USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1216 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 26 ASN : amide:sc= -2.53 K(o=-3.3,f=-0.74) USER MOD Set 1.2: B 91 ASN : amide:sc= -0.78 X(o=-3.3,f=-3.3!) USER MOD Set 2.1: B 31 GLN : amide:sc= -0.555 X(o=-0.56,f=-0.58) USER MOD Set 2.2: B 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: B 47 CYS SG : rot 180:sc= 0.973 USER MOD Set 3.2: B 55 SER OG : rot -108:sc= 0.532 USER MOD Set 4.1: B 37 SER OG : rot 70:sc= 1.05 USER MOD Set 4.2: B 38 CYS SG : rot -30:sc= 0.478 USER MOD Set 5.1: A 9 LYS NZ :NH3+ -141:sc= -0.447 (180deg=-2.21!) USER MOD Set 5.2: B 75 TYR OH : rot -163:sc= -6.69! USER MOD Single : A 6 LYS NZ :NH3+ -135:sc= -1.69! (180deg=-4.32!) USER MOD Single : A 7 SER OG : rot 180:sc= 0.0593 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 176:sc= 0.331 (180deg=0.323) USER MOD Single : A 25 SER OG : rot 133:sc= -4.08! USER MOD Single : A 26 CYS SG : rot 71:sc= -0.142 USER MOD Single : A 27 GLN : amide:sc=-0.00592 X(o=-0.0059,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.462 K(o=-0.46,f=-3.9!) USER MOD Single : A 44 SER OG : rot 27:sc= -1.97! USER MOD Single : A 47 CYS SG : rot 69:sc= -1.77! USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -53:sc= 0.2 USER MOD Single : A 66 ASN : amide:sc= -1.37 X(o=-1.4,f=-1.4!) USER MOD Single : A 73 THR OG1 : rot 22:sc= 1.12 USER MOD Single : A 76 GLN : amide:sc= -1.97 K(o=-2,f=-0.74) USER MOD Single : A 79 GLN : amide:sc= -0.0267 X(o=-0.027,f=-0.36) USER MOD Single : B 19 LYS NZ :NH3+ -122:sc= 1.82 (180deg=0.449) USER MOD Single : B 21 CYS SG : rot 59:sc= 1.19 USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 32 HIS : no HD1:sc= -14! C(o=-14!,f=-11!) USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ 150:sc= 1.09 (180deg=0.522) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 THR OG1 : rot -74:sc= -5.07! USER MOD Single : B 60 THR OG1 : rot 180:sc= -0.0887 USER MOD Single : B 68 THR OG1 : rot -14:sc= -0.775! USER MOD Single : B 78 CYS SG : rot -29:sc= 0.0155 USER MOD Single : B 81 SER OG : rot -151:sc= -1.81 USER MOD Single : B 82 ASN : amide:sc= -0.383 K(o=-0.38,f=-2.2) USER MOD Single : B 83 THR OG1 : rot -81:sc= 0.571 USER MOD Single : B 90 SER OG : rot 180:sc= 0 USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 96 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 78 N PRO A 5 2.794 15.578 1.555 1.00 0.00 N ATOM 79 CA PRO A 5 2.879 14.126 1.270 1.00 0.00 C ATOM 80 C PRO A 5 3.318 13.896 -0.179 1.00 0.00 C ATOM 81 O PRO A 5 2.896 14.589 -1.083 1.00 0.00 O ATOM 82 CB PRO A 5 1.452 13.630 1.497 1.00 0.00 C ATOM 83 CG PRO A 5 0.589 14.834 1.289 1.00 0.00 C ATOM 84 CD PRO A 5 1.406 16.036 1.686 1.00 0.00 C ATOM 0 HA PRO A 5 3.606 13.606 1.894 1.00 0.00 H new ATOM 0 HB2 PRO A 5 1.195 12.834 0.798 1.00 0.00 H new ATOM 0 HB3 PRO A 5 1.330 13.225 2.501 1.00 0.00 H new ATOM 0 HG2 PRO A 5 0.275 14.908 0.248 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -0.317 14.768 1.891 1.00 0.00 H new ATOM 0 HD2 PRO A 5 1.204 16.888 1.038 1.00 0.00 H new ATOM 0 HD3 PRO A 5 1.184 16.351 2.706 1.00 0.00 H new ATOM 92 N LYS A 6 4.166 12.931 -0.405 1.00 0.00 N ATOM 93 CA LYS A 6 4.635 12.659 -1.793 1.00 0.00 C ATOM 94 C LYS A 6 4.179 11.267 -2.239 1.00 0.00 C ATOM 95 O LYS A 6 3.975 10.383 -1.432 1.00 0.00 O ATOM 96 CB LYS A 6 6.161 12.730 -1.715 1.00 0.00 C ATOM 97 CG LYS A 6 6.747 12.719 -3.128 1.00 0.00 C ATOM 98 CD LYS A 6 8.271 12.829 -3.050 1.00 0.00 C ATOM 99 CE LYS A 6 8.874 11.440 -2.819 1.00 0.00 C ATOM 100 NZ LYS A 6 10.309 11.688 -2.506 1.00 0.00 N ATOM 0 H LYS A 6 4.555 12.319 0.312 1.00 0.00 H new ATOM 0 HA LYS A 6 4.233 13.370 -2.515 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.467 13.635 -1.190 1.00 0.00 H new ATOM 0 HB3 LYS A 6 6.546 11.885 -1.144 1.00 0.00 H new ATOM 0 HG2 LYS A 6 6.464 11.801 -3.643 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.341 13.548 -3.708 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.663 13.258 -3.972 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.557 13.500 -2.240 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.375 10.925 -1.998 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.766 10.811 -3.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 10.901 11.019 -3.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.560 12.661 -2.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.470 11.557 -1.487 1.00 0.00 H new ATOM 114 N SER A 7 4.015 11.065 -3.518 1.00 0.00 N ATOM 115 CA SER A 7 3.568 9.731 -4.012 1.00 0.00 C ATOM 116 C SER A 7 4.762 8.779 -4.128 1.00 0.00 C ATOM 117 O SER A 7 5.645 8.972 -4.940 1.00 0.00 O ATOM 118 CB SER A 7 2.961 9.999 -5.388 1.00 0.00 C ATOM 119 OG SER A 7 2.567 11.362 -5.471 1.00 0.00 O ATOM 0 H SER A 7 4.171 11.766 -4.242 1.00 0.00 H new ATOM 0 HA SER A 7 2.853 9.261 -3.336 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.686 9.770 -6.169 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.101 9.349 -5.551 1.00 0.00 H new ATOM 0 HG SER A 7 2.179 11.537 -6.354 1.00 0.00 H new ATOM 125 N VAL A 8 4.795 7.750 -3.323 1.00 0.00 N ATOM 126 CA VAL A 8 5.930 6.786 -3.390 1.00 0.00 C ATOM 127 C VAL A 8 5.421 5.352 -3.216 1.00 0.00 C ATOM 128 O VAL A 8 5.185 4.895 -2.115 1.00 0.00 O ATOM 129 CB VAL A 8 6.859 7.171 -2.236 1.00 0.00 C ATOM 130 CG1 VAL A 8 6.051 7.318 -0.946 1.00 0.00 C ATOM 131 CG2 VAL A 8 7.914 6.080 -2.048 1.00 0.00 C ATOM 0 H VAL A 8 4.085 7.536 -2.623 1.00 0.00 H new ATOM 0 HA VAL A 8 6.443 6.826 -4.351 1.00 0.00 H new ATOM 0 HB VAL A 8 7.345 8.119 -2.468 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.718 7.592 -0.128 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.297 8.095 -1.075 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.561 6.372 -0.714 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.577 6.352 -1.227 1.00 0.00 H new ATOM 0 HG22 VAL A 8 7.423 5.134 -1.820 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.496 5.975 -2.964 1.00 0.00 H new ATOM 141 N LYS A 9 5.252 4.638 -4.296 1.00 0.00 N ATOM 142 CA LYS A 9 4.761 3.232 -4.194 1.00 0.00 C ATOM 143 C LYS A 9 5.922 2.297 -3.834 1.00 0.00 C ATOM 144 O LYS A 9 7.075 2.670 -3.908 1.00 0.00 O ATOM 145 CB LYS A 9 4.220 2.908 -5.585 1.00 0.00 C ATOM 146 CG LYS A 9 2.908 3.662 -5.808 1.00 0.00 C ATOM 147 CD LYS A 9 2.626 3.767 -7.306 1.00 0.00 C ATOM 148 CE LYS A 9 3.323 5.008 -7.869 1.00 0.00 C ATOM 149 NZ LYS A 9 2.730 6.155 -7.125 1.00 0.00 N ATOM 0 H LYS A 9 5.432 4.967 -5.245 1.00 0.00 H new ATOM 0 HA LYS A 9 4.002 3.107 -3.422 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.948 3.190 -6.345 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.057 1.835 -5.683 1.00 0.00 H new ATOM 0 HG2 LYS A 9 2.089 3.143 -5.309 1.00 0.00 H new ATOM 0 HG3 LYS A 9 2.970 4.658 -5.369 1.00 0.00 H new ATOM 0 HD2 LYS A 9 2.982 2.873 -7.818 1.00 0.00 H new ATOM 0 HD3 LYS A 9 1.552 3.828 -7.482 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.402 4.956 -7.720 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.153 5.103 -8.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.593 6.956 -7.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.812 5.872 -6.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.370 6.438 -6.356 1.00 0.00 H new ATOM 163 N LEU A 10 5.629 1.085 -3.446 1.00 0.00 N ATOM 164 CA LEU A 10 6.721 0.134 -3.085 1.00 0.00 C ATOM 165 C LEU A 10 6.527 -1.198 -3.810 1.00 0.00 C ATOM 166 O LEU A 10 5.501 -1.445 -4.413 1.00 0.00 O ATOM 167 CB LEU A 10 6.601 -0.063 -1.574 1.00 0.00 C ATOM 168 CG LEU A 10 7.920 0.324 -0.901 1.00 0.00 C ATOM 169 CD1 LEU A 10 7.774 0.203 0.617 1.00 0.00 C ATOM 170 CD2 LEU A 10 9.029 -0.614 -1.383 1.00 0.00 C ATOM 0 H LEU A 10 4.683 0.712 -3.363 1.00 0.00 H new ATOM 0 HA LEU A 10 7.702 0.514 -3.370 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.788 0.547 -1.181 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.358 -1.102 -1.350 1.00 0.00 H new ATOM 0 HG LEU A 10 8.173 1.352 -1.160 1.00 0.00 H new ATOM 0 HD11 LEU A 10 8.714 0.479 1.096 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.982 0.869 0.961 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.522 -0.825 0.877 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.970 -0.341 -0.905 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.775 -1.642 -1.123 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.133 -0.529 -2.465 1.00 0.00 H new ATOM 182 N ARG A 11 7.505 -2.058 -3.755 1.00 0.00 N ATOM 183 CA ARG A 11 7.376 -3.376 -4.442 1.00 0.00 C ATOM 184 C ARG A 11 8.096 -4.472 -3.648 1.00 0.00 C ATOM 185 O ARG A 11 8.774 -4.207 -2.676 1.00 0.00 O ATOM 186 CB ARG A 11 8.034 -3.181 -5.808 1.00 0.00 C ATOM 187 CG ARG A 11 7.823 -4.437 -6.656 1.00 0.00 C ATOM 188 CD ARG A 11 8.149 -4.132 -8.119 1.00 0.00 C ATOM 189 NE ARG A 11 8.485 -5.453 -8.718 1.00 0.00 N ATOM 190 CZ ARG A 11 7.536 -6.299 -9.017 1.00 0.00 C ATOM 191 NH1 ARG A 11 6.287 -5.988 -8.794 1.00 0.00 N ATOM 192 NH2 ARG A 11 7.834 -7.457 -9.540 1.00 0.00 N ATOM 0 H ARG A 11 8.387 -1.907 -3.265 1.00 0.00 H new ATOM 0 HA ARG A 11 6.336 -3.688 -4.532 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.606 -2.313 -6.310 1.00 0.00 H new ATOM 0 HB3 ARG A 11 9.099 -2.985 -5.686 1.00 0.00 H new ATOM 0 HG2 ARG A 11 8.459 -5.244 -6.292 1.00 0.00 H new ATOM 0 HG3 ARG A 11 6.792 -4.779 -6.567 1.00 0.00 H new ATOM 0 HD2 ARG A 11 7.300 -3.672 -8.626 1.00 0.00 H new ATOM 0 HD3 ARG A 11 8.984 -3.437 -8.201 1.00 0.00 H new ATOM 0 HE ARG A 11 9.459 -5.698 -8.895 1.00 0.00 H new ATOM 0 HH11 ARG A 11 6.052 -5.083 -8.386 1.00 0.00 H new ATOM 0 HH12 ARG A 11 5.547 -6.650 -9.028 1.00 0.00 H new ATOM 0 HH21 ARG A 11 8.809 -7.702 -9.715 1.00 0.00 H new ATOM 0 HH22 ARG A 11 7.092 -8.117 -9.773 1.00 0.00 H new ATOM 206 N ALA A 12 7.946 -5.703 -4.057 1.00 0.00 N ATOM 207 CA ALA A 12 8.610 -6.827 -3.333 1.00 0.00 C ATOM 208 C ALA A 12 9.144 -7.856 -4.338 1.00 0.00 C ATOM 209 O ALA A 12 8.784 -7.846 -5.499 1.00 0.00 O ATOM 210 CB ALA A 12 7.503 -7.443 -2.477 1.00 0.00 C ATOM 0 H ALA A 12 7.389 -5.980 -4.865 1.00 0.00 H new ATOM 0 HA ALA A 12 9.458 -6.496 -2.734 1.00 0.00 H new ATOM 0 HB1 ALA A 12 7.906 -8.281 -1.909 1.00 0.00 H new ATOM 0 HB2 ALA A 12 7.114 -6.692 -1.789 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.698 -7.796 -3.122 1.00 0.00 H new ATOM 216 N LEU A 13 9.995 -8.747 -3.903 1.00 0.00 N ATOM 217 CA LEU A 13 10.542 -9.774 -4.839 1.00 0.00 C ATOM 218 C LEU A 13 10.020 -11.164 -4.466 1.00 0.00 C ATOM 219 O LEU A 13 9.361 -11.821 -5.247 1.00 0.00 O ATOM 220 CB LEU A 13 12.059 -9.710 -4.663 1.00 0.00 C ATOM 221 CG LEU A 13 12.603 -8.464 -5.360 1.00 0.00 C ATOM 222 CD1 LEU A 13 14.095 -8.321 -5.058 1.00 0.00 C ATOM 223 CD2 LEU A 13 12.398 -8.597 -6.871 1.00 0.00 C ATOM 0 H LEU A 13 10.335 -8.809 -2.943 1.00 0.00 H new ATOM 0 HA LEU A 13 10.243 -9.587 -5.871 1.00 0.00 H new ATOM 0 HB2 LEU A 13 12.312 -9.686 -3.603 1.00 0.00 H new ATOM 0 HB3 LEU A 13 12.522 -10.604 -5.081 1.00 0.00 H new ATOM 0 HG LEU A 13 12.074 -7.583 -4.997 1.00 0.00 H new ATOM 0 HD11 LEU A 13 14.483 -7.432 -5.555 1.00 0.00 H new ATOM 0 HD12 LEU A 13 14.241 -8.228 -3.982 1.00 0.00 H new ATOM 0 HD13 LEU A 13 14.626 -9.201 -5.421 1.00 0.00 H new ATOM 0 HD21 LEU A 13 12.785 -7.709 -7.370 1.00 0.00 H new ATOM 0 HD22 LEU A 13 12.928 -9.478 -7.234 1.00 0.00 H new ATOM 0 HD23 LEU A 13 11.334 -8.699 -7.086 1.00 0.00 H new ATOM 235 N ARG A 14 10.308 -11.617 -3.277 1.00 0.00 N ATOM 236 CA ARG A 14 9.827 -12.964 -2.855 1.00 0.00 C ATOM 237 C ARG A 14 8.347 -13.130 -3.207 1.00 0.00 C ATOM 238 O ARG A 14 7.971 -14.005 -3.960 1.00 0.00 O ATOM 239 CB ARG A 14 10.028 -12.992 -1.338 1.00 0.00 C ATOM 240 CG ARG A 14 9.914 -14.430 -0.830 1.00 0.00 C ATOM 241 CD ARG A 14 9.753 -14.418 0.691 1.00 0.00 C ATOM 242 NE ARG A 14 11.051 -14.922 1.222 1.00 0.00 N ATOM 243 CZ ARG A 14 11.229 -15.038 2.511 1.00 0.00 C ATOM 244 NH1 ARG A 14 10.273 -14.715 3.339 1.00 0.00 N ATOM 245 NH2 ARG A 14 12.368 -15.480 2.973 1.00 0.00 N ATOM 0 H ARG A 14 10.855 -11.113 -2.579 1.00 0.00 H new ATOM 0 HA ARG A 14 10.362 -13.773 -3.353 1.00 0.00 H new ATOM 0 HB2 ARG A 14 11.005 -12.582 -1.083 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.282 -12.364 -0.851 1.00 0.00 H new ATOM 0 HG2 ARG A 14 9.061 -14.925 -1.294 1.00 0.00 H new ATOM 0 HG3 ARG A 14 10.802 -14.998 -1.109 1.00 0.00 H new ATOM 0 HD2 ARG A 14 9.540 -13.414 1.057 1.00 0.00 H new ATOM 0 HD3 ARG A 14 8.925 -15.054 1.005 1.00 0.00 H new ATOM 0 HE ARG A 14 11.801 -15.176 0.579 1.00 0.00 H new ATOM 0 HH11 ARG A 14 9.382 -14.370 2.980 1.00 0.00 H new ATOM 0 HH12 ARG A 14 10.416 -14.807 4.345 1.00 0.00 H new ATOM 0 HH21 ARG A 14 13.116 -15.734 2.328 1.00 0.00 H new ATOM 0 HH22 ARG A 14 12.509 -15.571 3.979 1.00 0.00 H new ATOM 259 N SER A 15 7.505 -12.291 -2.668 1.00 0.00 N ATOM 260 CA SER A 15 6.048 -12.395 -2.972 1.00 0.00 C ATOM 261 C SER A 15 5.631 -11.277 -3.932 1.00 0.00 C ATOM 262 O SER A 15 6.091 -10.159 -3.819 1.00 0.00 O ATOM 263 CB SER A 15 5.350 -12.230 -1.623 1.00 0.00 C ATOM 264 OG SER A 15 3.951 -12.092 -1.832 1.00 0.00 O ATOM 0 H SER A 15 7.762 -11.538 -2.030 1.00 0.00 H new ATOM 0 HA SER A 15 5.790 -13.340 -3.451 1.00 0.00 H new ATOM 0 HB2 SER A 15 5.551 -13.093 -0.988 1.00 0.00 H new ATOM 0 HB3 SER A 15 5.740 -11.355 -1.103 1.00 0.00 H new ATOM 0 HG SER A 15 3.500 -11.988 -0.968 1.00 0.00 H new ATOM 270 N PRO A 16 4.768 -11.621 -4.851 1.00 0.00 N ATOM 271 CA PRO A 16 4.282 -10.632 -5.842 1.00 0.00 C ATOM 272 C PRO A 16 3.297 -9.657 -5.190 1.00 0.00 C ATOM 273 O PRO A 16 2.097 -9.834 -5.258 1.00 0.00 O ATOM 274 CB PRO A 16 3.581 -11.494 -6.890 1.00 0.00 C ATOM 275 CG PRO A 16 3.181 -12.741 -6.165 1.00 0.00 C ATOM 276 CD PRO A 16 4.172 -12.947 -5.048 1.00 0.00 C ATOM 0 HA PRO A 16 5.079 -10.019 -6.262 1.00 0.00 H new ATOM 0 HB2 PRO A 16 2.712 -10.983 -7.304 1.00 0.00 H new ATOM 0 HB3 PRO A 16 4.246 -11.719 -7.724 1.00 0.00 H new ATOM 0 HG2 PRO A 16 2.170 -12.648 -5.769 1.00 0.00 H new ATOM 0 HG3 PRO A 16 3.181 -13.596 -6.841 1.00 0.00 H new ATOM 0 HD2 PRO A 16 3.683 -13.303 -4.141 1.00 0.00 H new ATOM 0 HD3 PRO A 16 4.926 -13.687 -5.315 1.00 0.00 H new ATOM 284 N ARG A 17 3.796 -8.628 -4.561 1.00 0.00 N ATOM 285 CA ARG A 17 2.890 -7.639 -3.909 1.00 0.00 C ATOM 286 C ARG A 17 3.487 -6.232 -4.007 1.00 0.00 C ATOM 287 O ARG A 17 4.687 -6.063 -4.107 1.00 0.00 O ATOM 288 CB ARG A 17 2.798 -8.083 -2.448 1.00 0.00 C ATOM 289 CG ARG A 17 1.658 -7.332 -1.759 1.00 0.00 C ATOM 290 CD ARG A 17 1.490 -7.852 -0.330 1.00 0.00 C ATOM 291 NE ARG A 17 1.147 -9.292 -0.481 1.00 0.00 N ATOM 292 CZ ARG A 17 1.304 -10.112 0.523 1.00 0.00 C ATOM 293 NH1 ARG A 17 1.762 -9.672 1.665 1.00 0.00 N ATOM 294 NH2 ARG A 17 1.003 -11.375 0.386 1.00 0.00 N ATOM 0 H ARG A 17 4.792 -8.429 -4.470 1.00 0.00 H new ATOM 0 HA ARG A 17 1.910 -7.603 -4.384 1.00 0.00 H new ATOM 0 HB2 ARG A 17 2.625 -9.158 -2.393 1.00 0.00 H new ATOM 0 HB3 ARG A 17 3.740 -7.885 -1.936 1.00 0.00 H new ATOM 0 HG2 ARG A 17 1.870 -6.263 -1.745 1.00 0.00 H new ATOM 0 HG3 ARG A 17 0.731 -7.466 -2.317 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.406 -7.723 0.247 1.00 0.00 H new ATOM 0 HD3 ARG A 17 0.703 -7.312 0.196 1.00 0.00 H new ATOM 0 HE ARG A 17 0.789 -9.639 -1.371 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.998 -8.686 1.774 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.884 -10.315 2.448 1.00 0.00 H new ATOM 0 HH21 ARG A 17 0.646 -11.720 -0.505 1.00 0.00 H new ATOM 0 HH22 ARG A 17 1.125 -12.016 1.170 1.00 0.00 H new ATOM 308 N LYS A 18 2.662 -5.221 -3.982 1.00 0.00 N ATOM 309 CA LYS A 18 3.191 -3.829 -4.075 1.00 0.00 C ATOM 310 C LYS A 18 2.423 -2.898 -3.131 1.00 0.00 C ATOM 311 O LYS A 18 1.241 -2.668 -3.295 1.00 0.00 O ATOM 312 CB LYS A 18 2.970 -3.419 -5.532 1.00 0.00 C ATOM 313 CG LYS A 18 1.473 -3.241 -5.791 1.00 0.00 C ATOM 314 CD LYS A 18 1.207 -3.289 -7.297 1.00 0.00 C ATOM 315 CE LYS A 18 2.090 -2.260 -8.005 1.00 0.00 C ATOM 316 NZ LYS A 18 1.367 -1.936 -9.267 1.00 0.00 N ATOM 0 H LYS A 18 1.648 -5.297 -3.902 1.00 0.00 H new ATOM 0 HA LYS A 18 4.241 -3.769 -3.787 1.00 0.00 H new ATOM 0 HB2 LYS A 18 3.499 -2.490 -5.744 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.378 -4.178 -6.200 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.910 -4.026 -5.286 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.133 -2.290 -5.381 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.414 -4.288 -7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.156 -3.082 -7.498 1.00 0.00 H new ATOM 0 HE2 LYS A 18 2.230 -1.371 -7.391 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.081 -2.665 -8.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.877 -1.186 -9.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.314 -2.786 -9.