USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 813 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 115 CYS SG : rot -134:sc= 1.26 USER MOD Set 1.2: A 117 CYS SG : rot -146:sc= 0.921 USER MOD Set 1.3: A 121 TYR OH : rot -136:sc= 0.411 USER MOD Set 1.4: A 136 CYS SG : rot 151:sc= 0.435 USER MOD Set 1.5: A 139 CYS SG : rot -50:sc= 0.77 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 74:sc= 0.638 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.139 X(o=-0.14,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 101:sc= 0.638 USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HE2:sc= -0.844 K(o=-0.84,f=-1.5) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.205 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 CYS SG : rot 9:sc= 0.537 USER MOD Single : A 57 GLN : amide:sc= -0.148 K(o=-0.15,f=-0.75) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -1.01 K(o=-1,f=-1.8) USER MOD Single : A 67 LYS NZ :NH3+ -177:sc= 0.535 (180deg=0.53) USER MOD Single : A 71 ASN : amide:sc= -0.149 K(o=-0.15,f=-2.8!) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 CYS SG : rot 77:sc= 0.905 USER MOD Single : A 96 GLN : amide:sc= -1.16 X(o=-1.2,f=-1.1) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl -103:sc= -0.756 (180deg=-3.82) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -0.0145 K(o=-0.015,f=-1.4) USER MOD Single : A 109 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= -0.929 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= -0.371 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot -14:sc= 0.804 USER MOD Single : A 140 SER OG : rot 64:sc= 0.138 USER MOD Single : A 147 HIS : no HD1:sc= -0.56 X(o=-0.56,f=-0.52) USER MOD ----------------------------------------------------------------- ATOM 129 N LYS A 10 22.734 45.687 -48.874 1.00 52.14 N ATOM 130 CA LYS A 10 21.376 45.728 -49.406 1.00 64.23 C ATOM 131 C LYS A 10 20.459 46.535 -48.493 1.00 60.14 C ATOM 132 O LYS A 10 20.920 47.207 -47.570 1.00 1.35 O ATOM 133 CB LYS A 10 20.828 44.309 -49.571 1.00 65.42 C ATOM 134 CG LYS A 10 20.115 44.083 -50.893 1.00 21.35 C ATOM 135 CD LYS A 10 18.903 43.183 -50.726 1.00 14.21 C ATOM 136 CE LYS A 10 18.579 42.439 -52.012 1.00 32.10 C ATOM 137 NZ LYS A 10 17.142 42.054 -52.084 1.00 20.22 N ATOM 0 HA LYS A 10 21.409 46.214 -50.381 1.00 64.23 H new ATOM 0 HB2 LYS A 10 21.650 43.599 -49.485 1.00 65.42 H new ATOM 0 HB3 LYS A 10 20.138 44.098 -48.754 1.00 65.42 H new ATOM 0 HG2 LYS A 10 19.803 45.042 -51.308 1.00 21.35 H new ATOM 0 HG3 LYS A 10 20.806 43.636 -51.608 1.00 21.35 H new ATOM 0 HD2 LYS A 10 19.089 42.466 -49.927 1.00 14.21 H new ATOM 0 HD3 LYS A 10 18.043 43.781 -50.424 1.00 14.21 H new ATOM 0 HE2 LYS A 10 18.830 43.066 -52.867 1.00 32.10 H new ATOM 0 HE3 LYS A 10 19.198 41.545 -52.080 1.00 32.10 H new ATOM 0 HZ1 LYS A 10 16.962 41.549 -52.975 1.00 20.22 H new ATOM 0 HZ2 LYS A 10 16.908 41.435 -51.282 1.00 20.22 H new ATOM 0 HZ3 LYS A 10 16.551 42.909 -52.045 1.00 20.22 H new ATOM 147 N ASP A 11 19.159 46.465 -48.756 1.00 11.03 N ATOM 148 CA ASP A 11 18.176 47.187 -47.957 1.00 13.21 C ATOM 149 C ASP A 11 18.242 46.756 -46.495 1.00 11.33 C ATOM 150 O ASP A 11 17.767 47.463 -45.607 1.00 11.30 O ATOM 151 CB ASP A 11 16.768 46.953 -48.507 1.00 60.53 C ATOM 152 CG ASP A 11 16.630 47.402 -49.950 1.00 53.41 C ATOM 153 OD1 ASP A 11 17.053 46.646 -50.850 1.00 43.21 O ATOM 154 OD2 ASP A 11 16.096 48.507 -50.179 1.00 45.23 O ATOM 0 H ASP A 11 18.761 45.915 -49.517 1.00 11.03 H new ATOM 0 HA ASP A 11 18.408 48.250 -48.015 1.00 13.21 H new ATOM 0 HB2 ASP A 11 16.524 45.893 -48.434 1.00 60.53 H new ATOM 0 HB3 ASP A 11 16.046 47.490 -47.891 1.00 60.53 H new ATOM 158 N TRP A 12 18.831 45.590 -46.254 1.00 41.50 N ATOM 159 CA TRP A 12 18.957 45.064 -44.900 1.00 23.03 C ATOM 160 C TRP A 12 19.631 46.078 -43.982 1.00 43.01 C ATOM 161 O TRP A 12 18.996 46.639 -43.088 1.00 62.31 O ATOM 162 CB TRP A 12 19.754 43.759 -44.910 1.00 3.23 C ATOM 163 CG TRP A 12 19.340 42.818 -46.001 1.00 52.30 C ATOM 164 CD1 TRP A 12 20.163 42.138 -46.854 1.00 52.23 C ATOM 165 CD2 TRP A 12 18.001 42.455 -46.357 1.00 24.03 C ATOM 166 NE1 TRP A 12 19.415 41.375 -47.718 1.00 23.31 N ATOM 167 CE2 TRP A 12 18.087 41.551 -47.434 1.00 61.12 C ATOM 168 CE3 TRP A 12 16.739 42.804 -45.869 1.00 23.31 C ATOM 169 CZ2 TRP A 12 16.959 40.995 -48.030 1.00 4.30 C ATOM 170 CZ3 TRP A 12 15.620 42.251 -46.462 1.00 42.22 C ATOM 171 CH2 TRP A 12 15.736 41.354 -47.532 1.00 34.54 C ATOM 0 H TRP A 12 19.228 44.992 -46.978 1.00 41.50 H new ATOM 0 HA TRP A 12 17.955 44.867 -44.519 1.00 23.03 H new ATOM 0 HB2 TRP A 12 20.813 43.990 -45.022 1.00 3.23 H new ATOM 0 HB3 TRP A 12 19.636 43.262 -43.947 1.00 3.23 H new ATOM 0 HD1 TRP A 12 21.242 42.192 -46.850 1.00 52.23 H new ATOM 0 HE1 TRP A 12 19.789 40.774 -48.453 1.00 23.31 H new ATOM 0 HE3 TRP A 12 16.640 43.493 -45.043 1.00 23.31 H new ATOM 0 HZ2 TRP A 12 17.046 40.305 -48.856 1.00 4.30 H new ATOM 0 HZ3 TRP A 12 14.639 42.515 -46.094 1.00 42.22 H new ATOM 0 HH2 TRP A 12 14.842 40.938 -47.973 1.00 34.54 H new ATOM 181 N TYR A 13 20.919 46.309 -44.209 1.00 43.42 N ATOM 182 CA TYR A 13 21.679 47.255 -43.400 1.00 42.13 C ATOM 183 C TYR A 13 21.061 48.648 -43.466 1.00 44.14 C ATOM 184 O TYR A 13 21.305 49.489 -42.601 1.00 50.25 O ATOM 185 CB TYR A 13 23.134 47.307 -43.870 1.00 50.15 C ATOM 186 CG TYR A 13 23.403 48.392 -44.888 1.00 20.30 C ATOM 187 CD1 TYR A 13 23.772 49.671 -44.489 1.00 0.51 C ATOM 188 CD2 TYR A 13 23.288 48.138 -46.249 1.00 73.20 C ATOM 189 CE1 TYR A 13 24.018 50.665 -45.416 1.00 11.51 C ATOM 190 CE2 TYR A 13 23.533 49.126 -47.183 1.00 21.20 C ATOM 191 CZ TYR A 13 23.897 50.388 -46.761 1.00 65.52 C ATOM 192 OH TYR A 13 24.143 51.376 -47.687 1.00 33.13 O ATOM 0 H TYR A 13 21.459 45.855 -44.946 1.00 43.42 H new ATOM 0 HA TYR A 13 21.651 46.914 -42.365 1.00 42.13 H new ATOM 0 HB2 TYR A 13 23.781 47.462 -43.006 1.00 50.15 H new ATOM 0 HB3 TYR A 13 23.403 46.342 -44.300 1.00 50.15 H new ATOM 0 HD1 TYR A 13 23.868 49.892 -43.436 1.00 0.51 H new ATOM 0 HD2 TYR A 13 23.002 47.151 -46.583 1.00 73.20 H new ATOM 0 HE1 TYR A 13 24.304 51.654 -45.089 1.00 11.51 H new ATOM 0 HE2 TYR A 13 23.440 48.912 -48.237 1.00 21.20 H new ATOM 0 HH TYR A 13 24.015 51.017 -48.590 1.00 33.13 H new ATOM 201 N SER A 14 20.261 48.885 -44.500 1.00 13.23 N ATOM 202 CA SER A 14 19.609 50.176 -44.683 1.00 71.44 C ATOM 203 C SER A 14 18.451 50.344 -43.705 1.00 43.12 C ATOM 204 O SER A 14 18.310 51.388 -43.067 1.00 55.51 O ATOM 205 CB SER A 14 19.103 50.317 -46.120 1.00 1.53 C ATOM 206 OG SER A 14 20.092 49.917 -47.051 1.00 64.41 O ATOM 0 H SER A 14 20.049 48.199 -45.225 1.00 13.23 H new ATOM 0 HA SER A 14 20.344 50.957 -44.486 1.00 71.44 H new ATOM 0 HB2 SER A 14 18.207 49.711 -46.254 1.00 1.53 H new ATOM 0 HB3 SER A 14 18.819 51.352 -46.309 1.00 1.53 H new ATOM 0 HG SER A 14 20.172 48.940 -47.044 1.00 64.41 H new ATOM 211 N ILE A 15 17.625 49.309 -43.592 1.00 74.22 N ATOM 212 CA ILE A 15 16.479 49.342 -42.691 1.00 24.33 C ATOM 213 C ILE A 15 16.898 49.757 -41.286 1.00 45.51 C ATOM 214 O ILE A 15 16.337 50.689 -40.708 1.00 51.23 O ATOM 215 CB ILE A 15 15.779 47.972 -42.623 1.00 0.23 C ATOM 216 CG1 ILE A 15 14.991 47.712 -43.908 1.00 53.05 C ATOM 217 CG2 ILE A 15 14.863 47.906 -41.411 1.00 12.32 C ATOM 218 CD1 ILE A 15 14.268 46.384 -43.916 1.00 31.41 C ATOM 0 H ILE A 15 17.728 48.438 -44.113 1.00 74.22 H new ATOM 0 HA ILE A 15 15.782 50.078 -43.092 1.00 24.33 H new ATOM 0 HB ILE A 15 16.539 47.197 -42.523 1.00 0.23 H new ATOM 0 HG12 ILE A 15 14.265 48.513 -44.047 1.00 53.05 H new ATOM 0 HG13 ILE A 15 15.674 47.750 -44.757 1.00 53.05 H new ATOM 0 HG21 ILE A 15 14.375 46.932 -41.376 1.00 12.32 H new ATOM 0 HG22 ILE A 15 15.449 48.051 -40.504 1.00 12.32 H new ATOM 0 HG23 ILE A 15 14.107 48.688 -41.483 1.00 12.32 H new ATOM 0 HD11 ILE A 15 13.731 46.268 -44.857 1.00 31.41 H new ATOM 0 HD12 ILE A 15 14.991 45.575 -43.809 1.00 31.41 H new ATOM 0 HD13 ILE A 15 13.560 46.350 -43.088 1.00 31.41 H new ATOM 229 N LEU A 16 17.888 49.060 -40.738 1.00 35.32 N ATOM 230 CA LEU A 16 18.385 49.357 -39.399 1.00 14.43 C ATOM 231 C LEU A 16 19.497 50.398 -39.449 1.00 24.10 C ATOM 232 O LEU A 16 19.966 50.871 -38.415 1.00 55.34 O ATOM 233 CB LEU A 16 18.894 48.080 -38.728 1.00 61.44 C ATOM 234 CG LEU A 16 17.873 46.954 -38.563 1.00 42.01 C ATOM 235 CD1 LEU A 16 18.487 45.781 -37.815 1.00 31.33 C ATOM 236 CD2 LEU A 16 16.633 47.460 -37.839 1.00 24.40 C ATOM 0 H LEU A 16 18.362 48.285 -41.201 1.00 35.32 H new ATOM 0 HA LEU A 16 17.560 49.763 -38.814 1.00 14.43 H new ATOM 0 HB2 LEU A 16 19.734 47.699 -39.308 1.00 61.44 H new ATOM 0 HB3 LEU A 16 19.280 48.341 -37.742 1.00 61.44 H new ATOM 0 HG LEU A 16 17.577 46.611 -39.554 1.00 42.01 H new ATOM 0 HD11 LEU A 16 17.745 44.990 -37.707 1.00 31.33 H new ATOM 0 HD12 LEU A 16 19.344 45.402 -38.373 1.00 31.33 H new ATOM 0 HD13 LEU A 16 18.813 46.109 -36.828 1.00 31.33 H new ATOM 0 HD21 LEU A 16 15.917 46.645 -37.730 1.00 24.40 H new ATOM 0 HD22 LEU A 16 16.913 47.831 -36.853 1.00 24.40 H new ATOM 0 HD23 LEU A 16 16.180 48.267 -38.415 1.00 24.40 H new ATOM 247 N GLY A 17 19.916 50.751 -40.661 1.00 62.24 N ATOM 248 CA GLY A 17 20.969 51.737 -40.824 1.00 23.03 C ATOM 249 C GLY A 17 22.170 51.452 -39.943 1.00 75.33 C ATOM 250 O GLY A 17 22.856 52.373 -39.501 1.00 41.42 O ATOM 0 H GLY A 17 19.545 50.372 -41.532 1.00 62.24 H new ATOM 0 HA2 GLY A 17 21.284 51.759 -41.867 1.00 23.03 H new ATOM 0 HA3 GLY A 17 20.576 52.726 -40.589 1.00 23.03 H new ATOM 254 N ALA A 18 22.424 50.173 -39.686 1.00 74.32 N ATOM 255 CA ALA A 18 23.550 49.770 -38.854 1.00 72.14 C ATOM 256 C ALA A 18 24.764 49.417 -39.706 1.00 44.10 C ATOM 257 O ALA A 18 24.667 48.629 -40.647 1.00 41.55 O ATOM 258 CB ALA A 18 23.161 48.592 -37.973 1.00 15.54 C ATOM 0 H ALA A 18 21.865 49.398 -40.043 1.00 74.32 H new ATOM 0 HA ALA A 18 23.818 50.613 -38.217 1.00 72.14 H new ATOM 0 HB1 ALA A 18 24.012 48.302 -37.357 1.00 15.54 H new ATOM 0 HB2 ALA A 18 22.328 48.878 -37.330 1.00 15.54 H new ATOM 0 HB3 ALA A 18 22.864 47.751 -38.600 1.00 15.54 H new ATOM 264 N ASP A 19 25.907 50.006 -39.370 1.00 2.14 N ATOM 265 CA ASP A 19 27.141 49.753 -40.104 1.00 24.24 C ATOM 266 C ASP A 19 27.551 48.287 -39.992 1.00 44.14 C ATOM 267 O ASP A 19 27.081 47.551 -39.124 1.00 1.10 O ATOM 268 CB ASP A 19 28.265 50.650 -39.582 1.00 40.43 C ATOM 269 CG ASP A 19 28.523 51.839 -40.485 1.00 73.33 C ATOM 270 OD1 ASP A 19 27.544 52.501 -40.890 1.00 13.40 O ATOM 271 OD2 ASP A 19 29.705 52.110 -40.788 1.00 15.50 O ATOM 0 H ASP A 19 26.004 50.661 -38.595 1.00 2.14 H new ATOM 0 HA ASP A 19 26.961 49.982 -41.154 1.00 24.24 H new ATOM 0 HB2 ASP A 19 28.009 51.005 -38.584 1.00 40.43 H new ATOM 0 HB3 ASP A 19 29.179 50.064 -39.487 1.00 40.43 H new ATOM 275 N PRO A 20 28.447 47.851 -40.890 1.00 51.53 N ATOM 276 CA PRO A 20 28.939 46.470 -40.911 1.00 74.44 C ATOM 277 C PRO A 20 29.834 46.155 -39.719 1.00 43.43 C ATOM 278 O PRO A 20 30.205 45.003 -39.496 1.00 14.34 O ATOM 279 CB PRO A 20 29.738 46.399 -42.215 1.00 53.22 C ATOM 280 CG PRO A 20 30.158 47.804 -42.479 1.00 32.03 C ATOM 281 CD PRO A 20 29.049 48.673 -41.952 1.00 61.11 C ATOM 0 HA PRO A 20 28.126 45.746 -40.853 1.00 74.44 H new ATOM 0 HB2 PRO A 20 30.601 45.740 -42.115 1.00 53.22 H new ATOM 0 HB3 PRO A 20 29.130 46.008 -43.031 1.00 53.22 H new ATOM 0 HG2 PRO A 20 31.101 48.030 -41.981 1.00 32.03 H new ATOM 0 HG3 PRO A 20 30.312 47.972 -43.545 1.00 32.03 H new ATOM 0 HD2 PRO A 20 29.429 49.617 -41.562 1.00 61.11 H new ATOM 0 HD3 PRO A 20 28.326 48.917 -42.730 1.00 61.11 H new ATOM 286 N SER A 21 30.179 47.186 -38.955 1.00 1.22 N ATOM 287 CA SER A 21 31.035 47.019 -37.786 1.00 63.03 C ATOM 288 C SER A 21 30.200 46.787 -36.530 1.00 25.43 C ATOM 289 O SER A 21 30.669 46.190 -35.562 1.00 44.53 O ATOM 290 CB SER A 21 31.926 48.248 -37.600 1.00 61.03 C ATOM 291 OG SER A 21 32.928 48.010 -36.627 1.00 22.32 O ATOM 0 H SER A 21 29.879 48.146 -39.124 1.00 1.22 H new ATOM 0 HA SER A 21 31.665 46.144 -37.949 1.00 63.03 H new ATOM 0 HB2 SER A 21 32.392 48.510 -38.550 1.00 61.03 H new ATOM 0 HB3 SER A 21 31.317 49.100 -37.298 1.00 61.03 H new ATOM 0 HG SER A 21 33.485 48.810 -36.528 1.00 22.32 H new ATOM 296 N ALA A 22 28.960 47.264 -36.555 1.00 65.14 N ATOM 297 CA ALA A 22 28.059 47.107 -35.420 1.00 74.01 C ATOM 298 C ALA A 22 27.981 45.650 -34.978 1.00 75.02 C ATOM 299 O ALA A 22 28.496 44.759 -35.651 1.00 61.15 O ATOM 300 CB ALA A 22 26.673 47.630 -35.772 1.00 2.53 C ATOM 0 H ALA A 22 28.557 47.762 -37.348 1.00 65.14 H new ATOM 0 HA ALA A 22 28.455 47.690 -34.589 1.00 74.01 H new ATOM 0 HB1 ALA A 22 26.009 47.507 -34.916 1.00 2.53 H new ATOM 0 HB2 ALA A 22 26.738 48.687 -36.032 1.00 2.53 H new ATOM 0 HB3 ALA A 22 26.278 47.071 -36.620 1.00 2.53 H new ATOM 306 N ASN A 23 27.334 45.416 -33.841 1.00 15.33 N ATOM 307 CA ASN A 23 27.190 44.066 -33.308 1.00 52.10 C ATOM 308 C ASN A 23 25.719 43.669 -33.223 1.00 32.31 C ATOM 309 O ASN A 23 24.846 44.518 -33.045 1.00 53.44 O ATOM 310 CB ASN A 23 27.836 43.970 -31.925 1.00 43.54 C ATOM 311 CG ASN A 23 29.336 44.185 -31.970 1.00 72.31 C ATOM 312 OD1 ASN A 23 29.873 45.047 -31.274 1.00 13.12 O ATOM 313 ND2 ASN A 23 30.021 43.401 -32.795 1.00 0.43 N ATOM 0 H ASN A 23 26.901 46.143 -33.271 1.00 15.33 H new ATOM 0 HA ASN A 23 27.695 43.378 -33.986 1.00 52.10 H new ATOM 0 HB2 ASN A 23 27.385 44.711 -31.265 1.00 43.54 H new ATOM 0 HB3 ASN A 23 27.625 42.990 -31.496 1.00 43.54 H new ATOM 0 HD21 ASN A 23 31.033 43.500 -32.870 1.00 0.43 H new ATOM 0 HD22 ASN A 23 29.535 42.699 -33.353 1.00 0.43 H new ATOM 319 N ILE A 24 25.454 42.373 -33.352 1.00 35.45 N ATOM 320 CA ILE A 24 24.090 41.863 -33.289 1.00 54.11 C ATOM 321 C ILE A 24 23.368 42.377 -32.047 1.00 21.15 C ATOM 322 O ILE A 24 22.202 42.765 -32.111 1.00 71.12 O ATOM 323 CB ILE A 24 24.064 40.323 -33.283 1.00 61.43 C ATOM 324 CG1 ILE A 24 22.633 39.816 -33.092 1.00 61.31 C ATOM 325 CG2 ILE A 24 24.974 39.782 -32.190 1.00 62.31 C ATOM 326 CD1 ILE A 24 21.667 40.323 -34.141 1.00 2.03 C ATOM 0 H ILE A 24 26.166 41.658 -33.501 1.00 35.45 H new ATOM 0 HA ILE A 24 23.577 42.223 -34.181 1.00 54.11 H new ATOM 0 HB ILE A 24 24.431 39.964 -34.245 1.00 61.43 H new ATOM 0 HG12 ILE A 24 22.637 38.726 -33.110 1.00 61.31 H new ATOM 0 HG13 ILE A 24 22.278 40.117 -32.107 1.00 61.31 H new ATOM 0 HG21 ILE A 24 24.945 38.692 -32.198 1.00 62.31 H new ATOM 0 HG22 ILE A 24 25.995 40.119 -32.367 1.00 62.31 H new ATOM 0 HG23 ILE A 24 24.635 40.146 -31.220 1.00 62.31 H new ATOM 0 HD11 ILE A 24 20.672 39.924 -33.943 1.00 2.03 H new ATOM 0 HD12 ILE A 24 21.634 41.412 -34.109 1.00 2.03 H new ATOM 0 HD13 ILE A 24 21.998 39.999 -35.128 1.00 2.03 H new ATOM 337 N SER A 25 24.070 42.377 -30.919 1.00 61.14 N ATOM 338 CA SER A 25 23.496 42.842 -29.661 1.00 32.34 C ATOM 339 C SER A 25 22.972 44.267 -29.798 1.00 50.05 