00 44.01 N ATOM 0 H LYS A 70 13.989 -17.782 -10.716 1.00 3.22 H new ATOM 0 HA LYS A 70 13.107 -17.673 -13.529 1.00 71.10 H new ATOM 0 HB2 LYS A 70 11.798 -16.699 -10.958 1.00 53.40 H new ATOM 0 HB3 LYS A 70 11.097 -16.578 -12.559 1.00 53.40 H new ATOM 0 HG2 LYS A 70 11.480 -19.211 -12.580 1.00 33.12 H new ATOM 0 HG3 LYS A 70 11.492 -19.011 -10.839 1.00 33.12 H new ATOM 0 HD2 LYS A 70 9.280 -17.874 -12.585 1.00 64.42 H new ATOM 0 HD3 LYS A 70 9.219 -19.504 -11.943 1.00 64.42 H new ATOM 0 HE2 LYS A 70 9.003 -18.784 -9.730 1.00 62.40 H new ATOM 0 HE3 LYS A 70 9.799 -17.253 -10.034 1.00 62.40 H new ATOM 0 HZ1 LYS A 70 7.433 -16.957 -9.693 1.00 44.01 H new ATOM 0 HZ2 LYS A 70 7.850 -16.516 -11.279 1.00 44.01 H new ATOM 0 HZ3 LYS A 70 7.078 -18.000 -10.985 1.00 44.01 H new ATOM 1086 N VAL A 71 13.739 -15.325 -13.971 1.00 34.42 N ATOM 1087 CA VAL A 71 14.206 -13.978 -14.272 1.00 1.30 C ATOM 1088 C VAL A 71 13.146 -12.938 -13.925 1.00 5.02 C ATOM 1089 O VAL A 71 11.962 -13.128 -14.200 1.00 73.23 O ATOM 1090 CB VAL A 71 14.583 -13.834 -15.758 1.00 45.53 C ATOM 1091 CG1 VAL A 71 13.340 -13.887 -16.633 1.00 20.33 C ATOM 1092 CG2 VAL A 71 15.352 -12.541 -15.989 1.00 64.55 C ATOM 0 H VAL A 71 13.485 -15.876 -14.791 1.00 34.42 H new ATOM 0 HA VAL A 71 15.092 -13.807 -13.661 1.00 1.30 H new ATOM 0 HB VAL A 71 15.228 -14.669 -16.033 1.00 45.53 H new ATOM 0 HG11 VAL A 71 13.627 -13.784 -17.679 1.00 20.33 H new ATOM 0 HG12 VAL A 71 12.834 -14.841 -16.488 1.00 20.33 H new ATOM 0 HG13 VAL A 71 12.667 -13.074 -16.359 1.00 20.33 H new ATOM 0 HG21 VAL A 71 15.611 -12.455 -17.044 1.00 64.55 H new ATOM 0 HG22 VAL A 71 14.733 -11.693 -15.697 1.00 64.55 H new ATOM 0 HG23 VAL A 71 16.264 -12.548 -15.391 1.00 64.55 H new ATOM 1102 N ASP A 72 13.581 -11.838 -13.319 1.00 72.42 N ATOM 1103 CA ASP A 72 12.670 -10.766 -12.935 1.00 73.33 C ATOM 1104 C ASP A 72 12.586 -9.707 -14.029 1.00 53.34 C ATOM 1105 O ASP A 72 11.550 -9.066 -14.208 1.00 5.31 O ATOM 1106 CB ASP A 72 13.125 -10.127 -11.623 1.00 10.24 C ATOM 1107 CG ASP A 72 13.265 -11.140 -10.503 1.00 52.51 C ATOM 1108 OD1 ASP A 72 12.237 -11.722 -10.099 1.00 61.31 O ATOM 1109 OD2 ASP A 72 14.402 -11.349 -10.030 1.00 52.33 O ATOM 0 H ASP A 72 14.558 -11.666 -13.083 1.00 72.42 H new ATOM 0 HA ASP A 72 11.679 -11.197 -12.795 1.00 73.33 H new ATOM 0 HB2 ASP A 72 14.081 -9.627 -11.778 1.00 10.24 H new ATOM 0 HB3 ASP A 72 12.409 -9.360 -11.328 1.00 10.24 H new ATOM 1114 N MET A 73 13.683 -9.528 -14.758 1.00 55.32 N ATOM 1115 CA MET A 73 13.732 -8.546 -15.835 1.00 42.51 C ATOM 1116 C MET A 73 14.437 -9.118 -17.061 1.00 3.33 C ATOM 1117 O MET A 73 15.642 -9.370 -17.035 1.00 20.13 O ATOM 1118 CB MET A 73 14.449 -7.278 -15.365 1.00 53.04 C ATOM 1119 CG MET A 73 14.011 -6.024 -16.104 1.00 44.42 C ATOM 1120 SD MET A 73 15.184 -4.666 -15.922 1.00 13.21 S ATOM 1121 CE MET A 73 14.166 -3.449 -15.090 1.00 60.11 C ATOM 0 H MET A 73 14.549 -10.050 -14.623 1.00 55.32 H new ATOM 0 HA MET A 73 12.708 -8.295 -16.111 1.00 42.51 H new ATOM 0 HB2 MET A 73 14.269 -7.143 -14.298 1.00 53.04 H new ATOM 0 HB3 MET A 73 15.523 -7.409 -15.493 1.00 53.04 H new ATOM 0 HG2 MET A 73 13.889 -6.254 -17.162 1.00 44.42 H new ATOM 0 HG3 MET A 73 13.036 -5.709 -15.732 1.00 44.42 H new ATOM 0 HE1 MET A 73 14.752 -2.548 -14.907 1.00 60.11 H new ATOM 0 HE2 MET A 73 13.308 -3.203 -15.716 1.00 60.11 H new ATOM 0 HE3 MET A 73 13.818 -3.854 -14.140 1.00 60.11 H new ATOM 1131 N VAL A 74 13.679 -9.321 -18.133 1.00 50.34 N ATOM 1132 CA VAL A 74 14.232 -9.862 -19.369 1.00 73.40 C ATOM 1133 C VAL A 74 14.777 -8.752 -20.260 1.00 65.31 C ATOM 1134 O VAL A 74 14.096 -7.761 -20.523 1.00 32.34 O ATOM 1135 CB VAL A 74 13.175 -10.662 -20.153 1.00 73.34 C ATOM 1136 CG1 VAL A 74 13.764 -11.199 -21.449 1.00 30.32 C ATOM 1137 CG2 VAL A 74 12.622 -11.794 -19.300 1.00 40.11 C ATOM 0 H VAL A 74 12.680 -9.119 -18.171 1.00 50.34 H new ATOM 0 HA VAL A 74 15.046 -10.529 -19.086 1.00 73.40 H new ATOM 0 HB VAL A 74 12.352 -9.993 -20.405 1.00 73.34 H new ATOM 0 HG11 VAL A 74 13.002 -11.761 -21.989 1.00 30.32 H new ATOM 0 HG12 VAL A 74 14.106 -10.368 -22.065 1.00 30.32 H new ATOM 0 HG13 VAL A 74 14.606 -11.853 -21.222 1.00 30.32 H new ATOM 0 HG21 VAL A 74 11.877 -12.348 -19.870 1.00 40.11 H new ATOM 0 HG22 VAL A 74 13.433 -12.464 -19.015 1.00 40.11 H new ATOM 0 HG23 VAL A 74 12.160 -11.381 -18.403 1.00 40.11 H new ATOM 1147 N ASP A 75 16.011 -8.925 -20.723 1.00 34.32 N ATOM 1148 CA ASP A 75 16.649 -7.939 -21.587 1.00 14.44 C ATOM 1149 C ASP A 75 16.740 -8.450 -23.021 1.00 32.11 C ATOM 1150 O ASP A 75 17.470 -9.399 -23.307 1.00 74.25 O ATOM 1151 CB ASP A 75 18.045 -7.598 -21.064 1.00 30.35 C ATOM 1152 CG ASP A 75 18.072 -6.295 -20.289 1.00 75.14 C ATOM 1153 OD1 ASP A 75 16.992 -5.840 -19.857 1.00 22.42 O ATOM 1154 OD2 ASP A 75 19.172 -5.729 -20.117 1.00 33.41 O ATOM 0 H ASP A 75 16.589 -9.739 -20.514 1.00 34.32 H new ATOM 0 HA ASP A 75 16.037 -7.037 -21.580 1.00 14.44 H new ATOM 0 HB2 ASP A 75 18.397 -8.406 -20.422 1.00 30.35 H new ATOM 0 HB3 ASP A 75 18.738 -7.533 -21.903 1.00 30.35 H new ATOM 1159 N VAL A 76 15.993 -7.815 -23.919 1.00 30.31 N ATOM 1160 CA VAL A 76 15.989 -8.206 -25.324 1.00 3.34 C ATOM 1161 C VAL A 76 16.690 -7.162 -26.186 1.00 12.20 C ATOM 1162 O VAL A 76 16.143 -6.091 -26.450 1.00 2.54 O ATOM 1163 CB VAL A 76 14.555 -8.408 -25.846 1.00 73.51 C ATOM 1164 CG1 VAL A 76 14.575 -8.990 -27.251 1.00 62.24 C ATOM 1165 CG2 VAL A 76 13.766 -9.302 -24.902 1.00 35.54 C ATOM 0 H VAL A 76 15.383 -7.028 -23.699 1.00 30.31 H new ATOM 0 HA VAL A 76 16.528 -9.151 -25.392 1.00 3.34 H new ATOM 0 HB VAL A 76 14.062 -7.437 -25.888 1.00 73.51 H new ATOM 0 HG11 VAL A 76 13.552 -9.126 -27.603 1.00 62.24 H new ATOM 0 HG12 VAL A 76 15.102 -8.309 -27.919 1.00 62.24 H new ATOM 0 HG13 VAL A 76 15.085 -9.953 -27.239 1.00 62.24 H new ATOM 0 HG21 VAL A 76 12.755 -9.434 -25.286 1.00 35.54 H new ATOM 0 HG22 VAL A 76 14.255 -10.273 -24.827 1.00 35.54 H new ATOM 0 HG23 VAL A 76 13.722 -8.840 -23.916 1.00 35.54 H new ATOM 1175 N PHE A 77 17.903 -7.481 -26.624 1.00 22.44 N ATOM 1176 CA PHE A 77 18.680 -6.571 -27.457 1.00 12.23 C ATOM 1177 C PHE A 77 19.126 -7.258 -28.744 1.00 23.12 C ATOM 1178 O PHE A 77 19.784 -6.650 -29.589 1.00 32.42 O ATOM 1179 CB PHE A 77 19.900 -6.059 -26.689 1.00 2.31 C ATOM 1180 CG PHE A 77 19.564 -5.490 -25.340 1.00 25.11 C ATOM 1181 CD1 PHE A 77 18.623 -4.482 -25.213 1.00 54.34 C ATOM 1182 CD2 PHE A 77 20.190 -5.964 -24.198 