USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 953 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 101 GLN :FLIP amide:sc= 0.00532 F(o=-0.95,f=-0.057) USER MOD Set 1.2: A 125 CYS SG : rot 118:sc= -0.062 USER MOD Set 2.1: A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 96 LYS NZ :NH3+ -121:sc=-0.00177 (180deg=-1.55!) USER MOD Set 3.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0.317 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= -0.407 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -174:sc= -1.72 (180deg=-1.83) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 TYR OH : rot 117:sc= 0.889 USER MOD Single : A 39 GLN : amide:sc= -0.463 X(o=-0.46,f=-0.46) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0.454 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0.601 K(o=0.6,f=-0.11) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= -0.427 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0618 USER MOD Single : A 73 MET CE :methyl -133:sc= 0 (180deg=-0.534) USER MOD Single : A 79 ASN : amide:sc= -0.589 K(o=-0.59,f=-3.1!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN :FLIP amide:sc= -0.0261 F(o=-0.87,f=-0.026) USER MOD Single : A 97 THR OG1 : rot 91:sc= 1.16 USER MOD Single : A 106 ASN : amide:sc= 0.125 K(o=0.13,f=-0.97) USER MOD Single : A 108 GLN : amide:sc= -0.52 X(o=-0.52,f=-0.078) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 81 N ILE A 6 6.313 -4.039 -11.608 1.00 52.13 N ATOM 82 CA ILE A 6 7.733 -4.311 -11.791 1.00 21.43 C ATOM 83 C ILE A 6 8.549 -3.789 -10.613 1.00 33.11 C ATOM 84 O ILE A 6 9.618 -4.314 -10.304 1.00 33.34 O ATOM 85 CB ILE A 6 8.265 -3.679 -13.090 1.00 44.40 C ATOM 86 CG1 ILE A 6 7.831 -2.215 -13.185 1.00 43.51 C ATOM 87 CG2 ILE A 6 7.776 -4.461 -14.299 1.00 63.44 C ATOM 88 CD1 ILE A 6 8.706 -1.383 -14.097 1.00 74.15 C ATOM 0 HA ILE A 6 7.841 -5.394 -11.853 1.00 21.43 H new ATOM 0 HB ILE A 6 9.354 -3.716 -13.075 1.00 44.40 H new ATOM 0 HG12 ILE A 6 6.802 -2.172 -13.543 1.00 43.51 H new ATOM 0 HG13 ILE A 6 7.840 -1.776 -12.187 1.00 43.51 H new ATOM 0 HG21 ILE A 6 8.161 -4.001 -15.209 1.00 63.44 H new ATOM 0 HG22 ILE A 6 8.130 -5.490 -14.234 1.00 63.44 H new ATOM 0 HG23 ILE A 6 6.686 -4.453 -14.321 1.00 63.44 H new ATOM 0 HD11 ILE A 6 8.339 -0.357 -14.116 1.00 74.15 H new ATOM 0 HD12 ILE A 6 9.732 -1.395 -13.728 1.00 74.15 H new ATOM 0 HD13 ILE A 6 8.678 -1.797 -15.105 1.00 74.15 H new ATOM 100 N ALA A 7 8.035 -2.753 -9.958 1.00 45.31 N ATOM 101 CA ALA A 7 8.714 -2.162 -8.811 1.00 41.55 C ATOM 102 C ALA A 7 9.011 -3.213 -7.747 1.00 50.44 C ATOM 103 O ALA A 7 10.040 -3.157 -7.076 1.00 4.20 O ATOM 104 CB ALA A 7 7.875 -1.036 -8.225 1.00 4.24 C ATOM 0 H ALA A 7 7.151 -2.306 -10.202 1.00 45.31 H new ATOM 0 HA ALA A 7 9.664 -1.752 -9.153 1.00 41.55 H new ATOM 0 HB1 ALA A 7 8.393 -0.603 -7.369 1.00 4.24 H new ATOM 0 HB2 ALA A 7 7.719 -0.267 -8.981 1.00 4.24 H new ATOM 0 HB3 ALA A 7 6.911 -1.430 -7.904 1.00 4.24 H new ATOM 110 N GLY A 8 8.101 -4.171 -7.598 1.00 43.14 N ATOM 111 CA GLY A 8 8.284 -5.221 -6.613 1.00 43.23 C ATOM 112 C GLY A 8 9.289 -6.265 -7.058 1.00 42.33 C ATOM 113 O GLY A 8 9.987 -6.855 -6.233 1.00 72.44 O ATOM 0 H GLY A 8 7.241 -4.239 -8.142 1.00 43.14 H new ATOM 0 HA2 GLY A 8 8.616 -4.779 -5.673 1.00 43.23 H new ATOM 0 HA3 GLY A 8 7.326 -5.703 -6.418 1.00 43.23 H new ATOM 117 N ILE A 9 9.362 -6.494 -8.365 1.00 45.31 N ATOM 118 CA ILE A 9 10.289 -7.474 -8.917 1.00 70.15 C ATOM 119 C ILE A 9 11.717 -6.939 -8.922 1.00 20.41 C ATOM 120 O ILE A 9 12.678 -7.702 -8.804 1.00 55.51 O ATOM 121 CB ILE A 9 9.897 -7.872 -10.353 1.00 25.42 C ATOM 122 CG1 ILE A 9 8.539 -8.576 -10.357 1.00 71.25 C ATOM 123 CG2 ILE A 9 10.966 -8.767 -10.964 1.00 54.43 C ATOM 124 CD1 ILE A 9 7.385 -7.661 -10.704 1.00 65.12 C ATOM 0 H ILE A 9 8.791 -6.015 -9.061 1.00 45.31 H new ATOM 0 HA ILE A 9 10.236 -8.354 -8.276 1.00 70.15 H new ATOM 0 HB ILE A 9 9.818 -6.968 -10.957 1.00 25.42 H new ATOM 0 HG12 ILE A 9 8.567 -9.399 -11.072 1.00 71.25 H new ATOM 0 HG13 ILE A 9 8.363 -9.013 -9.374 1.00 71.25 H new ATOM 0 HG21 ILE A 9 10.676 -9.040 -11.978 1.00 54.43 H new ATOM 0 HG22 ILE A 9 11.916 -8.233 -10.990 1.00 54.43 H new ATOM 0 HG23 ILE A 9 11.073 -9.669 -10.362 1.00 54.43 H new ATOM 0 HD11 ILE A 9 6.454 -8.227 -10.688 1.00 65.12 H new ATOM 0 HD12 ILE A 9 7.330 -6.852 -9.976 1.00 65.12 H new ATOM 0 HD13 ILE A 9 7.538 -7.243 -11.699 1.00 65.12 H new ATOM 136 N LEU A 10 11.850 -5.625 -9.057 1.00 0.53 N ATOM 137 CA LEU A 10 13.162 -4.986 -9.074 1.00 54.04 C ATOM 138 C LEU A 10 13.648 -4.702 -7.657 1.00 21.21 C ATOM 139 O LEU A 10 14.851 -4.663 -7.398 1.00 4.55 O ATOM 140 CB LEU A 10 13.106 -3.685 -9.877 1.00 4.00 C ATOM 141 CG LEU A 10 12.802 -2.416 -9.079 1.00 64.51 C ATOM 142 CD1 LEU A 10 14.084 -1.814 -8.526 1.00 44.30 C ATOM 143 CD2 LEU A 10 12.066 -1.405 -9.945 1.00 72.23 C ATOM 0 H LEU A 10 11.066 -4.980 -9.156 1.00 0.53 H new ATOM 0 HA LEU A 10 13.866 -5.669 -9.549 1.00 54.04 H new ATOM 0 HB2 LEU A 10 14.063 -3.552 -10.382 1.00 4.00 H new ATOM 0 HB3 LEU A 10 12.348 -3.793 -10.653 1.00 4.00 H new ATOM 0 HG LEU A 10 12.159 -2.682 -8.240 1.00 64.51 H new ATOM 0 HD11 LEU A 10 13.848 -0.912 -7.961 1.00 44.30 H new ATOM 0 HD12 LEU A 10 14.572 -2.536 -7.870 1.00 44.30 H new ATOM 0 HD13 LEU A 10 14.752 -1.562 -9.349 1.00 44.30 H new ATOM 0 HD21 LEU A 10 11.858 -0.509 -9.361 1.00 72.23 H new ATOM 0 HD22 LEU A 10 12.684 -1.143 -10.804 1.00 72.23 H new ATOM 0 HD23 LEU A 10 11.128 -1.838 -10.292 1.00 72.23 H new ATOM 155 N THR A 11 12.705 -4.507 -6.741 1.00 33.03 N ATOM 156 CA THR A 11 13.037 -4.228 -5.349 1.00 74.22 C ATOM 157 C THR A 11 13.235 -5.518 -4.562 1.00 71.40 C ATOM 158 O THR A 11 13.898 -5.528 -3.525 1.00 31.41 O ATOM 159 CB THR A 11 11.940 -3.388 -4.668 1.00 3.32 C ATOM 160 OG1 THR A 11 12.456 -2.783 -3.476 1.00 71.43 O ATOM 161 CG2 THR A 11 10.734 -4.248 -4.325 1.00 34.12 C ATOM 0 H THR A 11 11.705 -4.537 -6.938 1.00 33.03 H new ATOM 0 HA THR A 11 13.968 -3.662 -5.353 1.00 74.22 H new ATOM 0 HB THR A 11 11.625 -2.610 -5.363 1.00 3.32 H new ATOM 0 HG1 THR A 11 11.753 -2.249 -3.049 1.00 71.43 H new ATOM 0 HG21 THR A 11 9.973 -3.633 -3.845 1.00 34.12 H new ATOM 0 HG22 THR A 11 10.326 -4.683 -5.237 1.00 34.12 H new ATOM 0 HG23 THR A 11 11.037 -5.045 -3.646 1.00 34.12 H new ATOM 169 N SER A 12 12.657 -6.606 -5.062 1.00 15.12 N ATOM 170 CA SER A 12 12.767 -7.902 -4.403 1.00 4.02 C ATOM 171 C SER A 12 14.005 -8.652 -4.885 1.00 24.23 C ATOM 172 O SER A 12 14.959 -8.851 -4.131 1.00 33.31 O ATOM 173 CB SER A 12 11.515 -8.740 -4.665 1.00 72.14 C ATOM 174 OG SER A 12 11.647 -10.040 -4.117 1.00 32.11 O ATOM 0 H SER A 12 12.108 -6.615 -5.921 1.00 15.12 H new ATOM 0 HA SER A 12 12.861 -7.730 -3.331 1.00 4.02 H new ATOM 0 HB2 SER A 12 10.646 -8.246 -4.231 1.00 72.14 H new ATOM 0 HB3 SER A 12 11.339 -8.811 -5.738 1.00 72.14 H new ATOM 0 HG SER A 12 10.833 -10.555 -4.297 1.00 32.11 H new ATOM 180 N THR A 13 13.984 -9.067 -6.148 1.00 31.34 N ATOM 181 CA THR A 13 15.102 -9.797 -6.731 1.00 44.35 C ATOM 182 C THR A 13 15.550 -9.160 -8.042 1.00 40.31 C ATOM 183 O THR A 13 14.813 -9.162 -9.028 1.00 15.11 O ATOM 184 CB THR A 13 14.739 -11.271 -6.988 1.00 72.34 C ATOM 185 OG1 THR A 13 14.393 -11.913 -5.756 1.00 2.44 O ATOM 186 CG2 THR A 13 15.898 -12.009 -7.642 1.00 11.50 C ATOM 0 H THR A 13 13.204 -8.910 -6.787 1.00 31.34 H new ATOM 0 HA THR A 13 15.918 -9.753 -6.010 1.00 44.35 H new ATOM 0 HB THR A 13 13.884 -11.298 -7.664 1.00 72.34 H new ATOM 0 HG1 THR A 13 14.162 -12.850 -5.929 1.00 2.44 H new ATOM 0 HG21 THR A 13 15.617 -13.048 -7.813 1.00 11.50 H new ATOM 0 HG22 THR A 13 16.139 -11.536 -8.594 1.00 11.50 H new ATOM 0 HG23 THR A 13 16.769 -11.972 -6.987 1.00 11.50 H new ATOM 194 N ARG A 14 16.763 -8.616 -8.046 1.00 55.35 N ATOM 195 CA ARG A 14 17.308 -7.974 -9.237 1.00 31.42 C ATOM 196 C ARG A 14 18.116 -8.967 -10.067 1.00 64.10 C ATOM 197 O ARG A 14 19.244 -9.315 -9.715 1.00 43.41 O ATOM 198 CB ARG A 14 18.188 -6.786 -8.844 1.00 55.02 C ATOM 199 CG ARG A 14 17.472 -5.756 -7.985 1.00 60.23 C ATOM 200 CD ARG A 14 18.447 -4.752 -7.392 1.00 2.43 C ATOM 201 NE ARG A 14 19.059 -5.245 -6.161 1.00 2.53 N ATOM 202 CZ ARG A 14 19.819 -4.498 -5.367 1.00 51.44 C ATOM 203 NH1 ARG A 14 20.058 -3.230 -5.674 1.00 63.25 N ATOM 204 NH2 ARG A 14 20.340 -5.018 -4.264 1.00 25.02 N ATOM 0 H ARG A 14 17.387 -8.607 -7.239 1.00 55.35 H new ATOM 0 HA ARG A 14 16.474 -7.616 -9.841 1.00 31.42 H new ATOM 0 HB2 ARG A 14 19.060 -7.154 -8.304 1.00 55.02 H new ATOM 0 HB3 ARG A 14 18.554 -6.301 -9.749 1.00 55.02 H new ATOM 0 HG2 ARG A 14 16.729 -5.232 -8.586 1.00 60.23 H new ATOM 0 HG3 ARG A 14 16.934 -6.260 -7.182 1.00 60.23 H new ATOM 0 HD2 ARG A 14 19.227 -4.530 -8.121 1.00 2.43 H new ATOM 0 HD3 ARG A 14 17.925 -3.817 -7.188 1.00 2.43 H new ATOM 0 HE ARG A 14 18.894 -6.216 -5.896 1.00 2.53 H new ATOM 0 HH11 ARG A 14 19.658 -2.826 -6.521 1.00 63.25 H new ATOM 0 HH12 ARG A 14 20.642 -2.659 -5.063 1.00 63.25 H new ATOM 0 HH21 ARG A 14 20.158 -5.992 -4.024 1.00 25.02 H new ATOM 0 HH22 ARG A 14 20.923 -4.444 -3.655 1.00 25.02 H new ATOM 218 N THR A 15 17.532 -9.421 -11.171 1.00 62.35 N ATOM 219 CA THR A 15 18.197 -10.375 -12.051 1.00 14.11 C ATOM 220 C THR A 15 17.957 -10.031 -13.516 1.00 53.24 C ATOM 221 O THR A 15 16.873 -9.579 -13.888 1.00 61.32 O ATOM 222 CB THR A 15 17.713 -11.813 -11.787 1.00 61.43 C ATOM 223 OG1 THR A 15 18.016 -12.193 -10.440 1.00 61.02 O ATOM 224 CG2 THR A 15 18.367 -12.790 -12.754 1.00 15.41 C ATOM 0 H THR A 15 16.600 -9.144 -11.478 1.00 62.35 H new ATOM 0 HA THR A 15 19.264 -10.313 -11.837 1.00 14.11 H new ATOM 0 HB THR A 15 16.634 -11.843 -11.938 1.00 61.43 H new ATOM 0 HG1 THR A 15 17.703 -13.108 -10.280 1.00 61.02 H new ATOM 0 HG21 THR A 15 18.010 -13.799 -12.549 1.00 15.41 H new ATOM 0 HG22 THR A 15 18.111 -12.516 -13.777 1.00 15.41 H new ATOM 0 HG23 THR A 15 19.449 -12.756 -12.630 1.00 15.41 H new ATOM 232 N ILE A 16 18.973 -10.247 -14.344 1.00 63.41 N ATOM 233 CA ILE A 16 18.871 -9.962 -15.770 1.00 2.52 C ATOM 234 C ILE A 16 19.304 -11.163 -16.604 1.00 2.53 C ATOM 235 O ILE A 16 20.291 -11.827 -16.288 1.00 35.23 O ATOM 236 CB ILE A 16 19.727 -8.743 -16.162 1.00 41.23 C ATOM 237 CG1 ILE A 16 19.283 -7.506 -15.378 1.00 74.23 C ATOM 238 CG2 ILE A 16 19.633 -8.490 -17.659 1.00 51.55 C ATOM 239 CD1 ILE A 16 19.948 -7.377 -14.026 1.00 42.42 C ATOM 0 H ILE A 16 19.877 -10.619 -14.052 1.00 63.41 H new ATOM 0 HA ILE A 16 17.823 -9.741 -15.974 1.00 2.52 H new ATOM 0 HB ILE A 16 20.767 -8.953 -15.913 1.00 41.23 H new ATOM 0 HG12 ILE A 16 19.500 -6.615 -15.967 1.00 74.23 H new ATOM 0 HG13 ILE A 16 18.202 -7.542 -15.240 1.00 74.23 H new ATOM 0 HG21 ILE A 16 20.243 -7.626 -17.921 1.00 51.55 H new ATOM 0 HG22 ILE A 16 19.993 -9.365 -18.199 1.00 51.55 H new ATOM 0 HG23 ILE A 16 18.595 -8.297 -17.931 1.00 51.55 H new ATOM 0 HD11 ILE A 16 19.586 -6.478 -13.527 1.00 42.42 H new ATOM 0 HD12 ILE A 16 19.710 -8.250 -13.419 1.00 42.42 H new ATOM 0 HD13 ILE A 16 21.028 -7.309 -14.157 1.00 42.42 H new ATOM 251 N ALA A 17 18.561 -11.434 -17.671 1.00 53.33 N ATOM 252 CA ALA A 17 18.870 -12.552 -18.553 1.00 72.14 C ATOM 253 C ALA A 17 19.051 -12.082 -19.993 1.00 20.22 C ATOM 254 O ALA A 17 18.133 -11.524 -20.595 1.00 11.54 O ATOM 255 CB ALA A 17 17.775 -13.605 -18.474 1.00 34.41 C ATOM 0 H ALA A 17 17.740 -10.894 -17.946 1.00 53.33 H new ATOM 0 HA ALA A 17 19.809 -12.995 -18.222 1.00 72.14 H new ATOM 0 HB1 ALA A 17 18.019 -14.434 -19.138 1.00 34.41 H new ATOM 0 HB2 ALA A 17 17.695 -13.971 -17.450 1.00 34.41 H new ATOM 0 HB3 ALA A 17 16.825 -13.165 -18.777 1.00 34.41 H new ATOM 261 N LEU A 18 20.240 -12.311 -20.540 1.00 32.14 N ATOM 262 CA LEU A 18 20.542 -11.910 -21.909 1.00 71.44 C ATOM 263 C LEU A 18 20.206 -13.029 -22.891 1.00 14.34 C ATOM 264 O LEU A 18 20.604 -14.178 -22.699 1.00 13.21 O ATOM 265 CB LEU A 18 22.018 -11.531 -22.037 1.00 23.31 C ATOM 266 CG LEU A 18 22.326 -10.313 -22.908 1.00 53.12 C ATOM 267 CD1 LEU A 18 21.672 -10.455 -24.274 1.00 14.42 C ATOM 268 CD2 LEU A 18 21.862 -9.036 -22.222 1.00 75.24 C ATOM 0 H LEU A 18 21.010 -12.772 -20.056 1.00 32.14 H new ATOM 0 HA LEU A 18 19.928 -11.042 -22.151 1.00 71.44 H new ATOM 0 HB2 LEU A 18 22.413 -11.347 -21.038 1.00 23.31 H new ATOM 0 HB3 LEU A 18 22.558 -12.387 -22.441 1.00 23.31 H new ATOM 0 HG LEU A 18 23.405 -10.254 -23.049 1.00 53.12 H new ATOM 0 HD11 LEU A 18 21.902 -9.579 -24.880 1.00 14.42 H new ATOM 0 HD12 LEU A 18 22.053 -11.349 -24.769 1.00 14.42 H new ATOM 0 HD13 LEU A 18 20.592 -10.539 -24.153 1.00 14.42 H new ATOM 0 HD21 LEU A 18 22.089 -8.179 -22.856 1.00 75.24 H new ATOM 0 HD22 LEU A 18 20.787 -9.085 -22.050 1.00 75.24 H new ATOM 0 HD23 LEU A 18 22.377 -8.928 -21.268 1.00 75.24 H new ATOM 280 N VAL A 19 19.472 -12.684 -23.944 1.00 34.00 N ATOM 281 CA VAL A 19 19.085 -13.658 -24.958 1.00 15.23 C ATOM 282 C VAL A 19 19.909 -13.486 -26.228 1.00 64.02 C ATOM 283 O VAL A 19 19.986 -12.393 -26.788 1.00 23.21 O ATOM 284 CB VAL A 19 17.590 -13.538 -25.309 1.00 73.02 C ATOM 285 CG1 VAL A 19 17.213 -14.541 -26.389 1.00 51.21 C ATOM 286 CG2 VAL A 19 16.733 -13.733 -24.067 1.00 5.10 C ATOM 0 H VAL A 19 19.133 -11.738 -24.117 1.00 34.00 H new ATOM 0 HA VAL A 19 19.274 -14.645 -24.537 1.00 15.23 H new ATOM 0 HB VAL A 19 17.405 -12.536 -25.696 1.00 73.02 H new ATOM 0 HG11 VAL A 19 16.153 -14.442 -26.624 1.00 51.21 H new ATOM 0 HG12 VAL A 19 17.803 -14.350 -27.285 1.00 51.21 H new ATOM 0 HG13 VAL A 19 17.412 -15.552 -26.033 1.00 51.21 H new ATOM 0 HG21 VAL A 19 15.680 -13.645 -24.334 1.00 5.10 H new ATOM 0 HG22 VAL A 19 16.920 -14.722 -23.648 1.00 5.10 H new ATOM 0 HG23 VAL A 19 16.985 -12.972 -23.328 1.00 5.10 H new ATOM 296 N GLY A 20 20.526 -14.575 -26.679 1.00 54.42 N ATOM 297 CA GLY A 20 21.337 -14.523 -27.881 1.00 70.53 C ATOM 298 C GLY A 20 22.726 -13.975 -27.620 1.00 53.25 