C ATOM 340 O SER A 25 21.769 44.510 -29.693 1.00 44.44 O ATOM 341 CB SER A 25 24.540 42.775 -28.545 1.00 11.51 C ATOM 342 OG SER A 25 25.005 41.449 -28.360 1.00 2.40 O ATOM 0 H SER A 25 25.037 42.060 -30.850 1.00 61.14 H new ATOM 0 HA SER A 25 22.661 42.189 -29.407 1.00 32.34 H new ATOM 0 HB2 SER A 25 25.379 43.427 -28.788 1.00 11.51 H new ATOM 0 HB3 SER A 25 24.107 43.145 -27.615 1.00 11.51 H new ATOM 0 HG SER A 25 25.672 41.433 -27.643 1.00 2.40 H new ATOM 347 N ASP A 26 23.881 45.207 -30.031 1.00 22.34 N ATOM 348 CA ASP A 26 23.512 46.609 -30.184 1.00 63.21 C ATOM 349 C ASP A 26 22.470 46.780 -31.284 1.00 51.22 C ATOM 350 O ASP A 26 21.703 47.744 -31.284 1.00 11.20 O ATOM 351 CB ASP A 26 24.748 47.453 -30.499 1.00 20.05 C ATOM 352 CG ASP A 26 24.725 48.797 -29.799 1.00 44.45 C ATOM 353 OD1 ASP A 26 24.969 48.834 -28.575 1.00 4.41 O ATOM 354 OD2 ASP A 26 24.463 49.814 -30.475 1.00 11.03 O ATOM 0 H ASP A 26 24.880 45.023 -30.118 1.00 22.34 H new ATOM 0 HA ASP A 26 23.080 46.950 -29.243 1.00 63.21 H new ATOM 0 HB2 ASP A 26 25.643 46.907 -30.201 1.00 20.05 H new ATOM 0 HB3 ASP A 26 24.813 47.609 -31.576 1.00 20.05 H new ATOM 358 N LEU A 27 22.448 45.840 -32.222 1.00 32.32 N ATOM 359 CA LEU A 27 21.500 45.887 -33.331 1.00 5.13 C ATOM 360 C LEU A 27 20.118 45.421 -32.884 1.00 32.35 C ATOM 361 O LEU A 27 19.101 45.825 -33.450 1.00 63.13 O ATOM 362 CB LEU A 27 21.995 45.018 -34.488 1.00 20.32 C ATOM 363 CG LEU A 27 22.424 45.764 -35.752 1.00 44.34 C ATOM 364 CD1 LEU A 27 21.291 46.638 -36.266 1.00 13.44 C ATOM 365 CD2 LEU A 27 23.665 46.601 -35.481 1.00 64.45 C ATOM 0 H LEU A 27 23.075 45.036 -32.237 1.00 32.32 H new ATOM 0 HA LEU A 27 21.423 46.920 -33.669 1.00 5.13 H new ATOM 0 HB2 LEU A 27 22.839 44.426 -34.136 1.00 20.32 H new ATOM 0 HB3 LEU A 27 21.203 44.318 -34.755 1.00 20.32 H new ATOM 0 HG LEU A 27 22.666 45.030 -36.520 1.00 44.34 H new ATOM 0 HD11 LEU A 27 21.615 47.161 -37.166 1.00 13.44 H new ATOM 0 HD12 LEU A 27 20.428 46.015 -36.499 1.00 13.44 H new ATOM 0 HD13 LEU A 27 21.017 47.366 -35.502 1.00 13.44 H new ATOM 0 HD21 LEU A 27 23.956 47.125 -36.391 1.00 64.45 H new ATOM 0 HD22 LEU A 27 23.450 47.327 -34.697 1.00 64.45 H new ATOM 0 HD23 LEU A 27 24.479 45.951 -35.160 1.00 64.45 H new ATOM 376 N LYS A 28 20.087 44.567 -31.867 1.00 41.14 N ATOM 377 CA LYS A 28 18.830 44.048 -31.341 1.00 14.55 C ATOM 378 C LYS A 28 17.997 45.164 -30.719 1.00 41.13 C ATOM 379 O LYS A 28 16.859 45.400 -31.123 1.00 11.44 O ATOM 380 CB LYS A 28 19.099 42.958 -30.301 1.00 23.14 C ATOM 381 CG LYS A 28 17.852 42.208 -29.869 1.00 31.25 C ATOM 382 CD LYS A 28 17.688 42.221 -28.359 1.00 52.22 C ATOM 383 CE LYS A 28 17.059 43.520 -27.878 1.00 62.23 C ATOM 384 NZ LYS A 28 16.069 43.289 -26.790 1.00 1.14 N ATOM 0 H LYS A 28 20.919 44.219 -31.390 1.00 41.14 H new ATOM 0 HA LYS A 28 18.268 43.619 -32.171 1.00 14.55 H new ATOM 0 HB2 LYS A 28 19.817 42.247 -30.710 1.00 23.14 H new ATOM 0 HB3 LYS A 28 19.562 43.411 -29.424 1.00 23.14 H new ATOM 0 HG2 LYS A 28 16.976 42.659 -30.335 1.00 31.25 H new ATOM 0 HG3 LYS A 28 17.906 41.178 -30.221 1.00 31.25 H new ATOM 0 HD2 LYS A 28 17.067 41.379 -28.052 1.00 52.22 H new ATOM 0 HD3 LYS A 28 18.661 42.089 -27.885 1.00 52.22 H new ATOM 0 HE2 LYS A 28 17.840 44.191 -27.521 1.00 62.23 H new ATOM 0 HE3 LYS A 28 16.569 44.018 -28.715 1.00 62.23 H new ATOM 0 HZ1 LYS A 28 15.664 44.199 -26.491 1.00 1.14 H new ATOM 0 HZ2 LYS A 28 15.310 42.669 -27.137 1.00 1.14 H new ATOM 0 HZ3 LYS A 28 16.541 42.837 -25.981 1.00 1.14 H new ATOM 394 N GLN A 29 18.574 45.848 -29.736 1.00 74.34 N ATOM 395 CA GLN A 29 17.883 46.940 -29.060 1.00 62.43 C ATOM 396 C GLN A 29 17.614 48.093 -30.022 1.00 2.32 C ATOM 397 O GLN A 29 16.550 48.713 -29.983 1.00 25.55 O ATOM 398 CB GLN A 29 18.710 47.435 -27.871 1.00 70.33 C ATOM 399 CG GLN A 29 17.965 48.415 -26.979 1.00 5.31 C ATOM 400 CD GLN A 29 17.650 47.837 -25.613 1.00 55.32 C ATOM 401 OE1 GLN A 29 18.549 47.445 -24.870 1.00 3.21 O ATOM 402 NE2 GLN A 29 16.367 47.780 -25.276 1.00 40.33 N ATOM 0 H GLN A 29 19.516 45.666 -29.390 1.00 74.34 H new ATOM 0 HA GLN A 29 16.927 46.563 -28.698 1.00 62.43 H new ATOM 0 HB2 GLN A 29 19.022 46.578 -27.274 1.00 70.33 H new ATOM 0 HB3 GLN A 29 19.617 47.912 -28.243 1.00 70.33 H new ATOM 0 HG2 GLN A 29 18.564 49.318 -26.858 1.00 5.31 H new ATOM 0 HG3 GLN A 29 17.036 48.711 -27.467 1.00 5.31 H new ATOM 0 HE21 GLN A 29 15.654 48.117 -25.923 1.00 40.33 H new ATOM 0 HE22 GLN A 29 16.094 47.400 -24.370 1.00 40.33 H new ATOM 409 N LYS A 30 18.584 48.377 -30.884 1.00 24.41 N ATOM 410 CA LYS A 30 18.453 49.454 -31.857 1.00 62.21 C ATOM 411 C LYS A 30 17.429 49.095 -32.931 1.00 65.33 C ATOM 412 O LYS A 30 16.839 49.976 -33.557 1.00 15.45 O ATOM 413 CB LYS A 30 19.806 49.750 -32.507 1.00 64.33 C ATOM 414 CG LYS A 30 19.884 51.124 -33.151 1.00 51.51 C ATOM 415 CD LYS A 30 20.597 52.122 -32.253 1.00 60.40 C ATOM 416 CE LYS A 30 19.611 52.926 -31.421 1.00 52.22 C ATOM 417 NZ LYS A 30 20.210 53.380 -30.135 1.00 42.02 N ATOM 0 H LYS A 30 19.471 47.875 -30.928 1.00 24.41 H new ATOM 0 HA LYS A 30 18.107 50.344 -31.332 1.00 62.21 H new ATOM 0 HB2 LYS A 30 20.588 49.667 -31.752 1.00 64.33 H new ATOM 0 HB3 LYS A 30 20.010 48.992 -33.263 1.00 64.33 H new ATOM 0 HG2 LYS A 30 20.409 51.051 -34.104 1.00 51.51 H new ATOM 0 HG3 LYS A 30 18.878 51.483 -33.368 1.00 51.51 H new ATOM 0 HD2 LYS A 30 21.285 51.593 -31.593 1.00 60.40 H new ATOM 0 HD3 LYS A 30 21.197 52.798 -32.863 1.00 60.40 H new ATOM 0 HE2 LYS A 30 19.276 53.792 -31.992 1.00 52.22 H new ATOM 0 HE3 LYS A 30 18.729 52.319 -31.216 1.00 52.22 H new ATOM 0 HZ1 LYS A 30 19.506 53.925 -29.597 1.00 42.02 H new ATOM 0 HZ2 LYS A 30 20.506 52.553 -29.579 1.00 42.02 H new ATOM 0 HZ3 LYS A 30 21.037 53.980 -30.330 1.00 42.02 H new ATOM 427 N TYR A 31 17.225 47.799 -33.137 1.00 64.42 N ATOM 428 CA TYR A 31 16.275 47.326 -34.136 1.00 32.24 C ATOM 429 C TYR A 31 14.852 47.744 -33.776 1.00 22.34 C ATOM 430 O TYR A 31 14.119 48.271 -34.612 1.00 42.32 O ATOM 431 CB TYR A 31 16.353 45.803 -34.263 1.00 22.33 C ATOM 432 CG TYR A 31 15.002 45.133 -34.368 1.00 44.00 C ATOM 433 CD1 TYR A 31 14.321 45.084 -35.578 1.00 2.44 C ATOM 434 CD2 TYR A 31 14.405 44.552 -33.256 1.00 11.34 C ATOM 435 CE1 TYR A 31 13.086 44.474 -35.678 1.00 21.11 C ATOM 436 CE2 TYR A 31 13.170 43.938 -33.347 1.00 23.31 C ATOM 437 CZ TYR A 31 12.515 43.902 -34.560 1.00 13.22 C ATOM 438 OH TYR A 31 11.285 43.293 -34.654 1.00 73.43 O ATOM 0 H TYR A 31 17.704 47.058 -32.626 1.00 64.42 H new ATOM 0 HA TYR A 31 16.537 47.779 -35.092 1.00 32.24 H new ATOM 0 HB2 TYR A 31 16.944 45.550 -35.144 1.00 22.33 H new ATOM 0 HB3 TYR A 31 16.882 45.402 -33.399 1.00 22.33 H new ATOM 0 HD1 TYR A 31 14.765 45.531 -36.455 1.00 2.44 H new ATOM 0 HD2 TYR A 31 14.915 44.581 -32.304 1.00 11.34 H new ATOM 0 HE1 TYR A 31 12.570 44.445 -36.626 1.00 21.11 H new ATOM 0 HE2 TYR A 31 12.721 43.489 -32.473 1.00 23.31 H new ATOM 0 HH TYR A 31 11.404 42.321 -34.701 1.00 73.43 H new ATOM 447 N GLN A 32 14.471 47.505 -32.525 1.00 72.30 N ATOM 448 CA GLN A 32 13.137 47.857 -32.054 1.00 5.52 C ATOM 449 C GLN A 32 12.915 49.364 -32.123 1.00 24.43 C ATOM 450 O GLN A 32 11.829 49.827 -32.470 1.00 75.00 O ATOM 451 CB GLN A 32 12.934 47.365 -30.619 1.00 51.11 C ATOM 452 CG GLN A 32 11.484 47.399 -30.165 1.00 44.34 C ATOM 453 CD GLN A 32 11.038 46.093 -29.539 1.00 2.33 C ATOM 454 OE1 GLN A 32 10.391 45.269 -30.187 1.00 24.01 O ATOM 455 NE2 GLN A 32 11.381 45.894 -28.272 1.00 45.24 N ATOM 0 H GLN A 32 15.067 47.070 -31.821 1.00 72.30 H new ATOM 0 HA GLN A 32 12.410 47.371 -32.704 1.00 5.52 H new ATOM 0 HB2 GLN A 32 13.308 46.344 -30.537 1.00 51.11 H new ATOM 0 HB3 GLN A 32 13.532 47.979 -29.945 1.00 51.11 H new ATOM 0 HG2 GLN A 32 11.352 48.207 -29.445 1.00 44.34 H new ATOM 0 HG3 GLN A 32 10.845 47.625 -31.019 1.00 44.34 H new ATOM 0 HE21 GLN A 32 11.917 46.603 -27.772 1.00 45.24 H new ATOM 0 HE22 GLN A 32 11.108 45.032 -27.799 1.00 45.24 H new ATOM 462 N LYS A 33 13.952 50.126 -31.790 1.00 3.10 N ATOM 463 CA LYS A 33 13.872 51.581 -31.815 1.00 44.13 C ATOM 464 C LYS A 33 13.989 52.109 -33.241 1.00 24.23 C ATOM 465 O LYS A 33 13.580 53.233 -33.534 1.00 11.03 O ATOM 466 CB LYS A 33 14.974 52.188 -30.943 1.00 74.01 C ATOM 467 CG LYS A 33 14.838 53.689 -30.749 1.00 22.31 C ATOM 468 CD LYS A 33 14.516 54.037 -29.306 1.00 60.23 C ATOM 469 CE LYS A 33 13.136 53.537 -28.906 1.00 72.42 C ATOM 470 NZ LYS A 33 12.939 53.574 -27.431 1.00 0.44 N ATOM 0 H LYS A 33 14.858 49.759 -31.499 1.00 3.10 H new ATOM 0 HA LYS A 33 12.900 51.873 -31.417 1.00 44.13 H new ATOM 0 HB2 LYS A 33 14.963 51.701 -29.968 1.00 74.01 H new ATOM 0 HB3 LYS A 33 15.943 51.975 -31.395 1.00 74.01 H new ATOM 0 HG2 LYS A 33 15.765 54.181 -31.045 1.00 22.31 H new ATOM 0 HG3 LYS A 33 14.052 54.071 -31.401 1.00 22.31 H new ATOM 0 HD2 LYS A 33 15.267 53.599 -28.649 1.00 60.23 H new ATOM 0 HD3 LYS A 33 14.566 55.118 -29.172 1.00 60.23 H new ATOM 0 HE2 LYS A 33 12.374 54.148 -29.390 1.00 72.42 H new ATOM 0 HE3 LYS A 33 13.001 52.517 -29.265 1.00 72.42 H new ATOM 0 HZ1 LYS A 33 11.987 53.226 -27.199 1.00 0.44 H new ATOM 0 HZ2 LYS A 33 13.650 52.971 -26.971 1.00 0.44 H new ATOM 0 HZ3 LYS A 33 13.042 54.552 -27.091 1.00 0.44 H new ATOM 480 N LEU A 34 14.551 51.291 -34.125 1.00 12.13 N ATOM 481 CA LEU A 34 14.721 51.674 -35.522 1.00 42.12 C ATOM 482 C LEU A 34 13.474 51.339 -36.334 1.00 75.10 C ATOM 483 O LEU A 34 12.807 52.231 -36.861 1.00 10.21 O ATOM 484 CB LEU A 34 15.938 50.967 -36.121 1.00 54.11 C ATOM 485 CG LEU A 34 17.291 51.636 -35.877 1.00 54.53 C ATOM 486 CD1 LEU A 34 18.419 50.626 -36.013 1.00 42.42 C ATOM 487 CD2 LEU A 34 17.493 52.796 -36.840 1.00 72.55 C ATOM 0 H LEU A 34 14.897 50.358 -33.899 1.00 12.13 H new ATOM 0 HA LEU A 34 14.879 52.752 -35.561 1.00 42.12 H new ATOM 0 HB2 LEU A 34 15.979 49.954 -35.720 1.00 54.11 H new ATOM 0 HB3 LEU A 34 15.788 50.878 -37.197 1.00 54.11 H new ATOM 0 HG LEU A 34 17.303 52.027 -34.860 1.00 54.53 H new ATOM 0 HD11 LEU A 34 19.374 51.121 -35.836 1.00 42.42 H new ATOM 0 HD12 LEU A 34 18.283 49.828 -35.283 1.00 42.42 H new ATOM 0 HD13 LEU A 34 18.410 50.204 -37.018 1.00 42.42 H new ATOM 0 HD21 LEU A 34 18.461 53.261 -36.652 1.00 72.55 H new ATOM 0 HD22 LEU A 34 17.460 52.428 -37.865 1.00 72.55 H new ATOM 0 HD23 LEU A 34 16.703 53.532 -36.694 1.00 72.55 H new ATOM 498 N ILE A 35 13.163 50.051 -36.429 1.00 4.30 N ATOM 499 CA ILE A 35 11.995 49.600 -37.174 1.00 14.33 C ATOM 500 C ILE A 35 10.740 50.348 -36.734 1.00 34.44 C ATOM 501 O ILE A 35 9.832 50.582 -37.533 1.00 13.44 O ATOM 502 CB ILE A 35 11.764 48.087 -36.998 1.00 75.30 C ATOM 503 CG1 ILE A 35 11.426 47.766 -35.540 1.00 71.50 C ATOM 504 CG2 ILE A 35 12.992 47.309 -37.446 1.00 21.52 C ATOM 505 CD1 ILE A 35 9.948 47.555 -35.296 1.00 24.22 C ATOM 0 H ILE A 35 13.704 49.301 -35.999 1.00 4.30 H new ATOM 0 HA ILE A 35 12.191 49.810 -38.225 1.00 14.33 H new ATOM 0 HB ILE A 35 10.921 47.788 -37.621 1.00 75.30 H new ATOM 0 HG12 ILE A 35 11.968 46.869 -35.239 1.00 71.50 H new ATOM 0 HG13 ILE A 35 11.778 48.580 -34.906 1.00 71.50 H new ATOM 0 HG21 ILE A 35 12.814 46.242 -37.316 1.00 21.52 H new ATOM 0 HG22 ILE A 35 13.192 47.518 -38.497 1.00 21.52 H new ATOM 0 HG23 ILE A 35 13.852 47.609 -36.847 1.00 21.52 H new ATOM 0 HD11 ILE A 35 9.781 47.332 -34.242 1.00 24.22 H new ATOM 0 HD12 ILE A 35 9.402 48.459 -35.566 1.00 24.22 H new ATOM 0 HD13 ILE A 35 9.594 46.722 -35.904 1.00 24.22 H new ATOM 516 N LEU A 36 10.698 50.723 -35.461 1.00 41.25 N ATOM 517 CA LEU A 36 9.555 51.448 -34.914 1.00 22.35 C ATOM 518 C LEU A 36 9.529 52.887 -35.422 1.00 0.34 C ATOM 519 O LEU A 36 8.545 53.328 -36.014 1.00 32.00 O ATOM 520 CB LEU A 36 9.602 51.436 -33.386 1.00 24.23 C ATOM 521 CG LEU A 36 8.448 52.140 -32.673 1.00 1.42 C ATOM 522 CD1 LEU A 36 7.431 51.126 -32.172 1.00 41.30 C ATOM 523 CD2 LEU A 36 8.969 52.988 -31.522 1.00 45.24 C ATOM 0 H LEU A 36 11.441 50.538 -34.788 1.00 41.25 H new ATOM 0 HA LEU A 36 8.646 50.948 -35.247 1.00 22.35 H new ATOM 0 HB2 LEU A 36 9.630 50.399 -33.052 1.00 24.23 H new ATOM 0 HB3 LEU A 36 10.536 51.899 -33.068 1.00 24.23 H new ATOM 0 HG LEU A 36 7.953 52.798 -33.388 1.00 1.42 H new ATOM 0 HD11 LEU A 36 6.617 51.646 -31.667 1.00 41.30 H new ATOM 0 HD12 LEU A 36 7.033 50.562 -33.016 1.00 41.30 H new ATOM 0 HD13 LEU A 36 7.913 50.442 -31.473 1.00 41.30 H new ATOM 0 HD21 LEU A 36 8.133 53.482 -31.026 1.00 45.24 H new ATOM 0 HD22 LEU A 36 9.490 52.351 -30.807 1.00 45.24 H new ATOM 0 HD23 LEU A 36 9.658 53.740 -31.907 1.00 45.24 H new ATOM 534 N MET A 37 10.619 53.610 -35.188 1.00 75.24 N ATOM 535 CA MET A 37 10.721 54.999 -35.625 1.00 2.12 C ATOM 536 C MET A 37 10.587 55.102 -37.141 1.00 71.23 C ATOM 537 O MET A 37 10.153 56.128 -37.666 1.00 34.21 O ATOM 538 CB MET A 37 12.055 55.599 -35.177 1.00 75.32 C ATOM 539 CG MET A 37 12.277 57.020 -35.670 1.00 4.41 C ATOM 540 SD MET A 37 13.794 57.749 -35.023 1.00 44.33 S ATOM 541 CE MET A 37 13.128 58.991 -33.917 1.00 74.35 C ATOM 0 H MET A 37 11.443 53.259 -34.699 1.00 75.24 H new ATOM 0 HA MET A 37 9.906 55.560 -35.167 1.00 2.12 H new ATOM 0 HB2 MET A 37 12.101 55.589 -34.088 1.00 75.32 H new ATOM 0 HB3 MET A 37 12.867 54.967 -35.536 1.00 75.32 H new ATOM 0 HG2 MET A 37 12.314 57.021 -36.759 1.00 4.41 H new ATOM 0 HG3 MET A 37 11.428 57.639 -35.379 1.00 4.41 H new ATOM 0 HE1 MET A 37 13.947 59.529 -33.439 1.00 74.35 H new ATOM 0 HE2 MET A 37 12.515 59.692 -34.484 1.00 74.35 H new ATOM 0 HE3 MET A 37 12.517 58.509 -33.154 1.00 74.35 H new ATOM 549 N TYR A 38 10.961 54.036 -37.838 1.00 25.01 N ATOM 550 CA TYR A 38 10.886 54.008 -39.294 1.00 51.52 C ATOM 551 C TYR A 38 9.437 53.891 -39.761 1.00 64.42 C ATOM 552 O TYR A 38 9.068 54.419 -40.811 1.00 13.33 O ATOM 553 CB TYR A 38 11.707 52.843 -39.847 1.00 72.41 C ATOM 554 CG TYR A 38 11.873 52.878 -41.349 1.00 31.31 C ATOM 555 CD1 TYR A 38 12.675 53.837 -41.957 1.00 53.21 C ATOM 556 CD2 TYR A 38 11.228 51.954 -42.162 1.00 3.30 C ATOM 557 CE1 TYR A 38 12.829 53.874 -43.329 1.00 60.10 C ATOM 558 CE2 TYR A 38 11.379 51.982 -43.535 1.00 52.10 C ATOM 559 CZ TYR A 38 12.180 52.945 -44.114 1.00 10.54 C ATOM 560 OH TYR A 38 12.330 52.977 -45.481 1.00 13.31 O ATOM 0 H TYR A 38 11.320 53.178 -37.418 1.00 25.01 H new ATOM 0 HA TYR A 38 11.298 54.944 -39.672 1.00 51.52 H new ATOM 0 HB2 TYR A 38 12.692 52.850 -39.381 1.00 72.41 H new ATOM 0 HB3 TYR A 38 11.228 51.906 -39.565 1.00 72.41 H new ATOM 0 HD1 TYR A 38 13.187 54.566 -41.346 1.00 53.21 H new ATOM 0 HD2 TYR A 38 10.598 51.201 -41.713 1.00 3.30 H new ATOM 0 HE1 TYR A 38 13.455 54.627 -43.785 1.00 60.10 H new ATOM 0 HE2 TYR A 38 10.873 51.254 -44.152 1.00 52.10 H new ATOM 0 HH TYR A 38 11.807 52.253 -45.885 1.00 13.31 H new ATOM 569 N HIS A 39 8.623 53.196 -38.974 1.00 41.34 N ATOM 570 CA HIS A 39 7.215 53.010 -39.305 1.00 55.22 C ATOM 571 C HIS A 39 