1.00 62.33 C ATOM 1183 CE1 PHE A 77 18.312 -3.956 -23.973 1.00 65.42 C ATOM 1184 CE2 PHE A 77 19.884 -5.443 -22.955 1.00 72.03 C ATOM 1185 CZ PHE A 77 18.943 -4.438 -22.843 1.00 31.43 C ATOM 0 H PHE A 77 18.370 -8.364 -26.416 1.00 22.44 H new ATOM 0 HA PHE A 77 18.044 -5.726 -27.719 1.00 12.23 H new ATOM 0 HB2 PHE A 77 20.609 -6.877 -26.563 1.00 2.31 H new ATOM 0 HB3 PHE A 77 20.398 -5.293 -27.283 1.00 2.31 H new ATOM 0 HD1 PHE A 77 18.126 -4.102 -26.093 1.00 54.34 H new ATOM 0 HD2 PHE A 77 20.926 -6.750 -24.280 1.00 62.33 H new ATOM 0 HE1 PHE A 77 17.577 -3.169 -23.888 1.00 65.42 H new ATOM 0 HE2 PHE A 77 20.380 -5.821 -22.073 1.00 72.03 H new ATOM 0 HZ PHE A 77 18.701 -4.030 -21.873 1.00 31.43 H new ATOM 1195 N ARG A 78 18.764 -8.529 -28.885 1.00 25.11 N ATOM 1196 CA ARG A 78 19.129 -9.300 -30.067 1.00 72.43 C ATOM 1197 C ARG A 78 18.732 -8.561 -31.342 1.00 21.40 C ATOM 1198 O ARG A 78 19.588 -8.132 -32.114 1.00 1.21 O ATOM 1199 CB ARG A 78 18.458 -10.675 -30.032 1.00 42.02 C ATOM 1200 CG ARG A 78 19.128 -11.655 -29.083 1.00 72.31 C ATOM 1201 CD ARG A 78 18.747 -13.092 -29.406 1.00 14.44 C ATOM 1202 NE ARG A 78 19.665 -13.700 -30.365 1.00 1.54 N ATOM 1203 CZ ARG A 78 19.543 -14.944 -30.812 1.00 32.43 C ATOM 1204 NH1 ARG A 78 18.546 -15.709 -30.389 1.00 33.21 N ATOM 1205 NH2 ARG A 78 20.419 -15.426 -31.684 1.00 72.41 N ATOM 0 H ARG A 78 18.219 -9.046 -28.196 1.00 25.11 H new ATOM 0 HA ARG A 78 20.211 -9.431 -30.065 1.00 72.43 H new ATOM 0 HB2 ARG A 78 17.415 -10.554 -29.739 1.00 42.02 H new ATOM 0 HB3 ARG A 78 18.460 -11.097 -31.037 1.00 42.02 H new ATOM 0 HG2 ARG A 78 20.210 -11.542 -29.145 1.00 72.31 H new ATOM 0 HG3 ARG A 78 18.842 -11.423 -28.057 1.00 72.31 H new ATOM 0 HD2 ARG A 78 18.740 -13.680 -28.488 1.00 14.44 H new ATOM 0 HD3 ARG A 78 17.734 -13.117 -29.808 1.00 14.44 H new ATOM 0 HE ARG A 78 20.443 -13.138 -30.710 1.00 1.54 H new ATOM 0 HH11 ARG A 78 17.871 -15.342 -29.719 1.00 33.21 H new ATOM 0 HH12 ARG A 78 18.455 -16.664 -30.734 1.00 33.21 H new ATOM 0 HH21 ARG A 78 21.187 -14.841 -32.012 1.00 72.41 H new ATOM 0 HH22 ARG A 78 20.324 -16.382 -32.027 1.00 72.41 H new ATOM 1219 N ASN A 79 17.428 -8.418 -31.555 1.00 61.13 N ATOM 1220 CA ASN A 79 16.918 -7.732 -32.737 1.00 33.22 C ATOM 1221 C ASN A 79 15.542 -7.132 -32.465 1.00 74.04 C ATOM 1222 O ASN A 79 14.983 -7.298 -31.381 1.00 63.51 O ATOM 1223 CB ASN A 79 16.840 -8.699 -33.920 1.00 24.31 C ATOM 1224 CG ASN A 79 17.075 -8.007 -35.249 1.00 34.03 C ATOM 1225 OD1 ASN A 79 16.213 -8.020 -36.128 1.00 65.24 O ATOM 1226 ND2 ASN A 79 18.245 -7.398 -35.400 1.00 71.02 N ATOM 0 H ASN A 79 16.706 -8.768 -30.925 1.00 61.13 H new ATOM 0 HA ASN A 79 17.606 -6.923 -32.983 1.00 33.22 H new ATOM 0 HB2 ASN A 79 17.579 -9.489 -33.789 1.00 24.31 H new ATOM 0 HB3 ASN A 79 15.861 -9.177 -33.931 1.00 24.31 H new ATOM 0 HD21 ASN A 79 18.460 -6.915 -36.272 1.00 71.02 H new ATOM 0 HD22 ASN A 79 18.929 -7.413 -34.644 1.00 71.02 H new ATOM 1233 N SER A 80 15.000 -6.434 -33.458 1.00 42.25 N ATOM 1234 CA SER A 80 13.691 -5.806 -33.326 1.00 52.23 C ATOM 1235 C SER A 80 12.584 -6.855 -33.315 1.00 34.52 C ATOM 1236 O SER A 80 11.770 -6.904 -32.393 1.00 23.33 O ATOM 1237 CB SER A 80 13.459 -4.816 -34.469 1.00 53.14 C ATOM 1238 OG SER A 80 13.839 -5.376 -35.714 1.00 62.02 O ATOM 0 H SER A 80 15.448 -6.289 -34.363 1.00 42.25 H new ATOM 0 HA SER A 80 13.668 -5.268 -32.378 1.00 52.23 H new ATOM 0 HB2 SER A 80 12.407 -4.532 -34.500 1.00 53.14 H new ATOM 0 HB3 SER A 80 14.030 -3.905 -34.287 1.00 53.14 H new ATOM 0 HG SER A 80 13.679 -4.724 -36.428 1.00 62.02 H new ATOM 1244 N GLU A 81 12.560 -7.693 -34.347 1.00 23.44 N ATOM 1245 CA GLU A 81 11.553 -8.742 -34.456 1.00 13.22 C ATOM 1246 C GLU A 81 11.783 -9.829 -33.410 1.00 64.13 C ATOM 1247 O GLU A 81 10.849 -10.515 -32.996 1.00 2.42 O ATOM 1248 CB GLU A 81 11.572 -9.355 -35.858 1.00 2.43 C ATOM 1249 CG GLU A 81 11.552 -8.323 -36.973 1.00 60.12 C ATOM 1250 CD GLU A 81 11.198 -8.926 -38.319 1.00 14.22 C ATOM 1251 OE1 GLU A 81 10.852 -10.125 -38.358 1.00 75.22 O ATOM 1252 OE2 GLU A 81 11.266 -8.199 -39.332 1.00 3.03 O ATOM 0 H GLU A 81 13.226 -7.666 -35.119 1.00 23.44 H new ATOM 0 HA GLU A 81 10.576 -8.292 -34.278 1.00 13.22 H new ATOM 0 HB2 GLU A 81 12.463 -9.974 -35.963 1.00 2.43 H new ATOM 0 HB3 GLU A 81 10.711 -10.014 -35.969 1.00 2.43 H new ATOM 0 HG2 GLU A 81 10.832 -7.542 -36.728 1.00 60.12 H new ATOM 0 HG3 GLU A 81 12.530 -7.845 -37.039 1.00 60.12 H new ATOM 1259 N ALA A 82 13.035 -9.981 -32.989 1.00 13.30 N ATOM 1260 CA ALA A 82 13.389 -10.983 -31.991 1.00 52.25 C ATOM 1261 C ALA A 82 12.580 -10.794 -30.713 1.00 30.04 C ATOM 1262 O ALA A 82 12.380 -11.738 -29.949 1.00 11.34 O ATOM 1263 CB ALA A 82 14.879 -10.923 -31.689 1.00 71.45 C ATOM 0 H ALA A 82 13.821 -9.423 -33.324 1.00 13.30 H new ATOM 0 HA ALA A 82 13.151 -11.966 -32.398 1.00 52.25 H new ATOM 0 HB1 ALA A 82 15.130 -11.676 -30.942 1.00 71.45 H new ATOM 0 HB2 ALA A 82 15.443 -11.115 -32.602 1.00 71.45 H new ATOM 0 HB3 ALA A 82 15.133 -9.935 -31.306 1.00 71.45 H new ATOM 1269 N ALA A 83 12.118 -9.569 -30.486 1.00 10.24 N ATOM 1270 CA ALA A 83 11.330 -9.257 -29.300 1.00 31.03 C ATOM 1271 C ALA A 83 10.164 -10.228 -29.144 1.00 42.14 C ATOM 1272 O ALA A 83 9.832 -10.640 -28.033 1.00 75.12 O ATOM 1273 CB ALA A 83 10.821 -7.825 -29.366 1.00 1.44 C ATOM 0 H ALA A 83 12.276 -8.776 -31.108 1.00 10.24 H new ATOM 0 HA ALA A 83 11.975 -9.362 -28.428 1.00 31.03 H new ATOM 0 HB1 ALA A 83 10.234 -7.606 -28.474 1.00 1.44 H new ATOM 0 HB2 ALA A 83 11.667 -7.140 -29.421 1.00 1.44 H new ATOM 0 HB3 ALA A 83 10.196 -7.701 -30.251 1.00 1.44 H new ATOM 1279 N TRP A 84 9.548 -10.588 -30.264 1.00 74.11 N ATOM 1280 CA TRP A 84 8.418 -11.510 -30.251 1.00 72.54 C ATOM 1281 C TRP A 84 8.871 -12.921 -29.890 1.00 55.11 C ATOM 1282 O TRP A 84 8.336 -13.538 -28.969 1.00 43.44 O ATOM 1283 CB TRP A 84 7.724 -11.518 -31.614 1.00 53.24 C ATOM 1284 CG TRP A 84 6.662 -12.569 -31.735 1.00 1.13 C ATOM 1285 CD1 TRP A 84 6.845 -13.888 -32.038 1.00 3.13 C ATOM 1286 CD2 TRP A 84 5.253 -12.388 -31.556 1.00 61.24 C ATOM 1287 NE1 TRP A 84 5.635 -14.538 -32.059 1.00 31.05 N ATOM 1288 CE2 TRP A 84 4.643 -13.640 -31.766 1.00 34.34 C ATOM 1289 CE3 TRP A 84 4.448 -11.291 -31.238 1.00 71.23 C ATOM 1290 CZ2 TRP A 84 3.266 -13.822 -31.668 1.00 32.51 C ATOM 1291 CZ3 TRP A 84 3.081 -11.474 -31.142 1.00 5.40 C ATOM 1292 CH2 TRP A 84 2.502 -12.731 -31.355 1.00 75.23 C ATOM 0 H TRP A 84 9.811 -10.256 -31.192 1.00 74.11 H new ATOM 0 HA TRP A 84 7.712 -11.170 -29.493 1.00 72.54 H new ATOM 0 HB2 TRP A 84 7.278 -10.539 -31.792 1.00 53.24 H new ATOM 0 HB3 TRP A 84 8.470 -11.675 -32.393 1.00 53.24 H new ATOM 0 HD1 TRP A 84 7.801 -14.352 -32.233 1.00 3.13 H new ATOM 0 HE1 TRP A 84 5.498 -15.528 -32.260 1.00 31.05 H new ATOM 0 HE3 TRP A 84 4.886 -10.318 -31.070 1.00 71.23 H new ATOM 0 HZ2 TRP A 84 2.817 -14.790 -31.833 1.00 32.51 H new ATOM 0 HZ3 TRP A 84 2.449 -10.633 -30.899 1.00 5.40 H new ATOM 0 HH2 TRP A 84 1.431 -12.842 -31.271 1.00 75.23 H new ATOM 1303 N GLY A 85 9.859 -13.426 -30.621 1.00 64.34 N ATOM 1304 CA GLY A 85 10.367 -14.761 -30.362 1.00 12.24 C ATOM 1305 C GLY A 85 10.885 -14.919 -28.946 1.00 10.31 C ATOM 1306 O GLY A 85 10.737 -15.979 -28.338 1.00 4.24 O ATOM 0 H GLY A 85 10.317 -12.935 -31.388 1.00 64.34 H new ATOM 0 HA2 GLY A 85 9.575 -15.489 -30.539 1.00 12.24 H new ATOM 0 HA3 GLY A 85 11.169 -14.984 -31.066 1.00 12.24 H new ATOM 1310 N VAL A 86 11.496 -13.862 -28.419 1.00 53.15 N ATOM 1311 CA VAL A 86 12.038 -13.888 -27.066 1.00 44.25 C ATOM 1312 C VAL A 86 10.937 -13.700 -26.029 1.00 42.00 C ATOM 1313 O VAL A 86 11.041 -14.187 -24.904 1.00 31.32 O ATOM 1314 CB VAL A 86 13.106 -12.796 -26.869 1.00 43.41 C ATOM 1315 CG1 VAL A 86 13.638 -12.819 -25.444 1.00 34.40 C ATOM 1316 CG2 VAL A 86 14.237 -12.970 -27.871 1.00 43.54 C ATOM 0 H VAL A 86 11.628 -12.977 -28.909 1.00 53.15 H new ATOM 0 HA VAL A 86 12.499 -14.866 -26.928 1.00 44.25 H new ATOM 0 HB VAL A 86 12.643 -11.825 -27.043 1.00 43.41 H new ATOM 0 HG11 VAL A 86 14.391 -12.040 -25.324 1.00 34.40 H new ATOM 0 HG12 VAL A 86 12.819 -12.642 -24.747 1.00 34.40 H new ATOM 0 HG13 VAL A 86 14.085 -13.791 -25.238 1.00 34.40 H new ATOM 0 HG21 VAL A 86 14.983 -12.190 -27.717 1.00 43.54 H new ATOM 0 HG22 VAL A 86 14.700 -13.947 -27.731 1.00 43.54 H new ATOM 0 HG23 VAL A 86 13.840 -12.898 -28.884 1.00 43.54 H new ATOM 1326 N ALA A 87 9.882 -12.990 -26.416 1.00 22.32 N ATOM 1327 CA ALA A 87 8.760 -12.740 -25.520 1.00 71.01 C ATOM 1328 C ALA A 87 8.021 -14.033 -25.191 1.00 52.25 C ATOM 1329 O ALA A 87 7.791 -14.346 -24.024 1.00 35.40 O ATOM 1330 CB ALA A 87 7.807 -11.728 -26.138 1.00 41.51 C ATOM 0 H ALA A 87 9.781 -12.578 -27.344 1.00 22.32 H new ATOM 0 HA ALA A 87 9.154 -12.331 -24.590 1.00 71.01 H new ATOM 0 HB1 ALA A 87 6.974 -11.551 -25.458 1.00 41.51 H new ATOM 0 HB2 ALA A 87 8.336 -10.792 -26.316 1.00 41.51 H new ATOM 0 HB3 ALA A 87 7.428 -12.116 -27.084 1.00 41.51 H new ATOM 1336 N GLN A 88 7.652 -14.778 -26.228 1.00 55.23 N ATOM 1337 CA GLN A 88 6.937 -16.036 -26.048 1.00 50.03 C ATOM 1338 C GLN A 88 7.735 -16.994 -25.170 1.00 72.32 C ATOM 1339 O GLN A 88 7.179 -17.657 -24.295 1.00 71.45 O ATOM 1340 CB GLN A 88 6.653 -16.684 -27.404 1.00 63.34 C ATOM 1341 CG GLN A 88 7.895 -16.869 -28.262 1.00 32.31 C ATOM 1342 CD GLN A 88 7.574 -17.396 -29.647 1.00 3.11 C ATOM 1343 OE1 GLN A 88 8.152 -18.386 -30.096 1.00 71.31 O ATOM 1344 NE2 GLN A 88 6.649 -16.735 -30.332 1.00 52.14 N ATOM 0 H GLN A 88 7.836 -14.533 -27.201 1.00 55.23 H new ATOM 0 HA GLN A 88 5.991 -15.820 -25.552 1.00 50.03 H new ATOM 0 HB2 GLN A 88 6.185 -17.655 -27.242 1.00 63.34 H new ATOM 0 HB3 GLN A 88 5.934 -16.070 -27.947 1.00 63.34 H new ATOM 0 HG2 GLN A 88 8.415 -15.915 -28.352 1.00 32.31 H new ATOM 0 HG3 GLN A 88 8.577 -17.558 -27.764 1.00 32.31 H new ATOM 0 HE21 GLN A 88 6.195 -15.919 -29.921 1.00 52.14 H new ATOM 0 HE22 GLN A 88 6.392 -17.043 -31.270 1.00 52.14 H new ATOM 1353 N GLU A 89 9.041 -17.062 -25.411 1.00 14.44 N ATOM 1354 CA GLU A 89 9.914 -17.940 -24.642 1.00 31.44 C ATOM 1355 C GLU A 89 9.935 -17.535 -23.171 1.00 34.35 C ATOM 1356 O GLU A 89 9.805 -18.377 -22.282 1.00 52.12 O ATOM 1357 CB GLU A 89 11.334 -17.910 -25.210 1.00 40.24 C ATOM 1358 CG GLU A 89 11.425 -18.399 -26.646 1.00 44.31 C ATOM 1359 CD GLU A 89 11.768 -19.873 -26.740 1.00 10.23 C ATOM 1360 OE1 GLU A 89 11.153 -20.673 -26.005 1.00 31.31 O ATOM 1361 OE2 GLU A 89 12.652 -20.226 -27.549 1.00 13.42 O ATOM 0 H GLU A 89 9.517 -16.520 -26.132 1.00 14.44 H new ATOM 0 HA GLU A 89 9.522 -18.954 -24.716 1.00 31.44 H new ATOM 0 HB2 GLU A 89 11.716 -16.891 -25.157 1.00 40.24 H new ATOM 0 HB3 GLU A 89 11.980 -18.525 -24.584 1.00 40.24 H new ATOM 0 HG2 GLU A 89 10.475 -18.218 -27.148 1.00 44.31 H new ATOM 0 HG3 GLU A 89 12.181 -17.819 -27.176 1.00 44.31 H new ATOM 1368 N ALA A 90 10.099 -16.240 -22.922 1.00 24.22 N ATOM 1369 CA ALA A 90 10.136 -15.723 -21.560 1.00 12.53 C ATOM 1370 C ALA A 90 8.792 -15.913 -20.864 1.00 25.43 C ATOM 1371 O ALA A 90 8.737 -16.302 -19.696 1.00 44.45 O ATOM 1372 CB ALA A 90 10.526 -14.252 -21.564 1.00 52.23 C ATOM 0 H ALA A 90 10.208 -15.530 -23.646 1.00 24.22 H new ATOM 0 HA ALA A 90 10.887 -16.286 -21.005 1.00 12.53 H new ATOM 0 HB1 ALA A 90 10.550 -13.879 -20.540 1.00 52.23 H new ATOM 0 HB2 ALA A 90 11.512 -14.138 -22.014 1.00 52.23 H new ATOM 0 HB3 ALA A 90 9.796 -13.684 -22.140 1.00 52.23 H new ATOM 1378 N ILE A 91 7.712 -15.638 -21.587 1.00 4.42 N ATOM 1379 CA ILE A 91 6.370 -15.780 -21.038 1.00 14.31 C ATOM 1380 C ILE A 91 6.018 -17.247 -20.817 1.00 64.11 C ATOM 1381 O ILE A 91 5.255 -17.584 -19.912 1.00 41.24 O ATOM 1382 CB ILE A 91 5.314 -15.144 -21.962 1.00 33.14 C ATOM 1383 CG1 ILE A 91 5.606 -13.655 -22.158 1.00 64.33 C ATOM 1384 CG2 ILE A 91 3.919 -15.344 -21.388 1.00 31.12 C ATOM 1385 CD1 ILE A 91 5.014 -13.086 -23.428 1.00 43.34 C ATOM 0 H ILE A 91 7.740 -15.316 -22.554 1.00 4.42 H new ATOM 0 HA ILE A 91 6.364 -15.260 -20.080 1.00 14.31 H new ATOM 0 HB ILE A 91 5.360 -15.635 -22.934 1.00 33.14 H new ATOM 0 HG12 ILE A 91 5.215 -13.101 -21.304 1.00 64.33 H new ATOM 0 HG13 ILE A 91 6.685 -13.503 -22.170 1.00 64.33 H new ATOM 0 HG21 ILE A 91 3.184 -14.889 -22.052 1.00 31.12 H new ATOM 0 HG22 ILE A 91 3.713 -16.410 -21.295 1.00 31.12 H new ATOM 0 HG23 ILE A 91 3.859 -14.876 -20.405 1.00 31.12 H new ATOM 0 HD11 ILE A 91 5.260 -12.027 -23.502 1.00 43.34 H new ATOM 0 HD12 ILE A 91 5.423 -13.614 -24.289 1.00 43.34 H new ATOM 0 HD13 ILE A 91 3.931 -13.206 -23.410 1.00 43.34 H new ATOM 1397 N ALA A 92 6.582 -18.116 -21.649 1.00 63.52 N ATOM 1398 CA ALA A 92 6.332 -19.548 -21.543 1.00 20.54 C ATOM 1399 C ALA A 92 6.956 -20.122 -20.275 1.00 65.12 C ATOM 1400 O ALA A 92 6.348 -20.943 -19.589 1.00 75.51 O ATOM 1401 CB ALA A 92 6.867 -20.271 -22.770 1.00 41.54 C ATOM 0 H ALA A 92 7.215 -17.853 -22.404 1.00 63.52 H new ATOM 0 HA ALA A 92 5.254 -19.699 -21.488 