USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 595 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 6 SER OG : rot 180:sc= 0.0235 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 TYR OH : rot -164:sc= 1.21 USER MOD Single : A 17 THR OG1 : rot -19:sc= 0.183 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 40:sc= 0.0481 USER MOD Single : A 28 ASN : amide:sc= -0.599 K(o=-0.6,f=-4!) USER MOD Single : A 30 ASN : amide:sc= -1.22 K(o=-1.2,f=-5.9!) USER MOD Single : A 41 LYS NZ :NH3+ 170:sc= 2.18 (180deg=2.17) USER MOD Single : A 42 TYR OH : rot -3:sc= 0.472 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 143:sc= 0.0353 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot 180:sc= -2.43! USER MOD Single : A 86 MET CE :methyl 176:sc= -3.15! (180deg=-3.29!) USER MOD Single : A 87 THR OG1 : rot 83:sc= 0.157 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 58 N GLY A 5 -13.738 -27.632 28.920 1.00 0.00 N ATOM 59 CA GLY A 5 -14.223 -26.934 27.744 1.00 0.00 C ATOM 60 C GLY A 5 -15.716 -27.072 27.593 1.00 0.00 C ATOM 61 O GLY A 5 -16.382 -26.185 27.058 1.00 0.00 O ATOM 0 HA2 GLY A 5 -13.960 -25.878 27.812 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -13.729 -27.329 26.856 1.00 0.00 H new ATOM 65 N SER A 6 -16.244 -28.177 28.072 1.00 0.00 N ATOM 66 CA SER A 6 -17.655 -28.425 28.021 1.00 0.00 C ATOM 67 C SER A 6 -18.311 -28.002 29.333 1.00 0.00 C ATOM 68 O SER A 6 -17.747 -28.203 30.415 1.00 0.00 O ATOM 69 CB SER A 6 -17.907 -29.907 27.737 1.00 0.00 C ATOM 70 OG SER A 6 -17.093 -30.727 28.569 1.00 0.00 O ATOM 0 H SER A 6 -15.702 -28.924 28.506 1.00 0.00 H new ATOM 0 HA SER A 6 -18.097 -27.837 27.217 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.958 -30.141 27.905 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.697 -30.122 26.689 1.00 0.00 H new ATOM 0 HG SER A 6 -17.271 -31.671 28.373 1.00 0.00 H new ATOM 76 N LEU A 7 -19.475 -27.404 29.237 1.00 0.00 N ATOM 77 CA LEU A 7 -20.200 -26.972 30.412 1.00 0.00 C ATOM 78 C LEU A 7 -21.463 -27.749 30.608 1.00 0.00 C ATOM 79 O LEU A 7 -22.185 -28.044 29.651 1.00 0.00 O ATOM 80 CB LEU A 7 -20.518 -25.476 30.366 1.00 0.00 C ATOM 81 CG LEU A 7 -19.347 -24.550 30.658 1.00 0.00 C ATOM 82 CD1 LEU A 7 -19.724 -23.105 30.378 1.00 0.00 C ATOM 83 CD2 LEU A 7 -18.924 -24.714 32.112 1.00 0.00 C ATOM 0 H LEU A 7 -19.943 -27.204 28.353 1.00 0.00 H new ATOM 0 HA LEU A 7 -19.543 -27.162 31.260 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -20.911 -25.236 29.378 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -21.311 -25.268 31.084 1.00 0.00 H new ATOM 0 HG LEU A 7 -18.514 -24.814 30.007 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -18.873 -22.459 30.593 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -20.005 -22.999 29.330 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -20.565 -22.819 31.010 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -18.085 -24.051 32.324 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -19.760 -24.461 32.765 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -18.624 -25.747 32.289 1.00 0.00 H new ATOM 95 N LYS A 8 -21.718 -28.098 31.851 1.00 0.00 N ATOM 96 CA LYS A 8 -22.935 -28.758 32.214 1.00 0.00 C ATOM 97 C LYS A 8 -24.000 -27.701 32.371 1.00 0.00 C ATOM 98 O LYS A 8 -24.003 -26.939 33.344 1.00 0.00 O ATOM 99 CB LYS A 8 -22.747 -29.509 33.518 1.00 0.00 C ATOM 100 CG LYS A 8 -23.713 -30.654 33.710 1.00 0.00 C ATOM 101 CD LYS A 8 -23.382 -31.432 34.968 1.00 0.00 C ATOM 102 CE LYS A 8 -23.645 -30.608 36.222 1.00 0.00 C ATOM 103 NZ LYS A 8 -23.359 -31.377 37.457 1.00 0.00 N ATOM 0 H LYS A 8 -21.083 -27.929 32.631 1.00 0.00 H new ATOM 0 HA LYS A 8 -23.225 -29.477 31.448 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -21.728 -29.895 33.560 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -22.858 -28.810 34.347 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -24.731 -30.270 33.772 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -23.674 -31.317 32.846 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -23.978 -32.344 35.000 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -22.335 -31.735 34.944 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -23.028 -29.710 36.202 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -24.685 -30.281 36.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -23.550 -30.782 38.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -23.965 -32.221 37.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -22.360 -31.668 37.462 1.00 0.00 H new ATOM 117 N VAL A 9 -24.882 -27.643 31.422 1.00 0.00 N ATOM 118 CA VAL A 9 -25.871 -26.608 31.382 1.00 0.00 C ATOM 119 C VAL A 9 -27.259 -27.190 31.592 1.00 0.00 C ATOM 120 O VAL A 9 -27.642 -28.159 30.945 1.00 0.00 O ATOM 121 CB VAL A 9 -25.745 -25.849 30.039 1.00 0.00 C ATOM 122 CG1 VAL A 9 -26.879 -24.888 29.797 1.00 0.00 C ATOM 123 CG2 VAL A 9 -24.432 -25.108 30.008 1.00 0.00 C ATOM 0 H VAL A 9 -24.938 -28.311 30.653 1.00 0.00 H new ATOM 0 HA VAL A 9 -25.708 -25.897 32.192 1.00 0.00 H new ATOM 0 HB VAL A 9 -25.787 -26.591 29.242 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -26.733 -24.387 28.840 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -27.822 -25.435 29.781 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -26.904 -24.146 30.595 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -24.339 -24.572 29.064 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -24.396 -24.397 30.834 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -23.611 -25.818 30.104 1.00 0.00 H new ATOM 133 N TYR A 10 -27.991 -26.602 32.514 1.00 0.00 N ATOM 134 CA TYR A 10 -29.287 -27.115 32.904 1.00 0.00 C ATOM 135 C TYR A 10 -30.433 -26.305 32.305 1.00 0.00 C ATOM 136 O TYR A 10 -30.686 -25.165 32.688 1.00 0.00 O ATOM 137 CB TYR A 10 -29.362 -27.175 34.445 1.00 0.00 C ATOM 138 CG TYR A 10 -30.723 -27.511 35.027 1.00 0.00 C ATOM 139 CD1 TYR A 10 -31.204 -28.811 35.025 1.00 0.00 C ATOM 140 CD2 TYR A 10 -31.501 -26.526 35.621 1.00 0.00 C ATOM 141 CE1 TYR A 10 -32.426 -29.124 35.588 1.00 0.00 C ATOM 142 CE2 TYR A 10 -32.724 -26.818 36.186 1.00 0.00 C ATOM 143 CZ TYR A 10 -33.187 -28.123 36.170 1.00 0.00 C ATOM 144 OH TYR A 10 -34.403 -28.433 36.739 1.00 0.00 O ATOM 0 H TYR A 10 -27.706 -25.759 33.012 1.00 0.00 H new ATOM 0 HA TYR A 10 -29.401 -28.123 32.504 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -28.644 -27.916 34.796 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -29.045 -26.211 34.843 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -30.612 -29.594 34.575 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -31.140 -25.508 35.641 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -32.786 -30.142 35.575 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -33.316 -26.036 36.637 1.00 0.00 H new ATOM 0 HH TYR A 10 -34.921 -27.612 36.872 1.00 0.00 H new ATOM 154 N GLY A 11 -31.108 -26.909 31.347 1.00 0.00 N ATOM 155 CA GLY A 11 -32.253 -26.285 30.724 1.00 0.00 C ATOM 156 C GLY A 11 -33.486 -27.134 30.896 1.00 0.00 C ATOM 157 O GLY A 11 -34.516 -26.897 30.259 1.00 0.00 O ATOM 0 H GLY A 11 -30.880 -27.835 30.984 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -32.420 -25.301 31.162 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -32.057 -26.132 29.663 1.00 0.00 H new ATOM 161 N GLY A 12 -33.376 -28.124 31.779 1.00 0.00 N ATOM 162 CA GLY A 12 -34.469 -29.042 32.053 1.00 0.00 C ATOM 163 C GLY A 12 -35.684 -28.356 32.603 1.00 0.00 C ATOM 164 O GLY A 12 -36.801 -28.859 32.483 1.00 0.00 O ATOM 0 H GLY A 12 -32.531 -28.308 32.319 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -34.737 -29.564 31.134 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -34.133 -29.798 32.762 1.00 0.00 H new ATOM 168 N GLU A 13 -35.470 -27.212 33.217 1.00 0.00 N ATOM 169 CA GLU A 13 -36.551 -26.458 33.790 1.00 0.00 C ATOM 170 C GLU A 13 -37.472 -25.949 32.683 1.00 0.00 C ATOM 171 O GLU A 13 -38.669 -25.731 32.893 1.00 0.00 O ATOM 172 CB GLU A 13 -36.005 -25.305 34.629 1.00 0.00 C ATOM 173 CG GLU A 13 -36.970 -24.852 35.698 1.00 0.00 C ATOM 174 CD GLU A 13 -37.381 -26.007 36.594 1.00 0.00 C ATOM 175 OE1 GLU A 13 -36.510 -26.830 36.951 1.00 0.00 O ATOM 176 OE2 GLU A 13 -38.575 -26.125 36.911 1.00 0.00 O ATOM 0 H GLU A 13 -34.550 -26.787 33.330 1.00 0.00 H new ATOM 0 HA GLU A 13 -37.132 -27.104 34.448 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -35.070 -25.613 35.097 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -35.773 -24.464 33.975 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -36.509 -24.069 36.299 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -37.854 -24.417 35.232 1.00 0.00 H new ATOM 183 N ILE A 14 -36.898 -25.761 31.502 1.00 0.00 N ATOM 184 CA ILE A 14 -37.646 -25.330 30.342 1.00 0.00 C ATOM 185 C ILE A 14 -38.078 -26.546 29.521 1.00 0.00 C ATOM 186 O ILE A 14 -39.259 -26.711 29.200 1.00 0.00 O ATOM 187 CB ILE A 14 -36.797 -24.394 29.455 1.00 0.00 C ATOM 188 CG1 ILE A 14 -36.321 -23.183 30.264 1.00 0.00 C ATOM 189 CG2 ILE A 14 -37.601 -23.939 28.241 1.00 0.00 C ATOM 190 CD1 ILE A 14 -35.329 -22.308 29.528 1.00 0.00 C ATOM 0 H ILE A 14 -35.903 -25.904 31.328 1.00 0.00 H new ATOM 0 HA ILE A 14 -38.524 -24.785 30.688 1.00 0.00 H new ATOM 0 HB ILE A 14 -35.923 -24.944 29.105 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -37.186 -22.581 30.542 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -35.865 -23.533 31.190 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -36.989 -23.280 27.625 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -37.899 -24.809 27.656 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -38.490 -23.403 28.573 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -35.039 -21.472 30.165 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -34.446 -22.894 29.273 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -35.787 -21.927 28.615 1.00 0.00 H new ATOM 202 N VAL A 15 -37.112 -27.406 29.203 1.00 0.00 N ATOM 203 CA VAL A 15 -37.366 -28.611 28.421 1.00 0.00 C ATOM 204 C VAL A 15 -36.950 -29.856 29.216 1.00 0.00 C ATOM 205 O VAL A 15 -35.775 -30.218 29.252 1.00 0.00 O ATOM 206 CB VAL A 15 -36.610 -28.579 27.064 1.00 0.00 C ATOM 207 CG1 VAL A 15 -36.902 -29.829 26.253 1.00 0.00 C ATOM 208 CG2 VAL A 15 -36.977 -27.333 26.268 1.00 0.00 C ATOM 0 H VAL A 15 -36.137 -27.287 29.479 1.00 0.00 H new ATOM 0 HA VAL A 15 -38.435 -28.652 28.214 1.00 0.00 H new ATOM 0 HB VAL A 15 -35.541 -28.549 27.277 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -36.362 -29.784 25.307 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -36.582 -30.708 26.812 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -37.972 -29.894 26.057 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -36.435 -27.333 25.322 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -38.049 -27.329 26.072 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -36.709 -26.444 26.839 1.00 0.00 H new ATOM 218 N PRO A 16 -37.922 -30.506 29.876 1.00 0.00 N ATOM 219 CA PRO A 16 -37.687 -31.690 30.731 1.00 0.00 C ATOM 220 C PRO A 16 -36.994 -32.870 30.028 1.00 0.00 C ATOM 221 O PRO A 16 -36.222 -33.591 30.657 1.00 0.00 O ATOM 222 CB PRO A 16 -39.096 -32.083 31.185 1.00 0.00 C ATOM 223 CG PRO A 16 -39.879 -30.825 31.079 1.00 0.00 C ATOM 224 CD PRO A 16 -39.341 -30.116 29.874 1.00 0.00 C ATOM 0 HA PRO A 16 -36.999 -31.446 31.540 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -39.514 -32.866 30.553 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -39.093 -32.465 32.206 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -40.943 -31.034 30.968 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -39.765 -30.216 31.976 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -39.846 -30.430 28.960 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -39.464 -29.036 29.951 1.00 0.00 H new ATOM 232 N THR A 17 -37.267 -33.073 28.737 1.00 0.00 N ATOM 233 CA THR A 17 -36.659 -34.196 28.008 1.00 0.00 C ATOM 234 C THR A 17 -35.132 -34.032 27.881 1.00 0.00 C ATOM 235 O THR A 17 -34.414 -34.991 27.589 1.00 0.00 O ATOM 236 CB THR A 17 -37.306 -34.415 26.604 1.00 0.00 C ATOM 237 OG1 THR A 17 -36.805 -35.622 26.005 1.00 0.00 O ATOM 238 CG2 THR A 17 -37.036 -33.244 25.674 1.00 0.00 C ATOM 0 H THR A 17 -37.892 -32.489 28.181 1.00 0.00 H new ATOM 0 HA THR A 17 -36.858 -35.088 28.602 1.00 0.00 H new ATOM 0 HB THR A 17 -38.383 -34.497 26.752 1.00 0.00 H new ATOM 0 HG1 THR A 17 -35.964 -35.878 26.438 1.00 0.00 H new ATOM 0 HG21 THR A 17 -37.502 -33.433 24.707 1.00 0.00 H new ATOM 0 HG22 THR A 17 -37.452 -32.333 26.105 1.00 0.00 H new ATOM 0 HG23 THR A 17 -35.961 -33.125 25.542 1.00 0.00 H new ATOM 246 N ARG A 18 -34.646 -32.818 28.109 1.00 0.00 N ATOM 247 CA ARG A 18 -33.217 -32.538 28.078 1.00 0.00 C ATOM 248 C ARG A 18 -32.809 -31.733 29.312 1.00 0.00 C ATOM 249 O ARG A 18 -32.584 -30.526 29.223 1.00 0.00 O ATOM 250 CB ARG A 18 -32.836 -31.776 26.803 1.00 0.00 C ATOM 251 CG ARG A 18 -32.792 -32.633 25.553 1.00 0.00 C ATOM 252 CD ARG A 18 -32.479 -31.797 24.324 1.00 0.00 C ATOM 253 NE ARG A 18 -32.157 -32.629 23.165 1.00 0.00 N ATOM 254 CZ ARG A 18 -32.137 -32.192 21.905 1.00 0.00 C ATOM 255 NH1 ARG A 18 -32.514 -30.953 21.619 1.00 0.00 N ATOM 256 NH2 ARG A 18 -31.756 -33.004 20.931 1.00 0.00 N ATOM 0 H ARG A 18 -35.227 -32.006 28.319 1.00 0.00 H new ATOM 0 HA ARG A 18 -32.684 -33.489 28.081 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -33.551 -30.967 26.650 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -31.859 -31.315 26.948 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -32.037 -33.411 25.669 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -33.750 -33.136 25.420 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -33.334 -31.163 24.089 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -31.640 -31.135 24.540 1.00 0.00 H new ATOM 0 HE ARG A 18 -31.933 -33.610 23.332 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -32.821 -30.329 22.365 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -32.496 -30.625 20.653 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -31.478 -33.962 21.145 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -31.740 -32.672 19.967 1.00 0.00 H new ATOM 270 N PRO A 19 -32.727 -32.393 30.495 1.00 0.00 N ATOM 271 CA PRO A 19 -32.394 -31.717 31.750 1.00 0.00 C ATOM 272 C PRO A 19 -31.039 -31.035 31.703 1.00 0.00 C ATOM 273 O PRO A 19 -30.898 -29.875 32.095 1.00 0.00 O ATOM 274 CB PRO A 19 -32.407 -32.839 32.799 1.00 0.00 C ATOM 275 CG PRO A 19 -32.287 -34.100 32.017 1.00 0.00 C ATOM 276 CD PRO A 19 -32.941 -33.833 30.690 1.00 0.00 C ATOM 0 HA PRO A 19 -33.101 -30.917 31.971 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -31.581 -32.731 33.502 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -33.327 -32.823 33.383 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -31.242 -34.380 31.887 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -32.776 -34.926 32.533 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -32.486 -34.420 29.892 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -34.002 -34.084 30.706 1.00 0.00 H new ATOM 284 N TYR A 20 -30.054 -31.748 31.214 1.00 0.00 N ATOM 285 CA TYR A 20 -28.728 -31.215 31.081 1.00 0.00 C ATOM 286 C TYR A 20 -28.265 -31.302 29.652 1.00 0.00 C ATOM 287 O TYR A 20 -28.514 -32.296 28.958 1.00 0.00 O ATOM 288 CB TYR A 20 -27.740 -31.924 32.013 1.00 0.00 C ATOM 289 CG TYR A 20 -27.939 -31.599 33.477 1.00 0.00 C ATOM 290 CD1 TYR A 20 -27.309 -30.503 34.050 1.00 0.00 C ATOM 291 CD2 TYR A 20 -28.751 -32.383 34.287 1.00 0.00 C ATOM 292 CE1 TYR A 20 -27.479 -30.194 35.382 1.00 0.00 C ATOM 293 CE2 TYR A 20 -28.930 -32.078 35.626 1.00 0.00 C ATOM 294 CZ TYR A 20 -28.290 -30.984 36.166 1.00 0.00 C ATOM 295 OH TYR A 20 -28.463 -30.676 37.493 1.00 0.00 O ATOM 0 H TYR A 20 -30.153 -32.713 30.898 1.00 0.00 H new ATOM 0 HA TYR A 20 -28.762 -30.166 31.374 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -27.833 -33.001 31.874 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -26.725 -31.652 31.725 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -26.673 -29.880 33.439 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -29.250 -33.243 33.866 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -26.979 -29.337 35.809 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -29.567 -32.694 36.243 1.00 0.00 H new ATOM 0 HH TYR A 20 -29.065 -31.330 37.905 1.00 0.00 H new ATOM 305 N VAL A 21 -27.615 -30.269 29.212 1.00 0.00 N ATOM 306 CA VAL A 21 -27.083 -30.212 27.890 1.00 0.00 C ATOM 307 C VAL A 21 -25.628 -29.832 27.966 1.00 0.00 C ATOM 308 O VAL A 21 -25.184 -29.223 28.948 1.00 0.00 O ATOM 309 CB VAL A 21 -27.867 -29.214 26.996 1.00 0.00 C ATOM 310 CG1 VAL A 21 -27.688 -27.780 27.469 1.00 0.00 C ATOM 311 CG2 VAL A 21 -27.498 -29.357 25.528 1.00 0.00 C ATOM 0 H VAL A 21 -27.438 -29.433 29.769 1.00 0.00 H new ATOM 0 HA VAL A 21 -27.184 -31.194 27.429 1.00 0.00 H new ATOM 0 HB VAL A 21 -28.923 -29.466 27.092 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -28.251 -27.110 26.820 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -28.053 -27.686 28.492 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -26.631 -27.515 27.435 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -28.069 -28.640 24.938 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -26.433 -29.165 25.400 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -27.727 -30.368 25.192 1.00 0.00 H new ATOM 321 N SER A 22 -24.898 -30.198 26.971 1.00 0.00 N ATOM 322 CA SER A 22 -23.484 -29.955 26.949 1.00 0.00 C ATOM 323 C SER A 22 -23.152 -28.884 25.930 1.00 0.00 C ATOM 324 O SER A 22 -23.546 -28.982 24.762 1.00 0.00 O ATOM 325 CB SER A 22 -22.739 -31.255 26.635 1.00 0.00 C ATOM 326 OG SER A 22 -23.315 -31.911 25.517 1.00 0.00 O ATOM 0 H SER A 22 -25.258 -30.676 26.145 1.00 0.00 H new ATOM 0 HA SER A 22 -23.166 -29.601 27.930 1.00 0.00 H new ATOM 0 HB2 SER A 22 -21.690 -31.038 26.434 1.00 0.00 H new ATOM 0 HB3 SER A 22 -22.767 -31.914 27.503 1.00 0.00 H new ATOM 0 HG SER A 22 -23.562 -31.247 24.840 1.00 0.00 H new ATOM 332 N ILE A 23 -22.460 -27.851 26.366 1.00 0.00 N ATOM 333 CA ILE A 23 -22.078 -26.785 25.470 1.00 0.00 C ATOM 334 C ILE A 23 -20.579 -26.552 25.540 1.00 0.00 C ATOM 335 O ILE A 23 -19.939 -26.890 26.540 1.00 0.00 O ATOM 336 CB ILE A 23 -22.814 -25.453 25.779 1.00 0.00 C ATOM 337 CG1 ILE A 23 -22.401 -24.898 27.145 1.00 0.00 C ATOM 338 CG2 ILE A 23 -24.317 -25.661 25.722 1.00 0.00 C ATOM 339 CD1 ILE A 23 -22.907 -23.494 27.397 1.00 0.00 C ATOM 0 H ILE A 23 -22.153 -27.729 27.331 1.00 0.00 H new ATOM 0 HA ILE A 23 -22.366 -27.101 24.467 1.00 0.00 H new ATOM 0 HB ILE A 23 -22.530 -24.723 25.022 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -22.777 -25.558 27.927 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -21.313 -24.904 27.218 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -24.823 -24.721 25.940 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -24.600 -26.002 24.726 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -24.609 -26.410 26.459 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -22.580 -23.160 28.382 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -22.510 -22.822 26.636 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -23.996 -23.487 27.355 1.00 0.00 H new ATOM 351 N LEU A 24 -20.029 -25.992 24.487 1.00 0.00 N ATOM 352 CA LEU A 24 -18.614 -25.679 24.436 1.00 0.00 C ATOM 353 C LEU A 24 -18.438 -24.181 24.653 1.00 0.00 C ATOM 354 O LEU A 24 -18.987 -23.374 23.898 1.00 0.00 O ATOM 355 CB LEU A 24 -18.044 -26.093 23.071 1.00 0.00 C ATOM 356 CG LEU A 24 -16.525 -25.979 22.901 1.00 0.00 C ATOM 357 CD1 LEU A 24 -15.803 -26.889 23.881 1.00 0.00 C ATOM 358 CD2 LEU A 24 -16.127 -26.312 21.473 1.00 0.00 C ATOM 0 H LEU A 24 -20.545 -25.740 23.644 1.00 0.00 H new ATOM 0 HA LEU A 24 -18.079 -26.223 25.214 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -18.332 -27.127 22.880 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -18.520 -25.483 22.303 1.00 0.00 H new ATOM 0 HG LEU A 24 -16.232 -24.951 23.113 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -14.726 -26.792 23.742 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -16.065 -26.606 24.901 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -16.100 -27.923 23.704 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -15.045 -26.227 21.367 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -16.435 -27.331 21.237 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -16.614 -25.618 20.788 1.00 0.00 H new ATOM 370 N ALA A 25 -17.682 -23.810 25.675 1.00 0.00 N ATOM 371 CA ALA A 25 -17.511 -22.403 26.011 1.00 0.00 C ATOM 372 C ALA A 25 -16.114 -22.113 26.528 1.00 0.00 C ATOM 373 O ALA A 25 -15.427 -23.002 27.030 1.00 0.00 O ATOM 374 CB ALA A 25 -18.551 -21.981 27.036 1.00 0.00 C ATOM 0 H ALA A 25 -17.180 -24.457 26.283 1.00 0.00 H new ATOM 0 HA ALA A 25 -17.649 -21.824 25.098 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -18.414 -20.928 27.280 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -19.549 -22.132 26.625 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -18.436 -22.581 27.939 1.00 0.00 H new ATOM 380 N GLU A 26 -15.707 -20.863 26.394 1.00 0.00 N ATOM 381 CA GLU A 26 -14.400 -20.416 26.849 1.00 0.00 C ATOM 382 C GLU A 26 -14.563 -19.494 28.049 1.00 0.00 C ATOM 383 O GLU A 26 -15.549 -18.769 28.144 1.00 0.00 O ATOM 384 CB GLU A 26 -13.680 -19.686 25.719 1.00 0.00 C ATOM 385 CG GLU A 26 -13.332 -20.578 24.542 1.00 0.00 C ATOM 386 CD GLU A 26 -12.695 -19.818 23.407 1.00 0.00 C ATOM 387 OE1 GLU A 26 -11.452 -19.656 23.409 1.00 0.00 O ATOM 388 OE2 GLU A 26 -13.431 -19.374 22.494 1.00 0.00 O ATOM 0 H GLU A 26 -16.272 -20.129 25.967 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.806 -21.281 27.144 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -14.308 -18.866 25.369 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.765 -19.242 26.110 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -12.653 -21.364 24.874 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -14.237 -21.069 24.183 1.00 0.00 H new ATOM 395 N ILE A 27 -13.599 -19.512 28.959 1.00 0.00 N ATOM 396 CA ILE A 27 -13.691 -18.697 30.172 1.00 0.00 C ATOM 397 C ILE A 27 -13.680 -17.198 29.872 1.00 0.00 C ATOM 398 O ILE A 27 -14.311 -16.409 30.575 1.00 0.00 O ATOM 399 CB ILE A 27 -12.588 -19.037 31.202 1.00 0.00 C ATOM 400 CG1 ILE A 27 -12.829 -18.247 32.486 1.00 0.00 C ATOM 401 CG2 ILE A 27 -11.198 -18.746 30.639 1.00 0.00 C ATOM 402 CD1 ILE A 27 -12.041 -18.734 33.657 1.00 0.00 C ATOM 0 H ILE A 27 -12.751 -20.074 28.886 1.00 0.00 H new ATOM 0 HA ILE A 27 -14.655 -18.948 30.614 1.00 0.00 H new ATOM 0 HB ILE A 27 -12.633 -20.103 31.424 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.585 -17.200 32.307 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.890 -18.289 32.732 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -10.444 -18.995 31.385 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -11.035 -19.347 29.744 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.122 -17.689 30.385 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -12.269 -18.121 34.529 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.302 -19.772 33.865 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.976 -18.665 33.433 1.00 0.00 H new ATOM 414 N ASN A 28 -12.995 -16.819 28.821 1.00 0.00 N ATOM 415 CA ASN A 28 -12.890 -15.423 28.443 1.00 0.00 C ATOM 416 C ASN A 28 -14.028 -15.033 27.508 1.00 0.00 C ATOM 417 O ASN A 28 -14.036 -13.940 26.938 1.00 0.00 O ATOM 418 CB ASN A 28 -11.532 -15.146 27.773 1.00 0.00 C ATOM 419 CG ASN A 28 -11.271 -16.017 26.540 1.00 0.00 C ATOM 420 OD1 ASN A 28 -12.196 -16.470 25.870 1.00 0.00 O ATOM 421 ND2 ASN A 28 -10.011 -16.243 26.233 1.00 0.00 N ATOM 0 H ASN A 28 -12.496 -17.461 28.205 1.00 0.00 H new ATOM 0 HA ASN A 28 -12.962 -14.819 29.347 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -11.486 -14.096 27.483 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -10.737 -15.311 28.500 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -9.779 -16.809 25.417 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -9.267 -15.852 26.811 1.00 0.00 H new ATOM 428 N GLU A 29 -14.982 -15.925 27.363 1.00 0.00 N ATOM 429 CA GLU A 29 -16.081 -15.712 26.495 1.00 0.00 C ATOM 430 C GLU A 29 -17.283 -15.221 27.300 1.00 0.00 C ATOM 431 O GLU A 29 -17.452 -15.581 28.468 1.00 0.00 O ATOM 432 CB GLU A 29 -16.363 -17.010 25.752 1.00 0.00 C ATOM 433 CG GLU A 29 -17.441 -16.927 24.724 1.00 0.00 C ATOM 434 CD GLU A 29 -17.519 -18.190 23.887 1.00 0.00 C ATOM 435 OE1 GLU A 29 -17.586 -19.287 24.465 1.00 0.00 O ATOM 436 OE2 GLU A 29 -17.487 -18.083 22.635 1.00 0.00 O ATOM 0 H GLU A 29 -15.003 -16.819 27.854 1.00 0.00 H new ATOM 0 HA GLU A 29 -15.859 -14.940 25.758 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -15.444 -17.341 25.267 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -16.633 -17.776 26.479 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -18.399 -16.756 25.215 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -17.259 -16.071 24.074 1.00 0.00 H new ATOM 443 N ASN A 30 -18.087 -14.378 26.691 1.00 0.00 N ATOM 444 CA ASN A 30 -19.224 -13.770 27.372 1.00 0.00 C ATOM 445 C ASN A 30 -20.442 -14.679 27.378 1.00 0.00 C ATOM 446 O ASN A 30 -20.535 -15.636 26.599 1.00 0.00 O ATOM 447 CB ASN A 30 -19.570 -12.407 26.750 1.00 0.00 C ATOM 448 CG ASN A 30 -19.887 -12.482 25.263 1.00 0.00 C ATOM 449 OD1 ASN A 30 -19.356 -13.323 24.535 1.00 0.00 O ATOM 450 ND2 ASN A 30 -20.757 -11.611 24.805 1.00 0.00 N ATOM 0 H ASN A 30 -17.979 -14.092 25.718 1.00 0.00 H new ATOM 0 HA ASN A 30 -18.929 -13.616 28.410 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -20.426 -11.984 27.275 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -18.734 -11.724 26.901 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -21.013 -11.617 23.818 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -21.177 -10.929 25.437 1.00 0.00 H new ATOM 457 N ALA A 31 -21.380 -14.359 28.255 1.00 0.00 N ATOM 458 CA ALA A 31 -22.582 -15.150 28.429 1.00 0.00 C ATOM 459 C ALA A 31 -23.495 -15.099 27.206 1.00 0.00 C ATOM 460 O ALA A 31 -24.362 -15.928 27.072 1.00 0.00 O ATOM 461 CB ALA A 31 -23.327 -14.733 29.688 1.00 0.00 C ATOM 0 H ALA A 31 -21.327 -13.543 28.865 1.00 0.00 H new ATOM 0 HA ALA A 31 -22.268 -16.188 28.542 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -24.225 -15.341 29.797 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -22.684 -14.877 30.556 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -23.607 -13.682 29.614 1.00 0.00 H new ATOM 467 N ASP A 32 -23.310 -14.115 26.319 1.00 0.00 N ATOM 468 CA ASP A 32 -24.098 -14.065 25.079 1.00 0.00 C ATOM 469 C ASP A 32 -23.846 -15.325 24.274 1.00 0.00 C ATOM 470 O ASP A 32 -24.777 -15.956 23.757 1.00 0.00 O ATOM 471 CB ASP A 32 -23.718 -12.847 24.218 1.00 0.00 C ATOM 472 CG ASP A 32 -24.205 -11.518 24.761 1.00 0.00 C ATOM 473 OD1 ASP A 32 -25.403 -11.205 24.588 1.00 0.00 O ATOM 474 OD2 ASP A 32 -23.385 -10.770 25.332 1.00 0.00 O ATOM 0 H ASP A 32 -22.637 -13.357 26.430 1.00 0.00 H new ATOM 0 HA ASP A 32 -25.150 -13.983 25.353 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -22.633 -12.810 24.122 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -24.123 -12.986 23.215 1.00 0.00 H new ATOM 479 N ARG A 33 -22.578 -15.696 24.187 1.00 0.00 N ATOM 480 CA ARG A 33 -22.160 -16.889 23.475 1.00 0.00 C ATOM 481 C ARG A 33 -22.613 -18.134 24.208 1.00 0.00 C ATOM 482 O ARG A 33 -23.173 -19.050 23.612 1.00 0.00 O ATOM 483 CB ARG A 33 -20.643 -16.917 23.357 1.00 0.00 C ATOM 484 CG ARG A 33 -20.045 -15.900 22.404 1.00 0.00 C ATOM 485 CD ARG A 33 -20.200 -16.343 20.959 1.00 0.00 C ATOM 486 NE ARG A 33 -19.494 -15.455 20.033 1.00 0.00 N ATOM 487 CZ ARG A 33 -18.172 -15.507 19.793 1.00 0.00 C ATOM 488 NH1 ARG A 33 -17.396 -16.365 20.458 1.00 0.00 N ATOM 489 NH2 ARG A 33 -17.630 -14.697 18.897 1.00 0.00 N ATOM 0 H ARG A 33 -21.810 -15.175 24.610 1.00 0.00 H new ATOM 0 HA ARG A 33 -22.612 -16.869 22.484 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -20.216 -16.757 24.347 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -20.339 -17.913 