C ATOM 299 O GLY A 20 23.328 -13.352 -28.494 1.00 2.41 O ATOM 0 H GLY A 20 20.478 -15.491 -26.233 1.00 54.42 H new ATOM 0 HA2 GLY A 20 21.418 -15.524 -28.304 1.00 70.53 H new ATOM 0 HA3 GLY A 20 20.839 -13.902 -28.625 1.00 70.53 H new ATOM 303 N ALA A 21 23.235 -14.205 -26.415 1.00 35.44 N ATOM 304 CA ALA A 21 24.561 -13.730 -26.041 1.00 71.05 C ATOM 305 C ALA A 21 25.648 -14.489 -26.795 1.00 41.41 C ATOM 306 O ALA A 21 25.901 -15.662 -26.524 1.00 30.40 O ATOM 307 CB ALA A 21 24.766 -13.863 -24.540 1.00 1.03 C ATOM 0 H ALA A 21 22.748 -14.718 -25.680 1.00 35.44 H new ATOM 0 HA ALA A 21 24.633 -12.677 -26.314 1.00 71.05 H new ATOM 0 HB1 ALA A 21 25.761 -13.504 -24.275 1.00 1.03 H new ATOM 0 HB2 ALA A 21 24.016 -13.271 -24.016 1.00 1.03 H new ATOM 0 HB3 ALA A 21 24.669 -14.909 -24.251 1.00 1.03 H new ATOM 313 N SER A 22 26.288 -13.811 -27.743 1.00 12.22 N ATOM 314 CA SER A 22 27.345 -14.423 -28.539 1.00 1.20 C ATOM 315 C SER A 22 28.671 -13.696 -28.332 1.00 33.30 C ATOM 316 O SER A 22 28.800 -12.860 -27.437 1.00 70.45 O ATOM 317 CB SER A 22 26.969 -14.409 -30.022 1.00 10.32 C ATOM 318 OG SER A 22 27.780 -15.305 -30.762 1.00 53.31 O ATOM 0 H SER A 22 26.093 -12.838 -27.978 1.00 12.22 H new ATOM 0 HA SER A 22 27.461 -15.456 -28.211 1.00 1.20 H new ATOM 0 HB2 SER A 22 25.920 -14.683 -30.137 1.00 10.32 H new ATOM 0 HB3 SER A 22 27.080 -13.400 -30.419 1.00 10.32 H new ATOM 0 HG SER A 22 27.519 -15.279 -31.706 1.00 53.31 H new ATOM 324 N ASP A 23 29.653 -14.022 -29.165 1.00 54.23 N ATOM 325 CA ASP A 23 30.969 -13.401 -29.076 1.00 11.52 C ATOM 326 C ASP A 23 31.063 -12.191 -30.001 1.00 10.14 C ATOM 327 O ASP A 23 32.063 -12.001 -30.693 1.00 23.13 O ATOM 328 CB ASP A 23 32.060 -14.413 -29.428 1.00 35.41 C ATOM 329 CG ASP A 23 31.785 -15.129 -30.736 1.00 35.02 C ATOM 330 OD1 ASP A 23 31.472 -14.444 -31.732 1.00 32.20 O ATOM 331 OD2 ASP A 23 31.881 -16.374 -30.763 1.00 61.01 O ATOM 0 H ASP A 23 29.562 -14.713 -29.910 1.00 54.23 H new ATOM 0 HA ASP A 23 31.115 -13.064 -28.050 1.00 11.52 H new ATOM 0 HB2 ASP A 23 33.020 -13.900 -29.492 1.00 35.41 H new ATOM 0 HB3 ASP A 23 32.144 -15.147 -28.626 1.00 35.41 H new ATOM 336 N LYS A 24 30.014 -11.375 -30.008 1.00 70.51 N ATOM 337 CA LYS A 24 29.977 -10.184 -30.847 1.00 52.42 C ATOM 338 C LYS A 24 30.072 -8.919 -30.000 1.00 53.32 C ATOM 339 O LYS A 24 29.067 -8.293 -29.661 1.00 40.35 O ATOM 340 CB LYS A 24 28.691 -10.159 -31.677 1.00 63.13 C ATOM 341 CG LYS A 24 28.735 -11.069 -32.893 1.00 12.21 C ATOM 342 CD LYS A 24 29.651 -10.515 -33.971 1.00 63.31 C ATOM 343 CE LYS A 24 29.553 -11.324 -35.255 1.00 62.43 C ATOM 344 NZ LYS A 24 30.705 -11.066 -36.163 1.00 22.31 N ATOM 0 H LYS A 24 29.178 -11.517 -29.441 1.00 70.51 H new ATOM 0 HA LYS A 24 30.835 -10.216 -31.518 1.00 52.42 H new ATOM 0 HB2 LYS A 24 27.854 -10.453 -31.044 1.00 63.13 H new ATOM 0 HB3 LYS A 24 28.500 -9.137 -32.005 1.00 63.13 H new ATOM 0 HG2 LYS A 24 29.079 -12.059 -32.595 1.00 12.21 H new ATOM 0 HG3 LYS A 24 27.729 -11.189 -33.295 1.00 12.21 H new ATOM 0 HD2 LYS A 24 29.390 -9.476 -34.173 1.00 63.31 H new ATOM 0 HD3 LYS A 24 30.681 -10.521 -33.614 1.00 63.31 H new ATOM 0 HE2 LYS A 24 29.512 -12.386 -35.013 1.00 62.43 H new ATOM 0 HE3 LYS A 24 28.624 -11.078 -35.769 1.00 62.43 H new ATOM 0 HZ1 LYS A 24 30.601 -11.636 -37.027 1.00 22.31 H new ATOM 0 HZ2 LYS A 24 30.729 -10.057 -36.415 1.00 22.31 H new ATOM 0 HZ3 LYS A 24 31.590 -11.324 -35.682 1.00 22.31 H new ATOM 358 N PRO A 25 31.307 -8.531 -29.650 1.00 61.11 N ATOM 359 CA PRO A 25 31.562 -7.336 -28.840 1.00 62.30 C ATOM 360 C PRO A 25 31.267 -6.047 -29.599 1.00 61.33 C ATOM 361 O PRO A 25 31.317 -4.956 -29.032 1.00 3.12 O ATOM 362 CB PRO A 25 33.055 -7.438 -28.519 1.00 3.33 C ATOM 363 CG PRO A 25 33.626 -8.255 -29.625 1.00 63.34 C ATOM 364 CD PRO A 25 32.550 -9.229 -30.019 1.00 22.35 C ATOM 0 HA PRO A 25 30.924 -7.298 -27.957 1.00 62.30 H new ATOM 0 HB2 PRO A 25 33.519 -6.452 -28.475 1.00 3.33 H new ATOM 0 HB3 PRO A 25 33.220 -7.911 -27.551 1.00 3.33 H new ATOM 0 HG2 PRO A 25 33.910 -7.626 -30.468 1.00 63.34 H new ATOM 0 HG3 PRO A 25 34.525 -8.778 -29.300 1.00 63.34 H new ATOM 0 HD2 PRO A 25 32.583 -9.455 -31.085 1.00 22.35 H new ATOM 0 HD3 PRO A 25 32.652 -10.176 -29.489 1.00 22.35 H new ATOM 372 N ASP A 26 30.959 -6.181 -30.885 1.00 10.34 N ATOM 373 CA ASP A 26 30.654 -5.026 -31.722 1.00 20.14 C ATOM 374 C ASP A 26 29.147 -4.861 -31.891 1.00 40.23 C ATOM 375 O ASP A 26 28.684 -4.266 -32.864 1.00 54.14 O ATOM 376 CB ASP A 26 31.321 -5.171 -33.090 1.00 70.23 C ATOM 377 CG ASP A 26 31.303 -3.879 -33.883 1.00 72.11 C ATOM 378 OD1 ASP A 26 31.622 -2.822 -33.301 1.00 13.33 O ATOM 379 OD2 ASP A 26 30.969 -3.925 -35.086 1.00 33.12 O ATOM 0 H ASP A 26 30.914 -7.077 -31.370 1.00 10.34 H new ATOM 0 HA ASP A 26 31.045 -4.136 -31.229 1.00 20.14 H new ATOM 0 HB2 ASP A 26 32.352 -5.497 -32.955 1.00 70.23 H new ATOM 0 HB3 ASP A 26 30.812 -5.950 -33.658 1.00 70.23 H new ATOM 384 N ARG A 27 28.388 -5.392 -30.939 1.00 34.03 N ATOM 385 CA ARG A 27 26.933 -5.305 -30.984 1.00 60.30 C ATOM 386 C ARG A 27 26.382 -4.732 -29.682 1.00 13.02 C ATOM 387 O ARG A 27 27.042 -4.740 -28.643 1.00 32.34 O ATOM 388 CB ARG A 27 26.326 -6.686 -31.243 1.00 44.42 C ATOM 389 CG ARG A 27 26.167 -7.014 -32.719 1.00 0.53 C ATOM 390 CD ARG A 27 24.702 -7.119 -33.111 1.00 14.21 C ATOM 391 NE ARG A 27 24.505 -7.997 -34.261 1.00 55.54 N ATOM 392 CZ ARG A 27 23.360 -8.086 -34.930 1.00 43.11 C ATOM 393 NH1 ARG A 27 22.316 -7.355 -34.565 1.00 44.51 N ATOM 394 NH2 ARG A 27 23.259 -8.908 -35.967 1.00 12.21 N ATOM 0 H ARG A 27 28.756 -5.887 -30.127 1.00 34.03 H new ATOM 0 HA ARG A 27 26.659 -4.636 -31.800 1.00 60.30 H new ATOM 0 HB2 ARG A 27 26.956 -7.444 -30.777 1.00 44.42 H new ATOM 0 HB3 ARG A 27 25.350 -6.741 -30.760 1.00 44.42 H new ATOM 0 HG2 ARG A 27 26.651 -6.243 -33.318 1.00 0.53 H new ATOM 0 HG3 ARG A 27 26.672 -7.954 -32.941 1.00 0.53 H new ATOM 0 HD2 ARG A 27 24.126 -7.495 -32.265 1.00 14.21 H new ATOM 0 HD3 ARG A 27 24.317 -6.126 -33.343 1.00 14.21 H new ATOM 0 HE ARG A 27 25.289 -8.573 -34.568 1.00 55.54 H new ATOM 0 HH11 ARG A 27 22.390 -6.722 -33.769 1.00 44.51 H new ATOM 0 HH12 ARG A 27 21.439 -7.426 -35.081 1.00 44.51 H new ATOM 0 HH21 ARG A 27 24.060 -9.472 -36.251 1.00 12.21 H new ATOM 0 HH22 ARG A 27 22.380 -8.976 -36.480 1.00 12.21 H new ATOM 408 N PRO A 28 25.143 -4.221 -29.738 1.00 33.24 N ATOM 409 CA PRO A 28 24.475 -3.634 -28.572 1.00 23.21 C ATOM 410 C PRO A 28 24.102 -4.682 -27.529 1.00 21.11 C ATOM 411 O PRO A 28 23.811 -4.351 -26.380 1.00 32.45 O ATOM 412 CB PRO A 28 23.216 -2.999 -29.167 1.00 32.44 C ATOM 413 CG PRO A 28 22.950 -3.777 -30.409 1.00 62.02 C ATOM 414 CD PRO A 28 24.298 -4.178 -30.943 1.00 13.12 C ATOM 0 HA PRO A 28 25.118 -2.927 -28.047 1.00 23.21 H new ATOM 0 HB2 PRO A 28 22.377 -3.060 -28.474 1.00 32.44 H new ATOM 0 HB3 PRO A 28 23.371 -1.943 -29.387 1.00 32.44 H new ATOM 0 HG2 PRO A 28 22.338 -4.654 -30.197 1.00 62.02 H new ATOM 0 HG3 PRO A 28 22.405 -3.176 -31.137 1.00 62.02 H new ATOM 0 HD2 PRO A 28 24.261 -5.146 -31.442 1.00 13.12 H new ATOM 0 HD3 PRO A 28 24.672 -3.458 -31.671 1.00 13.12 H new ATOM 422 N SER A 29 24.113 -5.947 -27.937 1.00 42.02 N ATOM 423 CA SER A 29 23.772 -7.043 -27.038 1.00 64.43 C ATOM 424 C SER A 29 24.932 -7.354 -26.096 1.00 53.14 C ATOM 425 O SER A 29 24.731 -7.865 -24.994 1.00 50.22 O ATOM 426 CB SER A 29 23.404 -8.293 -27.841 1.00 14.24 C ATOM 427 OG SER A 29 22.917 -9.318 -26.992 1.00 61.43 O ATOM 0 H SER A 29 24.354 -6.238 -28.884 1.00 42.02 H new ATOM 0 HA SER A 29 22.913 -6.737 -26.441 1.00 64.43 H new ATOM 0 HB2 SER A 29 22.648 -8.042 -28.585 1.00 14.24 H new ATOM 0 HB3 SER A 29 24.279 -8.651 -28.384 1.00 14.24 H new ATOM 0 HG SER A 29 22.687 -10.105 -27.528 1.00 61.43 H new ATOM 433 N TYR A 30 26.145 -7.042 -26.539 1.00 13.34 N ATOM 434 CA TYR A 30 27.337 -7.289 -25.737 1.00 64.13 C ATOM 435 C TYR A 30 27.626 -6.111 -24.812 1.00 42.11 C ATOM 436 O TYR A 30 27.902 -6.292 -23.626 1.00 44.31 O ATOM 437 CB TYR A 30 28.542 -7.547 -26.644 1.00 60.00 C ATOM 438 CG TYR A 30 29.611 -8.402 -26.002 1.00 71.31 C ATOM 439 CD1 TYR A 30 30.363 -7.925 -24.936 1.00 11.53 C ATOM 440 CD2 TYR A 30 29.870 -9.687 -26.462 1.00 72.43 C ATOM 441 CE1 TYR A 30 31.341 -8.702 -24.346 1.00 41.04 C ATOM 442 CE2 TYR A 30 30.845 -10.472 -25.878 1.00 71.42 C ATOM 443 CZ TYR A 30 31.578 -9.975 -24.821 1.00 31.32 C ATOM 444 OH TYR A 30 32.551 -10.754 -24.237 1.00 42.42 O ATOM 0 H TYR A 30 26.328 -6.618 -27.448 1.00 13.34 H new ATOM 0 HA TYR A 30 27.155 -8.172 -25.124 1.00 64.13 H new ATOM 0 HB2 TYR A 30 28.201 -8.033 -27.558 1.00 60.00 H new ATOM 0 HB3 TYR A 30 28.979 -6.591 -26.935 1.00 60.00 H new ATOM 0 HD1 TYR A 30 30.180 -6.929 -24.562 1.00 11.53 H new ATOM 0 HD2 TYR A 30 29.299 -10.079 -27.291 1.00 72.43 H new ATOM 0 HE1 TYR A 30 31.916 -8.315 -23.518 1.00 41.04 H new ATOM 0 HE2 TYR A 30 31.032 -11.470 -26.247 1.00 71.42 H new ATOM 0 HH TYR A 30 32.590 -11.623 -24.689 1.00 42.42 H new ATOM 454 N ARG A 31 27.559 -4.904 -25.364 1.00 5.42 N ATOM 455 CA ARG A 31 27.814 -3.695 -24.590 1.00 10.33 C ATOM 456 C ARG A 31 26.941 -3.656 -23.339 1.00 20.43 C ATOM 457 O ARG A 31 27.347 -3.131 -22.302 1.00 34.33 O ATOM 458 CB ARG A 31 27.555 -2.452 -25.444 1.00 35.51 C ATOM 459 CG ARG A 31 26.079 -2.157 -25.657 1.00 71.31 C ATOM 460 CD ARG A 31 25.876 -0.871 -26.442 1.00 51.04 C ATOM 461 NE ARG A 31 26.585 -0.891 -27.719 1.00 21.31 N ATOM 462 CZ ARG A 31 27.820 -0.430 -27.881 1.00 0.41 C ATOM 463 NH1 ARG A 31 28.479 0.085 -26.852 1.00 41.31 N ATOM 464 NH2 ARG A 31 28.398 -0.483 -29.074 1.00 4.10 N ATOM 0 H ARG A 31 27.330 -4.737 -26.344 1.00 5.42 H new ATOM 0 HA ARG A 31 28.860 -3.705 -24.283 1.00 10.33 H new ATOM 0 HB2 ARG A 31 28.024 -1.591 -24.969 1.00 35.51 H new ATOM 0 HB3 ARG A 31 28.035 -2.581 -26.414 1.00 35.51 H new ATOM 0 HG2 ARG A 31 25.614 -2.987 -26.189 1.00 71.31 H new ATOM 0 HG3 ARG A 31 25.580 -2.078 -24.691 1.00 71.31 H new ATOM 0 HD2 ARG A 31 24.811 -0.720 -26.621 1.00 51.04 H new ATOM 0 HD3 ARG A 31 26.223 -0.025 -25.848 1.00 51.04 H new ATOM 0 HE ARG A 31 26.105 -1.280 -28.531 1.00 21.31 H new ATOM 0 HH11 ARG A 31 28.038 0.128 -25.933 1.00 41.31 H new ATOM 0 HH12 ARG A 31 29.427 0.438 -26.979 1.00 41.31 H new ATOM 0 HH21 ARG A 31 27.894 -0.878 -29.868 1.00 4.10 H new ATOM 0 HH22 ARG A 31 29.346 -0.129 -29.197 1.00 4.10 H new ATOM 478 N VAL A 32 25.740 -4.216 -23.444 1.00 52.22 N ATOM 479 CA VAL A 32 24.809 -4.246 -22.322 1.00 25.30 C ATOM 480 C VAL A 32 25.203 -5.317 -21.311 1.00 21.12 C ATOM 481 O VAL A 32 25.108 -5.108 -20.102 1.00 30.23 O ATOM 482 CB VAL A 32 23.367 -4.508 -22.795 1.00 64.14 C ATOM 483 CG1 VAL A 32 22.420 -4.577 -21.608 1.00 35.12 C ATOM 484 CG2 VAL A 32 22.926 -3.434 -23.778 1.00 44.12 C ATOM 0 H VAL A 32 25.389 -4.655 -24.295 1.00 52.22 H new ATOM 0 HA VAL A 32 24.854 -3.266 -21.847 1.00 25.30 H new ATOM 0 HB VAL A 32 23.340 -5.470 -23.307 1.00 64.14 H new ATOM 0 HG11 VAL A 32 21.406 -4.763 -21.962 1.00 35.12 H new ATOM 0 HG12 VAL A 32 22.727 -5.386 -20.945 1.00 35.12 H new ATOM 0 HG13 VAL A 32 22.448 -3.632 -21.065 1.00 35.12 H new ATOM 0 HG21 VAL A 32 21.905 -3.635 -24.102 1.00 44.12 H new ATOM 0 HG22 VAL A 32 22.968 -2.458 -23.294 1.00 44.12 H new ATOM 0 HG23 VAL A 32 23.589 -3.439 -24.643 1.00 44.12 H new ATOM 494 N MET A 33 25.646 -6.465 -21.814 1.00 51.54 N ATOM 495 CA MET A 33 26.056 -7.568 -20.954 1.00 60.53 C ATOM 496 C MET A 33 27.127 -7.119 -19.966 1.00 11.54 C ATOM 497 O MET A 33 26.931 -7.179 -18.752 1.00 31.54 O ATOM 498 CB MET A 33 26.580 -8.732 -21.797 1.00 65.44 C ATOM 499 CG MET A 33 26.623 -10.055 -21.049 1.00 14.44 C ATOM 500 SD MET A 33 27.472 -11.349 -21.972 1.00 62.14 S ATOM 501 CE MET A 33 26.686 -11.194 -23.574 1.00 52.11 C ATOM 0 H MET A 33 25.730 -6.655 -22.813 1.00 51.54 H new ATOM 0 HA MET A 33 25.184 -7.900 -20.391 1.00 60.53 H new ATOM 0 HB2 MET A 33 25.949 -8.843 -22.679 1.00 65.44 H new ATOM 0 HB3 MET A 33 27.583 -8.491 -22.150 1.00 65.44 H new ATOM 0 HG2 MET A 33 27.123 -9.910 -20.091 1.00 14.44 H new ATOM 0 HG3 MET A 33 25.605 -10.378 -20.832 1.00 14.44 H new ATOM 0 HE1 MET A 33 27.028 -11.998 -24.226 1.00 52.11 H new ATOM 0 HE2 MET A 33 25.604 -11.258 -23.456 1.00 52.11 H new ATOM 0 HE3 MET A 33 26.947 -10.232 -24.016 1.00 52.11 H new ATOM 511 N LYS A 34 28.260 -6.667 -20.492 1.00 40.15 N ATOM 512 CA LYS A 34 29.362 -6.205 -19.657 1.00 64.51 C ATOM 513 C LYS A 34 28.960 -4.969 -18.860 1.00 43.41 C ATOM 514 O LYS A 34 29.555 -4.664 -17.826 1.00 20.42 O ATOM 515 CB LYS A 34 30.587 -5.893 -20.520 1.00 23.52 C ATOM 516 CG LYS A 34 31.892 -5.882 -19.742 1.00 51.12 C ATOM 517 CD LYS A 34 33.094 -5.844 -20.671 1.00 2.14 C ATOM 518 CE LYS A 34 34.389 -6.104 -19.917 1.00 22.34 C ATOM 519 NZ LYS A 34 35.581 -5.981 -20.801 1.00 74.24 N ATOM 0 H LYS A 34 28.439 -6.611 -21.495 1.00 40.15 H new ATOM 0 HA LYS A 34 29.612 -7.001 -18.956 1.00 64.51 H new ATOM 0 HB2 LYS A 34 30.656 -6.632 -21.319 1.00 23.52 H new ATOM 0 HB3 LYS A 34 30.449 -4.922 -20.995 1.00 23.52 H new ATOM 0 HG2 LYS A 34 31.915 -5.016 -19.080 1.00 51.12 H new ATOM 0 HG3 LYS A 34 31.947 -6.768 -19.110 1.00 51.12 H new ATOM 0 HD2 LYS A 34 32.972 -6.591 -21.456 1.00 2.14 H new ATOM 0 HD3 LYS A 34 33.146 -4.872 -21.161 1.00 2.14 H new ATOM 0 HE2 LYS A 34 34.476 -5.399 -19.091 1.00 22.34 H new ATOM 0 HE3 LYS A 34 34.361 -7.103 -19.482 1.00 22.34 H new ATOM 0 HZ1 LYS A 34 36.443 -6.166 -20.249 1.00 74.24 H new ATOM 0 HZ2 LYS A 34 35.511 -6.671 -21.576 1.00 74.24 H new ATOM 0 HZ3 LYS A 34 35.622 -5.020 -21.196 1.00 74.24 H new ATOM 533 N TYR A 35 27.948 -4.260 -19.347 1.00 34.30 N ATOM 534 CA TYR A 35 27.467 -3.056 -18.680 1.00 50.03 C ATOM 535 C TYR A 35 26.738 -3.404 -17.386 1.00 54.12 C ATOM 536 O TYR A 35 26.981 -2.800 -16.341 1.00 0.05 O ATOM 537 CB TYR A 35 26.538 -2.271 -19.607 1.00 55.14 