USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 707 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 141:sc= -4.49! (180deg=-9.01!) USER MOD Single : A 21 ASN : amide:sc= -1.46 K(o=-1.5,f=-7.1!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= -0.64 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 67:sc= 1.28 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 110:sc= -1.13 USER MOD Single : A 56 THR OG1 : rot 117:sc= 0.102 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.562 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 152:sc= -1.01 (180deg=-2.45!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -109:sc= -0.995 (180deg=-3.69!) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -32:sc= 0.0323 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N LEU A 5 9.499 -6.750 -7.869 1.00 0.00 N ATOM 76 CA LEU A 5 10.482 -6.879 -8.938 1.00 0.00 C ATOM 77 C LEU A 5 11.019 -8.305 -9.016 1.00 0.00 C ATOM 78 O LEU A 5 11.184 -8.974 -7.995 1.00 0.00 O ATOM 79 CB LEU A 5 11.636 -5.899 -8.718 1.00 0.00 C ATOM 80 CG LEU A 5 12.279 -5.920 -7.331 1.00 0.00 C ATOM 81 CD1 LEU A 5 13.758 -5.580 -7.423 1.00 0.00 C ATOM 82 CD2 LEU A 5 11.565 -4.953 -6.398 1.00 0.00 C ATOM 0 HA LEU A 5 9.989 -6.644 -9.881 1.00 0.00 H new ATOM 0 HB2 LEU A 5 12.409 -6.107 -9.458 1.00 0.00 H new ATOM 0 HB3 LEU A 5 11.272 -4.890 -8.912 1.00 0.00 H new ATOM 0 HG LEU A 5 12.183 -6.926 -6.922 1.00 0.00 H new ATOM 0 HD11 LEU A 5 14.199 -5.600 -6.426 1.00 0.00 H new ATOM 0 HD12 LEU A 5 14.261 -6.311 -8.057 1.00 0.00 H new ATOM 0 HD13 LEU A 5 13.877 -4.585 -7.852 1.00 0.00 H new ATOM 0 HD21 LEU A 5 12.036 -4.981 -5.415 1.00 0.00 H new ATOM 0 HD22 LEU A 5 11.629 -3.943 -6.802 1.00 0.00 H new ATOM 0 HD23 LEU A 5 10.518 -5.242 -6.307 1.00 0.00 H new ATOM 94 N LYS A 6 11.292 -8.764 -10.232 1.00 0.00 N ATOM 95 CA LYS A 6 11.813 -10.109 -10.444 1.00 0.00 C ATOM 96 C LYS A 6 13.112 -10.069 -11.243 1.00 0.00 C ATOM 97 O LYS A 6 13.302 -9.201 -12.095 1.00 0.00 O ATOM 98 CB LYS A 6 10.779 -10.970 -11.173 1.00 0.00 C ATOM 99 CG LYS A 6 10.695 -10.688 -12.663 1.00 0.00 C ATOM 100 CD LYS A 6 9.298 -10.948 -13.202 1.00 0.00 C ATOM 101 CE LYS A 6 8.387 -9.750 -12.989 1.00 0.00 C ATOM 102 NZ LYS A 6 7.168 -9.821 -13.843 1.00 0.00 N ATOM 0 H LYS A 6 11.161 -8.224 -11.087 1.00 0.00 H new ATOM 0 HA LYS A 6 12.020 -10.550 -9.469 1.00 0.00 H new ATOM 0 HB2 LYS A 6 11.024 -12.022 -11.024 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.799 -10.804 -10.725 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.973 -9.651 -12.854 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.413 -11.313 -13.194 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.354 -11.179 -14.266 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.873 -11.822 -12.708 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.093 -9.699 -11.941 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.934 -8.834 -13.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.573 -8.986 -13.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.447 -9.844 -14.