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.405 -1.610 -9.042 1.00 0.00 H new ATOM 330 N PHE A 19 3.088 -2.359 -2.145 1.00 0.00 N ATOM 331 CA PHE A 19 2.401 -1.441 -1.192 1.00 0.00 C ATOM 332 C PHE A 19 2.593 0.012 -1.632 1.00 0.00 C ATOM 333 O PHE A 19 3.688 0.429 -1.955 1.00 0.00 O ATOM 334 CB PHE A 19 3.091 -1.683 0.148 1.00 0.00 C ATOM 335 CG PHE A 19 2.788 -3.081 0.631 1.00 0.00 C ATOM 336 CD1 PHE A 19 3.400 -4.178 0.017 1.00 0.00 C ATOM 337 CD2 PHE A 19 1.899 -3.278 1.693 1.00 0.00 C ATOM 338 CE1 PHE A 19 3.123 -5.475 0.464 1.00 0.00 C ATOM 339 CE2 PHE A 19 1.621 -4.575 2.142 1.00 0.00 C ATOM 340 CZ PHE A 19 2.234 -5.674 1.527 1.00 0.00 C ATOM 0 H PHE A 19 4.079 -2.515 -1.958 1.00 0.00 H new ATOM 0 HA PHE A 19 1.327 -1.622 -1.141 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.168 -1.550 0.043 1.00 0.00 H new ATOM 0 HB3 PHE A 19 2.749 -0.952 0.881 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.087 -4.024 -0.802 1.00 0.00 H new ATOM 0 HD2 PHE A 19 1.427 -2.430 2.167 1.00 0.00 H new ATOM 0 HE1 PHE A 19 3.595 -6.322 -0.011 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.935 -4.728 2.962 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.021 -6.675 1.873 1.00 0.00 H new ATOM 350 N GLY A 20 1.545 0.788 -1.647 1.00 0.00 N ATOM 351 CA GLY A 20 1.690 2.210 -2.066 1.00 0.00 C ATOM 352 C GLY A 20 1.373 3.132 -0.889 1.00 0.00 C ATOM 353 O GLY A 20 0.313 3.064 -0.298 1.00 0.00 O ATOM 0 H GLY A 20 0.601 0.502 -1.389 1.00 0.00 H new ATOM 0 HA2 GLY A 20 2.705 2.393 -2.420 1.00 0.00 H new ATOM 0 HA3 GLY A 20 1.019 2.424 -2.898 1.00 0.00 H new ATOM 357 N VAL A 21 2.289 3.996 -0.547 1.00 0.00 N ATOM 358 CA VAL A 21 2.060 4.934 0.589 1.00 0.00 C ATOM 359 C VAL A 21 2.640 6.312 0.253 1.00 0.00 C ATOM 360 O VAL A 21 3.783 6.431 -0.141 1.00 0.00 O ATOM 361 CB VAL A 21 2.801 4.307 1.771 1.00 0.00 C ATOM 362 CG1 VAL A 21 2.859 5.301 2.932 1.00 0.00 C ATOM 363 CG2 VAL A 21 2.064 3.044 2.219 1.00 0.00 C ATOM 0 H VAL A 21 3.193 4.093 -1.009 1.00 0.00 H new ATOM 0 HA VAL A 21 1.002 5.080 0.806 1.00 0.00 H new ATOM 0 HB VAL A 21 3.816 4.051 1.466 1.00 0.00 H new ATOM 0 HG11 VAL A 21 3.388 4.850 3.771 1.00 0.00 H new ATOM 0 HG12 VAL A 21 3.384 6.202 2.614 1.00 0.00 H new ATOM 0 HG13 VAL A 21 1.846 5.561 3.239 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.590 2.595 3.061 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.049 3.303 2.521 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.027 2.333 1.394 1.00 0.00 H new ATOM 373 N ALA A 22 1.865 7.353 0.398 1.00 0.00 N ATOM 374 CA ALA A 22 2.385 8.715 0.078 1.00 0.00 C ATOM 375 C ALA A 22 2.575 9.531 1.360 1.00 0.00 C ATOM 376 O ALA A 22 1.697 10.259 1.779 1.00 0.00 O ATOM 377 CB ALA A 22 1.311 9.350 -0.806 1.00 0.00 C ATOM 0 H ALA A 22 0.899 7.321 0.723 1.00 0.00 H new ATOM 0 HA ALA A 22 3.355 8.678 -0.418 1.00 0.00 H new ATOM 0 HB1 ALA A 22 1.619 10.358 -1.086 1.00 0.00 H new ATOM 0 HB2 ALA A 22 1.178 8.749 -1.705 1.00 0.00 H new ATOM 0 HB3 ALA A 22 0.370 9.397 -0.258 1.00 0.00 H new ATOM 383 N GLY A 23 3.713 9.416 1.989 1.00 0.00 N ATOM 384 CA GLY A 23 3.953 10.185 3.243 1.00 0.00 C ATOM 385 C GLY A 23 5.067 11.209 3.016 1.00 0.00 C ATOM 386 O GLY A 23 5.899 11.053 2.145 1.00 0.00 O ATOM 0 H GLY A 23 4.487 8.823 1.689 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.038 10.691 3.551 1.00 0.00 H new ATOM 0 HA3 GLY A 23 4.229 9.506 4.050 1.00 0.00 H new ATOM 390 N ARG A 24 5.089 12.255 3.797 1.00 0.00 N ATOM 391 CA ARG A 24 6.150 13.291 3.631 1.00 0.00 C ATOM 392 C ARG A 24 7.407 12.888 4.407 1.00 0.00 C ATOM 393 O ARG A 24 8.471 13.443 4.218 1.00 0.00 O ATOM 394 CB ARG A 24 5.544 14.570 4.213 1.00 0.00 C ATOM 395 CG ARG A 24 6.571 15.701 4.151 1.00 0.00 C ATOM 396 CD ARG A 24 6.169 16.808 5.129 1.00 0.00 C ATOM 397 NE ARG A 24 7.440 17.222 5.786 1.00 0.00 N ATOM 398 CZ ARG A 24 8.031 16.424 6.633 1.00 0.00 C ATOM 399 NH1 ARG A 24 7.511 15.258 6.909 1.00 0.00 N ATOM 400 NH2 ARG A 24 9.145 16.792 7.206 1.00 0.00 N ATOM 0 H ARG A 24 4.418 12.437 4.543 1.00 0.00 H new ATOM 0 HA ARG A 24 6.448 13.418 2.590 1.00 0.00 H new ATOM 0 HB2 ARG A 24 4.650 14.847 3.655 1.00 0.00 H new ATOM 0 HB3 ARG A 24 5.236 14.401 5.245 1.00 0.00 H new ATOM 0 HG2 ARG A 24 7.562 15.321 4.402 1.00 0.00 H new ATOM 0 HG3 ARG A 24 6.629 16.099 3.138 1.00 0.00 H new ATOM 0 HD2 ARG A 24 5.703 17.645 4.608 1.00 0.00 H new ATOM 0 HD3 ARG A 24 5.447 16.445 5.860 1.00 0.00 H new ATOM 0 HE ARG A 24 7.850 18.132 5.573 1.00 0.00 H new ATOM 0 HH11 ARG A 24 6.641 14.969 6.462 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.975 14.636 7.571 1.00 0.00 H new ATOM 0 HH21 ARG A 24 9.552 17.702 6.992 1.00 0.00 H new ATOM 0 HH22 ARG A 24 9.608 16.169 7.868 1.00 0.00 H new ATOM 414 N SER A 25 7.290 11.928 5.283 1.00 0.00 N ATOM 415 CA SER A 25 8.475 11.490 6.076 1.00 0.00 C ATOM 416 C SER A 25 9.276 10.440 5.292 1.00 0.00 C ATOM 417 O SER A 25 8.977 9.264 5.320 1.00 0.00 O ATOM 418 CB SER A 25 7.889 10.900 7.355 1.00 0.00 C ATOM 419 OG SER A 25 8.935 10.682 8.293 1.00 0.00 O ATOM 0 H SER A 25 6.425 11.427 5.484 1.00 0.00 H new ATOM 0 HA SER A 25 9.165 12.306 6.290 1.00 0.00 H new ATOM 0 HB2 SER A 25 7.144 11.577 7.774 1.00 0.00 H new ATOM 0 HB3 SER A 25 7.379 9.962 7.136 1.00 0.00 H new ATOM 0 HG SER A 25 8.666 11.028 9.170 1.00 0.00 H new ATOM 425 N CYS A 26 10.292 10.871 4.587 1.00 0.00 N ATOM 426 CA CYS A 26 11.125 9.920 3.786 1.00 0.00 C ATOM 427 C CYS A 26 11.404 8.635 4.571 1.00 0.00 C ATOM 428 O CYS A 26 10.705 7.651 4.432 1.00 0.00 O ATOM 429 CB CYS A 26 12.428 10.673 3.515 1.00 0.00 C ATOM 430 SG CYS A 26 12.088 12.120 2.482 1.00 0.00 S ATOM 0 H CYS A 26 10.583 11.847 4.531 1.00 0.00 H new ATOM 0 HA CYS A 26 10.621 9.616 2.868 1.00 0.00 H new ATOM 0 HB2 CYS A 26 12.883 10.984 4.456 1.00 0.00 H new ATOM 0 HB3 CYS A 26 13.142 10.017 3.017 1.00 0.00 H new ATOM 0 HG CYS A 26 11.446 13.010 3.179 1.00 0.00 H new ATOM 436 N GLN A 27 12.431 8.636 5.386 1.00 0.00 N ATOM 437 CA GLN A 27 12.773 7.415 6.178 1.00 0.00 C ATOM 438 C GLN A 27 11.500 6.709 6.645 1.00 0.00 C ATOM 439 O GLN A 27 11.258 5.564 6.321 1.00 0.00 O ATOM 440 CB GLN A 27 13.569 7.933 7.376 1.00 0.00 C ATOM 441 CG GLN A 27 14.316 6.771 8.034 1.00 0.00 C ATOM 442 CD GLN A 27 14.476 7.045 9.531 1.00 0.00 C ATOM 443 OE1 GLN A 27 15.321 7.821 9.931 1.00 0.00 O ATOM 444 NE2 GLN A 27 13.693 6.438 10.380 1.00 0.00 N ATOM 0 H GLN A 27 13.049 9.434 5.537 1.00 0.00 H new ATOM 0 HA GLN A 27 13.338 6.690 5.593 1.00 0.00 H new ATOM 0 HB2 GLN A 27 14.276 8.697 7.053 1.00 0.00 H new ATOM 0 HB3 GLN A 27 12.899 8.402 8.096 1.00 0.00 H new ATOM 0 HG2 GLN A 27 13.769 5.841 7.881 1.00 0.00 H new ATOM 0 HG3 GLN A 27 15.295 6.646 7.570 1.00 0.00 H new ATOM 0 HE21 GLN A 27 12.984 5.787 10.044 1.00 0.00 H new ATOM 0 HE22 GLN A 27 13.790 6.615 11.380 1.00 0.00 H new ATOM 453 N GLU A 28 10.682 7.392 7.394 1.00 0.00 N ATOM 454 CA GLU A 28 9.412 6.779 7.878 1.00 0.00 C ATOM 455 C GLU A 28 8.768 5.936 6.774 1.00 0.00 C ATOM 456 O GLU A 28 8.566 4.748 6.925 1.00 0.00 O ATOM 457 CB GLU A 28 8.532 7.977 8.220 1.00 0.00 C ATOM 458 CG GLU A 28 8.824 8.435 9.650 1.00 0.00 C ATOM 459 CD GLU A 28 7.650 9.266 10.171 1.00 0.00 C ATOM 460 OE1 GLU A 28 6.597 8.692 10.397 1.00 0.00 O ATOM 461 OE2 GLU A 28 7.824 10.463 10.335 1.00 0.00 O ATOM 0 H GLU A 28 10.838 8.354 7.694 1.00 0.00 H new ATOM 0 HA GLU A 28 9.563 6.112 8.727 1.00 0.00 H new ATOM 0 HB2 GLU A 28 8.721 8.791 7.521 1.00 0.00 H new ATOM 0 HB3 GLU A 28 7.480 7.709 8.121 1.00 0.00 H new ATOM 0 HG2 GLU A 28 8.985 7.570 10.294 1.00 0.00 H new ATOM 0 HG3 GLU A 28 9.740 9.025 9.674 1.00 0.00 H new ATOM 468 N VAL A 29 8.445 6.542 5.663 1.00 0.00 N ATOM 469 CA VAL A 29 7.816 5.772 4.551 1.00 0.00 C ATOM 470 C VAL A 29 8.557 4.449 4.342 1.00 0.00 C ATOM 471 O VAL A 29 8.011 3.382 4.545 1.00 0.00 O ATOM 472 CB VAL A 29 7.958 6.667 3.320 1.00 0.00 C ATOM 473 CG1 VAL A 29 7.521 5.894 2.074 1.00 0.00 C ATOM 474 CG2 VAL A 29 7.075 7.905 3.486 1.00 0.00 C ATOM 0 H VAL A 29 8.589 7.535 5.478 1.00 0.00 H new ATOM 0 HA VAL A 29 6.774 5.524 4.756 1.00 0.00 H new ATOM 0 HB VAL A 29 8.998 6.973 3.212 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.622 6.532 1.196 1.00 0.00 H new ATOM 0 HG12 VAL A 29 8.149 5.011 1.955 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.480 5.588 2.182 1.00 0.00 H new ATOM 0 HG21 VAL A 29 7.176 8.544 2.609 1.00 0.00 H new ATOM 0 HG22 VAL A 29 6.035 7.598 3.594 1.00 0.00 H new ATOM 0 HG23 VAL A 29 7.385 8.456 4.374 1.00 0.00 H new ATOM 484 N LEU A 30 9.797 4.510 3.939 1.00 0.00 N ATOM 485 CA LEU A 30 10.571 3.254 3.721 1.00 0.00 C ATOM 486 C LEU A 30 10.520 2.383 4.979 1.00 0.00 C ATOM 487 O LEU A 30 10.053 1.262 4.951 1.00 0.00 O ATOM 488 CB LEU A 30 12.004 3.712 3.447 1.00 0.00 C ATOM 489 CG LEU A 30 12.029 4.607 2.207 1.00 0.00 C ATOM 490 CD1 LEU A 30 13.479 4.848 1.781 1.00 0.00 C ATOM 491 CD2 LEU A 30 11.273 3.921 1.067 1.00 0.00 C ATOM 0 H LEU A 30 10.307 5.373 3.752 1.00 0.00 H new ATOM 0 HA LEU A 30 10.171 2.658 2.901 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.394 4.255 4.308 1.00 0.00 H new ATOM 0 HB3 LEU A 30 12.650 2.847 3.297 1.00 0.00 H new ATOM 0 HG LEU A 30 11.553 5.560 2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 30 13.497 5.486 0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.020 5.336 2.592 1.00 0.00 H new ATOM 0 HD13 LEU A 30 13.954 3.894 1.550 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.291 4.559 0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.749 2.968 0.836 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.240 3.747 1.368 1.00 0.00 H new ATOM 503 N ARG A 31 10.995 2.892 6.081 1.00 0.00 N ATOM 504 CA ARG A 31 10.974 2.099 7.343 1.00 0.00 C ATOM 505 C ARG A 31 9.613 1.419 7.517 1.00 0.00 C ATOM 506 O ARG A 31 9.520 0.313 8.012 1.00 0.00 O ATOM 507 CB ARG A 31 11.206 3.124 8.454 1.00 0.00 C ATOM 508 CG ARG A 31 11.580 2.402 9.748 1.00 0.00 C ATOM 509 CD ARG A 31 11.706 3.421 10.884 1.00 0.00 C ATOM 510 NE ARG A 31 10.802 2.920 11.956 1.00 0.00 N ATOM 511 CZ ARG A 31 11.172 1.924 12.714 1.00 0.00 C ATOM 512 NH1 ARG A 31 12.337 1.361 12.536 1.00 0.00 N ATOM 513 NH2 ARG A 31 10.376 1.490 13.653 1.00 0.00 N ATOM 0 H ARG A 31 11.398 3.825 6.163 1.00 0.00 H new ATOM 0 HA ARG A 31 11.726 1.310 7.350 1.00 0.00 H new ATOM 0 HB2 ARG A 31 12.001 3.813 8.167 1.00 0.00 H new ATOM 0 HB3 ARG A 31 10.307 3.721 8.606 1.00 0.00 H new ATOM 0 HG2 ARG A 31 10.822 1.659 9.994 1.00 0.00 H new ATOM 0 HG3 ARG A 31 12.521 1.867 9.619 1.00 0.00 H new ATOM 0 HD2 ARG A 31 12.735 3.493 11.237 1.00 0.00 H new ATOM 0 HD3 ARG A 31 11.412 4.418 10.554 1.00 0.00 H new ATOM 0 HE ARG A 31 9.891 3.356 12.098 1.00 0.00 H new ATOM 0 HH11 ARG A 31 12.960 1.700 11.803 1.00 0.00 H new ATOM 0 HH12 ARG A 31 12.623 0.583 13.130 1.00 0.00 H new ATOM 0 HH21 ARG A 31 9.466 1.929 13.794 1.00 0.00 H new ATOM 0 HH22 ARG A 31 10.664 0.712 14.246 1.00 0.00 H new ATOM 527 N LYS A 32 8.557 2.073 7.116 1.00 0.00 N ATOM 528 CA LYS A 32 7.203 1.464 7.262 1.00 0.00 C ATOM 529 C LYS A 32 7.021 0.327 6.252 1.00 0.00 C ATOM 530 O LYS A 32 7.177 -0.833 6.576 1.00 0.00 O ATOM 531 CB LYS A 32 6.225 2.602 6.971 1.00 0.00 C ATOM 532 CG LYS A 32 6.090 3.487 8.213 1.00 0.00 C ATOM 533 CD LYS A 32 4.816 4.327 8.107 1.00 0.00 C ATOM 534 CE LYS A 32 4.321 4.682 9.511 1.00 0.00 C ATOM 535 NZ LYS A 32 2.987 5.310 9.300 1.00 0.00 N ATOM 0 H LYS A 32 8.573 3.002 6.694 1.00 0.00 H new ATOM 0 HA LYS A 32 7.047 1.035 8.252 1.00 0.00 H new ATOM 0 HB2 LYS A 32 6.579 3.193 6.126 1.00 0.00 H new ATOM 0 HB3 LYS A 32 5.252 2.198 6.692 1.00 0.00 H new ATOM 0 HG2 LYS A 32 6.057 2.869 9.110 1.00 0.00 H new ATOM 0 HG3 LYS A 32 6.960 4.137 8.305 1.00 0.00 H new ATOM 0 HD2 LYS A 32 5.013 5.236 7.539 1.00 0.00 H new ATOM 0 HD3 LYS A 32 4.047 3.774 7.568 1.00 0.00 H new ATOM 0 HE2 LYS A 32 4.245 3.794 10.139 1.00 0.00 H new ATOM 0 HE3 LYS A 32 5.006 5.368 10.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.582 5.582 10.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 3.092 6.156 8.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.354 4.632 8.830 1.00 0.00 H new ATOM 549 N GLY A 33 6.687 0.650 5.032 1.00 0.00 N ATOM 550 CA GLY A 33 6.493 -0.414 4.006 1.00 0.00 C ATOM 551 C GLY A 33 7.612 -1.454 4.121 1.00 0.00 C ATOM 552 O GLY A 33 7.376 -2.643 4.048 1.00 0.00 O ATOM 0 H GLY A 33 6.540 1.604 4.702 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.523 -0.893 4.144 1.00 0.00 H new ATOM 0 HA3 GLY A 33 6.493 0.025 3.008 1.00 0.00 H new ATOM 556 N CYS A 34 8.828 -1.016 4.298 1.00 0.00 N ATOM 557 CA CYS A 34 9.959 -1.982 4.416 1.00 0.00 C ATOM 558 C CYS A 34 9.709 -2.959 5.567 1.00 0.00 C ATOM 559 O CYS A 34 9.779 -4.160 5.400 1.00 0.00 O ATOM 560 CB CYS A 34 11.190 -1.120 4.704 1.00 0.00 C ATOM 561 SG CYS A 34 12.688 -2.095 4.423 1.00 0.00 S ATOM 0 H CYS A 34 9.088 -0.032 4.366 1.00 0.00 H new ATOM 0 HA CYS A 34 10.081 -2.581 3.514 1.00 0.00 H new ATOM 0 HB2 CYS A 34 11.190 -0.240 4.060 1.00 0.00 H new ATOM 0 HB3 CYS A 34 11.164 -0.762 5.733 1.00 0.00 H new ATOM 0 HG CYS A 34 13.734 -1.363 4.666 1.00 0.00 H new ATOM 567 N LEU A 35 9.416 -2.456 6.735 1.00 0.00 N ATOM 568 CA LEU A 35 9.161 -3.361 7.892 1.00 0.00 C ATOM 569 C LEU A 35 7.974 -4.279 7.595 1.00 0.00 C ATOM 570 O LEU A 35 7.900 -5.390 8.081 1.00 0.00 O ATOM 571 CB LEU A 35 8.843 -2.430 9.063 1.00 0.00 C ATOM 572 CG LEU A 35 10.136 -1.786 9.567 1.00 0.00 C ATOM 573 CD1 LEU A 35 9.807 -0.744 10.637 1.00 0.00 C ATOM 574 CD2 LEU A 35 11.038 -2.866 10.172 1.00 0.00 C ATOM 0 H LEU A 35 9.342 -1.459 6.938 1.00 0.00 H new ATOM 0 HA LEU A 35 10.013 -4.006 8.106 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.139 -1.660 8.748 1.00 0.00 H new ATOM 0 HB3 LEU A 35 8.365 -2.989 9.867 1.00 0.00 H new ATOM 0 HG LEU A 35 10.648 -1.303 8.735 1.00 0.00 H new ATOM 0 HD11 LEU A 35 10.729 -0.286 10.995 1.00 0.00 H new ATOM 0 HD12 LEU A 35 9.162 0.024 10.210 1.00 0.00 H new ATOM 0 HD13 LEU A 35 9.295 -1.226 11.469 1.00 0.00 H new ATOM 0 HD21 LEU A 35 11.960 -2.410 10.532 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.522 -3.347 11.003 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.274 -3.611 9.412 1.00 0.00 H new ATOM 586 N ARG A 36 7.045 -3.826 6.797 1.00 0.00 N ATOM 587 CA ARG A 36 5.867 -4.680 6.471 1.00 0.00 C ATOM 588 C ARG A 36 6.328 -5.974 5.793 1.00 0.00 C ATOM 589 O ARG A 36 5.770 -7.032 6.009 1.00 0.00 O ATOM 590 CB ARG A 36 5.021 -3.841 5.513 1.00 0.00 C ATOM 591 CG ARG A 36 3.683 -4.542 5.269 1.00 0.00 C ATOM 592 CD ARG A 36 2.558 -3.506 5.204 1.00 0.00 C ATOM 593 NE ARG A 36 2.321 -3.099 6.621 1.00 0.00 N ATOM 594 CZ ARG A 36 2.808 -1.977 7.099 1.00 0.00 C ATOM 595 NH1 ARG A 36 3.522 -1.174 6.351 1.00 0.00 N ATOM 596 NH2 ARG A 36 2.578 -1.656 8.343 1.00 0.00 N ATOM 0 H ARG A 36 7.050 -2.905 6.358 1.00 0.00 H new ATOM 0 HA ARG A 36 5.305 -4.969 7.359 1.00 0.00 H new ATOM 0 HB2 ARG A 36 4.853 -2.849 5.932 1.00 0.00 H new ATOM 0 HB3 ARG A 36 5.549 -3.703 4.570 1.00 0.00 H new ATOM 0 HG2 ARG A 36 3.723 -5.108 4.338 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.486 -5.257 6.068 1.00 0.00 H new ATOM 0 HD2 ARG A 36 2.844 -2.651 4.591 1.00 0.00 H new ATOM 0 HD3 ARG A 36 1.657 -3.930 4.760 1.00 0.00 H new ATOM 0 HE ARG A 36 1.770 -3.704 7.230 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.709 -1.415 5.378 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.891 -0.307 6.741 1.00 0.00 H new ATOM 0 HH21 ARG A 36 2.024 -2.275 8.935 1.00 0.00 H new ATOM 0 HH22 ARG A 36 2.952 -0.787 8.723 1.00 0.00 H new ATOM 610 N PHE A 37 7.346 -5.898 4.981 1.00 0.00 N ATOM 611 CA PHE A 37 7.850 -7.115 4.294 1.00 0.00 C ATOM 612 C PHE A 37 8.702 -7.952 5.252 1.00 0.00 C ATOM 613 O PHE A 37 9.147 -9.032 4.920 1.00 0.00 O ATOM 614 CB PHE A 37 8.696 -6.578 3.144 1.00 0.00 C ATOM 615 CG PHE A 37 7.800 -6.200 1.991 1.00 0.00 C ATOM 616 CD1 PHE A 37 6.819 -7.095 1.545 1.00 0.00 C ATOM 617 CD2 PHE A 37 7.949 -4.957 1.364 1.00 0.00 C ATOM 618 CE1 PHE A 37 5.988 -6.747 0.474 1.00 0.00 C ATOM 619 CE2 PHE A 37 7.117 -4.609 0.292 1.00 0.00 C ATOM 620 CZ PHE A 37 6.137 -5.505 -0.152 1.00 0.00 C ATOM 0 H PHE A 37 7.852 -5.039 4.764 1.00 0.00 H new ATOM 0 HA PHE A 37 7.047 -7.765 3.946 1.00 0.00 H new ATOM 0 HB2 PHE A 37 9.267 -5.710 3.474 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.416 -7.332 2.826 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.704 -8.054 2.028 1.00 0.00 H new ATOM 0 HD2 PHE A 37 8.705 -4.266 1.707 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.232 -7.437 0.131 1.00 0.00 H new ATOM 0 HE2 PHE A 37 7.231 -3.650 -0.192 1.00 0.00 H new ATOM 0 HZ PHE A 37 5.496 -5.237 -0.979 1.00 0.00 H new ATOM 630 N GLN A 38 8.932 -7.461 6.441 1.00 0.00 N ATOM 631 CA GLN A 38 9.752 -8.227 7.422 1.00 0.00 C ATOM 632 C GLN A 38 11.161 -8.459 6.869 1.00 0.00 C ATOM 633 O GLN A 38 11.549 -9.573 6.578 1.00 0.00 O ATOM 634 CB GLN A 38 9.018 -9.556 7.597 1.00 0.00 C ATOM 635 CG GLN A 38 7.537 -9.289 7.871 1.00 0.00 C ATOM 636 CD GLN A 38 7.083 -10.108 9.081 1.00 0.00 C ATOM 637 OE1 GLN A 38 7.891 -10.723 9.749 1.00 0.00 O ATOM 638 NE2 GLN A 38 5.817 -10.144 9.392 1.00 0.00 N ATOM 0 H GLN A 38 8.586 -6.561 6.775 1.00 0.00 H new ATOM 0 HA GLN A 38 9.867 -7.697 8.367 1.00 0.00 H new ATOM 0 HB2 GLN A 38 9.129 -10.166 6.700 1.00 0.00 H new ATOM 0 HB3 GLN A 38 9.455 -10.119 8.421 1.00 0.00 H new ATOM 0 HG2 GLN A 38 7.377 -8.227 8.057 1.00 0.00 H new ATOM 0 HG3 GLN A 38 6.942 -9.553 6.997 1.00 0.00 H new ATOM 0 HE21 GLN A 38 5.139 -9.628 8.831 1.00 0.00 H new ATOM 0 HE22 GLN A 38 5.505 -10.688 10.196 1.00 0.00 H new ATOM 647 N LEU A 39 11.930 -7.415 6.721 1.00 0.00 N ATOM 648 CA LEU A 39 13.313 -7.575 6.186 1.00 0.00 C ATOM 649 C LEU A 39 14.308 -6.771 7.029 1.00 0.00 C ATOM 650 O LEU A 39 14.206 -5.564 7.125 1.00 0.00 O ATOM 651 CB LEU A 39 13.249 -7.020 4.764 1.00 0.00 C ATOM 652 CG LEU A 39 12.540 -8.024 3.853 1.00 0.00 C ATOM 653 CD1 LEU A 39 12.272 -7.378 2.493 1.00 0.00 C ATOM 654 CD2 LEU A 39 13.429 -9.256 3.666 1.00 0.00 C ATOM 0 H LEU A 39 11.661 -6.458 6.947 1.00 0.00 H new ATOM 0 HA LEU A 39 13.646 -8.613 6.209 1.00 0.00 H new ATOM 0 HB2 LEU A 39 12.717 -6.069 4.758 1.00 0.00 H new ATOM 0 HB3 LEU A 39 14.255 -6.825 4.393 1.00 0.00 H new ATOM 0 HG LEU A 39 11.594 -8.322 4.306 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.767 -8.093 1.844 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.641 -6.499 2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.217 -7.080 2.039 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.926 -9.973 3.017 1.00 0.00 H new ATOM 0 HD22 LEU A 39 14.374 -8.957 3.212 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.621 -9.716 4.635 1.00 0.00 H new ATOM 666 N PRO A 40 15.244 -7.471 7.613 1.00 0.00 N ATOM 667 CA PRO A 40 16.274 -6.812 8.456 1.00 0.00 C ATOM 668 C PRO A 40 17.268 -6.040 7.583 1.00 0.00 C ATOM 669 O PRO A 40 17.230 -6.114 6.370 1.00 0.00 O ATOM 670 CB PRO A 40 16.960 -7.980 9.157 1.00 0.00 C ATOM 671 CG PRO A 40 16.738 -9.154 8.259 1.00 0.00 C ATOM 672 CD PRO A 40 15.432 -8.923 7.546 1.00 0.00 