1.00 20.54 H new ATOM 0 HB1 ALA A 92 6.673 -21.339 -22.676 1.00 41.54 H new ATOM 0 HB2 ALA A 92 6.371 -19.889 -23.662 1.00 41.54 H new ATOM 0 HB3 ALA A 92 7.941 -20.103 -22.852 1.00 41.54 H new ATOM 1407 N ILE A 93 8.174 -19.685 -19.971 1.00 32.01 N ATOM 1408 CA ILE A 93 8.880 -20.155 -18.786 1.00 33.44 C ATOM 1409 C ILE A 93 8.350 -19.479 -17.526 1.00 1.22 C ATOM 1410 O ILE A 93 8.461 -20.018 -16.426 1.00 34.14 O ATOM 1411 CB ILE A 93 10.395 -19.900 -18.894 1.00 15.31 C ATOM 1412 CG1 ILE A 93 10.675 -18.398 -18.987 1.00 60.51 C ATOM 1413 CG2 ILE A 93 10.970 -20.627 -20.100 1.00 34.41 C ATOM 1414 CD1 ILE A 93 12.145 -18.052 -18.907 1.00 64.43 C ATOM 0 H ILE A 93 8.692 -19.006 -20.529 1.00 32.01 H new ATOM 0 HA ILE A 93 8.705 -21.229 -18.720 1.00 33.44 H new ATOM 0 HB ILE A 93 10.879 -20.287 -17.997 1.00 15.31 H new ATOM 0 HG12 ILE A 93 10.271 -18.019 -19.926 1.00 60.51 H new ATOM 0 HG13 ILE A 93 10.145 -17.887 -18.183 1.00 60.51 H new ATOM 0 HG21 ILE A 93 12.041 -20.437 -20.163 1.00 34.41 H new ATOM 0 HG22 ILE A 93 10.797 -21.698 -19.996 1.00 34.41 H new ATOM 0 HG23 ILE A 93 10.484 -20.268 -21.007 1.00 34.41 H new ATOM 0 HD11 ILE A 93 12.269 -16.971 -18.980 1.00 64.43 H new ATOM 0 HD12 ILE A 93 12.550 -18.401 -17.957 1.00 64.43 H new ATOM 0 HD13 ILE A 93 12.677 -18.534 -19.727 1.00 64.43 H new ATOM 1426 N GLY A 94 7.772 -18.293 -17.695 1.00 62.34 N ATOM 1427 CA GLY A 94 7.232 -17.563 -16.564 1.00 0.42 C ATOM 1428 C GLY A 94 8.048 -16.331 -16.226 1.00 41.32 C ATOM 1429 O GLY A 94 8.633 -16.242 -15.147 1.00 15.21 O ATOM 0 H GLY A 94 7.669 -17.825 -18.596 1.00 62.34 H new ATOM 0 HA2 GLY A 94 6.206 -17.267 -16.783 1.00 0.42 H new ATOM 0 HA3 GLY A 94 7.195 -18.220 -15.695 1.00 0.42 H new ATOM 1433 N ALA A 95 8.090 -15.378 -17.152 1.00 72.32 N ATOM 1434 CA ALA A 95 8.840 -14.146 -16.947 1.00 1.40 C ATOM 1435 C ALA A 95 8.062 -13.168 -16.073 1.00 33.21 C ATOM 1436 O ALA A 95 6.944 -13.456 -15.645 1.00 31.34 O ATOM 1437 CB ALA A 95 9.179 -13.505 -18.285 1.00 24.41 C ATOM 0 H ALA A 95 7.613 -15.436 -18.052 1.00 72.32 H new ATOM 0 HA ALA A 95 9.767 -14.396 -16.431 1.00 1.40 H new ATOM 0 HB1 ALA A 95 9.739 -12.585 -18.116 1.00 24.41 H new ATOM 0 HB2 ALA A 95 9.782 -14.194 -18.876 1.00 24.41 H new ATOM 0 HB3 ALA A 95 8.259 -13.276 -18.822 1.00 24.41 H new ATOM 1443 N LYS A 96 8.659 -12.011 -15.811 1.00 5.14 N ATOM 1444 CA LYS A 96 8.023 -10.989 -14.988 1.00 33.53 C ATOM 1445 C LYS A 96 8.033 -9.637 -15.694 1.00 23.43 C ATOM 1446 O LYS A 96 7.062 -8.883 -15.628 1.00 70.14 O ATOM 1447 CB LYS A 96 8.734 -10.877 -13.637 1.00 74.12 C ATOM 1448 CG LYS A 96 8.579 -12.110 -12.764 1.00 20.20 C ATOM 1449 CD LYS A 96 7.348 -12.016 -11.879 1.00 14.02 C ATOM 1450 CE LYS A 96 7.606 -11.150 -10.655 1.00 73.41 C ATOM 1451 NZ LYS A 96 6.630 -11.427 -9.564 1.00 64.13 N ATOM 0 H LYS A 96 9.584 -11.757 -16.157 1.00 5.14 H new ATOM 0 HA LYS A 96 6.987 -11.284 -14.823 1.00 33.53 H new ATOM 0 HB2 LYS A 96 9.795 -10.694 -13.808 1.00 74.12 H new ATOM 0 HB3 LYS A 96 8.344 -10.012 -13.101 1.00 74.12 H new ATOM 0 HG2 LYS A 96 8.508 -12.996 -13.394 1.00 20.20 H new ATOM 0 HG3 LYS A 96 9.466 -12.231 -12.143 1.00 20.20 H new ATOM 0 HD2 LYS A 96 6.518 -11.601 -12.451 1.00 14.02 H new ATOM 0 HD3 LYS A 96 7.049 -13.015 -11.563 1.00 14.02 H new ATOM 0 HE2 LYS A 96 8.618 -11.328 -10.291 1.00 73.41 H new ATOM 0 HE3 LYS A 96 7.548 -10.098 -10.935 1.00 73.41 H new ATOM 0 HZ1 LYS A 96 6.839 -10.817 -8.748 1.00 64.13 H new ATOM 0 HZ2 LYS A 96 5.666 -11.233 -9.903 1.00 64.13 H new ATOM 0 HZ3 LYS A 96 6.702 -12.424 -9.278 1.00 64.13 H new ATOM 1465 N THR A 97 9.137 -9.337 -16.370 1.00 45.34 N ATOM 1466 CA THR A 97 9.274 -8.076 -17.089 1.00 21.02 C ATOM 1467 C THR A 97 9.986 -8.277 -18.422 1.00 34.21 C ATOM 1468 O THR A 97 10.711 -9.255 -18.609 1.00 31.21 O ATOM 1469 CB THR A 97 10.050 -7.037 -16.258 1.00 12.24 C ATOM 1470 OG1 THR A 97 9.795 -7.236 -14.863 1.00 15.03 O ATOM 1471 CG2 THR A 97 9.654 -5.622 -16.654 1.00 21.42 C ATOM 0 H THR A 97 9.950 -9.950 -16.435 1.00 45.34 H new ATOM 0 HA THR A 97 8.265 -7.705 -17.271 1.00 21.02 H new ATOM 0 HB THR A 97 11.114 -7.168 -16.455 1.00 12.24 H new ATOM 0 HG1 THR A 97 10.521 -7.764 -14.470 1.00 15.03 H new ATOM 0 HG21 THR A 97 10.215 -4.906 -16.054 1.00 21.42 H new ATOM 0 HG22 THR A 97 9.876 -5.464 -17.709 1.00 21.42 H new ATOM 0 HG23 THR A 97 8.587 -5.482 -16.483 1.00 21.42 H new ATOM 1479 N LEU A 98 9.775 -7.346 -19.346 1.00 32.51 N ATOM 1480 CA LEU A 98 10.397 -7.421 -20.663 1.00 64.21 C ATOM 1481 C LEU A 98 10.883 -6.048 -21.115 1.00 2.44 C ATOM 1482 O LEU A 98 10.117 -5.084 -21.136 1.00 64.03 O ATOM 1483 CB LEU A 98 9.409 -7.986 -21.685 1.00 21.42 C ATOM 1484 CG LEU A 98 10.013 -8.488 -22.997 1.00 3.31 C ATOM 1485 CD1 LEU A 98 11.026 -9.590 -22.731 1.00 65.32 C ATOM 1486 CD2 LEU A 98 8.920 -8.980 -23.934 1.00 31.22 C ATOM 0 H LEU A 98 9.178 -6.531 -19.207 1.00 32.51 H new ATOM 0 HA LEU A 98 11.258 -8.086 -20.593 1.00 64.21 H new ATOM 0 HB2 LEU A 98 8.867 -8.809 -21.220 1.00 21.42 H new ATOM 0 HB3 LEU A 98 8.676 -7.213 -21.918 1.00 21.42 H new ATOM 0 HG LEU A 98 10.529 -7.657 -23.478 1.00 3.31 H new ATOM 0 HD11 LEU A 98 11.445 -9.935 -23.676 1.00 65.32 H new ATOM 0 HD12 LEU A 98 11.826 -9.204 -22.099 1.00 65.32 H new ATOM 0 HD13 LEU A 98 10.534 -10.422 -22.227 1.00 65.32 H new ATOM 0 HD21 LEU A 98 9.369 -9.333 -24.862 1.00 31.22 H new ATOM 0 HD22 LEU A 98 8.375 -9.797 -23.460 1.00 31.22 H new ATOM 0 HD23 LEU A 98 8.232 -8.163 -24.151 1.00 31.22 H new ATOM 1498 N TRP A 99 12.159 -5.966 -21.476 1.00 35.51 N ATOM 1499 CA TRP A 99 12.746 -4.711 -21.929 1.00 52.24 C ATOM 1500 C TRP A 99 13.393 -4.876 -23.300 1.00 72.10 C ATOM 1501 O TRP A 99 14.104 -5.851 -23.548 1.00 43.53 O ATOM 1502 CB TRP A 99 13.782 -4.214 -20.919 1.00 74.33 C ATOM 1503 CG TRP A 99 13.777 -2.725 -20.747 1.00 33.54 C ATOM 1504 CD1 TRP A 99 14.524 -1.817 -21.441 1.00 20.41 C ATOM 1505 CD2 TRP A 99 12.988 -1.973 -19.819 1.00 32.15 C ATOM 1506 NE1 TRP A 99 14.247 -0.546 -21.000 1.00 43.32 N ATOM 1507 CE2 TRP A 99 13.308 -0.614 -20.006 1.00 35.00 C ATOM 1508 CE3 TRP A 99 12.041 -2.315 -18.849 1.00 42.40 C ATOM 1509 CZ2 TRP A 99 12.714 0.400 -19.258 1.00 65.24 C ATOM 1510 CZ3 TRP A 99 11.454 -1.307 -18.108 1.00 33.24 C ATOM 1511 CH2 TRP A 99 11.791 0.037 -18.316 1.00 22.31 C ATOM 0 H TRP A 99 12.806 -6.754 -21.464 1.00 35.51 H new ATOM 0 HA TRP A 99 11.947 -3.974 -22.011 1.00 52.24 H new ATOM 0 HB2 TRP A 99 13.593 -4.685 -19.954 1.00 74.33 H new ATOM 0 HB3 TRP A 99 14.774 -4.532 -21.240 1.00 74.33 H new ATOM 0 HD1 TRP A 99 15.229 -2.062 -22.222 1.00 20.41 H new ATOM 0 HE1 TRP A 99 14.672 0.310 -21.356 1.00 43.32 H new ATOM 0 HE3 TRP A 99 11.773 -3.348 -18.682 1.00 42.40 H new ATOM 0 HZ2 TRP A 99 12.973 1.436 -19.416 1.00 65.24 H new ATOM 0 HZ3 TRP A 99 10.722 -1.560 -17.355 1.00 33.24 H new ATOM 0 HH2 TRP A 99 11.313 0.801 -17.721 1.00 22.31 H new ATOM 1522 N LEU A 100 13.142 -3.919 -24.187 1.00 23.41 N ATOM 1523 CA LEU A 100 13.701 -3.959 -25.534 1.00 24.22 C ATOM 1524 C LEU A 100 14.779 -2.894 -25.708 1.00 13.51 C ATOM 1525 O LEU A 100 15.143 -2.205 -24.755 1.00 53.22 O ATOM 1526 CB LEU A 100 12.596 -3.758 -26.572 1.00 63.01 C ATOM 1527 CG LEU A 100 11.407 -4.715 -26.480 1.00 50.35 C ATOM 1528 CD1 LEU A 100 10.410 -4.435 -27.595 1.00 22.44 C ATOM 1529 CD2 LEU A 100 11.880 -6.160 -26.535 1.00 73.13 C ATOM 0 H LEU A 100 12.555 -3.106 -23.998 1.00 23.41 H new ATOM 0 HA LEU A 100 14.157 -4.938 -25.683 1.00 24.22 H new ATOM 0 HB2 LEU A 100 12.223 -2.738 -26.484 1.00 63.01 H new ATOM 0 HB3 LEU A 100 13.036 -3.852 -27.565 1.00 63.01 H new ATOM 0 HG LEU A 100 10.908 -4.554 -25.525 1.00 50.35 H new ATOM 0 HD11 LEU A 100 9.570 -5.125 -27.514 1.00 22.44 H new ATOM 0 HD12 LEU A 100 10.047 -3.411 -27.510 1.00 22.44 H new ATOM 0 HD13 LEU A 100 10.897 -4.568 -28.561 1.00 22.44 H new ATOM 0 HD21 LEU A 100 11.020 -6.827 -26.468 1.00 73.13 H new ATOM 0 HD22 LEU A 100 12.404 -6.336 -27.475 1.00 73.13 H new ATOM 0 HD23 LEU A 100 12.555 -6.354 -25.702 1.00 73.13 H new ATOM 1541 N GLN A 101 15.282 -2.763 -26.931 1.00 4.01 N ATOM 1542 CA GLN A 101 16.317 -1.780 -27.229 1.00 51.35 C ATOM 1543 C GLN A 101 15.709 -0.397 -27.439 1.00 1.44 C ATOM 1544 O GLN A 101 14.570 -0.269 -27.891 1.00 24.14 O ATOM 1545 CB GLN A 101 17.104 -2.197 -28.473 1.00 74.41 C ATOM 1546 CG GLN A 101 18.436 -1.480 -28.620 1.00 15.31 C ATOM 1547 CD GLN A 101 19.544 -2.138 -27.823 1.00 2.14 C ATOM 1548 OE1 GLN A 101 19.577 -1.871 -26.522 1.00 54.13 O flip ATOM 1549 NE2 GLN A 101 20.363 -2.878 -28.369 1.00 61.32 N flip ATOM 0 H GLN A 101 14.990 -3.325 -27.731 1.00 4.01 H new ATOM 0 HA GLN A 101 16.995 -1.734 -26.377 1.00 51.35 H new ATOM 0 HB2 GLN A 101 17.282 -3.272 -28.437 1.00 74.41 H new ATOM 0 HB3 GLN A 101 16.498 -2.004 -29.358 1.00 74.41 H new ATOM 0 HG2 GLN A 101 18.717 -1.455 -29.673 1.00 15.31 H new ATOM 0 HG3 GLN A 101 18.325 -0.445 -28.295 1.00 15.31 H new ATOM 0 HE21 GLN A 101 20.301 -3.056 -29.371 1.00 61.32 H new ATOM 0 HE22 GLN A 101 21.104 -3.313 -27.819 1.00 61.32 H new ATOM 1558 N LEU A 102 16.475 0.637 -27.107 1.00 20.12 N ATOM 1559 CA LEU A 102 16.012 2.012 -27.258 1.00 30.00 C ATOM 1560 C LEU A 102 15.849 2.373 -28.731 1.00 32.20 C ATOM 1561 O LEU A 102 16.805 2.321 -29.503 1.00 2.20 O ATOM 1562 CB LEU A 102 16.993 2.977 -26.590 1.00 53.53 C ATOM 1563 CG LEU A 102 16.378 4.016 -25.652 1.00 11.42 C ATOM 1564 CD1 LEU A 102 17.442 4.984 -25.156 1.00 74.22 C ATOM 1565 CD2 LEU A 102 15.255 4.768 -26.351 1.00 53.20 C ATOM 0 H LEU A 102 17.419 0.549 -26.732 1.00 20.12 H new ATOM 0 HA LEU A 102 15.040 2.098 -26.772 1.00 30.00 H new ATOM 0 HB2 LEU A 102 17.720 2.392 -26.026 1.00 53.53 H new ATOM 0 HB3 LEU A 102 17.544 3.502 -27.371 1.00 53.53 H new ATOM 0 HG LEU A 102 15.959 3.496 -24.791 1.00 11.42 H new ATOM 0 HD11 LEU A 102 16.986 5.716 -24.490 1.00 74.22 H new ATOM 0 HD12 LEU A 102 18.212 4.433 -24.616 1.00 74.22 H new ATOM 0 HD13 LEU A 102 17.891 5.497 -26.006 1.00 74.22 H new ATOM 0 HD21 LEU A 102 14.829 5.503 -25.668 1.00 53.20 H new ATOM 0 HD22 LEU A 102 15.650 5.276 -27.231 1.00 53.20 H new ATOM 0 HD23 LEU A 102 14.480 4.064 -26.655 1.00 53.20 H new ATOM 1577 N GLY A 103 14.630 2.741 -29.114 1.00 35.45 N ATOM 1578 CA GLY A 103 14.364 3.107 -30.492 1.00 74.13 C ATOM 1579 C GLY A 103 13.710 1.985 -31.275 1.00 22.04 C ATOM 1580 O GLY A 103 13.871 1.891 -32.491 1.00 64.15 O ATOM 0 H GLY A 103 13.822 2.792 -28.494 1.00 35.45 H new ATOM 0 HA2 GLY A 103 13.718 3.985 -30.513 1.00 74.13 H new ATOM 0 HA3 GLY A 103 15.299 3.387 -30.977 1.00 74.13 H new ATOM 1584 N VAL A 104 12.971 1.130 -30.575 1.00 22.12 N ATOM 1585 CA VAL A 104 12.291 0.008 -31.211 1.00 65.03 C ATOM 1586 C VAL A 104 10.789 0.060 -30.958 1.00 40.40 C ATOM 1587 O VAL A 104 10.341 0.554 -29.923 1.00 31.34 O ATOM 1588 CB VAL A 104 12.839 -1.340 -30.706 1.00 44.02 C ATOM 1589 CG1 VAL A 104 12.408 -1.587 -29.269 1.00 35.31 C ATOM 1590 CG2 VAL A 104 12.382 -2.474 -31.612 1.00 11.54 C ATOM 0 H VAL A 104 12.828 1.193 -29.567 1.00 22.12 H new ATOM 0 HA VAL A 104 12.479 0.090 -32.282 1.00 65.03 H new ATOM 0 HB VAL A 104 13.928 -1.302 -30.731 1.00 44.02 H new ATOM 0 HG11 VAL A 104 12.805 -2.544 -28.930 1.00 35.31 H new ATOM 0 HG12 VAL A 104 12.790 -0.789 -28.632 1.00 35.31 H new ATOM 0 HG13 VAL A 104 11.320 -1.605 -29.214 1.00 35.31 H new ATOM 0 HG21 VAL A 104 12.778 -3.419 -31.240 1.00 11.54 H new ATOM 0 HG22 VAL A 104 11.293 -2.516 -31.621 1.00 11.54 H new ATOM 0 HG23 VAL A 104 12.747 -2.301 -32.624 1.00 11.54 H new ATOM 1600 N ILE A 105 10.016 -0.452 -31.910 1.00 0.43 N ATOM 1601 CA ILE A 105 8.564 -0.465 -31.789 1.00 15.42 C ATOM 1602 C ILE A 105 7.975 -1.745 -32.371 1.00 52.02 C ATOM 1603 O ILE A 105 7.840 -1.881 -33.586 1.00 70.34 O ATOM 1604 CB ILE A 105 7.929 0.747 -32.496 1.00 52.24 C ATOM 1605 CG1 ILE A 105 8.475 2.051 -31.911 1.00 64.02 C ATOM 1606 CG2 ILE A 105 6.413 0.699 -32.373 1.00 23.15 C ATOM 1607 CD1 ILE A 105 9.710 2.561 -32.621 1.00 52.31 C ATOM 0 H ILE A 105 10.371 -0.863 -32.773 1.00 0.43 H new ATOM 0 HA ILE A 105 8.336 -0.415 -30.724 1.00 15.42 H new ATOM 0 HB ILE A 105 8.189 0.708 -33.554 1.00 52.24 H new ATOM 0 HG12 ILE A 105 7.698 2.814 -31.957 1.00 64.02 H new ATOM 0 HG13 ILE A 105 8.709 1.897 -30.857 1.00 64.02 H new ATOM 0 HG21 ILE A 105 5.979 1.562 -32.878 1.00 23.15 H new ATOM 0 HG22 ILE A 105 6.039 -0.216 -32.833 1.00 23.15 H new ATOM 0 HG23 ILE A 105 6.133 0.716 -31.320 1.00 23.15 H new ATOM 0 HD11 ILE A 105 10.042 3.488 -32.153 1.00 52.31 H new ATOM 0 HD12 ILE A 105 10.503 1.816 -32.553 1.00 52.31 H new ATOM 0 HD13 ILE A 105 9.476 2.747 -33.669 1.00 52.31 H new ATOM 1619 N ASN A 106 7.624 -2.681 -31.495 1.00 1.42 N ATOM 1620 CA ASN A 106 7.048 -3.950 -31.922 1.00 31.50 C ATOM 1621 C ASN A 106 5.660 -4.148 -31.319 1.00 63.44 C ATOM 1622 O ASN A 106 5.517 -4.731 -30.245 1.00 4.31 O ATOM 1623 CB ASN A 106 7.961 -5.110 -31.519 1.00 43.01 C ATOM 