23.036 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -20.532 -14.935 22.545 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -18.988 -15.761 22.633 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -19.819 -17.358 20.849 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -21.258 -16.369 20.700 1.00 0.00 H new ATOM 0 HE ARG A 33 -20.041 -14.751 19.538 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -17.805 -16.988 21.155 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -16.394 -16.398 20.270 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -18.215 -14.034 18.389 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -16.627 -14.736 18.715 1.00 0.00 H new ATOM 503 N ILE A 34 -22.387 -18.140 25.517 1.00 0.00 N ATOM 504 CA ILE A 34 -22.713 -19.285 26.352 1.00 0.00 C ATOM 505 C ILE A 34 -24.221 -19.541 26.354 1.00 0.00 C ATOM 506 O ILE A 34 -24.672 -20.682 26.187 1.00 0.00 O ATOM 507 CB ILE A 34 -22.221 -19.047 27.805 1.00 0.00 C ATOM 508 CG1 ILE A 34 -20.688 -18.973 27.836 1.00 0.00 C ATOM 509 CG2 ILE A 34 -22.714 -20.156 28.731 1.00 0.00 C ATOM 510 CD1 ILE A 34 -20.118 -18.542 29.173 1.00 0.00 C ATOM 0 H ILE A 34 -21.976 -17.356 26.024 1.00 0.00 H new ATOM 0 HA ILE A 34 -22.210 -20.160 25.941 1.00 0.00 H new ATOM 0 HB ILE A 34 -22.630 -18.100 28.157 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -20.282 -19.951 27.578 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -20.353 -18.276 27.068 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -22.358 -19.969 29.744 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -23.804 -20.175 28.727 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -22.333 -21.116 28.384 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -19.030 -18.515 29.113 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -20.493 -17.550 29.426 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -20.421 -19.251 29.943 1.00 0.00 H new ATOM 522 N LEU A 35 -24.992 -18.474 26.509 1.00 0.00 N ATOM 523 CA LEU A 35 -26.441 -18.561 26.508 1.00 0.00 C ATOM 524 C LEU A 35 -26.936 -19.020 25.159 1.00 0.00 C ATOM 525 O LEU A 35 -27.783 -19.894 25.066 1.00 0.00 O ATOM 526 CB LEU A 35 -27.062 -17.200 26.865 1.00 0.00 C ATOM 527 CG LEU A 35 -28.594 -17.115 26.832 1.00 0.00 C ATOM 528 CD1 LEU A 35 -29.218 -18.108 27.801 1.00 0.00 C ATOM 529 CD2 LEU A 35 -29.048 -15.704 27.154 1.00 0.00 C ATOM 0 H LEU A 35 -24.631 -17.529 26.638 1.00 0.00 H new ATOM 0 HA LEU A 35 -26.744 -19.289 27.260 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -26.727 -16.924 27.865 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -26.664 -16.453 26.178 1.00 0.00 H new ATOM 0 HG LEU A 35 -28.927 -17.372 25.826 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -30.304 -18.026 27.757 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -28.919 -19.120 27.528 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -28.879 -17.890 28.814 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -30.137 -15.657 27.127 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -28.697 -15.427 28.148 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -28.637 -15.013 26.418 1.00 0.00 H new ATOM 541 N GLY A 36 -26.372 -18.444 24.110 1.00 0.00 N ATOM 542 CA GLY A 36 -26.778 -18.794 22.775 1.00 0.00 C ATOM 543 C GLY A 36 -26.472 -20.231 22.435 1.00 0.00 C ATOM 544 O GLY A 36 -27.272 -20.901 21.801 1.00 0.00 O ATOM 0 H GLY A 36 -25.638 -17.738 24.164 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -27.848 -18.619 22.667 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -26.274 -18.141 22.063 1.00 0.00 H new ATOM 548 N ALA A 37 -25.318 -20.706 22.876 1.00 0.00 N ATOM 549 CA ALA A 37 -24.899 -22.078 22.624 1.00 0.00 C ATOM 550 C ALA A 37 -25.882 -23.077 23.221 1.00 0.00 C ATOM 551 O ALA A 37 -26.280 -24.047 22.565 1.00 0.00 O ATOM 552 CB ALA A 37 -23.518 -22.308 23.206 1.00 0.00 C ATOM 0 H ALA A 37 -24.649 -20.157 23.415 1.00 0.00 H new ATOM 0 HA ALA A 37 -24.874 -22.231 21.545 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -23.209 -23.336 23.015 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -22.809 -21.623 22.741 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -23.542 -22.130 24.281 1.00 0.00 H new ATOM 558 N ALA A 38 -26.258 -22.846 24.465 1.00 0.00 N ATOM 559 CA ALA A 38 -27.181 -23.720 25.166 1.00 0.00 C ATOM 560 C ALA A 38 -28.606 -23.553 24.661 1.00 0.00 C ATOM 561 O ALA A 38 -29.305 -24.531 24.406 1.00 0.00 O ATOM 562 CB ALA A 38 -27.119 -23.444 26.651 1.00 0.00 C ATOM 0 H ALA A 38 -25.934 -22.051 25.016 1.00 0.00 H new ATOM 0 HA ALA A 38 -26.882 -24.750 24.973 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -27.814 -24.102 27.173 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -26.107 -23.624 27.013 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -27.392 -22.406 26.840 1.00 0.00 H new ATOM 568 N LEU A 39 -29.009 -22.312 24.496 1.00 0.00 N ATOM 569 CA LEU A 39 -30.360 -21.970 24.082 1.00 0.00 C ATOM 570 C LEU A 39 -30.639 -22.512 22.671 1.00 0.00 C ATOM 571 O LEU A 39 -31.763 -22.916 22.353 1.00 0.00 O ATOM 572 CB LEU A 39 -30.533 -20.453 24.143 1.00 0.00 C ATOM 573 CG LEU A 39 -31.943 -19.921 23.981 1.00 0.00 C ATOM 574 CD1 LEU A 39 -32.820 -20.410 25.120 1.00 0.00 C ATOM 575 CD2 LEU A 39 -31.925 -18.414 23.958 1.00 0.00 C ATOM 0 H LEU A 39 -28.406 -21.503 24.646 1.00 0.00 H new ATOM 0 HA LEU A 39 -31.082 -22.430 24.757 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -30.146 -20.105 25.101 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -29.910 -20.008 23.367 1.00 0.00 H new ATOM 0 HG LEU A 39 -32.351 -20.287 23.039 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -33.831 -20.022 24.994 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -32.847 -21.500 25.117 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -32.413 -20.060 26.069 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -32.942 -18.040 23.841 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -31.506 -18.041 24.893 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -31.314 -18.070 23.124 1.00 0.00 H new ATOM 587 N GLU A 40 -29.599 -22.516 21.837 1.00 0.00 N ATOM 588 CA GLU A 40 -29.677 -23.041 20.474 1.00 0.00 C ATOM 589 C GLU A 40 -30.050 -24.522 20.482 1.00 0.00 C ATOM 590 O GLU A 40 -30.851 -24.968 19.661 1.00 0.00 O ATOM 591 CB GLU A 40 -28.328 -22.809 19.747 1.00 0.00 C ATOM 592 CG GLU A 40 -28.198 -23.433 18.357 1.00 0.00 C ATOM 593 CD GLU A 40 -27.646 -24.853 18.383 1.00 0.00 C ATOM 594 OE1 GLU A 40 -26.490 -25.045 18.838 1.00 0.00 O ATOM 595 OE2 GLU A 40 -28.354 -25.779 17.937 1.00 0.00 O ATOM 0 H GLU A 40 -28.678 -22.155 22.088 1.00 0.00 H new ATOM 0 HA GLU A 40 -30.461 -22.509 19.934 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -28.167 -21.735 19.657 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -27.528 -23.200 20.375 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -29.176 -23.440 17.876 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -27.547 -22.809 17.745 1.00 0.00 H new ATOM 602 N LYS A 41 -29.496 -25.269 21.440 1.00 0.00 N ATOM 603 CA LYS A 41 -29.758 -26.695 21.558 1.00 0.00 C ATOM 604 C LYS A 41 -31.242 -26.952 21.792 1.00 0.00 C ATOM 605 O LYS A 41 -31.814 -27.900 21.255 1.00 0.00 O ATOM 606 CB LYS A 41 -28.947 -27.287 22.712 1.00 0.00 C ATOM 607 CG LYS A 41 -27.449 -27.067 22.582 1.00 0.00 C ATOM 608 CD LYS A 41 -26.919 -27.643 21.290 1.00 0.00 C ATOM 609 CE LYS A 41 -25.422 -27.426 21.153 1.00 0.00 C ATOM 610 NZ LYS A 41 -25.093 -25.993 20.930 1.00 0.00 N ATOM 0 H LYS A 41 -28.860 -24.901 22.147 1.00 0.00 H new ATOM 0 HA LYS A 41 -29.461 -27.174 20.625 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -29.290 -26.847 23.649 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -29.144 -28.357 22.771 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -27.231 -26.000 22.623 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -26.937 -27.529 23.426 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -27.138 -28.710 21.250 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -27.433 -27.181 20.447 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -24.919 -27.779 22.053 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -25.043 -28.020 20.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -24.065 -25.856 21.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -25.407 -25.708 19.