C ATOM 0 HA PRO A 40 15.857 -6.086 9.154 1.00 0.00 H new ATOM 0 HB2 PRO A 40 18.023 -7.786 9.298 1.00 0.00 H new ATOM 0 HB3 PRO A 40 16.534 -8.153 10.145 1.00 0.00 H new ATOM 0 HG2 PRO A 40 17.555 -9.253 7.544 1.00 0.00 H new ATOM 0 HG3 PRO A 40 16.705 -10.079 8.835 1.00 0.00 H new ATOM 0 HD2 PRO A 40 15.473 -9.273 6.515 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.613 -9.454 8.031 1.00 0.00 H new ATOM 680 N GLU A 41 18.157 -5.302 8.188 1.00 0.00 N ATOM 681 CA GLU A 41 19.151 -4.526 7.392 1.00 0.00 C ATOM 682 C GLU A 41 20.169 -5.470 6.747 1.00 0.00 C ATOM 683 O GLU A 41 20.105 -5.760 5.570 1.00 0.00 O ATOM 684 CB GLU A 41 19.841 -3.613 8.406 1.00 0.00 C ATOM 685 CG GLU A 41 21.015 -2.901 7.736 1.00 0.00 C ATOM 686 CD GLU A 41 21.130 -1.477 8.284 1.00 0.00 C ATOM 687 OE1 GLU A 41 20.148 -0.989 8.818 1.00 0.00 O ATOM 688 OE2 GLU A 41 22.198 -0.900 8.161 1.00 0.00 O ATOM 0 H GLU A 41 18.239 -5.202 9.200 1.00 0.00 H new ATOM 0 HA GLU A 41 18.683 -3.964 6.584 1.00 0.00 H new ATOM 0 HB2 GLU A 41 19.132 -2.882 8.794 1.00 0.00 H new ATOM 0 HB3 GLU A 41 20.194 -4.197 9.256 1.00 0.00 H new ATOM 0 HG2 GLU A 41 21.939 -3.449 7.921 1.00 0.00 H new ATOM 0 HG3 GLU A 41 20.870 -2.876 6.656 1.00 0.00 H new ATOM 695 N ARG A 42 21.112 -5.947 7.509 1.00 0.00 N ATOM 696 CA ARG A 42 22.136 -6.868 6.937 1.00 0.00 C ATOM 697 C ARG A 42 21.461 -8.051 6.235 1.00 0.00 C ATOM 698 O ARG A 42 21.844 -8.440 5.150 1.00 0.00 O ATOM 699 CB ARG A 42 22.950 -7.351 8.137 1.00 0.00 C ATOM 700 CG ARG A 42 24.248 -7.997 7.646 1.00 0.00 C ATOM 701 CD ARG A 42 25.119 -8.371 8.848 1.00 0.00 C ATOM 702 NE ARG A 42 25.941 -7.159 9.117 1.00 0.00 N ATOM 703 CZ ARG A 42 26.482 -6.978 10.293 1.00 0.00 C ATOM 704 NH1 ARG A 42 26.305 -7.859 11.242 1.00 0.00 N ATOM 705 NH2 ARG A 42 27.201 -5.913 10.521 1.00 0.00 N ATOM 0 H ARG A 42 21.219 -5.740 8.502 1.00 0.00 H new ATOM 0 HA ARG A 42 22.760 -6.374 6.192 1.00 0.00 H new ATOM 0 HB2 ARG A 42 23.175 -6.514 8.798 1.00 0.00 H new ATOM 0 HB3 ARG A 42 22.371 -8.069 8.718 1.00 0.00 H new ATOM 0 HG2 ARG A 42 24.024 -8.885 7.056 1.00 0.00 H new ATOM 0 HG3 ARG A 42 24.786 -7.308 6.994 1.00 0.00 H new ATOM 0 HD2 ARG A 42 24.508 -8.634 9.712 1.00 0.00 H new ATOM 0 HD3 ARG A 42 25.748 -9.234 8.627 1.00 0.00 H new ATOM 0 HE ARG A 42 26.082 -6.467 8.381 1.00 0.00 H new ATOM 0 HH11 ARG A 42 25.743 -8.692 11.066 1.00 0.00 H new ATOM 0 HH12 ARG A 42 26.729 -7.714 12.158 1.00 0.00 H new ATOM 0 HH21 ARG A 42 27.340 -5.224 9.782 1.00 0.00 H new ATOM 0 HH22 ARG A 42 27.624 -5.770 11.438 1.00 0.00 H new ATOM 719 N GLY A 43 20.467 -8.632 6.849 1.00 0.00 N ATOM 720 CA GLY A 43 19.780 -9.796 6.217 1.00 0.00 C ATOM 721 C GLY A 43 19.139 -9.375 4.892 1.00 0.00 C ATOM 722 O GLY A 43 19.255 -10.059 3.895 1.00 0.00 O ATOM 0 H GLY A 43 20.101 -8.353 7.759 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.495 -10.600 6.044 1.00 0.00 H new ATOM 0 HA3 GLY A 43 19.017 -10.187 6.890 1.00 0.00 H new ATOM 726 N SER A 44 18.459 -8.259 4.868 1.00 0.00 N ATOM 727 CA SER A 44 17.811 -7.813 3.599 1.00 0.00 C ATOM 728 C SER A 44 18.270 -6.404 3.217 1.00 0.00 C ATOM 729 O SER A 44 18.382 -5.528 4.051 1.00 0.00 O ATOM 730 CB SER A 44 16.315 -7.818 3.894 1.00 0.00 C ATOM 731 OG SER A 44 15.626 -7.176 2.828 1.00 0.00 O ATOM 0 H SER A 44 18.325 -7.640 5.667 1.00 0.00 H new ATOM 0 HA SER A 44 18.071 -8.464 2.764 1.00 0.00 H new ATOM 0 HB2 SER A 44 15.958 -8.842 4.009 1.00 0.00 H new ATOM 0 HB3 SER A 44 16.116 -7.303 4.834 1.00 0.00 H new ATOM 0 HG SER A 44 16.147 -7.263 2.002 1.00 0.00 H new ATOM 737 N ARG A 45 18.526 -6.180 1.960 1.00 0.00 N ATOM 738 CA ARG A 45 18.970 -4.827 1.518 1.00 0.00 C ATOM 739 C ARG A 45 17.936 -4.213 0.572 1.00 0.00 C ATOM 740 O ARG A 45 17.529 -4.822 -0.399 1.00 0.00 O ATOM 741 CB ARG A 45 20.294 -5.060 0.788 1.00 0.00 C ATOM 742 CG ARG A 45 21.022 -3.725 0.619 1.00 0.00 C ATOM 743 CD ARG A 45 22.390 -3.966 -0.023 1.00 0.00 C ATOM 744 NE ARG A 45 23.376 -3.658 1.050 1.00 0.00 N ATOM 745 CZ ARG A 45 24.639 -3.944 0.883 1.00 0.00 C ATOM 746 NH1 ARG A 45 25.046 -4.502 -0.227 1.00 0.00 N ATOM 747 NH2 ARG A 45 25.498 -3.673 1.827 1.00 0.00 N ATOM 0 H ARG A 45 18.447 -6.875 1.217 1.00 0.00 H new ATOM 0 HA ARG A 45 19.083 -4.138 2.355 1.00 0.00 H new ATOM 0 HB2 ARG A 45 20.915 -5.757 1.351 1.00 0.00 H new ATOM 0 HB3 ARG A 45 20.110 -5.513 -0.186 1.00 0.00 H new ATOM 0 HG2 ARG A 45 20.431 -3.052 -0.002 1.00 0.00 H new ATOM 0 HG3 ARG A 45 21.144 -3.240 1.588 1.00 0.00 H new ATOM 0 HD2 ARG A 45 22.489 -4.995 -0.367 1.00 0.00 H new ATOM 0 HD3 ARG A 45 22.538 -3.324 -0.891 1.00 0.00 H new ATOM 0 HE ARG A 45 23.064 -3.222 1.918 1.00 0.00 H new ATOM 0 HH11 ARG A 45 24.376 -4.715 -0.966 1.00 0.00 H new ATOM 0 HH12 ARG A 45 26.033 -4.724 -0.354 1.00 0.00 H new ATOM 0 HH21 ARG A 45 25.183 -3.238 2.694 1.00 0.00 H new ATOM 0 HH22 ARG A 45 26.485 -3.896 1.698 1.00 0.00 H new ATOM 761 N LEU A 46 17.508 -3.010 0.846 1.00 0.00 N ATOM 762 CA LEU A 46 16.500 -2.356 -0.039 1.00 0.00 C ATOM 763 C LEU A 46 17.202 -1.654 -1.206 1.00 0.00 C ATOM 764 O LEU A 46 18.195 -0.978 -1.027 1.00 0.00 O ATOM 765 CB LEU A 46 15.790 -1.339 0.858 1.00 0.00 C ATOM 766 CG LEU A 46 14.535 -0.810 0.158 1.00 0.00 C ATOM 767 CD1 LEU A 46 14.940 0.161 -0.951 1.00 0.00 C ATOM 768 CD2 LEU A 46 13.749 -1.976 -0.448 1.00 0.00 C ATOM 0 H LEU A 46 17.812 -2.452 1.644 1.00 0.00 H new ATOM 0 HA LEU A 46 15.801 -3.070 -0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 46 15.519 -1.804 1.806 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.463 -0.513 1.089 1.00 0.00 H new ATOM 0 HG LEU A 46 13.909 -0.293 0.886 1.00 0.00 H new ATOM 0 HD11 LEU A 46 14.047 0.537 -1.449 1.00 0.00 H new ATOM 0 HD12 LEU A 46 15.494 0.995 -0.520 1.00 0.00 H new ATOM 0 HD13 LEU A 46 15.569 -0.356 -1.676 1.00 0.00 H new ATOM 0 HD21 LEU A 46 12.857 -1.594 -0.945 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.373 -2.498 -1.173 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.456 -2.667 0.342 1.00 0.00 H new ATOM 780 N CYS A 47 16.697 -1.813 -2.400 1.00 0.00 N ATOM 781 CA CYS A 47 17.344 -1.158 -3.575 1.00 0.00 C ATOM 782 C CYS A 47 16.283 -0.659 -4.562 1.00 0.00 C ATOM 783 O CYS A 47 15.102 -0.881 -4.383 1.00 0.00 O ATOM 784 CB CYS A 47 18.204 -2.247 -4.218 1.00 0.00 C ATOM 785 SG CYS A 47 19.158 -3.103 -2.939 1.00 0.00 S ATOM 0 H CYS A 47 15.867 -2.366 -2.613 1.00 0.00 H new ATOM 0 HA CYS A 47 17.936 -0.291 -3.284 1.00 0.00 H new ATOM 0 HB2 CYS A 47 17.571 -2.957 -4.750 1.00 0.00 H new ATOM 0 HB3 CYS A 47 18.877 -1.806 -4.954 1.00 0.00 H new ATOM 0 HG CYS A 47 18.353 -3.792 -2.186 1.00 0.00 H new ATOM 791 N LEU A 48 16.697 0.016 -5.600 1.00 0.00 N ATOM 792 CA LEU A 48 15.714 0.534 -6.598 1.00 0.00 C ATOM 793 C LEU A 48 15.284 -0.584 -7.554 1.00 0.00 C ATOM 794 O LEU A 48 15.719 -1.712 -7.441 1.00 0.00 O ATOM 795 CB LEU A 48 16.460 1.631 -7.357 1.00 0.00 C ATOM 796 CG LEU A 48 16.728 2.809 -6.420 1.00 0.00 C ATOM 797 CD1 LEU A 48 17.948 3.588 -6.915 1.00 0.00 C ATOM 798 CD2 LEU A 48 15.506 3.733 -6.404 1.00 0.00 C ATOM 0 H LEU A 48 17.673 0.232 -5.801 1.00 0.00 H new ATOM 0 HA LEU A 48 14.807 0.910 -6.124 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.400 1.242 -7.748 1.00 0.00 H new ATOM 0 HB3 LEU A 48 15.871 1.960 -8.213 1.00 0.00 H new ATOM 0 HG LEU A 48 16.919 2.437 -5.413 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.139 4.428 -6.247 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.818 2.931 -6.930 1.00 0.00 H new ATOM 0 HD13 LEU A 48 17.758 3.961 -7.921 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.694 4.574 -5.737 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.317 4.104 -7.411 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.636 3.179 -6.053 1.00 0.00 H new ATOM 810 N TYR A 49 14.427 -0.277 -8.490 1.00 0.00 N ATOM 811 CA TYR A 49 13.961 -1.319 -9.450 1.00 0.00 C ATOM 812 C TYR A 49 14.877 -1.373 -10.678 1.00 0.00 C ATOM 813 O TYR A 49 15.527 -2.368 -10.933 1.00 0.00 O ATOM 814 CB TYR A 49 12.552 -0.877 -9.854 1.00 0.00 C ATOM 815 CG TYR A 49 11.879 -1.981 -10.634 1.00 0.00 C ATOM 816 CD1 TYR A 49 12.328 -2.305 -11.920 1.00 0.00 C ATOM 817 CD2 TYR A 49 10.804 -2.680 -10.072 1.00 0.00 C ATOM 818 CE1 TYR A 49 11.704 -3.328 -12.643 1.00 0.00 C ATOM 819 CE2 TYR A 49 10.179 -3.702 -10.795 1.00 0.00 C ATOM 820 CZ TYR A 49 10.628 -4.026 -12.081 1.00 0.00 C ATOM 821 OH TYR A 49 10.011 -5.034 -12.793 1.00 0.00 O ATOM 0 H TYR A 49 14.029 0.651 -8.632 1.00 0.00 H new ATOM 0 HA TYR A 49 13.972 -2.316 -9.009 1.00 0.00 H new ATOM 0 HB2 TYR A 49 11.967 -0.636 -8.966 1.00 0.00 H new ATOM 0 HB3 TYR A 49 12.603 0.029 -10.457 1.00 0.00 H new ATOM 0 HD1 TYR A 49 13.156 -1.765 -12.354 1.00 0.00 H new ATOM 0 HD2 TYR A 49 10.457 -2.430 -9.080 1.00 0.00 H new ATOM 0 HE1 TYR A 49 12.052 -3.579 -13.634 1.00 0.00 H new ATOM 0 HE2 TYR A 49 9.350 -4.241 -10.361 1.00 0.00 H new ATOM 0 HH TYR A 49 9.284 -5.415 -12.257 1.00 0.00 H new ATOM 831 N GLU A 50 14.926 -0.318 -11.444 1.00 0.00 N ATOM 832 CA GLU A 50 15.794 -0.319 -12.659 1.00 0.00 C ATOM 833 C GLU A 50 17.235 -0.682 -12.290 1.00 0.00 C ATOM 834 O GLU A 50 17.748 -1.707 -12.690 1.00 0.00 O ATOM 835 CB GLU A 50 15.724 1.111 -13.197 1.00 0.00 C ATOM 836 CG GLU A 50 15.961 1.100 -14.708 1.00 0.00 C ATOM 837 CD GLU A 50 14.939 2.010 -15.392 1.00 0.00 C ATOM 838 OE1 GLU A 50 14.141 2.607 -14.688 1.00 0.00 O ATOM 839 OE2 GLU A 50 14.970 2.093 -16.609 1.00 0.00 O ATOM 0 H GLU A 50 14.404 0.544 -11.283 1.00 0.00 H new ATOM 0 HA GLU A 50 15.465 -1.051 -13.396 1.00 0.00 H new ATOM 0 HB2 GLU A 50 14.750 1.547 -12.974 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.472 1.733 -12.705 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.973 1.440 -14.931 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.874 0.084 -15.093 1.00 0.00 H new ATOM 846 N ASP A 51 17.893 0.151 -11.530 1.00 0.00 N ATOM 847 CA ASP A 51 19.297 -0.147 -11.141 1.00 0.00 C ATOM 848 C ASP A 51 19.320 -1.094 -9.939 1.00 0.00 C ATOM 849 O ASP A 51 20.043 -2.071 -9.918 1.00 0.00 O ATOM 850 CB ASP A 51 19.891 1.210 -10.767 1.00 0.00 C ATOM 851 CG ASP A 51 19.525 2.240 -11.837 1.00 0.00 C ATOM 852 OD1 ASP A 51 20.016 2.114 -12.946 1.00 0.00 O ATOM 853 OD2 ASP A 51 18.759 3.139 -11.528 1.00 0.00 O ATOM 0 H ASP A 51 17.517 1.025 -11.163 1.00 0.00 H new ATOM 0 HA ASP A 51 19.858 -0.635 -11.939 1.00 0.00 H new ATOM 0 HB2 ASP A 51 19.513 1.529 -9.796 1.00 0.00 H new ATOM 0 HB3 ASP A 51 20.975 1.132 -10.677 1.00 0.00 H new ATOM 858 N GLY A 52 18.535 -0.810 -8.937 1.00 0.00 N ATOM 859 CA GLY A 52 18.510 -1.690 -7.735 1.00 0.00 C ATOM 860 C GLY A 52 19.912 -1.778 -7.131 1.00 0.00 C ATOM 861 O GLY A 52 20.198 -2.641 -6.324 1.00 0.00 O ATOM 0 H GLY A 52 17.909 -0.006 -8.899 1.00 0.00 H new ATOM 0 HA2 GLY A 52 17.810 -1.296 -6.998 1.00 0.00 H new ATOM 0 HA3 GLY A 52 18.158 -2.685 -8.008 1.00 0.00 H new ATOM 865 N THR A 53 20.795 -0.895 -7.516 1.00 0.00 N ATOM 866 CA THR A 53 22.179 -0.944 -6.957 1.00 0.00 C ATOM 867 C THR A 53 22.156 -0.735 -5.433 1.00 0.00 C ATOM 868 O THR A 53 22.302 -1.675 -4.677 1.00 0.00 O ATOM 869 CB THR A 53 22.959 0.169 -7.677 1.00 0.00 C ATOM 870 OG1 THR A 53 24.149 0.459 -6.956 1.00 0.00 O ATOM 871 CG2 THR A 53 22.109 1.439 -7.803 1.00 0.00 C ATOM 0 H THR A 53 20.621 -0.147 -8.188 1.00 0.00 H new ATOM 0 HA THR A 53 22.651 -1.913 -7.118 1.00 0.00 H new ATOM 0 HB THR A 53 23.211 -0.177 -8.679 1.00 0.00 H new ATOM 0 HG1 THR A 53 24.646 1.167 -7.416 1.00 0.00 H new ATOM 0 HG21 THR A 53 22.683 2.211 -8.315 1.00 0.00 H new ATOM 0 HG22 THR A 53 21.207 1.218 -8.374 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.832 1.792 -6.809 1.00 0.00 H new ATOM 879 N GLU A 54 21.968 0.471 -4.966 1.00 0.00 N ATOM 880 CA GLU A 54 21.933 0.695 -3.493 1.00 0.00 C ATOM 881 C GLU A 54 20.866 1.735 -3.140 1.00 0.00 C ATOM 882 O GLU A 54 20.756 2.764 -3.777 1.00 0.00 O ATOM 883 CB GLU A 54 23.327 1.207 -3.129 1.00 0.00 C ATOM 884 CG GLU A 54 23.719 2.343 -4.073 1.00 0.00 C ATOM 885 CD GLU A 54 24.433 3.439 -3.281 1.00 0.00 C ATOM 886 OE1 GLU A 54 24.321 3.434 -2.066 1.00 0.00 O ATOM 887 OE2 GLU A 54 25.081 4.266 -3.902 1.00 0.00 O ATOM 0 H GLU A 54 21.838 1.306 -5.538 1.00 0.00 H new ATOM 0 HA GLU A 54 21.682 -0.214 -2.946 1.00 0.00 H new ATOM 0 HB2 GLU A 54 23.338 1.558 -2.097 1.00 0.00 H new ATOM 0 HB3 GLU A 54 24.053 0.397 -3.198 1.00 0.00 H new ATOM 0 HG2 GLU A 54 24.370 1.966 -4.862 1.00 0.00 H new ATOM 0 HG3 GLU A 54 22.832 2.749 -4.559 1.00 0.00 H new ATOM 894 N LEU A 55 20.085 1.477 -2.130 1.00 0.00 N ATOM 895 CA LEU A 55 19.029 2.452 -1.733 1.00 0.00 C ATOM 896 C LEU A 55 19.041 2.645 -0.215 1.00 0.00 C ATOM 897 O LEU A 55 18.637 1.777 0.534 1.00 0.00 O ATOM 898 CB LEU A 55 17.713 1.818 -2.189 1.00 0.00 C ATOM 899 CG LEU A 55 16.577 2.837 -2.071 1.00 0.00 C ATOM 900 CD1 LEU A 55 16.327 3.171 -0.598 1.00 0.00 C ATOM 901 CD2 LEU A 55 16.959 4.113 -2.824 1.00 0.00 C ATOM 0 H LEU A 55 20.131 0.632 -1.560 1.00 0.00 H new ATOM 0 HA LEU A 55 19.179 3.435 -2.179 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.802 1.477 -3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.492 0.941 -1.581 1.00 0.00 H new ATOM 0 HG LEU A 55 15.669 2.414 -2.501 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.517 3.897 -0.522 1.00 0.00 H new ATOM 0 HD12 LEU A 55 16.052 2.263 -0.061 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.233 3.591 -0.161 1.00 0.00 H new ATOM 0 HD21 LEU A 55 16.151 4.840 -2.741 1.00 0.00 H new ATOM 0 HD22 LEU A 55 17.869 4.531 -2.393 1.00 0.00 H new ATOM 0 HD23 LEU A 55 17.129 3.878 -3.875 1.00 0.00 H new ATOM 913 N THR A 56 19.501 3.776 0.245 1.00 0.00 N ATOM 914 CA THR A 56 19.538 4.021 1.715 1.00 0.00 C ATOM 915 C THR A 56 18.186 4.554 2.199 1.00 0.00 C ATOM 916 O THR A 56 17.660 5.511 1.668 1.00 0.00 O ATOM 917 CB THR A 56 20.630 5.074 1.913 1.00 0.00 C ATOM 918 OG1 THR A 56 20.660 5.472 3.277 1.00 0.00 O ATOM 919 CG2 THR A 56 20.339 6.288 1.030 1.00 0.00 C ATOM 0 H THR A 56 19.852 4.540 -0.332 1.00 0.00 H new ATOM 0 HA THR A 56 19.740 3.111 2.279 1.00 0.00 H new ATOM 0 HB THR A 56 21.596 4.652 1.636 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.360 6.145 3.406 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.118 7.037 1.173 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.318 5.981 -0.016 1.00 0.00 H new ATOM 0 HG23 THR A 56 19.373 6.713 1.303 1.00 0.00 H new ATOM 927 N GLU A 57 17.622 3.941 3.204 1.00 0.00 N ATOM 928 CA GLU A 57 16.305 4.414 3.723 1.00 0.00 C ATOM 929 C GLU A 57 16.388 5.895 4.102 1.00 0.00 C ATOM 930 O GLU A 57 15.396 6.595 4.138 1.00 0.00 O ATOM 931 CB GLU A 57 16.041 3.562 4.965 1.00 0.00 C ATOM 932 CG GLU A 57 16.000 2.083 4.574 1.00 0.00 C ATOM 933 CD GLU A 57 15.307 1.281 5.678 1.00 0.00 C ATOM 934 OE1 GLU A 57 14.189 1.627 6.022 1.00 0.00 O ATOM 935 OE2 GLU A 57 15.906 0.333 6.160 1.00 0.00 O ATOM 0 H GLU A 57 18.015 3.134 3.688 1.00 0.00 H new ATOM 0 HA GLU A 57 15.511 4.317 2.983 1.00 0.00 H new ATOM 0 HB2 GLU A 57 16.822 3.731 5.707 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.096 3.853 5.424 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.467 1.960 3.631 1.00 0.00 H new ATOM 0 HG3 GLU A 57 17.012 1.709 4.419 1.00 0.00 H new ATOM 942 N ASP A 58 17.568 6.374 4.388 1.00 0.00 N ATOM 943 CA ASP A 58 17.723 7.806 4.771 1.00 0.00 C ATOM 944 C ASP A 58 17.049 8.717 3.739 1.00 0.00 C ATOM 945 O ASP A 58 16.151 9.470 4.059 1.00 0.00 O ATOM 946 CB ASP A 58 19.233 8.047 4.790 1.00 0.00 C ATOM 947 CG ASP A 58 19.557 9.183 5.761 1.00 0.00 C ATOM 948 OD1 ASP A 58 19.299 9.019 6.942 1.00 0.00 O ATOM 949 OD2 ASP A 58 20.056 10.200 5.307 1.00 0.00 O ATOM 0 H ASP A 58 18.433 5.834 4.373 1.00 0.00 H new ATOM 0 HA ASP A 58 17.258 8.025 5.732 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.753 7.138 5.091 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.584 8.299 3.789 1.00 0.00 H new ATOM 954 N TYR A 59 17.476 8.660 2.508 1.00 0.00 N ATOM 955 CA TYR A 59 16.856 9.532 1.468 1.00 0.00 C ATOM 956 C TYR A 59 16.669 8.759 0.158 1.00 0.00 C ATOM 957 O TYR A 59 17.125 7.642 0.013 1.00 0.00 O ATOM 958 CB TYR A 59 17.850 10.678 1.275 1.00 0.00 C ATOM 959 CG TYR A 59 17.360 11.596 0.181 1.00 0.00 C ATOM 960 CD1 TYR A 59 16.171 12.314 0.350 1.00 0.00 C ATOM 961 CD2 TYR A 59 18.096 11.729 -1.003 1.00 0.00 C ATOM 962 CE1 TYR A 59 15.717 13.165 -0.665 1.00 0.00 C ATOM 963 CE2 TYR A 59 17.643 12.580 -2.018 1.00 0.00 C ATOM 964 CZ TYR A 59 16.453 13.299 -1.850 1.00 0.00 C ATOM 965 OH TYR A 59 16.007 14.138 -2.850 1.00 0.00 O ATOM 0 H TYR A 59 18.224 8.051 2.177 1.00 0.00 H new ATOM 0 HA TYR A 59 15.869 9.887 1.765 1.00 0.00 H new ATOM 0 HB2 TYR A 59 17.965 11.234 2.206 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.832 10.281 1.018 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.604 12.212 1.263 1.00 0.00 H new ATOM 0 HD2 TYR A 59 19.014 11.175 -1.133 1.00 0.00 H new ATOM 0 HE1 TYR A 59 14.799 13.719 -0.535 1.00 0.00 H new ATOM 0 HE2 TYR A 59 18.211 12.682 -2.931 1.00 0.00 H new ATOM 0 HH TYR A 59 16.636 14.114 -3.601 1.00 0.00 H new ATOM 975 N PHE A 60 15.998 9.348 -0.795 1.00 0.00 N ATOM 976 CA PHE A 60 15.777 8.652 -2.096 1.00 0.00 C ATOM 977 C PHE A 60 16.849 9.068 -3.109 1.00 0.00 C ATOM 978 O PHE A 60 17.482 10.094 -2.958 1.00 0.00 O ATOM 979 CB PHE A 60 14.394 9.115 -2.560 1.00 0.00 C ATOM 980 CG PHE A 60 13.377 8.843 -1.475 1.00 0.00 C ATOM 981 CD1 PHE A 60 13.137 7.530 -1.052 1.00 0.00 C ATOM 982 CD2 PHE A 60 12.669 9.905 -0.896 1.00 0.00 C ATOM 983 CE1 PHE A 60 12.194 7.278 -0.050 1.00 0.00 C ATOM 984 CE2 PHE A 60 11.725 9.651 0.105 1.00 0.00 C ATOM 985 CZ PHE A 60 11.487 8.339 0.528 1.00 0.00 C ATOM 0 H PHE A 60 15.593 10.282 -0.729 1.00 0.00 H new ATOM 0 HA PHE A 60 15.835 7.568 -2.000 1.00 0.00 H new ATOM 0 HB2 PHE A 60 14.415 10.179 -2.794 1.00 0.00 H new ATOM 0 HB3 PHE A 60 14.113 8.593 -3.475 1.00 0.00 H new ATOM 0 HD1 PHE A 60 13.680 6.711 -1.500 1.00 0.00 