C ATOM 538 CG TYR A 35 25.467 -1.494 -18.875 1.00 51.11 C ATOM 539 CD1 TYR A 35 25.801 -0.461 -18.008 1.00 22.23 C ATOM 540 CD2 TYR A 35 24.121 -1.793 -19.050 1.00 4.13 C ATOM 541 CE1 TYR A 35 24.827 0.251 -17.336 1.00 15.11 C ATOM 542 CE2 TYR A 35 23.140 -1.085 -18.383 1.00 60.13 C ATOM 543 CZ TYR A 35 23.498 -0.064 -17.527 1.00 75.24 C ATOM 544 OH TYR A 35 22.523 0.642 -16.861 1.00 10.34 O ATOM 0 H TYR A 35 27.445 -4.498 -20.202 1.00 34.30 H new ATOM 0 HA TYR A 35 28.331 -2.438 -18.434 1.00 50.03 H new ATOM 0 HB2 TYR A 35 27.133 -1.579 -20.203 1.00 55.14 H new ATOM 0 HB3 TYR A 35 26.062 -2.963 -20.302 1.00 55.14 H new ATOM 0 HD1 TYR A 35 26.841 -0.210 -17.857 1.00 22.23 H new ATOM 0 HD2 TYR A 35 23.837 -2.592 -19.719 1.00 4.13 H new ATOM 0 HE1 TYR A 35 25.105 1.050 -16.665 1.00 15.11 H new ATOM 0 HE2 TYR A 35 22.098 -1.329 -18.531 1.00 60.13 H new ATOM 0 HH TYR A 35 21.960 1.113 -17.510 1.00 10.34 H new ATOM 554 N LEU A 36 25.842 -4.382 -17.464 1.00 63.13 N ATOM 555 CA LEU A 36 25.076 -4.813 -16.300 1.00 4.01 C ATOM 556 C LEU A 36 25.968 -5.547 -15.303 1.00 54.10 C ATOM 557 O LEU A 36 25.727 -5.512 -14.096 1.00 34.15 O ATOM 558 CB LEU A 36 23.921 -5.718 -16.731 1.00 61.12 C ATOM 559 CG LEU A 36 22.808 -5.048 -17.536 1.00 55.53 C ATOM 560 CD1 LEU A 36 21.722 -6.054 -17.887 1.00 44.42 C ATOM 561 CD2 LEU A 36 22.221 -3.876 -16.762 1.00 41.02 C ATOM 0 H LEU A 36 25.628 -4.891 -18.321 1.00 63.13 H new ATOM 0 HA LEU A 36 24.671 -3.926 -15.813 1.00 4.01 H new ATOM 0 HB2 LEU A 36 24.329 -6.536 -17.324 1.00 61.12 H new ATOM 0 HB3 LEU A 36 23.480 -6.161 -15.838 1.00 61.12 H new ATOM 0 HG LEU A 36 23.236 -4.668 -18.464 1.00 55.53 H new ATOM 0 HD11 LEU A 36 20.938 -5.558 -18.460 1.00 44.42 H new ATOM 0 HD12 LEU A 36 22.151 -6.860 -18.481 1.00 44.42 H new ATOM 0 HD13 LEU A 36 21.297 -6.465 -16.971 1.00 44.42 H new ATOM 0 HD21 LEU A 36 21.430 -3.411 -17.350 1.00 41.02 H new ATOM 0 HD22 LEU A 36 21.809 -4.233 -15.818 1.00 41.02 H new ATOM 0 HD23 LEU A 36 23.003 -3.144 -16.562 1.00 41.02 H new ATOM 573 N LEU A 37 26.999 -6.209 -15.815 1.00 71.04 N ATOM 574 CA LEU A 37 27.929 -6.950 -14.970 1.00 53.10 C ATOM 575 C LEU A 37 28.745 -6.002 -14.098 1.00 5.12 C ATOM 576 O LEU A 37 28.891 -6.219 -12.895 1.00 23.51 O ATOM 577 CB LEU A 37 28.863 -7.802 -15.831 1.00 2.04 C ATOM 578 CG LEU A 37 28.412 -9.240 -16.090 1.00 3.04 C ATOM 579 CD1 LEU A 37 29.385 -9.945 -17.023 1.00 12.53 C ATOM 580 CD2 LEU A 37 28.281 -10.002 -14.779 1.00 10.11 C ATOM 0 H LEU A 37 27.212 -6.248 -16.812 1.00 71.04 H new ATOM 0 HA LEU A 37 27.349 -7.604 -14.319 1.00 53.10 H new ATOM 0 HB2 LEU A 37 28.993 -7.305 -16.792 1.00 2.04 H new ATOM 0 HB3 LEU A 37 29.842 -7.830 -15.352 1.00 2.04 H new ATOM 0 HG LEU A 37 27.434 -9.213 -16.571 1.00 3.04 H new ATOM 0 HD11 LEU A 37 29.048 -10.967 -17.196 1.00 12.53 H new ATOM 0 HD12 LEU A 37 29.429 -9.412 -17.973 1.00 12.53 H new ATOM 0 HD13 LEU A 37 30.376 -9.962 -16.570 1.00 12.53 H new ATOM 0 HD21 LEU A 37 27.959 -11.023 -14.982 1.00 10.11 H new ATOM 0 HD22 LEU A 37 29.245 -10.020 -14.271 1.00 10.11 H new ATOM 0 HD23 LEU A 37 27.545 -9.509 -14.144 1.00 10.11 H new ATOM 592 N ASP A 38 29.274 -4.949 -14.712 1.00 20.13 N ATOM 593 CA ASP A 38 30.073 -3.965 -13.991 1.00 24.22 C ATOM 594 C ASP A 38 29.208 -3.168 -13.019 1.00 61.45 C ATOM 595 O ASP A 38 29.672 -2.754 -11.958 1.00 0.23 O ATOM 596 CB ASP A 38 30.763 -3.018 -14.974 1.00 22.03 C ATOM 597 CG ASP A 38 32.228 -3.356 -15.173 1.00 34.31 C ATOM 598 OD1 ASP A 38 32.548 -4.557 -15.299 1.00 74.03 O ATOM 599 OD2 ASP A 38 33.053 -2.420 -15.203 1.00 64.33 O ATOM 0 H ASP A 38 29.164 -4.755 -15.707 1.00 20.13 H new ATOM 0 HA ASP A 38 30.832 -4.499 -13.419 1.00 24.22 H new ATOM 0 HB2 ASP A 38 30.250 -3.059 -15.935 1.00 22.03 H new ATOM 0 HB3 ASP A 38 30.676 -1.994 -14.610 1.00 22.03 H new ATOM 604 N GLN A 39 27.950 -2.958 -13.392 1.00 13.12 N ATOM 605 CA GLN A 39 27.021 -2.209 -12.554 1.00 33.13 C ATOM 606 C GLN A 39 26.775 -2.932 -11.233 1.00 40.33 C ATOM 607 O GLN A 39 26.427 -2.311 -10.230 1.00 11.12 O ATOM 608 CB GLN A 39 25.695 -1.998 -13.288 1.00 23.04 C ATOM 609 CG GLN A 39 25.704 -0.803 -14.228 1.00 31.35 C ATOM 610 CD GLN A 39 26.102 0.483 -13.532 1.00 45.52 C ATOM 611 OE1 GLN A 39 25.476 0.894 -12.555 1.00 3.23 O ATOM 612 NE2 GLN A 39 27.150 1.128 -14.034 1.00 33.24 N ATOM 0 H GLN A 39 27.551 -3.295 -14.268 1.00 13.12 H new ATOM 0 HA GLN A 39 27.467 -1.238 -12.338 1.00 33.13 H new ATOM 0 HB2 GLN A 39 25.458 -2.896 -13.858 1.00 23.04 H new ATOM 0 HB3 GLN A 39 24.900 -1.867 -12.554 1.00 23.04 H new ATOM 0 HG2 GLN A 39 26.395 -0.996 -15.049 1.00 31.35 H new ATOM 0 HG3 GLN A 39 24.713 -0.683 -14.667 1.00 31.35 H new ATOM 0 HE21 GLN A 39 27.640 0.751 -14.845 1.00 33.24 H new ATOM 0 HE22 GLN A 39 27.464 2.000 -13.608 1.00 33.24 H new ATOM 621 N GLY A 40 26.958 -4.249 -11.242 1.00 4.42 N ATOM 622 CA GLY A 40 26.752 -5.034 -10.039 1.00 75.12 C ATOM 623 C GLY A 40 25.477 -5.852 -10.093 1.00 72.53 C ATOM 624 O GLY A 40 24.832 -6.079 -9.069 1.00 50.41 O ATOM 0 H GLY A 40 27.245 -4.786 -12.060 1.00 4.42 H new ATOM 0 HA2 GLY A 40 27.602 -5.701 -9.894 1.00 75.12 H new ATOM 0 HA3 GLY A 40 26.717 -4.369 -9.176 1.00 75.12 H new ATOM 628 N TYR A 41 25.111 -6.296 -11.291 1.00 22.33 N ATOM 629 CA TYR A 41 23.902 -7.091 -11.475 1.00 45.31 C ATOM 630 C TYR A 41 24.248 -8.534 -11.827 1.00 71.50 C ATOM 631 O TYR A 41 25.395 -8.851 -12.145 1.00 73.12 O ATOM 632 CB TYR A 41 23.029 -6.481 -12.573 1.00 61.41 C ATOM 633 CG TYR A 41 22.381 -5.174 -12.176 1.00 23.20 C ATOM 634 CD1 TYR A 41 21.233 -5.154 -11.395 1.00 35.31 C ATOM 635 CD2 TYR A 41 22.919 -3.959 -12.581 1.00 40.42 C ATOM 636 CE1 TYR A 41 20.637 -3.962 -11.030 1.00 61.25 C ATOM 637 CE2 TYR A 41 22.331 -2.762 -12.220 1.00 41.33 C ATOM 638 CZ TYR A 41 21.190 -2.769 -11.445 1.00 42.34 C ATOM 639 OH TYR A 41 20.601 -1.579 -11.083 1.00 72.12 O ATOM 0 H TYR A 41 25.634 -6.119 -12.149 1.00 22.33 H new ATOM 0 HA TYR A 41 23.348 -7.088 -10.536 1.00 45.31 H new ATOM 0 HB2 TYR A 41 23.639 -6.319 -13.462 1.00 61.41 H new ATOM 0 HB3 TYR A 41 22.251 -7.194 -12.845 1.00 61.41 H new ATOM 0 HD1 TYR A 41 20.798 -6.087 -11.067 1.00 35.31 H new ATOM 0 HD2 TYR A 41 23.812 -3.950 -13.188 1.00 40.42 H new ATOM 0 HE1 TYR A 41 19.743 -3.965 -10.423 1.00 61.25 H new ATOM 0 HE2 TYR A 41 22.762 -1.826 -12.543 1.00 41.33 H new ATOM 0 HH TYR A 41 21.115 -0.833 -11.456 1.00 72.12 H new ATOM 649 N HIS A 42 23.247 -9.407 -11.768 1.00 54.20 N ATOM 650 CA HIS A 42 23.443 -10.818 -12.082 1.00 15.25 C ATOM 651 C HIS A 42 22.982 -11.128 -13.503 1.00 3.52 C ATOM 652 O HIS A 42 21.827 -11.490 -13.727 1.00 44.23 O ATOM 653 CB HIS A 42 22.683 -11.694 -11.085 1.00 11.33 C ATOM 654 CG HIS A 42 23.359 -12.999 -10.798 1.00 11.02 C ATOM 655 ND1 HIS A 42 24.408 -13.125 -9.912 1.00 12.55 N ATOM 656 CD2 HIS A 42 23.129 -14.241 -11.285 1.00 11.14 C ATOM 657 CE1 HIS A 42 24.795 -14.387 -9.867 1.00 12.22 C ATOM 658 NE2 HIS A 42 24.034 -15.085 -10.691 1.00 24.24 N ATOM 0 H HIS A 42 22.292 -9.162 -11.506 1.00 54.20 H new ATOM 0 HA HIS A 42 24.508 -11.036 -12.009 1.00 15.25 H new ATOM 0 HB2 HIS A 42 22.560 -11.145 -10.151 1.00 11.33 H new ATOM 0 HB3 HIS A 42 21.684 -11.890 -11.474 1.00 11.33 H new ATOM 0 HD2 HIS A 42 22.374 -14.516 -12.007 1.00 11.14 H new ATOM 0 HE1 HIS A 42 25.597 -14.781 -9.260 1.00 12.22 H new ATOM 0 HE2 HIS A 42 24.107 -16.088 -10.859 1.00 24.24 H new ATOM 666 N VAL A 43 23.893 -10.982 -14.460 1.00 4.22 N ATOM 667 CA VAL A 43 23.581 -11.246 -15.859 1.00 62.22 C ATOM 668 C VAL A 43 23.492 -12.744 -16.129 1.00 14.02 C ATOM 669 O VAL A 43 24.223 -13.537 -15.534 1.00 53.41 O ATOM 670 CB VAL A 43 24.637 -10.629 -16.796 1.00 32.30 C ATOM 671 CG1 VAL A 43 24.846 -9.158 -16.470 1.00 74.32 C ATOM 672 CG2 VAL A 43 25.947 -11.396 -16.700 1.00 30.31 C ATOM 0 H VAL A 43 24.853 -10.682 -14.291 1.00 4.22 H new ATOM 0 HA VAL A 43 22.614 -10.785 -16.060 1.00 62.22 H new ATOM 0 HB VAL A 43 24.274 -10.701 -17.821 1.00 32.30 H new ATOM 0 HG11 VAL A 43 25.595 -8.739 -17.142 1.00 74.32 H new ATOM 0 HG12 VAL A 43 23.906 -8.621 -16.595 1.00 74.32 H new ATOM 0 HG13 VAL A 43 25.187 -9.059 -15.439 1.00 74.32 H new ATOM 0 HG21 VAL A 43 26.682 -10.947 -17.368 1.00 30.31 H new ATOM 0 HG22 VAL A 43 26.317 -11.357 -15.675 1.00 30.31 H new ATOM 0 HG23 VAL A 43 25.782 -12.434 -16.987 1.00 30.31 H new ATOM 682 N ILE A 44 22.591 -13.125 -17.029 1.00 5.31 N ATOM 683 CA ILE A 44 22.408 -14.528 -17.379 1.00 14.35 C ATOM 684 C ILE A 44 22.272 -14.705 -18.887 1.00 31.20 C ATOM 685 O ILE A 44 21.175 -14.874 -19.421 1.00 65.10 O ATOM 686 CB ILE A 44 21.165 -15.121 -16.689 1.00 71.52 C ATOM 687 CG1 ILE A 44 21.293 -15.004 -15.169 1.00 40.01 C ATOM 688 CG2 ILE A 44 20.975 -16.574 -17.099 1.00 60.15 C ATOM 689 CD1 ILE A 44 19.962 -14.982 -14.450 1.00 62.04 C ATOM 0 H ILE A 44 21.977 -12.482 -17.529 1.00 5.31 H new ATOM 0 HA ILE A 44 23.295 -15.059 -17.033 1.00 14.35 H new ATOM 0 HB ILE A 44 20.288 -14.556 -17.005 1.00 71.52 H new ATOM 0 HG12 ILE A 44 21.884 -15.841 -14.797 1.00 40.01 H new ATOM 0 HG13 ILE A 44 21.842 -14.094 -14.928 1.00 40.01 H new ATOM 0 HG21 ILE A 44 20.093 -16.980 -16.603 1.00 60.15 H new ATOM 0 HG22 ILE A 44 20.844 -16.633 -18.179 1.00 60.15 H new ATOM 0 HG23 ILE A 44 21.852 -17.152 -16.808 1.00 60.15 H new ATOM 0 HD11 ILE A 44 20.130 -14.898 -13.376 1.00 62.04 H new ATOM 0 HD12 ILE A 44 19.377 -14.129 -14.794 1.00 62.04 H new ATOM 0 HD13 ILE A 44 19.419 -15.903 -14.661 1.00 62.04 H new ATOM 701 N PRO A 45 23.412 -14.668 -19.592 1.00 63.11 N ATOM 702 CA PRO A 45 23.448 -14.825 -21.049 1.00 75.41 C ATOM 703 C PRO A 45 23.108 -16.246 -21.487 1.00 41.02 C ATOM 704 O PRO A 45 23.591 -17.218 -20.906 1.00 15.25 O ATOM 705 CB PRO A 45 24.897 -14.487 -21.407 1.00 72.34 C ATOM 706 CG PRO A 45 25.672 -14.785 -20.171 1.00 21.14 C ATOM 707 CD PRO A 45 24.755 -14.470 -19.021 1.00 62.42 C ATOM 0 HA PRO A 45 22.713 -14.191 -21.546 1.00 75.41 H new ATOM 0 HB2 PRO A 45 25.247 -15.086 -22.248 1.00 72.34 H new ATOM 0 HB3 PRO A 45 25.000 -13.441 -21.696 1.00 72.34 H new ATOM 0 HG2 PRO A 45 25.983 -15.830 -20.148 1.00 21.14 H new ATOM 0 HG3 PRO A 45 26.579 -14.182 -20.124 1.00 21.14 H new ATOM 0 HD2 PRO A 45 24.933 -15.131 -18.173 1.00 62.42 H new ATOM 0 HD3 PRO A 45 24.894 -13.449 -18.664 1.00 62.42 H new ATOM 715 N VAL A 46 22.275 -16.360 -22.517 1.00 10.22 N ATOM 716 CA VAL A 46 21.872 -17.662 -23.034 1.00 62.10 C ATOM 717 C VAL A 46 22.051 -17.732 -24.546 1.00 64.14 C ATOM 718 O VAL A 46 21.485 -16.928 -25.287 1.00 21.22 O ATOM 719 CB VAL A 46 20.404 -17.974 -22.687 1.00 64.30 C ATOM 720 CG1 VAL A 46 20.025 -19.364 -23.174 1.00 35.54 C ATOM 721 CG2 VAL A 46 20.172 -17.843 -21.189 1.00 52.45 C ATOM 0 H VAL A 46 21.866 -15.566 -23.010 1.00 10.22 H new ATOM 0 HA VAL A 46 22.515 -18.404 -22.560 1.00 62.10 H new ATOM 0 HB VAL A 46 19.766 -17.251 -23.195 1.00 64.30 H new ATOM 0 HG11 VAL A 46 18.985 -19.567 -22.920 1.00 35.54 H new ATOM 0 HG12 VAL A 46 20.152 -19.418 -24.255 1.00 35.54 H new ATOM 0 HG13 VAL A 46 20.666 -20.104 -22.696 1.00 35.54 H new ATOM 0 HG21 VAL A 46 19.130 -18.067 -20.961 1.00 52.45 H new ATOM 0 HG22 VAL A 46 20.818 -18.543 -20.658 1.00 52.45 H new ATOM 0 HG23 VAL A 46 20.402 -16.826 -20.873 1.00 52.45 H new ATOM 731 N SER A 47 22.843 -18.699 -24.999 1.00 32.42 N ATOM 732 CA SER A 47 23.100 -18.873 -26.424 1.00 32.13 C ATOM 733 C SER A 47 23.276 -20.349 -26.768 1.00 55.11 C ATOM 734 O SER A 47 23.699 -21.159 -25.943 1.00 71.14 O ATOM 735 CB SER A 47 24.347 -18.089 -26.838 1.00 34.12 C ATOM 736 OG SER A 47 25.064 -18.771 -27.852 1.00 51.44 O ATOM 0 H SER A 47 23.318 -19.374 -24.400 1.00 32.42 H new ATOM 0 HA SER A 47 22.240 -18.490 -26.973 1.00 32.13 H new ATOM 0 HB2 SER A 47 24.057 -17.101 -27.195 1.00 34.12 H new ATOM 0 HB3 SER A 47 24.991 -17.939 -25.971 1.00 34.12 H new ATOM 0 HG SER A 47 25.855 -18.249 -28.100 1.00 51.44 H new ATOM 742 N PRO A 48 22.942 -20.708 -28.017 1.00 4.12 N ATOM 743 CA PRO A 48 23.055 -22.087 -28.501 1.00 32.14 C ATOM 744 C PRO A 48 24.506 -22.531 -28.655 1.00 55.22 C ATOM 745 O PRO A 48 24.784 -23.705 -28.898 1.00 61.13 O ATOM 746 CB PRO A 48 22.361 -22.042 -29.864 1.00 61.33 C ATOM 747 CG PRO A 48 22.484 -20.625 -30.306 1.00 2.34 C ATOM 748 CD PRO A 48 22.431 -19.795 -29.053 1.00 12.13 C ATOM 0 HA PRO A 48 22.613 -22.801 -27.806 1.00 32.14 H new ATOM 0 HB2 PRO A 48 22.836 -22.720 -30.573 1.00 61.33 H new ATOM 0 HB3 PRO A 48 21.316 -22.343 -29.786 1.00 61.33 H new ATOM 0 HG2 PRO A 48 23.419 -20.463 -30.842 1.00 2.34 H new ATOM 0 HG3 PRO A 48 21.676 -20.357 -30.986 1.00 2.34 H new ATOM 0 HD2 PRO A 48 23.046 -18.899 -29.138 1.00 12.13 H new ATOM 0 HD3 PRO A 48 21.416 -19.465 -28.832 1.00 12.13 H new ATOM 756 N LYS A 49 25.427 -21.584 -28.512 1.00 62.43 N ATOM 757 CA LYS A 49 26.850 -21.877 -28.634 1.00 63.12 C ATOM 758 C LYS A 49 27.523 -21.885 -27.265 1.00 63.13 C ATOM 759 O LYS A 49 28.449 -22.659 -27.022 1.00 63.12 O ATOM 760 CB LYS A 49 27.528 -20.848 -29.541 1.00 51.44 C ATOM 761 CG LYS A 49 29.027 -21.050 -29.678 1.00 30.51 C ATOM 762 CD LYS A 49 29.355 -22.428 -30.230 1.00 4.43 C ATOM 763 CE LYS A 49 30.825 -22.543 -30.603 1.00 5.44 C ATOM 764 NZ LYS A 49 31.073 -23.670 -31.543 1.00 75.51 N ATOM 0 H LYS A 49 25.213 -20.607 -28.311 1.00 62.43 H new ATOM 0 HA LYS A 49 26.955 -22.867 -29.077 1.00 63.12 H new ATOM 0 HB2 LYS A 49 27.072 -20.892 -30.530 1.00 51.44 H new ATOM 0 HB3 LYS A 49 27.339 -19.849 -29.147 1.00 51.44 H new ATOM 0 HG2 LYS A 49 29.440 -20.285 -30.336 1.00 30.51 H new ATOM 0 HG3 LYS A 49 29.503 -20.924 -28.705 1.00 30.51 H new ATOM 0 HD2 LYS A 49 29.106 -23.187 -29.488 1.00 4.43 H new ATOM 0 HD3 LYS A 49 28.739 -22.626 -31.107 1.00 4.43 H new ATOM 0 HE2 LYS A 49 31.158 -21.610 -31.059 1.00 5.44 H new ATOM 0 HE3 LYS A 49 31.418 -22.686 -29.700 1.00 5.44 H new ATOM 0 HZ1 LYS A 49 32.086 -23.714 -31.772 1.00 75.51 H new ATOM 0 HZ2 LYS A 49 30.779 -24.563 -31.099 1.00 75.51 H new ATOM 0 HZ3 LYS A 49 30.527 -23.521 -32.415 1.00 75.51 H new ATOM 778 N VAL A 50 27.051 -21.020 -26.374 1.00 10.15 N ATOM 779 CA VAL A 50 27.605 -20.929 -25.028 1.00 64.41 C ATOM 780 C VAL A 50 27.102 -22.068 -24.148 1.00 60.35 C ATOM 781 O VAL A 50 27.591 -22.270 -23.037 1.00 75.43 O ATOM 782 CB VAL A 50 27.250 -19.586 -24.364 1.00 34.24 C ATOM 783 CG1 VAL A 50 25.763 -19.524 -24.048 1.00 52.43 C ATOM 784 CG2 VAL A 50 28.079 -19.378 -23.105 1.00 70.54 C ATOM 0 H VAL A 50 26.286 -20.372 -26.560 1.00 10.15 H new ATOM 0 HA VAL A 50 28.688 -21.001 -25.126 1.00 64.41 H new ATOM 0 HB VAL A 50 27.484 -18.782 -25.062 1.00 34.24 H new ATOM 0 HG11 VAL A 50 25.530 -18.568 -23.579 1.00 52.43 H new ATOM 0 HG12 VAL A 50 25.191 -19.625 -24.970 1.00 52.43 H new ATOM 0 HG13 VAL A 50 25.501 -20.335 -23.368 1.00 52.43 H new ATOM 0 HG21 VAL A 50 27.815 -18.424 -22.649 1.00 70.54 H new ATOM 0 HG22 VAL A 50 27.879 -20.185 -22.400 1.00 70.54 H new ATOM 0 HG23 VAL A 50 29.138 -19.376 -23.363 1.00 70.54 H new ATOM 794 N ALA A 51 26.122 -22.810 -24.654 1.00 21.20 N ATOM 795 CA ALA A 51 25.554 -23.931 -23.915 1.00 53.04 C ATOM 796 C ALA A 51 26.637 -24.921 -23.500 1.00 51.23 C ATOM 797 O ALA A 51 27.090 -25.734 -24.305 1.00 10.31 O ATOM 798 CB ALA A 51 24.491 -24.629 -24.751 1.00 14.31 C ATOM 0 H ALA A 51 25.705 -22.655 -25.572 1.00 21.20 H new ATOM 0 HA ALA A 51 25.090 -23.540 -23.009 1.00 53.04 H new ATOM 0 HB1 ALA A 51 24.075 -25.464 -24.187 1.00 14.31 H new ATOM 0 HB2 ALA A 51 23.697 -23.923 -24.993 1.00 14.31 H new ATOM 0 HB3 ALA A 51 24.939 -25.001 -25.673 1.00 14.31 H new ATOM 804 N GLY A 52 27.049 -24.846 -22.238 1.00 51.33 N ATOM 805 CA GLY A 52 28.077 -25.740 -21.739 1.00 33.30 C ATOM 806 C GLY A 52 29.424 -25.059 -21.608 1.00 25.12 C ATOM 807 O GLY A 52 30.458 -25.722 -21.522 1.00 63.21 O ATOM 0 H GLY A 52 26.689 -24.182 -21.553 1.00 51.33 H new ATOM 0 HA2 GLY A 52 27.774 -26.130 -20.767 1.00 33.30 H new ATOM 0 HA3 GLY A 52 28.169 -26.594 -22.410 1.00 33.30 H new ATOM 811 N LYS A 53 29.415 -23.731 -21.594 1.00 2.55 N ATOM 812 CA LYS A 53 30.646 -22.958 -21.472 1.00 54.45 C ATOM 813 C LYS A 53 30.489 -21.843 -20.443 1.00 20.22 C ATOM 814 O LYS A 53 29.413 -21.654 -19.875 1.00 34.50 O ATOM 815 CB LYS A 53 31.034 -22.363 -22.828 1.00 62.00 C ATOM 816 CG LYS A 53 31.090 -23.387 -23.948 1.00 72.51 C ATOM 817 CD LYS A 53 32.101 -22.995 -25.013 1.00 34.43 C ATOM 818 CE LYS A 53 31.729 -21.678 -25.676 1.00 74.33 C ATOM 819 NZ LYS A 53 32.496 -21.454 -26.933 1.00 32.22 N ATOM 0 H LYS A 53 28.568 -23.167 -21.666 1.00 2.55 H new ATOM 0 HA LYS A 53 31.436 -23.630 -21.136 1.00 54.45 H new ATOM 0 HB2 LYS A 53 30.317 -21.586 -23.093 1.00 62.00 H new ATOM 0 HB3 LYS A 53 32.008 -21.881 -22.739 1.00 62.00 H new ATOM 0 HG2 LYS A 53 31.352 -24.362 -23.538 1.00 72.51 H new ATOM 0 HG3 LYS A 53 30.103 -23.486 -24.401 1.00 72.51 H new ATOM 0 HD2 LYS A 53 33.090 -22.911 -24.564 1.00 34.43 H new ATOM 0 HD3 LYS A 53 32.159 -23.780 -25.767 1.00 34.43 H new ATOM 0 HE2 LYS A 53 30.661 -21.671 -25.896 1.00 74.33 H new ATOM 0 HE3 LYS A 53 31.918 -20.857 -24.984 1.00 74.33 H new ATOM 0 HZ1 LYS A 53 32.214 -20.546 -27.355 1.00 32.22 H new ATOM 0 HZ2 LYS A 53 33.514 -21.435 -26.720 1.00 32.22 H new ATOM 0 HZ3 LYS A 53 32.297 -22.224 -27.603 1.00 32.22 H new ATOM 833 N THR A 54 31.570 -21.105 -20.207 1.00 35.42 N ATOM 834 CA THR A 54 31.552 -20.010 -19.246 1.00 51.41 C ATOM 835 C THR A 54 31.890 -18.684 -19.918 1.00 4.20 C ATOM 836 O THR A 54 33.038 -18.442 -20.295 1.00 20.22 O ATOM 837 CB THR A 54 32.544 -20.256 -18.094 1.00 61.41 C ATOM 838 OG1 THR A 54 33.398 -21.361 -18.411 1.00 63.04 O ATOM 839 CG2 THR A 54 31.805 -20.537 -16.794 1.00 63.23 C ATOM 0 H THR A 54 32.469 -21.246 -20.669 1.00 35.42 H new ATOM 0 HA THR A 54 30.541 -19.962 -18.841 1.00 51.41 H new ATOM 0 HB THR A 54 33.146 -19.357 -17.964 1.00 61.41 H new ATOM 0 HG1 THR A 54 34.027 -21.510 -17.674 1.00 63.04 H new ATOM 0 HG21 THR A 54 32.526 -20.708 -15.995 1.00 63.23 H new ATOM 0 HG22 THR A 54 31.178 -19.683 -16.540 1.00 63.23 H new ATOM 0 HG23 THR A 54 31.181 -21.422 -16.914 1.00 63.23 H new ATOM 847 N LEU A 55 30.886 -17.827 -20.065 1.00 30.01 N ATOM 848 CA LEU A 55 31.078 -16.524 -20.691 1.00 54.53 C ATOM 849 C LEU A 55 31.088 -15.413 -19.646 1.00 34.13 C ATOM 850 O LEU A 55 30.132 -15.253 -18.885 1.00 70.02 O ATOM 851 CB LEU A 55 29.975 -16.262 -21.719 1.00 32.43 C ATOM 852 CG LEU A 55 30.176 -15.047 -22.625 1.00 32.31 C ATOM 853 CD1 LEU A 55 31.283 -15.311 -23.633 1.00 44.42 C ATOM 854 CD2 LEU A 55 28.878 -14.692 -23.336 1.00 2.10 C ATOM 0 H LEU A 55 29.931 -18.011 -19.759 1.00 30.01 H new ATOM 0 HA LEU A 55 32.044 -16.531 -21.196 1.00 54.53 H new ATOM 0 HB2 LEU A 55 29.875 -17.146 -22.348 1.00 32.43 H new ATOM 0 HB3 LEU A 55 29.031 -16.141 -21.187 1.00 32.43 H new ATOM 0 HG LEU A 55 30.471 -14.200 -22.006 1.00 32.31 H new ATOM 0 HD11 LEU A 55 31.412 -14.435 -24.269 1.00 44.42 H new ATOM 0 HD12 LEU A 55 32.214 -15.516 -23.105 1.00 44.42 H new ATOM 0 HD13 LEU A 55 31.017 -16.171 -24.248 1.00 44.42 H new ATOM 0 HD21 LEU A 55 29.039 -13.825 -23.977 1.00 2.10 H new ATOM 0 HD22 LEU A 55 28.553 -15.537 -23.944 1.00 2.10 H new ATOM 0 HD23 LEU A 55 28.110 -14.460 -22.598 1.00 2.10 H new ATOM 866 N LEU A 56 32.172 -14.647 -19.614 1.00 44.04 N ATOM 867 CA LEU A 56 32.306 -13.549 -18.663 1.00 44.24 C ATOM 868 C LEU A 56 32.189 -14.054 -17.229 1.00 5.52 C ATOM 869 O LEU A 56 31.838 -13.300 -16.322 1.00 23.44 O ATOM 870 CB LEU A 56 31.241 -12.484 -18.930 1.00 73.41 C ATOM 871 CG LEU A 56 31.578 -11.452 -20.006 1.00 52.14 C ATOM 872 CD1 LEU A 56 30.417 -10.490 -20.206 1.00 32.12 C ATOM 873 CD2 LEU A 56 32.845 -10.693 -19.639 1.00 54.12 C ATOM 0 H LEU A 56 32.972 -14.766 -20.236 1.00 44.04 H new ATOM 0 HA LEU A 56 33.294 -13.106 -18.793 1.00 44.24 H new ATOM 0 HB2 LEU A 56 30.317 -12.987 -19.214 1.00 73.41 H new ATOM 0 HB3 LEU A 56 31.043 -11.955 -17.998 1.00 73.41 H new ATOM 0 HG LEU A 56 31.752 -11.978 -20.945 1.00 52.14 H new ATOM 0 HD11 LEU A 56 30.676 -9.763 -20.976 1.00 32.12 H new ATOM 0 HD12 LEU A 56 29.532 -11.047 -20.515 1.00 32.12 H new ATOM 0 HD13 LEU A 56 30.210 -9.970 -19.271 1.00 32.12 H new ATOM 0 HD21 LEU A 56 33.070 -9.963 -20.416 1.00 54.12 H new ATOM 0 HD22 LEU A 56 32.699 -10.179 -18.689 1.00 54.12 H new ATOM 0 HD23 LEU A 56 33.675 -11.393 -19.548 1.00 54.12 H new ATOM 885 N GLY A 57 32.489 -15.334 -17.031 1.00 13.11 N ATOM 886 CA GLY A 57 32.413 -15.917 -15.704 1.00 41.11 C ATOM 887 C GLY A 57 31.034 -16.459 -15.387 1.00 33.41 C ATOM 888 O GLY A 57 30.818 -17.039 -14.323 1.00 11.53 O ATOM 0 H GLY A 57 32.783 -15.978 -17.766 1.00 13.11 H new ATOM 0 HA2 GLY A 57 33.144 -16.721 -15.622 1.00 41.11 H new ATOM 0 HA3 GLY A 57 32.683 -15.164 -14.964 1.00 41.11 H new ATOM 892 N GLN A 58 30.098 -16.270 -16.312 1.00 21.23 N ATOM 893 CA GLN A 58 28.732 -16.743 -16.123 1.00 73.23 C ATOM 894 C GLN A 58 28.512 -18.072 -16.839 1.00 41.10 C ATOM 895 O GLN A 58 29.213 -18.394 -17.798 1.00 3.32 O ATOM 896 CB GLN A 58 27.734 -15.703 -16.636 1.00 62.12 C ATOM 897 CG GLN A 58 28.044 -14.286 -16.180 1.00 70.41 C ATOM 898 CD GLN A 58 28.458 -14.220 -14.723 1.00 52.43 C ATOM 899 OE1 GLN A 58 27.692 -14.585 -13.831 1.00 53.40 O ATOM 900 NE2 GLN A 58 29.675 -13.752 -14.474 1.00 43.22 N ATOM 0 H GLN A 58 30.261 -15.793 -17.199 1.00 21.23 H new ATOM 0 HA GLN A 58 28.572 -16.895 -15.056 1.00 73.23 H new ATOM 0 HB2 GLN A 58 27.721 -15.731 -17.726 1.00 62.12 H new ATOM 0 HB3 GLN A 58 26.734 -15.974 -16.298 1.00 62.12 H new ATOM 0 HG2 GLN A 58 28.841 -13.875 -16.799 1.00 70.41 H new ATOM 0 HG3 GLN A 58 27.166 -13.659 -16.333 1.00 70.41 H new ATOM 0 HE21 GLN A 58 30.277 -13.461 -15.244 1.00 43.22 H new ATOM 0 HE22 GLN A 58 30.008 -13.684 -13.512 1.00 43.22 H new ATOM 909 N GLN A 59 27.535 -18.839 -16.366 1.00 40.21 N ATOM 910 CA GLN A 59 27.225 -20.133 -16.961 1.00 74.30 C ATOM 911 C GLN A 59 26.446 -19.962 -18.261 1.00 64.15 C ATOM 912 O GLN A 59 25.571 -19.104 -18.364 1.00 40.14 O ATOM 913 CB GLN A 59 26.421 -20.989 -15.981 1.00 32.23 C ATOM 914 CG GLN A 59 26.226 -22.424 -16.444 1.00 23.14 C ATOM 915 CD GLN A 59 27.397 -23.317 -16.084 1.00 23.21 C ATOM 916 OE1 GLN A 59 27.509 -23.788 -14.951 1.00 42.45 O ATOM 917 NE2 GLN A 59 28.278 -23.556 -17.048 1.00 62.04 N ATOM 0 H GLN A 59 26.945 -18.587 -15.573 1.00 40.21 H new ATOM 0 HA GLN A 59 28.166 -20.636 -17.185 1.00 74.30 H new ATOM 0 HB2 GLN A 59 26.927 -20.993 -15.016 1.00 32.23 H new ATOM 0 HB3 GLN A 59 25.444 -20.530 -15.827 1.00 32.23 H new ATOM 0 HG2 GLN A 59 25.317 -22.826 -15.997 1.00 23.14 H new ATOM 0 HG3 GLN A 59 26.083 -22.437 -17.524 1.00 23.14 H new ATOM 0 HE21 GLN A 59 28.146 -23.145 -17.972 1.00 62.04 H new ATOM 0 HE22 GLN A 59 29.086 -24.150 -16.864 1.00 62.04 H new ATOM 926 N GLY A 60 26.772 -20.785 -19.253 1.00 64.54 N ATOM 927 CA GLY A 60 26.095 -20.708 -20.534 1.00 72.44 C ATOM 928 C GLY A 60 24.899 -21.637 -20.615 1.00 3.22 C ATOM 929 O GLY A 60 24.826 -22.630 -19.890 1.00 54.52 O ATOM 0 H GLY A 60 27.493 -21.504 -19.192 1.00 64.54 H new ATOM 0 HA2 GLY A 60 25.767 -19.683 -20.707 1.00 72.44 H new ATOM 0 HA3 GLY A 60 26.798 -20.956 -21.329 1.00 72.44 H new ATOM 933 N TYR A 61 23.960 -21.314 -21.496 1.00 53.44 N ATOM 934 CA TYR A 61 22.759 -22.124 -21.666 1.00 4.13 C ATOM 935 C TYR A 61 22.303 -22.124 -23.121 1.00 53.54 C ATOM 936 O TYR A 61 22.276 -21.081 -23.775 1.00 35.13 O ATOM 937 CB TYR A 61 21.636 -21.603 -20.767 1.00 63.31 C ATOM 938 CG TYR A 61 21.669 -22.172 -19.367 1.00 34.15 C ATOM 939 CD1 TYR A 61 21.236 -23.468 -19.111 1.00 44.43 C ATOM 940 CD2 TYR A 61 22.133 -21.414 -18.298 1.00 55.04 C ATOM 941 CE1 TYR A 61 21.263 -23.991 -17.833 1.00 44.21 C ATOM 942 CE2 TYR A 61 22.165 -21.930 -17.017 1.00 54.51 C ATOM 943 CZ TYR A 61 21.729 -23.218 -16.789 1.00 74.15 C ATOM 944 OH TYR A 61 21.758 -23.736 -15.515 1.00 65.20 O ATOM 0 H TYR A 61 24.007 -20.497 -22.104 1.00 53.44 H new ATOM 0 HA TYR A 61 22.999 -23.148 -21.380 1.00 4.13 H new ATOM 0 HB2 TYR A 61 21.702 -20.516 -20.710 1.00 63.31 H new ATOM 0 HB3 TYR A 61 20.676 -21.841 -21.224 1.00 63.31 H new ATOM 0 HD1 TYR A 61 20.872 -24.076 -19.926 1.00 44.43 H new ATOM 0 HD2 TYR A 61 22.474 -20.404 -18.472 1.00 55.04 H new ATOM 0 HE1 TYR A 61 20.921 -24.999 -17.652 1.00 44.21 H new ATOM 0 HE2 TYR A 61 22.530 -21.328 -16.198 1.00 54.51 H new ATOM 0 HH TYR A 61 22.114 -23.064 -14.897 1.00 65.20 H new ATOM 954 N ALA A 62 21.944 -23.301 -23.622 1.00 70.14 N ATOM 955 CA ALA A 62 21.486 -23.438 -24.999 1.00 54.23 C ATOM 956 C ALA A 62 20.149 -22.734 -25.205 1.00 52.53 C ATOM 957 O ALA A 62 19.818 -22.318 -26.316 1.00 45.35 O ATOM 958 CB ALA A 62 21.373 -24.908 -25.375 1.00 2.04 C ATOM 0 H ALA A 62 21.961 -24.174 -23.095 1.00 70.14 H new ATOM 0 HA ALA A 62 22.222 -22.964 -25.649 1.00 54.23 H new ATOM 0 HB1 ALA A 62 21.030 -24.995 -26.406 1.00 2.04 H new ATOM 0 HB2 ALA A 62 22.348 -25.385 -25.276 1.00 2.04 H new ATOM 0 HB3 ALA A 62 20.660 -25.399 -24.713 1.00 2.04 H new ATOM 964 N THR A 63 19.382 -22.603 -24.128 1.00 15.15 N ATOM 965 CA THR A 63 18.080 -21.951 -24.191 1.00 13.34 C ATOM 966 C THR A 63 17.522 -21.701 -22.794 1.00 75.22 C ATOM 967 O THR A 63 17.841 -22.423 -21.849 1.00 32.24 O ATOM 968 CB THR A 63 17.068 -22.791 -24.993 1.00 25.54 C ATOM 969 OG1 THR A 63 15.751 -22.252 -24.838 1.00 41.01 O ATOM 970 CG2 THR A 63 17.085 -24.242 -24.533 1.00 43.51 C ATOM 0 H THR A 63 19.640 -22.940 -23.201 1.00 15.15 H new ATOM 0 HA THR A 63 18.229 -20.997 -24.696 1.00 13.34 H new ATOM 0 HB THR A 63 17.353 -22.756 -26.045 1.00 25.54 H new ATOM 0 HG1 THR A 63 15.114 -22.791 -25.352 1.00 41.01 H new ATOM 0 HG21 THR A 63 16.363 -24.816 -25.113 1.00 43.51 H new ATOM 0 HG22 THR A 63 18.082 -24.659 -24.680 1.00 43.51 H new ATOM 0 HG23 THR A 63 16.823 -24.292 -23.476 1.00 43.51 H new ATOM 978 N LEU A 64 16.686 -20.676 -22.671 1.00 1.23 N ATOM 979 CA LEU A 64 16.082 -20.331 -21.388 1.00 71.34 C ATOM 980 C LEU A 64 15.270 -21.499 -20.838 1.00 20.34 C ATOM 981 O LEU A 64 15.015 -21.579 -19.636 1.00 53.24 O ATOM 982 CB LEU A 64 15.187 -19.099 -21.538 1.00 65.42 C ATOM 983 CG LEU A 64 14.209 -19.120 -22.713 1.00 13.52 C ATOM 984 CD1 LEU A 64 12.846 -18.599 -22.281 1.00 64.13 C ATOM 985 CD2 LEU A 64 14.752 -18.299 -23.874 1.00 32.32 C ATOM 0 H LEU A 64 16.411 -20.069 -23.443 1.00 1.23 H new ATOM 0 HA LEU A 64 16.884 -20.106 -20.685 1.00 71.34 H new ATOM 0 HB2 LEU A 64 14.616 -18.975 -20.618 1.00 65.42 H new ATOM 0 HB3 LEU A 64 15.825 -18.221 -21.638 1.00 65.42 H new ATOM 0 HG LEU A 64 14.093 -20.151 -23.047 1.00 13.52 H new ATOM 0 HD11 LEU A 64 12.162 -18.621 -23.130 1.00 64.13 H new ATOM 0 HD12 LEU A 64 12.453 -19.228 -21.482 1.00 64.13 H new ATOM 0 HD13 LEU A 64 12.945 -17.575 -21.921 1.00 64.13 H new ATOM 0 HD21 LEU A 64 14.043 -18.325 -24.701 1.00 32.32 H new ATOM 0 HD22 LEU A 64 14.898 -17.267 -23.553 1.00 32.32 H new ATOM 0 HD23 LEU A 64 15.705 -18.716 -24.200 1.00 32.32 H new ATOM 997 N ALA A 65 14.869 -22.405 -21.724 1.00 40.40 N ATOM 998 CA ALA A 65 14.090 -23.571 -21.326 1.00 41.41 C ATOM 999 C ALA A 65 14.888 -24.470 -20.388 1.00 42.12 C ATOM 1000 O ALA A 65 14.324 -25.321 -19.700 1.00 5.34 O ATOM 1001 CB ALA A 65 13.642 -24.350 -22.554 1.00 21.04 C ATOM 0 H ALA A 65 15.071 -22.354 -22.722 1.00 40.40 H new ATOM 0 HA ALA A 65 13.208 -23.222 -20.789 1.00 41.41 H new ATOM 0 HB1 ALA A 65 13.061 -25.218 -22.242 1.00 21.04 H new ATOM 0 HB2 ALA A 65 13.027 -23.710 -23.186 1.00 21.04 H new ATOM 0 HB3 ALA A 65 14.517 -24.681 -23.114 1.00 21.04 H new ATOM 1007 N ASP A 66 16.202 -24.277 -20.367 1.00 43.31 N ATOM 1008 CA ASP A 66 17.078 -25.071 -19.513 1.00 42.41 C ATOM 1009 C ASP A 66 17.399 -24.325 -18.221 1.00 70.23 C ATOM 1010 O ASP A 66 17.596 -24.937 -17.171 1.00 73.34 