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -25.576 -25.411 21.644 1.00 0.00 H new ATOM 624 N TYR A 42 -31.864 -26.096 22.588 1.00 0.00 N ATOM 625 CA TYR A 42 -33.275 -26.236 22.895 1.00 0.00 C ATOM 626 C TYR A 42 -34.149 -25.605 21.810 1.00 0.00 C ATOM 627 O TYR A 42 -35.373 -25.687 21.863 1.00 0.00 O ATOM 628 CB TYR A 42 -33.596 -25.621 24.260 1.00 0.00 C ATOM 629 CG TYR A 42 -32.870 -26.283 25.412 1.00 0.00 C ATOM 630 CD1 TYR A 42 -33.319 -27.488 25.936 1.00 0.00 C ATOM 631 CD2 TYR A 42 -31.735 -25.709 25.973 1.00 0.00 C ATOM 632 CE1 TYR A 42 -32.666 -28.100 26.983 1.00 0.00 C ATOM 633 CE2 TYR A 42 -31.073 -26.319 27.023 1.00 0.00 C ATOM 634 CZ TYR A 42 -31.546 -27.516 27.523 1.00 0.00 C ATOM 635 OH TYR A 42 -30.894 -28.132 28.571 1.00 0.00 O ATOM 0 H TYR A 42 -31.412 -25.297 23.032 1.00 0.00 H new ATOM 0 HA TYR A 42 -33.499 -27.302 22.930 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -33.339 -24.562 24.241 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -34.670 -25.685 24.434 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -34.197 -27.954 25.514 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -31.365 -24.772 25.583 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -33.033 -29.036 27.378 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -30.192 -25.862 27.449 1.00 0.00 H new ATOM 0 HH TYR A 42 -31.385 -28.939 28.832 1.00 0.00 H new ATOM 645 N GLY A 43 -33.508 -24.984 20.822 1.00 0.00 N ATOM 646 CA GLY A 43 -34.235 -24.367 19.722 1.00 0.00 C ATOM 647 C GLY A 43 -34.964 -23.103 20.133 1.00 0.00 C ATOM 648 O GLY A 43 -35.955 -22.717 19.510 1.00 0.00 O ATOM 0 H GLY A 43 -32.493 -24.897 20.763 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -33.537 -24.133 18.918 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -34.954 -25.082 19.322 1.00 0.00 H new ATOM 652 N LEU A 44 -34.480 -22.460 21.182 1.00 0.00 N ATOM 653 CA LEU A 44 -35.112 -21.253 21.701 1.00 0.00 C ATOM 654 C LEU A 44 -34.219 -20.032 21.507 1.00 0.00 C ATOM 655 O LEU A 44 -34.443 -18.995 22.126 1.00 0.00 O ATOM 656 CB LEU A 44 -35.433 -21.427 23.184 1.00 0.00 C ATOM 657 CG LEU A 44 -36.397 -22.558 23.534 1.00 0.00 C ATOM 658 CD1 LEU A 44 -36.567 -22.658 25.037 1.00 0.00 C ATOM 659 CD2 LEU A 44 -37.737 -22.341 22.859 1.00 0.00 C ATOM 0 H LEU A 44 -33.648 -22.753 21.695 1.00 0.00 H new ATOM 0 HA LEU A 44 -36.035 -21.092 21.144 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -34.499 -21.594 23.720 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -35.851 -20.492 23.557 1.00 0.00 H new ATOM 0 HG LEU A 44 -35.979 -23.496 23.170 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -37.257 -23.468 25.272 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -35.601 -22.858 25.500 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -36.966 -21.719 25.421 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -38.412 -23.156 23.119 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -38.164 -21.396 23.194 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -37.600 -22.315 21.778 1.00 0.00 H new ATOM 671 N GLU A 45 -33.232 -20.155 20.621 1.00 0.00 N ATOM 672 CA GLU A 45 -32.244 -19.092 20.375 1.00 0.00 C ATOM 673 C GLU A 45 -32.937 -17.789 19.957 1.00 0.00 C ATOM 674 O GLU A 45 -32.506 -16.697 20.324 1.00 0.00 O ATOM 675 CB GLU A 45 -31.247 -19.565 19.298 1.00 0.00 C ATOM 676 CG GLU A 45 -29.948 -18.761 19.210 1.00 0.00 C ATOM 677 CD GLU A 45 -30.063 -17.514 18.352 1.00 0.00 C ATOM 678 OE1 GLU A 45 -30.313 -17.647 17.134 1.00 0.00 O ATOM 679 OE2 GLU A 45 -29.873 -16.402 18.881 1.00 0.00 O ATOM 0 H GLU A 45 -33.090 -20.990 20.052 1.00 0.00 H new ATOM 0 HA GLU A 45 -31.698 -18.886 21.296 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.997 -20.608 19.491 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -31.742 -19.531 18.328 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -29.640 -18.473 20.215 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -29.162 -19.399 18.806 1.00 0.00 H new ATOM 686 N HIS A 46 -34.024 -17.926 19.221 1.00 0.00 N ATOM 687 CA HIS A 46 -34.817 -16.787 18.764 1.00 0.00 C ATOM 688 C HIS A 46 -35.370 -15.982 19.953 1.00 0.00 C ATOM 689 O HIS A 46 -35.401 -14.751 19.926 1.00 0.00 O ATOM 690 CB HIS A 46 -35.970 -17.284 17.878 1.00 0.00 C ATOM 691 CG HIS A 46 -36.849 -16.197 17.323 1.00 0.00 C ATOM 692 ND1 HIS A 46 -36.636 -15.607 16.094 1.00 0.00 N ATOM 693 CD2 HIS A 46 -37.957 -15.603 17.833 1.00 0.00 C ATOM 694 CE1 HIS A 46 -37.572 -14.696 15.878 1.00 0.00 C ATOM 695 NE2 HIS A 46 -38.381 -14.679 16.917 1.00 0.00 N ATOM 0 H HIS A 46 -34.388 -18.830 18.919 1.00 0.00 H new ATOM 0 HA HIS A 46 -34.171 -16.127 18.185 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -35.553 -17.854 17.048 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -36.587 -17.970 18.458 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -38.419 -15.819 18.785 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -37.658 -14.073 15.000 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -39.195 -14.073 17.022 1.00 0.00 H new ATOM 703 N SER A 47 -35.790 -16.692 20.988 1.00 0.00 N ATOM 704 CA SER A 47 -36.400 -16.078 22.161 1.00 0.00 C ATOM 705 C SER A 47 -35.361 -15.692 23.223 1.00 0.00 C ATOM 706 O SER A 47 -35.700 -15.505 24.382 1.00 0.00 O ATOM 707 CB SER A 47 -37.423 -17.036 22.763 1.00 0.00 C ATOM 708 OG SER A 47 -38.430 -17.371 21.816 1.00 0.00 O ATOM 0 H SER A 47 -35.719 -17.708 21.041 1.00 0.00 H new ATOM 0 HA SER A 47 -36.889 -15.159 21.837 1.00 0.00 H new ATOM 0 HB2 SER A 47 -36.922 -17.943 23.101 1.00 0.00 H new ATOM 0 HB3 SER A 47 -37.882 -16.579 23.640 1.00 0.00 H new ATOM 0 HG SER A 47 -39.072 -17.987 22.226 1.00 0.00 H new ATOM 714 N LYS A 48 -34.109 -15.531 22.805 1.00 0.00 N ATOM 715 CA LYS A 48 -33.008 -15.191 23.725 1.00 0.00 C ATOM 716 C LYS A 48 -33.260 -13.863 24.446 1.00 0.00 C ATOM 717 O LYS A 48 -32.616 -13.552 25.450 1.00 0.00 O ATOM 718 CB LYS A 48 -31.706 -15.072 22.953 1.00 0.00 C ATOM 719 CG LYS A 48 -30.471 -15.223 23.818 1.00 0.00 C ATOM 720 CD LYS A 48 -29.201 -15.110 23.002 1.00 0.00 C ATOM 721 CE LYS A 48 -29.103 -16.194 21.949 1.00 0.00 C ATOM 722 NZ LYS A 48 -27.929 -15.994 21.066 1.00 0.00 N ATOM 0 H LYS A 48 -33.822 -15.629 21.831 1.00 0.00 H new ATOM 0 HA LYS A 48 -32.948 -15.990 24.464 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -31.686 -15.831 22.171 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -31.675 -14.102 22.457 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -30.474 -14.458 24.594 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -30.495 -16.189 24.322 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -29.166 -14.133 22.520 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -28.338 -15.170 23.665 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -29.032 -17.168 22.434 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -30.013 -16.202 21.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -27.515 -16.917 20.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -28.228 -15.509 20.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -27.219 -15.415 21.558 1.00 0.00 H new ATOM 736 N ASP A 49 -34.195 -13.102 23.929 1.00 0.00 N ATOM 737 CA ASP A 49 -34.508 -11.784 24.446 1.00 0.00 C ATOM 738 C ASP A 49 -35.006 -11.849 25.886 1.00 0.00 C ATOM 739 O ASP A 49 -34.715 -10.962 26.689 1.00 0.00 O ATOM 740 CB ASP A 49 -35.561 -11.112 23.556 1.00 0.00 C ATOM 741 CG ASP A 49 -35.918 -9.713 24.011 1.00 0.00 C ATOM 742 OD1 ASP A 49 -35.244 -8.756 23.583 1.00 0.00 O ATOM 743 OD2 ASP A 49 -36.883 -9.562 24.787 1.00 0.00 O ATOM 0 H ASP A 49 -34.767 -13.379 23.131 1.00 0.00 H new ATOM 0 HA ASP A 49 -33.592 -11.194 24.438 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -35.190 -11.071 22.532 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -36.462 -11.725 23.544 1.00 0.00 H new ATOM 748 N ASP A 50 -35.748 -12.902 26.213 1.00 0.00 N ATOM 749 CA ASP A 50 -36.328 -13.023 27.544 1.00 0.00 C ATOM 750 C ASP A 50 -35.597 -14.031 28.441 1.00 0.00 C ATOM 751 O ASP A 50 -36.127 -14.434 29.464 1.00 0.00 O ATOM 752 CB ASP A 50 -37.844 -13.328 27.475 1.00 0.00 C ATOM 753 CG ASP A 50 -38.193 -14.743 27.041 1.00 0.00 C ATOM 754 OD1 ASP A 50 -38.211 -15.002 25.818 1.00 0.00 O ATOM 755 OD2 ASP A 50 -38.515 -15.577 27.910 1.00 0.00 O ATOM 0 H ASP A 50 -35.960 -13.675 25.582 1.00 0.00 H new ATOM 0 HA ASP A 50 -36.195 -12.049 28.016 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -38.281 -13.146 28.457 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -38.310 -12.626 26.783 1.00 0.00 H new ATOM 760 N PHE A 51 -34.368 -14.408 28.091 1.00 0.00 N ATOM 761 CA PHE A 51 -33.627 -15.374 28.920 1.00 0.00 C ATOM 762 C PHE A 51 -32.244 -14.872 29.330 1.00 0.00 C ATOM 763 O PHE A 51 -31.613 -14.092 28.622 1.00 0.00 O ATOM 764 CB PHE A 51 -33.452 -16.703 28.203 1.00 0.00 C ATOM 765 CG PHE A 51 -34.720 -17.437 27.914 1.00 0.00 C ATOM 766 CD1 PHE A 51 -35.359 -18.157 28.905 1.00 0.00 C ATOM 767 CD2 PHE A 51 -35.268 -17.413 26.650 1.00 0.00 C ATOM 768 CE1 PHE A 51 -36.524 -18.838 28.640 1.00 0.00 C ATOM 769 CE2 PHE A 51 -36.434 -18.095 26.375 1.00 0.00 C ATOM 770 CZ PHE A 51 -37.063 -18.810 27.372 1.00 0.00 C ATOM 0 H PHE A 51 -33.871 -14.075 27.265 1.00 0.00 H new ATOM 0 HA PHE A 51 -34.233 -15.503 29.817 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -32.931 -16.525 27.262 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -32.809 -17.343 28.808 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -34.939 -18.185 29.899 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -34.779 -16.854 25.866 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -37.016 -19.394 29.424 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -36.854 -18.069 25.380 1.00 0.00 H new ATOM 0 HZ PHE A 51 -37.976 -19.347 27.160 1.00 0.00 H new ATOM 780 N ILE A 52 -31.799 -15.341 30.494 1.00 0.00 N ATOM 781 CA ILE A 52 -30.459 -15.078 31.014 1.00 0.00 C ATOM 782 C ILE A 52 -29.922 -16.366 31.647 1.00 0.00 C ATOM 783 O ILE A 52 -30.641 -17.372 31.718 1.00 0.00 O ATOM 784 CB ILE A 52 -30.424 -13.935 32.075 1.00 0.00 C ATOM 785 CG1 ILE A 52 -31.276 -14.307 33.298 1.00 0.00 C ATOM 786 CG2 ILE A 52 -30.900 -12.621 31.463 1.00 0.00 C ATOM 787 CD1 ILE A 52 -31.158 -13.331 34.448 1.00 0.00 C ATOM 0 H ILE A 52 -32.367 -15.922 31.111 1.00 0.00 H new ATOM 0 HA ILE A 52 -29.842 -14.751 30.177 1.00 0.00 H new ATOM 0 HB ILE A 52 -29.394 -13.803 32.406 