H new ATOM 0 HD2 PHE A 60 12.852 10.918 -1.222 1.00 0.00 H new ATOM 0 HE1 PHE A 60 12.011 6.265 0.278 1.00 0.00 H new ATOM 0 HE2 PHE A 60 11.179 10.469 0.552 1.00 0.00 H new ATOM 0 HZ PHE A 60 10.758 8.145 1.301 1.00 0.00 H new ATOM 995 N PRO A 61 17.018 8.248 -4.112 1.00 0.00 N ATOM 996 CA PRO A 61 18.025 8.527 -5.165 1.00 0.00 C ATOM 997 C PRO A 61 17.535 9.638 -6.098 1.00 0.00 C ATOM 998 O PRO A 61 17.211 9.402 -7.244 1.00 0.00 O ATOM 999 CB PRO A 61 18.135 7.202 -5.913 1.00 0.00 C ATOM 1000 CG PRO A 61 16.831 6.508 -5.678 1.00 0.00 C ATOM 1001 CD PRO A 61 16.294 6.995 -4.354 1.00 0.00 C ATOM 0 HA PRO A 61 18.979 8.868 -4.764 1.00 0.00 H new ATOM 0 HB2 PRO A 61 18.309 7.364 -6.977 1.00 0.00 H new ATOM 0 HB3 PRO A 61 18.970 6.608 -5.541 1.00 0.00 H new ATOM 0 HG2 PRO A 61 16.128 6.728 -6.482 1.00 0.00 H new ATOM 0 HG3 PRO A 61 16.969 5.427 -5.662 1.00 0.00 H new ATOM 0 HD2 PRO A 61 15.217 7.159 -4.397 1.00 0.00 H new ATOM 0 HD3 PRO A 61 16.475 6.271 -3.560 1.00 0.00 H new ATOM 1009 N SER A 62 17.483 10.850 -5.615 1.00 0.00 N ATOM 1010 CA SER A 62 17.018 11.978 -6.474 1.00 0.00 C ATOM 1011 C SER A 62 15.725 11.598 -7.201 1.00 0.00 C ATOM 1012 O SER A 62 15.461 12.057 -8.296 1.00 0.00 O ATOM 1013 CB SER A 62 18.149 12.206 -7.475 1.00 0.00 C ATOM 1014 OG SER A 62 17.959 13.459 -8.120 1.00 0.00 O ATOM 0 H SER A 62 17.742 11.108 -4.663 1.00 0.00 H new ATOM 0 HA SER A 62 16.800 12.874 -5.893 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.112 12.189 -6.964 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.165 11.403 -8.212 1.00 0.00 H new ATOM 0 HG SER A 62 17.055 13.500 -8.496 1.00 0.00 H new ATOM 1020 N VAL A 63 14.914 10.769 -6.603 1.00 0.00 N ATOM 1021 CA VAL A 63 13.637 10.369 -7.262 1.00 0.00 C ATOM 1022 C VAL A 63 12.446 10.771 -6.386 1.00 0.00 C ATOM 1023 O VAL A 63 11.885 9.955 -5.683 1.00 0.00 O ATOM 1024 CB VAL A 63 13.720 8.848 -7.402 1.00 0.00 C ATOM 1025 CG1 VAL A 63 13.725 8.201 -6.015 1.00 0.00 C ATOM 1026 CG2 VAL A 63 12.509 8.344 -8.191 1.00 0.00 C ATOM 0 H VAL A 63 15.080 10.351 -5.687 1.00 0.00 H new ATOM 0 HA VAL A 63 13.498 10.855 -8.228 1.00 0.00 H new ATOM 0 HB VAL A 63 14.638 8.584 -7.928 1.00 0.00 H new ATOM 0 HG11 VAL A 63 13.784 7.118 -6.119 1.00 0.00 H new ATOM 0 HG12 VAL A 63 14.586 8.559 -5.450 1.00 0.00 H new ATOM 0 HG13 VAL A 63 12.809 8.465 -5.487 1.00 0.00 H new ATOM 0 HG21 VAL A 63 12.566 7.260 -8.292 1.00 0.00 H new ATOM 0 HG22 VAL A 63 11.594 8.612 -7.663 1.00 0.00 H new ATOM 0 HG23 VAL A 63 12.504 8.801 -9.181 1.00 0.00 H new ATOM 1036 N PRO A 64 12.104 12.028 -6.461 1.00 0.00 N ATOM 1037 CA PRO A 64 10.974 12.561 -5.665 1.00 0.00 C ATOM 1038 C PRO A 64 9.632 12.158 -6.286 1.00 0.00 C ATOM 1039 O PRO A 64 8.696 11.814 -5.591 1.00 0.00 O ATOM 1040 CB PRO A 64 11.167 14.072 -5.739 1.00 0.00 C ATOM 1041 CG PRO A 64 11.940 14.310 -7.000 1.00 0.00 C ATOM 1042 CD PRO A 64 12.739 13.063 -7.285 1.00 0.00 C ATOM 0 HA PRO A 64 10.960 12.182 -4.643 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.208 14.590 -5.761 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.709 14.442 -4.869 1.00 0.00 H new ATOM 0 HG2 PRO A 64 11.265 14.530 -7.827 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.600 15.171 -6.889 1.00 0.00 H new ATOM 0 HD2 PRO A 64 12.707 12.804 -8.343 1.00 0.00 H new ATOM 0 HD3 PRO A 64 13.788 13.194 -7.020 1.00 0.00 H new ATOM 1050 N ASP A 65 9.528 12.204 -7.586 1.00 0.00 N ATOM 1051 CA ASP A 65 8.241 11.833 -8.244 1.00 0.00 C ATOM 1052 C ASP A 65 7.718 10.505 -7.689 1.00 0.00 C ATOM 1053 O ASP A 65 6.646 10.441 -7.120 1.00 0.00 O ATOM 1054 CB ASP A 65 8.585 11.695 -9.728 1.00 0.00 C ATOM 1055 CG ASP A 65 9.038 13.051 -10.275 1.00 0.00 C ATOM 1056 OD1 ASP A 65 9.032 14.006 -9.515 1.00 0.00 O ATOM 1057 OD2 ASP A 65 9.382 13.111 -11.444 1.00 0.00 O ATOM 0 H ASP A 65 10.276 12.482 -8.221 1.00 0.00 H new ATOM 0 HA ASP A 65 7.461 12.574 -8.070 1.00 0.00 H new ATOM 0 HB2 ASP A 65 9.374 10.955 -9.862 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.716 11.339 -10.282 1.00 0.00 H new ATOM 1062 N ASN A 66 8.463 9.446 -7.848 1.00 0.00 N ATOM 1063 CA ASN A 66 8.002 8.127 -7.325 1.00 0.00 C ATOM 1064 C ASN A 66 9.178 7.347 -6.733 1.00 0.00 C ATOM 1065 O ASN A 66 10.277 7.374 -7.251 1.00 0.00 O ATOM 1066 CB ASN A 66 7.427 7.393 -8.538 1.00 0.00 C ATOM 1067 CG ASN A 66 8.366 7.557 -9.734 1.00 0.00 C ATOM 1068 OD1 ASN A 66 9.571 7.480 -9.590 1.00 0.00 O ATOM 1069 ND2 ASN A 66 7.864 7.779 -10.918 1.00 0.00 N ATOM 0 H ASN A 66 9.369 9.436 -8.316 1.00 0.00 H new ATOM 0 HA ASN A 66 7.265 8.238 -6.530 1.00 0.00 H new ATOM 0 HB2 ASN A 66 7.298 6.336 -8.307 1.00 0.00 H new ATOM 0 HB3 ASN A 66 6.441 7.789 -8.781 1.00 0.00 H new ATOM 0 HD21 ASN A 66 8.482 7.888 -11.722 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.853 7.844 -11.039 1.00 0.00 H new ATOM 1076 N ALA A 67 8.953 6.646 -5.656 1.00 0.00 N ATOM 1077 CA ALA A 67 10.056 5.859 -5.037 1.00 0.00 C ATOM 1078 C ALA A 67 9.671 4.378 -4.983 1.00 0.00 C ATOM 1079 O ALA A 67 9.350 3.847 -3.938 1.00 0.00 O ATOM 1080 CB ALA A 67 10.204 6.430 -3.628 1.00 0.00 C ATOM 0 H ALA A 67 8.054 6.584 -5.178 1.00 0.00 H new ATOM 0 HA ALA A 67 10.986 5.927 -5.601 1.00 0.00 H new ATOM 0 HB1 ALA A 67 11.000 5.902 -3.103 1.00 0.00 H new ATOM 0 HB2 ALA A 67 10.451 7.490 -3.689 1.00 0.00 H new ATOM 0 HB3 ALA A 67 9.267 6.306 -3.085 1.00 0.00 H new ATOM 1086 N GLU A 68 9.699 3.710 -6.103 1.00 0.00 N ATOM 1087 CA GLU A 68 9.331 2.264 -6.121 1.00 0.00 C ATOM 1088 C GLU A 68 10.558 1.400 -5.820 1.00 0.00 C ATOM 1089 O GLU A 68 11.309 1.044 -6.705 1.00 0.00 O ATOM 1090 CB GLU A 68 8.831 2.001 -7.543 1.00 0.00 C ATOM 1091 CG GLU A 68 7.730 3.002 -7.894 1.00 0.00 C ATOM 1092 CD GLU A 68 7.225 2.728 -9.313 1.00 0.00 C ATOM 1093 OE1 GLU A 68 8.051 2.630 -10.204 1.00 0.00 O ATOM 1094 OE2 GLU A 68 6.022 2.620 -9.482 1.00 0.00 O ATOM 0 H GLU A 68 9.961 4.102 -7.008 1.00 0.00 H new ATOM 0 HA GLU A 68 8.579 2.022 -5.370 1.00 0.00 H new ATOM 0 HB2 GLU A 68 9.655 2.089 -8.251 1.00 0.00 H new ATOM 0 HB3 GLU A 68 8.450 0.983 -7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.909 2.920 -7.182 1.00 0.00 H new ATOM 0 HG3 GLU A 68 8.113 4.020 -7.823 1.00 0.00 H new ATOM 1101 N LEU A 69 10.764 1.055 -4.578 1.00 0.00 N ATOM 1102 CA LEU A 69 11.941 0.209 -4.230 1.00 0.00 C ATOM 1103 C LEU A 69 11.528 -1.265 -4.159 1.00 0.00 C ATOM 1104 O LEU A 69 10.507 -1.607 -3.597 1.00 0.00 O ATOM 1105 CB LEU A 69 12.396 0.703 -2.854 1.00 0.00 C ATOM 1106 CG LEU A 69 12.979 2.114 -2.971 1.00 0.00 C ATOM 1107 CD1 LEU A 69 13.930 2.185 -4.168 1.00 0.00 C ATOM 1108 CD2 LEU A 69 11.842 3.120 -3.162 1.00 0.00 C ATOM 0 H LEU A 69 10.171 1.321 -3.792 1.00 0.00 H new ATOM 0 HA LEU A 69 12.736 0.284 -4.972 1.00 0.00 H new ATOM 0 HB2 LEU A 69 11.554 0.705 -2.162 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.144 0.024 -2.444 1.00 0.00 H new ATOM 0 HG LEU A 69 13.530 2.352 -2.061 1.00 0.00 H new ATOM 0 HD11 LEU A 69 14.342 3.191 -4.246 1.00 0.00 H new ATOM 0 HD12 LEU A 69 14.742 1.470 -4.031 1.00 0.00 H new ATOM 0 HD13 LEU A 69 13.385 1.944 -5.081 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.256 4.125 -3.245 1.00 0.00 H new ATOM 0 HD22 LEU A 69 11.291 2.878 -4.071 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.169 3.075 -2.306 1.00 0.00 H new ATOM 1120 N VAL A 70 12.315 -2.138 -4.723 1.00 0.00 N ATOM 1121 CA VAL A 70 11.969 -3.588 -4.684 1.00 0.00 C ATOM 1122 C VAL A 70 12.747 -4.276 -3.558 1.00 0.00 C ATOM 1123 O VAL A 70 13.960 -4.349 -3.587 1.00 0.00 O ATOM 1124 CB VAL A 70 12.392 -4.133 -6.048 1.00 0.00 C ATOM 1125 CG1 VAL A 70 11.924 -5.583 -6.189 1.00 0.00 C ATOM 1126 CG2 VAL A 70 11.758 -3.286 -7.155 1.00 0.00 C ATOM 0 H VAL A 70 13.183 -1.911 -5.209 1.00 0.00 H new ATOM 0 HA VAL A 70 10.910 -3.762 -4.493 1.00 0.00 H new ATOM 0 HB VAL A 70 13.478 -4.092 -6.132 1.00 0.00 H new ATOM 0 HG11 VAL A 70 12.226 -5.970 -7.162 1.00 0.00 H new ATOM 0 HG12 VAL A 70 12.374 -6.189 -5.402 1.00 0.00 H new ATOM 0 HG13 VAL A 70 10.838 -5.625 -6.103 1.00 0.00 H new ATOM 0 HG21 VAL A 70 12.059 -3.674 -8.128 1.00 0.00 H new ATOM 0 HG22 VAL A 70 10.672 -3.327 -7.068 1.00 0.00 H new ATOM 0 HG23 VAL A 70 12.090 -2.252 -7.058 1.00 0.00 H new ATOM 1136 N LEU A 71 12.064 -4.770 -2.561 1.00 0.00 N ATOM 1137 CA LEU A 71 12.773 -5.438 -1.435 1.00 0.00 C ATOM 1138 C LEU A 71 13.724 -6.510 -1.976 1.00 0.00 C ATOM 1139 O LEU A 71 13.354 -7.320 -2.802 1.00 0.00 O ATOM 1140 CB LEU A 71 11.668 -6.068 -0.583 1.00 0.00 C ATOM 1141 CG LEU A 71 11.158 -7.349 -1.243 1.00 0.00 C ATOM 1142 CD1 LEU A 71 12.081 -8.512 -0.872 1.00 0.00 C ATOM 1143 CD2 LEU A 71 9.745 -7.647 -0.738 1.00 0.00 C ATOM 0 H LEU A 71 11.048 -4.740 -2.479 1.00 0.00 H new ATOM 0 HA LEU A 71 13.379 -4.742 -0.854 1.00 0.00 H new ATOM 0 HB2 LEU A 71 12.049 -6.291 0.414 1.00 0.00 H new ATOM 0 HB3 LEU A 71 10.847 -5.362 -0.460 1.00 0.00 H new ATOM 0 HG LEU A 71 11.144 -7.223 -2.326 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.720 -9.427 -1.341 1.00 0.00 H new ATOM 0 HD12 LEU A 71 13.092 -8.300 -1.221 1.00 0.00 H new ATOM 0 HD13 LEU A 71 12.090 -8.638 0.211 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.376 -8.560 -1.206 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.765 -7.776 0.344 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.085 -6.817 -0.992 1.00 0.00 H new ATOM 1155 N LEU A 72 14.947 -6.519 -1.521 1.00 0.00 N ATOM 1156 CA LEU A 72 15.916 -7.536 -2.016 1.00 0.00 C ATOM 1157 C LEU A 72 16.768 -8.067 -0.860 1.00 0.00 C ATOM 1158 O LEU A 72 17.438 -7.319 -0.176 1.00 0.00 O ATOM 1159 CB LEU A 72 16.790 -6.789 -3.025 1.00 0.00 C ATOM 1160 CG LEU A 72 18.045 -7.610 -3.331 1.00 0.00 C ATOM 1161 CD1 LEU A 72 18.093 -7.933 -4.825 1.00 0.00 C ATOM 1162 CD2 LEU A 72 19.287 -6.802 -2.947 1.00 0.00 C ATOM 0 H LEU A 72 15.316 -5.867 -0.829 1.00 0.00 H new ATOM 0 HA LEU A 72 15.418 -8.397 -2.463 1.00 0.00 H new ATOM 0 HB2 LEU A 72 16.230 -6.609 -3.942 1.00 0.00 H new ATOM 0 HB3 LEU A 72 17.070 -5.814 -2.626 1.00 0.00 H new ATOM 0 HG LEU A 72 18.020 -8.537 -2.759 1.00 0.00 H new ATOM 0 HD11 LEU A 72 18.987 -8.518 -5.042 1.00 0.00 H new ATOM 0 HD12 LEU A 72 17.208 -8.506 -5.102 1.00 0.00 H new ATOM 0 HD13 LEU A 72 18.118 -7.006 -5.397 1.00 0.00 H new ATOM 0 HD21 LEU A 72 20.182 -7.385 -3.164 1.00 0.00 H new ATOM 0 HD22 LEU A 72 19.310 -5.875 -3.520 1.00 0.00 H new ATOM 0 HD23 LEU A 72 19.255 -6.569 -1.883 1.00 0.00 H new ATOM 1174 N THR A 73 16.752 -9.352 -0.640 1.00 0.00 N ATOM 1175 CA THR A 73 17.568 -9.926 0.467 1.00 0.00 C ATOM 1176 C THR A 73 18.318 -11.167 -0.025 1.00 0.00 C ATOM 1177 O THR A 73 17.907 -12.286 0.205 1.00 0.00 O ATOM 1178 CB THR A 73 16.557 -10.302 1.551 1.00 0.00 C ATOM 1179 OG1 THR A 73 17.242 -10.865 2.661 1.00 0.00 O ATOM 1180 CG2 THR A 73 15.561 -11.321 0.992 1.00 0.00 C ATOM 0 H THR A 73 16.210 -10.029 -1.178 1.00 0.00 H new ATOM 0 HA THR A 73 18.317 -9.226 0.837 1.00 0.00 H new ATOM 0 HB THR A 73 16.019 -9.410 1.871 1.00 0.00 H new ATOM 0 HG1 THR A 73 18.177 -10.573 2.651 1.00 0.00 H new ATOM 0 HG21 THR A 73 14.841 -11.588 1.766 1.00 0.00 H new ATOM 0 HG22 THR A 73 15.035 -10.887 0.141 1.00 0.00 H new ATOM 0 HG23 THR A 73 16.096 -12.214 0.670 1.00 0.00 H new ATOM 1188 N LEU A 74 19.419 -10.973 -0.697 1.00 0.00 N ATOM 1189 CA LEU A 74 20.204 -12.134 -1.205 1.00 0.00 C ATOM 1190 C LEU A 74 21.699 -11.810 -1.174 1.00 0.00 C ATOM 1191 O LEU A 74 22.097 -10.709 -0.853 1.00 0.00 O ATOM 1192 CB LEU A 74 19.729 -12.344 -2.643 1.00 0.00 C ATOM 1193 CG LEU A 74 19.964 -13.800 -3.051 1.00 0.00 C ATOM 1194 CD1 LEU A 74 18.625 -14.472 -3.359 1.00 0.00 C ATOM 1195 CD2 LEU A 74 20.853 -13.843 -4.296 1.00 0.00 C ATOM 0 H LEU A 74 19.810 -10.057 -0.917 1.00 0.00 H new ATOM 0 HA LEU A 74 20.058 -13.028 -0.598 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.670 -12.098 -2.727 1.00 0.00 H new ATOM 0 HB3 LEU A 74 20.266 -11.675 -3.316 1.00 0.00 H new ATOM 0 HG LEU A 74 20.454 -14.329 -2.233 1.00 0.00 H new ATOM 0 HD11 LEU A 74 18.796 -15.509 -3.649 1.00 0.00 H new ATOM 0 HD12 LEU A 74 17.991 -14.443 -2.473 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.132 -13.944 -4.175 1.00 0.00 H new ATOM 0 HD21 LEU A 74 21.021 -14.880 -4.587 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.363 -13.312 -5.112 1.00 0.00 H new ATOM 0 HD23 LEU A 74 21.809 -13.368 -4.077 1.00 0.00 H new ATOM 1207 N GLY A 75 22.528 -12.760 -1.506 1.00 0.00 N ATOM 1208 CA GLY A 75 23.995 -12.502 -1.496 1.00 0.00 C ATOM 1209 C GLY A 75 24.361 -11.561 -2.647 1.00 0.00 C ATOM 1210 O GLY A 75 25.441 -11.003 -2.682 1.00 0.00 O ATOM 0 H GLY A 75 22.254 -13.702 -1.783 1.00 0.00 H new ATOM 0 HA2 GLY A 75 24.290 -12.060 -0.544 1.00 0.00 H new ATOM 0 HA3 GLY A 75 24.540 -13.441 -1.594 1.00 0.00 H new ATOM 1214 N GLN A 76 23.476 -11.380 -3.591 1.00 0.00 N ATOM 1215 CA GLN A 76 23.787 -10.475 -4.737 1.00 0.00 C ATOM 1216 C GLN A 76 22.840 -9.271 -4.748 1.00 0.00 C ATOM 1217 O GLN A 76 21.761 -9.309 -4.190 1.00 0.00 O ATOM 1218 CB GLN A 76 23.589 -11.337 -5.990 1.00 0.00 C ATOM 1219 CG GLN A 76 22.099 -11.428 -6.330 1.00 0.00 C ATOM 1220 CD GLN A 76 21.855 -12.632 -7.241 1.00 0.00 C ATOM 1221 OE1 GLN A 76 21.304 -12.494 -8.314 1.00 0.00 O ATOM 1222 NE2 GLN A 76 22.247 -13.815 -6.856 1.00 0.00 N ATOM 0 H GLN A 76 22.555 -11.817 -3.619 1.00 0.00 H new ATOM 0 HA GLN A 76 24.798 -10.071 -4.677 1.00 0.00 H new ATOM 0 HB2 GLN A 76 24.137 -10.906 -6.828 1.00 0.00 H new ATOM 0 HB3 GLN A 76 23.994 -12.335 -5.823 1.00 0.00 H new ATOM 0 HG2 GLN A 76 21.512 -11.525 -5.417 1.00 0.00 H new ATOM 0 HG3 GLN A 76 21.771 -10.513 -6.824 1.00 0.00 H new ATOM 0 HE21 GLN A 76 22.710 -13.931 -5.954 1.00 0.00 H new ATOM 0 HE22 GLN A 76 22.091 -14.625 -7.456 1.00 0.00 H new ATOM 1231 N ALA A 77 23.238 -8.205 -5.388 1.00 0.00 N ATOM 1232 CA ALA A 77 22.367 -6.995 -5.447 1.00 0.00 C ATOM 1233 C ALA A 77 21.386 -7.112 -6.617 1.00 0.00 C ATOM 1234 O ALA A 77 21.542 -7.945 -7.488 1.00 0.00 O ATOM 1235 CB ALA A 77 23.326 -5.826 -5.669 1.00 0.00 C ATOM 0 H ALA A 77 24.131 -8.119 -5.874 1.00 0.00 H new ATOM 0 HA ALA A 77 21.773 -6.868 -4.542 1.00 0.00 H new ATOM 0 HB1 ALA A 77 22.760 -4.896 -5.724 1.00 0.00 H new ATOM 0 HB2 ALA A 77 24.032 -5.772 -4.841 1.00 0.00 H new ATOM 0 HB3 ALA A 77 23.871 -5.974 -6.601 1.00 0.00 H new ATOM 1241 N TRP A 78 20.372 -6.290 -6.644 1.00 0.00 N ATOM 1242 CA TRP A 78 19.384 -6.365 -7.760 1.00 0.00 C ATOM 1243 C TRP A 78 19.904 -5.628 -8.997 1.00 0.00 C ATOM 1244 O TRP A 78 20.523 -4.586 -8.899 1.00 0.00 O ATOM 1245 CB TRP A 78 18.126 -5.681 -7.228 1.00 0.00 C ATOM 1246 CG TRP A 78 17.046 -5.763 -8.259 1.00 0.00 C ATOM 1247 CD1 TRP A 78 16.424 -4.699 -8.818 1.00 0.00 C ATOM 1248 CD2 TRP A 78 16.455 -6.949 -8.868 1.00 0.00 C ATOM 1249 NE1 TRP A 78 15.487 -5.157 -9.727 1.00 0.00 N ATOM 1250 CE2 TRP A 78 15.468 -6.535 -9.794 1.00 0.00 C ATOM 1251 CE3 TRP A 78 16.677 -8.330 -8.706 1.00 0.00 C ATOM 1252 CZ2 TRP A 78 14.728 -7.459 -10.534 1.00 0.00 C ATOM 1253 CZ3 TRP A 78 15.933 -9.261 -9.451 1.00 0.00 C ATOM 1254 CH2 TRP A 78 14.960 -8.825 -10.362 1.00 0.00 C ATOM 0 H TRP A 78 20.185 -5.572 -5.944 1.00 0.00 H new ATOM 0 HA TRP A 78 19.197 -7.395 -8.063 1.00 0.00 H new ATOM 0 HB2 TRP A 78 17.800 -6.160 -6.305 1.00 0.00 H new ATOM 0 HB3 TRP A 78 18.338 -4.639 -6.989 1.00 0.00 H new ATOM 0 HD1 TRP A 78 16.626 -3.662 -8.592 1.00 0.00 H new ATOM 0 HE1 TRP A 78 14.883 -4.549 -10.281 1.00 0.00 H new ATOM 0 HE3 TRP A 78 17.423 -8.676 -8.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 13.980 -7.119 -11.