O ATOM 1011 CB ASP A 66 18.372 -25.415 -20.253 1.00 11.33 C ATOM 1012 CG ASP A 66 18.471 -26.889 -20.590 1.00 25.55 C ATOM 1013 OD1 ASP A 66 17.607 -27.385 -21.342 1.00 22.40 O ATOM 1014 OD2 ASP A 66 19.413 -27.548 -20.100 1.00 62.10 O ATOM 0 H ASP A 66 16.684 -23.578 -20.932 1.00 43.31 H new ATOM 0 HA ASP A 66 16.558 -25.994 -19.259 1.00 42.41 H new ATOM 0 HB2 ASP A 66 18.428 -24.831 -21.171 1.00 11.33 H new ATOM 0 HB3 ASP A 66 19.226 -25.127 -19.639 1.00 11.33 H new ATOM 1019 N VAL A 67 17.451 -23.000 -18.306 1.00 42.42 N ATOM 1020 CA VAL A 67 17.748 -22.170 -17.144 1.00 62.34 C ATOM 1021 C VAL A 67 16.869 -22.551 -15.958 1.00 64.03 C ATOM 1022 O VAL A 67 15.667 -22.286 -15.934 1.00 63.12 O ATOM 1023 CB VAL A 67 17.550 -20.675 -17.457 1.00 24.12 C ATOM 1024 CG1 VAL A 67 17.836 -19.830 -16.225 1.00 44.41 C ATOM 1025 CG2 VAL A 67 18.434 -20.253 -18.621 1.00 5.15 C ATOM 0 H VAL A 67 17.291 -22.478 -19.167 1.00 42.42 H new ATOM 0 HA VAL A 67 18.793 -22.344 -16.889 1.00 62.34 H new ATOM 0 HB VAL A 67 16.511 -20.516 -17.744 1.00 24.12 H new ATOM 0 HG11 VAL A 67 17.691 -18.777 -16.465 1.00 44.41 H new ATOM 0 HG12 VAL A 67 17.157 -20.116 -15.422 1.00 44.41 H new ATOM 0 HG13 VAL A 67 18.865 -19.991 -15.904 1.00 44.41 H new ATOM 0 HG21 VAL A 67 18.281 -19.194 -18.829 1.00 5.15 H new ATOM 0 HG22 VAL A 67 19.479 -20.426 -18.365 1.00 5.15 H new ATOM 0 HG23 VAL A 67 18.176 -20.837 -19.504 1.00 5.15 H new ATOM 1035 N PRO A 68 17.481 -23.188 -14.949 1.00 4.33 N ATOM 1036 CA PRO A 68 16.774 -23.618 -13.739 1.00 54.13 C ATOM 1037 C PRO A 68 16.346 -22.442 -12.868 1.00 44.51 C ATOM 1038 O PRO A 68 15.214 -22.392 -12.388 1.00 65.43 O ATOM 1039 CB PRO A 68 17.809 -24.476 -13.009 1.00 23.15 C ATOM 1040 CG PRO A 68 19.126 -23.969 -13.486 1.00 62.00 C ATOM 1041 CD PRO A 68 18.912 -23.536 -14.910 1.00 14.00 C ATOM 0 HA PRO A 68 15.851 -24.148 -13.973 1.00 54.13 H new ATOM 0 HB2 PRO A 68 17.714 -24.376 -11.928 1.00 23.15 H new ATOM 0 HB3 PRO A 68 17.683 -25.533 -13.244 1.00 23.15 H new ATOM 0 HG2 PRO A 68 19.469 -23.136 -12.872 1.00 62.00 H new ATOM 0 HG3 PRO A 68 19.889 -24.745 -13.425 1.00 62.00 H new ATOM 0 HD2 PRO A 68 19.540 -22.684 -15.170 1.00 14.00 H new ATOM 0 HD3 PRO A 68 19.151 -24.334 -15.613 1.00 14.00 H new ATOM 1049 N GLU A 69 17.260 -21.496 -12.669 1.00 34.22 N ATOM 1050 CA GLU A 69 16.976 -20.320 -11.855 1.00 33.34 C ATOM 1051 C GLU A 69 15.982 -19.400 -12.557 1.00 13.44 C ATOM 1052 O GLU A 69 16.213 -18.961 -13.683 1.00 51.35 O ATOM 1053 CB GLU A 69 18.268 -19.558 -11.552 1.00 35.22 C ATOM 1054 CG GLU A 69 18.057 -18.319 -10.698 1.00 23.34 C ATOM 1055 CD GLU A 69 17.861 -18.649 -9.231 1.00 3.45 C ATOM 1056 OE1 GLU A 69 17.827 -19.850 -8.892 1.00 73.54 O ATOM 1057 OE2 GLU A 69 17.742 -17.706 -8.421 1.00 3.51 O ATOM 0 H GLU A 69 18.202 -21.522 -13.060 1.00 34.22 H new ATOM 0 HA GLU A 69 16.533 -20.657 -10.918 1.00 33.34 H new ATOM 0 HB2 GLU A 69 18.963 -20.226 -11.043 1.00 35.22 H new ATOM 0 HB3 GLU A 69 18.737 -19.266 -12.492 1.00 35.22 H new ATOM 0 HG2 GLU A 69 18.916 -17.657 -10.806 1.00 23.34 H new ATOM 0 HG3 GLU A 69 17.187 -17.774 -11.064 1.00 23.34 H new ATOM 1064 N LYS A 70 14.874 -19.111 -11.883 1.00 34.34 N ATOM 1065 CA LYS A 70 13.843 -18.243 -12.439 1.00 1.30 C ATOM 1066 C LYS A 70 14.338 -16.803 -12.533 1.00 53.22 C ATOM 1067 O LYS A 70 14.674 -16.184 -11.523 1.00 62.14 O ATOM 1068 CB LYS A 70 12.578 -18.303 -11.580 1.00 73.34 C ATOM 1069 CG LYS A 70 12.807 -17.910 -10.131 1.00 73.52 C ATOM 1070 CD LYS A 70 11.747 -18.504 -9.218 1.00 70.34 C ATOM 1071 CE LYS A 70 12.161 -18.423 -7.757 1.00 60.20 C ATOM 1072 NZ LYS A 70 11.877 -17.083 -7.174 1.00 13.14 N ATOM 0 H LYS A 70 14.667 -19.466 -10.949 1.00 34.34 H new ATOM 0 HA LYS A 70 13.609 -18.596 -13.444 1.00 1.30 H new ATOM 0 HB2 LYS A 70 11.824 -17.644 -12.012 1.00 73.34 H new ATOM 0 HB3 LYS A 70 12.174 -19.315 -11.614 1.00 73.34 H new ATOM 0 HG2 LYS A 70 13.793 -18.248 -9.813 1.00 73.52 H new ATOM 0 HG3 LYS A 70 12.798 -16.824 -10.042 1.00 73.52 H new ATOM 0 HD2 LYS A 70 10.805 -17.975 -9.360 1.00 70.34 H new ATOM 0 HD3 LYS A 70 11.572 -19.545 -9.491 1.00 70.34 H new ATOM 0 HE2 LYS A 70 11.632 -19.187 -7.187 1.00 60.20 H new ATOM 0 HE3 LYS A 70 13.226 -18.639 -7.669 1.00 60.20 H new ATOM 0 HZ1 LYS A 70 12.173 -17.068 -6.177 1.00 13.14 H new ATOM 0 HZ2 LYS A 70 12.401 -16.356 -7.702 1.00 13.14 H new ATOM 0 HZ3 LYS A 70 10.857 -16.887 -7.235 1.00 13.14 H new ATOM 1086 N VAL A 71 14.378 -16.274 -13.752 1.00 60.22 N ATOM 1087 CA VAL A 71 14.829 -14.906 -13.978 1.00 31.14 C ATOM 1088 C VAL A 71 13.762 -13.900 -13.560 1.00 62.11 C ATOM 1089 O VAL A 71 12.566 -14.146 -13.719 1.00 44.21 O ATOM 1090 CB VAL A 71 15.190 -14.671 -15.456 1.00 43.33 C ATOM 1091 CG1 VAL A 71 13.942 -14.711 -16.324 1.00 53.41 C ATOM 1092 CG2 VAL A 71 15.922 -13.347 -15.621 1.00 62.43 C ATOM 0 H VAL A 71 14.103 -16.772 -14.598 1.00 60.22 H new ATOM 0 HA VAL A 71 15.720 -14.761 -13.367 1.00 31.14 H new ATOM 0 HB VAL A 71 15.855 -15.471 -15.781 1.00 43.33 H new ATOM 0 HG11 VAL A 71 14.217 -14.543 -17.365 1.00 53.41 H new ATOM 0 HG12 VAL A 71 13.463 -15.686 -16.228 1.00 53.41 H new ATOM 0 HG13 VAL A 71 13.250 -13.933 -16.002 1.00 53.41 H new ATOM 0 HG21 VAL A 71 16.170 -13.197 -16.672 1.00 62.43 H new ATOM 0 HG22 VAL A 71 15.283 -12.533 -15.279 1.00 62.43 H new ATOM 0 HG23 VAL A 71 16.838 -13.362 -15.031 1.00 62.43 H new ATOM 1102 N ASP A 72 14.203 -12.766 -13.026 1.00 70.40 N ATOM 1103 CA ASP A 72 13.286 -11.721 -12.587 1.00 21.04 C ATOM 1104 C ASP A 72 13.077 -10.684 -13.686 1.00 30.30 C ATOM 1105 O ASP A 72 12.052 -10.005 -13.725 1.00 14.01 O ATOM 1106 CB ASP A 72 13.820 -11.043 -11.324 1.00 15.13 C ATOM 1107 CG ASP A 72 13.359 -11.735 -10.056 1.00 71.31 C ATOM 1108 OD1 ASP A 72 13.974 -12.755 -9.680 1.00 42.33 O ATOM 1109 OD2 ASP A 72 12.382 -11.258 -9.440 1.00 64.34 O ATOM 0 H ASP A 72 15.190 -12.547 -12.887 1.00 70.40 H new ATOM 0 HA ASP A 72 12.325 -12.185 -12.363 1.00 21.04 H new ATOM 0 HB2 ASP A 72 14.910 -11.033 -11.353 1.00 15.13 H new ATOM 0 HB3 ASP A 72 13.492 -10.004 -11.307 1.00 15.13 H new ATOM 1114 N MET A 73 14.056 -10.568 -14.577 1.00 24.03 N ATOM 1115 CA MET A 73 13.979 -9.614 -15.677 1.00 1.12 C ATOM 1116 C MET A 73 14.697 -10.149 -16.912 1.00 0.22 C ATOM 1117 O MET A 73 15.864 -10.536 -16.845 1.00 11.40 O ATOM 1118 CB MET A 73 14.586 -8.273 -15.261 1.00 1.35 C ATOM 1119 CG MET A 73 14.070 -7.094 -16.070 1.00 73.42 C ATOM 1120 SD MET A 73 14.409 -5.508 -15.283 1.00 23.43 S ATOM 1121 CE MET A 73 16.117 -5.253 -15.758 1.00 23.33 C ATOM 0 H MET A 73 14.912 -11.123 -14.559 1.00 24.03 H new ATOM 0 HA MET A 73 12.928 -9.467 -15.925 1.00 1.12 H new ATOM 0 HB2 MET A 73 14.374 -8.099 -14.206 1.00 1.35 H new ATOM 0 HB3 MET A 73 15.670 -8.327 -15.364 1.00 1.35 H new ATOM 0 HG2 MET A 73 14.528 -7.109 -17.059 1.00 73.42 H new ATOM 0 HG3 MET A 73 12.995 -7.201 -16.215 1.00 73.42 H new ATOM 0 HE1 MET A 73 16.696 -4.949 -14.886 1.00 23.33 H new ATOM 0 HE2 MET A 73 16.525 -6.180 -16.160 1.00 23.33 H new ATOM 0 HE3 MET A 73 16.171 -4.474 -16.518 1.00 23.33 H new ATOM 1131 N VAL A 74 13.992 -10.168 -18.039 1.00 22.13 N ATOM 1132 CA VAL A 74 14.563 -10.655 -19.289 1.00 52.10 C ATOM 1133 C VAL A 74 15.029 -9.499 -20.167 1.00 74.13 C ATOM 1134 O VAL A 74 14.229 -8.661 -20.584 1.00 12.02 O ATOM 1135 CB VAL A 74 13.548 -11.506 -20.075 1.00 60.12 C ATOM 1136 CG1 VAL A 74 14.172 -12.031 -21.359 1.00 43.02 C ATOM 1137 CG2 VAL A 74 13.034 -12.651 -19.216 1.00 23.15 C ATOM 0 H VAL A 74 13.025 -9.852 -18.112 1.00 22.13 H new ATOM 0 HA VAL A 74 15.420 -11.276 -19.026 1.00 52.10 H new ATOM 0 HB VAL A 74 12.701 -10.874 -20.343 1.00 60.12 H new ATOM 0 HG11 VAL A 74 13.440 -12.630 -21.901 1.00 43.02 H new ATOM 0 HG12 VAL A 74 14.486 -11.192 -21.980 1.00 43.02 H new ATOM 0 HG13 VAL A 74 15.038 -12.648 -21.117 1.00 43.02 H new ATOM 0 HG21 VAL A 74 12.318 -13.242 -19.787 1.00 23.15 H new ATOM 0 HG22 VAL A 74 13.869 -13.284 -18.916 1.00 23.15 H new ATOM 0 HG23 VAL A 74 12.546 -12.249 -18.328 1.00 23.15 H new ATOM 1147 N ASP A 75 16.327 -9.461 -20.445 1.00 40.24 N ATOM 1148 CA ASP A 75 16.900 -8.408 -21.276 1.00 63.31 C ATOM 1149 C ASP A 75 16.992 -8.855 -22.732 1.00 4.40 C ATOM 1150 O ASP A 75 17.662 -9.837 -23.050 1.00 24.32 O ATOM 1151 CB ASP A 75 18.287 -8.020 -20.760 1.00 72.11 C ATOM 1152 CG ASP A 75 18.255 -6.773 -19.898 1.00 65.31 C ATOM 1153 OD1 ASP A 75 17.205 -6.507 -19.279 1.00 34.14 O ATOM 1154 OD2 ASP A 75 19.282 -6.063 -19.844 1.00 34.34 O ATOM 0 H ASP A 75 17.003 -10.147 -20.107 1.00 40.24 H new ATOM 0 HA ASP A 75 16.245 -7.539 -21.222 1.00 63.31 H new ATOM 0 HB2 ASP A 75 18.701 -8.847 -20.183 1.00 72.11 H new ATOM 0 HB3 ASP A 75 18.954 -7.856 -21.606 1.00 72.11 H new ATOM 1159 N VAL A 76 16.314 -8.126 -23.613 1.00 71.41 N ATOM 1160 CA VAL A 76 16.319 -8.447 -25.035 1.00 70.04 C ATOM 1161 C VAL A 76 16.813 -7.266 -25.863 1.00 55.22 C ATOM 1162 O VAL A 76 16.164 -6.221 -25.922 1.00 50.11 O ATOM 1163 CB VAL A 76 14.916 -8.852 -25.524 1.00 53.15 C ATOM 1164 CG1 VAL A 76 14.977 -9.371 -26.953 1.00 21.42 C ATOM 1165 CG2 VAL A 76 14.308 -9.892 -24.596 1.00 32.13 C ATOM 0 H VAL A 76 15.755 -7.309 -23.367 1.00 71.41 H new ATOM 0 HA VAL A 76 16.998 -9.289 -25.167 1.00 70.04 H new ATOM 0 HB VAL A 76 14.277 -7.969 -25.511 1.00 53.15 H new ATOM 0 HG11 VAL A 76 13.976 -9.652 -27.281 1.00 21.42 H new ATOM 0 HG12 VAL A 76 15.367 -8.591 -27.607 1.00 21.42 H new ATOM 0 HG13 VAL A 76 15.631 -10.242 -26.996 1.00 21.42 H new ATOM 0 HG21 VAL A 76 13.317 -10.166 -24.957 1.00 32.13 H new ATOM 0 HG22 VAL A 76 14.944 -10.777 -24.575 1.00 32.13 H new ATOM 0 HG23 VAL A 76 14.227 -9.479 -23.590 1.00 32.13 H new ATOM 1175 N PHE A 77 17.965 -7.439 -26.502 1.00 53.35 N ATOM 1176 CA PHE A 77 18.546 -6.386 -27.328 1.00 25.54 C ATOM 1177 C PHE A 77 18.971 -6.934 -28.687 1.00 44.21 C ATOM 1178 O PHE A 77 19.606 -6.236 -29.478 1.00 64.21 O ATOM 1179 CB PHE A 77 19.749 -5.760 -26.619 1.00 41.31 C ATOM 1180 CG PHE A 77 19.456 -5.326 -25.211 1.00 43.22 C ATOM 1181 CD1 PHE A 77 18.697 -4.193 -24.965 1.00 43.02 C ATOM 1182 CD2 PHE A 77 19.939 -6.051 -24.134 1.00 63.00 C ATOM 1183 CE1 PHE A 77 18.427 -3.791 -23.671 1.00 21.23 C ATOM 1184 CE2 PHE A 77 19.672 -5.654 -22.837 1.00 70.32 C ATOM 1185 CZ PHE A 77 18.914 -4.523 -22.605 1.00 71.44 C ATOM 0 H PHE A 77 18.515 -8.297 -26.464 1.00 53.35 H new ATOM 0 HA PHE A 77 17.786 -5.620 -27.486 1.00 25.54 H new ATOM 0 HB2 PHE A 77 20.568 -6.479 -26.606 1.00 41.31 H new ATOM 0 HB3 PHE A 77 20.091 -4.898 -27.193 1.00 41.31 H new ATOM 0 HD1 PHE A 77 18.312 -3.618 -25.794 1.00 43.02 H new ATOM 0 HD2 PHE A 77 20.531 -6.937 -24.310 1.00 63.00 H new ATOM 0 HE1 PHE A 77 17.836 -2.905 -23.493 1.00 21.23 H new ATOM 0 HE2 PHE A 77 20.056 -6.228 -22.006 1.00 70.32 H new ATOM 0 HZ PHE A 77 18.702 -4.211 -21.593 1.00 71.44 H new ATOM 1195 N ARG A 78 18.617 -8.187 -28.951 1.00 34.12 N ATOM 1196 CA ARG A 78 18.962 -8.829 -30.213 1.00 61.52 C ATOM 1197 C ARG A 78 18.443 -8.018 -31.396 1.00 41.43 C ATOM 1198 O ARG A 78 19.211 -7.352 -32.089 1.00 40.14 O ATOM 1199 CB ARG A 78 18.388 -10.247 -30.263 1.00 3.35 C ATOM 1200 CG ARG A 78 18.981 -11.181 -29.220 1.00 44.52 C ATOM 1201 CD ARG A 78 18.714 -12.638 -29.561 1.00 71.14 C ATOM 1202 NE ARG A 78 17.319 -12.867 -29.929 1.00 21.23 N ATOM 1203 CZ ARG A 78 16.878 -13.997 -30.470 1.00 33.23 C ATOM 1204 NH1 ARG A 78 17.717 -14.996 -30.705 1.00 4.13 N ATOM 1205 NH2 ARG A 78 15.594 -14.130 -30.776 1.00 75.14 N ATOM 0 H ARG A 78 18.091 -8.778 -28.307 1.00 34.12 H new ATOM 0 HA ARG A 78 20.049 -8.881 -30.279 1.00 61.52 H new ATOM 0 HB2 ARG A 78 17.308 -10.198 -30.123 1.00 3.35 H new ATOM 0 HB3 ARG A 78 18.562 -10.666 -31.254 1.00 3.35 H new ATOM 0 HG2 ARG A 78 20.056 -11.014 -29.149 1.00 44.52 H new ATOM 0 HG3 ARG A 78 18.558 -10.952 -28.242 1.00 44.52 H new ATOM 0 HD2 ARG A 78 19.361 -12.942 -30.384 1.00 71.14 H new ATOM 0 HD3 ARG A 78 18.971 -13.263 -28.706 1.00 71.14 H new ATOM 0 HE ARG A 78 16.647 -12.118 -29.761 1.00 21.23 H new ATOM 0 HH11 ARG A 78 18.705 -14.898 -30.470 1.00 4.13 H new ATOM 0 HH12 ARG A 78 17.375 -15.862 -31.121 1.00 4.13 H new ATOM 0 HH21 ARG A 78 14.945 -13.364 -30.596 1.00 75.14 H new ATOM 0 HH22 ARG A 78 15.256 -14.998 -31.191 1.00 75.14 H new ATOM 1219 N ASN A 79 17.134 -8.079 -31.621 1.00 5.32 N ATOM 1220 CA ASN A 79 16.513 -7.350 -32.721 1.00 32.24 C ATOM 1221 C ASN A 79 15.062 -7.008 -32.395 1.00 71.34 C ATOM 1222 O ASN A 79 14.560 -7.343 -31.322 1.00 42.33 O ATOM 1223 CB ASN A 79 16.578 -8.175 -34.008 1.00 30.04 C ATOM 1224 CG ASN A 79 16.712 -7.308 -35.244 1.00 44.52 C ATOM 1225 OD1 ASN A 79 16.929 -6.099 -35.148 1.00 32.41 O ATOM 1226 ND2 ASN A 79 16.584 -7.922 -36.414 1.00 42.25 N ATOM 0 H ASN A 79 16.483 -8.625 -31.056 1.00 5.32 H new ATOM 0 HA ASN A 79 17.064 -6.420 -32.866 1.00 32.24 H new ATOM 0 HB2 ASN A 79 17.424 -8.860 -33.955 1.00 30.04 H new ATOM 0 HB3 ASN A 79 15.678 -8.785 -34.091 1.00 30.04 H new ATOM 0 HD21 ASN A 79 16.665 -7.390 -37.281 1.00 42.25 H new ATOM 0 HD22 ASN A 79 16.405 -8.926 -36.446 1.00 42.25 H new ATOM 1233 N SER A 80 14.393 -6.340 -33.330 1.00 62.40 N ATOM 1234 CA SER A 80 13.001 -5.950 -33.142 1.00 72.21 C ATOM 1235 C SER A 80 12.074 -7.153 -33.295 1.00 3.31 C ATOM 1236 O SER A 80 11.273 -7.448 -32.409 1.00 25.43 O ATOM 1237 CB SER A 80 12.614 -4.863 -34.146 1.00 52.04 C ATOM 1238 OG SER A 80 11.207 -4.712 -34.217 1.00 54.50 O ATOM 0 H SER A 80 14.793 -6.058 -34.225 1.00 62.40 H new ATOM 0 HA SER A 80 12.893 -5.556 -32.131 1.00 72.21 H new ATOM 0 HB2 SER A 80 13.070 -3.917 -33.856 1.00 52.04 H new ATOM 0 HB3 SER A 80 13.006 -5.117 -35.131 1.00 52.04 H new ATOM 0 HG SER A 80 10.986 -4.010 -34.864 1.00 54.50 H new ATOM 1244 N GLU A 81 12.191 -7.842 -34.426 1.00 14.51 N ATOM 1245 CA GLU A 81 11.363 -9.011 -34.696 1.00 31.34 C ATOM 1246 C GLU A 81 11.638 -10.118 -33.682 1.00 1.05 C ATOM 1247 O GLU A 81 10.753 -10.908 -33.354 1.00 24.21 O ATOM 1248 CB GLU A 81 11.618 -9.528 -36.113 1.00 30.41 C ATOM 1249 CG GLU A 81 11.318 -8.506 -37.197 1.00 23.53 C ATOM 1250 CD GLU A 81 11.149 -9.139 -38.564 1.00 73.23 C ATOM 1251 OE1 GLU A 81 10.365 -10.105 -38.677 1.00 60.12 O ATOM 1252 OE2 GLU A 81 11.799 -8.669 -39.521 1.00 21.31 O ATOM 0 H GLU A 81 12.850 -7.611 -35.169 1.00 14.51 H new ATOM 0 HA GLU A 81 10.318 -8.713 -34.608 1.00 31.34 H new ATOM 0 HB2 GLU A 81 12.660 -9.838 -36.196 1.00 30.41 H new ATOM 0 HB3 GLU A 81 11.007 -10.415 -36.283 1.00 30.41 H new ATOM 0 HG2 GLU A 81 10.409 -7.963 -36.937 1.00 23.53 H new ATOM 0 HG3 GLU A 81 12.126 -7.776 -37.236 1.00 23.53 H new ATOM 1259 N ALA A 82 12.871 -10.168 -33.189 1.00 4.31 N ATOM 1260 CA ALA A 82 13.264 -11.176 -32.212 1.00 14.54 C ATOM 1261 C ALA A 82 12.466 -11.027 -30.920 1.00 63.42 C ATOM 1262 O ALA A 82 12.259 -11.998 -30.193 1.00 20.12 O ATOM 1263 CB ALA A 82 14.755 -11.082 -31.927 1.00 23.31 C ATOM 0 H ALA A 82 13.616 -9.522 -33.450 1.00 4.31 H new ATOM 0 HA ALA A 82 13.047 -12.158 -32.632 1.00 14.54 H new ATOM 0 HB1 ALA A 82 15.034 -11.841 -31.196 1.00 23.31 H new ATOM 0 HB2 ALA A 82 15.313 -11.244 -32.849 1.00 23.31 H new ATOM 0 HB3 ALA A 82 14.988 -10.093 -31.531 1.00 23.31 H new ATOM 1269 N ALA A 83 12.022 -9.806 -30.641 1.00 63.21 N ATOM 1270 CA ALA A 83 11.247 -9.532 -29.438 1.00 13.21 C ATOM 1271 C ALA A 83 10.059 -10.481 -29.322 1.00 23.54 C ATOM 1272 O ALA A 83 9.762 -10.989 -28.240 1.00 64.33 O ATOM 1273 CB ALA A 83 10.771 -8.086 -29.435 1.00 24.55 C ATOM 0 H ALA A 83 12.186 -8.991 -31.232 1.00 63.21 H new ATOM 0 HA ALA A 83 11.893 -9.693 -28.575 1.00 13.21 H new ATOM 0 HB1 ALA A 83 10.193 -7.895 -28.531 1.00 24.55 H new ATOM 0 HB2 ALA A 83 11.633 -7.419 -29.463 1.00 24.55 H new ATOM 0 HB3 ALA A 83 10.146 -7.907 -30.310 1.00 24.55 H new ATOM 1279 N TRP A 84 9.384 -10.716 -30.441 1.00 30.13 N ATOM 1280 CA TRP A 84 8.228 -11.605 -30.463 1.00 53.24 C ATOM 1281 C TRP A 84 8.639 -13.042 -30.162 1.00 44.42 C ATOM 1282 O TRP A 84 8.092 -13.679 -29.263 1.00 40.24 O ATOM 1283 CB TRP A 84 7.532 -11.535 -31.824 1.00 34.14 C ATOM 1284 CG TRP A 84 6.447 -12.557 -31.989 1.00 45.31 C ATOM 1285 CD1 TRP A 84 6.602 -13.865 -32.351 1.00 1.45 C ATOM 1286 CD2 TRP A 84 5.043 -12.354 -31.801 1.00 53.42 C ATOM 1287 NE1 TRP A 84 5.378 -14.487 -32.399 1.00 11.23 N ATOM 1288 CE2 TRP A 84 4.405 -13.582 -32.065 1.00 43.20 C ATOM 1289 CE3 TRP A 84 4.262 -11.255 -31.434 1.00 15.22 C ATOM 1290 CZ2 TRP A 84 3.025 -13.738 -31.974 1.00 31.42 C ATOM 1291 CZ3 TRP A 84 2.892 -11.412 -31.344 1.00 55.30 C ATOM 1292 CH2 TRP A 84 2.284 -12.646 -31.612 1.00 45.22 C ATOM 0 H TRP A 84 9.617 -10.304 -31.345 1.00 30.13 H new ATOM 0 HA TRP A 84 7.534 -11.277 -29.689 1.00 53.24 H new ATOM 0 HB2 TRP A 84 7.107 -10.540 -31.956 1.00 34.14 H new ATOM 0 HB3 TRP A 84 8.274 -11.672 -32.611 1.00 34.14 H new ATOM 0 HD1 TRP A 84 7.547 -14.340 -32.568 1.00 1.45 H new ATOM 0 HE1 TRP A 84 5.219 -15.464 -32.644 1.00 11.23 H new ATOM 0 HE3 TRP A 84 4.721 -10.300 -31.224 1.00 15.22 H new ATOM 0 HZ2 TRP A 84 2.555 -14.688 -32.182 1.00 31.42 H new ATOM 0 HZ3 TRP A 84 2.279 -10.569 -31.062 1.00 55.30 H new ATOM 0 HH2 TRP A 84 1.211 -12.737 -31.531 1.00 45.22 H new ATOM 1303 N GLY A 85 9.608 -13.547 -30.920 1.00 43.51 N ATOM 1304 CA GLY A 85 10.077 -14.905 -30.718 1.00 34.22 C ATOM 1305 C GLY A 85 10.520 -15.159 -29.291 1.00 22.12 C ATOM 1306 O GLY A 85 10.275 -16.232 -28.738 1.00 44.33 O ATOM 0 H GLY A 85 10.076 -13.039 -31.670 1.00 43.51 H new ATOM 0 HA2 GLY A 85 9.281 -15.603 -30.978 1.00 34.22 H new ATOM 0 HA3 GLY A 85 10.909 -15.103 -31.394 1.00 34.22 H new ATOM 1310 N VAL A 86 11.176 -14.170 -28.692 1.00 25.41 N ATOM 1311 CA VAL A 86 11.656 -14.292 -27.320 1.00 42.24 C ATOM 1312 C VAL A 86 10.518 -14.111 -26.322 1.00 62.01 C ATOM 1313 O VAL A 86 10.488 -14.759 -25.276 1.00 53.23 O ATOM 1314 CB VAL A 86 12.759 -13.259 -27.018 1.00 34.51 C ATOM 1315 CG1 VAL A 86 13.225 -13.383 -25.575 1.00 53.13 C ATOM 1316 CG2 VAL A 86 13.925 -13.429 -27.980 1.00 13.40 C ATOM 0 H VAL A 86 11.387 -13.276 -29.135 1.00 25.41 H new ATOM 0 HA VAL A 86 12.070 -15.295 -27.217 1.00 42.24 H new ATOM 0 HB VAL A 86 12.346 -12.260 -27.157 1.00 34.51 H new ATOM 0 HG11 VAL A 86 14.004 -12.646 -25.380 1.00 53.13 H new ATOM 0 HG12 VAL A 86 12.384 -13.208 -24.905 1.00 53.13 H new ATOM 0 HG13 VAL A 86 13.622 -14.384 -25.406 1.00 53.13 H new ATOM 0 HG21 VAL A 86 14.695 -12.692 -27.753 1.00 13.40 H new ATOM 0 HG22 VAL A 86 14.340 -14.431 -27.875 1.00 13.40 H new ATOM 0 HG23 VAL A 86 13.577 -13.286 -29.003 1.00 13.40 H new ATOM 1326 N ALA A 87 9.583 -13.226 -26.653 1.00 23.32 N ATOM 1327 CA ALA A 87 8.441 -12.962 -25.787 1.00 2.24 C ATOM 1328 C ALA A 87 7.670 -14.243 -25.488 1.00 63.20 C ATOM 1329 O ALA A 87 7.502 -14.621 -24.329 1.00 3.32 O ATOM 1330 CB ALA A 87 7.524 -11.928 -26.423 1.00 42.01 C ATOM 0 H ALA A 87 9.594 -12.680 -27.515 1.00 23.32 H new ATOM 0 HA ALA A 87 8.817 -12.567 -24.843 1.00 2.24 H new ATOM 0 HB1 ALA A 87 6.675 -11.741 -25.765 1.00 42.01 H new ATOM 0 HB2 ALA A 87 8.074 -11.000 -26.578 1.00 42.01 H new ATOM 0 HB3 ALA A 87 7.164 -12.301 -27.382 1.00 42.01 H new ATOM 1336 N GLN A 88 7.204 -14.907 -26.541 1.00 13.50 N ATOM 1337 CA GLN A 88 6.449 -16.145 -26.390 1.00 21.00 C ATOM 1338 C GLN A 88 7.212 -17.146 -25.529 1.00 3.24 C ATOM 1339 O GLN A 88 6.634 -17.798 -24.660 1.00 4.02 O ATOM 1340 CB GLN A 88 6.152 -16.756 -27.760 1.00 73.14 C ATOM 1341 CG GLN A 88 7.384 -16.916 -28.636 1.00 2.42 C ATOM 1342 CD GLN A 88 7.047 -17.382 -30.038 1.00 65.33 C ATOM 1343 OE1 GLN A 88 6.101 -16.704 -30.677 1.00 4.23 O flip ATOM 1344 NE2 GLN A 88 7.631 -18.342 -30.543 1.00 31.22 N flip ATOM 0 H GLN A 88 7.336 -14.608 -27.507 1.00 13.50 H new ATOM 0 HA GLN A 88 5.508 -15.909 -25.893 1.00 21.00 H new ATOM 0 HB2 GLN A 88 5.687 -17.732 -27.620 1.00 73.14 H new ATOM 0 HB3 GLN A 88 5.427 -16.129 -28.279 1.00 73.14 H new ATOM 0 HG2 GLN A 88 7.912 -15.964 -28.691 1.00 2.42 H new ATOM 0 HG3 GLN A 88 8.064 -17.631 -28.173 1.00 2.42 H new ATOM 0 HE21 GLN A 88 8.352 -18.835 -30.016 1.00 31.22 H new ATOM 0 HE22 GLN A 88 7.393 -18.644 -31.488 1.00 31.22 H new ATOM 1353 N GLU A 89 8.513 -17.262 -25.776 1.00 42.44 N ATOM 1354 CA GLU A 89 9.354 -18.184 -25.023 1.00 64.44 C ATOM 1355 C GLU A 89 9.386 -17.809 -23.545 1.00 35.14 C ATOM 1356 O GLU A 89 9.353 -18.677 -22.672 1.00 52.44 O ATOM 1357 CB GLU A 89 10.776 -18.191 -25.589 1.00 61.02 C ATOM 1358 CG GLU A 89 10.904 -18.938 -26.906 1.00 33.30 C ATOM 1359 CD GLU A 89 12.218 -19.685 -27.028 1.00 52.11 C ATOM 1360 OE1 GLU A 89 12.436 -20.635 -26.248 1.00 73.43 O ATOM 1361 OE2 GLU A 89 13.028 -19.318 -27.905 1.00 25.14 O ATOM 0 H GLU A 89 9.007 -16.729 -26.492 1.00 42.44 H new ATOM 0 HA GLU A 89 8.928 -19.183 -25.117 1.00 64.44 H new ATOM 0 HB2 GLU A 89 11.106 -17.162 -25.731 1.00 61.02 H new ATOM 0 HB3 GLU A 89 11.447 -18.643 -24.858 1.00 61.02 H new ATOM 0 HG2 GLU A 89 10.079 -19.644 -27.001 1.00 33.30 H new ATOM 0 HG3 GLU A 89 10.815 -18.231 -27.731 1.00 33.30 H new ATOM 1368 N ALA A 90 9.450 -16.510 -23.271 1.00 74.11 N ATOM 1369 CA ALA A 90 9.484 -16.019 -21.899 1.00 73.11 C ATOM 1370 C ALA A 90 8.220 -16.414 -21.143 1.00 54.21 C ATOM 1371 O ALA A 90 8.276 -16.778 -19.968 1.00 41.02 O ATOM 1372 CB ALA A 90 9.660 -14.508 -21.884 1.00 2.04 C ATOM 0 H ALA A 90 9.479 -15.779 -23.981 1.00 74.11 H new ATOM 0 HA ALA A 90 10.335 -16.478 -21.396 1.00 73.11 H new ATOM 0 HB1 ALA A 90 9.684 -14.155 -20.853 1.00 2.04 H new ATOM 0 HB2 ALA A 90 10.595 -14.246 -22.379 1.00 2.04 H new ATOM 0 HB3 ALA A 90 8.828 -14.040 -22.409 1.00 2.04 H new ATOM 1378 N ILE A 91 7.081 -16.338 -21.824 1.00 30.42 N ATOM 1379 CA ILE A 91 5.803 -16.688 -21.216 1.00 24.44 C ATOM 1380 C ILE A 91 5.655 -18.200 -21.079 1.00 5.14 C ATOM 1381 O ILE A 91 4.909 -18.686 -20.230 1.00 74.32 O ATOM 1382 CB ILE A 91 4.621 -16.140 -22.036 1.00 34.43 C ATOM 1383 CG1 ILE A 91 4.708 -14.616 -22.141 1.00 75.43 C ATOM 1384 CG2 ILE A 91 3.300 -16.559 -21.406 1.00 4.43 C ATOM 1385 CD1 ILE A 91 4.292 -14.080 -23.493 1.00 42.22 C ATOM 0 H ILE A 91 7.017 -16.037 -22.797 1.00 30.42 H new ATOM 0 HA ILE A 91 5.789 -16.233 -20.226 1.00 24.44 H new ATOM 0 HB ILE A 91 4.670 -16.558 -23.042 1.00 34.43 H new ATOM 0 HG12 ILE A 91 4.077 -14.170 -21.372 1.00 75.43 H new ATOM 0 HG13 ILE A 91 5.731 -14.303 -21.934 1.00 75.43 H new ATOM 0 HG21 ILE A 91 2.474 -16.164 -21.997 1.00 4.43 H new ATOM 0 HG22 ILE A 91 3.239 -17.647 -21.378 1.00 4.43 H new ATOM 0 HG23 ILE A 91 3.240 -16.166 -20.391 1.00 4.43 H new ATOM 0 HD11 ILE A 91 4.378 -12.993 -23.496 1.00 42.22 H new ATOM 0 HD12 ILE A 91 4.939 -14.498 -24.265 1.00 42.22 H new ATOM 0 HD13 ILE A 91 3.259 -14.362 -23.694 1.00 42.22 H new ATOM 1397 N ALA A 92 6.374 -18.938 -21.919 1.00 10.24 N ATOM 1398 CA ALA A 92 6.326 -20.394 -21.889 1.00 31.31 C ATOM 1399 C ALA A 92 6.977 -20.939 -20.622 1.00 74.30 C ATOM 1400 O ALA A 92 6.384 -21.749 -19.908 1.00 2.22 O ATOM 1401 CB ALA A 92 7.005 -20.970 -23.123 1.00 33.01 C ATOM 0 H ALA A 92 6.996 -18.551 -22.628 1.00 10.24 H new ATOM 0 HA ALA A 92 5.279 -20.698 -21.888 1.00 31.31 H new ATOM 0 HB1 ALA A 92 6.962 -22.059 -23.087 1.00 33.01 H new ATOM 0 HB2 ALA A 92 6.494 -20.616 -24.018 1.00 33.01 H new ATOM 0 HB3 ALA A 92 8.046 -20.649 -23.149 1.00 33.01 H new ATOM 1407 N ILE A 93 8.198 -20.491 -20.350 1.00 35.31 N ATOM 1408 CA ILE A 93 8.928 -20.934 -19.169 1.00 34.53 C ATOM 1409 C ILE A 93 8.325 -20.346 -17.897 1.00 64.13 C ATOM 1410 O ILE A 93 8.368 -20.964 -16.834 1.00 52.22 O ATOM 1411 CB ILE A 93 10.415 -20.544 -19.247 1.00 3.10 C ATOM 1412 CG1 ILE A 93 10.562 -19.024 -19.337 1.00 51.43 C ATOM 1413 CG2 ILE A 93 11.078 -21.217 -20.440 1.00 34.22 C ATOM 1414 CD1 ILE A 93 10.816 -18.361 -18.002 1.00 2.43 C ATOM 0 H ILE A 93 8.702 -19.822 -20.931 1.00 35.31 H new ATOM 0 HA ILE A 93 8.847 -22.021 -19.138 1.00 34.53 H new ATOM 0 HB ILE A 93 10.913 -20.885 -18.339 1.00 3.10 H new ATOM 0 HG12 ILE A 93 11.383 -18.786 -20.014 1.00 51.43 H new ATOM 0 HG13 ILE A 93 9.656 -18.605 -19.775 1.00 51.43 H new ATOM 0 HG21 ILE A 93 12.129 -20.931 -20.481 1.00 34.22 H new ATOM 0 HG22 ILE A 93 11.000 -22.299 -20.337 1.00 34.22 H new ATOM 0 HG23 ILE A 93 10.580 -20.903 -21.358 1.00 34.22 H new ATOM 0 HD11 ILE A 93 10.910 -17.284 -18.142 1.00 2.43 H new ATOM 0 HD12 ILE A 93 9.984 -18.568 -17.329 1.00 2.43 H new ATOM 0 HD13 ILE A 93 11.738 -18.752 -17.571 1.00 2.43 H new ATOM 1426 N GLY A 94 7.762 -19.147 -18.015 1.00 64.23 N ATOM 1427 CA GLY A 94 7.157 -18.496 -16.868 1.00 44.33 C ATOM 1428 C GLY A 94 7.995 -17.345 -16.347 1.00 11.12 C ATOM 1429 O GLY A 94 8.289 -17.273 -15.154 1.00 63.41 O ATOM 0 H GLY A 94 7.714 -18.615 -18.884 1.00 64.23 H new ATOM 0 HA2 GLY A 94 6.169 -18.127 -17.143 1.00 44.33 H new ATOM 0 HA3 GLY A 94 7.014 -19.227 -16.072 1.00 44.33 H new ATOM 1433 N ALA A 95 8.381 -16.442 -17.243 1.00 21.53 N ATOM 1434 CA ALA A 95 9.189 -15.290 -16.866 1.00 44.52 C ATOM 1435 C ALA A 95 8.431 -14.376 -15.910 1.00 14.22 C ATOM 1436 O ALA A 95 7.323 -14.695 -15.477 1.00 1.12 O ATOM 1437 CB ALA A 95 9.620 -14.519 -18.106 1.00 35.03 C ATOM 0 H ALA A 95 8.147 -16.487 -18.235 1.00 21.53 H new ATOM 0 HA ALA A 95 10.078 -15.654 -16.350 1.00 44.52 H new ATOM 0 HB1 ALA A 95 10.223 -13.661 -17.809 1.00 35.03 H new ATOM 0 HB2 ALA A 95 10.208 -15.170 -18.753 1.00 35.03 H new ATOM 0 HB3 ALA A 95 8.738 -14.174 -18.645 1.00 35.03 H new ATOM 1443 N LYS A 96 9.034 -13.238 -15.583 1.00 14.13 N ATOM 1444 CA LYS A 96 8.415 -12.276 -14.678 1.00 22.45 C ATOM 1445 C LYS A 96 8.370 -10.888 -15.307 1.00 51.20 C ATOM 1446 O LYS A 96 7.396 -10.151 -15.143 1.00 64.43 O ATOM 1447 CB LYS A 96 9.183 -12.224 -13.355 1.00 13.43 C ATOM 1448 CG LYS A 96 8.890 -13.396 -12.434 1.00 52.23 C ATOM 1449 CD LYS A 96 9.422 -13.151 -11.032 1.00 42.34 C ATOM 1450 CE LYS A 96 10.778 -13.809 -10.828 1.00 31.21 C ATOM 1451 NZ LYS A 96 10.647 -15.201 -10.315 1.00 13.04 N ATOM 0 H LYS A 96 9.951 -12.959 -15.931 1.00 14.13 H new ATOM 0 HA LYS A 96 7.392 -12.601 -14.486 1.00 22.45 H new ATOM 0 HB2 LYS A 96 10.252 -12.197 -13.566 1.00 13.43 H new ATOM 0 HB3 LYS A 96 8.937 -11.296 -12.838 1.00 13.43 H new ATOM 0 HG2 LYS A 96 7.814 -13.566 -12.391 1.00 52.23 H new ATOM 0 HG3 LYS A 96 9.340 -14.301 -12.842 1.00 52.23 H new ATOM 0 HD2 LYS A 96 9.507 -12.079 -10.856 1.00 42.34 H new ATOM 0 HD3 LYS A 96 8.714 -13.539 -10.300 1.00 42.34 H new ATOM 0 HE2 LYS A 96 11.322 -13.820 -11.772 1.00 31.21 H new ATOM 0 HE3 LYS A 96 11.367 -13.217 -10.127 1.00 31.21 H new ATOM 0 HZ1 LYS A 96 11.141 -15.283 -9.403 1.00 13.04 H new ATOM 0 HZ2 LYS A 96 9.641 -15.430 -10.186 1.00 13.04 H new ATOM 0 HZ3 LYS A 96 11.068 -15.863 -10.997 1.00 13.04 H new ATOM 1465 N THR A 97 9.429 -10.535 -16.029 1.00 70.54 N ATOM 1466 CA THR A 97 9.510 -9.236 -16.684 1.00 12.33 C ATOM 1467 C THR A 97 10.203 -9.344 -18.037 1.00 50.40 C ATOM 1468 O THR A 97 10.950 -10.290 -18.290 1.00 5.53 O ATOM 1469 CB THR A 97 10.265 -8.214 -15.813 1.00 22.33 C ATOM 1470 OG1 THR A 97 10.043 -8.494 -14.426 1.00 25.01 O ATOM 1471 CG2 THR A 97 9.814 -6.796 -16.128 1.00 21.04 C ATOM 0 H THR A 97 10.243 -11.132 -16.175 1.00 70.54 H new ATOM 0 HA THR A 97 8.486 -8.892 -16.830 1.00 12.33 H new ATOM 0 HB THR A 97 11.329 -8.297 -16.034 1.00 22.33 H new ATOM 0 HG1 THR A 97 10.738 -9.103 -14.100 1.00 25.01 H new ATOM 0 HG21 THR A 97 10.361 -6.092 -15.501 1.00 21.04 H new ATOM 0 HG22 THR A 97 10.011 -6.576 -17.177 1.00 21.04 H new ATOM 0 HG23 THR A 97 8.746 -6.702 -15.932 1.00 21.04 H new ATOM 1479 N LEU A 98 9.952 -8.369 -18.904 1.00 74.45 N ATOM 1480 CA LEU A 98 10.553 -8.354 -20.234 1.00 32.45 C ATOM 1481 C LEU A 98 10.983 -6.943 -20.621 1.00 23.25 C ATOM 1482 O LEU A 98 10.185 -6.007 -20.580 1.00 72.21 O ATOM 1483 CB LEU