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -32.321 -14.371 32.995 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -30.983 -15.298 33.644 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -30.869 -11.836 32.218 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -30.250 -12.351 30.631 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -31.922 -12.737 31.102 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -31.789 -13.663 35.273 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -30.121 -13.284 34.780 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -31.479 -12.342 34.120 1.00 0.00 H new ATOM 799 N LEU A 53 -28.688 -16.343 32.107 1.00 0.00 N ATOM 800 CA LEU A 53 -28.088 -17.521 32.714 1.00 0.00 C ATOM 801 C LEU A 53 -28.097 -17.406 34.223 1.00 0.00 C ATOM 802 O LEU A 53 -27.854 -16.347 34.762 1.00 0.00 O ATOM 803 CB LEU A 53 -26.652 -17.702 32.231 1.00 0.00 C ATOM 804 CG LEU A 53 -26.479 -18.003 30.747 1.00 0.00 C ATOM 805 CD1 LEU A 53 -25.008 -18.004 30.383 1.00 0.00 C ATOM 806 CD2 LEU A 53 -27.111 -19.345 30.403 1.00 0.00 C ATOM 0 H LEU A 53 -28.079 -15.525 32.074 1.00 0.00 H new ATOM 0 HA LEU A 53 -28.678 -18.388 32.417 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -26.094 -16.795 32.465 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -26.197 -18.512 32.801 1.00 0.00 H new ATOM 0 HG LEU A 53 -26.981 -17.226 30.171 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -24.896 -18.220 29.321 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -24.578 -17.026 30.602 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -24.490 -18.766 30.965 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -26.980 -19.547 29.340 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -26.631 -20.133 30.984 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -28.175 -19.317 30.639 1.00 0.00 H new ATOM 818 N VAL A 54 -28.404 -18.489 34.897 1.00 0.00 N ATOM 819 CA VAL A 54 -28.377 -18.500 36.348 1.00 0.00 C ATOM 820 C VAL A 54 -27.462 -19.605 36.854 1.00 0.00 C ATOM 821 O VAL A 54 -27.589 -20.767 36.462 1.00 0.00 O ATOM 822 CB VAL A 54 -29.791 -18.653 36.970 1.00 0.00 C ATOM 823 CG1 VAL A 54 -30.646 -17.429 36.669 1.00 0.00 C ATOM 824 CG2 VAL A 54 -30.472 -19.917 36.468 1.00 0.00 C ATOM 0 H VAL A 54 -28.675 -19.374 34.469 1.00 0.00 H new ATOM 0 HA VAL A 54 -27.988 -17.532 36.664 1.00 0.00 H new ATOM 0 HB VAL A 54 -29.677 -18.736 38.051 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -31.633 -17.556 37.114 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -30.171 -16.542 37.088 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -30.747 -17.312 35.590 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -31.461 -20.001 36.919 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -30.570 -19.871 35.383 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -29.874 -20.786 36.742 1.00 0.00 H new ATOM 834 N GLU A 55 -26.531 -19.238 37.702 1.00 0.00 N ATOM 835 CA GLU A 55 -25.582 -20.192 38.248 1.00 0.00 C ATOM 836 C GLU A 55 -26.151 -20.789 39.521 1.00 0.00 C ATOM 837 O GLU A 55 -26.535 -20.056 40.427 1.00 0.00 O ATOM 838 CB GLU A 55 -24.273 -19.491 38.555 1.00 0.00 C ATOM 839 CG GLU A 55 -23.128 -20.415 38.866 1.00 0.00 C ATOM 840 CD GLU A 55 -22.052 -19.706 39.664 1.00 0.00 C ATOM 841 OE1 GLU A 55 -22.230 -19.543 40.884 1.00 0.00 O ATOM 842 OE2 GLU A 55 -21.050 -19.264 39.067 1.00 0.00 O ATOM 0 H GLU A 55 -26.406 -18.281 38.033 1.00 0.00 H new ATOM 0 HA GLU A 55 -25.402 -20.984 37.521 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -24.000 -18.869 37.702 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -24.424 -18.822 39.402 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -23.493 -21.275 39.427 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -22.703 -20.797 37.938 1.00 0.00 H new ATOM 849 N VAL A 56 -26.213 -22.101 39.591 1.00 0.00 N ATOM 850 CA VAL A 56 -26.796 -22.760 40.746 1.00 0.00 C ATOM 851 C VAL A 56 -25.851 -23.778 41.337 1.00 0.00 C ATOM 852 O VAL A 56 -25.168 -24.511 40.606 1.00 0.00 O ATOM 853 CB VAL A 56 -28.131 -23.463 40.401 1.00 0.00 C ATOM 854 CG1 VAL A 56 -28.708 -24.171 41.629 1.00 0.00 C ATOM 855 CG2 VAL A 56 -29.127 -22.469 39.840 1.00 0.00 C ATOM 0 H VAL A 56 -25.870 -22.732 38.867 1.00 0.00 H new ATOM 0 HA VAL A 56 -26.988 -21.974 41.476 1.00 0.00 H new ATOM 0 HB VAL A 56 -27.931 -24.216 39.639 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -29.646 -24.657 41.361 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -27.999 -24.919 41.984 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -28.890 -23.441 42.418 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -30.059 -22.982 39.604 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -29.319 -21.690 40.578 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -28.721 -22.019 38.934 1.00 0.00 H new ATOM 1112 N GLY A 73 -30.713 -19.557 41.510 1.00 0.00 N ATOM 1113 CA GLY A 73 -29.423 -19.322 40.927 1.00 0.00 C ATOM 1114 C GLY A 73 -29.032 -17.866 40.946 1.00 0.00 C ATOM 1115 O GLY A 73 -29.827 -17.004 41.323 1.00 0.00 O ATOM 0 HA2 GLY A 73 -28.674 -19.902 41.466 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -29.423 -19.680 39.898 1.00 0.00 H new ATOM 1119 N ARG A 74 -27.809 -17.589 40.554 1.00 0.00 N ATOM 1120 CA ARG A 74 -27.331 -16.232 40.485 1.00 0.00 C ATOM 1121 C ARG A 74 -27.653 -15.665 39.115 1.00 0.00 C ATOM 1122 O ARG A 74 -27.181 -16.192 38.112 1.00 0.00 O ATOM 1123 CB ARG A 74 -25.817 -16.182 40.741 1.00 0.00 C ATOM 1124 CG ARG A 74 -25.398 -16.819 42.059 1.00 0.00 C ATOM 1125 CD ARG A 74 -23.972 -16.442 42.444 1.00 0.00 C ATOM 1126 NE ARG A 74 -22.957 -16.971 41.520 1.00 0.00 N ATOM 1127 CZ ARG A 74 -21.939 -16.253 41.032 1.00 0.00 C ATOM 1128 NH1 ARG A 74 -21.839 -14.957 41.317 1.00 0.00 N ATOM 1129 NH2 ARG A 74 -21.025 -16.825 40.254 1.00 0.00 N ATOM 0 H ARG A 74 -27.125 -18.293 40.277 1.00 0.00 H new ATOM 0 HA ARG A 74 -27.823 -15.635 41.252 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -25.302 -16.687 39.924 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -25.490 -15.142 40.730 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -26.082 -16.505 42.848 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -25.478 -17.903 41.980 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -23.889 -15.356 42.480 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -23.765 -16.811 43.449 1.00 0.00 H new ATOM 0 HE ARG A 74 -23.034 -17.947 41.233 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -22.539 -14.509 41.908 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -21.062 -14.411 40.944 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -21.098 -17.817 40.026 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -20.251 -16.272 39.885 1.00 0.00 H new ATOM 1143 N PRO A 75 -28.490 -14.609 39.046 1.00 0.00 N ATOM 1144 CA PRO A 75 -28.858 -13.989 37.771 1.00 0.00 C ATOM 1145 C PRO A 75 -27.646 -13.398 37.066 1.00 0.00 C ATOM 1146 O PRO A 75 -27.026 -12.445 37.546 1.00 0.00 O ATOM 1147 CB PRO A 75 -29.850 -12.881 38.166 1.00 0.00 C ATOM 1148 CG PRO A 75 -30.290 -13.230 39.550 1.00 0.00 C ATOM 1149 CD PRO A 75 -29.140 -13.952 40.186 1.00 0.00 C ATOM 0 HA PRO A 75 -29.282 -14.710 37.072 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -29.377 -11.900 38.138 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -30.696 -12.846 37.480 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -30.547 -12.333 40.114 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -31.180 -13.859 39.528 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -28.464 -13.265 40.695 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -29.478 -14.674 40.929 1.00 0.00 H new ATOM 1157 N ILE A 76 -27.314 -13.975 35.937 1.00 0.00 N ATOM 1158 CA ILE A 76 -26.171 -13.569 35.161 1.00 0.00 C ATOM 1159 C ILE A 76 -26.600 -13.136 33.762 1.00 0.00 C ATOM 1160 O ILE A 76 -27.100 -13.948 32.975 1.00 0.00 O ATOM 1161 CB ILE A 76 -25.160 -14.735 35.051 1.00 0.00 C ATOM 1162 CG1 ILE A 76 -24.764 -15.215 36.449 1.00 0.00 C ATOM 1163 CG2 ILE A 76 -23.930 -14.307 34.264 1.00 0.00 C ATOM 1164 CD1 ILE A 76 -24.167 -16.602 36.476 1.00 0.00 C ATOM 0 H ILE A 76 -27.837 -14.749 35.527 1.00 0.00 H new ATOM 0 HA ILE A 76 -25.698 -12.726 35.665 1.00 0.00 H new ATOM 0 HB ILE A 76 -25.633 -15.559 34.517 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -24.046 -14.513 36.873 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -25.645 -15.197 37.091 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -23.232 -15.141 34.198 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -24.228 -14.003 33.260 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -23.448 -13.470 34.769 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -23.913 -16.869 37.502 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -24.890 -17.317 36.084 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -23.267 -16.623 35.862 1.00 0.00 H new ATOM 1176 N PRO A 77 -26.439 -11.849 33.444 1.00 0.00 N ATOM 1177 CA PRO A 77 -26.771 -11.318 32.124 1.00 0.00 C ATOM 1178 C PRO A 77 -25.798 -11.821 31.059 1.00 0.00 C ATOM 1179 O PRO A 77 -24.677 -12.230 31.374 1.00 0.00 O ATOM 1180 CB PRO A 77 -26.607 -9.808 32.297 1.00 0.00 C ATOM 1181 CG PRO A 77 -25.647 -9.667 33.416 1.00 0.00 C ATOM 1182 CD PRO A 77 -25.931 -10.804 34.347 1.00 0.00 C ATOM 0 HA PRO A 77 -27.766 -11.620 31.797 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -26.228 -9.343 31.387 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -27.559 -9.329 32.527 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -24.619 -9.705 33.056 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -25.773 -8.709 33.920 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -25.034 -11.127 34.875 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -26.666 -10.532 35.104 1.00 0.00 H new ATOM 1190 N PRO A 78 -26.208 -11.782 29.783 1.00 0.00 N ATOM 1191 CA PRO A 78 -25.367 -12.224 28.664 1.00 0.00 C ATOM 1192 C PRO A 78 -24.047 -11.443 28.594 1.00 0.00 C ATOM 1193 O PRO A 78 -23.024 -11.956 28.149 1.00 0.00 O ATOM 1194 CB PRO A 78 -26.215 -11.920 27.432 1.00 0.00 C ATOM 1195 CG PRO A 78 -27.613 -11.828 27.924 1.00 0.00 C ATOM 1196 CD PRO A 78 -27.528 -11.313 29.326 1.00 0.00 C ATOM 0 HA PRO A 78 -25.087 -13.273 28.758 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -25.903 -10.988 26.961 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -26.114 -12.705 26.683 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -28.203 -11.158 27.298 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -28.101 -12.802 27.896 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -27.602 -10.226 29.360 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -28.332 -11.707 29.948 1.00 0.00 H new ATOM 1204 N THR A 79 -24.086 -10.211 29.053 1.00 0.00 N ATOM 1205 CA THR A 79 -22.922 -9.336 29.009 1.00 0.00 C ATOM 1206 C THR A 79 -21.890 -9.673 30.124 1.00 0.00 C ATOM 1207 O THR A 79 -20.838 -9.038 30.224 1.00 0.00 O ATOM 1208 CB THR A 79 -23.365 -7.863 29.121 1.00 0.00 C ATOM 1209 OG1 THR A 79 -24.569 -7.675 28.359 1.00 0.00 O ATOM 1210 CG2 THR A 79 -22.289 -6.930 28.580 1.00 0.00 C ATOM 0 H THR A 79 -24.916 -9.785 29.465 1.00 0.00 H new ATOM 0 HA THR A 79 -22.427 -9.497 28.051 1.00 0.00 H new ATOM 0 HB THR A 79 -23.536 -7.631 30.172 1.00 0.00 H new ATOM 0 HG1 THR A 79 -24.857 -6.741 28.427 1.00 0.00 H new ATOM 0 HG21 THR A 79 -22.625 -5.897 28.670 1.00 0.00 H new ATOM 0 HG22 THR A 79 -21.370 -7.064 29.151 1.00 0.00 H new ATOM 0 HG23 THR A 79 -22.101 -7.161 27.531 1.00 0.00 H new ATOM 1218 N GLU A 80 -22.203 -10.655 30.960 1.00 0.00 N ATOM 1219 CA GLU A 80 -21.298 -11.057 32.041 1.00 0.00 C ATOM 1220 C GLU A 80 -20.491 -12.308 31.634 1.00 0.00 C ATOM 1221 O GLU A 80 -20.887 -13.046 30.736 1.00 0.00 O ATOM 1222 CB GLU A 80 -22.108 -11.353 33.317 1.00 0.00 C ATOM 1223 CG GLU A 80 -21.493 -10.828 34.618 1.00 0.00 C ATOM 1224 CD GLU A 80 -20.173 -11.473 34.967 1.00 0.00 C ATOM 1225 OE1 GLU A 80 -19.125 -10.989 34.493 1.00 0.00 O ATOM 1226 OE2 GLU A 80 -20.177 -12.468 35.715 1.00 0.00 O ATOM 0 H GLU A 80 -23.071 -11.188 30.915 1.00 0.00 H new ATOM 0 HA GLU A 80 -20.603 -10.240 32.234 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -23.103 -10.922 33.205 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -22.236 -12.432 33.404 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -21.350 -9.751 34.534 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -22.196 -10.993 35.435 1.00 0.00 H new ATOM 1233 N CYS A 81 -19.362 -12.516 32.293 1.00 0.00 N ATOM 1234 CA CYS A 81 -18.536 -13.701 32.088 1.00 0.00 C ATOM 1235 C CYS A 81 -18.378 -14.434 33.421 1.00 0.00 C ATOM 1236 O CYS A 81 -17.399 -14.227 34.147 1.00 0.00 O ATOM 1237 CB CYS A 81 -17.161 -13.329 31.520 1.00 0.00 C ATOM 1238 SG CYS A 81 -17.203 -12.637 29.852 1.00 0.00 S ATOM 0 H CYS A 81 -18.990 -11.868 32.987 1.00 0.00 H new ATOM 0 HA CYS A 81 -19.026 -14.351 31.363 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -16.689 -12.608 32.187 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -16.531 -14.218 31.515 1.00 0.00 H new ATOM 0 HG CYS A 81 -15.993 -12.356 29.468 1.00 0.00 H new ATOM 1244 N PRO A 82 -19.351 -15.297 33.757 1.00 0.00 N ATOM 1245 CA PRO A 82 -19.409 -15.976 35.065 1.00 0.00 C ATOM 1246 C PRO A 82 -18.318 -17.027 35.273 1.00 0.00 C ATOM 1247 O PRO A 82 -18.037 -17.426 36.405 1.00 0.00 O ATOM 1248 CB PRO A 82 -20.786 -16.639 35.059 1.00 0.00 C ATOM 1249 CG PRO A 82 -21.118 -16.833 33.618 1.00 0.00 C ATOM 1250 CD PRO A 82 -20.468 -15.697 32.876 1.00 0.00 C ATOM 0 HA PRO A 82 -19.250 -15.266 35.876 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -20.768 -17.590 35.591 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -21.528 -16.012 35.553 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -20.747 -17.793 33.260 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -22.197 -16.830 33.464 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -20.112 -16.011 31.895 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -21.164 -14.874 32.714 1.00 0.00 H new ATOM 1258 N LEU A 83 -17.693 -17.457 34.189 1.00 0.00 N ATOM 1259 CA LEU A 83 -16.688 -18.512 34.257 1.00 0.00 C ATOM 1260 C LEU A 83 -15.481 -18.101 35.082 1.00 0.00 C ATOM 1261 O LEU A 83 -14.812 -18.954 35.673 1.00 0.00 O ATOM 1262 CB LEU A 83 -16.259 -18.955 32.863 1.00 0.00 C ATOM 1263 CG LEU A 83 -17.373 -19.513 31.994 1.00 0.00 C ATOM 1264 CD1 LEU A 83 -16.828 -20.073 30.703 1.00 0.00 C ATOM 1265 CD2 LEU A 83 -18.180 -20.561 32.733 1.00 0.00 C ATOM 0 H LEU A 83 -17.862 -17.094 33.251 1.00 0.00 H new ATOM 0 HA LEU A 83 -17.154 -19.359 34.760 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -15.810 -18.104 32.350 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -15.482 -19.713 32.962 1.00 0.00 H new ATOM 0 HG LEU A 83 -18.041 -18.686 31.751 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -17.648 -20.465 30.102 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -16.318 -19.284 30.151 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -16.124 -20.875 30.923 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -18.968 -20.939 32.082 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -17.527 -21.383 33.027 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -18.626 -20.116 33.623 1.00 0.00 H new ATOM 1277 N PHE A 84 -15.194 -16.804 35.120 1.00 0.00 N ATOM 1278 CA PHE A 84 -14.075 -16.302 35.899 1.00 0.00 C ATOM 1279 C PHE A 84 -14.227 -16.644 37.377 1.00 0.00 C ATOM 1280 O PHE A 84 -13.299 -17.170 37.991 1.00 0.00 O ATOM 1281 CB PHE A 84 -13.905 -14.794 35.703 1.00 0.00 C ATOM 1282 CG PHE A 84 -13.073 -14.431 34.506 1.00 0.00 C ATOM 1283 CD1 PHE A 84 -13.612 -14.446 33.239 1.00 0.00 C ATOM 1284 CD2 PHE A 84 -11.745 -14.065 34.660 1.00 0.00 C ATOM 1285 CE1 PHE A 84 -12.847 -14.106 32.139 1.00 0.00 C ATOM 1286 CE2 PHE A 84 -10.973 -13.726 33.567 1.00 0.00 C ATOM 1287 CZ PHE A 84 -11.526 -13.746 32.303 1.00 0.00 C ATOM 0 H PHE A 84 -15.720 -16.086 34.622 1.00 0.00 H new ATOM 0 HA PHE A 84 -13.173 -16.796 35.536 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -14.889 -14.336 35.603 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -13.446 -14.370 36.596 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -14.646 -14.727 33.103 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -11.309 -14.045 35.648 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -13.284 -14.122 31.151 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -9.939 -13.446 33.701 1.00 0.00 H new ATOM 0 HZ PHE A 84 -10.926 -13.481 31.445 1.00 0.00 H new ATOM 1297 N GLU A 85 -15.403 -16.383 37.940 1.00 0.00 N ATOM 1298 CA GLU A 85 -15.645 -16.718 39.337 1.00 0.00 C ATOM 1299 C GLU A 85 -15.709 -18.222 39.533 1.00 0.00 C ATOM 1300 O GLU A 85 -15.204 -18.748 40.527 1.00 0.00 O ATOM 1301 CB GLU A 85 -16.921 -16.076 39.868 1.00 0.00 C ATOM 1302 CG GLU A 85 -16.863 -14.567 40.001 1.00 0.00 C ATOM 1303 CD GLU A 85 -18.130 -14.002 40.610 1.00 0.00 C ATOM 1304 OE1 GLU A 85 -18.978 -14.798 41.088 1.00 0.00 O ATOM 1305 OE2 GLU A 85 -18.283 -12.760 40.636 1.00 0.00 O ATOM 0 H GLU A 85 -16.190 -15.948 37.459 1.00 0.00 H new ATOM 0 HA GLU A 85 -14.805 -16.318 39.904 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -17.746 -16.337 39.205 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -17.148 -16.505 40.844 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -16.009 -14.290 40.619 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.703 -14.122 39.019 1.00 0.00 H new ATOM 1312 N MET A 86 -16.324 -18.915 38.577 1.00 0.00 N ATOM 1313 CA MET A 86 -16.457 -20.362 38.645 1.00 0.00 C ATOM 1314 C MET A 86 -15.103 -21.035 38.727 1.00 0.00 C ATOM 1315 O MET A 86 -14.804 -21.736 39.686 1.00 0.00 O ATOM 1316 CB MET A 86 -17.161 -20.904 37.410 1.00 0.00 C ATOM 1317 CG MET A 86 -18.650 -20.693 37.356 1.00 0.00 C ATOM 1318 SD MET A 86 -19.338 -21.428 35.859 1.00 0.00 S ATOM 1319 CE MET A 86 -21.081 -21.360 36.201 1.00 0.00 C ATOM 0 H MET A 86 -16.738 -18.493 37.746 1.00 0.00 H new ATOM 0 HA MET A 86 -17.039 -20.578 39.541 1.00 0.00 H new ATOM 0 HB2 MET A 86 -16.716 -20.441 36.529 1.00 0.00 H new ATOM 0 HB3 MET A 86 -16.962 -21.974 37.343 1.00 0.00 H new ATOM 0 HG2 MET A 86 -19.118 -21.137 38.235 1.00 0.00 H new ATOM 0 HG3 MET A 86 -18.873 -19.626 37.380 1.00 0.00 H new ATOM 0 HE1 MET A 86 -21.636 -21.715 35.333 1.00 0.00 H new ATOM 0 HE2 MET A 86 -21.308 -21.991 37.060 1.00 0.00 H new ATOM 0 HE3 MET A 86 -21.369 -20.332 36.420 1.00 0.00 H new ATOM 1329 N THR A 87 -14.284 -20.800 37.725 1.00 0.00 N ATOM 1330 CA THR A 87 -12.992 -21.443 37.615 1.00 0.00 C ATOM 1331 C THR A 87 -12.068 -21.067 38.775 1.00 0.00 C ATOM 1332 O THR A 87 -11.327 -21.905 39.283 1.00 0.00 O ATOM 1333 CB THR A 87 -12.334 -21.135 36.263 1.00 0.00 C ATOM 1334 