6.494 54.352 -39.387 1.00 74.34 C ATOM 572 O HIS A 39 6.956 55.367 -38.864 1.00 23.14 O ATOM 573 CB HIS A 39 6.538 52.118 -38.265 1.00 40.31 C ATOM 574 CG HIS A 39 6.278 50.724 -38.749 1.00 40.35 C ATOM 575 ND1 HIS A 39 5.024 50.152 -38.757 1.00 41.55 N ATOM 576 CD2 HIS A 39 7.120 49.788 -39.244 1.00 61.01 C ATOM 577 CE1 HIS A 39 5.106 48.923 -39.235 1.00 54.11 C ATOM 578 NE2 HIS A 39 6.368 48.679 -39.538 1.00 34.45 N ATOM 0 H HIS A 39 8.914 52.752 -38.103 1.00 41.34 H new ATOM 0 HA HIS A 39 7.158 52.526 -40.280 1.00 55.22 H new ATOM 0 HB2 HIS A 39 7.164 52.073 -37.374 1.00 40.31 H new ATOM 0 HB3 HIS A 39 5.593 52.573 -37.968 1.00 40.31 H new ATOM 0 HD1 HIS A 39 4.167 50.607 -38.443 1.00 41.55 H new ATOM 0 HD2 HIS A 39 8.186 49.894 -39.382 1.00 61.01 H new ATOM 0 HE1 HIS A 39 4.282 48.236 -39.357 1.00 54.11 H new ATOM 585 N PRO A 40 5.333 54.362 -40.061 1.00 22.34 N ATOM 586 CA PRO A 40 4.525 55.573 -40.228 1.00 30.43 C ATOM 587 C PRO A 40 3.883 56.026 -38.921 1.00 73.32 C ATOM 588 O PRO A 40 4.160 55.472 -37.858 1.00 42.13 O ATOM 589 CB PRO A 40 3.451 55.147 -41.232 1.00 33.42 C ATOM 590 CG PRO A 40 3.342 53.671 -41.067 1.00 3.25 C ATOM 591 CD PRO A 40 4.723 53.191 -40.711 1.00 34.22 C ATOM 0 HA PRO A 40 5.125 56.421 -40.559 1.00 30.43 H new ATOM 0 HB2 PRO A 40 2.500 55.639 -41.027 1.00 33.42 H new ATOM 0 HB3 PRO A 40 3.734 55.412 -42.251 1.00 33.42 H new ATOM 0 HG2 PRO A 40 2.627 53.418 -40.284 1.00 3.25 H new ATOM 0 HG3 PRO A 40 2.990 53.201 -41.985 1.00 3.25 H new ATOM 0 HD2 PRO A 40 4.690 52.332 -40.041 1.00 34.22 H new ATOM 0 HD3 PRO A 40 5.283 52.885 -41.595 1.00 34.22 H new ATOM 596 N ASP A 41 3.023 57.035 -39.009 1.00 10.44 N ATOM 597 CA ASP A 41 2.339 57.561 -37.833 1.00 33.11 C ATOM 598 C ASP A 41 0.826 57.426 -37.978 1.00 4.04 C ATOM 599 O ASP A 41 0.116 57.192 -37.000 1.00 65.43 O ATOM 600 CB ASP A 41 2.714 59.028 -37.613 1.00 13.43 C ATOM 601 CG ASP A 41 2.632 59.844 -38.888 1.00 50.21 C ATOM 602 OD1 ASP A 41 1.547 60.394 -39.172 1.00 64.22 O ATOM 603 OD2 ASP A 41 3.653 59.933 -39.600 1.00 73.34 O ATOM 0 H ASP A 41 2.783 57.505 -39.882 1.00 10.44 H new ATOM 0 HA ASP A 41 2.656 56.979 -36.968 1.00 33.11 H new ATOM 0 HB2 ASP A 41 2.051 59.461 -36.865 1.00 13.43 H new ATOM 0 HB3 ASP A 41 3.726 59.085 -37.213 1.00 13.43 H new ATOM 607 N LYS A 42 0.339 57.574 -39.205 1.00 74.41 N ATOM 608 CA LYS A 42 -1.089 57.469 -39.479 1.00 34.32 C ATOM 609 C LYS A 42 -1.360 56.417 -40.551 1.00 54.41 C ATOM 610 O LYS A 42 -0.542 56.204 -41.445 1.00 5.35 O ATOM 611 CB LYS A 42 -1.645 58.823 -39.927 1.00 24.40 C ATOM 612 CG LYS A 42 -2.228 59.646 -38.791 1.00 1.11 C ATOM 613 CD LYS A 42 -1.148 60.413 -38.047 1.00 51.43 C ATOM 614 CE LYS A 42 -1.708 61.110 -36.816 1.00 14.34 C ATOM 615 NZ LYS A 42 -2.439 62.357 -37.168 1.00 75.15 N ATOM 0 H LYS A 42 0.913 57.767 -40.026 1.00 74.41 H new ATOM 0 HA LYS A 42 -1.589 57.164 -38.559 1.00 34.32 H new ATOM 0 HB2 LYS A 42 -0.849 59.393 -40.406 1.00 24.40 H new ATOM 0 HB3 LYS A 42 -2.417 58.659 -40.679 1.00 24.40 H new ATOM 0 HG2 LYS A 42 -2.964 60.345 -39.188 1.00 1.11 H new ATOM 0 HG3 LYS A 42 -2.753 58.990 -38.097 1.00 1.11 H new ATOM 0 HD2 LYS A 42 -0.354 59.729 -37.749 1.00 51.43 H new ATOM 0 HD3 LYS A 42 -0.700 61.151 -38.712 1.00 51.43 H new ATOM 0 HE2 LYS A 42 -2.380 60.432 -36.289 1.00 14.34 H new ATOM 0 HE3 LYS A 42 -0.894 61.348 -36.132 1.00 14.34 H new ATOM 0 HZ1 LYS A 42 -2.805 62.801 -36.302 1.00 75.15 H new ATOM 0 HZ2 LYS A 42 -1.792 63.015 -37.648 1.00 75.15 H new ATOM 0 HZ3 LYS A 42 -3.232 62.128 -37.801 1.00 75.15 H new ATOM 625 N GLN A 43 -2.516 55.767 -40.455 1.00 33.44 N ATOM 626 CA GLN A 43 -2.894 54.738 -41.417 1.00 75.14 C ATOM 627 C GLN A 43 -4.407 54.547 -41.442 1.00 31.04 C ATOM 628 O GLN A 43 -5.142 55.241 -40.740 1.00 1.44 O ATOM 629 CB GLN A 43 -2.207 53.415 -41.079 1.00 21.13 C ATOM 630 CG GLN A 43 -2.648 52.822 -39.751 1.00 44.32 C ATOM 631 CD GLN A 43 -2.299 51.353 -39.621 1.00 34.34 C ATOM 632 OE1 GLN A 43 -1.299 50.890 -40.171 1.00 43.21 O ATOM 633 NE2 GLN A 43 -3.125 50.610 -38.894 1.00 22.35 N ATOM 0 H GLN A 43 -3.206 55.934 -39.722 1.00 33.44 H new ATOM 0 HA GLN A 43 -2.570 55.064 -42.405 1.00 75.14 H new ATOM 0 HB2 GLN A 43 -2.410 52.697 -41.873 1.00 21.13 H new ATOM 0 HB3 GLN A 43 -1.128 53.570 -41.058 1.00 21.13 H new ATOM 0 HG2 GLN A 43 -2.180 53.376 -38.937 1.00 44.32 H new ATOM 0 HG3 GLN A 43 -3.725 52.946 -39.642 1.00 44.32 H new ATOM 0 HE21 GLN A 43 -3.942 51.035 -38.456 1.00 22.35 H new ATOM 0 HE22 GLN A 43 -2.942 49.614 -38.773 1.00 22.35 H new ATOM 640 N SER A 44 -4.866 53.603 -42.258 1.00 2.55 N ATOM 641 CA SER A 44 -6.292 53.323 -42.377 1.00 0.11 C ATOM 642 C SER A 44 -7.048 54.554 -42.867 1.00 32.10 C ATOM 643 O SER A 44 -7.794 55.180 -42.114 1.00 44.55 O ATOM 644 CB SER A 44 -6.858 52.864 -41.032 1.00 41.22 C ATOM 645 OG SER A 44 -8.219 52.488 -41.152 1.00 72.03 O ATOM 0 H SER A 44 -4.271 53.020 -42.846 1.00 2.55 H new ATOM 0 HA SER A 44 -6.420 52.524 -43.108 1.00 0.11 H new ATOM 0 HB2 SER A 44 -6.277 52.021 -40.658 1.00 41.22 H new ATOM 0 HB3 SER A 44 -6.763 53.667 -40.301 1.00 41.22 H new ATOM 0 HG SER A 44 -8.556 52.197 -40.279 1.00 72.03 H new ATOM 650 N THR A 45 -6.849 54.896 -44.137 1.00 41.54 N ATOM 651 CA THR A 45 -7.510 56.053 -44.728 1.00 4.20 C ATOM 652 C THR A 45 -8.294 55.660 -45.975 1.00 72.12 C ATOM 653 O THR A 45 -9.504 55.870 -46.050 1.00 73.23 O ATOM 654 CB THR A 45 -6.494 57.151 -45.098 1.00 74.02 C ATOM 655 OG1 THR A 45 -5.523 56.631 -46.012 1.00 61.20 O ATOM 656 CG2 THR A 45 -5.797 57.685 -43.856 1.00 35.23 C ATOM 0 H THR A 45 -6.236 54.388 -44.775 1.00 41.54 H new ATOM 0 HA THR A 45 -8.198 56.443 -43.978 1.00 4.20 H new ATOM 0 HB THR A 45 -7.034 57.971 -45.571 1.00 74.02 H new ATOM 0 HG1 THR A 45 -4.882 57.335 -46.244 1.00 61.20 H new ATOM 0 HG21 THR A 45 -5.085 58.459 -44.143 1.00 35.23 H new ATOM 0 HG22 THR A 45 -6.537 58.107 -43.176 1.00 35.23 H new ATOM 0 HG23 THR A 45 -5.269 56.872 -43.357 1.00 35.23 H new ATOM 664 N ASP A 46 -7.596 55.088 -46.950 1.00 15.24 N ATOM 665 CA ASP A 46 -8.228 54.663 -48.194 1.00 34.10 C ATOM 666 C ASP A 46 -7.378 53.616 -48.906 1.00 61.44 C ATOM 667 O ASP A 46 -6.728 53.908 -49.911 1.00 40.33 O ATOM 668 CB ASP A 46 -8.455 55.865 -49.112 1.00 44.12 C ATOM 669 CG ASP A 46 -7.285 56.828 -49.104 1.00 21.13 C ATOM 670 OD1 ASP A 46 -6.171 56.412 -49.487 1.00 21.41 O ATOM 671 OD2 ASP A 46 -7.482 57.999 -48.717 1.00 2.24 O ATOM 0 H ASP A 46 -6.593 54.908 -46.903 1.00 15.24 H new ATOM 0 HA ASP A 46 -9.191 54.216 -47.949 1.00 34.10 H new ATOM 0 HB2 ASP A 46 -8.626 55.514 -50.130 1.00 44.12 H new ATOM 0 HB3 ASP A 46 -9.357 56.391 -48.800 1.00 44.12 H new ATOM 675 N VAL A 47 -7.385 52.396 -48.378 1.00 21.51 N ATOM 676 CA VAL A 47 -6.613 51.306 -48.963 1.00 32.31 C ATOM 677 C VAL A 47 -7.282 49.960 -48.709 1.00 55.34 C ATOM 678 O VAL A 47 -6.826 49.156 -47.895 1.00 54.21 O ATOM 679 CB VAL A 47 -5.180 51.269 -48.402 1.00 24.32 C ATOM 680 CG1 VAL A 47 -5.202 51.180 -46.884 1.00 52.32 C ATOM 681 CG2 VAL A 47 -4.404 50.104 -49.000 1.00 71.20 C ATOM 0 H VAL A 47 -7.916 52.138 -47.547 1.00 21.51 H new ATOM 0 HA VAL A 47 -6.570 51.490 -50.037 1.00 32.31 H new ATOM 0 HB VAL A 47 -4.676 52.194 -48.681 1.00 24.32 H new ATOM 0 HG11 VAL A 47 -4.180 51.155 -46.506 1.00 52.32 H new ATOM 0 HG12 VAL A 47 -5.718 52.049 -46.476 1.00 52.32 H new ATOM 0 HG13 VAL A 47 -5.723 50.272 -46.580 1.00 52.32 H new ATOM 0 HG21 VAL A 47 -3.393 50.093 -48.593 1.00 71.20 H new ATOM 0 HG22 VAL A 47 -4.905 49.168 -48.753 1.00 71.20 H new ATOM 0 HG23 VAL A 47 -4.357 50.216 -50.083 1.00 71.20 H new ATOM 691 N PRO A 48 -8.392 49.707 -49.419 1.00 71.21 N ATOM 692 CA PRO A 48 -9.148 48.458 -49.288 1.00 72.54 C ATOM 693 C PRO A 48 -8.392 47.260 -49.855 1.00 53.25 C ATOM 694 O PRO A 48 -7.873 47.313 -50.969 1.00 53.24 O ATOM 695 CB PRO A 48 -10.416 48.724 -50.102 1.00 51.12 C ATOM 696 CG PRO A 48 -10.020 49.764 -51.093 1.00 24.04 C ATOM 697 CD PRO A 48 -8.992 50.620 -50.406 1.00 13.35 C ATOM 0 HA PRO A 48 -9.340 48.205 -48.245 1.00 72.54 H new ATOM 0 HB2 PRO A 48 -10.766 47.818 -50.597 1.00 51.12 H new ATOM 0 HB3 PRO A 48 -11.229 49.073 -49.465 1.00 51.12 H new ATOM 0 HG2 PRO A 48 -9.609 49.308 -51.994 1.00 24.04 H new ATOM 0 HG3 PRO A 48 -10.881 50.358 -51.400 1.00 24.04 H new ATOM 0 HD2 PRO A 48 -8.249 50.997 -51.108 1.00 13.35 H new ATOM 0 HD3 PRO A 48 -9.446 51.487 -49.927 1.00 13.35 H new ATOM 702 N ALA A 49 -8.336 46.182 -49.081 1.00 63.02 N ATOM 703 CA ALA A 49 -7.646 44.971 -49.507 1.00 35.02 C ATOM 704 C ALA A 49 -6.134 45.154 -49.457 1.00 71.43 C ATOM 705 O ALA A 49 -5.439 44.465 -48.711 1.00 52.41 O ATOM 706 CB ALA A 49 -8.087 44.579 -50.909 1.00 33.42 C ATOM 0 H ALA A 49 -8.760 46.122 -48.155 1.00 63.02 H new ATOM 0 HA ALA A 49 -7.911 44.169 -48.817 1.00 35.02 H new ATOM 0 HB1 ALA A 49 -7.564 43.673 -51.215 1.00 33.42 H new ATOM 0 HB2 ALA A 49 -9.162 44.397 -50.915 1.00 33.42 H new ATOM 0 HB3 ALA A 49 -7.852 45.386 -51.603 1.00 33.42 H new ATOM 712 N GLY A 50 -5.628 46.087 -50.259 1.00 51.41 N ATOM 713 CA GLY A 50 -4.200 46.343 -50.290 1.00 70.31 C ATOM 714 C GLY A 50 -3.630 46.621 -48.914 1.00 21.31 C ATOM 715 O GLY A 50 -2.438 46.420 -48.674 1.00 32.13 O ATOM 0 H GLY A 50 -6.182 46.669 -50.887 1.00 51.41 H new ATOM 0 HA2 GLY A 50 -3.689 45.483 -50.724 1.00 70.31 H new ATOM 0 HA3 GLY A 50 -4.001 47.194 -50.941 1.00 70.31 H new ATOM 719 N THR A 51 -4.481 47.085 -48.005 1.00 50.03 N ATOM 720 CA THR A 51 -4.055 47.394 -46.646 1.00 41.11 C ATOM 721 C THR A 51 -3.264 46.239 -46.042 1.00 72.23 C ATOM 722 O THR A 51 -2.234 46.447 -45.400 1.00 34.31 O ATOM 723 CB THR A 51 -5.259 47.709 -45.737 1.00 3.44 C ATOM 724 OG1 THR A 51 -4.839 47.756 -44.369 1.00 51.30 O ATOM 725 CG2 THR A 51 -6.349 46.660 -45.902 1.00 64.10 C ATOM 0 H THR A 51 -5.470 47.255 -48.186 1.00 50.03 H new ATOM 0 HA THR A 51 -3.416 48.275 -46.708 1.00 41.11 H new ATOM 0 HB THR A 51 -5.663 48.679 -46.027 1.00 3.44 H new ATOM 0 HG1 THR A 51 -5.609 47.958 -43.797 1.00 51.30 H new ATOM 0 HG21 THR A 51 -7.189 46.903 -45.251 1.00 64.10 H new ATOM 0 HG22 THR A 51 -6.686 46.645 -46.939 1.00 64.10 H new ATOM 0 HG23 THR A 51 -5.954 45.680 -45.635 1.00 64.10 H new ATOM 733 N VAL A 52 -3.752 45.020 -46.251 1.00 73.51 N ATOM 734 CA VAL A 52 -3.090 43.832 -45.729 1.00 21.22 C ATOM 735 C VAL A 52 -1.943 43.399 -46.635 1.00 34.24 C ATOM 736 O VAL A 52 -0.863 43.049 -46.161 1.00 2.21 O ATOM 737 CB VAL A 52 -4.078 42.661 -45.574 1.00 35.34 C ATOM 738 CG1 VAL A 52 -3.414 41.491 -44.864 1.00 62.24 C ATOM 739 CG2 VAL A 52 -5.325 43.111 -44.827 1.00 21.43 C ATOM 0 H VAL A 52 -4.604 44.830 -46.779 1.00 73.51 H new ATOM 0 HA VAL A 52 -2.694 44.096 -44.748 1.00 21.22 H new ATOM 0 HB VAL A 52 -4.378 42.328 -46.568 1.00 35.34 H new ATOM 0 HG11 VAL A 52 -4.128 40.673 -44.764 1.00 62.24 H new ATOM 0 HG12 VAL A 52 -2.555 41.154 -45.444 1.00 62.24 H new ATOM 0 HG13 VAL A 52 -3.083 41.806 -43.875 1.00 62.24 H new ATOM 0 HG21 VAL A 52 -6.012 42.271 -44.727 1.00 21.43 H new ATOM 0 HG22 VAL A 52 -5.046 43.472 -43.837 1.00 21.43 H new ATOM 0 HG23 VAL A 52 -5.812 43.913 -45.382 1.00 21.43 H new ATOM 749 N GLU A 53 -2.186 43.425 -47.942 1.00 75.03 N ATOM 750 CA GLU A 53 -1.173 43.035 -48.915 1.00 31.15 C ATOM 751 C GLU A 53 0.110 43.836 -48.716 1.00 41.11 C ATOM 752 O GLU A 53 1.212 43.312 -48.876 1.00 22.24 O ATOM 753 CB GLU A 53 -1.697 43.236 -50.338 1.00 63.43 C ATOM 754 CG GLU A 53 -1.407 42.066 -51.264 1.00 72.35 C ATOM 755 CD GLU A 53 -2.592 41.709 -52.141 1.00 5.41 C ATOM 756 OE1 GLU A 53 -3.167 42.627 -52.763 1.00 23.14 O ATOM 757 OE2 GLU A 53 -2.944 40.512 -52.204 1.00 51.13 O ATOM 0 H GLU A 53 -3.075 43.712 -48.351 1.00 75.03 H new ATOM 0 HA GLU A 53 -0.949 41.979 -48.764 1.00 31.15 H new ATOM 0 HB2 GLU A 53 -2.774 43.400 -50.300 1.00 63.43 H new ATOM 0 HB3 GLU A 53 -1.252 44.139 -50.756 1.00 63.43 H new ATOM 0 HG2 GLU A 53 -0.553 42.310 -51.895 1.00 72.35 H new ATOM 0 HG3 GLU A 53 -1.125 41.197 -50.669 1.00 72.35 H new ATOM 762 N GLU A 54 -0.043 45.109 -48.364 1.00 25.43 N ATOM 763 CA GLU A 54 1.104 45.982 -48.145 1.00 63.15 C ATOM 764 C GLU A 54 1.608 45.868 -46.709 1.00 43.11 C ATOM 765 O GLU A 54 2.812 45.912 -46.457 1.00 25.12 O ATOM 766 CB GLU A 54 0.734 47.435 -48.453 1.00 42.43 C ATOM 767 CG GLU A 54 1.933 48.363 -48.543 1.00 41.04 C ATOM 768 CD GLU A 54 1.747 49.637 -47.740 1.00 20.44 C ATOM 769 OE1 GLU A 54 1.598 49.541 -46.504 1.00 20.32 O ATOM 770 OE2 GLU A 54 1.750 50.727 -48.349 1.00 44.10 O ATOM 0 H GLU A 54 -0.948 45.558 -48.225 1.00 25.43 H new ATOM 0 HA GLU A 54 1.901 45.667 -48.818 1.00 63.15 H new ATOM 0 HB2 GLU A 54 0.187 47.470 -49.395 1.00 42.43 H new ATOM 0 HB3 GLU A 54 0.059 47.801 -47.679 1.00 42.43 H new ATOM 0 HG2 GLU A 54 2.820 47.840 -48.187 1.00 41.04 H new ATOM 0 HG3 GLU A 54 2.112 48.619 -49.587 1.00 41.04 H new ATOM 775 N CYS A 55 0.677 45.723 -45.772 1.00 23.31 N ATOM 776 CA CYS A 55 1.027 45.603 -44.360 1.00 54.20 C ATOM 777 C CYS A 55 1.889 44.369 -44.116 1.00 13.32 C ATOM 778 O CYS A 55 3.017 44.472 -43.635 1.00 71.03 O ATOM 779 CB CYS A 55 -0.240 45.534 -43.505 1.00 32.44 C ATOM 780 SG CYS A 55 0.070 45.232 -41.749 1.00 21.55 S ATOM 0 H CYS A 55 -0.324 45.686 -45.964 1.00 23.31 H new ATOM 0 HA CYS A 55 1.601 46.485 -44.076 1.00 54.20 H new ATOM 0 HB2 CYS A 55 -0.788 46.470 -43.610 1.00 32.44 H new ATOM 0 HB3 CYS A 55 -0.883 44.743 -43.891 1.00 32.44 H new ATOM 0 HG CYS A 55 1.345 45.326 -41.511 1.00 21.55 H new ATOM 785 N VAL A 56 1.348 43.201 -44.449 1.00 23.10 N ATOM 786 CA VAL A 56 2.068 41.947 -44.264 1.00 14.34 C ATOM 787 C VAL A 56 3.406 41.967 -44.995 1.00 61.14 C ATOM 788 O VAL A 56 4.447 41.664 -44.411 1.00 35.31 O ATOM 789 CB VAL A 56 1.242 40.746 -44.765 1.00 75.41 C ATOM 790 CG1 VAL A 56 2.019 39.452 -44.586 1.00 15.34 C ATOM 791 CG2 VAL A 56 -0.095 40.682 -44.042 1.00 10.53 C ATOM 0 H VAL A 56 0.415 43.097 -44.848 1.00 23.10 H new ATOM 0 HA VAL A 56 2.243 41.839 -43.194 1.00 14.34 H new ATOM 0 HB VAL A 56 1.047 40.878 -45.829 1.00 75.41 H new ATOM 0 HG11 VAL A 56 1.420 38.615 -44.945 1.00 15.34 H new ATOM 0 HG12 VAL A 56 2.948 39.504 -45.154 1.00 15.34 H new ATOM 0 HG13 VAL A 56 2.247 39.308 -43.530 1.00 15.34 H new ATOM 0 HG21 VAL A 56 -0.666 39.828 -44.408 1.00 10.53 H new ATOM 0 HG22 VAL A 56 0.075 40.573 -42.971 1.00 10.53 H new ATOM 0 HG23 VAL A 56 -0.654 41.599 -44.229 1.00 10.53 H new ATOM 801 N GLN A 57 3.371 42.329 -46.273 1.00 52.45 N ATOM 802 CA GLN A 57 4.581 42.391 -47.083 1.00 22.33 C ATOM 803 C GLN A 57 5.645 43.252 -46.409 1.00 31.13 C ATOM 804 O GLN A 57 6.749 42.786 -46.126 1.00 73.31 O ATOM 805 CB GLN A 57 4.264 42.946 -48.472 1.00 14.45 C ATOM 806 CG GLN A 57 5.362 42.695 -49.493 1.00 72.24 C ATOM 807 CD GLN A 57 4.849 42.014 -50.746 1.00 24.31 C ATOM 808 OE1 GLN A 57 3.702 42.209 -51.148 1.00 52.50 O ATOM 809 NE2 GLN A 57 5.699 41.207 -51.372 1.00 41.33 N ATOM 0 H GLN A 57 2.517 42.584 -46.770 1.00 52.45 H new ATOM 0 HA GLN A 57 4.970 41.378 -47.185 1.00 22.33 H new ATOM 0 HB2 GLN A 57 3.337 42.498 -48.830 1.00 14.45 H new ATOM 0 HB3 GLN A 57 4.090 44.019 -48.394 1.00 14.45 H new ATOM 0 HG2 GLN A 57 5.825 43.644 -49.764 1.00 72.24 H new ATOM 0 HG3 GLN A 57 6.139 42.078 -49.041 1.00 72.24 H new ATOM 0 HE21 GLN A 57 6.641 41.074 -51.004 1.00 41.33 H new ATOM 0 HE22 GLN A 57 5.410 40.721 -52.221 1.00 41.33 H new ATOM 816 N LYS A 58 5.304 44.510 -46.154 1.00 23.01 N ATOM 817 CA LYS A 58 6.228 45.438 -45.512 1.00 4.24 C ATOM 818 C LYS A 58 6.692 44.898 -44.163 1.00 1.44 C ATOM 819 O LYS A 58 7.876 44.959 -43.832 1.00 0.23 O ATOM 820 CB LYS A 58 5.565 46.804 -45.326 1.00 52.13 C ATOM 821 CG LYS A 58 5.387 47.576 -46.621 1.00 31.32 C ATOM 822 CD LYS A 58 6.523 48.561 -46.844 1.00 52.11 C ATOM 823 CE LYS A 58 6.423 49.750 -45.901 1.00 3.54 C ATOM 824 NZ LYS A 58 5.920 50.968 -46.594 1.00 3.23 N ATOM 0 H LYS A 58 4.394 44.911 -46.382 1.00 23.01 H new ATOM 0 HA LYS A 58 7.099 45.549 -46.158 1.00 4.24 H new ATOM 0 HB2 LYS A 58 4.590 46.664 -44.859 1.00 52.13 H new ATOM 0 HB3 LYS A 58 6.165 47.399 -44.638 1.00 52.13 H new ATOM 0 HG2 LYS A 58 5.339 46.879 -47.458 1.00 31.32 H new ATOM 0 HG3 LYS A 58 4.438 48.112 -46.598 1.00 31.32 H new ATOM 0 HD2 LYS A 58 7.478 48.057 -46.695 1.00 52.11 H new ATOM 0 HD3 LYS A 58 6.505 48.911 -47.876 1.00 52.11 H new ATOM 0 HE2 LYS A 58 5.758 49.502 -45.074 1.00 3.54 H new ATOM 0 HE3 LYS A 58 7.403 49.956 -45.471 1.00 3.54 H new ATOM 0 HZ1 LYS A 58 5.866 51.756 -45.917 1.00 3.23 H new ATOM 0 HZ2 LYS A 58 6.568 51.220 -47.367 1.00 3.23 H new ATOM 0 HZ3 LYS A 58 4.974 50.781 -46.982 1.00 3.23 H new ATOM 834 N PHE A 59 5.750 44.368 -43.387 1.00 65.54 N ATOM 835 CA PHE A 59 6.063 43.817 -42.074 1.00 50.22 C ATOM 836 C PHE A 59 7.207 42.811 -42.164 1.00 71.43 C ATOM 837 O PHE A 59 8.033 42.711 -41.257 1.00 4.31 O ATOM 838 CB PHE A 59 4.827 43.147 -41.472 1.00 52.12 C ATOM 839 CG PHE A 59 4.173 43.957 -40.390 1.00 40.34 C ATOM 840 CD1 PHE A 59 3.594 45.183 -40.677 1.00 61.02 C ATOM 841 CD2 PHE A 59 4.138 43.494 -39.084 1.00 61.42 C ATOM 842 CE1 PHE A 59 2.992 45.931 -39.684 1.00 50.23 C ATOM 843 CE2 PHE A 59 3.536 44.238 -38.086 1.00 21.23 C ATOM 844 CZ PHE A 59 2.964 45.458 -38.386 1.00 72.21 C ATOM 0 H PHE A 59 4.765 44.309 -43.645 1.00 65.54 H new ATOM 0 HA PHE A 59 6.375 44.638 -41.428 1.00 50.22 H new ATOM 0 HB2 PHE A 59 4.102 42.962 -42.264 1.00 52.12 H new ATOM 0 HB3 PHE A 59 5.111 42.176 -41.066 1.00 52.12 H new ATOM 0 HD1 PHE A 59 3.614 45.558 -41.690 1.00 61.02 H new ATOM 0 HD2 PHE A 59 4.586 42.541 -38.843 1.00 61.42 H new ATOM 0 HE1 PHE A 59 2.544 46.884 -39.922 1.00 50.23 H new ATOM 0 HE2 PHE A 59 3.513 43.865 -37.073 1.00 21.23 H new ATOM 0 HZ PHE A 59 2.495 46.042 -37.608 1.00 72.21 H new ATOM 853 N ILE A 60 7.248 42.068 -43.266 1.00 45.14 N ATOM 854 CA ILE A 60 8.291 41.071 -43.475 1.00 0.52 C ATOM 855 C ILE A 60 9.662 41.726 -43.596 1.00 73.52 C ATOM 856 O ILE A 60 10.602 41.357 -42.893 1.00 0.55 O ATOM 857 CB ILE A 60 8.022 40.232 -44.739 1.00 54.32 C ATOM 858 CG1 ILE A 60 6.681 39.505 -44.618 1.00 31.05 C ATOM 859 CG2 ILE A 60 9.151 39.239 -44.965 1.00 34.23 C ATOM 860 CD1 ILE A 60 5.964 39.336 -45.939 1.00 52.42 C ATOM 0 H ILE A 60 6.572 42.138 -44.027 1.00 45.14 H new ATOM 0 HA ILE A 60 8.280 40.416 -42.604 1.00 0.52 H new ATOM 0 HB ILE A 60 7.975 40.900 -45.599 1.00 54.32 H new ATOM 0 HG12 ILE A 60 6.848 38.523 -44.176 1.00 31.05 H new ATOM 0 HG13 ILE A 60 6.038 40.057 -43.933 1.00 31.05 H new ATOM 0 HG21 ILE A 60 8.947 38.654 -45.861 1.00 34.23 H new ATOM 0 HG22 ILE A 60 10.090 39.778 -45.090 1.00 34.23 H new ATOM 0 HG23 ILE A 60 9.227 38.572 -44.106 1.00 34.23 H new ATOM 0 HD11 ILE A 60 5.022 38.813 -45.777 1.00 52.42 H new ATOM 0 HD12 ILE A 60 5.765 40.316 -46.373 1.00 52.42 H new ATOM 0 HD13 ILE A 60 6.588 38.757 -46.620 1.00 52.42 H new ATOM 871 N GLU A 61 9.768 42.702 -44.492 1.00 64.30 N ATOM 872 CA GLU A 61 11.025 43.410 -44.704 1.00 60.34 C ATOM 873 C GLU A 61 11.597 43.913 -43.382 1.00 1.22 C ATOM 874 O GLU A 61 12.813 43.982 -43.205 1.00 62.32 O ATOM 875 CB GLU A 61 10.820 44.585 -45.663 1.00 12.30 C ATOM 876 CG GLU A 61 11.788 44.591 -46.835 1.00 12.42 C ATOM 877 CD GLU A 61 11.165 45.142 -48.104 1.00 43.45 C ATOM 878 OE1 GLU A 61 10.123 44.605 -48.533 1.00 33.20 O ATOM 879 OE2 GLU A 61 11.719 46.109 -48.665 1.00 53.24 O ATOM 0 H GLU A 61 8.999 43.020 -45.082 1.00 64.30 H new ATOM 0 HA GLU A 61 11.735 42.710 -45.145 1.00 60.34 H new ATOM 0 HB2 GLU A 61 9.800 44.557 -46.046 1.00 12.30 H new ATOM 0 HB3 GLU A 61 10.927 45.518 -45.109 1.00 12.30 H new ATOM 0 HG2 GLU A 61 12.663 45.187 -46.576 1.00 12.42 H new ATOM 0 HG3 GLU A 61 12.138 43.575 -47.018 1.00 12.42 H new ATOM 884 N ILE A 62 10.710 44.263 -42.456 1.00 60.44 N ATOM 885 CA ILE A 62 11.126 44.759 -41.150 1.00 53.04 C ATOM 886 C ILE A 62 11.933 43.710 -40.395 1.00 15.33 C ATOM 887 O ILE A 62 13.119 43.898 -40.126 1.00 44.51 O ATOM 888 CB ILE A 62 9.914 45.174 -40.295 1.00 4.53 C ATOM 889 CG1 ILE A 62 9.125 46.283 -40.992 1.00 53.32 C ATOM 890 CG2 ILE A 62 10.371 45.627 -38.915 1.00 74.25 C ATOM 891 CD1 ILE A 62 9.904 47.570 -41.152 1.00 2.03 C ATOM 0 H ILE A 62 9.700 44.212 -42.586 1.00 60.44 H new ATOM 0 HA ILE A 62 11.751 45.634 -41.328 1.00 53.04 H new ATOM 0 HB ILE A 62 9.260 44.311 -40.175 1.00 4.53 H new ATOM 0 HG12 ILE A 62 8.812 45.932 -41.976 1.00 53.32 H new ATOM 0 HG13 ILE A 62 8.218 46.485 -40.423 1.00 53.32 H new ATOM 0 HG21 ILE A 62 9.504 45.917 -38.322 1.00 74.25 H new ATOM 0 HG22 ILE A 62 10.893 44.809 -38.418 1.00 74.25 H new ATOM 0 HG23 ILE A 62 11.043 46.479 -39.016 1.00 74.25 H new ATOM 0 HD11 ILE A 62 9.282 48.311 -41.654 1.00 2.03 H new ATOM 0 HD12 ILE A 62 10.194 47.944 -40.170 1.00 2.03 H new ATOM 0 HD13 ILE A 62 10.798 47.383 -41.747 1.00 2.03 H new ATOM 902 N ASP A 63 11.281 42.601 -40.056 1.00 72.55 N ATOM 903 CA ASP A 63 11.939 41.519 -39.334 1.00 1.42 C ATOM 904 C ASP A 63 13.123 40.976 -40.128 1.00 34.04 C ATOM 905 O ASP A 63 14.059 40.416 -39.558 1.00 70.24 O ATOM 906 CB ASP A 63 10.944 40.393 -39.044 1.00 61.15 C ATOM 907 CG ASP A 63 9.971 40.751 -37.938 1.00 61.01 C ATOM 908 OD1 ASP A 63 10.431 41.193 -36.863 1.00 33.41 O ATOM 909 OD2 ASP A 63 8.751 40.590 -38.146 1.00 63.20 O ATOM 0 H ASP A 63 10.299 42.429 -40.270 1.00 72.55 H new ATOM 0 HA ASP A 63 12.311 41.918 -38.390 1.00 1.42 H new ATOM 0 HB2 ASP A 63 10.388 40.161 -39.952 1.00 61.15 H new ATOM 0 HB3 ASP A 63 11.490 39.492 -38.766 1.00 61.15 H new ATOM 913 N GLN A 64 13.073 41.146 -41.446 1.00 43.41 N ATOM 914 CA GLN A 64 14.141 40.670 -42.317 1.00 72.55 C ATOM 915 C GLN A 64 15.496 41.194 -41.853 1.00 43.54 C ATOM 916 O GLN A 64 16.341 40.431 -41.388 1.00 4.20 O ATOM 917 CB GLN A 64 13.881 41.105 -43.760 1.00 20.53 C ATOM 918 CG GLN A 64 13.719 39.942 -44.726 1.00 54.12 C ATOM 919 CD GLN A 64 12.759 38.886 -44.211 1.00 63.55 C ATOM 920 OE1 GLN A 64 11.904 39.165 -43.372 1.00 42.21 O ATOM 921 NE2 GLN A 64 12.899 37.665 -44.714 1.00 53.43 N ATOM 0 H GLN A 64 12.306 41.609 -41.933 1.00 43.41 H new ATOM 0 HA GLN A 64 14.157 39.581 -42.269 1.00 72.55 H new ATOM 0 HB2 GLN A 64 12.981 41.719 -43.789 1.00 20.53 H new ATOM 0 HB3 GLN A 64 14.706 41.733 -44.096 1.00 20.53 H new ATOM 0 HG2 GLN A 64 13.360 40.318 -45.684 1.00 54.12 H new ATOM 0 HG3 GLN A 64 14.692 39.486 -44.907 1.00 54.12 H new ATOM 0 HE21 GLN A 64 13.623 37.479 -45.408 1.00 53.43 H new ATOM 0 HE22 GLN A 64 12.283 36.913 -44.406 1.00 53.43 H new ATOM 928 N ALA A 65 15.695 42.503 -41.981 1.00 24.45 N ATOM 929 CA ALA A 65 16.947 43.128 -41.573 1.00 62.55 C ATOM 930 C ALA A 65 17.311 42.745 -40.142 1.00 70.43 C ATOM 931 O ALA A 65 18.480 42.522 -39.829 1.00 22.01 O ATOM 932 CB ALA A 65 16.850 44.641 -41.709 1.00 14.53 C ATOM 0 H ALA A 65 15.005 43.150 -42.364 1.00 24.45 H new ATOM 0 HA ALA A 65 17.737 42.765 -42.230 1.00 62.55 H new ATOM 0 HB1 ALA A 65 17.792 45.095 -41.401 1.00 14.53 H new ATOM 0 HB2 ALA A 65 16.645 44.901 -42.748 1.00 14.53 H new ATOM 0 HB3 ALA A 65 16.044 45.012 -41.076 1.00 14.53 H new ATOM 938 N TRP A 66 16.303 42.674 -39.280 1.00 21.12 N ATOM 939 CA TRP A 66 16.519 42.319 -37.882 1.00 10.11 C ATOM 940 C TRP A 66 17.282 41.003 -37.765 1.00 75.24 C ATOM 941 O TRP A 66 17.961 40.755 -36.769 1.00 20.43 O ATOM 942 CB TRP A 66 15.180 42.214 -37.150 1.00 43.12 C ATOM 943 CG TRP A 66 15.326 41.955 -35.680 1.00 55.33 C ATOM 944 CD1 TRP A 66 16.385 42.299 -34.889 1.00 12.35 C ATOM 945 CD2 TRP A 66 14.381 41.298 -34.828 1.00 23.42 C ATOM 946 NE1 TRP A 66 16.156 41.893 -33.595 1.00 34.20 N ATOM 947 CE2 TRP A 66 14.933 41.278 -33.532 1.00 24.40 C ATOM 948 CE3 TRP A 66 13.123 40.726 -35.033 1.00 73.15 C ATOM 949 CZ2 TRP A 66 14.270 40.708 -32.449 1.00 33.54 C ATOM 950 CZ3 TRP A 66 12.466 40.160 -33.957 1.00 32.40 C ATOM 951 CH2 TRP A 66 13.039 40.155 -32.678 1.00 22.21 C ATOM 0 H TRP A 66 15.330 42.857 -39.524 1.00 21.12 H new ATOM 0 HA TRP A 66 17.117 43.105 -37.421 1.00 10.11 H new ATOM 0 HB2 TRP A 66 14.621 43.138 -37.295 1.00 43.12 H new ATOM 0 HB3 TRP A 66 14.592 41.412 -37.596 1.00 43.12 H new ATOM 0 HD1 TRP A 66 17.271 42.814 -35.229 1.00 12.35 H new ATOM 0 HE1 TRP A 66 16.793 42.028 -32.810 1.00 34.20 H new ATOM 0 HE3 TRP A 66 12.672 40.726 -36.014 1.00 73.15 H new ATOM 0 HZ2 TRP A 66 14.711 40.702 -31.463 1.00 33.54 H new ATOM 0 HZ3 TRP A 66 11.494 39.714 -34.104 1.00 32.40 H new ATOM 0 HH2 TRP A 66 12.499 39.706 -31.857 1.00 22.21 H new ATOM 961 N LYS A 67 17.164 40.164 -38.788 1.00 42.12 N ATOM 962 CA LYS A 67 17.843 38.875 -38.801 1.00 4.13 C ATOM 963 C LYS A 67 19.127 38.944 -39.623 1.00 1.12 C ATOM 964 O LYS A 67 20.226 38.810 -39.086 1.00 31.50 O ATOM 965 CB LYS A 67 16.920 37.793 -39.368 1.00 42.05 C ATOM 966 CG LYS A 67 16.337 36.875 -38.309 1.00 42.31 C ATOM 967 CD LYS A 67 14.825 37.003 -38.230 1.00 43.10 C ATOM 968 CE LYS A 67 14.408 38.076 -37.235 1.00 22.21 C ATOM 969 NZ LYS A 67 13.023 37.858 -36.733 1.00 54.11 N ATOM 0 H LYS A 67 16.604 40.354 -39.619 1.00 42.12 H new ATOM 0 HA LYS A 67 18.103 38.620 -37.774 1.00 4.13 H new ATOM 0 HB2 LYS A 67 16.105 38.271 -39.911 1.00 42.05 H new ATOM 0 HB3 LYS A 67 17.476 37.194 -40.089 1.00 42.05 H new ATOM 0 HG2 LYS A 67 16.604 35.843 -38.534 1.00 42.31 H new ATOM 0 HG3 LYS A 67 16.774 37.113 -37.339 1.00 42.31 H new ATOM 0 HD2 LYS A 67 14.427 37.245 -39.216 1.00 43.10 H new ATOM 0 HD3 LYS A 67 14.392 36.046 -37.938 1.00 43.10 H new ATOM 0 HE2 LYS A 67 15.102 38.082 -36.395 1.00 22.21 H new ATOM 0 HE3 LYS A 67 14.473 39.056 -37.709 1.00 22.21 H new ATOM 0 HZ1 LYS A 67 12.758 38.637 -36.097 1.00 54.11 H new ATOM 0 HZ2 LYS A 67 12.363 37.827 -37.536 1.00 54.11 H new ATOM 0 HZ3 LYS A 67 12.979 36.958 -36.214 1.00 54.11 H new ATOM 979 N ILE A 68 18.978 39.155 -40.927 1.00 21.02 N ATOM 980 CA ILE A 68 20.125 39.244 -41.821 1.00 2.24 C ATOM 981 C ILE A 68 20.575 40.690 -41.995 1.00 44.34 C ATOM 982 O ILE A 68 20.788 41.157 -43.115 1.00 0.23 O ATOM 983 CB ILE A 68 19.809 38.647 -43.205 1.00 51.33 C ATOM 984 CG1 ILE A 68 18.374 38.988 -43.615 1.00 1.31 C ATOM 985 CG2 ILE A 68 20.019 37.141 -43.193 1.00 11.30 C ATOM 986 CD1 ILE A 68 18.090 40.472 -43.644 1.00 72.23 C ATOM 0 H ILE A 68 18.075 39.267 -41.387 1.00 21.02 H new ATOM 0 HA ILE A 68 20.928 38.668 -41.361 1.00 2.24 H new ATOM 0 HB ILE A 68 20.490 39.082 -43.937 1.00 51.33 H new ATOM 0 HG12 ILE A 68 18.178 38.570 -44.602 1.00 1.31 H new ATOM 0 HG13 ILE A 68 17.683 38.508 -42.922 1.00 1.31 H new ATOM 0 HG21 ILE A 68 19.792 36.734 -44.178 1.00 11.30 H new ATOM 0 HG22 ILE A 68 21.056 36.920 -42.940 1.00 11.30 H new ATOM 0 HG23 ILE A 68 19.360 36.688 -42.452 1.00 11.30 H new ATOM 0 HD11 ILE A 68 17.055 40.639 -43.943 1.00 72.23 H new ATOM 0 HD12 ILE A 68 18.254 40.893 -42.652 1.00 72.23 H new ATOM 0 HD13 ILE A 68 18.756 40.956 -44.358 1.00 72.23 H new ATOM 997 N LEU A 69 20.721 41.397 -40.879 1.00 75.01 N ATOM 998 CA LEU A 69 21.148 42.792 -40.907 1.00 25.53 C ATOM 999 C LEU A 69 22.370 42.969 -41.803 1.00 34.33 C ATOM 1000 O LEU A 69 22.532 44.003 -42.451 1.00 1.24 O ATOM 1001 CB LEU A 69 21.466 43.277 -39.491 1.00 2.54 C ATOM 1002 CG LEU A 69 21.853 44.749 -39.358 1.00 40.35 C ATOM 1003 CD1 LEU A 69 23.315 44.953 -39.719 1.00 5.34 C ATOM 1004 CD2 LEU A 69 20.960 45.617 -40.232 1.00 53.42 C ATOM 0 H LEU A 69 20.550 41.027 -39.944 1.00 75.01 H new ATOM 0 HA LEU A 69 20.332 43.388 -41.314 1.00 25.53 H new ATOM 0 HB2 LEU A 69 20.596 43.092 -38.861 1.00 2.54 H new ATOM 0 HB3 LEU A 69 22.281 42.671 -39.095 1.00 2.54 H new ATOM 0 HG LEU A 69 21.712 45.048 -38.319 1.00 40.35 H new ATOM 0 HD11 LEU A 69 23.571 46.008 -39.618 1.00 5.34 H new ATOM 0 HD12 LEU A 69 23.941 44.362 -39.050 1.00 5.34 H new ATOM 0 HD13 LEU A 69 23.483 44.636 -40.748 1.00 5.34 H new ATOM 0 HD21 LEU A 69 21.250 46.662 -40.124 1.00 53.42 H new ATOM 0 HD22 LEU A 69 21.068 45.316 -41.274 1.00 53.42 H new ATOM 0 HD23 LEU A 69 19.921 45.496 -39.925 1.00 53.42 H new ATOM 1015 N GLY A 70 23.225 41.952 -41.837 1.00 64.03 N ATOM 1016 CA GLY A 70 24.420 42.016 -42.659 1.00 25.14 C ATOM 1017 C GLY A 70 24.369 41.055 -43.830 1.00 60.53 C ATOM 1018 O GLY A 70 24.163 41.467 -44.971 1.00 64.33 O ATOM 0 H GLY A 70 23.112 41.086 -41.311 1.00 64.03 H new ATOM 0 HA2 GLY A 70 24.547 43.032 -43.032 1.00 25.14 H new ATOM 0 HA3 GLY A 70 25.292 41.790 -42.045 1.00 25.14 H new ATOM 1022 N ASN A 71 24.558 39.770 -43.549 1.00 60.11 N ATOM 1023 CA ASN A 71 24.535 38.748 -44.589 1.00 34.33 C ATOM 1024 C ASN A 71 23.832 37.487 -44.097 1.00 12.23 C ATOM 1025 O ASN A 71 23.380 37.422 -42.954 1.00 54.04 O ATOM 1026 CB ASN A 71 25.959 38.411 -45.034 1.00 10.53 C ATOM 1027 CG ASN A 71 26.907 38.248 -43.862 1.00 0.11 C ATOM 1028 OD1 ASN A 71 26.484 37.960 -42.743 1.00 42.41 O ATOM 1029 ND2 ASN A 71 28.197 38.433 -44.115 1.00 5.32 N ATOM 0 H ASN A 71 24.729 39.412 -42.609 1.00 60.11 H new ATOM 0 HA ASN A 71 23.980 39.143 -45.440 1.00 34.33 H new ATOM 0 HB2 ASN A 71 25.946 37.491 -45.618 1.00 10.53 H new ATOM 0 HB3 ASN A 71 26.328 39.200 -45.690 1.00 10.53 H new ATOM 0 HD21 ASN A 71 28.882 38.337 -43.366 1.00 5.32 H new ATOM 0 HD22 ASN A 71 28.503 38.671 -45.059 1.00 5.32 H new ATOM 1035 N GLU A 72 23.743 36.486 -44.969 1.00 42.45 N ATOM 1036 CA GLU A 72 23.095 35.227 -44.622 1.00 72.41 C ATOM 1037 C GLU A 72 23.780 34.574 -43.426 1.00 51.41 C ATOM 1038 O GLU A 72 23.188 33.745 -42.736 1.00 11.45 O ATOM 1039 CB GLU A 72 23.113 34.272 -45.818 1.00 75.05 C ATOM 1040 CG GLU A 72 22.131 34.652 -46.914 1.00 12.45 C ATOM 1041 CD GLU A 72 22.365 33.880 -48.199 1.00 52.55 C ATOM 1042 OE1 GLU A 72 23.282 34.254 -48.958 1.00 61.24 O ATOM 1043 OE2 GLU A 72 21.629 32.901 -48.443 1.00 75.33 O ATOM 0 H GLU A 72 24.111 36.523 -45.919 1.00 42.45 H new ATOM 0 HA GLU A 72 22.061 35.442 -44.353 1.00 