A 98 9.566 -8.900 -21.267 1.00 64.43 C ATOM 1484 CG LEU A 98 10.113 -9.087 -22.683 1.00 73.22 C ATOM 1485 CD1 LEU A 98 11.360 -9.957 -22.664 1.00 32.33 C ATOM 1486 CD2 LEU A 98 9.051 -9.694 -23.589 1.00 31.02 C ATOM 0 H LEU A 98 9.337 -7.579 -18.710 1.00 74.45 H new ATOM 0 HA LEU A 98 11.437 -8.991 -20.214 1.00 32.45 H new ATOM 0 HB2 LEU A 98 9.194 -9.861 -20.912 1.00 64.43 H new ATOM 0 HB3 LEU A 98 8.711 -8.226 -21.315 1.00 64.43 H new ATOM 0 HG LEU A 98 10.384 -8.108 -23.079 1.00 73.22 H new ATOM 0 HD11 LEU A 98 11.734 -10.079 -23.680 1.00 32.33 H new ATOM 0 HD12 LEU A 98 12.125 -9.483 -22.050 1.00 32.33 H new ATOM 0 HD13 LEU A 98 11.115 -10.934 -22.248 1.00 32.33 H new ATOM 0 HD21 LEU A 98 9.458 -9.820 -24.592 1.00 31.02 H new ATOM 0 HD22 LEU A 98 8.749 -10.664 -23.196 1.00 31.02 H new ATOM 0 HD23 LEU A 98 8.185 -9.033 -23.629 1.00 31.02 H new ATOM 1498 N TRP A 99 12.249 -6.799 -20.997 1.00 53.11 N ATOM 1499 CA TRP A 99 12.785 -5.502 -21.394 1.00 14.32 C ATOM 1500 C TRP A 99 13.394 -5.569 -22.790 1.00 4.43 C ATOM 1501 O TRP A 99 14.195 -6.457 -23.087 1.00 14.25 O ATOM 1502 CB TRP A 99 13.835 -5.031 -20.387 1.00 24.43 C ATOM 1503 CG TRP A 99 13.798 -3.554 -20.136 1.00 21.34 C ATOM 1504 CD1 TRP A 99 14.547 -2.598 -20.759 1.00 41.34 C ATOM 1505 CD2 TRP A 99 12.970 -2.866 -19.191 1.00 65.24 C ATOM 1506 NE1 TRP A 99 14.235 -1.356 -20.260 1.00 31.32 N ATOM 1507 CE2 TRP A 99 13.270 -1.494 -19.297 1.00 52.24 C ATOM 1508 CE3 TRP A 99 12.004 -3.275 -18.268 1.00 63.34 C ATOM 1509 CZ2 TRP A 99 12.638 -0.532 -18.514 1.00 51.31 C ATOM 1510 CZ3 TRP A 99 11.378 -2.319 -17.491 1.00 63.35 C ATOM 1511 CH2 TRP A 99 11.696 -0.961 -17.619 1.00 2.54 C ATOM 0 H TRP A 99 12.923 -7.564 -21.035 1.00 53.11 H new ATOM 0 HA TRP A 99 11.963 -4.787 -21.411 1.00 14.32 H new ATOM 0 HB2 TRP A 99 13.685 -5.556 -19.444 1.00 24.43 H new ATOM 0 HB3 TRP A 99 14.825 -5.306 -20.750 1.00 24.43 H new ATOM 0 HD1 TRP A 99 15.278 -2.789 -21.531 1.00 41.34 H new ATOM 0 HE1 TRP A 99 14.654 -0.475 -20.558 1.00 31.32 H new ATOM 0 HE3 TRP A 99 11.751 -4.320 -18.164 1.00 63.34 H new ATOM 0 HZ2 TRP A 99 12.882 0.516 -18.610 1.00 51.31 H new ATOM 0 HZ3 TRP A 99 10.631 -2.624 -16.773 1.00 63.35 H new ATOM 0 HH2 TRP A 99 11.187 -0.238 -16.999 1.00 2.54 H new ATOM 1522 N LEU A 100 13.012 -4.625 -23.643 1.00 64.02 N ATOM 1523 CA LEU A 100 13.523 -4.577 -25.009 1.00 54.10 C ATOM 1524 C LEU A 100 14.468 -3.394 -25.196 1.00 34.20 C ATOM 1525 O LEU A 100 14.845 -2.731 -24.230 1.00 61.34 O ATOM 1526 CB LEU A 100 12.365 -4.481 -26.004 1.00 35.21 C ATOM 1527 CG LEU A 100 11.260 -5.527 -25.851 1.00 32.35 C ATOM 1528 CD1 LEU A 100 10.244 -5.399 -26.975 1.00 31.50 C ATOM 1529 CD2 LEU A 100 11.853 -6.929 -25.822 1.00 15.55 C ATOM 0 H LEU A 100 12.351 -3.883 -23.413 1.00 64.02 H new ATOM 0 HA LEU A 100 14.079 -5.496 -25.195 1.00 54.10 H new ATOM 0 HB2 LEU A 100 11.916 -3.492 -25.914 1.00 35.21 H new ATOM 0 HB3 LEU A 100 12.772 -4.556 -27.012 1.00 35.21 H new ATOM 0 HG LEU A 100 10.748 -5.351 -24.905 1.00 32.35 H new ATOM 0 HD11 LEU A 100 9.466 -6.151 -26.849 1.00 31.50 H new ATOM 0 HD12 LEU A 100 9.796 -4.406 -26.949 1.00 31.50 H new ATOM 0 HD13 LEU A 100 10.741 -5.548 -27.934 1.00 31.50 H new ATOM 0 HD21 LEU A 100 11.052 -7.661 -25.713 1.00 15.55 H new ATOM 0 HD22 LEU A 100 12.391 -7.116 -26.751 1.00 15.55 H new ATOM 0 HD23 LEU A 100 12.541 -7.016 -24.981 1.00 15.55 H new ATOM 1541 N GLN A 101 14.844 -3.135 -26.444 1.00 75.33 N ATOM 1542 CA GLN A 101 15.743 -2.031 -26.757 1.00 61.32 C ATOM 1543 C GLN A 101 14.982 -0.711 -26.823 1.00 24.13 C ATOM 1544 O GLN A 101 13.811 -0.676 -27.201 1.00 53.41 O ATOM 1545 CB GLN A 101 16.457 -2.288 -28.085 1.00 64.42 C ATOM 1546 CG GLN A 101 17.638 -1.363 -28.330 1.00 51.53 C ATOM 1547 CD GLN A 101 18.862 -1.752 -27.525 1.00 12.42 C ATOM 1548 OE1 GLN A 101 18.927 -1.285 -26.283 1.00 33.02 O flip ATOM 1549 NE2 GLN A 101 19.740 -2.464 -28.013 1.00 51.45 N flip ATOM 0 H GLN A 101 14.540 -3.675 -27.255 1.00 75.33 H new ATOM 0 HA GLN A 101 16.484 -1.963 -25.961 1.00 61.32 H new ATOM 0 HB2 GLN A 101 16.805 -3.321 -28.107 1.00 64.42 H new ATOM 0 HB3 GLN A 101 15.742 -2.175 -28.900 1.00 64.42 H new ATOM 0 HG2 GLN A 101 17.888 -1.372 -29.391 1.00 51.53 H new ATOM 0 HG3 GLN A 101 17.352 -0.341 -28.079 1.00 51.53 H new ATOM 0 HE21 GLN A 101 19.649 -2.801 -28.972 1.00 51.45 H new ATOM 0 HE22 GLN A 101 20.558 -2.717 -27.459 1.00 51.45 H new ATOM 1558 N LEU A 102 15.655 0.373 -26.452 1.00 22.43 N ATOM 1559 CA LEU A 102 15.043 1.696 -26.468 1.00 14.41 C ATOM 1560 C LEU A 102 14.915 2.220 -27.895 1.00 4.11 C ATOM 1561 O LEU A 102 15.869 2.174 -28.671 1.00 54.02 O ATOM 1562 CB LEU A 102 15.867 2.672 -25.626 1.00 60.11 C ATOM 1563 CG LEU A 102 15.375 4.119 -25.602 1.00 41.51 C ATOM 1564 CD1 LEU A 102 14.615 4.404 -24.316 1.00 31.30 C ATOM 1565 CD2 LEU A 102 16.543 5.082 -25.757 1.00 42.33 C ATOM 0 H LEU A 102 16.625 0.361 -26.136 1.00 22.43 H new ATOM 0 HA LEU A 102 14.044 1.612 -26.041 1.00 14.41 H new ATOM 0 HB2 LEU A 102 15.895 2.302 -24.601 1.00 60.11 H new ATOM 0 HB3 LEU A 102 16.892 2.664 -25.996 1.00 60.11 H new ATOM 0 HG LEU A 102 14.695 4.265 -26.441 1.00 41.51 H new ATOM 0 HD11 LEU A 102 14.273 5.439 -24.317 1.00 31.30 H new ATOM 0 HD12 LEU A 102 13.755 3.738 -24.246 1.00 31.30 H new ATOM 0 HD13 LEU A 102 15.271 4.240 -23.461 1.00 31.30 H new ATOM 0 HD21 LEU A 102 16.174 6.107 -25.738 1.00 42.33 H new ATOM 0 HD22 LEU A 102 17.247 4.934 -24.938 1.00 42.33 H new ATOM 0 HD23 LEU A 102 17.045 4.895 -26.706 1.00 42.33 H new ATOM 1577 N GLY A 103 13.731 2.720 -28.233 1.00 53.30 N ATOM 1578 CA GLY A 103 13.501 3.248 -29.565 1.00 61.34 C ATOM 1579 C GLY A 103 12.655 2.323 -30.417 1.00 74.22 C ATOM 1580 O GLY A 103 12.093 2.740 -31.430 1.00 64.04 O ATOM 0 H GLY A 103 12.926 2.769 -27.608 1.00 53.30 H new ATOM 0 HA2 GLY A 103 13.009 4.218 -29.488 1.00 61.34 H new ATOM 0 HA3 GLY A 103 14.459 3.415 -30.057 1.00 61.34 H new ATOM 1584 N VAL A 104 12.563 1.062 -30.007 1.00 60.41 N ATOM 1585 CA VAL A 104 11.779 0.074 -30.740 1.00 44.41 C ATOM 1586 C VAL A 104 10.453 -0.203 -30.042 1.00 12.41 C ATOM 1587 O VAL A 104 10.403 -0.356 -28.821 1.00 75.12 O ATOM 1588 CB VAL A 104 12.550 -1.250 -30.897 1.00 44.34 C ATOM 1589 CG1 VAL A 104 11.767 -2.225 -31.763 1.00 13.42 C ATOM 1590 CG2 VAL A 104 13.931 -0.995 -31.483 1.00 23.42 C ATOM 0 H VAL A 104 13.022 0.700 -29.171 1.00 60.41 H new ATOM 0 HA VAL A 104 11.586 0.493 -31.728 1.00 44.41 H new ATOM 0 HB VAL A 104 12.675 -1.697 -29.911 1.00 44.34 H new ATOM 0 HG11 VAL A 104 12.328 -3.154 -31.862 1.00 13.42 H new ATOM 0 HG12 VAL A 104 10.803 -2.431 -31.298 1.00 13.42 H new ATOM 0 HG13 VAL A 104 11.609 -1.789 -32.750 1.00 13.42 H new ATOM 0 HG21 VAL A 104 14.462 -1.941 -31.587 1.00 23.42 H new ATOM 0 HG22 VAL A 104 13.830 -0.526 -32.462 1.00 23.42 H new ATOM 0 HG23 VAL A 104 14.491 -0.335 -30.820 1.00 23.42 H new ATOM 1600 N ILE A 105 9.381 -0.266 -30.824 1.00 53.53 N ATOM 1601 CA ILE A 105 8.053 -0.526 -30.281 1.00 44.21 C ATOM 1602 C ILE A 105 7.384 -1.692 -31.000 1.00 22.31 C ATOM 1603 O ILE A 105 7.024 -1.588 -32.172 1.00 22.24 O ATOM 1604 CB ILE A 105 7.148 0.716 -30.388 1.00 21.44 C ATOM 1605 CG1 ILE A 105 7.778 1.898 -29.648 1.00 34.21 C ATOM 1606 CG2 ILE A 105 5.765 0.412 -29.832 1.00 31.33 C ATOM 1607 CD1 ILE A 105 7.171 3.234 -30.017 1.00 23.40 C ATOM 0 H ILE A 105 9.406 -0.141 -31.836 1.00 53.53 H new ATOM 0 HA ILE A 105 8.186 -0.779 -29.229 1.00 44.21 H new ATOM 0 HB ILE A 105 7.045 0.984 -31.440 1.00 21.44 H new ATOM 0 HG12 ILE A 105 7.671 1.743 -28.574 1.00 34.21 H new ATOM 0 HG13 ILE A 105 8.847 1.922 -29.861 1.00 34.21 H new ATOM 0 HG21 ILE A 105 5.137 1.299 -29.914 1.00 31.33 H new ATOM 0 HG22 ILE A 105 5.317 -0.404 -30.398 1.00 31.33 H new ATOM 0 HG23 ILE A 105 5.849 0.123 -28.784 1.00 31.33 H new ATOM 0 HD11 ILE A 105 7.666 4.026 -29.455 1.00 23.40 H new ATOM 0 HD12 ILE A 105 7.302 3.411 -31.085 1.00 23.40 H new ATOM 0 HD13 ILE A 105 6.108 3.229 -29.778 1.00 23.40 H new ATOM 1619 N ASN A 106 7.219 -2.803 -30.288 1.00 44.33 N ATOM 1620 CA ASN A 106 6.592 -3.990 -30.858 1.00 52.51 C ATOM 1621 C ASN A 106 5.246 -4.265 -30.194 1.00 22.21 C ATOM 1622 O ASN A 106 5.165 -5.017 -29.223 1.00 42.01 O ATOM 1623 CB ASN A 106 7.510 -5.203 -30.699 1.00 73.34 C ATOM 1624 CG ASN A 106 7.306 -6.230 -31.797 1.00 41.42 C ATOM 1625 OD1 ASN A 106 6.179 -6.487 -32.220 1.00 40.24 O ATOM 1626 ND2 ASN A 106 8.399 -6.822 -32.264 1.00 4.35 N ATOM 0 H ASN A 106 7.511 -2.906 -29.316 1.00 44.33 H new ATOM 0 HA ASN A 106 6.423 -3.808 -31.919 1.00 52.51 H new ATOM 0 HB2 ASN A 106 8.549 -4.872 -30.703 1.00 73.34 H new ATOM 0 HB3 ASN A 106 7.327 -5.669 -29.731 1.00 73.34 H new ATOM 0 HD21 ASN A 106 8.324 -7.521 -33.003 1.00 4.35 H new ATOM 0 HD22 ASN A 106 9.313 -6.578 -31.884 1.00 4.35 H new ATOM 1633 N GLU A 107 4.193 -3.652 -30.725 1.00 44.32 N ATOM 1634 CA GLU A 107 2.852 -3.831 -30.183 1.00 74.33 C ATOM 1635 C GLU A 107 2.512 -5.313 -30.050 1.00 65.23 C ATOM 1636 O GLU A 107 2.032 -5.759 -29.009 1.00 1.24 O ATOM 1637 CB GLU A 107 1.820 -3.139 -31.076 1.00 51.04 C ATOM 1638 CG GLU A 107 1.938 -3.512 -32.545 1.00 34.34 C ATOM 1639 CD GLU A 107 1.089 -2.631 -33.440 1.00 72.14 C ATOM 1640 OE1 GLU A 107 -0.102 -2.953 -33.633 1.00 52.55 O ATOM 1641 OE2 GLU A 107 1.617 -1.619 -33.948 1.00 75.42 O ATOM 0 H GLU A 107 4.243 -3.027 -31.530 1.00 44.32 H new ATOM 0 HA GLU A 107 2.826 -3.379 -29.192 1.00 74.33 H new ATOM 0 HB2 GLU A 107 0.820 -3.393 -30.725 1.00 51.04 H new ATOM 0 HB3 GLU A 107 1.930 -2.059 -30.974 1.00 51.04 H new ATOM 0 HG2 GLU A 107 2.981 -3.438 -32.852 1.00 34.34 H new ATOM 0 HG3 GLU A 107 1.640 -4.552 -32.677 1.00 34.34 H new ATOM 1648 N GLN A 108 2.766 -6.070 -31.113 1.00 52.12 N ATOM 1649 CA GLN A 108 2.486 -7.501 -31.116 1.00 3.03 C ATOM 1650 C GLN A 108 3.170 -8.191 -29.940 1.00 64.34 C ATOM 1651 O GLN A 108 2.574 -9.033 -29.269 1.00 53.15 O ATOM 1652 CB GLN A 108 2.948 -8.130 -32.431 1.00 63.02 C ATOM 1653 CG GLN A 108 1.844 -8.864 -33.176 1.00 4.25 C ATOM 1654 CD GLN A 108 2.380 -9.783 -34.256 1.00 11.42 C ATOM 1655 OE1 GLN A 108 3.237 -9.393 -35.049 1.00 64.42 O ATOM 1656 NE2 GLN A 108 1.876 -11.011 -34.292 1.00 51.43 N ATOM 0 H GLN A 108 3.165 -5.716 -31.983 1.00 52.12 H new ATOM 0 HA GLN A 108 1.409 -7.636 -31.017 1.00 3.03 H new ATOM 0 HB2 GLN A 108 3.352 -7.349 -33.075 1.00 63.02 H new ATOM 0 HB3 GLN A 108 3.761 -8.826 -32.225 1.00 63.02 H new ATOM 0 HG2 GLN A 108 1.257 -9.447 -32.466 1.00 4.25 H new ATOM 0 HG3 GLN A 108 1.168 -8.136 -33.626 1.00 4.25 H new ATOM 0 HE21 GLN A 108 1.167 -11.291 -33.614 1.00 51.43 H new ATOM 0 HE22 GLN A 108 2.198 -11.674 -34.997 1.00 51.43 H new ATOM 1665 N ALA A 109 4.426 -7.830 -29.697 1.00 51.43 N ATOM 1666 CA ALA A 109 5.191 -8.413 -28.602 1.00 75.01 C ATOM 1667 C ALA A 109 4.675 -7.926 -27.252 1.00 43.41 C ATOM 1668 O ALA A 109 4.852 -8.591 -26.232 1.00 64.44 O ATOM 1669 CB ALA A 109 6.668 -8.083 -28.756 1.00 30.44 C ATOM 0 H ALA A 109 4.935 -7.136 -30.244 1.00 51.43 H new ATOM 0 HA ALA A 109 5.067 -9.495 -28.640 1.00 75.01 H new ATOM 0 HB1 ALA A 109 7.227 -8.525 -27.931 1.00 30.44 H new ATOM 0 HB2 ALA A 109 7.034 -8.486 -29.700 1.00 30.44 H new ATOM 0 HB3 ALA A 109 6.802 -7.001 -28.747 1.00 30.44 H new ATOM 1675 N ALA A 110 4.038 -6.760 -27.253 1.00 52.53 N ATOM 1676 CA ALA A 110 3.496 -6.184 -26.029 1.00 11.03 C ATOM 1677 C ALA A 110 2.241 -6.927 -25.581 1.00 44.43 C ATOM 1678 O ALA A 110 2.139 -7.357 -24.433 1.00 21.35 O ATOM 1679 CB ALA A 110 3.194 -4.706 -26.229 1.00 33.33 C ATOM 0 H ALA A 110 3.885 -6.195 -28.089 1.00 52.53 H new ATOM 0 HA ALA A 110 4.247 -6.287 -25.245 1.00 11.03 H new ATOM 0 HB1 ALA A 110 2.790 -4.289 -25.307 1.00 33.33 H new ATOM 0 HB2 ALA A 110 4.111 -4.180 -26.494 1.00 33.33 H new ATOM 0 HB3 ALA A 110 2.464 -4.589 -27.030 1.00 33.33 H new ATOM 1685 N VAL A 111 1.288 -7.073 -26.496 1.00 11.31 N ATOM 1686 CA VAL A 111 0.040 -7.764 -26.195 1.00 52.25 C ATOM 1687 C VAL A 111 0.275 -9.254 -25.979 1.00 23.41 C ATOM 1688 O VAL A 111 -0.410 -9.893 -25.178 1.00 43.45 O ATOM 1689 CB VAL A 111 -0.991 -7.577 -27.324 1.00 52.14 C ATOM 1690 CG1 VAL A 111 -0.695 -8.521 -28.480 1.00 11.21 C ATOM 1691 CG2 VAL A 111 -2.402 -7.792 -26.798 1.00 11.41 C ATOM 0 H VAL A 111 1.356 -6.722 -27.451 1.00 11.31 H new ATOM 0 HA VAL A 111 -0.352 -7.324 -25.278 1.00 52.25 H new ATOM 0 HB VAL A 111 -0.917 -6.554 -27.693 1.00 52.14 H new ATOM 0 HG11 VAL A 111 -1.434 -8.374 -29.268 1.00 11.21 H new ATOM 0 HG12 VAL A 111 0.300 -8.314 -28.873 1.00 11.21 H new ATOM 0 HG13 VAL A 111 -0.739 -9.552 -28.128 1.00 11.21 H new ATOM 0 HG21 VAL A 111 -3.117 -7.656 -27.609 1.00 11.41 H new ATOM 0 HG22 VAL A 111 -2.492 -8.803 -26.401 1.00 11.41 H new ATOM 0 HG23 VAL A 111 -2.609 -7.071 -26.007 1.00 11.41 H new ATOM 1701 N LEU A 112 1.249 -9.804 -26.697 1.00 34.24 N ATOM 1702 CA LEU A 112 1.576 -11.221 -26.583 1.00 61.21 C ATOM 1703 C LEU A 112 1.876 -11.596 -25.135 1.00 61.54 C ATOM 1704 O LEU A 112 1.679 -12.740 -24.727 1.00 31.33 O ATOM 1705 CB LEU A 112 2.776 -11.560 -27.469 1.00 23.01 C ATOM 1706 CG LEU A 112 3.465 -12.895 -27.184 1.00 60.21 C ATOM 1707 CD1 LEU A 112 2.524 -14.054 -27.475 1.00 0.02 C ATOM 1708 CD2 LEU A 112 4.740 -13.023 -28.004 1.00 45.12 C ATOM 0 H LEU A 112 1.825 -9.290 -27.364 1.00 34.24 H new ATOM 0 HA LEU A 112 0.712 -11.796 -26.916 1.00 61.21 H new ATOM 0 HB2 LEU A 112 2.447 -11.558 -28.508 1.00 23.01 H new ATOM 0 HB3 LEU A 112 3.514 -10.764 -27.367 1.00 23.01 H new ATOM 0 HG LEU A 112 3.731 -12.926 -26.128 1.00 60.21 H new ATOM 0 HD11 LEU A 112 3.031 -14.996 -27.266 1.00 0.02 H new ATOM 0 HD12 LEU A 112 1.639 -13.971 -26.844 1.00 0.02 H new ATOM 0 HD13 LEU A 112 2.226 -14.027 -28.523 1.00 0.02 H new ATOM 0 HD21 LEU A 112 5.217 -13.979 -27.788 1.00 45.12 H new ATOM 0 HD22 LEU A 112 4.497 -12.970 -29.065 1.00 45.12 H