1624 CG ASN A 106 7.844 -6.292 -32.461 1.00 65.44 C ATOM 1625 OD1 ASN A 106 6.764 -6.591 -32.969 1.00 75.22 O ATOM 1626 ND2 ASN A 106 8.960 -6.972 -32.699 1.00 44.21 N ATOM 0 H ASN A 106 7.729 -2.584 -30.485 1.00 1.42 H new ATOM 0 HA ASN A 106 6.954 -3.930 -33.008 1.00 31.50 H new ATOM 0 HB2 ASN A 106 8.995 -4.765 -31.500 1.00 43.01 H new ATOM 0 HB3 ASN A 106 7.713 -5.430 -30.507 1.00 43.01 H new ATOM 0 HD21 ASN A 106 8.943 -7.777 -33.325 1.00 44.21 H new ATOM 0 HD22 ASN A 106 9.834 -6.689 -32.256 1.00 44.21 H new ATOM 1633 N GLU A 107 4.642 -3.660 -32.020 1.00 54.01 N ATOM 1634 CA GLU A 107 3.266 -3.783 -31.553 1.00 74.45 C ATOM 1635 C GLU A 107 2.941 -5.230 -31.194 1.00 74.43 C ATOM 1636 O GLU A 107 2.386 -5.507 -30.131 1.00 5.53 O ATOM 1637 CB GLU A 107 2.294 -3.281 -32.624 1.00 32.45 C ATOM 1638 CG GLU A 107 2.526 -3.897 -33.993 1.00 40.43 C ATOM 1639 CD GLU A 107 1.787 -3.163 -35.095 1.00 55.13 C ATOM 1640 OE1 GLU A 107 1.073 -2.187 -34.784 1.00 34.13 O ATOM 1641 OE2 GLU A 107 1.922 -3.565 -36.270 1.00 25.32 O ATOM 0 H GLU A 107 4.744 -3.176 -32.912 1.00 54.01 H new ATOM 0 HA GLU A 107 3.157 -3.171 -30.658 1.00 74.45 H new ATOM 0 HB2 GLU A 107 1.274 -3.496 -32.306 1.00 32.45 H new ATOM 0 HB3 GLU A 107 2.382 -2.197 -32.703 1.00 32.45 H new ATOM 0 HG2 GLU A 107 3.594 -3.894 -34.212 1.00 40.43 H new ATOM 0 HG3 GLU A 107 2.206 -4.939 -33.978 1.00 40.43 H new ATOM 1648 N GLN A 108 3.289 -6.149 -32.090 1.00 2.24 N ATOM 1649 CA GLN A 108 3.033 -7.567 -31.868 1.00 25.03 C ATOM 1650 C GLN A 108 3.667 -8.037 -30.562 1.00 43.25 C ATOM 1651 O GLN A 108 3.032 -8.726 -29.765 1.00 72.14 O ATOM 1652 CB GLN A 108 3.573 -8.393 -33.037 1.00 32.13 C ATOM 1653 CG GLN A 108 2.493 -9.142 -33.801 1.00 65.15 C ATOM 1654 CD GLN A 108 3.057 -10.002 -34.916 1.00 4.43 C ATOM 1655 OE1 GLN A 108 3.236 -9.539 -36.043 1.00 1.34 O ATOM 1656 NE2 GLN A 108 3.342 -11.261 -34.606 1.00 75.31 N ATOM 0 H GLN A 108 3.749 -5.937 -32.976 1.00 2.24 H new ATOM 0 HA GLN A 108 1.955 -7.709 -31.799 1.00 25.03 H new ATOM 0 HB2 GLN A 108 4.101 -7.733 -33.725 1.00 32.13 H new ATOM 0 HB3 GLN A 108 4.302 -9.109 -32.659 1.00 32.13 H new ATOM 0 HG2 GLN A 108 1.934 -9.772 -33.109 1.00 65.15 H new ATOM 0 HG3 GLN A 108 1.787 -8.426 -34.221 1.00 65.15 H new ATOM 0 HE21 GLN A 108 3.178 -11.603 -33.659 1.00 75.31 H new ATOM 0 HE22 GLN A 108 3.725 -11.886 -35.315 1.00 75.31 H new ATOM 1665 N ALA A 109 4.924 -7.659 -30.351 1.00 71.32 N ATOM 1666 CA ALA A 109 5.643 -8.041 -29.142 1.00 41.40 C ATOM 1667 C ALA A 109 4.999 -7.426 -27.904 1.00 23.33 C ATOM 1668 O ALA A 109 5.088 -7.979 -26.808 1.00 12.03 O ATOM 1669 CB ALA A 109 7.103 -7.623 -29.242 1.00 72.34 C ATOM 0 H ALA A 109 5.465 -7.089 -31.001 1.00 71.32 H new ATOM 0 HA ALA A 109 5.593 -9.126 -29.046 1.00 41.40 H new ATOM 0 HB1 ALA A 109 7.628 -7.914 -28.332 1.00 72.34 H new ATOM 0 HB2 ALA A 109 7.564 -8.113 -30.100 1.00 72.34 H new ATOM 0 HB3 ALA A 109 7.164 -6.542 -29.366 1.00 72.34 H new ATOM 1675 N ALA A 110 4.352 -6.280 -28.086 1.00 2.12 N ATOM 1676 CA ALA A 110 3.693 -5.591 -26.983 1.00 74.52 C ATOM 1677 C ALA A 110 2.394 -6.292 -26.597 1.00 4.03 C ATOM 1678 O ALA A 110 2.002 -6.295 -25.430 1.00 25.23 O ATOM 1679 CB ALA A 110 3.422 -4.141 -27.353 1.00 51.32 C ATOM 0 H ALA A 110 4.270 -5.809 -28.987 1.00 2.12 H new ATOM 0 HA ALA A 110 4.360 -5.616 -26.121 1.00 74.52 H new ATOM 0 HB1 ALA A 110 2.930 -3.639 -26.520 1.00 51.32 H new ATOM 0 HB2 ALA A 110 4.364 -3.639 -27.573 1.00 51.32 H new ATOM 0 HB3 ALA A 110 2.777 -4.104 -28.231 1.00 51.32 H new ATOM 1685 N VAL A 111 1.730 -6.884 -27.584 1.00 64.42 N ATOM 1686 CA VAL A 111 0.476 -7.589 -27.347 1.00 51.32 C ATOM 1687 C VAL A 111 0.723 -8.955 -26.718 1.00 22.03 C ATOM 1688 O VAL A 111 -0.001 -9.375 -25.814 1.00 1.31 O ATOM 1689 CB VAL A 111 -0.319 -7.774 -28.653 1.00 53.23 C ATOM 1690 CG1 VAL A 111 -1.705 -8.328 -28.361 1.00 32.12 C ATOM 1691 CG2 VAL A 111 -0.411 -6.458 -29.411 1.00 73.25 C ATOM 0 H VAL A 111 2.040 -6.890 -28.556 1.00 64.42 H new ATOM 0 HA VAL A 111 -0.106 -6.976 -26.659 1.00 51.32 H new ATOM 0 HB VAL A 111 0.208 -8.493 -29.280 1.00 53.23 H new ATOM 0 HG11 VAL A 111 -2.252 -8.452 -29.296 1.00 32.12 H new ATOM 0 HG12 VAL A 111 -1.614 -9.293 -27.863 1.00 32.12 H new ATOM 0 HG13 VAL A 111 -2.245 -7.636 -27.714 1.00 32.12 H new ATOM 0 HG21 VAL A 111 -0.976 -6.607 -30.331 1.00 73.25 H new ATOM 0 HG22 VAL A 111 -0.915 -5.716 -28.792 1.00 73.25 H new ATOM 0 HG23 VAL A 111 0.592 -6.107 -29.654 1.00 73.25 H new ATOM 1701 N LEU A 112 1.751 -9.645 -27.200 1.00 75.33 N ATOM 1702 CA LEU A 112 2.095 -10.966 -26.685 1.00 10.35 C ATOM 1703 C LEU A 112 2.257 -10.933 -25.168 1.00 55.21 C ATOM 1704 O LEU A 112 1.710 -11.776 -24.457 1.00 64.05 O ATOM 1705 CB LEU A 112 3.385 -11.469 -27.335 1.00 54.45 C ATOM 1706 CG LEU A 112 3.782 -12.909 -27.012 1.00 60.42 C ATOM 1707 CD1 LEU A 112 2.644 -13.863 -27.340 1.00 31.41 C ATOM 1708 CD2 LEU A 112 5.042 -13.298 -27.772 1.00 31.32 C ATOM 0 H LEU A 112 2.361 -9.312 -27.947 1.00 75.33 H new ATOM 0 HA LEU A 112 1.281 -11.648 -26.931 1.00 10.35 H new ATOM 0 HB2 LEU A 112 3.284 -11.375 -28.416 1.00 54.45 H new ATOM 0 HB3 LEU A 112 4.201 -10.812 -27.033 1.00 54.45 H new ATOM 0 HG LEU A 112 3.990 -12.977 -25.944 1.00 60.42 H new ATOM 0 HD11 LEU A 112 2.945 -14.884 -27.103 1.00 31.41 H new ATOM 0 HD12 LEU A 112 1.766 -13.598 -26.751 1.00 31.41 H new ATOM 0 HD13 LEU A 112 2.404 -13.792 -28.401 1.00 31.41 H new ATOM 0 HD21 LEU A 112 5.310 -14.326 -27.530 1.00 31.32 H new ATOM 0 HD22 LEU A 112 4.862 -13.213 -28.844 1.00 31.32 H new ATOM 0 HD23 LEU A 112 5.858 -12.634 -27.488 1.00 31.32 H new ATOM 1720 N ALA A 113 3.009 -9.952 -24.679 1.00 74.15 N ATOM 1721 CA ALA A 113 3.238 -9.807 -23.247 1.00 44.35 C ATOM 1722 C ALA A 113 1.977 -9.333 -22.534 1.00 54.44 C ATOM 1723 O ALA A 113 1.750 -9.662 -21.370 1.00 14.50 O ATOM 1724 CB ALA A 113 4.386 -8.840 -22.993 1.00 33.45 C ATOM 0 H ALA A 113 3.470 -9.246 -25.254 1.00 74.15 H new ATOM 0 HA ALA A 113 3.504 -10.785 -22.845 1.00 44.35 H new ATOM 0 HB1 ALA A 113 4.547 -8.740 -21.920 1.00 33.45 H new ATOM 0 HB2 ALA A 113 5.293 -9.221 -23.462 1.00 33.45 H new ATOM 0 HB3 ALA A 113 4.141 -7.865 -23.415 1.00 33.45 H new ATOM 1730 N ARG A 114 1.159 -8.558 -23.240 1.00 44.21 N ATOM 1731 CA ARG A 114 -0.079 -8.037 -22.673 1.00 43.12 C ATOM 1732 C ARG A 114 -1.112 -9.148 -22.511 1.00 52.24 C ATOM 1733 O ARG A 114 -1.951 -9.101 -21.613 1.00 33.13 O ATOM 1734 CB ARG A 114 -0.643 -6.926 -23.561 1.00 11.14 C ATOM 1735 CG ARG A 114 -1.484 -5.910 -22.804 1.00 64.13 C ATOM 1736 CD ARG A 114 -2.399 -5.137 -23.740 1.00 74.24 C ATOM 1737 NE ARG A 114 -2.898 -3.909 -23.128 1.00 5.41 N ATOM 1738 CZ ARG A 114 -3.754 -3.086 -23.723 1.00 12.14 C ATOM 1739 NH1 ARG A 114 -4.206 -3.360 -24.939 1.00 2.52 N ATOM 1740 NH2 ARG A 114 -4.161 -1.987 -23.100 1.00 53.24 N ATOM 0 H ARG A 114 1.332 -8.277 -24.205 1.00 44.21 H new ATOM 0 HA ARG A 114 0.145 -7.627 -21.688 1.00 43.12 H new ATOM 0 HB2 ARG A 114 0.182 -6.409 -24.051 1.00 11.14 H new ATOM 0 HB3 ARG A 114 -1.250 -7.374 -24.348 1.00 11.14 H new ATOM 0 HG2 ARG A 114 -2.082 -6.421 -22.049 1.00 64.13 H new ATOM 0 HG3 ARG A 114 -0.830 -5.215 -22.277 1.00 64.13 H new ATOM 0 HD2 ARG A 114 -1.859 -4.892 -24.655 1.00 74.24 H new ATOM 0 HD3 ARG A 114 -3.241 -5.767 -24.026 1.00 74.24 H new ATOM 0 HE ARG A 114 -2.571 -3.670 -22.192 1.00 5.41 H new ATOM 0 HH11 ARG A 114 -3.896 -4.205 -25.420 1.00 2.52 H new ATOM 0 HH12 ARG A 114 -4.863 -2.726 -25.394 1.00 2.52 H new ATOM 0 HH21 ARG A 114 -3.816 -1.774 -22.164 1.00 53.24 H new ATOM 0 HH22 ARG A 114 -4.818 -1.355 -23.557 1.00 53.24 H new ATOM 1754 N GLU A 115 -1.044 -10.145 -23.388 1.00 53.44 N ATOM 1755 CA GLU A 115 -1.975 -11.266 -23.343 1.00 32.03 C ATOM 1756 C GLU A 115 -1.737 -12.121 -22.101 1.00 50.32 C ATOM 1757 O GLU A 115 -2.676 -12.662 -21.518 1.00 23.20 O ATOM 1758 CB GLU A 115 -1.836 -12.125 -24.601 1.00 64.12 C ATOM 1759 CG GLU A 115 -2.519 -11.532 -25.822 1.00 34.33 C ATOM 1760 CD GLU A 115 -2.962 -12.590 -26.814 1.00 34.34 C ATOM 1761 OE1 GLU A 115 -3.792 -13.444 -26.438 1.00 34.52 O ATOM 1762 OE2 GLU A 115 -2.479 -12.565 -27.965 1.00 13.43 O ATOM 0 H GLU A 115 -0.354 -10.199 -24.138 1.00 53.44 H new ATOM 0 HA GLU A 115 -2.987 -10.863 -23.298 1.00 32.03 H new ATOM 0 HB2 GLU A 115 -0.777 -12.265 -24.820 1.00 64.12 H new ATOM 0 HB3 GLU A 115 -2.254 -13.112 -24.405 1.00 64.12 H new ATOM 0 HG2 GLU A 115 -3.385 -10.953 -25.503 1.00 34.33 H new ATOM 0 HG3 GLU A 115 -1.836 -10.840 -26.315 1.00 34.33 H new ATOM 1769 N ALA A 116 -0.474 -12.237 -21.704 1.00 32.15 N ATOM 1770 CA ALA A 116 -0.112 -13.024 -20.531 1.00 61.03 C ATOM 1771 C ALA A 116 -0.087 -12.159 -19.276 1.00 4.02 C ATOM 1772 O ALA A 116 -0.242 -12.659 -18.162 1.00 40.25 O ATOM 1773 CB ALA A 116 1.239 -13.693 -20.741 1.00 53.53 C ATOM 0 H ALA A 116 0.315 -11.796 -22.177 1.00 32.15 H new ATOM 0 HA ALA A 116 -0.870 -13.795 -20.393 1.00 61.03 H new ATOM 0 HB1 ALA A 116 1.497 -14.277 -19.858 1.00 53.53 H new ATOM 0 HB2 ALA A 116 1.188 -14.351 -21.609 1.00 53.53 H new ATOM 0 HB3 ALA A 116 2.000 -12.931 -20.907 1.00 53.53 H new ATOM 1779 N GLY A 117 0.111 -10.857 -19.463 1.00 62.41 N ATOM 1780 CA GLY A 117 0.154 -9.944 -18.336 1.00 42.02 C ATOM 1781 C GLY A 117 1.544 -9.390 -18.091 1.00 72.25 C ATOM 1782 O GLY A 117 1.714 -8.431 -17.338 1.00 42.53 O ATOM 0 H GLY A 117 0.242 -10.419 -20.375 1.00 62.41 H new ATOM 0 HA2 GLY A 117 -0.536 -9.119 -18.514 1.00 42.02 H new ATOM 0 HA3 GLY A 117 -0.191 -10.461 -17.440 1.00 42.02 H new ATOM 1786 N LEU A 118 2.541 -9.996 -18.727 1.00 53.01 N ATOM 1787 CA LEU A 118 3.924 -9.559 -18.573 1.00 51.35 C ATOM 1788 C LEU A 118 4.052 -8.060 -18.826 1.00 4.12 C ATOM 1789 O LEU A 118 3.300 -7.486 -19.613 1.00 33.03 O ATOM 1790 CB LEU A 118 4.832 -10.329 -19.533 1.00 45.24 C ATOM 1791 CG LEU A 118 6.164 -10.811 -18.956 1.00 40.52 C ATOM 1792 CD1 LEU A 118 5.942 -11.968 -17.995 1.00 73.02 C ATOM 1793 CD2 LEU A 118 7.114 -11.217 -20.074 1.00 35.54 C ATOM 0 H LEU A 118 2.417 -10.791 -19.354 1.00 53.01 H new ATOM 0 HA LEU A 118 4.233 -9.764 -17.548 1.00 51.35 H new ATOM 0 HB2 LEU A 118 4.284 -11.196 -19.903 1.00 45.24 H new ATOM 0 HB3 LEU A 118 5.040 -9.693 -20.393 1.00 45.24 H new ATOM 0 HG LEU A 118 6.617 -9.989 -18.403 1.00 40.52 H new ATOM 0 HD11 LEU A 118 6.901 -12.298 -17.595 1.00 73.02 H new ATOM 0 HD12 LEU A 118 5.299 -11.643 -17.177 1.00 73.02 H new ATOM 0 HD13 LEU A 118 5.466 -12.794 -18.524 1.00 73.02 H new ATOM 0 HD21 LEU A 118 8.057 -11.557 -19.645 1.00 35.54 H new ATOM 0 HD22 LEU A 118 6.668 -12.024 -20.656 1.00 35.54 H new ATOM 0 HD23 LEU A 118 7.299 -10.361 -20.723 1.00 35.54 H new ATOM 1805 N SER A 119 5.013 -7.432 -18.154 1.00 75.23 N ATOM 1806 CA SER A 119 5.239 -6.000 -18.304 1.00 40.54 C ATOM 1807 C SER A 119 6.244 -5.722 -19.419 1.00 33.24 C ATOM 1808 O SER A 119 7.454 -5.836 -19.222 1.00 34.10 O ATOM 1809 CB SER A 119 5.741 -5.400 -16.989 1.00 72.51 C ATOM 1810 OG SER A 119 4.660 -5.054 -16.141 1.00 75.12 O ATOM 0 H SER A 119 5.647 -7.893 -17.501 1.00 75.23 H new ATOM 0 HA SER A 119 4.290 -5.534 -18.569 1.00 40.54 H new ATOM 0 HB2 SER A 119 6.389 -6.115 -16.483 1.00 72.51 H new ATOM 0 HB3 SER A 119 6.343 -4.515 -17.196 1.00 72.51 H new ATOM 0 HG SER A 119 5.007 -4.674 -15.307 1.00 75.12 H new ATOM 1816 N VAL A 120 5.733 -5.357 -20.590 1.00 73.22 N ATOM 1817 CA VAL A 120 6.584 -5.062 -21.737 1.00 34.22 C ATOM 1818 C VAL A 120 6.914 -3.576 -21.808 1.00 10.41 C ATOM 1819 O VAL A 120 6.033 -2.726 -21.677 1.00 0.33 O ATOM 1820 CB VAL A 120 5.916 -5.492 -23.057 1.00 30.14 C ATOM 1821 CG1 VAL A 120 4.553 -4.833 -23.205 1.00 42.14 C ATOM 1822 CG2 VAL A 120 6.811 -5.157 -24.240 1.00 24.31 C ATOM 0 H VAL A 120 4.734 -5.258 -20.770 1.00 73.22 H new ATOM 0 HA VAL A 120 7.505 -5.630 -21.603 1.00 34.22 H new ATOM 0 HB VAL A 120 5.770 -6.572 -23.036 1.00 30.14 H new ATOM 0 HG11 VAL A 120 4.096 -5.148 -24.143 1.00 42.14 H new ATOM 0 HG12 VAL A 120 3.914 -5.128 -22.373 1.00 42.14 H new ATOM 0 HG13 VAL A 120 4.671 -3.749 -23.205 1.00 42.14 H new ATOM 0 HG21 VAL A 120 6.324 -5.468 -25.164 1.00 24.31 H new ATOM 0 HG22 VAL A 120 6.990 -4.082 -24.268 1.00 24.31 H new ATOM 0 HG23 VAL A 120 7.761 -5.681 -24.137 1.00 24.31 H new ATOM 1832 N VAL A 121 8.190 -3.268 -22.017 1.00 2.10 N ATOM 1833 CA VAL A 121 8.638 -1.883 -22.107 1.00 71.34 C ATOM 1834 C VAL A 121 9.570 -1.684 -23.297 1.00 54.44 C ATOM 1835 O VAL A 121 10.698 -2.174 -23.304 1.00 4.43 O ATOM 1836 CB VAL A 121 9.363 -1.443 -20.822 1.00 1.11 C ATOM 1837 CG1 VAL A 121 9.745 0.027 -20.901 1.00 12.40 C ATOM 1838 CG2 VAL A 121 8.495 -1.712 -19.602 1.00 41.00 C ATOM 0 H VAL A 121 8.932 -3.959 -22.127 1.00 2.10 H new ATOM 0 HA VAL A 121 7.747 -1.270 -22.240 1.00 71.34 H new ATOM 0 HB VAL A 121 10.278 -2.027 -20.724 1.00 1.11 H new ATOM 0 HG11 VAL A 121 10.256 0.320 -19.984 1.00 12.40 H new ATOM 0 HG12 VAL A 121 10.407 0.186 -21.752 1.00 12.40 