72.41 H new ATOM 0 HB2 GLU A 72 24.119 34.246 -46.236 1.00 75.05 H new ATOM 0 HB3 GLU A 72 22.885 33.264 -45.471 1.00 75.05 H new ATOM 0 HG2 GLU A 72 21.114 34.470 -46.565 1.00 12.45 H new ATOM 0 HG3 GLU A 72 22.213 35.720 -47.116 1.00 12.45 H new ATOM 1048 N GLU A 73 25.031 34.954 -43.187 1.00 20.45 N ATOM 1049 CA GLU A 73 25.797 34.404 -42.075 1.00 50.04 C ATOM 1050 C GLU A 73 25.444 35.110 -40.769 1.00 43.21 C ATOM 1051 O GLU A 73 25.772 34.632 -39.682 1.00 40.13 O ATOM 1052 CB GLU A 73 27.297 34.532 -42.347 1.00 20.53 C ATOM 1053 CG GLU A 73 27.703 34.086 -43.743 1.00 44.15 C ATOM 1054 CD GLU A 73 29.192 34.231 -43.991 1.00 52.12 C ATOM 1055 OE1 GLU A 73 29.895 34.751 -43.100 1.00 41.12 O ATOM 1056 OE2 GLU A 73 29.653 33.825 -45.078 1.00 60.40 O ATOM 0 H GLU A 73 25.535 35.640 -43.748 1.00 20.45 H new ATOM 0 HA GLU A 73 25.541 33.349 -41.978 1.00 50.04 H new ATOM 0 HB2 GLU A 73 27.596 35.571 -42.205 1.00 20.53 H new ATOM 0 HB3 GLU A 73 27.843 33.940 -41.612 1.00 20.53 H new ATOM 0 HG2 GLU A 73 27.414 33.045 -43.886 1.00 44.15 H new ATOM 0 HG3 GLU A 73 27.157 34.673 -44.481 1.00 44.15 H new ATOM 1127 N TYR A 78 21.809 31.151 -42.353 1.00 33.10 N ATOM 1128 CA TYR A 78 22.886 30.334 -41.807 1.00 54.34 C ATOM 1129 C TYR A 78 22.416 29.566 -40.575 1.00 24.42 C ATOM 1130 O TYR A 78 22.709 28.380 -40.420 1.00 30.42 O ATOM 1131 CB TYR A 78 24.087 31.211 -41.448 1.00 13.22 C ATOM 1132 CG TYR A 78 25.295 30.425 -40.991 1.00 1.31 C ATOM 1133 CD1 TYR A 78 25.764 29.344 -41.728 1.00 41.40 C ATOM 1134 CD2 TYR A 78 25.967 30.761 -39.823 1.00 70.25 C ATOM 1135 CE1 TYR A 78 26.867 28.622 -41.315 1.00 41.53 C ATOM 1136 CE2 TYR A 78 27.071 30.047 -39.402 1.00 3.02 C ATOM 1137 CZ TYR A 78 27.518 28.978 -40.151 1.00 72.10 C ATOM 1138 OH TYR A 78 28.617 28.263 -39.735 1.00 43.41 O ATOM 0 HA TYR A 78 23.185 29.614 -42.569 1.00 54.34 H new ATOM 0 HB2 TYR A 78 24.361 31.810 -42.316 1.00 13.22 H new ATOM 0 HB3 TYR A 78 23.796 31.906 -40.660 1.00 13.22 H new ATOM 0 HD1 TYR A 78 25.257 29.064 -42.640 1.00 41.40 H new ATOM 0 HD2 TYR A 78 25.619 31.596 -39.233 1.00 70.25 H new ATOM 0 HE1 TYR A 78 27.218 27.784 -41.899 1.00 41.53 H new ATOM 0 HE2 TYR A 78 27.582 30.324 -38.492 1.00 3.02 H new ATOM 0 HH TYR A 78 28.958 28.644 -38.899 1.00 43.41 H new ATOM 1147 N ASP A 79 21.686 30.250 -39.703 1.00 53.55 N ATOM 1148 CA ASP A 79 21.172 29.634 -38.485 1.00 22.14 C ATOM 1149 C ASP A 79 20.235 28.478 -38.815 1.00 11.23 C ATOM 1150 O ASP A 79 20.442 27.348 -38.367 1.00 61.42 O ATOM 1151 CB ASP A 79 20.442 30.672 -37.631 1.00 22.33 C ATOM 1152 CG ASP A 79 21.396 31.570 -36.869 1.00 61.03 C ATOM 1153 OD1 ASP A 79 22.504 31.830 -37.383 1.00 74.32 O ATOM 1154 OD2 ASP A 79 21.035 32.013 -35.758 1.00 61.22 O ATOM 0 H ASP A 79 21.436 31.232 -39.816 1.00 53.55 H new ATOM 0 HA ASP A 79 22.018 29.242 -37.921 1.00 22.14 H new ATOM 0 HB2 ASP A 79 19.806 31.283 -38.272 1.00 22.33 H new ATOM 0 HB3 ASP A 79 19.787 30.161 -36.925 1.00 22.33 H new ATOM 1158 N LEU A 80 19.203 28.765 -39.600 1.00 53.34 N ATOM 1159 CA LEU A 80 18.231 27.749 -39.989 1.00 32.30 C ATOM 1160 C LEU A 80 18.890 26.659 -40.829 1.00 4.42 C ATOM 1161 O LEU A 80 18.458 25.506 -40.814 1.00 71.30 O ATOM 1162 CB LEU A 80 17.083 28.387 -40.775 1.00 45.52 C ATOM 1163 CG LEU A 80 15.724 28.410 -40.074 1.00 11.12 C ATOM 1164 CD1 LEU A 80 15.153 27.004 -39.971 1.00 12.13 C ATOM 1165 CD2 LEU A 80 15.844 29.040 -38.694 1.00 72.50 C ATOM 0 H LEU A 80 19.017 29.693 -39.980 1.00 53.34 H new ATOM 0 HA LEU A 80 17.835 27.295 -39.081 1.00 32.30 H new ATOM 0 HB2 LEU A 80 17.361 29.412 -41.019 1.00 45.52 H new ATOM 0 HB3 LEU A 80 16.974 27.853 -41.719 1.00 45.52 H new ATOM 0 HG LEU A 80 15.041 29.016 -40.669 1.00 11.12 H new ATOM 0 HD11 LEU A 80 14.186 27.040 -39.469 1.00 12.13 H new ATOM 0 HD12 LEU A 80 15.028 26.588 -40.971 1.00 12.13 H new ATOM 0 HD13 LEU A 80 15.835 26.375 -39.399 1.00 12.13 H new ATOM 0 HD21 LEU A 80 14.867 29.047 -38.211 1.00 72.50 H new ATOM 0 HD22 LEU A 80 16.543 28.462 -38.090 1.00 72.50 H new ATOM 0 HD23 LEU A 80 16.208 30.063 -38.791 1.00 72.50 H new ATOM 1176 N GLN A 81 19.940 27.030 -41.554 1.00 54.22 N ATOM 1177 CA GLN A 81 20.659 26.083 -42.397 1.00 30.44 C ATOM 1178 C GLN A 81 21.052 24.840 -41.606 1.00 64.22 C ATOM 1179 O GLN A 81 20.710 23.718 -41.982 1.00 72.33 O ATOM 1180 CB GLN A 81 21.907 26.740 -42.990 1.00 43.13 C ATOM 1181 CG GLN A 81 21.834 26.938 -44.495 1.00 31.30 C ATOM 1182 CD GLN A 81 22.588 25.870 -45.262 1.00 11.20 C ATOM 1183 OE1 GLN A 81 23.794 25.982 -45.480 1.00 31.53 O ATOM 1184 NE2 GLN A 81 21.880 24.825 -45.673 1.00 12.12 N ATOM 0 H GLN A 81 20.312 27.980 -41.574 1.00 54.22 H new ATOM 0 HA GLN A 81 19.996 25.781 -43.208 1.00 30.44 H new ATOM 0 HB2 GLN A 81 22.060 27.707 -42.512 1.00 43.13 H new ATOM 0 HB3 GLN A 81 22.777 26.127 -42.754 1.00 43.13 H new ATOM 0 HG2 GLN A 81 20.790 26.935 -44.808 1.00 31.30 H new ATOM 0 HG3 GLN A 81 22.240 27.917 -44.749 1.00 31.30 H new ATOM 0 HE21 GLN A 81 20.882 24.774 -45.470 1.00 12.12 H new ATOM 0 HE22 GLN A 81 22.334 24.073 -46.192 1.00 12.12 H new ATOM 1191 N ARG A 82 21.773 25.046 -40.509 1.00 52.45 N ATOM 1192 CA ARG A 82 22.214 23.941 -39.665 1.00 63.22 C ATOM 1193 C ARG A 82 21.034 23.316 -38.929 1.00 2.52 C ATOM 1194 O ARG A 82 21.091 22.157 -38.515 1.00 14.40 O ATOM 1195 CB ARG A 82 23.259 24.427 -38.658 1.00 0.54 C ATOM 1196 CG ARG A 82 24.429 23.472 -38.486 1.00 14.04 C ATOM 1197 CD ARG A 82 25.736 24.222 -38.296 1.00 64.21 C ATOM 1198 NE ARG A 82 26.457 23.773 -37.107 1.00 51.10 N ATOM 1199 CZ ARG A 82 26.071 24.046 -35.866 1.00 75.05 C ATOM 1200 NH1 ARG A 82 24.976 24.763 -35.653 1.00 53.45 N ATOM 1201 NH2 ARG A 82 26.779 23.603 -34.836 1.00 1.03 N ATOM 0 H ARG A 82 22.064 25.968 -40.183 1.00 52.45 H new ATOM 0 HA ARG A 82 22.663 23.182 -40.306 1.00 63.22 H new ATOM 0 HB2 ARG A 82 23.637 25.397 -38.979 1.00 0.54 H new ATOM 0 HB3 ARG A 82 22.778 24.577 -37.691 1.00 0.54 H new ATOM 0 HG2 ARG A 82 24.250 22.827 -37.626 1.00 14.04 H new ATOM 0 HG3 ARG A 82 24.503 22.825 -39.360 1.00 14.04 H new ATOM 0 HD2 ARG A 82 26.365 24.083 -39.175 1.00 64.21 H new ATOM 0 HD3 ARG A 82 25.533 25.290 -38.215 1.00 64.21 H new ATOM 0 HE ARG A 82 27.304 23.219 -37.237 1.00 51.10 H new ATOM 0 HH11 ARG A 82 24.429 25.106 -36.443 1.00 53.45 H new ATOM 0 HH12 ARG A 82 24.681 24.972 -34.699 1.00 53.45 H new ATOM 0 HH21 ARG A 82 27.622 23.051 -34.996 1.00 1.03 H new ATOM 0 HH22 ARG A 82 26.481 23.814 -33.884 1.00 1.03 H new ATOM 1212 N CYS A 83 19.966 24.089 -38.767 1.00 3.12 N ATOM 1213 CA CYS A 83 18.772 23.611 -38.078 1.00 61.52 C ATOM 1214 C CYS A 83 18.038 22.573 -38.920 1.00 34.34 C ATOM 1215 O CYS A 83 17.882 21.424 -38.510 1.00 41.41 O ATOM 1216 CB CYS A 83 17.839 24.780 -37.760 1.00 23.05 C ATOM 1217 SG CYS A 83 18.462 25.895 -36.481 1.00 45.32 S ATOM 0 H CYS A 83 19.902 25.050 -39.103 1.00 3.12 H new ATOM 0 HA CYS A 83 19.084 23.141 -37.145 1.00 61.52 H new ATOM 0 HB2 CYS A 83 17.666 25.351 -38.672 1.00 23.05 H new ATOM 0 HB3 CYS A 83 16.874 24.385 -37.444 1.00 23.05 H new ATOM 0 HG CYS A 83 19.381 26.664 -36.986 1.00 45.32 H new ATOM 1222 N GLU A 84 17.588 22.988 -40.101 1.00 2.42 N ATOM 1223 CA GLU A 84 16.867 22.093 -40.999 1.00 33.34 C ATOM 1224 C GLU A 84 17.680 20.832 -41.280 1.00 10.32 C ATOM 1225 O GLU A 84 17.123 19.770 -41.557 1.00 52.30 O ATOM 1226 CB GLU A 84 16.544 22.807 -42.314 1.00 13.25 C ATOM 1227 CG GLU A 84 15.102 23.277 -42.413 1.00 31.31 C ATOM 1228 CD GLU A 84 14.356 22.633 -43.566 1.00 44.24 C ATOM 1229 OE1 GLU A 84 14.457 21.398 -43.722 1.00 22.53 O ATOM 1230 OE2 GLU A 84 13.672 23.364 -44.311 1.00 71.15 O ATOM 0 H GLU A 84 17.710 23.936 -40.457 1.00 2.42 H new ATOM 0 HA GLU A 84 15.936 21.803 -40.511 1.00 33.34 H new ATOM 0 HB2 GLU A 84 17.206 23.666 -42.423 1.00 13.25 H new ATOM 0 HB3 GLU A 84 16.756 22.134 -43.145 1.00 13.25 H new ATOM 0 HG2 GLU A 84 14.586 23.052 -41.480 1.00 31.31 H new ATOM 0 HG3 GLU A 84 15.084 24.360 -42.534 1.00 31.31 H new ATOM 1235 N ASP A 85 19.000 20.958 -41.205 1.00 62.32 N ATOM 1236 CA ASP A 85 19.891 19.830 -41.449 1.00 33.44 C ATOM 1237 C ASP A 85 20.059 18.987 -40.189 1.00 52.11 C ATOM 1238 O ASP A 85 20.289 17.780 -40.263 1.00 12.43 O ATOM 1239 CB ASP A 85 21.256 20.324 -41.932 1.00 34.12 C ATOM 1240 CG ASP A 85 22.048 19.240 -42.636 1.00 41.25 C ATOM 1241 OD1 ASP A 85 21.441 18.462 -43.399 1.00 13.43 O ATOM 1242 OD2 ASP A 85 23.277 19.170 -42.422 1.00 1.20 O ATOM 0 H ASP A 85 19.477 21.830 -40.977 1.00 62.32 H new ATOM 0 HA ASP A 85 19.443 19.208 -42.224 1.00 33.44 H new ATOM 0 HB2 ASP A 85 21.115 21.166 -42.610 1.00 34.12 H new ATOM 0 HB3 ASP A 85 21.828 20.693 -41.080 1.00 34.12 H new ATOM 1246 N ASP A 86 19.943 19.631 -39.033 1.00 4.51 N ATOM 1247 CA ASP A 86 20.082 18.941 -37.756 1.00 45.21 C ATOM 1248 C ASP A 86 18.773 18.269 -37.355 1.00 73.43 C ATOM 1249 O ASP A 86 18.761 17.337 -36.552 1.00 2.44 O ATOM 1250 CB ASP A 86 20.521 19.922 -36.667 1.00 53.42 C ATOM 1251 CG ASP A 86 22.014 20.176 -36.683 1.00 61.34 C ATOM 1252 OD1 ASP A 86 22.675 19.770 -37.663 1.00 45.41 O ATOM 1253 OD2 ASP A 86 22.523 20.784 -35.718 1.00 0.24 O ATOM 0 H ASP A 86 19.753 20.630 -38.954 1.00 4.51 H new ATOM 0 HA ASP A 86 20.845 18.170 -37.869 1.00 45.21 H new ATOM 0 HB2 ASP A 86 19.994 20.867 -36.799 1.00 53.42 H new ATOM 0 HB3 ASP A 86 20.233 19.530 -35.692 1.00 53.42 H new ATOM 1257 N LEU A 87 17.671 18.749 -37.921 1.00 51.14 N ATOM 1258 CA LEU A 87 16.355 18.197 -37.623 1.00 15.33 C ATOM 1259 C LEU A 87 16.084 16.951 -38.462 1.00 41.32 C ATOM 1260 O LEU A 87 15.511 15.976 -37.976 1.00 3.02 O ATOM 1261 CB LEU A 87 15.269 19.244 -37.880 1.00 54.31 C ATOM 1262 CG LEU A 87 14.023 19.150 -36.998 1.00 2.52 C ATOM 1263 CD1 LEU A 87 14.213 19.952 -35.720 1.00 0.42 C ATOM 1264 CD2 LEU A 87 12.795 19.632 -37.756 1.00 2.01 C ATOM 0 H LEU A 87 17.663 19.520 -38.589 1.00 51.14 H new ATOM 0 HA LEU A 87 16.337 17.915 -36.570 1.00 15.33 H new ATOM 0 HB2 LEU A 87 15.708 20.233 -37.750 1.00 54.31 H new ATOM 0 HB3 LEU A 87 14.959 19.168 -38.922 1.00 54.31 H new ATOM 0 HG LEU A 87 13.870 18.105 -36.727 1.00 2.52 H new ATOM 0 HD11 LEU A 87 13.317 19.874 -35.105 1.00 0.42 H new ATOM 0 HD12 LEU A 87 15.067 19.560 -35.168 1.00 0.42 H new ATOM 0 HD13 LEU A 87 14.391 20.998 -35.970 1.00 0.42 H new ATOM 0 HD21 LEU A 87 11.918 19.558 -37.113 1.00 2.01 H new ATOM 0 HD22 LEU A 87 12.937 20.670 -38.057 1.00 2.01 H new ATOM 0 HD23 LEU A 87 12.648 19.014 -38.642 1.00 2.01 H new ATOM 1275 N ARG A 88 16.502 16.992 -39.722 1.00 73.01 N ATOM 1276 CA ARG A 88 16.306 15.866 -40.629 1.00 52.12 C ATOM 1277 C ARG A 88 17.408 14.827 -40.451 1.00 60.00 C ATOM 1278 O ARG A 88 17.214 13.647 -40.736 1.00 34.15 O ATOM 1279 CB ARG A 88 16.277 16.352 -42.079 1.00 14.45 C ATOM 1280 CG ARG A 88 15.379 15.520 -42.981 1.00 54.15 C ATOM 1281 CD ARG A 88 16.057 15.206 -44.306 1.00 3.24 C ATOM 1282 NE ARG A 88 16.401 16.417 -45.045 1.00 14.22 N ATOM 1283 CZ ARG A 88 15.509 17.165 -45.686 1.00 1.24 C ATOM 1284 NH1 ARG A 88 14.227 16.828 -45.676 1.00 1.33 N ATOM 1285 NH2 ARG A 88 15.899 18.253 -46.337 1.00 13.31 N ATOM 0 H ARG A 88 16.978 17.792 -40.139 1.00 73.01 H new ATOM 0 HA ARG A 88 15.350 15.400 -40.390 1.00 52.12 H new ATOM 0 HB2 ARG A 88 15.939 17.388 -42.100 1.00 14.45 H new ATOM 0 HB3 ARG A 88 17.291 16.339 -42.478 1.00 14.45 H new ATOM 0 HG2 ARG A 88 15.116 14.590 -42.477 1.00 54.15 H new ATOM 0 HG3 ARG A 88 14.449 16.057 -43.165 1.00 54.15 H new ATOM 0 HD2 ARG A 88 16.960 14.625 -44.122 1.00 3.24 H new ATOM 0 HD3 ARG A 88 15.397 14.586 -44.913 1.00 3.24 H new ATOM 0 HE ARG A 88 17.379 16.705 -45.071 1.00 14.22 H new ATOM 0 HH11 ARG A 88 13.923 15.993 -45.175 1.00 1.33 H new ATOM 0 HH12 ARG A 88 13.544 17.404 -46.169 1.00 1.33 H new ATOM 0 HH21 ARG A 88 16.884 18.516 -46.346 1.00 13.31 H new ATOM 0 HH22 ARG A 88 15.213 18.826 -46.829 1.00 13.31 H new ATOM 1359 N ASP A 94 22.268 7.150 -43.351 1.00 3.33 N ATOM 1360 CA ASP A 94 23.472 6.336 -43.217 1.00 33.44 C ATOM 1361 C ASP A 94 24.232 6.271 -44.539 1.00 0.24 C ATOM 1362 O ASP A 94 23.736 5.729 -45.526 1.00 31.02 O ATOM 1363 CB ASP A 94 23.110 4.924 -42.753 1.00 72.33 C ATOM 1364 CG ASP A 94 21.951 4.337 -43.534 1.00 23.30 C ATOM 1365 OD1 ASP A 94 20.790 4.619 -43.175 1.00 3.11 O ATOM 1366 OD2 ASP A 94 22.207 3.593 -44.505 1.00 12.02 O ATOM 0 HA ASP A 94 24.115 6.801 -42.470 1.00 33.44 H new ATOM 0 HB2 ASP A 94 23.980 4.276 -42.858 1.00 72.33 H new ATOM 0 HB3 ASP A 94 22.856 4.947 -41.693 1.00 72.33 H new ATOM 1370 N ALA A 95 25.439 6.828 -44.549 1.00 41.01 N ATOM 1371 CA ALA A 95 26.269 6.832 -45.748 1.00 53.33 C ATOM 1372 C ALA A 95 27.610 6.156 -45.489 1.00 12.24 C ATOM 1373 O ALA A 95 27.863 5.660 -44.392 1.00 24.24 O ATOM 1374 CB ALA A 95 26.479 8.258 -46.238 1.00 4.34 C ATOM 0 H ALA A 95 25.864 7.282 -43.740 1.00 41.01 H new ATOM 0 HA ALA A 95 25.751 6.266 -46.522 1.00 53.33 H new ATOM 0 HB1 ALA A 95 27.100 8.247 -47.134 1.00 4.34 H new ATOM 0 HB2 ALA A 95 25.514 8.708 -46.471 1.00 4.34 H new ATOM 0 HB3 ALA A 95 26.973 8.841 -45.461 1.00 4.34 H new ATOM 1380 N GLN A 96 28.465 6.138 -46.507 1.00 10.50 N ATOM 1381 CA GLN A 96 29.780 5.520 -46.389 1.00 21.35 C ATOM 1382 C GLN A 96 30.830 6.549 -45.982 1.00 21.02 C ATOM 1383 O GLN A 96 30.733 7.723 -46.337 1.00 41.44 O ATOM 1384 CB GLN A 96 30.178 4.863 -47.711 1.00 22.32 C ATOM 1385 CG GLN A 96 30.418 5.856 -48.837 1.00 52.53 C ATOM 1386 CD GLN A 96 29.145 6.217 -49.577 1.00 51.25 C ATOM 1387 OE1 GLN A 96 28.512 5.365 -50.199 1.00 54.51 O ATOM 1388 NE2 GLN A 96 28.764 7.488 -49.513 1.00 72.00 N ATOM 0 H GLN A 96 28.270 6.544 -47.422 1.00 10.50 H new ATOM 0 HA GLN A 96 29.727 4.756 -45.613 1.00 21.35 H new ATOM 0 HB2 GLN A 96 31.083 4.276 -47.557 1.00 22.32 H new ATOM 0 HB3 GLN A 96 29.394 4.168 -48.012 1.00 22.32 H new ATOM 0 HG2 GLN A 96 30.866 6.762 -48.428 1.00 52.53 H new ATOM 0 HG3 GLN A 96 31.136 5.435 -49.541 1.00 52.53 H new ATOM 0 HE21 GLN A 96 29.320 8.161 -48.985 1.00 72.00 H new ATOM 0 HE22 GLN A 96 27.916 7.791 -49.992 1.00 72.00 H new ATOM 1395 N VAL A 97 31.833 6.099 -45.235 1.00 2.43 N ATOM 1396 CA VAL A 97 32.902 6.980 -44.780 1.00 72.31 C ATOM 1397 C VAL A 97 34.272 6.410 -45.133 1.00 0.44 C ATOM 1398 O VAL A 97 34.482 5.197 -45.087 1.00 41.34 O ATOM 1399 CB VAL A 97 32.830 7.211 -43.260 1.00 3.43 C ATOM 1400 CG1 VAL A 97 32.780 5.882 -42.519 1.00 62.32 C ATOM 1401 CG2 VAL A 97 34.012 8.046 -42.791 1.00 72.04 C ATOM 0 H VAL A 97 31.928 5.130 -44.932 1.00 2.43 H new ATOM 0 HA VAL A 97 32.766 7.933 -45.291 1.00 72.31 H new ATOM 0 HB VAL A 97 31.915 7.760 -43.037 1.00 3.43 H new ATOM 0 HG11 VAL A 97 32.729 6.066 -41.446 1.00 62.32 H new ATOM 0 HG12 VAL A 97 31.899 5.323 -42.834 1.00 62.32 H new ATOM 0 HG13 VAL A 97 33.676 5.305 -42.746 1.00 62.32 H new ATOM 0 HG21 VAL A 97 33.945 8.199 -41.714 1.00 72.04 H new ATOM 0 HG22 VAL