new ATOM 0 HD23 LEU A 112 5.421 -12.212 -27.747 1.00 45.12 H new ATOM 1720 N ALA A 113 2.352 -10.624 -24.364 1.00 60.50 N ATOM 1721 CA ALA A 113 2.675 -10.852 -22.961 1.00 10.41 C ATOM 1722 C ALA A 113 1.453 -10.638 -22.075 1.00 14.33 C ATOM 1723 O ALA A 113 1.204 -11.409 -21.148 1.00 13.23 O ATOM 1724 CB ALA A 113 3.811 -9.938 -22.526 1.00 50.52 C ATOM 0 H ALA A 113 2.522 -9.672 -24.687 1.00 60.50 H new ATOM 0 HA ALA A 113 2.994 -11.888 -22.851 1.00 10.41 H new ATOM 0 HB1 ALA A 113 4.042 -10.119 -21.476 1.00 50.52 H new ATOM 0 HB2 ALA A 113 4.694 -10.141 -23.132 1.00 50.52 H new ATOM 0 HB3 ALA A 113 3.512 -8.898 -22.658 1.00 50.52 H new ATOM 1730 N ARG A 114 0.694 -9.586 -22.365 1.00 74.21 N ATOM 1731 CA ARG A 114 -0.502 -9.270 -21.593 1.00 21.22 C ATOM 1732 C ARG A 114 -1.452 -10.463 -21.549 1.00 70.41 C ATOM 1733 O ARG A 114 -2.145 -10.680 -20.556 1.00 34.10 O ATOM 1734 CB ARG A 114 -1.216 -8.057 -22.192 1.00 73.50 C ATOM 1735 CG ARG A 114 -1.463 -6.940 -21.192 1.00 21.14 C ATOM 1736 CD ARG A 114 -2.491 -5.946 -21.709 1.00 3.11 C ATOM 1737 NE ARG A 114 -1.863 -4.756 -22.278 1.00 73.43 N ATOM 1738 CZ ARG A 114 -2.503 -3.888 -23.054 1.00 63.33 C ATOM 1739 NH1 ARG A 114 -3.781 -4.076 -23.351 1.00 71.15 N ATOM 1740 NH2 ARG A 114 -1.863 -2.829 -23.534 1.00 72.45 N ATOM 0 H ARG A 114 0.886 -8.938 -23.129 1.00 74.21 H new ATOM 0 HA ARG A 114 -0.195 -9.035 -20.574 1.00 21.22 H new ATOM 0 HB2 ARG A 114 -0.622 -7.668 -23.019 1.00 73.50 H new ATOM 0 HB3 ARG A 114 -2.171 -8.377 -22.609 1.00 73.50 H new ATOM 0 HG2 ARG A 114 -1.808 -7.364 -20.249 1.00 21.14 H new ATOM 0 HG3 ARG A 114 -0.527 -6.422 -20.985 1.00 21.14 H new ATOM 0 HD2 ARG A 114 -3.111 -6.426 -22.466 1.00 3.11 H new ATOM 0 HD3 ARG A 114 -3.153 -5.652 -20.894 1.00 3.11 H new ATOM 0 HE ARG A 114 -0.880 -4.582 -22.068 1.00 73.43 H new ATOM 0 HH11 ARG A 114 -4.276 -4.889 -22.984 1.00 71.15 H new ATOM 0 HH12 ARG A 114 -4.270 -3.408 -23.947 1.00 71.15 H new ATOM 0 HH21 ARG A 114 -0.880 -2.681 -23.307 1.00 72.45 H new ATOM 0 HH22 ARG A 114 -2.355 -2.163 -24.130 1.00 72.45 H new ATOM 1754 N GLU A 115 -1.478 -11.233 -22.633 1.00 3.12 N ATOM 1755 CA GLU A 115 -2.344 -12.403 -22.718 1.00 1.13 C ATOM 1756 C GLU A 115 -2.075 -13.364 -21.563 1.00 63.04 C ATOM 1757 O GLU A 115 -2.948 -14.135 -21.168 1.00 20.54 O ATOM 1758 CB GLU A 115 -2.138 -13.122 -24.053 1.00 12.42 C ATOM 1759 CG GLU A 115 -2.941 -12.524 -25.196 1.00 1.31 C ATOM 1760 CD GLU A 115 -2.666 -13.207 -26.522 1.00 13.25 C ATOM 1761 OE1 GLU A 115 -1.663 -13.944 -26.613 1.00 22.31 O ATOM 1762 OE2 GLU A 115 -3.456 -13.004 -27.468 1.00 1.34 O ATOM 0 H GLU A 115 -0.910 -11.067 -23.464 1.00 3.12 H new ATOM 0 HA GLU A 115 -3.378 -12.064 -22.652 1.00 1.13 H new ATOM 0 HB2 GLU A 115 -1.079 -13.095 -24.311 1.00 12.42 H new ATOM 0 HB3 GLU A 115 -2.412 -14.171 -23.937 1.00 12.42 H new ATOM 0 HG2 GLU A 115 -4.004 -12.599 -24.967 1.00 1.31 H new ATOM 0 HG3 GLU A 115 -2.708 -11.463 -25.283 1.00 1.31 H new ATOM 1769 N ALA A 116 -0.859 -13.311 -21.028 1.00 73.24 N ATOM 1770 CA ALA A 116 -0.475 -14.175 -19.919 1.00 64.23 C ATOM 1771 C ALA A 116 -0.348 -13.381 -18.623 1.00 73.44 C ATOM 1772 O ALA A 116 -0.470 -13.934 -17.531 1.00 72.01 O ATOM 1773 CB ALA A 116 0.833 -14.887 -20.234 1.00 34.52 C ATOM 0 H ALA A 116 -0.124 -12.679 -21.345 1.00 73.24 H new ATOM 0 HA ALA A 116 -1.259 -14.920 -19.783 1.00 64.23 H new ATOM 0 HB1 ALA A 116 1.108 -15.529 -19.397 1.00 34.52 H new ATOM 0 HB2 ALA A 116 0.710 -15.493 -21.132 1.00 34.52 H new ATOM 0 HB3 ALA A 116 1.618 -14.149 -20.399 1.00 34.52 H new ATOM 1779 N GLY A 117 -0.102 -12.081 -18.753 1.00 32.14 N ATOM 1780 CA GLY A 117 0.038 -11.233 -17.584 1.00 14.35 C ATOM 1781 C GLY A 117 1.451 -10.712 -17.411 1.00 15.22 C ATOM 1782 O GLY A 117 1.689 -9.790 -16.629 1.00 63.30 O ATOM 0 H GLY A 117 0.003 -11.600 -19.647 1.00 32.14 H new ATOM 0 HA2 GLY A 117 -0.649 -10.391 -17.666 1.00 14.35 H new ATOM 0 HA3 GLY A 117 -0.250 -11.794 -16.695 1.00 14.35 H new ATOM 1786 N LEU A 118 2.390 -11.303 -18.140 1.00 44.31 N ATOM 1787 CA LEU A 118 3.789 -10.894 -18.063 1.00 53.10 C ATOM 1788 C LEU A 118 3.927 -9.388 -18.261 1.00 44.15 C ATOM 1789 O LEU A 118 3.131 -8.769 -18.967 1.00 42.21 O ATOM 1790 CB LEU A 118 4.616 -11.637 -19.113 1.00 44.44 C ATOM 1791 CG LEU A 118 6.033 -12.032 -18.695 1.00 50.10 C ATOM 1792 CD1 LEU A 118 6.007 -13.300 -17.856 1.00 4.23 C ATOM 1793 CD2 LEU A 118 6.918 -12.218 -19.919 1.00 1.12 C ATOM 0 H LEU A 118 2.209 -12.067 -18.791 1.00 44.31 H new ATOM 0 HA LEU A 118 4.163 -11.147 -17.071 1.00 53.10 H new ATOM 0 HB2 LEU A 118 4.077 -12.541 -19.398 1.00 44.44 H new ATOM 0 HB3 LEU A 118 4.682 -11.012 -20.003 1.00 44.44 H new ATOM 0 HG LEU A 118 6.450 -11.228 -18.089 1.00 50.10 H new ATOM 0 HD11 LEU A 118 7.024 -13.566 -17.567 1.00 4.23 H new ATOM 0 HD12 LEU A 118 5.408 -13.132 -16.961 1.00 4.23 H new ATOM 0 HD13 LEU A 118 5.570 -14.112 -18.437 1.00 4.23 H new ATOM 0 HD21 LEU A 118 7.922 -12.499 -19.602 1.00 1.12 H new ATOM 0 HD22 LEU A 118 6.504 -13.003 -20.551 1.00 1.12 H new ATOM 0 HD23 LEU A 118 6.962 -11.285 -20.481 1.00 1.12 H new ATOM 1805 N SER A 119 4.945 -8.805 -17.636 1.00 0.02 N ATOM 1806 CA SER A 119 5.188 -7.371 -17.742 1.00 75.03 C ATOM 1807 C SER A 119 6.118 -7.063 -18.911 1.00 43.22 C ATOM 1808 O SER A 119 7.338 -7.185 -18.798 1.00 21.23 O ATOM 1809 CB SER A 119 5.790 -6.836 -16.442 1.00 34.25 C ATOM 1810 OG SER A 119 4.775 -6.447 -15.532 1.00 32.41 O ATOM 0 H SER A 119 5.615 -9.304 -17.051 1.00 0.02 H new ATOM 0 HA SER A 119 4.232 -6.878 -17.921 1.00 75.03 H new ATOM 0 HB2 SER A 119 6.418 -7.602 -15.986 1.00 34.25 H new ATOM 0 HB3 SER A 119 6.434 -5.984 -16.659 1.00 34.25 H new ATOM 0 HG SER A 119 5.186 -6.110 -14.708 1.00 32.41 H new ATOM 1816 N VAL A 120 5.533 -6.662 -20.036 1.00 23.04 N ATOM 1817 CA VAL A 120 6.309 -6.335 -21.226 1.00 53.22 C ATOM 1818 C VAL A 120 6.660 -4.852 -21.263 1.00 3.24 C ATOM 1819 O VAL A 120 5.780 -3.992 -21.210 1.00 23.52 O ATOM 1820 CB VAL A 120 5.544 -6.702 -22.512 1.00 44.31 C ATOM 1821 CG1 VAL A 120 4.183 -6.024 -22.536 1.00 34.43 C ATOM 1822 CG2 VAL A 120 6.358 -6.324 -23.741 1.00 31.51 C ATOM 0 H VAL A 120 4.525 -6.556 -20.148 1.00 23.04 H new ATOM 0 HA VAL A 120 7.227 -6.921 -21.177 1.00 53.22 H new ATOM 0 HB VAL A 120 5.386 -7.780 -22.525 1.00 44.31 H new ATOM 0 HG11 VAL A 120 3.658 -6.295 -23.452 1.00 34.43 H new ATOM 0 HG12 VAL A 120 3.600 -6.348 -21.674 1.00 34.43 H new ATOM 0 HG13 VAL A 120 4.315 -4.943 -22.500 1.00 34.43 H new ATOM 0 HG21 VAL A 120 5.803 -6.590 -24.641 1.00 31.51 H new ATOM 0 HG22 VAL A 120 6.548 -5.251 -23.736 1.00 31.51 H new ATOM 0 HG23 VAL A 120 7.307 -6.860 -23.728 1.00 31.51 H new ATOM 1832 N VAL A 121 7.953 -4.558 -21.354 1.00 5.23 N ATOM 1833 CA VAL A 121 8.422 -3.178 -21.399 1.00 65.10 C ATOM 1834 C VAL A 121 9.381 -2.961 -22.565 1.00 31.44 C ATOM 1835 O VAL A 121 10.532 -3.395 -22.524 1.00 32.22 O ATOM 1836 CB VAL A 121 9.128 -2.782 -20.088 1.00 53.43 C ATOM 1837 CG1 VAL A 121 9.473 -1.300 -20.095 1.00 21.35 C ATOM 1838 CG2 VAL A 121 8.258 -3.130 -18.890 1.00 2.24 C ATOM 0 H VAL A 121 8.695 -5.257 -21.398 1.00 5.23 H new ATOM 0 HA VAL A 121 7.542 -2.549 -21.534 1.00 65.10 H new ATOM 0 HB VAL A 121 10.057 -3.346 -20.010 1.00 53.43 H new ATOM 0 HG11 VAL A 121 9.971 -1.038 -19.161 1.00 21.35 H new ATOM 0 HG12 VAL A 121 10.136 -1.085 -20.933 1.00 21.35 H new ATOM 0 HG13 VAL A 121 8.559 -0.714 -20.196 1.00 21.35 H new ATOM 0 HG21 VAL A 121 8.771 -2.844 -17.972 1.00 2.24 H new ATOM 0 HG22 VAL A 121 7.312 -2.593 -18.959 1.00 2.24 H new ATOM 0 HG23 VAL A 121 8.066 -4.203 -18.879 1.00 2.24 H new ATOM 1848 N MET A 122 8.898 -2.287 -23.603 1.00 41.10 N ATOM 1849 CA MET A 122 9.713 -2.011 -24.780 1.00 42.13 C ATOM 1850 C MET A 122 10.038 -0.524 -24.880 1.00 52.24 C ATOM 1851 O MET A 122 9.617 0.271 -24.040 1.00 32.14 O ATOM 1852 CB MET A 122 8.991 -2.474 -26.047 1.00 52.51 C ATOM 1853 CG MET A 122 7.694 -1.727 -26.314 1.00 51.10 C ATOM 1854 SD MET A 122 6.240 -2.645 -25.772 1.00 53.11 S ATOM 1855 CE MET A 122 5.166 -1.306 -25.260 1.00 75.23 C ATOM 0 H MET A 122 7.947 -1.922 -23.653 1.00 41.10 H new ATOM 0 HA MET A 122 10.648 -2.563 -24.681 1.00 42.13 H new ATOM 0 HB2 MET A 122 9.656 -2.348 -26.901 1.00 52.51 H new ATOM 0 HB3 MET A 122 8.777 -3.540 -25.965 1.00 52.51 H new ATOM 0 HG2 MET A 122 7.722 -0.764 -25.804 1.00 51.10 H new ATOM 0 HG3 MET A 122 7.611 -1.520 -27.381 1.00 51.10 H new ATOM 0 HE1 MET A 122 4.223 -1.714 -24.898 1.00 75.23 H new ATOM 0 HE2 MET A 122 5.646 -0.739 -24.462 1.00 75.23 H new ATOM 0 HE3 MET A 122 4.975 -0.648 -26.108 1.00 75.23 H new ATOM 1865 N ASP A 123 10.788 -0.155 -25.912 1.00 45.14 N ATOM 1866 CA ASP A 123 11.169 1.237 -26.122 1.00 52.24 C ATOM 1867 C ASP A 123 11.798 1.824 -24.863 1.00 2.41 C ATOM 1868 O ASP A 123 11.589 2.994 -24.540 1.00 63.11 O ATOM 1869 CB ASP A 123 9.950 2.065 -26.532 1.00 14.02 C ATOM 1870 CG ASP A 123 10.333 3.406 -27.126 1.00 64.34 C ATOM 1871 OD1 ASP A 123 11.516 3.790 -27.010 1.00 41.13 O ATOM 1872 OD2 ASP A 123 9.451 4.070 -27.709 1.00 2.32 O ATOM 0 H ASP A 123 11.145 -0.801 -26.617 1.00 45.14 H new ATOM 0 HA ASP A 123 11.907 1.269 -26.924 1.00 52.24 H new ATOM 0 HB2 ASP A 123 9.361 1.504 -27.258 1.00 14.02 H new ATOM 0 HB3 ASP A 123 9.314 2.225 -25.661 1.00 14.02 H new ATOM 1877 N ARG A 124 12.568 1.005 -24.155 1.00 65.31 N ATOM 1878 CA ARG A 124 13.226 1.442 -22.930 1.00 3.22 C ATOM 1879 C ARG A 124 14.532 0.683 -22.713 1.00 1.20 C ATOM 1880 O ARG A 124 14.583 -0.539 -22.858 1.00 52.22 O ATOM 1881 CB ARG A 124 12.301 1.240 -21.729 1.00 31.14 C ATOM 1882 CG ARG A 124 11.211 2.294 -21.615 1.00 24.42 C ATOM 1883 CD ARG A 124 10.888 2.606 -20.162 1.00 44.31 C ATOM 1884 NE ARG A 124 9.598 3.275 -20.020 1.00 73.20 N ATOM 1885 CZ ARG A 124 9.406 4.564 -20.275 1.00 11.21 C ATOM 1886 NH1 ARG A 124 10.416 5.320 -20.683 1.00 52.11 N ATOM 1887 NH2 ARG A 124 8.202 5.100 -20.122 1.00 54.00 N ATOM 0 H ARG A 124 12.752 0.034 -24.409 1.00 65.31 H new ATOM 0 HA ARG A 124 13.455 2.503 -23.029 1.00 3.22 H new ATOM 0 HB2 ARG A 124 11.837 0.256 -21.800 1.00 31.14 H new ATOM 0 HB3 ARG A 124 12.897 1.246 -20.817 1.00 31.14 H new ATOM 0 HG2 ARG A 124 11.530 3.205 -22.122 1.00 24.42 H new ATOM 0 HG3 ARG A 124 10.311 1.945 -22.122 1.00 24.42 H new ATOM 0 HD2 ARG A 124 10.882 1.681 -19.585 1.00 44.31 H new ATOM 0 HD3 ARG A 124 11.672 3.237 -19.744 1.00 44.31 H new ATOM 0 HE ARG A 124 8.800 2.722 -19.708 1.00 73.20 H new ATOM 0 HH11 ARG A 124 11.343 4.912 -20.802 1.00 52.11 H new ATOM 0 HH12 ARG A 124 10.266 6.310 -20.878 1.00 52.11 H new ATOM 0 HH21 ARG A 124 7.423 4.522 -19.808 1.00 54.00 H new ATOM 0 HH22 ARG A 124 8.056 6.090 -20.318 1.00 54.00 H new ATOM 1901 N CYS A 125 15.585 1.415 -22.366 1.00 31.03 N ATOM 1902 CA CYS A 125 16.892 0.811 -22.130 1.00 54.21 C ATOM 1903 C CYS A 125 17.467 1.265 -20.792 1.00 70.34 C ATOM 1904 O CYS A 125 17.526 2.456 -20.486 1.00 32.32 O ATOM 1905 CB CYS A 125 17.855 1.172 -23.262 1.00 32.00 C ATOM 1906 SG CYS A 125 19.367 0.181 -23.288 1.00 42.42 S ATOM 0 H CYS A 125 15.559 2.427 -22.242 1.00 31.03 H new ATOM 0 HA CYS A 125 16.765 -0.271 -22.102 1.00 54.21 H new ATOM 0 HB2 CYS A 125 17.339 1.054 -24.215 1.00 32.00 H new ATOM 0 HB3 CYS A 125 18.124 2.224 -23.174 1.00 32.00 H new ATOM 0 HG CYS A 125 19.430 -0.485 -24.402 1.00 42.42 H new ATOM 1912 N PRO A 126 17.901 0.294 -19.975 1.00 33.12 N ATOM 1913 CA PRO A 126 18.478 0.569 -18.656 1.00 20.12 C ATOM 1914 C PRO A 126 19.846 1.236 -18.749 1.00 40.04 C ATOM 1915 O PRO A 126 20.342 1.796 -17.772 1.00 62.23 O ATOM 1916 CB PRO A 126 18.603 -0.821 -18.026 1.00 52.24 C ATOM 1917 CG PRO A 126 18.699 -1.754 -19.184 1.00 2.41 C ATOM 1918 CD PRO A 126 17.861 -1.147 -20.275 1.00 63.14 C ATOM 0 HA PRO A 126 17.863 1.260 -18.079 1.00 20.12 H new ATOM 0 HB2 PRO A 126 19.485 -0.889 -17.389 1.00 52.24 H new ATOM 0 HB3 PRO A 126 17.740 -1.052 -17.402 1.00 52.24 H new ATOM 0 HG2 PRO A 126 19.734 -1.871 -19.506 1.00 2.41 H new ATOM 0 HG3 PRO A 126 18.334 -2.746 -18.917 1.00 2.41 H new ATOM 0 HD2 PRO A 126 18.269 -1.363 -21.262 1.00 63.14 H new ATOM 0 HD3 PRO A 126 16.841 -1.532 -20.260 1.00 63.14 H new ATOM 1926 N ALA A 127 20.450 1.173 -19.931 1.00 64.24 N ATOM 1927 CA ALA A 127 21.760 1.773 -20.153 1.00 1.13 C ATOM 1928 C ALA A 127 21.712 3.284 -19.953 1.00 42.11 C ATOM 1929 O ALA A 127 22.593 3.863 -19.316 1.00 55.51 O ATOM 1930 CB ALA A 127 22.265 1.439 -21.549 1.00 33.03 C ATOM 0 H ALA A 127 20.053 0.712 -20.750 1.00 64.24 H new ATOM 0 HA ALA A 127 22.451 1.357 -19.420 1.00 1.13 H new ATOM 0 HB1 ALA A 127 23.244 1.894 -21.700 1.00 33.03 H new ATOM 0 HB2 ALA A 127 22.347 0.357 -21.657 1.00 33.03 H new ATOM 0 HB3 ALA A 127 21.567 1.826 -22.291 1.00 33.03 H new ATOM 1936 N ILE A 128 20.680 3.916 -20.502 1.00 2.35 N ATOM 1937 CA ILE A 128 20.519 5.360 -20.383 1.00 34.03 C ATOM 1938 C ILE A 128 19.547 5.714 -19.262 1.00 71.10 C ATOM 1939 O ILE A 128 19.549 6.836 -18.757 1.00 41.24 O ATOM 1940 CB ILE A 128 20.014 5.980 -21.699 1.00 43.31 C ATOM 1941 CG1 ILE A 128 20.927 5.579 -22.860 1.00 11.12 C ATOM 1942 CG2 ILE A 128 19.939 7.495 -21.576 1.00 61.23 C ATOM 1943 CD1 ILE A 128 20.385 5.970 -24.217 1.00 64.21 C ATOM 0 H ILE A 128 19.944 3.451 -21.033 1.00 2.35 H new ATOM 0 HA ILE A 128 21.502 5.769 -20.151 1.00 34.03 H new ATOM 0 HB ILE A 128 19.012 5.601 -21.901 1.00 43.31 H new ATOM 0 HG12 ILE A 128 21.904 6.042 -22.720 1.00 11.12 H new ATOM 0 HG13 ILE A 128 21.080 4.500 -22.836 1.00 11.12 H new ATOM 0 HG21 ILE A 128 19.580 7.919 -22.514 1.00 61.23 H new ATOM 0 HG22 ILE A 128 19.253 7.761 -20.772 1.00 61.23 H new ATOM 0 HG23 ILE A 128 20.930 7.892 -21.354 1.00 61.23 H new ATOM 0 HD11 ILE A 128 21.083 5.655 -24.992 1.00 64.21 H new ATOM 0 HD12 ILE A 128 19.422 5.486 -24.377 1.00 64.21 H new ATOM 0 HD13 ILE A 128 20.259 7.052 -24.260 1.00 64.21 H new