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 16.112 -10.318 -9.321 1.00 0.00 H new ATOM 0 HH2 TRP A 78 14.390 -9.546 -10.930 1.00 0.00 H new ATOM 1265 N GLN A 79 19.648 -6.160 -10.162 1.00 0.00 N ATOM 1266 CA GLN A 79 20.115 -5.494 -11.411 1.00 0.00 C ATOM 1267 C GLN A 79 19.041 -5.619 -12.497 1.00 0.00 C ATOM 1268 O GLN A 79 19.212 -6.316 -13.477 1.00 0.00 O ATOM 1269 CB GLN A 79 21.381 -6.250 -11.818 1.00 0.00 C ATOM 1270 CG GLN A 79 22.016 -5.564 -13.030 1.00 0.00 C ATOM 1271 CD GLN A 79 23.490 -5.959 -13.128 1.00 0.00 C ATOM 1272 OE1 GLN A 79 24.225 -5.857 -12.165 1.00 0.00 O ATOM 1273 NE2 GLN A 79 23.959 -6.407 -14.261 1.00 0.00 N ATOM 0 H GLN A 79 19.134 -7.030 -10.302 1.00 0.00 H new ATOM 0 HA GLN A 79 20.309 -4.431 -11.269 1.00 0.00 H new ATOM 0 HB2 GLN A 79 22.087 -6.272 -10.988 1.00 0.00 H new ATOM 0 HB3 GLN A 79 21.138 -7.285 -12.058 1.00 0.00 H new ATOM 0 HG2 GLN A 79 21.490 -5.852 -13.940 1.00 0.00 H new ATOM 0 HG3 GLN A 79 21.924 -4.482 -12.938 1.00 0.00 H new ATOM 0 HE21 GLN A 79 23.343 -6.493 -15.070 1.00 0.00 H new ATOM 0 HE22 GLN A 79 24.941 -6.671 -14.338 1.00 0.00 H new ATOM 1282 N GLY A 80 17.930 -4.953 -12.326 1.00 0.00 N ATOM 1283 CA GLY A 80 16.843 -5.039 -13.343 1.00 0.00 C ATOM 1284 C GLY A 80 17.159 -4.113 -14.519 1.00 0.00 C ATOM 1285 O GLY A 80 16.614 -3.032 -14.636 1.00 0.00 O ATOM 0 H GLY A 80 17.729 -4.353 -11.526 1.00 0.00 H new ATOM 0 HA2 GLY A 80 16.741 -6.066 -13.694 1.00 0.00 H new ATOM 0 HA3 GLY A 80 15.890 -4.760 -12.894 1.00 0.00 H new ATOM 1416 N LYS B 19 -12.848 12.713 4.761 1.00 0.00 N ATOM 1417 CA LYS B 19 -12.826 12.704 3.271 1.00 0.00 C ATOM 1418 C LYS B 19 -13.754 11.610 2.735 1.00 0.00 C ATOM 1419 O LYS B 19 -13.467 10.436 2.859 1.00 0.00 O ATOM 1420 CB LYS B 19 -11.373 12.400 2.904 1.00 0.00 C ATOM 1421 CG LYS B 19 -11.154 12.653 1.412 1.00 0.00 C ATOM 1422 CD LYS B 19 -9.656 12.598 1.104 1.00 0.00 C ATOM 1423 CE LYS B 19 -8.919 13.615 1.977 1.00 0.00 C ATOM 1424 NZ LYS B 19 -7.941 14.269 1.063 1.00 0.00 N ATOM 0 HA LYS B 19 -13.169 13.647 2.845 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -10.701 13.026 3.491 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -11.136 11.364 3.146 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -11.686 11.906 0.823 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -11.559 13.626 1.133 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -9.272 11.595 1.292 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -9.482 12.814 0.050 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -9.609 14.343 2.403 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -8.415 13.127 2.811 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -6.978 14.141 1.436 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -8.007 13.838 0.119 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -8.154 15.285 0.996 1.00 0.00 H new ATOM 1438 N PRO B 20 -14.841 12.037 2.151 1.00 0.00 N ATOM 1439 CA PRO B 20 -15.824 11.081 1.584 1.00 0.00 C ATOM 1440 C PRO B 20 -15.259 10.436 0.315 1.00 0.00 C ATOM 1441 O PRO B 20 -15.275 11.020 -0.750 1.00 0.00 O ATOM 1442 CB PRO B 20 -17.031 11.959 1.263 1.00 0.00 C ATOM 1443 CG PRO B 20 -16.472 13.335 1.083 1.00 0.00 C ATOM 1444 CD PRO B 20 -15.252 13.432 1.963 1.00 0.00 C ATOM 0 HA PRO B 20 -16.071 10.261 2.258 1.00 0.00 H new ATOM 0 HB2 PRO B 20 -17.538 11.618 0.361 1.00 0.00 H new ATOM 0 HB3 PRO B 20 -17.764 11.933 2.070 1.00 0.00 H new ATOM 0 HG2 PRO B 20 -16.210 13.512 0.040 1.00 0.00 H new ATOM 0 HG3 PRO B 20 -17.208 14.090 1.359 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -14.465 14.020 1.491 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -15.482 13.912 2.914 1.00 0.00 H new ATOM 1452 N CYS B 21 -14.750 9.240 0.425 1.00 0.00 N ATOM 1453 CA CYS B 21 -14.174 8.563 -0.772 1.00 0.00 C ATOM 1454 C CYS B 21 -15.162 7.541 -1.339 1.00 0.00 C ATOM 1455 O CYS B 21 -16.213 7.299 -0.779 1.00 0.00 O ATOM 1456 CB CYS B 21 -12.914 7.862 -0.263 1.00 0.00 C ATOM 1457 SG CYS B 21 -11.941 9.015 0.737 1.00 0.00 S ATOM 0 H CYS B 21 -14.708 8.702 1.291 1.00 0.00 H new ATOM 0 HA CYS B 21 -13.956 9.268 -1.574 1.00 0.00 H new ATOM 0 HB2 CYS B 21 -13.186 6.989 0.331 1.00 0.00 H new ATOM 0 HB3 CYS B 21 -12.320 7.503 -1.104 1.00 0.00 H new ATOM 0 HG CYS B 21 -12.657 9.430 1.740 1.00 0.00 H new ATOM 1463 N LEU B 22 -14.828 6.941 -2.449 1.00 0.00 N ATOM 1464 CA LEU B 22 -15.740 5.931 -3.062 1.00 0.00 C ATOM 1465 C LEU B 22 -15.128 4.531 -2.959 1.00 0.00 C ATOM 1466 O LEU B 22 -14.087 4.257 -3.521 1.00 0.00 O ATOM 1467 CB LEU B 22 -15.866 6.350 -4.528 1.00 0.00 C ATOM 1468 CG LEU B 22 -16.706 7.624 -4.627 1.00 0.00 C ATOM 1469 CD1 LEU B 22 -16.344 8.377 -5.909 1.00 0.00 C ATOM 1470 CD2 LEU B 22 -18.190 7.252 -4.658 1.00 0.00 C ATOM 0 H LEU B 22 -13.961 7.107 -2.960 1.00 0.00 H new ATOM 0 HA LEU B 22 -16.708 5.893 -2.561 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -14.877 6.520 -4.954 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.329 5.551 -5.107 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.506 8.259 -3.764 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -16.943 9.285 -5.979 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -15.286 8.640 -5.890 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -16.544 7.743 -6.772 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -18.791 8.159 -4.729 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -18.388 6.617 -5.522 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -18.450 6.715 -3.746 1.00 0.00 H new ATOM 1482 N LEU B 23 -15.766 3.644 -2.246 1.00 0.00 N ATOM 1483 CA LEU B 23 -15.218 2.262 -2.111 1.00 0.00 C ATOM 1484 C LEU B 23 -15.972 1.305 -3.039 1.00 0.00 C ATOM 1485 O LEU B 23 -16.922 1.683 -3.693 1.00 0.00 O ATOM 1486 CB LEU B 23 -15.455 1.884 -0.648 1.00 0.00 C ATOM 1487 CG LEU B 23 -14.447 2.615 0.239 1.00 0.00 C ATOM 1488 CD1 LEU B 23 -13.030 2.354 -0.271 1.00 0.00 C ATOM 1489 CD2 LEU B 23 -14.732 4.119 0.200 1.00 0.00 C ATOM 0 H LEU B 23 -16.642 3.815 -1.751 1.00 0.00 H new ATOM 0 HA LEU B 23 -14.164 2.206 -2.381 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -16.471 2.146 -0.354 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -15.354 0.806 -0.519 1.00 0.00 H new ATOM 0 HG LEU B 23 -14.536 2.252 1.263 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -12.313 2.876 0.363 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -12.825 1.284 -0.245 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -12.940 2.716 -1.295 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -14.014 4.642 0.832 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -14.643 4.480 -0.825 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -15.742 4.308 0.565 1.00 0.00 H new ATOM 1501 N ARG B 24 -15.553 0.071 -3.105 1.00 0.00 N ATOM 1502 CA ARG B 24 -16.256 -0.903 -3.991 1.00 0.00 C ATOM 1503 C ARG B 24 -16.336 -2.274 -3.316 1.00 0.00 C ATOM 1504 O ARG B 24 -15.786 -2.488 -2.254 1.00 0.00 O ATOM 1505 CB ARG B 24 -15.410 -0.972 -5.263 1.00 0.00 C ATOM 1506 CG ARG B 24 -16.143 -1.802 -6.320 1.00 0.00 C ATOM 1507 CD ARG B 24 -15.488 -1.587 -7.687 1.00 0.00 C ATOM 1508 NE ARG B 24 -15.897 -2.768 -8.498 1.00 0.00 N ATOM 1509 CZ ARG B 24 -15.303 -3.021 -9.633 1.00 0.00 C ATOM 1510 NH1 ARG B 24 -14.347 -2.242 -10.063 1.00 0.00 N ATOM 1511 NH2 ARG B 24 -15.664 -4.057 -10.341 1.00 0.00 N ATOM 0 H ARG B 24 -14.759 -0.305 -2.587 1.00 0.00 H new ATOM 0 HA ARG B 24 -17.281 -0.599 -4.205 1.00 0.00 H new ATOM 0 HB2 ARG B 24 -15.221 0.033 -5.641 1.00 0.00 H new ATOM 0 HB3 ARG B 24 -14.440 -1.418 -5.043 1.00 0.00 H new ATOM 0 HG2 ARG B 24 -16.112 -2.858 -6.053 1.00 0.00 H new ATOM 0 HG3 ARG B 24 -17.193 -1.513 -6.359 1.00 0.00 H new ATOM 0 HD2 ARG B 24 -15.826 -0.657 -8.145 1.00 0.00 H new ATOM 0 HD3 ARG B 24 -14.403 -1.524 -7.600 1.00 0.00 H new ATOM 0 HE ARG B 24 -16.642 -3.380 -8.166 1.00 0.00 H new ATOM 0 HH11 ARG B 24 -14.062 -1.433 -9.512 1.00 0.00 H new ATOM 0 HH12 ARG B 24 -13.885 -2.443 -10.950 1.00 0.00 H new ATOM 0 HH21 ARG B 24 -16.410 -4.668 -10.007 1.00 0.00 H new ATOM 0 HH22 ARG B 24 -15.201 -4.255 -11.228 1.00 0.00 H new ATOM 1525 N ARG B 25 -17.014 -3.206 -3.929 1.00 0.00 N ATOM 1526 CA ARG B 25 -17.128 -4.566 -3.329 1.00 0.00 C ATOM 1527 C ARG B 25 -16.618 -5.614 -4.324 1.00 0.00 C ATOM 1528 O ARG B 25 -16.848 -5.515 -5.513 1.00 0.00 O ATOM 1529 CB ARG B 25 -18.624 -4.752 -3.063 1.00 0.00 C ATOM 1530 CG ARG B 25 -18.847 -6.000 -2.206 1.00 0.00 C ATOM 1531 CD ARG B 25 -20.313 -6.064 -1.774 1.00 0.00 C ATOM 1532 NE ARG B 25 -20.730 -7.470 -2.029 1.00 0.00 N ATOM 1533 CZ ARG B 25 -21.996 -7.766 -2.168 1.00 0.00 C ATOM 1534 NH1 ARG B 25 -22.905 -6.832 -2.082 1.00 0.00 N ATOM 1535 NH2 ARG B 25 -22.353 -9.001 -2.392 1.00 0.00 N ATOM 0 H ARG B 25 -17.494 -3.084 -4.820 1.00 0.00 H new ATOM 0 HA ARG B 25 -16.539 -4.677 -2.419 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -19.024 -3.875 -2.555 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -19.161 -4.847 -4.007 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -18.583 -6.894 -2.771 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -18.199 -5.974 -1.330 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -20.426 -5.804 -0.722 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -20.923 -5.362 -2.343 1.00 0.00 H new ATOM 0 HE ARG B 25 -20.026 -8.205 -2.096 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -22.629 -5.866 -1.906 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -23.891 -7.069 -2.191 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -21.645 -9.732 -2.458 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -23.340 -9.235 -2.501 1.00 0.00 H new ATOM 1549 N ASN B 26 -15.923 -6.612 -3.852 1.00 0.00 N ATOM 1550 CA ASN B 26 -15.394 -7.657 -4.777 1.00 0.00 C ATOM 1551 C ASN B 26 -16.544 -8.341 -5.524 1.00 0.00 C ATOM 1552 O ASN B 26 -16.379 -8.822 -6.627 1.00 0.00 O ATOM 1553 CB ASN B 26 -14.671 -8.655 -3.875 1.00 0.00 C ATOM 1554 CG ASN B 26 -13.949 -9.694 -4.735 1.00 0.00 C ATOM 1555 OD1 ASN B 26 -12.883 -9.434 -5.256 1.00 0.00 O ATOM 1556 ND2 ASN B 26 -14.490 -10.870 -4.909 1.00 0.00 N ATOM 0 H ASN B 26 -15.698 -6.750 -2.867 1.00 0.00 H new ATOM 0 HA ASN B 26 -14.732 -7.238 -5.535 1.00 0.00 H new ATOM 0 HB2 ASN B 26 -13.955 -8.134 -3.239 1.00 0.00 H new ATOM 0 HB3 ASN B 26 -15.385 -9.147 -3.215 1.00 0.00 H new ATOM 0 HD21 ASN B 26 -14.017 -11.569 -5.482 1.00 0.00 H new ATOM 0 HD22 ASN B 26 -15.385 -11.089 -4.472 1.00 0.00 H new ATOM 1563 N TYR B 27 -17.705 -8.388 -4.931 1.00 0.00 N ATOM 1564 CA TYR B 27 -18.861 -9.044 -5.606 1.00 0.00 C ATOM 1565 C TYR B 27 -19.628 -8.029 -6.461 1.00 0.00 C ATOM 1566 O TYR B 27 -19.938 -8.280 -7.609 1.00 0.00 O ATOM 1567 CB TYR B 27 -19.748 -9.552 -4.470 1.00 0.00 C ATOM 1568 CG TYR B 27 -18.936 -10.425 -3.544 1.00 0.00 C ATOM 1569 CD1 TYR B 27 -18.252 -9.854 -2.464 1.00 0.00 C ATOM 1570 CD2 TYR B 27 -18.870 -11.806 -3.762 1.00 0.00 C ATOM 1571 CE1 TYR B 27 -17.502 -10.664 -1.603 1.00 0.00 C ATOM 1572 CE2 TYR B 27 -18.121 -12.616 -2.901 1.00 0.00 C ATOM 1573 CZ TYR B 27 -17.436 -12.044 -1.822 1.00 0.00 C ATOM 1574 OH TYR B 27 -16.698 -12.842 -0.972 1.00 0.00 O ATOM 0 H TYR B 27 -17.904 -8.001 -4.008 1.00 0.00 H new ATOM 0 HA TYR B 27 -18.543 -9.846 -6.271 1.00 0.00 H new ATOM 0 HB2 TYR B 27 -20.167 -8.710 -3.918 1.00 0.00 H new ATOM 0 HB3 TYR B 27 -20.587 -10.117 -4.875 1.00 0.00 H new ATOM 0 HD1 TYR B 27 -18.303 -8.789 -2.295 1.00 0.00 H new ATOM 0 HD2 TYR B 27 -19.397 -12.247 -4.595 1.00 0.00 H new ATOM 0 HE1 TYR B 27 -16.974 -10.223 -0.770 1.00 0.00 H new ATOM 0 HE2 TYR B 27 -18.071 -13.682 -3.069 1.00 0.00 H new ATOM 0 HH TYR B 27 -16.758 -13.775 -1.265 1.00 0.00 H new ATOM 1584 N SER B 28 -19.942 -6.889 -5.909 1.00 0.00 N ATOM 1585 CA SER B 28 -20.697 -5.866 -6.688 1.00 0.00 C ATOM 1586 C SER B 28 -19.756 -5.097 -7.620 1.00 0.00 C ATOM 1587 O SER B 28 -18.697 -4.652 -7.221 1.00 0.00 O ATOM 1588 CB SER B 28 -21.292 -4.928 -5.639 1.00 0.00 C ATOM 1589 OG SER B 28 -22.224 -4.056 -6.265 1.00 0.00 O ATOM 0 H SER B 28 -19.709 -6.621 -4.953 1.00 0.00 H new ATOM 0 HA SER B 28 -21.464 -6.317 -7.318 1.00 0.00 H new ATOM 0 HB2 SER B 28 -21.785 -5.505 -4.856 1.00 0.00 H new ATOM 0 HB3 SER B 28 -20.501 -4.351 -5.160 1.00 0.00 H new ATOM 0 HG SER B 28 -22.609 -3.454 -5.595 1.00 0.00 H new ATOM 1595 N ARG B 29 -20.135 -4.937 -8.857 1.00 0.00 N ATOM 1596 CA ARG B 29 -19.267 -4.195 -9.815 1.00 0.00 C ATOM 1597 C ARG B 29 -19.617 -2.704 -9.800 1.00 0.00 C ATOM 1598 O ARG B 29 -18.971 -1.898 -10.439 1.00 0.00 O ATOM 1599 CB ARG B 29 -19.576 -4.804 -11.183 1.00 0.00 C ATOM 1600 CG ARG B 29 -18.744 -4.097 -12.255 1.00 0.00 C ATOM 1601 CD ARG B 29 -19.552 -2.941 -12.848 1.00 0.00 C ATOM 1602 NE ARG B 29 -18.547 -1.884 -13.147 1.00 0.00 N ATOM 1603 CZ ARG B 29 -18.932 -0.653 -13.357 1.00 0.00 C ATOM 1604 NH1 ARG B 29 -20.200 -0.344 -13.307 1.00 0.00 N ATOM 1605 NH2 ARG B 29 -18.047 0.269 -13.618 1.00 0.00 N ATOM 0 H ARG B 29 -21.010 -5.288 -9.247 1.00 0.00 H new ATOM 0 HA ARG B 29 -18.210 -4.276 -9.562 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -19.351 -5.871 -11.177 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -20.638 -4.703 -11.406 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -17.817 -3.722 -11.822 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -18.468 -4.802 -13.039 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -20.080 -3.250 -13.750 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -20.304 -2.583 -12.145 1.00 0.00 H new ATOM 0 HE ARG B 29 -17.556 -2.121 -13.188 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -20.893 -1.064 -13.104 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -20.497 0.618 -13.471 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -17.057 0.029 -13.658 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -18.345 1.230 -13.782 1.00 0.00 H new ATOM 1619 N GLU B 30 -20.636 -2.332 -9.072 1.00 0.00 N ATOM 1620 CA GLU B 30 -21.028 -0.893 -9.013 1.00 0.00 C ATOM 1621 C GLU B 30 -20.111 -0.141 -8.045 1.00 0.00 C ATOM 1622 O GLU B 30 -19.441 -0.736 -7.225 1.00 0.00 O ATOM 1623 CB GLU B 30 -22.468 -0.902 -8.497 1.00 0.00 C ATOM 1624 CG GLU B 30 -22.921 0.531 -8.212 1.00 0.00 C ATOM 1625 CD GLU B 30 -24.278 0.503 -7.504 1.00 0.00 C ATOM 1626 OE1 GLU B 30 -24.293 0.263 -6.307 1.00 0.00 O ATOM 1627 OE2 GLU B 30 -25.277 0.719 -8.169 1.00 0.00 O ATOM 0 H GLU B 30 -21.214 -2.962 -8.516 1.00 0.00 H new ATOM 0 HA GLU B 30 -20.945 -0.396 -9.979 1.00 0.00 H new ATOM 0 HB2 GLU B 30 -23.126 -1.362 -9.234 1.00 0.00 H new ATOM 0 HB3 GLU B 30 -22.536 -1.503 -7.590 1.00 0.00 H new ATOM 0 HG2 GLU B 30 -22.184 1.040 -7.591 1.00 0.00 H new ATOM 0 HG3 GLU B 30 -22.996 1.093 -9.143 1.00 0.00 H new ATOM 1634 N GLN B 31 -20.069 1.161 -8.133 1.00 0.00 N ATOM 1635 CA GLN B 31 -19.188 1.937 -7.213 1.00 0.00 C ATOM 1636 C GLN B 31 -19.925 2.250 -5.910 1.00 0.00 C ATOM 1637 O GLN B 31 -21.115 2.494 -5.896 1.00 0.00 O ATOM 1638 CB GLN B 31 -18.859 3.225 -7.967 1.00 0.00 C ATOM 1639 CG GLN B 31 -17.862 4.052 -7.153 1.00 0.00 C ATOM 1640 CD GLN B 31 -17.312 5.187 -8.019 1.00 0.00 C ATOM 1641 OE1 GLN B 31 -16.241 5.073 -8.581 1.00 0.00 O ATOM 1642 NE2 GLN B 31 -18.004 6.286 -8.150 1.00 0.00 N ATOM 0 H GLN B 31 -20.604 1.719 -8.799 1.00 0.00 H new ATOM 0 HA GLN B 31 -18.289 1.384 -6.942 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -18.439 2.989 -8.945 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -19.769 3.800 -8.140 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -18.349 4.460 -6.267 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -17.046 3.418 -6.805 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -18.903 6.382 -7.678 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -17.646 7.049 -8.724 1.00 0.00 H new ATOM 1651 N HIS B 32 -19.220 2.241 -4.812 1.00 0.00 N ATOM 1652 CA HIS B 32 -19.866 2.532 -3.505 1.00 0.00 C ATOM 1653 C HIS B 32 -19.333 3.860 -2.959 1.00 0.00 C ATOM 1654 O HIS B 32 -18.452 4.466 -3.535 1.00 0.00 O ATOM 1655 CB HIS B 32 -19.468 1.372 -2.585 1.00 0.00 C ATOM 1656 CG HIS B 32 -19.701 0.041 -3.266 1.00 0.00 C ATOM 1657 ND1 HIS B 32 -20.196 -1.050 -2.572 1.00 0.00 N ATOM 1658 CD2 HIS B 32 -19.515 -0.399 -4.559 1.00 0.00 C ATOM 1659 CE1 HIS B 32 -20.296 -2.076 -3.436 1.00 0.00 C ATOM 1660 NE2 HIS B 32 -19.895 -1.733 -4.660 1.00 0.00 N ATOM 0 H HIS B 32 -18.220 2.044 -4.766 1.00 0.00 H new ATOM 0 HA HIS B 32 -20.949 2.621 -3.586 1.00 0.00 H new ATOM 0 HB2 HIS B 32 -18.418 1.465 -2.309 1.00 0.00 H new ATOM 0 HB3 HIS B 32 -20.046 1.419 -1.662 1.00 0.00 H new ATOM 0 HD2 HIS B 32 -19.132 0.201 -5.371 1.00 0.00 H new ATOM 0 HE1 HIS B 32 -20.657 -3.058 -3.170 1.00 0.00 H new ATOM 0 HE2 HIS B 32 -19.872 -2.322 -5.492 1.00 0.00 H new ATOM 1668 N GLY B 33 -19.858 4.323 -1.858 1.00 0.00 N ATOM 1669 CA GLY B 33 -19.370 5.616 -1.296 1.00 0.00 C ATOM 1670 C GLY B 33 -19.285 5.520 0.229 1.00 0.00 C ATOM 1671 O GLY B 33 -20.189 5.040 0.884 1.00 0.00 O ATOM 0 H GLY B 33 -20.599 3.866 -1.326 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.390 5.856 -1.709 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -20.043 6.424 -1.582 1.00 0.00 H new ATOM 1675 N VAL B 34 -18.204 5.979 0.798 1.00 0.00 N ATOM 1676 CA VAL B 34 -18.055 5.921 2.280 1.00 0.00 C ATOM 1677 C VAL B 34 -17.401 7.206 2.794 1.00 0.00 C ATOM 1678 O VAL B 34 -17.000 8.059 2.028 1.00 0.00 O ATOM 1679 CB VAL B 34 -17.150 4.717 2.540 1.00 0.00 C ATOM 1680 CG1 VAL B 34 -17.198 4.354 4.026 1.00 0.00 C ATOM 1681 CG2 VAL B 34 -17.637 3.528 1.709 1.00 0.00 C ATOM 0 H VAL B 34 -17.416 6.392 0.300 1.00 0.00 H new ATOM 0 HA VAL B 34 -19.014 5.826 2.789 1.00 0.00 H new ATOM 0 HB VAL B 34 -16.126 4.963 2.260 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -16.553 3.495 4.212 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.854 5.202 4.619 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -18.222 4.106 4.307 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -16.993 2.668 1.893 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -18.661 3.282 1.991 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -17.604 3.786 0.651 1.00 0.00 H new ATOM 1691 N ALA B 35 -17.293 7.353 4.086 1.00 0.00 N ATOM 1692 CA ALA B 35 -16.664 8.585 4.646 1.00 0.00 C ATOM 1693 C ALA B 35 -15.755 8.225 5.824 1.00 0.00 C ATOM 1694 O ALA B 35 -16.211 8.013 6.930 1.00 0.00 O ATOM 1695 CB ALA B 35 -17.835 9.447 5.116 1.00 0.00 C ATOM 0 H ALA B 35 -17.612 6.675 4.778 1.00 0.00 H new ATOM 0 HA ALA B 35 -16.044 9.103 3.914 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -17.455 10.375 5.543 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -18.482 9.675 4.269 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -18.404 8.906 5.872 1.00 0.00 H new ATOM 1701 N ALA B 36 -14.472 8.155 5.597 1.00 0.00 N ATOM 1702 CA ALA B 36 -13.536 7.807 6.704 1.00 0.00 C ATOM 1703 C ALA B 36 -12.265 8.657 6.613 1.00 0.00 C ATOM 1704 O ALA B 36 -11.758 8.921 5.541 1.00 0.00 O ATOM 1705 CB ALA B 36 -13.209 6.330 6.495 1.00 0.00 C ATOM 0 H ALA B 36 -14.031 8.324 4.693 1.00 0.00 H new ATOM 0 HA ALA B 36 -13.971 7.994 7.686 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -12.522 5.996 7.273 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -14.126 5.744 6.545 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -12.745 6.195 5.518 1.00 0.00 H new ATOM 1711 N SER B 37 -11.747 9.085 7.731 1.00 0.00 N ATOM 1712 CA SER B 37 -10.509 9.916 7.711 1.00 0.00 C ATOM 1713 C SER B 37 -9.271 9.020 7.790 1.00 0.00 C ATOM 1714 O SER B 37 -8.172 9.433 7.477 1.00 0.00 O ATOM 1715 CB SER B 37 -10.608 10.805 8.951 1.00 0.00 C ATOM 1716 OG SER B 37 -10.691 9.988 10.114 1.00 0.00 O ATOM 0 H SER B 37 -12.127 8.895 8.658 1.00 0.00 H new ATOM 0 HA SER B 37 -10.419 10.502 6.796 1.00 0.00 H new ATOM 0 HB2 SER B 37 -9.738 11.458 9.014 1.00 0.00 H new ATOM 0 HB3 SER B 37 -11.485 11.448 8.882 1.00 0.00 H new ATOM 0 HG SER B 37 -9.831 9.543 10.263 1.00 0.00 H new ATOM 1722 N CYS B 38 -9.439 7.795 8.207 1.00 0.00 N ATOM 1723 CA CYS B 38 -8.270 6.874 8.307 1.00 0.00 C ATOM 1724 C CYS B 38 -8.591 5.534 7.639 1.00 0.00 C ATOM 1725 O CYS B 38 -9.737 5.199 7.418 1.00 0.00 O ATOM 1726 CB CYS B 38 -8.046 6.684 9.808 1.00 0.00 C ATOM 1727 SG CYS B 38 -7.987 8.301 10.619 1.00 0.00 S ATOM 0 H CYS B 38 -10.334 7.392 