A 97 34.941 7.526 -43.026 1.00 72.04 H new ATOM 0 HG23 VAL A 97 33.999 9.012 -43.296 1.00 72.04 H new ATOM 1411 N TYR A 98 35.200 7.292 -45.485 1.00 4.13 N ATOM 1412 CA TYR A 98 36.551 6.876 -45.847 1.00 74.41 C ATOM 1413 C TYR A 98 37.474 6.906 -44.634 1.00 63.15 C ATOM 1414 O TYR A 98 37.518 7.893 -43.897 1.00 3.54 O ATOM 1415 CB TYR A 98 37.107 7.781 -46.948 1.00 33.44 C ATOM 1416 CG TYR A 98 36.130 8.034 -48.074 1.00 21.02 C ATOM 1417 CD1 TYR A 98 35.675 6.992 -48.873 1.00 35.42 C ATOM 1418 CD2 TYR A 98 35.663 9.315 -48.340 1.00 14.13 C ATOM 1419 CE1 TYR A 98 34.783 7.218 -49.904 1.00 62.54 C ATOM 1420 CE2 TYR A 98 34.769 9.550 -49.367 1.00 22.21 C ATOM 1421 CZ TYR A 98 34.333 8.499 -50.146 1.00 32.42 C ATOM 1422 OH TYR A 98 33.445 8.730 -51.172 1.00 13.15 O ATOM 0 H TYR A 98 35.043 8.299 -45.528 1.00 4.13 H new ATOM 0 HA TYR A 98 36.502 5.852 -46.217 1.00 74.41 H new ATOM 0 HB2 TYR A 98 37.398 8.735 -46.510 1.00 33.44 H new ATOM 0 HB3 TYR A 98 38.011 7.329 -47.357 1.00 33.44 H new ATOM 0 HD1 TYR A 98 36.025 5.988 -48.685 1.00 35.42 H new ATOM 0 HD2 TYR A 98 36.004 10.141 -47.734 1.00 14.13 H new ATOM 0 HE1 TYR A 98 34.441 6.397 -50.516 1.00 62.54 H new ATOM 0 HE2 TYR A 98 34.414 10.552 -49.559 1.00 22.21 H new ATOM 0 HH TYR A 98 33.227 9.685 -51.207 1.00 13.15 H new ATOM 1431 N LEU A 99 38.212 5.820 -44.432 1.00 61.42 N ATOM 1432 CA LEU A 99 39.137 5.722 -43.309 1.00 4.21 C ATOM 1433 C LEU A 99 40.080 6.919 -43.272 1.00 62.43 C ATOM 1434 O LEU A 99 40.616 7.268 -42.221 1.00 52.12 O ATOM 1435 CB LEU A 99 39.944 4.426 -43.400 1.00 12.04 C ATOM 1436 CG LEU A 99 39.143 3.155 -43.686 1.00 10.23 C ATOM 1437 CD1 LEU A 99 40.018 1.922 -43.514 1.00 32.50 C ATOM 1438 CD2 LEU A 99 37.924 3.077 -42.777 1.00 24.05 C ATOM 0 H LEU A 99 38.188 4.995 -45.031 1.00 61.42 H new ATOM 0 HA LEU A 99 38.552 5.716 -42.389 1.00 4.21 H new ATOM 0 HB2 LEU A 99 40.694 4.543 -44.182 1.00 12.04 H new ATOM 0 HB3 LEU A 99 40.481 4.289 -42.461 1.00 12.04 H new ATOM 0 HG LEU A 99 38.799 3.190 -44.720 1.00 10.23 H new ATOM 0 HD11 LEU A 99 39.431 1.027 -43.722 1.00 32.50 H new ATOM 0 HD12 LEU A 99 40.859 1.973 -44.206 1.00 32.50 H new ATOM 0 HD13 LEU A 99 40.392 1.881 -42.491 1.00 32.50 H new ATOM 0 HD21 LEU A 99 37.366 2.166 -42.994 1.00 24.05 H new ATOM 0 HD22 LEU A 99 38.247 3.065 -41.736 1.00 24.05 H new ATOM 0 HD23 LEU A 99 37.286 3.944 -42.949 1.00 24.05 H new ATOM 1449 N GLU A 100 40.277 7.547 -44.428 1.00 41.04 N ATOM 1450 CA GLU A 100 41.155 8.707 -44.527 1.00 60.15 C ATOM 1451 C GLU A 100 40.674 9.833 -43.615 1.00 14.22 C ATOM 1452 O GLU A 100 41.434 10.739 -43.279 1.00 42.24 O ATOM 1453 CB GLU A 100 41.222 9.201 -45.974 1.00 44.11 C ATOM 1454 CG GLU A 100 42.405 10.114 -46.250 1.00 74.20 C ATOM 1455 CD GLU A 100 41.994 11.561 -46.436 1.00 60.44 C ATOM 1456 OE1 GLU A 100 41.532 11.909 -47.543 1.00 12.10 O ATOM 1457 OE2 GLU A 100 42.134 12.347 -45.476 1.00 45.21 O ATOM 0 H GLU A 100 39.841 7.272 -45.308 1.00 41.04 H new ATOM 0 HA GLU A 100 42.152 8.405 -44.207 1.00 60.15 H new ATOM 0 HB2 GLU A 100 41.274 8.340 -46.641 1.00 44.11 H new ATOM 0 HB3 GLU A 100 40.300 9.732 -46.211 1.00 44.11 H new ATOM 0 HG2 GLU A 100 43.113 10.045 -45.424 1.00 74.20 H new ATOM 0 HG3 GLU A 100 42.924 9.770 -47.145 1.00 74.20 H new ATOM 1462 N GLU A 101 39.406 9.765 -43.221 1.00 41.33 N ATOM 1463 CA GLU A 101 38.824 10.779 -42.349 1.00 40.12 C ATOM 1464 C GLU A 101 38.985 10.394 -40.882 1.00 62.10 C ATOM 1465 O GLU A 101 39.364 11.219 -40.051 1.00 12.12 O ATOM 1466 CB GLU A 101 37.342 10.974 -42.676 1.00 72.25 C ATOM 1467 CG GLU A 101 36.910 12.431 -42.701 1.00 50.53 C ATOM 1468 CD GLU A 101 35.770 12.718 -41.743 1.00 2.13 C ATOM 1469 OE1 GLU A 101 36.012 12.726 -40.518 1.00 53.43 O ATOM 1470 OE2 GLU A 101 34.637 12.935 -42.219 1.00 55.51 O ATOM 0 H GLU A 101 38.763 9.020 -43.491 1.00 41.33 H new ATOM 0 HA GLU A 101 39.354 11.716 -42.521 1.00 40.12 H new ATOM 0 HB2 GLU A 101 37.131 10.525 -43.646 1.00 72.25 H new ATOM 0 HB3 GLU A 101 36.743 10.439 -41.939 1.00 72.25 H new ATOM 0 HG2 GLU A 101 37.761 13.063 -42.447 1.00 50.53 H new ATOM 0 HG3 GLU A 101 36.605 12.698 -43.713 1.00 50.53 H new ATOM 1475 N MET A 102 38.696 9.135 -40.571 1.00 62.20 N ATOM 1476 CA MET A 102 38.810 8.640 -39.205 1.00 12.53 C ATOM 1477 C MET A 102 40.210 8.885 -38.653 1.00 43.51 C ATOM 1478 O MET A 102 41.204 8.734 -39.364 1.00 12.11 O ATOM 1479 CB MET A 102 38.482 7.145 -39.152 1.00 61.43 C ATOM 1480 CG MET A 102 37.124 6.800 -39.739 1.00 51.10 C ATOM 1481 SD MET A 102 36.984 5.060 -40.189 1.00 12.22 S ATOM 1482 CE MET A 102 35.218 4.921 -40.460 1.00 23.11 C ATOM 0 H MET A 102 38.381 8.439 -41.247 1.00 62.20 H new ATOM 0 HA MET A 102 38.095 9.184 -38.587 1.00 12.53 H new ATOM 0 HB2 MET A 102 39.252 6.593 -39.691 1.00 61.43 H new ATOM 0 HB3 MET A 102 38.516 6.810 -38.115 1.00 61.43 H new ATOM 0 HG2 MET A 102 36.347 7.048 -39.016 1.00 51.10 H new ATOM 0 HG3 MET A 102 36.947 7.415 -40.621 1.00 51.10 H new ATOM 0 HE1 MET A 102 34.756 4.430 -39.603 1.00 23.11 H new ATOM 0 HE2 MET A 102 34.789 5.916 -40.583 1.00 23.11 H new ATOM 0 HE3 MET A 102 35.033 4.332 -41.359 1.00 23.11 H new ATOM 1490 N SER A 103 40.282 9.264 -37.381 1.00 2.43 N ATOM 1491 CA SER A 103 41.561 9.533 -36.734 1.00 63.14 C ATOM 1492 C SER A 103 42.529 8.372 -36.937 1.00 73.31 C ATOM 1493 O SER A 103 42.275 7.253 -36.491 1.00 45.53 O ATOM 1494 CB SER A 103 41.358 9.788 -35.240 1.00 2.40 C ATOM 1495 OG SER A 103 42.434 10.533 -34.697 1.00 74.45 O ATOM 0 H SER A 103 39.469 9.392 -36.778 1.00 2.43 H new ATOM 0 HA SER A 103 41.990 10.424 -37.192 1.00 63.14 H new ATOM 0 HB2 SER A 103 40.424 10.327 -35.084 1.00 2.40 H new ATOM 0 HB3 SER A 103 41.269 8.837 -34.715 1.00 2.40 H new ATOM 0 HG SER A 103 42.278 10.684 -33.741 1.00 74.45 H new ATOM 1500 N TRP A 104 43.638 8.646 -37.615 1.00 13.32 N ATOM 1501 CA TRP A 104 44.645 7.623 -37.878 1.00 75.11 C ATOM 1502 C TRP A 104 45.684 7.583 -36.764 1.00 72.34 C ATOM 1503 O TRP A 104 46.352 8.580 -36.490 1.00 31.44 O ATOM 1504 CB TRP A 104 45.327 7.885 -39.221 1.00 51.11 C ATOM 1505 CG TRP A 104 46.476 6.961 -39.494 1.00 63.15 C ATOM 1506 CD1 TRP A 104 46.635 5.690 -39.021 1.00 2.21 C ATOM 1507 CD2 TRP A 104 47.626 7.238 -40.300 1.00 64.04 C ATOM 1508 NE1 TRP A 104 47.816 5.160 -39.485 1.00 55.15 N ATOM 1509 CE2 TRP A 104 48.440 6.090 -40.272 1.00 21.55 C ATOM 1510 CE3 TRP A 104 48.045 8.344 -41.044 1.00 22.43 C ATOM 1511 CZ2 TRP A 104 49.649 6.019 -40.960 1.00 4.45 C ATOM 1512 CZ3 TRP A 104 49.246 8.272 -41.726 1.00 70.11 C ATOM 1513 CH2 TRP A 104 50.036 7.116 -41.681 1.00 5.14 C ATOM 0 H TRP A 104 43.863 9.567 -37.992 1.00 13.32 H new ATOM 0 HA TRP A 104 44.144 6.656 -37.916 1.00 75.11 H new ATOM 0 HB2 TRP A 104 44.592 7.785 -40.019 1.00 51.11 H new ATOM 0 HB3 TRP A 104 45.684 8.914 -39.244 1.00 51.11 H new ATOM 0 HD1 TRP A 104 45.936 5.177 -38.377 1.00 2.21 H new ATOM 0 HE1 TRP A 104 48.169 4.226 -39.277 1.00 55.15 H new ATOM 0 HE3 TRP A 104 47.442 9.239 -41.086 1.00 22.43 H new ATOM 0 HZ2 TRP A 104 50.260 5.129 -40.926 1.00 4.45 H new ATOM 0 HZ3 TRP A 104 49.581 9.121 -42.303 1.00 70.11 H new ATOM 0 HH2 TRP A 104 50.968 7.090 -42.226 1.00 5.14 H new ATOM 1523 N ASN A 105 45.816 6.427 -36.124 1.00 13.54 N ATOM 1524 CA ASN A 105 46.775 6.258 -35.038 1.00 64.20 C ATOM 1525 C ASN A 105 47.857 5.252 -35.420 1.00 62.25 C ATOM 1526 O ASN A 105 47.815 4.095 -35.006 1.00 1.34 O ATOM 1527 CB ASN A 105 46.062 5.798 -33.765 1.00 74.31 C ATOM 1528 CG ASN A 105 46.939 5.920 -32.534 1.00 74.14 C ATOM 1529 OD1 ASN A 105 47.988 6.562 -32.568 1.00 23.13 O ATOM 1530 ND2 ASN A 105 46.511 5.303 -31.439 1.00 13.03 N ATOM 0 H ASN A 105 45.271 5.592 -36.338 1.00 13.54 H new ATOM 0 HA ASN A 105 47.248 7.222 -34.852 1.00 64.20 H new ATOM 0 HB2 ASN A 105 45.158 6.391 -33.624 1.00 74.31 H new ATOM 0 HB3 ASN A 105 45.748 4.761 -33.882 1.00 74.31 H new ATOM 0 HD21 ASN A 105 47.059 5.350 -30.580 1.00 13.03 H new ATOM 0 HD22 ASN A 105 45.634 4.782 -31.457 1.00 13.03 H new ATOM 1536 N GLU A 106 48.826 5.705 -36.210 1.00 33.32 N ATOM 1537 CA GLU A 106 49.919 4.845 -36.648 1.00 42.53 C ATOM 1538 C GLU A 106 50.661 4.258 -35.450 1.00 23.12 C ATOM 1539 O GLU A 106 51.301 3.212 -35.555 1.00 11.43 O ATOM 1540 CB GLU A 106 50.892 5.628 -37.531 1.00 52.32 C ATOM 1541 CG GLU A 106 51.291 6.974 -36.952 1.00 43.52 C ATOM 1542 CD GLU A 106 50.473 8.119 -37.517 1.00 60.31 C ATOM 1543 OE1 GLU A 106 49.410 8.430 -36.942 1.00 5.41 O ATOM 1544 OE2 GLU A 106 50.897 8.703 -38.536 1.00 65.53 O ATOM 0 H GLU A 106 48.876 6.662 -36.559 1.00 33.32 H new ATOM 0 HA GLU A 106 49.494 4.026 -37.228 1.00 42.53 H new ATOM 0 HB2 GLU A 106 51.789 5.029 -37.688 1.00 52.32 H new ATOM 0 HB3 GLU A 106 50.437 5.783 -38.509 1.00 52.32 H new ATOM 0 HG2 GLU A 106 51.173 6.948 -35.869 1.00 43.52 H new ATOM 0 HG3 GLU A 106 52.347 7.153 -37.154 1.00 43.52 H new ATOM 1549 N GLY A 107 50.571 4.940 -34.312 1.00 72.54 N ATOM 1550 CA GLY A 107 51.239 4.473 -33.112 1.00 13.15 C ATOM 1551 C GLY A 107 50.912 3.027 -32.792 1.00 71.24 C ATOM 1552 O GLY A 107 51.810 2.217 -32.564 1.00 52.11 O ATOM 0 H GLY A 107 50.047 5.808 -34.200 1.00 72.54 H new ATOM 0 HA2 GLY A 107 52.317 4.580 -33.235 1.00 13.15 H new ATOM 0 HA3 GLY A 107 50.950 5.103 -32.270 1.00 13.15 H new ATOM 1556 N ASP A 108 49.624 2.705 -32.774 1.00 54.10 N ATOM 1557 CA ASP A 108 49.180 1.347 -32.479 1.00 40.53 C ATOM 1558 C ASP A 108 48.471 0.734 -33.682 1.00 21.15 C ATOM 1559 O ASP A 108 47.786 -0.283 -33.560 1.00 73.41 O ATOM 1560 CB ASP A 108 48.248 1.345 -31.266 1.00 53.21 C ATOM 1561 CG ASP A 108 48.365 0.075 -30.448 1.00 3.24 C ATOM 1562 OD1 ASP A 108 49.446 -0.161 -29.868 1.00 61.44 O ATOM 1563 OD2 ASP A 108 47.376 -0.686 -30.387 1.00 23.00 O ATOM 0 H ASP A 108 48.869 3.365 -32.960 1.00 54.10 H new ATOM 0 HA ASP A 108 50.060 0.744 -32.253 1.00 40.53 H new ATOM 0 HB2 ASP A 108 48.477 2.203 -30.634 1.00 53.21 H new ATOM 0 HB3 ASP A 108 47.218 1.463 -31.603 1.00 53.21 H new ATOM 1567 N HIS A 109 48.638 1.358 -34.843 1.00 4.02 N ATOM 1568 CA HIS A 109 48.014 0.874 -36.069 1.00 3.15 C ATOM 1569 C HIS A 109 46.519 0.648 -35.864 1.00 24.51 C ATOM 1570 O HIS A 109 46.050 -0.490 -35.850 1.00 43.33 O ATOM 1571 CB HIS A 109 48.680 -0.425 -36.527 1.00 73.34 C ATOM 1572 CG HIS A 109 49.963 -0.210 -37.269 1.00 20.50 C ATOM 1573 ND1 HIS A 109 51.196 -0.551 -36.754 1.00 70.15 N ATOM 1574 CD2 HIS A 109 50.200 0.313 -38.494 1.00 21.54 C ATOM 1575 CE1 HIS A 109 52.137 -0.246 -37.631 1.00 54.32 C ATOM 1576 NE2 HIS A 109 51.559 0.279 -38.696 1.00 54.32 N ATOM 0 H HIS A 109 49.201 2.201 -34.961 1.00 4.02 H new ATOM 0 HA HIS A 109 48.147 1.633 -36.840 1.00 3.15 H new ATOM 0 HB2 HIS A 109 48.874 -1.051 -35.656 1.00 73.34 H new ATOM 0 HB3 HIS A 109 47.988 -0.973 -37.166 1.00 73.34 H new ATOM 0 HD2 HIS A 109 49.459 0.688 -39.185 1.00 21.54 H new ATOM 0 HE1 HIS A 109 53.198 -0.400 -37.499 1.00 54.32 H new ATOM 0 HE2 HIS A 109 52.043 0.606 -39.532 1.00 54.32 H new ATOM 1583 N SER A 110 45.777 1.739 -35.706 1.00 60.41 N ATOM 1584 CA SER A 110 44.336 1.660 -35.499 1.00 3.00 C ATOM 1585 C SER A 110 43.659 2.973 -35.880 1.00 0.44 C ATOM 1586 O SER A 110 44.310 4.012 -35.989 1.00 4.41 O ATOM 1587 CB SER A 110 44.028 1.319 -34.039 1.00 0.23 C ATOM 1588 OG SER A 110 44.848 2.065 -33.157 1.00 71.14 O ATOM 0 H SER A 110 46.150 2.688 -35.717 1.00 60.41 H new ATOM 0 HA SER A 110 43.944 0.870 -36.140 1.00 3.00 H new ATOM 0 HB2 SER A 110 42.979 1.526 -33.828 1.00 0.23 H new ATOM 0 HB3 SER A 110 44.183 0.253 -33.871 1.00 0.23 H new ATOM 0 HG SER A 110 44.630 1.830 -32.231 1.00 71.14 H new ATOM 1593 N PHE A 111 42.346 2.917 -36.081 1.00 64.54 N ATOM 1594 CA PHE A 111 41.580 4.102 -36.452 1.00 10.22 C ATOM 1595 C PHE A 111 40.364 4.267 -35.545 1.00 14.51 C ATOM 1596 O PHE A 111 39.644 3.305 -35.272 1.00 73.40 O ATOM 1597 CB PHE A 111 41.132 4.010 -37.912 1.00 5.03 C ATOM 1598 CG PHE A 111 42.225 3.576 -38.847 1.00 31.21 C ATOM 1599 CD1 PHE A 111 43.108 4.501 -39.379 1.00 30.10 C ATOM 1600 CD2 PHE A 111 42.368 2.242 -39.194 1.00 25.23 C ATOM 1601 CE1 PHE A 111 44.115 4.106 -40.240 1.00 50.30 C ATOM 1602 CE2 PHE A 111 43.374 1.840 -40.054 1.00 53.44 C ATOM 1603 CZ PHE A 111 44.247 2.773 -40.578 1.00 72.23 C ATOM 0 H PHE A 111 41.791 2.066 -35.993 1.00 64.54 H new ATOM 0 HA PHE A 111 42.224 4.973 -36.332 1.00 10.22 H new ATOM 0 HB2 PHE A 111 40.301 3.308 -37.986 1.00 5.03 H new ATOM 0 HB3 PHE A 111 40.757 4.982 -38.231 1.00 5.03 H new ATOM 0 HD1 PHE A 111 43.009 5.544 -39.118 1.00 30.10 H new ATOM 0 HD2 PHE A 111 41.687 1.508 -38.789 1.00 25.23 H new ATOM 0 HE1 PHE A 111 44.797 4.838 -40.647 1.00 50.30 H new ATOM 0 HE2 PHE A 111 43.477 0.797 -40.316 1.00 53.44 H new ATOM 0 HZ PHE A 111 45.032 2.461 -41.251 1.00 72.23 H new ATOM 1612 N TYR A 112 40.140 5.491 -35.081 1.00 70.31 N ATOM 1613 CA TYR A 112 39.014 5.783 -34.204 1.00 43.23 C ATOM 1614 C TYR A 112 38.072 6.798 -34.845 1.00 2.33 C ATOM 1615 O TYR A 112 38.511 7.732 -35.517 1.00 21.12 O ATOM 1616 CB TYR A 112 39.512 6.312 -32.858 1.00 72.11 C ATOM 1617 CG TYR A 112 38.682 7.450 -32.309 1.00 74.53 C ATOM 1618 CD1 TYR A 112 38.885 8.756 -32.740 1.00 30.30 C ATOM 1619 CD2 TYR A 112 37.694 7.221 -31.360 1.00 53.04 C ATOM 1620 CE1 TYR A 112 38.129 9.799 -32.242 1.00 20.11 C ATOM 1621 CE2 TYR A 112 36.932 8.258 -30.857 1.00 3.43 C ATOM 1622 CZ TYR A 112 37.154 9.545 -31.301 1.00 50.11 C ATOM 1623 OH TYR A 112 36.398 10.581 -30.801 1.00 2.10 O ATOM 0 H TYR A 112 40.725 6.298 -35.298 1.00 70.31 H new ATOM 0 HA TYR A 112 38.464 4.856 -34.042 1.00 43.23 H new ATOM 0 HB2 TYR A 112 39.517 5.496 -32.136 1.00 72.11 H new ATOM 0 HB3 TYR A 112 40.544 6.646 -32.968 1.00 72.11 H new ATOM 0 HD1 TYR A 112 39.648 8.959 -33.477 1.00 30.30 H new ATOM 0 HD2 TYR A 112 37.518 6.215 -31.009 1.00 53.04 H new ATOM 0 HE1 TYR A 112 38.301 10.808 -32.588 1.00 20.11 H new ATOM 0 HE2 TYR A 112 36.167 8.062 -30.120 1.00 3.43 H new ATOM 0 HH TYR A 112 35.755 10.232 -30.149 1.00 2.10 H new ATOM 1632 N LEU A 113 36.775 6.609 -34.630 1.00 31.04 N ATOM 1633 CA LEU A 113 35.768 7.507 -35.186 1.00 25.35 C ATOM 1634 C LEU A 113 34.909 8.112 -34.081 1.00 20.14 C ATOM 1635 O LEU A 113 34.811 7.561 -32.985 1.00 2.01 O ATOM 1636 CB LEU A 113 34.883 6.758 -36.184 1.00 24.51 C ATOM 1637 CG LEU A 113 34.970 5.232 -36.145 1.00 41.21 C ATOM 1638 CD1 LEU A 113 33.698 4.611 -36.702 1.00 71.34 C ATOM 1639 CD2 LEU A 113 36.186 4.747 -36.920 1.00 71.14 C ATOM 0 H LEU A 113 36.395 5.842 -34.075 1.00 31.04 H new ATOM 0 HA LEU A 113 36.284 8.316 -35.704 1.00 25.35 H new ATOM 0 HB2 LEU A 113 33.847 7.047 -36.009 1.00 24.51 H new ATOM 0 HB3 LEU A 113 35.141 7.091 -37.189 1.00 24.51 H new ATOM 0 HG LEU A 113 35.078 4.920 -35.106 1.00 41.21 H new ATOM 0 HD11 LEU A 113 33.778 3.525 -36.666 1.00 71.34 H new ATOM 0 HD12 LEU A 113 32.845 4.932 -36.105 1.00 71.34 H new ATOM 0 HD13 