OG1 THR A 87 -13.314 -21.299 35.225 1.00 0.00 O ATOM 1335 CG2 THR A 87 -11.181 -22.094 35.998 1.00 0.00 C ATOM 0 H THR A 87 -14.495 -20.157 36.962 1.00 0.00 H new ATOM 0 HA THR A 87 -13.161 -22.518 37.671 1.00 0.00 H new ATOM 0 HB THR A 87 -11.952 -20.114 36.280 1.00 0.00 H new ATOM 0 HG1 THR A 87 -13.858 -20.487 35.157 1.00 0.00 H new ATOM 0 HG21 THR A 87 -10.727 -21.860 35.035 1.00 0.00 H new ATOM 0 HG22 THR A 87 -10.434 -21.992 36.786 1.00 0.00 H new ATOM 0 HG23 THR A 87 -11.555 -23.118 35.984 1.00 0.00 H new ATOM 1495 N PHE A 100 -23.359 -25.828 38.326 1.00 0.00 N ATOM 1496 CA PHE A 100 -23.895 -25.898 36.996 1.00 0.00 C ATOM 1497 C PHE A 100 -24.540 -24.578 36.633 1.00 0.00 C ATOM 1498 O PHE A 100 -24.929 -23.794 37.511 1.00 0.00 O ATOM 1499 CB PHE A 100 -24.902 -27.041 36.831 1.00 0.00 C ATOM 1500 CG PHE A 100 -26.131 -26.918 37.683 1.00 0.00 C ATOM 1501 CD1 PHE A 100 -27.152 -26.055 37.320 1.00 0.00 C ATOM 1502 CD2 PHE A 100 -26.284 -27.692 38.821 1.00 0.00 C ATOM 1503 CE1 PHE A 100 -28.298 -25.961 38.076 1.00 0.00 C ATOM 1504 CE2 PHE A 100 -27.429 -27.599 39.585 1.00 0.00 C ATOM 1505 CZ PHE A 100 -28.438 -26.734 39.212 1.00 0.00 C ATOM 0 HA PHE A 100 -23.065 -26.103 36.320 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -25.205 -27.093 35.785 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -24.405 -27.982 37.066 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -27.047 -25.448 36.433 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -25.500 -28.375 39.113 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -29.086 -25.284 37.782 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -27.536 -28.203 40.474 1.00 0.00 H new ATOM 0 HZ PHE A 100 -29.336 -26.662 39.808 1.00 0.00 H new ATOM 1515 N LEU A 101 -24.666 -24.335 35.360 1.00 0.00 N ATOM 1516 CA LEU A 101 -25.240 -23.112 34.888 1.00 0.00 C ATOM 1517 C LEU A 101 -26.542 -23.406 34.155 1.00 0.00 C ATOM 1518 O LEU A 101 -26.581 -24.238 33.252 1.00 0.00 O ATOM 1519 CB LEU A 101 -24.224 -22.410 34.001 1.00 0.00 C ATOM 1520 CG LEU A 101 -24.537 -20.985 33.579 1.00 0.00 C ATOM 1521 CD1 LEU A 101 -24.923 -20.149 34.780 1.00 0.00 C ATOM 1522 CD2 LEU A 101 -23.316 -20.393 32.950 1.00 0.00 C ATOM 0 H LEU A 101 -24.374 -24.978 34.624 1.00 0.00 H new ATOM 0 HA LEU A 101 -25.482 -22.449 35.719 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -23.267 -22.405 34.522 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -24.093 -23.008 33.099 1.00 0.00 H new ATOM 0 HG LEU A 101 -25.368 -20.996 32.874 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -25.144 -19.131 34.459 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -25.805 -20.579 35.254 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -24.099 -20.134 35.493 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -23.526 -19.369 32.642 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -22.498 -20.395 33.671 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -23.033 -20.984 32.079 1.00 0.00 H new ATOM 1534 N ALA A 102 -27.602 -22.741 34.561 1.00 0.00 N ATOM 1535 CA ALA A 102 -28.920 -22.998 34.011 1.00 0.00 C ATOM 1536 C ALA A 102 -29.471 -21.797 33.263 1.00 0.00 C ATOM 1537 O ALA A 102 -28.945 -20.690 33.369 1.00 0.00 O ATOM 1538 CB ALA A 102 -29.869 -23.403 35.122 1.00 0.00 C ATOM 0 H ALA A 102 -27.578 -22.013 35.275 1.00 0.00 H new ATOM 0 HA ALA A 102 -28.827 -23.812 33.292 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -30.857 -23.595 34.704 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -29.498 -24.306 35.606 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -29.935 -22.599 35.855 1.00 0.00 H new ATOM 1544 N ILE A 103 -30.533 -22.025 32.504 1.00 0.00 N ATOM 1545 CA ILE A 103 -31.174 -20.970 31.738 1.00 0.00 C ATOM 1546 C ILE A 103 -32.543 -20.640 32.327 1.00 0.00 C ATOM 1547 O ILE A 103 -33.376 -21.530 32.531 1.00 0.00 O ATOM 1548 CB ILE A 103 -31.366 -21.383 30.256 1.00 0.00 C ATOM 1549 CG1 ILE A 103 -30.020 -21.723 29.618 1.00 0.00 C ATOM 1550 CG2 ILE A 103 -32.060 -20.269 29.473 1.00 0.00 C ATOM 1551 CD1 ILE A 103 -30.141 -22.305 28.228 1.00 0.00 C ATOM 0 H ILE A 103 -30.971 -22.941 32.403 1.00 0.00 H new ATOM 0 HA ILE A 103 -30.523 -20.097 31.786 1.00 0.00 H new ATOM 0 HB ILE A 103 -31.998 -22.270 30.226 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -29.410 -20.821 29.574 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -29.494 -22.433 30.256 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -32.186 -20.578 28.435 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -33.037 -20.069 29.913 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -31.453 -19.365 29.511 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -29.147 -22.522 27.837 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -30.724 -23.225 28.268 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -30.639 -21.588 27.575 1.00 0.00 H new ATOM 1563 N LYS A 104 -32.763 -19.370 32.603 1.00 0.00 N ATOM 1564 CA LYS A 104 -34.026 -18.900 33.105 1.00 0.00 C ATOM 1565 C LYS A 104 -34.445 -17.655 32.391 1.00 0.00 C ATOM 1566 O LYS A 104 -33.652 -17.038 31.684 1.00 0.00 O ATOM 1567 CB LYS A 104 -33.968 -18.596 34.566 1.00 0.00 C ATOM 1568 CG LYS A 104 -34.040 -19.806 35.458 1.00 0.00 C ATOM 1569 CD LYS A 104 -33.960 -19.385 36.891 1.00 0.00 C ATOM 1570 CE LYS A 104 -35.200 -18.607 37.317 1.00 0.00 C ATOM 1571 NZ LYS A 104 -35.151 -18.223 38.745 1.00 0.00 N ATOM 0 H LYS A 104 -32.064 -18.637 32.483 1.00 0.00 H new ATOM 0 HA LYS A 104 -34.745 -19.701 32.934 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -33.043 -18.060 34.776 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -34.789 -17.925 34.818 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -34.970 -20.346 35.279 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -33.224 -20.490 35.224 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -33.847 -20.265 37.524 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -33.074 -18.769 37.041 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -35.294 -17.711 36.704 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -36.088 -19.212 37.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -36.013 -17.696 38.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -35.087 -19.079 39.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -34.318 -17.624 38.915 1.00 0.00 H new ATOM 1585 N ARG A 105 -35.681 -17.284 32.579 1.00 0.00 N ATOM 1586 CA ARG A 105 -36.195 -16.068 32.005 1.00 0.00 C ATOM 1587 C ARG A 105 -35.640 -14.875 32.759 1.00 0.00 C ATOM 1588 O ARG A 105 -35.453 -14.936 33.978 1.00 0.00 O ATOM 1589 CB ARG A 105 -37.716 -16.038 32.079 1.00 0.00 C ATOM 1590 CG ARG A 105 -38.417 -17.047 31.194 1.00 0.00 C ATOM 1591 CD ARG A 105 -39.913 -16.965 31.393 1.00 0.00 C ATOM 1592 NE ARG A 105 -40.647 -17.905 30.559 1.00 0.00 N ATOM 1593 CZ ARG A 105 -41.921 -18.240 30.762 1.00 0.00 C ATOM 1594 NH1 ARG A 105 -42.597 -17.711 31.781 1.00 0.00 N ATOM 1595 NH2 ARG A 105 -42.518 -19.092 29.945 1.00 0.00 N ATOM 0 H ARG A 105 -36.358 -17.811 33.131 1.00 0.00 H new ATOM 0 HA ARG A 105 -35.890 -16.026 30.959 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -38.019 -16.210 33.112 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -38.059 -15.039 31.809 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -38.171 -16.858 30.149 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -38.066 -18.052 31.428 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -40.146 -17.157 32.440 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -40.249 -15.952 31.172 1.00 0.00 H new ATOM 0 HE ARG A 105 -40.158 -18.333 29.773 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -42.140 -17.048 32.407 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -43.572 -17.969 31.935 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -42.003 -19.492 29.160 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -43.493 -19.349 30.100 1.00 0.00 H new ATOM 1609 N LYS A 106 -35.355 -13.814 32.036 1.00 0.00 N ATOM 1610 CA LYS A 106 -34.879 -12.579 32.638 1.00 0.00 C ATOM 1611 C LYS A 106 -35.942 -12.017 33.610 1.00 0.00 C ATOM 1612 O LYS A 106 -37.141 -12.241 33.416 1.00 0.00 O ATOM 1613 CB LYS A 106 -34.558 -11.557 31.539 1.00 0.00 C ATOM 1614 CG LYS A 106 -35.780 -11.021 30.804 1.00 0.00 C ATOM 1615 CD LYS A 106 -35.391 -10.225 29.567 1.00 0.00 C ATOM 1616 CE LYS A 106 -34.478 -9.059 29.894 1.00 0.00 C ATOM 1617 NZ LYS A 106 -34.107 -8.302 28.674 1.00 0.00 N ATOM 0 H LYS A 106 -35.444 -13.778 31.021 1.00 0.00 H new ATOM 0 HA LYS A 106 -33.970 -12.782 33.204 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -34.020 -10.720 31.984 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -33.887 -12.019 30.815 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -36.423 -11.852 30.514 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -36.360 -10.388 31.476 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -34.894 -10.884 28.856 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -36.292 -9.852 29.080 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -34.975 -8.393 30.600 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -33.576 -9.427 30.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -33.482 -7.512 28.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -33.612 -8.932 28.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -34.966 -7.930 28.221 1.00 0.00 H new