8.483 1.00 0.00 H new ATOM 0 HA CYS B 38 -7.386 7.272 7.808 1.00 0.00 H new ATOM 0 HB2 CYS B 38 -8.849 6.081 10.233 1.00 0.00 H new ATOM 0 HB3 CYS B 38 -7.115 6.144 9.982 1.00 0.00 H new ATOM 0 HG CYS B 38 -7.517 9.185 9.790 1.00 0.00 H new ATOM 1733 N LEU B 39 -7.587 4.768 7.314 1.00 0.00 N ATOM 1734 CA LEU B 39 -7.834 3.450 6.660 1.00 0.00 C ATOM 1735 C LEU B 39 -8.667 2.552 7.575 1.00 0.00 C ATOM 1736 O LEU B 39 -9.766 2.156 7.241 1.00 0.00 O ATOM 1737 CB LEU B 39 -6.445 2.849 6.440 1.00 0.00 C ATOM 1738 CG LEU B 39 -5.758 3.559 5.274 1.00 0.00 C ATOM 1739 CD1 LEU B 39 -4.420 2.878 4.978 1.00 0.00 C ATOM 1740 CD2 LEU B 39 -6.652 3.482 4.034 1.00 0.00 C ATOM 0 H LEU B 39 -6.606 4.997 7.472 1.00 0.00 H new ATOM 0 HA LEU B 39 -8.387 3.551 5.726 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -5.846 2.951 7.345 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -6.528 1.782 6.231 1.00 0.00 H new ATOM 0 HG LEU B 39 -5.585 4.603 5.536 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -3.930 3.384 4.146 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -3.782 2.930 5.861 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -4.593 1.834 4.716 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -6.164 3.988 3.201 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -6.824 2.438 3.774 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -7.606 3.966 4.243 1.00 0.00 H new ATOM 1752 N GLU B 40 -8.152 2.226 8.730 1.00 0.00 N ATOM 1753 CA GLU B 40 -8.915 1.351 9.665 1.00 0.00 C ATOM 1754 C GLU B 40 -10.380 1.794 9.727 1.00 0.00 C ATOM 1755 O GLU B 40 -11.286 0.989 9.654 1.00 0.00 O ATOM 1756 CB GLU B 40 -8.240 1.535 11.024 1.00 0.00 C ATOM 1757 CG GLU B 40 -8.755 0.476 11.999 1.00 0.00 C ATOM 1758 CD GLU B 40 -8.136 0.706 13.378 1.00 0.00 C ATOM 1759 OE1 GLU B 40 -8.515 1.670 14.022 1.00 0.00 O ATOM 1760 OE2 GLU B 40 -7.293 -0.085 13.767 1.00 0.00 O ATOM 0 H GLU B 40 -7.237 2.527 9.066 1.00 0.00 H new ATOM 0 HA GLU B 40 -8.912 0.308 9.349 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -7.158 1.452 10.919 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -8.446 2.532 11.412 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -9.842 0.525 12.064 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -8.502 -0.520 11.637 1.00 0.00 H new ATOM 1767 N ASP B 41 -10.618 3.071 9.861 1.00 0.00 N ATOM 1768 CA ASP B 41 -12.024 3.564 9.925 1.00 0.00 C ATOM 1769 C ASP B 41 -12.714 3.360 8.573 1.00 0.00 C ATOM 1770 O ASP B 41 -13.890 3.063 8.504 1.00 0.00 O ATOM 1771 CB ASP B 41 -11.908 5.053 10.250 1.00 0.00 C ATOM 1772 CG ASP B 41 -13.291 5.613 10.587 1.00 0.00 C ATOM 1773 OD1 ASP B 41 -14.081 4.882 11.161 1.00 0.00 O ATOM 1774 OD2 ASP B 41 -13.536 6.764 10.266 1.00 0.00 O ATOM 0 H ASP B 41 -9.901 3.793 9.929 1.00 0.00 H new ATOM 0 HA ASP B 41 -12.617 3.032 10.669 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -11.230 5.200 11.091 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -11.484 5.589 9.401 1.00 0.00 H new ATOM 1779 N LEU B 42 -11.990 3.514 7.498 1.00 0.00 N ATOM 1780 CA LEU B 42 -12.603 3.326 6.152 1.00 0.00 C ATOM 1781 C LEU B 42 -13.170 1.910 6.027 1.00 0.00 C ATOM 1782 O LEU B 42 -14.239 1.704 5.485 1.00 0.00 O ATOM 1783 CB LEU B 42 -11.458 3.538 5.163 1.00 0.00 C ATOM 1784 CG LEU B 42 -12.007 3.548 3.734 1.00 0.00 C ATOM 1785 CD1 LEU B 42 -12.398 2.126 3.329 1.00 0.00 C ATOM 1786 CD2 LEU B 42 -13.239 4.455 3.666 1.00 0.00 C ATOM 0 H LEU B 42 -11.001 3.762 7.493 1.00 0.00 H new ATOM 0 HA LEU B 42 -13.428 4.015 5.971 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -10.951 4.479 5.375 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -10.718 2.745 5.273 1.00 0.00 H new ATOM 0 HG LEU B 42 -11.242 3.923 3.054 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -12.789 2.132 2.312 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -11.521 1.480 3.377 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -13.163 1.751 4.009 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -13.630 4.462 2.649 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -14.004 4.081 4.346 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -12.961 5.469 3.955 1.00 0.00 H new ATOM 1798 N ARG B 43 -12.465 0.932 6.528 1.00 0.00 N ATOM 1799 CA ARG B 43 -12.966 -0.469 6.440 1.00 0.00 C ATOM 1800 C ARG B 43 -14.210 -0.632 7.312 1.00 0.00 C ATOM 1801 O ARG B 43 -15.304 -0.840 6.826 1.00 0.00 O ATOM 1802 CB ARG B 43 -11.824 -1.330 6.984 1.00 0.00 C ATOM 1803 CG ARG B 43 -12.052 -2.791 6.593 1.00 0.00 C ATOM 1804 CD ARG B 43 -11.104 -3.688 7.393 1.00 0.00 C ATOM 1805 NE ARG B 43 -11.892 -4.921 7.679 1.00 0.00 N ATOM 1806 CZ ARG B 43 -12.793 -4.919 8.624 1.00 0.00 C ATOM 1807 NH1 ARG B 43 -13.010 -3.838 9.324 1.00 0.00 N ATOM 1808 NH2 ARG B 43 -13.481 -6.000 8.869 1.00 0.00 N ATOM 0 H ARG B 43 -11.564 1.043 6.994 1.00 0.00 H new ATOM 0 HA ARG B 43 -13.243 -0.748 5.423 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -10.871 -0.981 6.587 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -11.770 -1.237 8.069 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -13.087 -3.073 6.787 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -11.880 -2.924 5.525 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -10.203 -3.918 6.824 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -10.783 -3.202 8.314 1.00 0.00 H new ATOM 0 HE ARG B 43 -11.727 -5.768 7.135 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -12.475 -2.991 9.133 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -13.715 -3.841 10.061 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -13.315 -6.845 8.323 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -14.185 -6.000 9.607 1.00 0.00 H new ATOM 1822 N SER B 44 -14.045 -0.538 8.602 1.00 0.00 N ATOM 1823 CA SER B 44 -15.211 -0.685 9.520 1.00 0.00 C ATOM 1824 C SER B 44 -16.406 0.118 8.999 1.00 0.00 C ATOM 1825 O SER B 44 -17.512 -0.378 8.920 1.00 0.00 O ATOM 1826 CB SER B 44 -14.732 -0.126 10.858 1.00 0.00 C ATOM 1827 OG SER B 44 -15.790 -0.206 11.805 1.00 0.00 O ATOM 0 H SER B 44 -13.151 -0.365 9.062 1.00 0.00 H new ATOM 0 HA SER B 44 -15.541 -1.721 9.603 1.00 0.00 H new ATOM 0 HB2 SER B 44 -13.868 -0.688 11.212 1.00 0.00 H new ATOM 0 HB3 SER B 44 -14.412 0.909 10.739 1.00 0.00 H new ATOM 0 HG SER B 44 -15.486 0.150 12.666 1.00 0.00 H new ATOM 1833 N LYS B 45 -16.195 1.357 8.645 1.00 0.00 N ATOM 1834 CA LYS B 45 -17.321 2.187 8.133 1.00 0.00 C ATOM 1835 C LYS B 45 -17.798 1.652 6.781 1.00 0.00 C ATOM 1836 O LYS B 45 -18.967 1.386 6.586 1.00 0.00 O ATOM 1837 CB LYS B 45 -16.739 3.592 7.984 1.00 0.00 C ATOM 1838 CG LYS B 45 -16.702 4.273 9.353 1.00 0.00 C ATOM 1839 CD LYS B 45 -16.489 5.777 9.171 1.00 0.00 C ATOM 1840 CE LYS B 45 -17.604 6.540 9.891 1.00 0.00 C ATOM 1841 NZ LYS B 45 -17.384 7.970 9.535 1.00 0.00 N ATOM 0 H LYS B 45 -15.292 1.829 8.688 1.00 0.00 H new ATOM 0 HA LYS B 45 -18.184 2.174 8.799 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -15.734 3.539 7.564 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -17.344 4.177 7.291 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -17.634 4.089 9.887 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -15.899 3.852 9.958 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -15.518 6.069 9.570 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -16.487 6.029 8.111 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -18.588 6.200 9.568 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -17.553 6.389 10.969 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -18.296 8.470 9.528 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -16.754 8.409 10.236 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -16.949 8.030 8.592 1.00 0.00 H new ATOM 1855 N ALA B 46 -16.903 1.487 5.846 1.00 0.00 N ATOM 1856 CA ALA B 46 -17.313 0.964 4.512 1.00 0.00 C ATOM 1857 C ALA B 46 -18.078 -0.351 4.681 1.00 0.00 C ATOM 1858 O ALA B 46 -18.809 -0.773 3.809 1.00 0.00 O ATOM 1859 CB ALA B 46 -16.004 0.729 3.756 1.00 0.00 C ATOM 0 H ALA B 46 -15.909 1.691 5.947 1.00 0.00 H new ATOM 0 HA ALA B 46 -17.970 1.653 3.980 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -16.223 0.342 2.761 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -15.461 1.670 3.668 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -15.394 0.007 4.300 1.00 0.00 H new ATOM 1865 N CYS B 47 -17.918 -0.998 5.804 1.00 0.00 N ATOM 1866 CA CYS B 47 -18.636 -2.284 6.033 1.00 0.00 C ATOM 1867 C CYS B 47 -20.111 -2.016 6.344 1.00 0.00 C ATOM 1868 O CYS B 47 -20.997 -2.608 5.758 1.00 0.00 O ATOM 1869 CB CYS B 47 -17.941 -2.916 7.239 1.00 0.00 C ATOM 1870 SG CYS B 47 -18.489 -4.630 7.423 1.00 0.00 S ATOM 0 H CYS B 47 -17.321 -0.691 6.572 1.00 0.00 H new ATOM 0 HA CYS B 47 -18.608 -2.935 5.159 1.00 0.00 H new ATOM 0 HB2 CYS B 47 -16.859 -2.881 7.108 1.00 0.00 H new ATOM 0 HB3 CYS B 47 -18.171 -2.351 8.142 1.00 0.00 H new ATOM 0 HG CYS B 47 -17.896 -5.168 8.447 1.00 0.00 H new ATOM 1876 N ASP B 48 -20.383 -1.127 7.261 1.00 0.00 N ATOM 1877 CA ASP B 48 -21.802 -0.821 7.605 1.00 0.00 C ATOM 1878 C ASP B 48 -22.522 -0.231 6.390 1.00 0.00 C ATOM 1879 O ASP B 48 -23.709 -0.418 6.209 1.00 0.00 O ATOM 1880 CB ASP B 48 -21.724 0.203 8.739 1.00 0.00 C ATOM 1881 CG ASP B 48 -21.300 1.561 8.176 1.00 0.00 C ATOM 1882 OD1 ASP B 48 -22.087 2.153 7.454 1.00 0.00 O ATOM 1883 OD2 ASP B 48 -20.197 1.988 8.476 1.00 0.00 O ATOM 0 H ASP B 48 -19.685 -0.600 7.786 1.00 0.00 H new ATOM 0 HA ASP B 48 -22.358 -1.710 7.901 1.00 0.00 H new ATOM 0 HB2 ASP B 48 -22.692 0.289 9.232 1.00 0.00 H new ATOM 0 HB3 ASP B 48 -21.010 -0.128 9.493 1.00 0.00 H new ATOM 1888 N ILE B 49 -21.812 0.474 5.553 1.00 0.00 N ATOM 1889 CA ILE B 49 -22.455 1.072 4.348 1.00 0.00 C ATOM 1890 C ILE B 49 -22.451 0.058 3.201 1.00 0.00 C ATOM 1891 O ILE B 49 -23.366 0.004 2.403 1.00 0.00 O ATOM 1892 CB ILE B 49 -21.594 2.288 4.000 1.00 0.00 C ATOM 1893 CG1 ILE B 49 -22.300 3.134 2.932 1.00 0.00 C ATOM 1894 CG2 ILE B 49 -20.238 1.820 3.468 1.00 0.00 C ATOM 1895 CD1 ILE B 49 -22.367 2.361 1.612 1.00 0.00 C ATOM 0 H ILE B 49 -20.814 0.662 5.651 1.00 0.00 H new ATOM 0 HA ILE B 49 -23.494 1.352 4.524 1.00 0.00 H new ATOM 0 HB ILE B 49 -21.444 2.891 4.896 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -23.306 3.389 3.265 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -21.765 4.072 2.787 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -19.625 2.687 3.220 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -19.734 1.225 4.230 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -20.387 1.214 2.574 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -22.870 2.969 0.860 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -21.357 2.128 1.275 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -22.922 1.435 1.760 1.00 0.00 H new ATOM 1907 N LEU B 50 -21.428 -0.748 3.115 1.00 0.00 N ATOM 1908 CA LEU B 50 -21.366 -1.760 2.021 1.00 0.00 C ATOM 1909 C LEU B 50 -22.431 -2.838 2.243 1.00 0.00 C ATOM 1910 O LEU B 50 -22.791 -3.565 1.337 1.00 0.00 O ATOM 1911 CB LEU B 50 -19.963 -2.362 2.118 1.00 0.00 C ATOM 1912 CG LEU B 50 -19.810 -3.478 1.084 1.00 0.00 C ATOM 1913 CD1 LEU B 50 -19.603 -2.865 -0.302 1.00 0.00 C ATOM 1914 CD2 LEU B 50 -18.596 -4.339 1.442 1.00 0.00 C ATOM 0 H LEU B 50 -20.633 -0.750 3.754 1.00 0.00 H new ATOM 0 HA LEU B 50 -21.554 -1.324 1.040 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -19.213 -1.590 1.948 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -19.794 -2.756 3.120 1.00 0.00 H new ATOM 0 HG LEU B 50 -20.709 -4.095 1.080 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -19.494 -3.661 -1.039 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -20.464 -2.248 -0.559 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -18.704 -2.249 -0.297 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -18.485 -5.135 0.706 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -17.699 -3.720 1.445 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -18.738 -4.776 2.430 1.00 0.00 H new ATOM 1926 N ALA B 51 -22.939 -2.943 3.440 1.00 0.00 N ATOM 1927 CA ALA B 51 -23.983 -3.970 3.722 1.00 0.00 C ATOM 1928 C ALA B 51 -23.534 -5.342 3.211 1.00 0.00 C ATOM 1929 O ALA B 51 -24.258 -6.022 2.512 1.00 0.00 O ATOM 1930 CB ALA B 51 -25.221 -3.495 2.963 1.00 0.00 C ATOM 0 H ALA B 51 -22.676 -2.362 4.236 1.00 0.00 H new ATOM 0 HA ALA B 51 -24.175 -4.078 4.790 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -26.037 -4.200 3.120 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -25.516 -2.511 3.328 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -24.994 -3.434 1.899 1.00 0.00 H new ATOM 1936 N ILE B 52 -22.345 -5.756 3.555 1.00 0.00 N ATOM 1937 CA ILE B 52 -21.857 -7.085 3.089 1.00 0.00 C ATOM 1938 C ILE B 52 -22.059 -8.133 4.188 1.00 0.00 C ATOM 1939 O ILE B 52 -22.110 -7.814 5.359 1.00 0.00 O ATOM 1940 CB ILE B 52 -20.368 -6.883 2.807 1.00 0.00 C ATOM 1941 CG1 ILE B 52 -19.798 -8.138 2.141 1.00 0.00 C ATOM 1942 CG2 ILE B 52 -19.628 -6.623 4.120 1.00 0.00 C ATOM 1943 CD1 ILE B 52 -19.461 -7.834 0.681 1.00 0.00 C ATOM 0 H ILE B 52 -21.692 -5.233 4.137 1.00 0.00 H new ATOM 0 HA ILE B 52 -22.393 -7.439 2.208 1.00 0.00 H new ATOM 0 HB ILE B 52 -20.239 -6.028 2.143 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -18.904 -8.469 2.670 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -20.521 -8.952 2.196 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -18.567 -6.479 3.917 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -20.031 -5.728 4.594 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -19.758 -7.476 4.786 1.00 0.00 H new ATOM 0 HD11 ILE B 52 -19.055 -8.728 0.208 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -20.364 -7.524 0.156 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -18.723 -7.033 0.637 1.00 0.00 H new ATOM 1955 N ASP B 53 -22.175 -9.378 3.820 1.00 0.00 N ATOM 1956 CA ASP B 53 -22.375 -10.441 4.846 1.00 0.00 C ATOM 1957 C ASP B 53 -21.055 -11.164 5.123 1.00 0.00 C ATOM 1958 O ASP B 53 -20.898 -11.828 6.128 1.00 0.00 O ATOM 1959 CB ASP B 53 -23.396 -11.400 4.231 1.00 0.00 C ATOM 1960 CG ASP B 53 -23.706 -12.523 5.222 1.00 0.00 C ATOM 1961 OD1 ASP B 53 -24.228 -12.224 6.283 1.00 0.00 O ATOM 1962 OD2 ASP B 53 -23.419 -13.665 4.902 1.00 0.00 O ATOM 0 H ASP B 53 -22.140 -9.706 2.855 1.00 0.00 H new ATOM 0 HA ASP B 53 -22.720 -10.037 5.798 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -24.310 -10.862 3.978 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -23.005 -11.818 3.303 1.00 0.00 H new ATOM 1967 N LYS B 54 -20.104 -11.041 4.238 1.00 0.00 N ATOM 1968 CA LYS B 54 -18.794 -11.721 4.452 1.00 0.00 C ATOM 1969 C LYS B 54 -17.849 -10.809 5.236 1.00 0.00 C ATOM 1970 O LYS B 54 -16.645 -10.865 5.082 1.00 0.00 O ATOM 1971 CB LYS B 54 -18.248 -11.978 3.048 1.00 0.00 C ATOM 1972 CG LYS B 54 -17.033 -12.902 3.134 1.00 0.00 C ATOM 1973 CD LYS B 54 -17.505 -14.355 3.214 1.00 0.00 C ATOM 1974 CE LYS B 54 -17.605 -14.935 1.801 1.00 0.00 C ATOM 1975 NZ LYS B 54 -18.593 -16.045 1.912 1.00 0.00 N ATOM 0 H LYS B 54 -20.177 -10.500 3.377 1.00 0.00 H new ATOM 0 HA LYS B 54 -18.895 -12.643 5.025 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -19.019 -12.430 2.424 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -17.969 -11.036 2.577 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -16.394 -12.763 2.262 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -16.435 -12.654 4.010 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -16.809 -14.943 3.812 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -18.474 -14.407 3.710 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -17.936 -14.181 1.087 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -16.638 -15.300 1.454 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -18.717 -16.494 0.982 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -18.248 -16.750 2.594 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -19.505 -15.666 2.238 1.00 0.00 H new ATOM 1989 N SER B 55 -18.385 -9.966 6.073 1.00 0.00 N ATOM 1990 CA SER B 55 -17.518 -9.046 6.865 1.00 0.00 C ATOM 1991 C SER B 55 -16.474 -9.844 7.653 1.00 0.00 C ATOM 1992 O SER B 55 -15.485 -9.306 8.110 1.00 0.00 O ATOM 1993 CB SER B 55 -18.473 -8.326 7.815 1.00 0.00 C ATOM 1994 OG SER B 55 -19.467 -7.648 7.056 1.00 0.00 O ATOM 0 H SER B 55 -19.386 -9.873 6.244 1.00 0.00 H new ATOM 0 HA SER B 55 -16.969 -8.349 6.232 1.00 0.00 H new ATOM 0 HB2 SER B 55 -18.940 -9.042 8.491 1.00 0.00 H new ATOM 0 HB3 SER B 55 -17.923 -7.616 8.433 1.00 0.00 H new ATOM 0 HG SER B 55 -19.304 -6.682 7.091 1.00 0.00 H new ATOM 2000 N LEU B 56 -16.689 -11.122 7.822 1.00 0.00 N ATOM 2001 CA LEU B 56 -15.717 -11.952 8.585 1.00 0.00 C ATOM 2002 C LEU B 56 -14.417 -12.175 7.794 1.00 0.00 C ATOM 2003 O LEU B 56 -13.546 -12.908 8.220 1.00 0.00 O ATOM 2004 CB LEU B 56 -16.460 -13.272 8.847 1.00 0.00 C ATOM 2005 CG LEU B 56 -16.437 -14.200 7.619 1.00 0.00 C ATOM 2006 CD1 LEU B 56 -16.774 -13.419 6.347 1.00 0.00 C ATOM 2007 CD2 LEU B 56 -15.058 -14.847 7.475 1.00 0.00 C ATOM 0 H LEU B 56 -17.499 -11.626 7.462 1.00 0.00 H new ATOM 0 HA LEU B 56 -15.402 -11.470 9.511 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -16.004 -13.782 9.696 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -17.493 -13.058 9.121 1.00 0.00 H new ATOM 0 HG LEU B 56 -17.187 -14.978 7.763 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -16.753 -14.092 5.490 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -17.768 -12.983 6.441 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -16.041 -12.625 6.203 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -15.052 -15.502 6.603 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.303 -14.071 7.351 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.835 -15.430 8.368 1.00 0.00 H new ATOM 2019 N THR B 57 -14.270 -11.552 6.655 1.00 0.00 N ATOM 2020 CA THR