LEU A 113 33.559 4.931 -37.735 1.00 71.34 H new ATOM 0 HD21 LEU A 113 36.232 3.659 -36.881 1.00 71.14 H new ATOM 0 HD22 LEU A 113 36.109 5.070 -37.958 1.00 71.14 H new ATOM 0 HD23 LEU A 113 37.090 5.164 -36.477 1.00 71.14 H new ATOM 1650 N SER A 114 34.287 9.249 -34.378 1.00 12.42 N ATOM 1651 CA SER A 114 33.436 9.930 -33.408 1.00 21.42 C ATOM 1652 C SER A 114 32.227 10.558 -34.094 1.00 75.05 C ATOM 1653 O SER A 114 32.332 11.086 -35.202 1.00 53.32 O ATOM 1654 CB SER A 114 34.233 11.005 -32.666 1.00 14.32 C ATOM 1655 OG SER A 114 33.914 12.298 -33.147 1.00 53.32 O ATOM 0 H SER A 114 34.356 9.718 -35.281 1.00 12.42 H new ATOM 0 HA SER A 114 33.081 9.191 -32.690 1.00 21.42 H new ATOM 0 HB2 SER A 114 34.020 10.948 -31.598 1.00 14.32 H new ATOM 0 HB3 SER A 114 35.300 10.821 -32.789 1.00 14.32 H new ATOM 0 HG SER A 114 34.435 12.967 -32.656 1.00 53.32 H new ATOM 1660 N CYS A 115 31.079 10.500 -33.427 1.00 10.44 N ATOM 1661 CA CYS A 115 29.848 11.062 -33.970 1.00 64.21 C ATOM 1662 C CYS A 115 29.745 12.552 -33.652 1.00 24.33 C ATOM 1663 O CYS A 115 30.628 13.123 -33.012 1.00 32.51 O ATOM 1664 CB CYS A 115 28.633 10.324 -33.407 1.00 4.11 C ATOM 1665 SG CYS A 115 27.306 10.040 -34.623 1.00 51.34 S ATOM 0 H CYS A 115 30.976 10.069 -32.508 1.00 10.44 H new ATOM 0 HA CYS A 115 29.868 10.939 -35.053 1.00 64.21 H new ATOM 0 HB2 CYS A 115 28.958 9.363 -33.008 1.00 4.11 H new ATOM 0 HB3 CYS A 115 28.229 10.896 -32.571 1.00 4.11 H new ATOM 0 HG CYS A 115 26.160 10.351 -34.095 1.00 51.34 H new ATOM 1669 N ARG A 116 28.661 13.173 -34.105 1.00 0.52 N ATOM 1670 CA ARG A 116 28.442 14.595 -33.869 1.00 1.41 C ATOM 1671 C ARG A 116 27.225 14.817 -32.976 1.00 50.05 C ATOM 1672 O ARG A 116 26.577 15.863 -33.039 1.00 45.21 O ATOM 1673 CB ARG A 116 28.253 15.330 -35.198 1.00 3.21 C ATOM 1674 CG ARG A 116 29.529 15.450 -36.013 1.00 23.30 C ATOM 1675 CD ARG A 116 29.531 14.488 -37.190 1.00 31.13 C ATOM 1676 NE ARG A 116 30.873 14.000 -37.497 1.00 32.23 N ATOM 1677 CZ ARG A 116 31.170 13.302 -38.588 1.00 3.14 C ATOM 1678 NH1 ARG A 116 30.224 13.012 -39.470 1.00 31.43 N ATOM 1679 NH2 ARG A 116 32.415 12.893 -38.797 1.00 12.42 N ATOM 0 H ARG A 116 27.921 12.714 -34.637 1.00 0.52 H new ATOM 0 HA ARG A 116 29.321 14.993 -33.362 1.00 1.41 H new ATOM 0 HB2 ARG A 116 27.502 14.807 -35.789 1.00 3.21 H new ATOM 0 HB3 ARG A 116 27.863 16.328 -34.999 1.00 3.21 H new ATOM 0 HG2 ARG A 116 29.635 16.472 -36.377 1.00 23.30 H new ATOM 0 HG3 ARG A 116 30.390 15.248 -35.375 1.00 23.30 H new ATOM 0 HD2 ARG A 116 28.880 13.642 -36.968 1.00 31.13 H new ATOM 0 HD3 ARG A 116 29.118 14.987 -38.066 1.00 31.13 H new ATOM 0 HE ARG A 116 31.623 14.206 -36.838 1.00 32.23 H new ATOM 0 HH11 ARG A 116 29.266 13.325 -39.312 1.00 31.43 H new ATOM 0 HH12 ARG A 116 30.454 12.476 -40.307 1.00 31.43 H new ATOM 0 HH21 ARG A 116 33.145 13.114 -38.120 1.00 12.42 H new ATOM 0 HH22 ARG A 116 32.642 12.357 -39.635 1.00 12.42 H new ATOM 1690 N CYS A 117 26.919 13.827 -32.144 1.00 23.24 N ATOM 1691 CA CYS A 117 25.781 13.913 -31.238 1.00 1.54 C ATOM 1692 C CYS A 117 26.204 13.616 -29.802 1.00 24.21 C ATOM 1693 O CYS A 117 25.793 14.303 -28.868 1.00 41.25 O ATOM 1694 CB CYS A 117 24.685 12.936 -31.669 1.00 11.12 C ATOM 1695 SG CYS A 117 25.265 11.226 -31.909 1.00 53.51 S ATOM 0 H CYS A 117 27.444 12.955 -32.079 1.00 23.24 H new ATOM 0 HA CYS A 117 25.391 14.930 -31.281 1.00 1.54 H new ATOM 0 HB2 CYS A 117 23.895 12.938 -30.918 1.00 11.12 H new ATOM 0 HB3 CYS A 117 24.241 13.292 -32.599 1.00 11.12 H new ATOM 0 HG CYS A 117 24.594 10.672 -32.875 1.00 53.51 H new ATOM 1699 N GLY A 118 27.031 12.589 -29.634 1.00 24.24 N ATOM 1700 CA GLY A 118 27.497 12.219 -28.311 1.00 21.21 C ATOM 1701 C GLY A 118 28.168 10.860 -28.291 1.00 42.43 C ATOM 1702 O GLY A 118 29.069 10.616 -27.489 1.00 73.21 O ATOM 0 H GLY A 118 27.387 12.006 -30.392 1.00 24.24 H new ATOM 0 HA2 GLY A 118 28.199 12.972 -27.953 1.00 21.21 H new ATOM 0 HA3 GLY A 118 26.654 12.214 -27.620 1.00 21.21 H new ATOM 1706 N GLY A 119 27.726 9.971 -29.175 1.00 3.53 N ATOM 1707 CA GLY A 119 28.300 8.639 -29.237 1.00 51.20 C ATOM 1708 C GLY A 119 29.678 8.630 -29.868 1.00 12.50 C ATOM 1709 O GLY A 119 30.118 9.632 -30.430 1.00 50.25 O ATOM 0 H GLY A 119 26.981 10.149 -29.849 1.00 3.53 H new ATOM 0 HA2 GLY A 119 28.362 8.226 -28.230 1.00 51.20 H new ATOM 0 HA3 GLY A 119 27.638 7.988 -29.808 1.00 51.20 H new ATOM 1713 N LYS A 120 30.362 7.495 -29.775 1.00 2.21 N ATOM 1714 CA LYS A 120 31.699 7.358 -30.341 1.00 52.04 C ATOM 1715 C LYS A 120 32.010 5.898 -30.655 1.00 3.21 C ATOM 1716 O LYS A 120 31.286 4.995 -30.235 1.00 62.22 O ATOM 1717 CB LYS A 120 32.745 7.918 -29.374 1.00 53.21 C ATOM 1718 CG LYS A 120 32.450 7.612 -27.916 1.00 73.02 C ATOM 1719 CD LYS A 120 32.504 6.120 -27.637 1.00 34.34 C ATOM 1720 CE LYS A 120 32.730 5.836 -26.160 1.00 71.31 C ATOM 1721 NZ LYS A 120 32.592 4.388 -25.845 1.00 13.44 N ATOM 0 H LYS A 120 30.012 6.656 -29.313 1.00 2.21 H new ATOM 0 HA LYS A 120 31.733 7.926 -31.271 1.00 52.04 H new ATOM 0 HB2 LYS A 120 33.722 7.509 -29.632 1.00 53.21 H new ATOM 0 HB3 LYS A 120 32.807 8.998 -29.505 1.00 53.21 H new ATOM 0 HG2 LYS A 120 33.171 8.128 -27.282 1.00 73.02 H new ATOM 0 HG3 LYS A 120 31.464 7.996 -27.655 1.00 73.02 H new ATOM 0 HD2 LYS A 120 31.573 5.655 -27.959 1.00 34.34 H new ATOM 0 HD3 LYS A 120 33.305 5.668 -28.222 1.00 34.34 H new ATOM 0 HE2 LYS A 120 33.725 6.177 -25.873 1.00 71.31 H new ATOM 0 HE3 LYS A 120 32.015 6.406 -25.567 1.00 71.31 H new ATOM 0 HZ1 LYS A 120 32.753 4.237 -24.829 1.00 13.44 H new ATOM 0 HZ2 LYS A 120 31.634 4.068 -26.095 1.00 13.44 H new ATOM 0 HZ3 LYS A 120 33.292 3.846 -26.391 1.00 13.44 H new ATOM 1731 N TYR A 121 33.093 5.674 -31.392 1.00 74.43 N ATOM 1732 CA TYR A 121 33.500 4.324 -31.762 1.00 14.43 C ATOM 1733 C TYR A 121 35.001 4.259 -32.021 1.00 34.22 C ATOM 1734 O TYR A 121 35.673 5.287 -32.104 1.00 10.31 O ATOM 1735 CB TYR A 121 32.735 3.860 -33.003 1.00 61.42 C ATOM 1736 CG TYR A 121 31.839 4.924 -33.595 1.00 53.14 C ATOM 1737 CD1 TYR A 121 32.373 6.066 -34.180 1.00 32.11 C ATOM 1738 CD2 TYR A 121 30.456 4.788 -33.569 1.00 51.33 C ATOM 1739 CE1 TYR A 121 31.558 7.041 -34.720 1.00 30.10 C ATOM 1740 CE2 TYR A 121 29.632 5.758 -34.109 1.00 1.42 C ATOM 1741 CZ TYR A 121 30.188 6.883 -34.682 1.00 33.25 C ATOM 1742 OH TYR A 121 29.372 7.851 -35.222 1.00 11.33 O ATOM 0 H TYR A 121 33.704 6.410 -31.745 1.00 74.43 H new ATOM 0 HA TYR A 121 33.265 3.660 -30.930 1.00 14.43 H new ATOM 0 HB2 TYR A 121 33.449 3.536 -33.760 1.00 61.42 H new ATOM 0 HB3 TYR A 121 32.130 2.991 -32.743 1.00 61.42 H new ATOM 0 HD1 TYR A 121 33.445 6.193 -34.213 1.00 32.11 H new ATOM 0 HD2 TYR A 121 30.017 3.909 -33.119 1.00 51.33 H new ATOM 0 HE1 TYR A 121 31.991 7.922 -35.170 1.00 30.10 H new ATOM 0 HE2 TYR A 121 28.559 5.636 -34.082 1.00 1.42 H new ATOM 0 HH TYR A 121 28.626 8.028 -34.612 1.00 11.33 H new ATOM 1751 N SER A 122 35.520 3.043 -32.152 1.00 23.25 N ATOM 1752 CA SER A 122 36.944 2.841 -32.399 1.00 55.20 C ATOM 1753 C SER A 122 37.198 1.470 -33.018 1.00 62.41 C ATOM 1754 O SER A 122 37.001 0.439 -32.375 1.00 75.11 O ATOM 1755 CB SER A 122 37.734 2.981 -31.097 1.00 1.14 C ATOM 1756 OG SER A 122 36.916 2.710 -29.972 1.00 12.11 O ATOM 0 H SER A 122 34.976 2.182 -32.091 1.00 23.25 H new ATOM 0 HA SER A 122 37.278 3.605 -33.101 1.00 55.20 H new ATOM 0 HB2 SER A 122 38.582 2.296 -31.107 1.00 1.14 H new ATOM 0 HB3 SER A 122 38.140 3.990 -31.021 1.00 1.14 H new ATOM 0 HG SER A 122 37.445 2.805 -29.152 1.00 12.11 H new ATOM 1761 N VAL A 123 37.640 1.467 -34.273 1.00 12.40 N ATOM 1762 CA VAL A 123 37.924 0.225 -34.980 1.00 13.32 C ATOM 1763 C VAL A 123 39.410 0.098 -35.294 1.00 34.51 C ATOM 1764 O VAL A 123 39.953 0.866 -36.089 1.00 65.22 O ATOM 1765 CB VAL A 123 37.121 0.129 -36.292 1.00 63.02 C ATOM 1766 CG1 VAL A 123 37.166 -1.287 -36.843 1.00 12.52 C ATOM 1767 CG2 VAL A 123 35.685 0.580 -36.072 1.00 2.20 C ATOM 0 H VAL A 123 37.809 2.311 -34.820 1.00 12.40 H new ATOM 0 HA VAL A 123 37.625 -0.590 -34.320 1.00 13.32 H new ATOM 0 HB VAL A 123 37.577 0.793 -37.026 1.00 63.02 H new ATOM 0 HG11 VAL A 123 36.594 -1.335 -37.769 1.00 12.52 H new ATOM 0 HG12 VAL A 123 38.201 -1.568 -37.041 1.00 12.52 H new ATOM 0 HG13 VAL A 123 36.736 -1.975 -36.115 1.00 12.52 H new ATOM 0 HG21 VAL A 123 35.133 0.506 -37.009 1.00 2.20 H new ATOM 0 HG22 VAL A 123 35.215 -0.056 -35.322 1.00 2.20 H new ATOM 0 HG23 VAL A 123 35.677 1.614 -35.727 1.00 2.20 H new ATOM 1777 N SER A 124 40.061 -0.875 -34.668 1.00 22.43 N ATOM 1778 CA SER A 124 41.487 -1.100 -34.878 1.00 32.24 C ATOM 1779 C SER A 124 41.765 -1.502 -36.325 1.00 44.30 C ATOM 1780 O SER A 124 40.845 -1.788 -37.090 1.00 33.21 O ATOM 1781 CB SER A 124 42.000 -2.185 -33.928 1.00 73.30 C ATOM 1782 OG SER A 124 43.064 -1.699 -33.129 1.00 15.42 O ATOM 0 H SER A 124 39.625 -1.521 -34.011 1.00 22.43 H new ATOM 0 HA SER A 124 42.012 -0.168 -34.670 1.00 32.24 H new ATOM 0 HB2 SER A 124 41.187 -2.527 -33.288 1.00 73.30 H new ATOM 0 HB3 SER A 124 42.337 -3.047 -34.503 1.00 73.30 H new ATOM 0 HG SER A 124 43.374 -2.409 -32.529 1.00 15.42 H new ATOM 1787 N LYS A 125 43.042 -1.520 -36.690 1.00 11.14 N ATOM 1788 CA LYS A 125 43.445 -1.888 -38.043 1.00 44.52 C ATOM 1789 C LYS A 125 42.929 -3.276 -38.406 1.00 34.32 C ATOM 1790 O LYS A 125 42.122 -3.427 -39.325 1.00 72.04 O ATOM 1791 CB LYS A 125 44.970 -1.850 -38.170 1.00 34.45 C ATOM 1792 CG LYS A 125 45.480 -2.334 -39.516 1.00 32.43 C ATOM 1793 CD LYS A 125 46.853 -1.766 -39.830 1.00 64.44 C ATOM 1794 CE LYS A 125 46.991 -1.422 -41.306 1.00 4.11 C ATOM 1795 NZ LYS A 125 48.384 -1.620 -41.794 1.00 32.14 N ATOM 0 H LYS A 125 43.816 -1.284 -36.069 1.00 11.14 H new ATOM 0 HA LYS A 125 43.010 -1.166 -38.734 1.00 44.52 H new ATOM 0 HB2 LYS A 125 45.315 -0.829 -38.006 1.00 34.45 H new ATOM 0 HB3 LYS A 125 45.407 -2.464 -37.383 1.00 34.45 H new ATOM 0 HG2 LYS A 125 45.527 -3.423 -39.518 1.00 32.43 H new ATOM 0 HG3 LYS A 125 44.778 -2.044 -40.298 1.00 32.43 H new ATOM 0 HD2 LYS A 125 47.024 -0.872 -39.230 1.00 64.44 H new ATOM 0 HD3 LYS A 125 47.619 -2.489 -39.551 1.00 64.44 H new ATOM 0 HE2 LYS A 125 46.310 -2.043 -41.889 1.00 4.11 H new ATOM 0 HE3 LYS A 125 46.694 -0.386 -41.467 1.00 4.11 H new ATOM 0 HZ1 LYS A 125 48.436 -1.375 -42.803 1.00 32.14 H new ATOM 0 HZ2 LYS A 125 49.031 -1.009 -41.255 1.00 32.14 H new ATOM 0 HZ3 LYS A 125 48.659 -2.615 -41.664 1.00 32.14 H new ATOM 1805 N ASP A 126 43.396 -4.285 -37.682 1.00 5.12 N ATOM 1806 CA ASP A 126 42.980 -5.661 -37.927 1.00 71.53 C ATOM 1807 C ASP A 126 41.483 -5.827 -37.680 1.00 71.21 C ATOM 1808 O ASP A 126 40.847 -6.715 -38.246 1.00 31.32 O ATOM 1809 CB ASP A 126 43.766 -6.622 -37.034 1.00 52.21 C ATOM 1810 CG ASP A 126 45.174 -6.864 -37.542 1.00 34.15 C ATOM 1811 OD1 ASP A 126 45.450 -6.519 -38.711 1.00 0.11 O ATOM 1812 OD2 ASP A 126 45.999 -7.397 -36.771 1.00 21.24 O ATOM 0 H ASP A 126 44.064 -4.177 -36.919 1.00 5.12 H new ATOM 0 HA ASP A 126 43.187 -5.897 -38.971 1.00 71.53 H new ATOM 0 HB2 ASP A 126 43.812 -6.218 -36.023 1.00 52.21 H new ATOM 0 HB3 ASP A 126 43.236 -7.573 -36.974 1.00 52.21 H new ATOM 1816 N GLU A 127 40.930 -4.967 -36.832 1.00 11.21 N ATOM 1817 CA GLU A 127 39.509 -5.021 -36.509 1.00 52.15 C ATOM 1818 C GLU A 127 38.663 -4.581 -37.701 1.00 44.12 C ATOM 1819 O GLU A 127 37.683 -5.235 -38.055 1.00 32.51 O ATOM 1820 CB GLU A 127 39.203 -4.135 -35.300 1.00 4.33 C ATOM 1821 CG GLU A 127 38.130 -4.702 -34.386 1.00 55.42 C ATOM 1822 CD GLU A 127 38.515 -4.637 -32.921 1.00 23.03 C ATOM 1823 OE1 GLU A 127 38.984 -3.568 -32.478 1.00 50.14 O ATOM 1824 OE2 GLU A 127 38.350 -5.656 -32.218 1.00 5.05 O ATOM 0 H GLU A 127 41.443 -4.225 -36.356 1.00 11.21 H new ATOM 0 HA GLU A 127 39.258 -6.054 -36.267 1.00 52.15 H new ATOM 0 HB2 GLU A 127 40.118 -3.990 -34.726 1.00 4.33 H new ATOM 0 HB3 GLU A 127 38.888 -3.152 -35.651 1.00 4.33 H new ATOM 0 HG2 GLU A 127 37.201 -4.152 -34.538 1.00 55.42 H new ATOM 0 HG3 GLU A 127 37.935 -5.739 -34.661 1.00 55.42 H new ATOM 1829 N ALA A 128 39.051 -3.468 -38.315 1.00 15.22 N ATOM 1830 CA ALA A 128 38.330 -2.940 -39.467 1.00 1.14 C ATOM 1831 C ALA A 128 38.211 -3.990 -40.567 1.00 13.42 C ATOM 1832 O ALA A 128 37.238 -4.005 -41.320 1.00 74.34 O ATOM 1833 CB ALA A 128 39.023 -1.694 -39.997 1.00 71.23 C ATOM 0 H ALA A 128 39.860 -2.915 -38.034 1.00 15.22 H new ATOM 0 HA ALA A 128 37.324 -2.673 -39.145 1.00 1.14 H new ATOM 0 HB1 ALA A 128 38.474 -1.310 -40.857 1.00 71.23 H new ATOM 0 HB2 ALA A 128 39.052 -0.934 -39.216 1.00 71.23 H new ATOM 0 HB3 ALA A 128 40.040 -1.944 -40.298 1.00 71.23 H new ATOM 1839 N GLU A 129 39.207 -4.866 -40.654 1.00 4.22 N ATOM 1840 CA GLU A 129 39.213 -5.918 -41.664 1.00 2.30 C ATOM 1841 C GLU A 129 38.116 -6.943 -41.389 1.00 41.34 C ATOM 1842 O GLU A 129 37.650 -7.626 -42.299 1.00 14.31 O ATOM 1843 CB GLU A 129 40.576 -6.612 -41.701 1.00 4.41 C ATOM 1844 CG GLU A 129 40.613 -7.833 -42.604 1.00 32.23 C ATOM 1845 CD GLU A 129 40.019 -7.564 -43.973 1.00 15.11 C ATOM 1846 OE1 GLU A 129 40.355 -6.522 -44.572 1.00 63.21 O ATOM 1847 OE2 GLU A 129 39.216 -8.396 -44.445 1.00 32.13 O ATOM 0 H GLU A 129 40.020 -4.868 -40.038 1.00 4.22 H new ATOM 0 HA GLU A 129 39.021 -5.457 -42.633 1.00 2.30 H new ATOM 0 HB2 GLU A 129 41.328 -5.899 -42.038 1.00 4.41 H new ATOM 0 HB3 GLU A 129 40.850 -6.911 -40.689 1.00 4.41 H new ATOM 0 HG2 GLU A 129 41.645 -8.164 -42.719 1.00 32.23 H new ATOM 0 HG3 GLU A 129 40.067 -8.648 -42.129 1.00 32.23 H new ATOM 1852 N GLU A 130 37.709 -7.042 -40.127 1.00 44.51 N ATOM 1853 CA GLU A 130 36.668 -7.983 -39.732 1.00 21.02 C ATOM 1854 C GLU A 130 35.311 -7.291 -39.652 1.00 14.44 C ATOM 1855 O GLU A 130 34.271 -7.914 -39.865 1.00 54.14 O ATOM 1856 CB GLU A 130 37.009 -8.618 -38.382 1.00 43.10 C ATOM 1857 CG GLU A 130 37.239 -10.119 -38.456 1.00 4.30 C ATOM 1858 CD GLU A 130 36.472 -10.880 -37.391 1.00 65.34 C ATOM 1859 OE1 GLU A 130 36.946 -10.918 -36.236 1.00 0.53 O ATOM 1860 OE2 GLU A 130 35.402 -11.435 -37.712 1.00 22.41 O ATOM 0 H GLU A 130 38.084 -6.482 -39.361 1.00 44.51 H new ATOM 0 HA GLU A 130 36.614 -8.764 -40.490 1.00 21.02 H new ATOM 0 HB2 GLU A 130 37.904 -8.141 -37.981 1.00 43.10 H new ATOM 0 HB3 GLU A 130 36.199 -8.417 -37.681 1.00 43.10 H new ATOM 0 HG2 GLU A 130 36.942 -10.480 -39.440 1.00 4.30 H new ATOM 0 HG3 GLU A 130 38.304 -10.325 -38.349 1.00 4.30 H new ATOM 1865 N VAL A 131 35.330 -5.999 -39.342 1.00 53.53 N ATOM 1866 CA VAL A 131 34.100 -5.220 -39.234 1.00 24.45 C ATOM 1867 C VAL A 131 34.091 -4.069 -40.233 1.00 40.32 C ATOM 1868 O VAL A 131 35.000 -3.239 -40.248 1.00 54.34 O ATOM 1869 CB VAL A 131 33.917 -4.655 -37.813 1.00 22.13 C ATOM 1870 CG1 VAL A 131 33.687 -5.781 -36.816 1.00 24.24 C ATOM 1871 CG2 VAL A 131 35.123 -3.817 -37.414 1.00 54.33 C ATOM 0 H VAL A 131 36.182 -5.469 -39.161 1.00 53.53 H new ATOM 0 HA VAL A 131 