H new ATOM 0 HG13 VAL A 121 8.846 0.631 -21.024 1.00 12.40 H new ATOM 0 HG21 VAL A 121 9.023 -1.395 -18.703 1.00 41.00 H new ATOM 0 HG22 VAL A 121 7.562 -1.156 -19.690 1.00 41.00 H new ATOM 0 HG23 VAL A 121 8.277 -2.778 -19.538 1.00 41.00 H new ATOM 1848 N MET A 122 9.089 -0.960 -24.303 1.00 40.02 N ATOM 1849 CA MET A 122 9.880 -0.694 -25.499 1.00 2.31 C ATOM 1850 C MET A 122 10.264 0.780 -25.580 1.00 5.35 C ATOM 1851 O MET A 122 9.871 1.581 -24.731 1.00 41.23 O ATOM 1852 CB MET A 122 9.102 -1.099 -26.752 1.00 61.22 C ATOM 1853 CG MET A 122 7.896 -0.217 -27.031 1.00 1.23 C ATOM 1854 SD MET A 122 6.640 -1.049 -28.021 1.00 22.30 S ATOM 1855 CE MET A 122 5.142 -0.399 -27.284 1.00 65.24 C ATOM 0 H MET A 122 8.156 -0.548 -24.314 1.00 40.02 H new ATOM 0 HA MET A 122 10.793 -1.287 -25.439 1.00 2.31 H new ATOM 0 HB2 MET A 122 9.772 -1.067 -27.611 1.00 61.22 H new ATOM 0 HB3 MET A 122 8.770 -2.132 -26.645 1.00 61.22 H new ATOM 0 HG2 MET A 122 7.456 0.100 -26.085 1.00 1.23 H new ATOM 0 HG3 MET A 122 8.223 0.685 -27.549 1.00 1.23 H new ATOM 0 HE1 MET A 122 4.274 -0.822 -27.790 1.00 65.24 H new ATOM 0 HE2 MET A 122 5.111 -0.665 -26.228 1.00 65.24 H new ATOM 0 HE3 MET A 122 5.128 0.686 -27.385 1.00 65.24 H new ATOM 1865 N ASP A 123 11.035 1.131 -26.604 1.00 14.15 N ATOM 1866 CA ASP A 123 11.471 2.509 -26.795 1.00 2.31 C ATOM 1867 C ASP A 123 12.225 3.016 -25.569 1.00 71.31 C ATOM 1868 O ASP A 123 12.203 4.208 -25.264 1.00 1.14 O ATOM 1869 CB ASP A 123 10.270 3.412 -27.080 1.00 1.44 C ATOM 1870 CG ASP A 123 10.657 4.669 -27.834 1.00 12.31 C ATOM 1871 OD1 ASP A 123 11.661 4.631 -28.575 1.00 22.23 O ATOM 1872 OD2 ASP A 123 9.956 5.692 -27.683 1.00 35.21 O ATOM 0 H ASP A 123 11.371 0.480 -27.314 1.00 14.15 H new ATOM 0 HA ASP A 123 12.146 2.535 -27.650 1.00 2.31 H new ATOM 0 HB2 ASP A 123 9.531 2.857 -27.659 1.00 1.44 H new ATOM 0 HB3 ASP A 123 9.795 3.688 -26.139 1.00 1.44 H new ATOM 1877 N ARG A 124 12.890 2.102 -24.870 1.00 71.52 N ATOM 1878 CA ARG A 124 13.648 2.455 -23.676 1.00 43.24 C ATOM 1879 C ARG A 124 14.811 1.490 -23.465 1.00 44.25 C ATOM 1880 O ARG A 124 14.767 0.343 -23.911 1.00 24.33 O ATOM 1881 CB ARG A 124 12.738 2.449 -22.447 1.00 55.23 C ATOM 1882 CG ARG A 124 13.137 3.463 -21.388 1.00 44.30 C ATOM 1883 CD ARG A 124 11.933 4.236 -20.874 1.00 11.21 C ATOM 1884 NE ARG A 124 11.048 3.399 -20.068 1.00 62.45 N ATOM 1885 CZ ARG A 124 10.130 3.884 -19.240 1.00 23.42 C ATOM 1886 NH1 ARG A 124 9.977 5.194 -19.109 1.00 1.05 N ATOM 1887 NH2 ARG A 124 9.363 3.057 -18.541 1.00 11.13 N ATOM 0 H ARG A 124 12.919 1.111 -25.110 1.00 71.52 H new ATOM 0 HA ARG A 124 14.051 3.458 -23.816 1.00 43.24 H new ATOM 0 HB2 ARG A 124 11.714 2.650 -22.763 1.00 55.23 H new ATOM 0 HB3 ARG A 124 12.746 1.453 -22.005 1.00 55.23 H new ATOM 0 HG2 ARG A 124 13.623 2.951 -20.558 1.00 44.30 H new ATOM 0 HG3 ARG A 124 13.866 4.158 -21.805 1.00 44.30 H new ATOM 0 HD2 ARG A 124 12.273 5.083 -20.278 1.00 11.21 H new ATOM 0 HD3 ARG A 124 11.377 4.644 -21.718 1.00 11.21 H new ATOM 0 HE ARG A 124 11.140 2.386 -20.145 1.00 62.45 H new ATOM 0 HH11 ARG A 124 10.565 5.832 -19.645 1.00 1.05 H new ATOM 0 HH12 ARG A 124 9.271 5.564 -18.472 1.00 1.05 H new ATOM 0 HH21 ARG A 124 9.478 2.048 -18.640 1.00 11.13 H new ATOM 0 HH22 ARG A 124 8.658 3.430 -17.905 1.00 11.13 H new ATOM 1901 N CYS A 125 15.850 1.963 -22.785 1.00 54.22 N ATOM 1902 CA CYS A 125 17.025 1.143 -22.516 1.00 64.14 C ATOM 1903 C CYS A 125 17.767 1.644 -21.282 1.00 2.14 C ATOM 1904 O CYS A 125 18.082 2.827 -21.154 1.00 44.42 O ATOM 1905 CB CYS A 125 17.962 1.146 -23.725 1.00 62.13 C ATOM 1906 SG CYS A 125 19.236 -0.136 -23.675 1.00 5.11 S ATOM 0 H CYS A 125 15.902 2.910 -22.410 1.00 54.22 H new ATOM 0 HA CYS A 125 16.690 0.123 -22.327 1.00 64.14 H new ATOM 0 HB2 CYS A 125 17.369 1.019 -24.631 1.00 62.13 H new ATOM 0 HB3 CYS A 125 18.445 2.121 -23.794 1.00 62.13 H new ATOM 0 HG CYS A 125 19.283 -0.746 -24.822 1.00 5.11 H new ATOM 1912 N PRO A 126 18.052 0.724 -20.348 1.00 41.01 N ATOM 1913 CA PRO A 126 18.759 1.049 -19.106 1.00 1.32 C ATOM 1914 C PRO A 126 20.223 1.400 -19.347 1.00 3.31 C ATOM 1915 O PRO A 126 20.897 1.933 -18.465 1.00 72.24 O ATOM 1916 CB PRO A 126 18.646 -0.238 -18.286 1.00 31.32 C ATOM 1917 CG PRO A 126 18.477 -1.318 -19.298 1.00 23.42 C ATOM 1918 CD PRO A 126 17.706 -0.705 -20.434 1.00 5.22 C ATOM 0 HA PRO A 126 18.335 1.924 -18.613 1.00 1.32 H new ATOM 0 HB2 PRO A 126 19.537 -0.400 -17.679 1.00 31.32 H new ATOM 0 HB3 PRO A 126 17.797 -0.199 -17.603 1.00 31.32 H new ATOM 0 HG2 PRO A 126 19.444 -1.689 -19.638 1.00 23.42 H new ATOM 0 HG3 PRO A 126 17.940 -2.168 -18.876 1.00 23.42 H new ATOM 0 HD2 PRO A 126 17.997 -1.132 -21.394 1.00 5.22 H new ATOM 0 HD3 PRO A 126 16.633 -0.866 -20.325 1.00 5.22 H new ATOM 1926 N ALA A 127 20.709 1.099 -20.546 1.00 65.25 N ATOM 1927 CA ALA A 127 22.093 1.385 -20.904 1.00 3.12 C ATOM 1928 C ALA A 127 22.371 2.884 -20.866 1.00 24.13 C ATOM 1929 O ALA A 127 23.379 3.324 -20.311 1.00 32.33 O ATOM 1930 CB ALA A 127 22.410 0.823 -22.282 1.00 32.54 C ATOM 0 H ALA A 127 20.165 0.657 -21.287 1.00 65.25 H new ATOM 0 HA ALA A 127 22.739 0.903 -20.170 1.00 3.12 H new ATOM 0 HB1 ALA A 127 23.447 1.044 -22.536 1.00 32.54 H new ATOM 0 HB2 ALA A 127 22.260 -0.257 -22.278 1.00 32.54 H new ATOM 0 HB3 ALA A 127 21.751 1.278 -23.021 1.00 32.54 H new ATOM 1936 N ILE A 128 21.473 3.663 -21.459 1.00 62.20 N ATOM 1937 CA ILE A 128 21.623 5.112 -21.492 1.00 13.41 C ATOM 1938 C ILE A 128 20.791 5.776 -20.399 1.00 72.35 C ATOM 1939 O ILE A 128 21.054 6.913 -20.011 1.00 13.14 O ATOM 1940 CB ILE A 128 21.209 5.690 -22.858 1.00 43.14 C ATOM 1941 CG1 ILE A 128 21.999 5.015 -23.982 1.00 34.11 C ATOM 1942 CG2 ILE A 128 21.424 7.196 -22.884 1.00 2.03 C ATOM 1943 CD1 ILE A 128 21.470 5.327 -25.364 1.00 53.42 C ATOM 0 H ILE A 128 20.634 3.315 -21.923 1.00 62.20 H new ATOM 0 HA ILE A 128 22.679 5.324 -21.322 1.00 13.41 H new ATOM 0 HB ILE A 128 20.149 5.491 -23.013 1.00 43.14 H new ATOM 0 HG12 ILE A 128 23.041 5.328 -23.921 1.00 34.11 H new ATOM 0 HG13 ILE A 128 21.981 3.936 -23.830 1.00 34.11 H new ATOM 0 HG21 ILE A 128 21.127 7.589 -23.856 1.00 2.03 H new ATOM 0 HG22 ILE A 128 20.822 7.663 -22.104 1.00 2.03 H new ATOM 0 HG23 ILE A 128 22.477 7.416 -22.710 1.00 2.03 H new ATOM 0 HD11 ILE A 128 22.078 4.815 -26.110 1.00 53.42 H new ATOM 0 HD12 ILE A 128 20.437 4.988 -25.443 1.00 53.42 H new ATOM 0 HD13 ILE A 128 21.513 6.402 -25.536 1.00 53.42 H new