B 57 -13.022 -11.739 5.861 1.00 0.00 C ATOM 2021 C THR B 57 -12.175 -10.464 5.899 1.00 0.00 C ATOM 2022 O THR B 57 -12.701 -9.374 6.008 1.00 0.00 O ATOM 2023 CB THR B 57 -13.499 -12.022 4.437 1.00 0.00 C ATOM 2024 OG1 THR B 57 -12.387 -12.385 3.629 1.00 0.00 O ATOM 2025 CG2 THR B 57 -14.163 -10.770 3.860 1.00 0.00 C ATOM 0 H THR B 57 -14.959 -10.923 6.241 1.00 0.00 H new ATOM 0 HA THR B 57 -12.401 -12.545 6.251 1.00 0.00 H new ATOM 0 HB THR B 57 -14.220 -12.839 4.452 1.00 0.00 H new ATOM 0 HG1 THR B 57 -11.853 -11.588 3.431 1.00 0.00 H new ATOM 0 HG21 THR B 57 -14.503 -10.973 2.844 1.00 0.00 H new ATOM 0 HG22 THR B 57 -15.016 -10.492 4.479 1.00 0.00 H new ATOM 0 HG23 THR B 57 -13.444 -9.951 3.845 1.00 0.00 H new ATOM 2033 N PRO B 58 -10.886 -10.646 5.803 1.00 0.00 N ATOM 2034 CA PRO B 58 -9.953 -9.495 5.823 1.00 0.00 C ATOM 2035 C PRO B 58 -10.017 -8.742 4.491 1.00 0.00 C ATOM 2036 O PRO B 58 -9.458 -9.166 3.499 1.00 0.00 O ATOM 2037 CB PRO B 58 -8.586 -10.144 6.016 1.00 0.00 C ATOM 2038 CG PRO B 58 -8.738 -11.537 5.489 1.00 0.00 C ATOM 2039 CD PRO B 58 -10.184 -11.927 5.669 1.00 0.00 C ATOM 0 HA PRO B 58 -10.184 -8.766 6.600 1.00 0.00 H new ATOM 0 HB2 PRO B 58 -7.811 -9.600 5.475 1.00 0.00 H new ATOM 0 HB3 PRO B 58 -8.297 -10.149 7.067 1.00 0.00 H new ATOM 0 HG2 PRO B 58 -8.455 -11.583 4.437 1.00 0.00 H new ATOM 0 HG3 PRO B 58 -8.084 -12.225 6.026 1.00 0.00 H new ATOM 0 HD2 PRO B 58 -10.553 -12.496 4.816 1.00 0.00 H new ATOM 0 HD3 PRO B 58 -10.322 -12.551 6.552 1.00 0.00 H new ATOM 2047 N VAL B 59 -10.702 -7.632 4.459 1.00 0.00 N ATOM 2048 CA VAL B 59 -10.809 -6.857 3.190 1.00 0.00 C ATOM 2049 C VAL B 59 -9.621 -5.903 3.042 1.00 0.00 C ATOM 2050 O VAL B 59 -9.412 -5.024 3.854 1.00 0.00 O ATOM 2051 CB VAL B 59 -12.113 -6.072 3.317 1.00 0.00 C ATOM 2052 CG1 VAL B 59 -12.473 -5.457 1.963 1.00 0.00 C ATOM 2053 CG2 VAL B 59 -13.232 -7.017 3.760 1.00 0.00 C ATOM 0 H VAL B 59 -11.192 -7.228 5.257 1.00 0.00 H new ATOM 0 HA VAL B 59 -10.803 -7.504 2.313 1.00 0.00 H new ATOM 0 HB VAL B 59 -11.990 -5.279 4.055 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -13.404 -4.897 2.054 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -11.675 -4.786 1.644 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -12.597 -6.249 1.225 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -14.164 -6.459 3.852 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -13.354 -7.809 3.021 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -12.976 -7.457 4.724 1.00 0.00 H new ATOM 2063 N THR B 60 -8.846 -6.067 2.005 1.00 0.00 N ATOM 2064 CA THR B 60 -7.676 -5.166 1.798 1.00 0.00 C ATOM 2065 C THR B 60 -8.075 -3.995 0.897 1.00 0.00 C ATOM 2066 O THR B 60 -9.159 -3.962 0.352 1.00 0.00 O ATOM 2067 CB THR B 60 -6.621 -6.037 1.114 1.00 0.00 C ATOM 2068 OG1 THR B 60 -5.450 -5.268 0.884 1.00 0.00 O ATOM 2069 CG2 THR B 60 -7.168 -6.552 -0.218 1.00 0.00 C ATOM 0 H THR B 60 -8.972 -6.786 1.292 1.00 0.00 H new ATOM 0 HA THR B 60 -7.306 -4.741 2.731 1.00 0.00 H new ATOM 0 HB THR B 60 -6.377 -6.884 1.755 1.00 0.00 H new ATOM 0 HG1 THR B 60 -4.773 -5.826 0.447 1.00 0.00 H new ATOM 0 HG21 THR B 60 -6.416 -7.173 -0.705 1.00 0.00 H new ATOM 0 HG22 THR B 60 -8.066 -7.144 -0.038 1.00 0.00 H new ATOM 0 HG23 THR B 60 -7.413 -5.707 -0.862 1.00 0.00 H new ATOM 2077 N LEU B 61 -7.209 -3.032 0.734 1.00 0.00 N ATOM 2078 CA LEU B 61 -7.546 -1.867 -0.133 1.00 0.00 C ATOM 2079 C LEU B 61 -6.522 -1.735 -1.263 1.00 0.00 C ATOM 2080 O LEU B 61 -5.330 -1.826 -1.046 1.00 0.00 O ATOM 2081 CB LEU B 61 -7.484 -0.653 0.794 1.00 0.00 C ATOM 2082 CG LEU B 61 -8.630 -0.725 1.804 1.00 0.00 C ATOM 2083 CD1 LEU B 61 -8.506 0.429 2.800 1.00 0.00 C ATOM 2084 CD2 LEU B 61 -9.966 -0.618 1.066 1.00 0.00 C ATOM 0 H LEU B 61 -6.284 -3.001 1.163 1.00 0.00 H new ATOM 0 HA LEU B 61 -8.524 -1.970 -0.603 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -6.527 -0.628 1.315 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -7.555 0.266 0.212 1.00 0.00 H new ATOM 0 HG LEU B 61 -8.584 -1.674 2.339 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -9.323 0.378 3.520 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -7.554 0.355 3.326 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -8.553 1.378 2.265 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -10.784 -0.669 1.785 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -10.011 0.331 0.532 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -10.056 -1.439 0.355 1.00 0.00 H new ATOM 2096 N VAL B 62 -6.977 -1.527 -2.468 1.00 0.00 N ATOM 2097 CA VAL B 62 -6.029 -1.392 -3.612 1.00 0.00 C ATOM 2098 C VAL B 62 -6.359 -0.143 -4.432 1.00 0.00 C ATOM 2099 O VAL B 62 -7.333 0.537 -4.181 1.00 0.00 O ATOM 2100 CB VAL B 62 -6.240 -2.651 -4.452 1.00 0.00 C ATOM 2101 CG1 VAL B 62 -5.978 -3.889 -3.593 1.00 0.00 C ATOM 2102 CG2 VAL B 62 -7.682 -2.682 -4.963 1.00 0.00 C ATOM 0 H VAL B 62 -7.964 -1.445 -2.711 1.00 0.00 H new ATOM 0 HA VAL B 62 -4.996 -1.290 -3.279 1.00 0.00 H new ATOM 0 HB VAL B 62 -5.552 -2.645 -5.297 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -6.129 -4.787 -4.193 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -4.952 -3.866 -3.225 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -6.666 -3.898 -2.748 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -7.836 -3.579 -5.563 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -8.368 -2.689 -4.116 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -7.870 -1.800 -5.575 1.00 0.00 H new ATOM 2112 N LEU B 63 -5.556 0.160 -5.414 1.00 0.00 N ATOM 2113 CA LEU B 63 -5.822 1.362 -6.255 1.00 0.00 C ATOM 2114 C LEU B 63 -6.219 0.932 -7.671 1.00 0.00 C ATOM 2115 O LEU B 63 -5.492 0.230 -8.343 1.00 0.00 O ATOM 2116 CB LEU B 63 -4.499 2.130 -6.276 1.00 0.00 C ATOM 2117 CG LEU B 63 -4.221 2.715 -4.889 1.00 0.00 C ATOM 2118 CD1 LEU B 63 -3.077 3.725 -4.982 1.00 0.00 C ATOM 2119 CD2 LEU B 63 -5.477 3.417 -4.367 1.00 0.00 C ATOM 0 H LEU B 63 -4.726 -0.373 -5.671 1.00 0.00 H new ATOM 0 HA LEU B 63 -6.638 1.971 -5.866 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -3.686 1.466 -6.571 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -4.543 2.929 -7.016 1.00 0.00 H new ATOM 0 HG LEU B 63 -3.944 1.911 -4.207 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -2.879 4.142 -3.995 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -2.181 3.227 -5.352 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -3.355 4.527 -5.666 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.277 3.833 -3.379 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -5.755 4.220 -5.050 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.294 2.699 -4.300 1.00 0.00 H new ATOM 2131 N ALA B 64 -7.370 1.345 -8.126 1.00 0.00 N ATOM 2132 CA ALA B 64 -7.812 0.955 -9.497 1.00 0.00 C ATOM 2133 C ALA B 64 -6.795 1.426 -10.541 1.00 0.00 C ATOM 2134 O ALA B 64 -6.702 0.878 -11.622 1.00 0.00 O ATOM 2135 CB ALA B 64 -9.151 1.665 -9.697 1.00 0.00 C ATOM 0 H ALA B 64 -8.023 1.934 -7.610 1.00 0.00 H new ATOM 0 HA ALA B 64 -7.900 -0.126 -9.608 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -9.544 1.429 -10.686 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -9.857 1.331 -8.936 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.008 2.742 -9.612 1.00 0.00 H new ATOM 2141 N GLU B 65 -6.033 2.440 -10.231 1.00 0.00 N ATOM 2142 CA GLU B 65 -5.026 2.942 -11.211 1.00 0.00 C ATOM 2143 C GLU B 65 -3.744 2.107 -11.133 1.00 0.00 C ATOM 2144 O GLU B 65 -3.384 1.419 -12.066 1.00 0.00 O ATOM 2145 CB GLU B 65 -4.749 4.385 -10.789 1.00 0.00 C ATOM 2146 CG GLU B 65 -4.021 5.117 -11.919 1.00 0.00 C ATOM 2147 CD GLU B 65 -5.017 5.460 -13.029 1.00 0.00 C ATOM 2148 OE1 GLU B 65 -6.055 6.018 -12.715 1.00 0.00 O ATOM 2149 OE2 GLU B 65 -4.723 5.160 -14.174 1.00 0.00 O ATOM 0 H GLU B 65 -6.064 2.942 -9.344 1.00 0.00 H new ATOM 0 HA GLU B 65 -5.384 2.877 -12.238 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -5.685 4.893 -10.556 1.00 0.00 H new ATOM 0 HB3 GLU B 65 -4.144 4.400 -9.883 1.00 0.00 H new ATOM 0 HG2 GLU B 65 -3.557 6.027 -11.538 1.00 0.00 H new ATOM 0 HG3 GLU B 65 -3.220 4.493 -12.315 1.00 0.00 H new ATOM 2156 N ASP B 66 -3.055 2.163 -10.027 1.00 0.00 N ATOM 2157 CA ASP B 66 -1.799 1.371 -9.892 1.00 0.00 C ATOM 2158 C ASP B 66 -2.115 -0.032 -9.368 1.00 0.00 C ATOM 2159 O ASP B 66 -1.470 -0.999 -9.724 1.00 0.00 O ATOM 2160 CB ASP B 66 -0.949 2.143 -8.882 1.00 0.00 C ATOM 2161 CG ASP B 66 0.469 1.570 -8.861 1.00 0.00 C ATOM 2162 OD1 ASP B 66 1.119 1.612 -9.892 1.00 0.00 O ATOM 2163 OD2 ASP B 66 0.881 1.098 -7.814 1.00 0.00 O ATOM 0 H ASP B 66 -3.306 2.722 -9.212 1.00 0.00 H new ATOM 0 HA ASP B 66 -1.284 1.246 -10.845 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -0.921 3.200 -9.147 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -1.394 2.075 -7.889 1.00 0.00 H new ATOM 2168 N GLY B 67 -3.105 -0.149 -8.527 1.00 0.00 N ATOM 2169 CA GLY B 67 -3.466 -1.487 -7.980 1.00 0.00 C ATOM 2170 C GLY B 67 -2.519 -1.844 -6.834 1.00 0.00 C ATOM 2171 O GLY B 67 -2.234 -2.999 -6.591 1.00 0.00 O ATOM 0 H GLY B 67 -3.680 0.625 -8.195 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -4.497 -1.480 -7.625 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -3.404 -2.241 -8.765 1.00 0.00 H new ATOM 2175 N THR B 68 -2.029 -0.864 -6.125 1.00 0.00 N ATOM 2176 CA THR B 68 -1.104 -1.159 -4.995 1.00 0.00 C ATOM 2177 C THR B 68 -1.847 -1.044 -3.663 1.00 0.00 C ATOM 2178 O THR B 68 -2.679 -0.177 -3.478 1.00 0.00 O ATOM 2179 CB THR B 68 0.002 -0.104 -5.090 1.00 0.00 C ATOM 2180 OG1 THR B 68 1.105 -0.507 -4.289 1.00 0.00 O ATOM 2181 CG2 THR B 68 -0.521 1.245 -4.593 1.00 0.00 C ATOM 0 H THR B 68 -2.228 0.124 -6.279 1.00 0.00 H new ATOM 0 HA THR B 68 -0.700 -2.170 -5.048 1.00 0.00 H new ATOM 0 HB THR B 68 0.317 -0.005 -6.129 1.00 0.00 H new ATOM 0 HG1 THR B 68 0.828 -1.235 -3.694 1.00 0.00 H new ATOM 0 HG21 THR B 68 0.271 1.991 -4.663 1.00 0.00 H new ATOM 0 HG22 THR B 68 -1.367 1.555 -5.206 1.00 0.00 H new ATOM 0 HG23 THR B 68 -0.840 1.151 -3.555 1.00 0.00 H new ATOM 2189 N ILE B 69 -1.555 -1.910 -2.735 1.00 0.00 N ATOM 2190 CA ILE B 69 -2.246 -1.849 -1.416 1.00 0.00 C ATOM 2191 C ILE B 69 -1.616 -0.764 -0.542 1.00 0.00 C ATOM 2192 O ILE B 69 -0.410 -0.653 -0.445 1.00 0.00 O ATOM 2193 CB ILE B 69 -2.034 -3.227 -0.795 1.00 0.00 C ATOM 2194 CG1 ILE B 69 -0.547 -3.418 -0.489 1.00 0.00 C ATOM 2195 CG2 ILE B 69 -2.495 -4.307 -1.776 1.00 0.00 C ATOM 2196 CD1 ILE B 69 -0.307 -4.839 0.021 1.00 0.00 C ATOM 0 H ILE B 69 -0.868 -2.658 -2.832 1.00 0.00 H new ATOM 0 HA ILE B 69 -3.304 -1.605 -1.513 1.00 0.00 H new ATOM 0 HB ILE B 69 -2.611 -3.305 0.126 1.00 0.00 H new ATOM 0 HG12 ILE B 69 0.045 -3.238 -1.386 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -0.223 -2.693 0.258 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -2.343 -5.291 -1.332 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -3.553 -4.169 -1.999 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -1.918 -4.232 -2.697 1.00 0.00 H new ATOM 0 HD11 ILE B 69 0.753 -4.973 0.238 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -0.887 -5.003 0.929 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -0.615 -5.556 -0.740 1.00 0.00 H new ATOM 2208 N VAL B 70 -2.423 0.034 0.097 1.00 0.00 N ATOM 2209 CA VAL B 70 -1.872 1.112 0.967 1.00 0.00 C ATOM 2210 C VAL B 70 -2.101 0.759 2.439 1.00 0.00 C ATOM 2211 O VAL B 70 -3.178 0.945 2.970 1.00 0.00 O ATOM 2212 CB VAL B 70 -2.658 2.365 0.584 1.00 0.00 C ATOM 2213 CG1 VAL B 70 -2.115 3.568 1.356 1.00 0.00 C ATOM 2214 CG2 VAL B 70 -2.512 2.617 -0.918 1.00 0.00 C ATOM 0 H VAL B 70 -3.441 -0.012 0.055 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.799 1.251 0.835 1.00 0.00 H new ATOM 0 HB VAL B 70 -3.710 2.222 0.831 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -2.677 4.461 1.081 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -2.218 3.390 2.426 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -1.063 3.712 1.111 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -3.072 3.511 -1.193 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -1.459 2.759 -1.162 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -2.900 1.761 -1.470 1.00 0.00 H new ATOM 2224 N ASP B 71 -1.098 0.251 3.103 1.00 0.00 N ATOM 2225 CA ASP B 71 -1.264 -0.114 4.540 1.00 0.00 C ATOM 2226 C ASP B 71 -1.189 1.140 5.416 1.00 0.00 C ATOM 2227 O ASP B 71 -1.212 1.064 6.628 1.00 0.00 O ATOM 2228 CB ASP B 71 -0.100 -1.055 4.848 1.00 0.00 C ATOM 2229 CG ASP B 71 -0.629 -2.311 5.544 1.00 0.00 C ATOM 2230 OD1 ASP B 71 -1.055 -2.199 6.682 1.00 0.00 O ATOM 2231 OD2 ASP B 71 -0.598 -3.363 4.928 1.00 0.00 O ATOM 0 H ASP B 71 -0.172 0.073 2.714 1.00 0.00 H new ATOM 0 HA ASP B 71 -2.228 -0.582 4.738 1.00 0.00 H new ATOM 0 HB2 ASP B 71 0.415 -1.327 3.927 1.00 0.00 H new ATOM 0 HB3 ASP B 71 0.629 -0.553 5.485 1.00 0.00 H new ATOM 2236 N ASP B 72 -1.098 2.292 4.812 1.00 0.00 N ATOM 2237 CA ASP B 72 -1.021 3.549 5.610 1.00 0.00 C ATOM 2238 C ASP B 72 -2.029 4.572 5.081 1.00 0.00 C ATOM 2239 O ASP B 72 -2.352 4.590 3.909 1.00 0.00 O ATOM 2240 CB ASP B 72 0.409 4.053 5.417 1.00 0.00 C ATOM 2241 CG ASP B 72 1.395 2.944 5.790 1.00 0.00 C ATOM 2242 OD1 ASP B 72 1.378 1.917 5.132 1.00 0.00 O ATOM 2243 OD2 ASP B 72 2.152 3.142 6.727 1.00 0.00 O ATOM 0 H ASP B 72 -1.074 2.418 3.800 1.00 0.00 H new ATOM 0 HA ASP B 72 -1.256 3.387 6.662 1.00 0.00 H new ATOM 0 HB2 ASP B 72 0.562 4.357 4.382 1.00 0.00 H new ATOM 0 HB3 ASP B 72 0.583 4.933 6.037 1.00 0.00 H new ATOM 2248 N ASP B 73 -2.528 5.426 5.933 1.00 0.00 N ATOM 2249 CA ASP B 73 -3.512 6.447 5.474 1.00 0.00 C ATOM 2250 C ASP B 73 -2.831 7.460 4.550 1.00 0.00 C ATOM 2251 O ASP B 73 -3.471 8.315 3.970 1.00 0.00 O ATOM 2252 CB ASP B 73 -4.003 7.130 6.753 1.00 0.00 C ATOM 2253 CG ASP B 73 -2.805 7.669 7.537 1.00 0.00 C ATOM 2254 OD1 ASP B 73 -2.067 8.464 6.981 1.00 0.00 O ATOM 2255 OD2 ASP B 73 -2.648 7.276 8.682 1.00 0.00 O ATOM 0 H ASP B 73 -2.297 5.461 6.926 1.00 0.00 H new ATOM 0 HA ASP B 73 -4.333 6.005 4.909 1.00 0.00 H new ATOM 0 HB2 ASP B 73 -4.684 7.944 6.505 1.00 0.00 H new ATOM 0 HB3 ASP B 73 -4.562 6.422 7.364 1.00 0.00 H new ATOM 2260 N ASP B 74 -1.536 7.367 4.408 1.00 0.00 N ATOM 2261 CA ASP B 74 -0.808 8.319 3.521 1.00 0.00 C ATOM 2262 C ASP B 74 -1.599 8.560 2.232 1.00 0.00 C ATOM 2263 O ASP B 74 -2.281 9.556 2.088 1.00 0.00 O ATOM 2264 CB ASP B 74 0.520 7.625 3.215 1.00 0.00 C ATOM 2265 CG ASP B 74 1.376 7.582 4.481 1.00 0.00 C ATOM 2266 OD1 ASP B 74 1.748 8.641 4.957 1.00 0.00 O ATOM 2267 OD2 ASP B 74 1.646 6.489 4.953 1.00 0.00 O ATOM 0 H ASP B 74 -0.950 6.671 4.869 1.00 0.00 H new ATOM 0 HA ASP B 74 -0.666 9.294 3.987 1.00 0.00 H new ATOM 0 HB2 ASP B 74 0.339 6.614 2.851 1.00 0.00 H new ATOM 0 HB3 ASP B 74 1.048 8.158 2.424 1.00 0.00 H new ATOM 2272 N TYR B 75 -1.519 7.655 1.296 1.00 0.00 N ATOM 2273 CA TYR B 75 -2.268 7.824 0.024 1.00 0.00 C ATOM 2274 C TYR B 75 -3.771 7.931 0.296 1.00 0.00 C ATOM 2275 O TYR B 75 -4.509 8.520 -0.469 1.00 0.00 O ATOM 2276 CB TYR B 75 -1.948 6.558 -0.768 1.00 0.00 C ATOM 2277 CG TYR B 75 -0.829 6.832 -1.742 1.00 0.00 C ATOM 2278 CD1 TYR B 75 -0.942 7.878 -2.665 1.00 0.00 C ATOM 2279 CD2 TYR B 75 0.318 6.035 -1.726 1.00 0.00 C ATOM 2280 CE1 TYR B 75 0.095 8.124 -3.574 1.00 0.00 C ATOM 2281 CE2 TYR B 75 1.355 6.280 -2.631 1.00 0.00 C ATOM 2282 CZ TYR B 75 1.244 7.326 -3.556 1.00 0.00 C ATOM 2283 OH TYR B 75 2.268 7.566 -4.450 1.00 0.00 O ATOM 0 H TYR B 75 -0.963 6.802 1.360 1.00 0.00 H new ATOM 0 HA TYR B 75 -1.989 8.732 -0.512 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -1.662 5.756 -0.088 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -2.835 6.220 -1.305 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -1.828 8.495 -2.676 1.00 0.00 H new ATOM 0 HD2 TYR B 75 0.404 5.228 -1.013 1.00 0.00 H new ATOM 0 HE1 TYR B 75 0.008 8.929 -4.288 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.241 5.663 -2.617 1.00 0.00 H new ATOM 0 HH TYR B 75 2.854 6.782 -4.494 1.00 0.00 H new ATOM 2293 N PHE B 76 -4.230 7.368 1.379 1.00 0.00 N ATOM 2294 CA PHE B 76 -5.686 7.440 1.694 1.00 0.00 C ATOM 2295 C PHE B 76 -6.121 8.898 1.867 1.00 0.00 C ATOM 2296 O PHE B 76 -7.213 9.278 1.495 1.00 0.00 O ATOM 2297 CB PHE B 76 -5.847 6.675 3.007 1.00 0.00 C ATOM 2298 CG PHE B 76 -7.306 6.652 3.398 1.00 0.00 C ATOM 2299 CD1 PHE B 76 -8.277 6.290 2.456 1.00 0.00 C ATOM 2300 CD2 PHE B 76 -7.688 6.995 4.700 1.00 0.00 C ATOM 2301 CE1 PHE B 76 -9.629 6.272 2.816 1.00 0.00 C ATOM 2302 CE2 PHE B 76 -9.041 6.976 5.060 1.00 0.00 C ATOM 2303 CZ PHE B 76 -10.012 6.614 4.118 1.00 0.00 C ATOM 0 H PHE B 76 -3.662 6.862 2.059 1.00 0.00 H new ATOM 0 HA PHE B 76 -6.300 7.018 0.898 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -5.473 5.657 2.896 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -5.256 7.148 3.791 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.982 6.025 1.451 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -6.939 7.274 5.427 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.377 5.994 2.089 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.336 7.241 6.065 1.00 0.00 H new ATOM 0 HZ PHE B 76 -11.055 6.599 4.396 1.00 0.00 H new ATOM 2313 N LEU B 77 -5.277 9.718 2.431 1.00 0.00 N ATOM 2314 CA LEU B 77 -5.647 11.149 2.628 1.00 0.00 C ATOM 2315 C LEU B 77 -4.963 12.023 1.573 1.00 0.00 C ATOM 2316 O LEU B 77 -5.435 13.093 1.239 1.00 0.00 O ATOM 2317 CB LEU B 77 -5.140 11.499 4.027 1.00 0.00 C ATOM 2318 CG LEU B 77 -5.942 10.719 5.070 1.00 0.00 C ATOM 2319 CD1 LEU B 77 -5.114 10.572 6.348 1.00 0.00 C ATOM 2320 CD2 LEU B 77 -7.236 11.473 5.386 1.00 0.00 C ATOM 0 H LEU B 77 -4.348 9.460 2.764 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.720 11.316 2.530 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.080 11.258 4.112 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -5.238 12.570 4.204 1.00 0.00 H new ATOM 0 HG LEU B 77 -6.182 9.731 