33.275 -5.897 -39.456 1.00 24.45 H new ATOM 0 HB VAL A 131 33.037 -4.011 -37.807 1.00 22.13 H new ATOM 0 HG11 VAL A 131 33.560 -5.363 -35.818 1.00 24.24 H new ATOM 0 HG12 VAL A 131 32.791 -6.336 -37.094 1.00 24.24 H new ATOM 0 HG13 VAL A 131 34.545 -6.453 -36.821 1.00 24.24 H new ATOM 0 HG21 VAL A 131 34.977 -3.426 -36.407 1.00 54.33 H new ATOM 0 HG22 VAL A 131 36.020 -4.436 -37.436 1.00 54.33 H new ATOM 0 HG23 VAL A 131 35.237 -2.988 -38.113 1.00 54.33 H new ATOM 1881 N SER A 132 33.055 -4.024 -41.065 1.00 44.24 N ATOM 1882 CA SER A 132 32.928 -2.974 -42.069 1.00 12.13 C ATOM 1883 C SER A 132 31.698 -2.112 -41.801 1.00 33.30 C ATOM 1884 O SER A 132 31.619 -0.966 -42.247 1.00 32.03 O ATOM 1885 CB SER A 132 32.839 -3.588 -43.469 1.00 63.35 C ATOM 1886 OG SER A 132 34.121 -3.680 -44.067 1.00 52.34 O ATOM 0 H SER A 132 32.293 -4.701 -41.064 1.00 44.24 H new ATOM 0 HA SER A 132 33.813 -2.341 -42.012 1.00 12.13 H new ATOM 0 HB2 SER A 132 32.391 -4.580 -43.407 1.00 63.35 H new ATOM 0 HB3 SER A 132 32.185 -2.981 -44.095 1.00 63.35 H new ATOM 0 HG SER A 132 34.038 -4.077 -44.959 1.00 52.34 H new ATOM 1891 N LEU A 133 30.740 -2.670 -41.069 1.00 2.12 N ATOM 1892 CA LEU A 133 29.513 -1.953 -40.740 1.00 15.14 C ATOM 1893 C LEU A 133 29.488 -1.565 -39.265 1.00 50.12 C ATOM 1894 O LEU A 133 29.563 -2.423 -38.385 1.00 24.43 O ATOM 1895 CB LEU A 133 28.292 -2.813 -41.073 1.00 20.10 C ATOM 1896 CG LEU A 133 26.969 -2.065 -41.239 1.00 63.23 C ATOM 1897 CD1 LEU A 133 26.517 -1.478 -39.910 1.00 70.35 C ATOM 1898 CD2 LEU A 133 27.103 -0.970 -42.289 1.00 1.24 C ATOM 0 H LEU A 133 30.789 -3.617 -40.692 1.00 2.12 H new ATOM 0 HA LEU A 133 29.482 -1.042 -41.337 1.00 15.14 H new ATOM 0 HB2 LEU A 133 28.497 -3.357 -41.995 1.00 20.10 H new ATOM 0 HB3 LEU A 133 28.170 -3.556 -40.285 1.00 20.10 H new ATOM 0 HG LEU A 133 26.213 -2.774 -41.576 1.00 63.23 H new ATOM 0 HD11 LEU A 133 25.574 -0.949 -40.048 1.00 70.35 H new ATOM 0 HD12 LEU A 133 26.381 -2.281 -39.185 1.00 70.35 H new ATOM 0 HD13 LEU A 133 27.272 -0.783 -39.544 1.00 70.35 H new ATOM 0 HD21 LEU A 133 26.152 -0.448 -42.394 1.00 1.24 H new ATOM 0 HD22 LEU A 133 27.873 -0.263 -41.981 1.00 1.24 H new ATOM 0 HD23 LEU A 133 27.380 -1.414 -43.245 1.00 1.24 H new ATOM 1909 N ILE A 134 29.380 -0.267 -39.003 1.00 44.11 N ATOM 1910 CA ILE A 134 29.341 0.235 -37.634 1.00 23.25 C ATOM 1911 C ILE A 134 28.202 1.230 -37.445 1.00 62.43 C ATOM 1912 O ILE A 134 27.991 2.112 -38.278 1.00 54.33 O ATOM 1913 CB ILE A 134 30.669 0.911 -37.246 1.00 2.42 C ATOM 1914 CG1 ILE A 134 30.730 1.133 -35.733 1.00 2.12 C ATOM 1915 CG2 ILE A 134 30.829 2.230 -37.986 1.00 51.14 C ATOM 1916 CD1 ILE A 134 32.036 1.736 -35.262 1.00 15.24 C ATOM 0 H ILE A 134 29.318 0.456 -39.720 1.00 44.11 H new ATOM 0 HA ILE A 134 29.178 -0.626 -36.986 1.00 23.25 H new ATOM 0 HB ILE A 134 31.491 0.254 -37.532 1.00 2.42 H new ATOM 0 HG12 ILE A 134 29.910 1.787 -35.437 1.00 2.12 H new ATOM 0 HG13 ILE A 134 30.576 0.180 -35.228 1.00 2.12 H new ATOM 0 HG21 ILE A 134 31.773 2.695 -37.701 1.00 51.14 H new ATOM 0 HG22 ILE A 134 30.825 2.047 -39.061 1.00 51.14 H new ATOM 0 HG23 ILE A 134 30.004 2.894 -37.728 1.00 51.14 H new ATOM 0 HD11 ILE A 134 32.008 1.865 -34.180 1.00 15.24 H new ATOM 0 HD12 ILE A 134 32.859 1.073 -35.527 1.00 15.24 H new ATOM 0 HD13 ILE A 134 32.182 2.705 -35.739 1.00 15.24 H new ATOM 1927 N SER A 135 27.473 1.084 -36.344 1.00 71.25 N ATOM 1928 CA SER A 135 26.353 1.971 -36.047 1.00 52.30 C ATOM 1929 C SER A 135 26.636 2.804 -34.800 1.00 23.41 C ATOM 1930 O SER A 135 27.484 2.447 -33.981 1.00 55.55 O ATOM 1931 CB SER A 135 25.071 1.158 -35.850 1.00 62.23 C ATOM 1932 OG SER A 135 25.103 0.445 -34.626 1.00 33.32 O ATOM 0 H SER A 135 27.637 0.361 -35.643 1.00 71.25 H new ATOM 0 HA SER A 135 26.221 2.646 -36.892 1.00 52.30 H new ATOM 0 HB2 SER A 135 24.208 1.824 -35.864 1.00 62.23 H new ATOM 0 HB3 SER A 135 24.948 0.460 -36.678 1.00 62.23 H new ATOM 0 HG SER A 135 24.273 -0.065 -34.523 1.00 33.32 H new ATOM 1937 N CYS A 136 25.922 3.915 -34.665 1.00 71.14 N ATOM 1938 CA CYS A 136 26.096 4.802 -33.520 1.00 0.45 C ATOM 1939 C CYS A 136 25.097 4.468 -32.417 1.00 24.12 C ATOM 1940 O CYS A 136 23.908 4.281 -32.678 1.00 23.33 O ATOM 1941 CB CYS A 136 25.933 6.261 -33.948 1.00 11.43 C ATOM 1942 SG CYS A 136 25.905 7.435 -32.573 1.00 5.20 S ATOM 0 H CYS A 136 25.217 4.224 -35.334 1.00 71.14 H new ATOM 0 HA CYS A 136 27.103 4.657 -33.129 1.00 0.45 H new ATOM 0 HB2 CYS A 136 26.750 6.525 -34.620 1.00 11.43 H new ATOM 0 HB3 CYS A 136 25.008 6.361 -34.516 1.00 11.43 H new ATOM 0 HG CYS A 136 26.378 8.579 -32.970 1.00 5.20 H new ATOM 1946 N ASP A 137 25.587 4.392 -31.184 1.00 22.43 N ATOM 1947 CA ASP A 137 24.738 4.079 -30.042 1.00 42.31 C ATOM 1948 C ASP A 137 24.224 5.355 -29.381 1.00 55.11 C ATOM 1949 O ASP A 137 24.396 5.559 -28.179 1.00 12.45 O ATOM 1950 CB ASP A 137 25.507 3.238 -29.021 1.00 61.51 C ATOM 1951 CG ASP A 137 26.031 1.945 -29.615 1.00 31.30 C ATOM 1952 OD1 ASP A 137 25.295 1.312 -30.400 1.00 54.21 O ATOM 1953 OD2 ASP A 137 27.177 1.566 -29.295 1.00 5.13 O ATOM 0 H ASP A 137 26.568 4.543 -30.951 1.00 22.43 H new ATOM 0 HA ASP A 137 23.884 3.507 -30.403 1.00 42.31 H new ATOM 0 HB2 ASP A 137 26.342 3.820 -28.630 1.00 61.51 H new ATOM 0 HB3 ASP A 137 24.855 3.009 -28.178 1.00 61.51 H new ATOM 1957 N THR A 138 23.592 6.214 -30.177 1.00 5.04 N ATOM 1958 CA THR A 138 23.055 7.470 -29.671 1.00 74.31 C ATOM 1959 C THR A 138 22.023 8.051 -30.630 1.00 53.13 C ATOM 1960 O THR A 138 20.963 8.520 -30.209 1.00 22.23 O ATOM 1961 CB THR A 138 24.171 8.508 -29.445 1.00 13.03 C ATOM 1962 OG1 THR A 138 25.107 8.018 -28.478 1.00 52.44 O ATOM 1963 CG2 THR A 138 23.590 9.832 -28.973 1.00 45.30 C ATOM 0 H THR A 138 23.440 6.061 -31.174 1.00 5.04 H new ATOM 0 HA THR A 138 22.577 7.248 -28.717 1.00 74.31 H new ATOM 0 HB THR A 138 24.683 8.672 -30.393 1.00 13.03 H new ATOM 0 HG1 THR A 138 24.721 7.248 -28.010 1.00 52.44 H new ATOM 0 HG21 THR A 138 24.396 10.549 -28.820 1.00 45.30 H new ATOM 0 HG22 THR A 138 22.901 10.216 -29.725 1.00 45.30 H new ATOM 0 HG23 THR A 138 23.056 9.681 -28.035 1.00 45.30 H new ATOM 1971 N CYS A 139 22.335 8.019 -31.921 1.00 65.10 N ATOM 1972 CA CYS A 139 21.435 8.543 -32.940 1.00 20.11 C ATOM 1973 C CYS A 139 21.251 7.536 -34.073 1.00 62.45 C ATOM 1974 O CYS A 139 22.132 6.719 -34.339 1.00 11.21 O ATOM 1975 CB CYS A 139 21.973 9.862 -33.497 1.00 23.42 C ATOM 1976 SG CYS A 139 23.423 9.673 -34.584 1.00 43.22 S ATOM 0 H CYS A 139 23.206 7.635 -32.286 1.00 65.10 H new ATOM 0 HA CYS A 139 20.465 8.722 -32.475 1.00 20.11 H new ATOM 0 HB2 CYS A 139 21.179 10.361 -34.052 1.00 23.42 H new ATOM 0 HB3 CYS A 139 22.238 10.514 -32.665 1.00 23.42 H new ATOM 0 HG CYS A 139 24.315 8.935 -33.993 1.00 43.22 H new ATOM 1980 N SER A 140 20.102 7.604 -34.736 1.00 42.22 N ATOM 1981 CA SER A 140 19.800 6.697 -35.838 1.00 3.40 C ATOM 1982 C SER A 140 20.689 6.992 -37.043 1.00 42.42 C ATOM 1983 O SER A 140 20.309 7.745 -37.940 1.00 53.23 O ATOM 1984 CB SER A 140 18.327 6.815 -36.235 1.00 23.21 C ATOM 1985 OG SER A 140 17.728 7.953 -35.640 1.00 30.33 O ATOM 0 H SER A 140 19.364 8.278 -34.530 1.00 42.22 H new ATOM 0 HA SER A 140 19.998 5.679 -35.503 1.00 3.40 H new ATOM 0 HB2 SER A 140 18.244 6.882 -37.320 1.00 23.21 H new ATOM 0 HB3 SER A 140 17.791 5.916 -35.929 1.00 23.21 H new ATOM 0 HG SER A 140 18.157 8.765 -35.982 1.00 30.33 H new ATOM 1990 N LEU A 141 21.875 6.394 -37.055 1.00 3.33 N ATOM 1991 CA LEU A 141 22.820 6.590 -38.149 1.00 50.23 C ATOM 1992 C LEU A 141 23.841 5.458 -38.197 1.00 52.04 C ATOM 1993 O LEU A 141 24.240 4.925 -37.161 1.00 60.44 O ATOM 1994 CB LEU A 141 23.536 7.933 -37.996 1.00 41.52 C ATOM 1995 CG LEU A 141 24.861 8.077 -38.744 1.00 31.15 C ATOM 1996 CD1 LEU A 141 24.635 8.006 -40.246 1.00 23.30 C ATOM 1997 CD2 LEU A 141 25.548 9.381 -38.367 1.00 1.31 C ATOM 0 H LEU A 141 22.205 5.769 -36.319 1.00 3.33 H new ATOM 0 HA LEU A 141 22.260 6.588 -39.084 1.00 50.23 H new ATOM 0 HB2 LEU A 141 22.863 8.721 -38.335 1.00 41.52 H new ATOM 0 HB3 LEU A 141 23.720 8.105 -36.936 1.00 41.52 H new ATOM 0 HG LEU A 141 25.511 7.251 -38.455 1.00 31.15 H new ATOM 0 HD11 LEU A 141 25.589 8.110 -40.763 1.00 23.30 H new ATOM 0 HD12 LEU A 141 24.187 7.046 -40.502 1.00 23.30 H new ATOM 0 HD13 LEU A 141 23.967 8.811 -40.552 1.00 23.30 H new ATOM 0 HD21 LEU A 141 26.490 9.466 -38.909 1.00 1.31 H new ATOM 0 HD22 LEU A 141 24.903 10.220 -38.626 1.00 1.31 H new ATOM 0 HD23 LEU A 141 25.744 9.392 -37.295 1.00 1.31 H new ATOM 2008 N ILE A 142 24.262 5.099 -39.405 1.00 54.20 N ATOM 2009 CA ILE A 142 25.240 4.033 -39.587 1.00 53.12 C ATOM 2010 C ILE A 142 26.227 4.377 -40.696 1.00 72.14 C ATOM 2011 O ILE A 142 25.848 4.928 -41.729 1.00 34.32 O ATOM 2012 CB ILE A 142 24.557 2.694 -39.919 1.00 32.31 C ATOM 2013 CG1 ILE A 142 23.445 2.398 -38.910 1.00 20.34 C ATOM 2014 CG2 ILE A 142 25.579 1.567 -39.936 1.00 51.25 C ATOM 2015 CD1 ILE A 142 22.098 2.951 -39.316 1.00 51.52 C ATOM 0 H ILE A 142 23.941 5.530 -40.272 1.00 54.20 H new ATOM 0 HA ILE A 142 25.778 3.933 -38.644 1.00 53.12 H new ATOM 0 HB ILE A 142 24.111 2.768 -40.911 1.00 32.31 H new ATOM 0 HG12 ILE A 142 23.361 1.319 -38.780 1.00 20.34 H new ATOM 0 HG13 ILE A 142 23.723 2.815 -37.942 1.00 20.34 H new ATOM 0 HG21 ILE A 142 25.080 0.627 -40.172 1.00 51.25 H new ATOM 0 HG22 ILE A 142 26.337 1.775 -40.691 1.00 51.25 H new ATOM 0 HG23 ILE A 142 26.053 1.490 -38.957 1.00 51.25 H new ATOM 0 HD11 ILE A 142 21.359 2.703 -38.554 1.00 51.52 H new ATOM 0 HD12 ILE A 142 22.165 4.034 -39.418 1.00 51.52 H new ATOM 0 HD13 ILE A 142 21.798 2.515 -40.269 1.00 51.52 H new ATOM 2026 N ILE A 143 27.495 4.046 -40.475 1.00 52.23 N ATOM 2027 CA ILE A 143 28.537 4.318 -41.458 1.00 63.24 C ATOM 2028 C ILE A 143 29.320 3.053 -41.792 1.00 21.54 C ATOM 2029 O ILE A 143 29.477 2.168 -40.952 1.00 40.24 O ATOM 2030 CB ILE A 143 29.516 5.397 -40.958 1.00 40.52 C ATOM 2031 CG1 ILE A 143 29.999 5.061 -39.545 1.00 61.23 C ATOM 2032 CG2 ILE A 143 28.854 6.766 -40.986 1.00 62.20 C ATOM 2033 CD1 ILE A 143 31.505 4.968 -39.428 1.00 11.33 C ATOM 0 H ILE A 143 27.825 3.590 -39.625 1.00 52.23 H new ATOM 0 HA ILE A 143 28.037 4.681 -42.356 1.00 63.24 H new ATOM 0 HB ILE A 143 30.380 5.420 -41.622 1.00 40.52 H new ATOM 0 HG12 ILE A 143 29.635 5.822 -38.855 1.00 61.23 H new ATOM 0 HG13 ILE A 143 29.559 4.113 -39.235 1.00 61.23 H new ATOM 0 HG21 ILE A 143 29.558 7.518 -40.630 1.00 62.20 H new ATOM 0 HG22 ILE A 143 28.554 7.004 -42.006 1.00 62.20 H new ATOM 0 HG23 ILE A 143 27.975 6.758 -40.342 1.00 62.20 H new ATOM 0 HD11 ILE A 143 31.776 4.727 -38.400 1.00 11.33 H new ATOM 0 HD12 ILE A 143 31.874 4.187 -40.093 1.00 11.33 H new ATOM 0 HD13 ILE A 143 31.951 5.923 -39.707 1.00 11.33 H new ATOM 2044 N GLU A 144 29.811 2.976 -43.025 1.00 11.31 N ATOM 2045 CA GLU A 144 30.578 1.819 -43.470 1.00 24.44 C ATOM 2046 C GLU A 144 32.054 2.175 -43.632 1.00 11.31 C ATOM 2047 O GLU A 144 32.401 3.325 -43.902 1.00 53.12 O ATOM 2048 CB GLU A 144 30.023 1.288 -44.793 1.00 1.34 C ATOM 2049 CG GLU A 144 28.506 1.203 -44.826 1.00 50.24 C ATOM 2050 CD GLU A 144 27.993 0.362 -45.978 1.00 74.14 C ATOM 2051 OE1 GLU A 144 28.024 0.849 -47.128 1.00 12.22 O ATOM 2052 OE2 GLU A 144 27.560 -0.782 -45.730 1.00 23.03 O ATOM 0 H GLU A 144 29.691 3.701 -43.733 1.00 11.31 H new ATOM 0 HA GLU A 144 30.489 1.043 -42.710 1.00 24.44 H new ATOM 0 HB2 GLU A 144 30.360 1.934 -45.604 1.00 1.34 H new ATOM 0 HB3 GLU A 144 30.438 0.298 -44.980 1.00 1.34 H new ATOM 0 HG2 GLU A 144 28.149 0.781 -43.886 1.00 50.24 H new ATOM 0 HG3 GLU A 144 28.091 2.208 -44.902 1.00 50.24 H new ATOM 2057 N LEU A 145 32.918 1.179 -43.465 1.00 53.33 N ATOM 2058 CA LEU A 145 34.356 1.386 -43.592 1.00 64.22 C ATOM 2059 C LEU A 145 34.829 1.070 -45.008 1.00 44.10 C ATOM 2060 O LEU A 145 34.691 -0.058 -45.483 1.00 44.42 O ATOM 2061 CB LEU A 145 35.107 0.514 -42.585 1.00 2.03 C ATOM 2062 CG LEU A 145 34.916 0.874 -41.111 1.00 32.04 C ATOM 2063 CD1 LEU A 145 33.644 0.241 -40.568 1.00 41.34 C ATOM 2064 CD2 LEU A 145 36.123 0.435 -40.294 1.00 2.44 C ATOM 0 H LEU A 145 32.648 0.221 -43.242 1.00 53.33 H new ATOM 0 HA LEU A 145 34.567 2.435 -43.384 1.00 64.22 H new ATOM 0 HB2 LEU A 145 34.797 -0.521 -42.729 1.00 2.03 H new ATOM 0 HB3 LEU A 145 36.171 0.563 -42.815 1.00 2.03 H new ATOM 0 HG LEU A 145 34.822 1.957 -41.030 1.00 32.04 H new ATOM 0 HD11 LEU A 145 33.524 0.508 -39.518 1.00 41.34 H new ATOM 0 HD12 LEU A 145 32.786 0.604 -41.135 1.00 41.34 H new ATOM 0 HD13 LEU A 145 33.708 -0.843 -40.662 1.00 41.34 H new ATOM 0 HD21 LEU A 145 35.970 0.699 -39.248 1.00 2.44 H new ATOM 0 HD22 LEU A 145 36.248 -0.644 -40.381 1.00 2.44 H new ATOM 0 HD23 LEU A 145 37.017 0.935 -40.667 1.00 2.44 H new ATOM 2075 N LEU A 146 35.389 2.072 -45.675 1.00 72.54 N ATOM 2076 CA LEU A 146 35.885 1.902 -47.037 1.00 21.12 C ATOM 2077 C LEU A 146 37.409 1.971 -47.074 1.00 54.55 C ATOM 2078 O LEU A 146 37.998 3.028 -46.843 1.00 4.10 O ATOM 2079 CB LEU A 146 35.292 2.972 -47.954 1.00 35.42 C ATOM 2080 CG LEU A 146 33.786 3.207 -47.825 1.00 73.53 C ATOM 2081 CD1 LEU A 146 33.307 4.190 -48.883 1.00 21.14 C ATOM 2082 CD2 LEU A 146 33.030 1.892 -47.934 1.00 33.21 C ATOM 0 H LEU A 146 35.511 3.011 -45.296 1.00 72.54 H new ATOM 0 HA LEU A 146 35.576 0.918 -47.390 1.00 21.12 H new ATOM 0 HB2 LEU A 146 35.805 3.914 -47.759 1.00 35.42 H new ATOM 0 HB3 LEU A 146 35.510 2.699 -48.986 1.00 35.42 H new ATOM 0 HG LEU A 146 33.587 3.636 -46.843 1.00 73.53 H new ATOM 0 HD11 LEU A 146 32.233 4.345 -48.776 1.00 21.14 H new ATOM 0 HD12 LEU A 146 33.825 5.141 -48.758 1.00 21.14 H new ATOM 0 HD13 LEU A 146 33.519 3.789 -49.874 1.00 21.14 H new ATOM 0 HD21 LEU A 146 31.960 2.078 -47.840 1.00 33.21 H new ATOM 0 HD22 LEU A 146 33.235 1.434 -48.902 1.00 33.21 H new ATOM 0 HD23 LEU A 146 33.352 1.220 -47.139 1.00 33.21 H new ATOM 2093 N HIS A 147 38.040 0.840 -47.369 1.00 25.13 N ATOM 2094 CA HIS A 147 39.496 0.773 -47.439 1.00 35.01 C ATOM 2095 C HIS A 147 40.018 1.562 -48.636 1.00 73.54 C ATOM 2096 O HIS A 147 39.562 1.374 -49.764 1.00 30.10 O ATOM 2097 CB HIS A 147 39.956 -0.682 -47.532 1.00 23.33 C ATOM 2098 CG HIS A 147 39.322 -1.440 -48.657 1.00 51.21 C ATOM 2099 ND1 HIS A 147 38.206 -2.234 -48.495 1.00 5.45 N ATOM 2100 CD2 HIS A 147 39.651 -1.522 -49.968 1.00 43.01 C ATOM 2101 CE1 HIS A 147 37.878 -2.773 -49.655 1.00 63.25 C ATOM 2102 NE2 HIS A 147 38.740 -2.356 -50.566 1.00 1.31 N ATOM 0 H HIS A 147 37.567 -0.043 -47.563 1.00 25.13 H new ATOM 0 HA HIS A 147 39.901 1.216 -46.529 1.00 35.01 H new ATOM 0 HB2 HIS A 147 41.039 -0.705 -47.654 1.00 23.33 H new ATOM 0 HB3 HIS A 147 39.731 -1.186 -46.592 1.00 23.33 H new ATOM 0 HD2 HIS A 147 40.477 -1.023 -50.453 1.00 43.01 H new ATOM 0 HE1 HIS A 147 37.047 -3.441 -49.830 1.00 63.25 H new ATOM 0 HE2 HIS A 147 38.730 -2.612 -51.553 1.00 1.31 H new