4.678 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -5.686 10.016 7.091 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -4.192 10.035 6.124 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -4.873 11.560 6.741 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -7.808 10.918 6.129 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.995 12.461 5.778 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.828 11.578 4.476 1.00 0.00 H new ATOM 2332 N CYS B 78 -3.855 11.579 1.046 1.00 0.00 N ATOM 2333 CA CYS B 78 -3.144 12.386 0.013 1.00 0.00 C ATOM 2334 C CYS B 78 -4.041 12.587 -1.213 1.00 0.00 C ATOM 2335 O CYS B 78 -3.892 13.538 -1.954 1.00 0.00 O ATOM 2336 CB CYS B 78 -1.909 11.563 -0.354 1.00 0.00 C ATOM 2337 SG CYS B 78 -0.846 12.527 -1.457 1.00 0.00 S ATOM 0 H CYS B 78 -3.411 10.693 1.286 1.00 0.00 H new ATOM 0 HA CYS B 78 -2.878 13.378 0.377 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -1.361 11.288 0.547 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -2.209 10.635 -0.840 1.00 0.00 H new ATOM 0 HG CYS B 78 -1.573 13.355 -2.147 1.00 0.00 H new ATOM 2343 N LEU B 79 -4.970 11.697 -1.430 1.00 0.00 N ATOM 2344 CA LEU B 79 -5.876 11.836 -2.606 1.00 0.00 C ATOM 2345 C LEU B 79 -6.983 12.849 -2.306 1.00 0.00 C ATOM 2346 O LEU B 79 -7.199 13.214 -1.167 1.00 0.00 O ATOM 2347 CB LEU B 79 -6.469 10.442 -2.815 1.00 0.00 C ATOM 2348 CG LEU B 79 -5.383 9.496 -3.331 1.00 0.00 C ATOM 2349 CD1 LEU B 79 -5.819 8.047 -3.108 1.00 0.00 C ATOM 2350 CD2 LEU B 79 -5.167 9.738 -4.826 1.00 0.00 C ATOM 0 H LEU B 79 -5.141 10.880 -0.844 1.00 0.00 H new ATOM 0 HA LEU B 79 -5.350 12.194 -3.491 1.00 0.00 H new ATOM 0 HB2 LEU B 79 -6.879 10.065 -1.878 1.00 0.00 H new ATOM 0 HB3 LEU B 79 -7.293 10.489 -3.527 1.00 0.00 H new ATOM 0 HG LEU B 79 -4.453 9.682 -2.793 1.00 0.00 H new ATOM 0 HD11 LEU B 79 -5.045 7.373 -3.476 1.00 0.00 H new ATOM 0 HD12 LEU B 79 -5.975 7.874 -2.043 1.00 0.00 H new ATOM 0 HD13 LEU B 79 -6.748 7.860 -3.646 1.00 0.00 H new ATOM 0 HD21 LEU B 79 -4.393 9.065 -5.196 1.00 0.00 H new ATOM 0 HD22 LEU B 79 -6.097 9.551 -5.363 1.00 0.00 H new ATOM 0 HD23 LEU B 79 -4.856 10.770 -4.986 1.00 0.00 H new ATOM 2362 N PRO B 80 -7.652 13.271 -3.346 1.00 0.00 N ATOM 2363 CA PRO B 80 -8.753 14.253 -3.197 1.00 0.00 C ATOM 2364 C PRO B 80 -9.975 13.591 -2.555 1.00 0.00 C ATOM 2365 O PRO B 80 -9.997 12.398 -2.325 1.00 0.00 O ATOM 2366 CB PRO B 80 -9.053 14.676 -4.633 1.00 0.00 C ATOM 2367 CG PRO B 80 -8.588 13.533 -5.478 1.00 0.00 C ATOM 2368 CD PRO B 80 -7.448 12.875 -4.743 1.00 0.00 C ATOM 0 HA PRO B 80 -8.493 15.096 -2.556 1.00 0.00 H new ATOM 0 HB2 PRO B 80 -10.117 14.864 -4.775 1.00 0.00 H new ATOM 0 HB3 PRO B 80 -8.529 15.596 -4.891 1.00 0.00 H new ATOM 0 HG2 PRO B 80 -9.398 12.824 -5.647 1.00 0.00 H new ATOM 0 HG3 PRO B 80 -8.263 13.885 -6.457 1.00 0.00 H new ATOM 0 HD2 PRO B 80 -7.471 11.791 -4.858 1.00 0.00 H new ATOM 0 HD3 PRO B 80 -6.482 13.215 -5.117 1.00 0.00 H new ATOM 2376 N SER B 81 -10.991 14.356 -2.262 1.00 0.00 N ATOM 2377 CA SER B 81 -12.209 13.768 -1.632 1.00 0.00 C ATOM 2378 C SER B 81 -12.804 12.705 -2.551 1.00 0.00 C ATOM 2379 O SER B 81 -13.077 11.592 -2.146 1.00 0.00 O ATOM 2380 CB SER B 81 -13.179 14.937 -1.499 1.00 0.00 C ATOM 2381 OG SER B 81 -14.211 14.591 -0.584 1.00 0.00 O ATOM 0 H SER B 81 -11.031 15.361 -2.431 1.00 0.00 H new ATOM 0 HA SER B 81 -11.995 13.294 -0.674 1.00 0.00 H new ATOM 0 HB2 SER B 81 -12.651 15.825 -1.150 1.00 0.00 H new ATOM 0 HB3 SER B 81 -13.607 15.182 -2.471 1.00 0.00 H new ATOM 0 HG SER B 81 -15.031 15.074 -0.818 1.00 0.00 H new ATOM 2387 N ASN B 82 -13.007 13.049 -3.788 1.00 0.00 N ATOM 2388 CA ASN B 82 -13.588 12.070 -4.752 1.00 0.00 C ATOM 2389 C ASN B 82 -12.508 11.103 -5.243 1.00 0.00 C ATOM 2390 O ASN B 82 -11.723 11.420 -6.114 1.00 0.00 O ATOM 2391 CB ASN B 82 -14.113 12.919 -5.911 1.00 0.00 C ATOM 2392 CG ASN B 82 -14.688 12.002 -6.994 1.00 0.00 C ATOM 2393 OD1 ASN B 82 -15.344 11.025 -6.693 1.00 0.00 O ATOM 2394 ND2 ASN B 82 -14.470 12.278 -8.250 1.00 0.00 N ATOM 0 H ASN B 82 -12.796 13.968 -4.178 1.00 0.00 H new ATOM 0 HA ASN B 82 -14.374 11.464 -4.300 1.00 0.00 H new ATOM 0 HB2 ASN B 82 -14.881 13.605 -5.555 1.00 0.00 H new ATOM 0 HB3 ASN B 82 -13.309 13.528 -6.324 1.00 0.00 H new ATOM 0 HD21 ASN B 82 -14.850 11.674 -8.978 1.00 0.00 H new ATOM 0 HD22 ASN B 82 -13.919 13.098 -8.504 1.00 0.00 H new ATOM 2401 N THR B 83 -12.464 9.920 -4.690 1.00 0.00 N ATOM 2402 CA THR B 83 -11.437 8.929 -5.124 1.00 0.00 C ATOM 2403 C THR B 83 -12.061 7.534 -5.230 1.00 0.00 C ATOM 2404 O THR B 83 -12.910 7.162 -4.443 1.00 0.00 O ATOM 2405 CB THR B 83 -10.370 8.959 -4.029 1.00 0.00 C ATOM 2406 OG1 THR B 83 -9.357 8.009 -4.331 1.00 0.00 O ATOM 2407 CG2 THR B 83 -11.011 8.615 -2.684 1.00 0.00 C ATOM 0 H THR B 83 -13.095 9.597 -3.956 1.00 0.00 H new ATOM 0 HA THR B 83 -11.021 9.166 -6.103 1.00 0.00 H new ATOM 0 HB THR B 83 -9.929 9.955 -3.976 1.00 0.00 H new ATOM 0 HG1 THR B 83 -9.654 7.116 -4.057 1.00 0.00 H new ATOM 0 HG21 THR B 83 -10.251 8.636 -1.903 1.00 0.00 H new ATOM 0 HG22 THR B 83 -11.788 9.344 -2.454 1.00 0.00 H new ATOM 0 HG23 THR B 83 -11.451 7.619 -2.735 1.00 0.00 H new ATOM 2415 N LYS B 84 -11.653 6.763 -6.200 1.00 0.00 N ATOM 2416 CA LYS B 84 -12.226 5.396 -6.362 1.00 0.00 C ATOM 2417 C LYS B 84 -11.280 4.343 -5.772 1.00 0.00 C ATOM 2418 O LYS B 84 -10.082 4.394 -5.964 1.00 0.00 O ATOM 2419 CB LYS B 84 -12.358 5.211 -7.873 1.00 0.00 C ATOM 2420 CG LYS B 84 -12.986 6.462 -8.490 1.00 0.00 C ATOM 2421 CD LYS B 84 -13.412 6.166 -9.929 1.00 0.00 C ATOM 2422 CE LYS B 84 -14.047 7.414 -10.544 1.00 0.00 C ATOM 2423 NZ LYS B 84 -15.121 6.900 -11.438 1.00 0.00 N ATOM 0 H LYS B 84 -10.946 7.021 -6.889 1.00 0.00 H new ATOM 0 HA LYS B 84 -13.179 5.282 -5.846 1.00 0.00 H new ATOM 0 HB2 LYS B 84 -11.378 5.028 -8.314 1.00 0.00 H new ATOM 0 HB3 LYS B 84 -12.973 4.338 -8.090 1.00 0.00 H new ATOM 0 HG2 LYS B 84 -13.848 6.776 -7.902 1.00 0.00 H new ATOM 0 HG3 LYS B 84 -12.272 7.286 -8.473 1.00 0.00 H new ATOM 0 HD2 LYS B 84 -12.549 5.857 -10.518 1.00 0.00 H new ATOM 0 HD3 LYS B 84 -14.122 5.339 -9.946 1.00 0.00 H new ATOM 0 HE2 LYS B 84 -14.454 8.069 -9.774 1.00 0.00 H new ATOM 0 HE3 LYS B 84 -13.313 7.996 -11.102 1.00 0.00 H new ATOM 0 HZ1 LYS B 84 -15.603 7.699 -11.897 1.00 0.00 H new ATOM 0 HZ2 LYS B 84 -14.703 6.285 -12.165 1.00 0.00 H new ATOM 0 HZ3 LYS B 84 -15.808 6.356 -10.878 1.00 0.00 H new ATOM 2437 N PHE B 85 -11.813 3.388 -5.057 1.00 0.00 N ATOM 2438 CA PHE B 85 -10.950 2.333 -4.454 1.00 0.00 C ATOM 2439 C PHE B 85 -11.589 0.951 -4.630 1.00 0.00 C ATOM 2440 O PHE B 85 -12.731 0.827 -5.027 1.00 0.00 O ATOM 2441 CB PHE B 85 -10.868 2.691 -2.973 1.00 0.00 C ATOM 2442 CG PHE B 85 -9.741 3.670 -2.746 1.00 0.00 C ATOM 2443 CD1 PHE B 85 -8.438 3.198 -2.552 1.00 0.00 C ATOM 2444 CD2 PHE B 85 -9.998 5.047 -2.726 1.00 0.00 C ATOM 2445 CE1 PHE B 85 -7.390 4.101 -2.339 1.00 0.00 C ATOM 2446 CE2 PHE B 85 -8.949 5.950 -2.510 1.00 0.00 C ATOM 2447 CZ PHE B 85 -7.646 5.477 -2.316 1.00 0.00 C ATOM 0 H PHE B 85 -12.810 3.294 -4.865 1.00 0.00 H new ATOM 0 HA PHE B 85 -9.968 2.290 -4.924 1.00 0.00 H new ATOM 0 HB2 PHE B 85 -11.811 3.125 -2.641 1.00 0.00 H new ATOM 0 HB3 PHE B 85 -10.705 1.791 -2.380 1.00 0.00 H new ATOM 0 HD1 PHE B 85 -8.241 2.136 -2.567 1.00 0.00 H new ATOM 0 HD2 PHE B 85 -11.003 5.412 -2.877 1.00 0.00 H new ATOM 0 HE1 PHE B 85 -6.384 3.736 -2.192 1.00 0.00 H new ATOM 0 HE2 PHE B 85 -9.146 7.012 -2.493 1.00 0.00 H new ATOM 0 HZ PHE B 85 -6.838 6.174 -2.149 1.00 0.00 H new ATOM 2457 N VAL B 86 -10.856 -0.087 -4.328 1.00 0.00 N ATOM 2458 CA VAL B 86 -11.411 -1.467 -4.465 1.00 0.00 C ATOM 2459 C VAL B 86 -10.947 -2.333 -3.290 1.00 0.00 C ATOM 2460 O VAL B 86 -9.805 -2.274 -2.878 1.00 0.00 O ATOM 2461 CB VAL B 86 -10.843 -1.996 -5.782 1.00 0.00 C ATOM 2462 CG1 VAL B 86 -11.148 -3.490 -5.904 1.00 0.00 C ATOM 2463 CG2 VAL B 86 -11.488 -1.249 -6.953 1.00 0.00 C ATOM 0 H VAL B 86 -9.894 -0.040 -3.991 1.00 0.00 H new ATOM 0 HA VAL B 86 -12.501 -1.480 -4.462 1.00 0.00 H new ATOM 0 HB VAL B 86 -9.764 -1.841 -5.801 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -10.744 -3.868 -6.843 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -10.691 -4.024 -5.071 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -12.227 -3.644 -5.886 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -11.083 -1.626 -7.892 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -12.567 -1.405 -6.934 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -11.274 -0.184 -6.867 1.00 0.00 H new ATOM 2473 N ALA B 87 -11.820 -3.137 -2.743 1.00 0.00 N ATOM 2474 CA ALA B 87 -11.418 -3.998 -1.593 1.00 0.00 C ATOM 2475 C ALA B 87 -11.662 -5.475 -1.919 1.00 0.00 C ATOM 2476 O ALA B 87 -12.653 -5.832 -2.526 1.00 0.00 O ATOM 2477 CB ALA B 87 -12.308 -3.550 -0.434 1.00 0.00 C ATOM 0 H ALA B 87 -12.790 -3.234 -3.042 1.00 0.00 H new ATOM 0 HA ALA B 87 -10.358 -3.900 -1.357 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -12.073 -4.138 0.453 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -12.132 -2.494 -0.227 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -13.354 -3.698 -0.701 1.00 0.00 H new ATOM 2483 N LEU B 88 -10.765 -6.338 -1.518 1.00 0.00 N ATOM 2484 CA LEU B 88 -10.945 -7.790 -1.805 1.00 0.00 C ATOM 2485 C LEU B 88 -11.545 -8.505 -0.595 1.00 0.00 C ATOM 2486 O LEU B 88 -10.993 -8.496 0.487 1.00 0.00 O ATOM 2487 CB LEU B 88 -9.542 -8.320 -2.078 1.00 0.00 C ATOM 2488 CG LEU B 88 -9.045 -7.793 -3.422 1.00 0.00 C ATOM 2489 CD1 LEU B 88 -10.098 -8.071 -4.495 1.00 0.00 C ATOM 2490 CD2 LEU B 88 -8.804 -6.285 -3.324 1.00 0.00 C ATOM 0 H LEU B 88 -9.917 -6.099 -1.005 1.00 0.00 H new ATOM 0 HA LEU B 88 -11.621 -7.955 -2.644 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -8.865 -8.010 -1.282 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -9.549 -9.410 -2.084 1.00 0.00 H new ATOM 0 HG LEU B 88 -8.113 -8.292 -3.686 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -9.746 -7.696 -5.456 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -10.271 -9.145 -4.566 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -11.029 -7.571 -4.229 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -8.449 -5.910 -4.284 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -9.736 -5.784 -3.061 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -8.055 -6.085 -2.557 1.00 0.00 H new ATOM 2502 N ALA B 89 -12.660 -9.140 -0.783 1.00 0.00 N ATOM 2503 CA ALA B 89 -13.302 -9.884 0.337 1.00 0.00 C ATOM 2504 C ALA B 89 -12.731 -11.302 0.382 1.00 0.00 C ATOM 2505 O ALA B 89 -11.792 -11.608 -0.324 1.00 0.00 O ATOM 2506 CB ALA B 89 -14.794 -9.911 0.002 1.00 0.00 C ATOM 0 H ALA B 89 -13.162 -9.179 -1.670 1.00 0.00 H new ATOM 0 HA ALA B 89 -13.125 -9.424 1.309 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -15.333 -10.444 0.785 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -15.170 -8.890 -0.067 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.944 -10.418 -0.951 1.00 0.00 H new ATOM 2512 N SER B 90 -13.279 -12.161 1.206 1.00 0.00 N ATOM 2513 CA SER B 90 -12.759 -13.562 1.287 1.00 0.00 C ATOM 2514 C SER B 90 -12.321 -14.042 -0.102 1.00 0.00 C ATOM 2515 O SER B 90 -11.399 -14.820 -0.241 1.00 0.00 O ATOM 2516 CB SER B 90 -13.935 -14.394 1.797 1.00 0.00 C ATOM 2517 OG SER B 90 -13.464 -15.674 2.201 1.00 0.00 O ATOM 0 H SER B 90 -14.063 -11.953 1.825 1.00 0.00 H new ATOM 0 HA SER B 90 -11.891 -13.644 1.941 1.00 0.00 H new ATOM 0 HB2 SER B 90 -14.416 -13.890 2.635 1.00 0.00 H new ATOM 0 HB3 SER B 90 -14.687 -14.500 1.015 1.00 0.00 H new ATOM 0 HG SER B 90 -14.215 -16.210 2.530 1.00 0.00 H new ATOM 2523 N ASN B 91 -12.964 -13.557 -1.132 1.00 0.00 N ATOM 2524 CA ASN B 91 -12.575 -13.958 -2.514 1.00 0.00 C ATOM 2525 C ASN B 91 -11.391 -13.100 -2.977 1.00 0.00 C ATOM 2526 O ASN B 91 -11.539 -11.937 -3.294 1.00 0.00 O ATOM 2527 CB ASN B 91 -13.811 -13.681 -3.370 1.00 0.00 C ATOM 2528 CG ASN B 91 -13.564 -14.161 -4.802 1.00 0.00 C ATOM 2529 OD1 ASN B 91 -12.625 -14.888 -5.058 1.00 0.00 O ATOM 2530 ND2 ASN B 91 -14.374 -13.782 -5.752 1.00 0.00 N ATOM 0 H ASN B 91 -13.742 -12.900 -1.074 1.00 0.00 H new ATOM 0 HA ASN B 91 -12.268 -15.002 -2.582 1.00 0.00 H new ATOM 0 HB2 ASN B 91 -14.678 -14.191 -2.950 1.00 0.00 H new ATOM 0 HB3 ASN B 91 -14.036 -12.614 -3.367 1.00 0.00 H new ATOM 0 HD21 ASN B 91 -14.219 -14.096 -6.710 1.00 0.00 H new ATOM 0 HD22 ASN B 91 -15.162 -13.172 -5.537 1.00 0.00 H new ATOM 2537 N GLU B 92 -10.214 -13.666 -3.004 1.00 0.00 N ATOM 2538 CA GLU B 92 -9.005 -12.898 -3.426 1.00 0.00 C ATOM 2539 C GLU B 92 -9.105 -12.396 -4.879 1.00 0.00 C ATOM 2540 O GLU B 92 -8.198 -11.758 -5.375 1.00 0.00 O ATOM 2541 CB GLU B 92 -7.855 -13.891 -3.290 1.00 0.00 C ATOM 2542 CG GLU B 92 -7.903 -14.550 -1.909 1.00 0.00 C ATOM 2543 CD GLU B 92 -6.530 -15.135 -1.574 1.00 0.00 C ATOM 2544 OE1 GLU B 92 -5.545 -14.454 -1.804 1.00 0.00 O ATOM 2545 OE2 GLU B 92 -6.486 -16.255 -1.091 1.00 0.00 O ATOM 0 H GLU B 92 -10.036 -14.638 -2.749 1.00 0.00 H new ATOM 0 HA GLU B 92 -8.876 -12.003 -2.817 1.00 0.00 H new ATOM 0 HB2 GLU B 92 -7.924 -14.651 -4.069 1.00 0.00 H new ATOM 0 HB3 GLU B 92 -6.902 -13.380 -3.427 1.00 0.00 H new ATOM 0 HG2 GLU B 92 -8.192 -13.818 -1.155 1.00 0.00 H new ATOM 0 HG3 GLU B 92 -8.658 -15.336 -1.896 1.00 0.00 H new ATOM 2552 N LYS B 93 -10.177 -12.676 -5.572 1.00 0.00 N ATOM 2553 CA LYS B 93 -10.283 -12.207 -6.985 1.00 0.00 C ATOM 2554 C LYS B 93 -10.044 -10.695 -7.061 1.00 0.00 C ATOM 2555 O LYS B 93 -10.932 -9.901 -6.825 1.00 0.00 O ATOM 2556 CB LYS B 93 -11.712 -12.546 -7.412 1.00 0.00 C ATOM 2557 CG LYS B 93 -11.834 -12.412 -8.931 1.00 0.00 C ATOM 2558 CD LYS B 93 -13.308 -12.260 -9.316 1.00 0.00 C ATOM 2559 CE LYS B 93 -13.421 -11.382 -10.564 1.00 0.00 C ATOM 2560 NZ LYS B 93 -14.879 -11.331 -10.866 1.00 0.00 N ATOM 0 H LYS B 93 -10.977 -13.204 -5.225 1.00 0.00 H new ATOM 0 HA LYS B 93 -9.543 -12.679 -7.632 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -11.964 -13.561 -7.104 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -12.419 -11.878 -6.919 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -11.266 -11.548 -9.277 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -11.409 -13.289 -9.419 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -13.748 -13.239 -9.506 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -13.866 -11.814 -8.493 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -13.020 -10.385 -10.383 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -12.860 -11.805 -11.397 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -15.038 -10.746 -11.711 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -15.231 -12.294 -11.040 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -15.387 -10.918 -10.058 1.00 0.00 H new ATOM 2574 N TRP B 94 -8.843 -10.298 -7.385 1.00 0.00 N ATOM 2575 CA TRP B 94 -8.526 -8.842 -7.475 1.00 0.00 C ATOM 2576 C TRP B 94 -8.069 -8.486 -8.891 1.00 0.00 C ATOM 2577 O TRP B 94 -7.654 -9.337 -9.654 1.00 0.00 O ATOM 2578 CB TRP B 94 -7.393 -8.639 -6.467 1.00 0.00 C ATOM 2579 CG TRP B 94 -6.833 -7.259 -6.593 1.00 0.00 C ATOM 2580 CD1 TRP B 94 -7.554 -6.116 -6.537 1.00 0.00 C ATOM 2581 CD2 TRP B 94 -5.444 -6.858 -6.784 1.00 0.00 C ATOM 2582 NE1 TRP B 94 -6.697 -5.039 -6.686 1.00 0.00 N ATOM 2583 CE2 TRP B 94 -5.387 -5.446 -6.840 1.00 0.00 C ATOM 2584 CE3 TRP B 94 -4.243 -7.576 -6.915 1.00 0.00 C ATOM 2585 CZ2 TRP B 94 -4.180 -4.769 -7.019 1.00 0.00 C ATOM 2586 CZ3 TRP B 94 -3.025 -6.899 -7.093 1.00 0.00 C ATOM 2587 CH2 TRP B 94 -2.994 -5.499 -7.145 1.00 0.00 C ATOM 0 H TRP B 94 -8.063 -10.922 -7.592 1.00 0.00 H new ATOM 0 HA TRP B 94 -9.386 -8.208 -7.260 1.00 0.00 H new ATOM 0 HB2 TRP B 94 -7.764 -8.798 -5.455 1.00 0.00 H new ATOM 0 HB3 TRP B 94 -6.608 -9.375 -6.638 1.00 0.00 H new ATOM 0 HD1 TRP B 94 -8.623 -6.054 -6.399 1.00 0.00 H new ATOM 0 HE1 TRP B 94 -6.997 -4.064 -6.682 1.00 0.00 H new ATOM 0 HE3 TRP B 94 -4.257 -8.655 -6.879 1.00 0.00 H new ATOM 0 HZ2 TRP B 94 -4.162 -3.690 -7.060 1.00 0.00 H new ATOM 0 HZ3 TRP B 94 -2.108 -7.461 -7.190 1.00 0.00 H new ATOM 0 HH2 TRP B 94 -2.055 -4.984 -7.282 1.00 0.00 H new ATOM 2598 N ALA B 95 -8.146 -7.234 -9.252 1.00 0.00 N ATOM 2599 CA ALA B 95 -7.721 -6.824 -10.622 1.00 0.00 C ATOM 2600 C ALA B 95 -6.264 -6.359 -10.606 1.00 0.00 C ATOM 2601 O ALA B 95 -5.923 -5.365 -9.996 1.00 0.00 O ATOM 2602 CB ALA B 95 -8.648 -5.664 -10.993 1.00 0.00 C ATOM 0 H ALA B 95 -8.485 -6.477 -8.658 1.00 0.00 H new ATOM 0 HA ALA B 95 -7.786 -7.644 -11.337 1.00 0.00 H new ATOM 0 HB1 ALA B 95 -8.399 -5.304 -11.991 1.00 0.00 H new ATOM 0 HB2 ALA B 95 -9.683 -6.006 -10.978 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -8.523 -4.854 -10.274 1.00 0.00 H new ATOM 2608 N TYR B 96 -5.400 -7.072 -11.276 1.00 0.00 N ATOM 2609 CA TYR B 96 -3.965 -6.674 -11.302 1.00 0.00 C ATOM 2610 C TYR B 96 -3.533 -6.340 -12.733 1.00 0.00 C ATOM 2611 O TYR B 96 -3.627 -7.158 -13.627 1.00 0.00 O ATOM 2612 CB TYR B 96 -3.205 -7.896 -10.783 1.00 0.00 C ATOM 2613 CG TYR B 96 -1.727 -7.585 -10.726 1.00 0.00 C ATOM 2614 CD1 TYR B 96 -1.268 -6.504 -9.965 1.00 0.00 C ATOM 2615 CD2 TYR B 96 -0.817 -8.379 -11.434 1.00 0.00 C ATOM 2616 CE1 TYR B 96 0.101 -6.215 -9.913 1.00 0.00 C ATOM 2617 CE2 TYR B 96 0.553 -8.091 -11.381 1.00 0.00 C ATOM 2618 CZ TYR B 96 1.011 -7.009 -10.622 1.00 0.00 C ATOM 2619 OH TYR B 96 2.361 -6.724 -10.570 1.00 0.00 O ATOM 0 H TYR B 96 -5.627 -7.913 -11.807 1.00 0.00 H new ATOM 0 HA TYR B 96 -3.772 -5.787 -10.698 1.00 0.00 H new ATOM 0 HB2 TYR B 96 -3.568 -8.169 -9.792 1.00 0.00 H new ATOM 0 HB3 TYR B 96 -3.382 -8.751 -11.435 1.00 0.00 H new ATOM 0 HD1 TYR B 96 -1.970 -5.892 -9.418 1.00 0.00 H new ATOM 0 HD2 TYR B 96 -1.171 -9.214 -12.021 1.00 0.00 H new ATOM 0 HE1 TYR B 96 0.455 -5.380 -9.326 1.00 0.00 H new ATOM 0 HE2 TYR B 96 1.255 -8.704 -11.926 1.00 0.00 H new ATOM 0 HH TYR B 96 2.853 -7.372 -11.117 1.00 0.00 H new