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 6.632 -10.682 -13.613 1.00 0.00 H new ATOM 116 N VAL A 7 14.003 -11.015 -10.964 1.00 0.00 N ATOM 117 CA VAL A 7 15.282 -11.090 -11.659 1.00 0.00 C ATOM 118 C VAL A 7 15.352 -12.323 -12.552 1.00 0.00 C ATOM 119 O VAL A 7 15.046 -13.435 -12.120 1.00 0.00 O ATOM 120 CB VAL A 7 16.459 -11.122 -10.665 1.00 0.00 C ATOM 121 CG1 VAL A 7 16.648 -9.759 -10.016 1.00 0.00 C ATOM 122 CG2 VAL A 7 16.238 -12.197 -9.612 1.00 0.00 C ATOM 0 H VAL A 7 13.862 -11.740 -10.261 1.00 0.00 H new ATOM 0 HA VAL A 7 15.360 -10.195 -12.276 1.00 0.00 H new ATOM 0 HB VAL A 7 17.369 -11.365 -11.214 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.484 -9.801 -9.317 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.856 -9.015 -10.785 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.740 -9.482 -9.480 1.00 0.00 H new ATOM 0 HG21 VAL A 7 17.079 -12.205 -8.919 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.319 -11.987 -9.065 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.158 -13.170 -10.097 1.00 0.00 H new ATOM 132 N LYS A 8 15.756 -12.120 -13.801 1.00 0.00 N ATOM 133 CA LYS A 8 15.868 -13.215 -14.758 1.00 0.00 C ATOM 134 C LYS A 8 17.177 -13.126 -15.535 1.00 0.00 C ATOM 135 O LYS A 8 17.750 -12.047 -15.685 1.00 0.00 O ATOM 136 CB LYS A 8 14.684 -13.195 -15.727 1.00 0.00 C ATOM 137 CG LYS A 8 14.717 -12.033 -16.704 1.00 0.00 C ATOM 138 CD LYS A 8 13.327 -11.467 -16.944 1.00 0.00 C ATOM 139 CE LYS A 8 12.711 -12.025 -18.218 1.00 0.00 C ATOM 140 NZ LYS A 8 11.719 -11.086 -18.812 1.00 0.00 N ATOM 0 H LYS A 8 16.012 -11.206 -14.175 1.00 0.00 H new ATOM 0 HA LYS A 8 15.859 -14.153 -14.203 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.668 -14.130 -16.288 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.758 -13.151 -15.154 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.368 -11.249 -16.317 1.00 0.00 H new ATOM 0 HG3 LYS A 8 15.145 -12.364 -17.650 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.685 -11.702 -16.095 1.00 0.00 H new ATOM 0 HD3 LYS A 8 13.382 -10.380 -17.011 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.499 -12.228 -18.944 1.00 0.00 H new ATOM 0 HE3 LYS A 8 12.225 -12.976 -18.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 11.322 -11.503 -19.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 10.954 -10.912 -18.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.188 -10.187 -19.044 1.00 0.00 H new ATOM 154 N VAL A 9 17.645 -14.268 -16.030 1.00 0.00 N ATOM 155 CA VAL A 9 18.885 -14.319 -16.794 1.00 0.00 C ATOM 156 C VAL A 9 18.766 -13.521 -18.088 1.00 0.00 C ATOM 157 O VAL A 9 17.823 -13.704 -18.857 1.00 0.00 O ATOM 158 CB VAL A 9 19.277 -15.769 -17.133 1.00 0.00 C ATOM 159 CG1 VAL A 9 20.570 -15.801 -17.933 1.00 0.00 C ATOM 160 CG2 VAL A 9 19.405 -16.597 -15.863 1.00 0.00 C ATOM 0 H VAL A 9 17.183 -15.170 -15.915 1.00 0.00 H new ATOM 0 HA VAL A 9 19.661 -13.878 -16.168 1.00 0.00 H new ATOM 0 HB VAL A 9 18.489 -16.206 -17.746 1.00 0.00 H new ATOM 0 HG11 VAL A 9 20.830 -16.834 -18.163 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.437 -15.245 -18.861 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.370 -15.347 -17.349 1.00 0.00 H new ATOM 0 HG21 VAL A 9 19.683 -17.619 -16.121 1.00 0.00 H new ATOM 0 HG22 VAL A 9 20.173 -16.164 -15.222 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.452 -16.603 -15.335 1.00 0.00 H new ATOM 170 N GLU A 10 19.730 -12.635 -18.321 1.00 0.00 N ATOM 171 CA GLU A 10 19.733 -11.808 -19.522 1.00 0.00 C ATOM 172 C GLU A 10 20.868 -12.212 -20.458 1.00 0.00 C ATOM 173 O GLU A 10 20.771 -12.052 -21.675 1.00 0.00 O ATOM 174 CB GLU A 10 19.865 -10.330 -19.150 1.00 0.00 C ATOM 175 CG GLU A 10 21.269 -9.932 -18.728 1.00 0.00 C ATOM 176 CD GLU A 10 22.063 -9.306 -19.858 1.00 0.00 C ATOM 177 OE1 GLU A 10 21.623 -9.411 -21.022 1.00 0.00 O ATOM 178 OE2 GLU A 10 23.124 -8.710 -19.578 1.00 0.00 O ATOM 0 H GLU A 10 20.518 -12.472 -17.694 1.00 0.00 H new ATOM 0 HA GLU A 10 18.786 -11.961 -20.040 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.565 -9.721 -20.003 1.00 0.00 H new ATOM 0 HB3 GLU A 10 19.173 -10.105 -18.338 1.00 0.00 H new ATOM 0 HG2 GLU A 10 21.209 -9.228 -17.898 1.00 0.00 H new ATOM 0 HG3 GLU A 10 21.797 -10.812 -18.362 1.00 0.00 H new ATOM 185 N ASP A 11 21.944 -12.736 -19.881 1.00 0.00 N ATOM 186 CA ASP A 11 23.099 -13.164 -20.663 1.00 0.00 C ATOM 187 C ASP A 11 24.049 -14.003 -19.814 1.00 0.00 C ATOM 188 O ASP A 11 24.729 -13.485 -18.929 1.00 0.00 O ATOM 189 CB ASP A 11 23.837 -11.950 -21.228 1.00 0.00 C ATOM 190 CG ASP A 11 25.083 -12.337 -22.001 1.00 0.00 C ATOM 191 OD1 ASP A 11 24.944 -12.929 -23.092 1.00 0.00 O ATOM 192 OD2 ASP A 11 26.196 -12.048 -21.515 1.00 0.00 O ATOM 0 H ASP A 11 22.041 -12.875 -18.875 1.00 0.00 H new ATOM 0 HA ASP A 11 22.740 -13.778 -21.489 1.00 0.00 H new ATOM 0 HB2 ASP A 11 23.166 -11.393 -21.882 1.00 0.00 H new ATOM 0 HB3 ASP A 11 24.112 -11.283 -20.411 1.00 0.00 H new ATOM 197 N PHE A 12 24.089 -15.303 -20.090 1.00 0.00 N ATOM 198 CA PHE A 12 24.954 -16.215 -19.351 1.00 0.00 C ATOM 199 C PHE A 12 26.141 -16.651 -20.204 1.00 0.00 C ATOM 200 O PHE A 12 26.068 -16.655 -21.432 1.00 0.00 O ATOM 201 CB PHE A 12 24.163 -17.442 -18.892 1.00 0.00 C ATOM 202 CG PHE A 12 23.551 -18.218 -20.023 1.00 0.00 C ATOM 203 CD1 PHE A 12 22.286 -17.902 -20.493 1.00 0.00 C ATOM 204 CD2 PHE A 12 24.240 -19.263 -20.616 1.00 0.00 C ATOM 205 CE1 PHE A 12 21.720 -18.614 -21.534 1.00 0.00 C ATOM 206 CE2 PHE A 12 23.679 -19.978 -21.657 1.00 0.00 C ATOM 207 CZ PHE A 12 22.418 -19.654 -22.116 1.00 0.00 C ATOM 0 H PHE A 12 23.532 -15.748 -20.820 1.00 0.00 H new ATOM 0 HA PHE A 12 25.333 -15.687 -18.476 1.00 0.00 H new ATOM 0 HB2 PHE A 12 24.823 -18.099 -18.326 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.373 -17.122 -18.212 1.00 0.00 H new ATOM 0 HD1 PHE A 12 21.736 -17.090 -20.041 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.227 -19.522 -20.261 1.00 0.00 H new ATOM 0 HE1 PHE A 12 20.734 -18.357 -21.892 1.00 0.00 H new ATOM 0 HE2 PHE A 12 24.227 -20.790 -22.111 1.00 0.00 H new ATOM 0 HZ PHE A 12 21.978 -20.213 -22.929 1.00 0.00 H new ATOM 217 N GLY A 13 27.235 -17.016 -19.543 1.00 0.00 N ATOM 218 CA GLY A 13 28.423 -17.448 -20.256 1.00 0.00 C ATOM 219 C GLY A 13 29.451 -18.082 -19.340 1.00 0.00 C ATOM 220 O GLY A 13 29.283 -18.094 -18.120 1.00 0.00 O ATOM 0 H GLY A 13 27.320 -17.020 -18.527 1.00 0.00 H new ATOM 0 HA2 GLY A 13 28.139 -18.163 -21.029 1.00 0.00 H new ATOM 0 HA3 GLY A 13 28.870 -16.593 -20.762 1.00 0.00 H new ATOM 224 N PHE A 14 30.518 -18.612 -19.928 1.00 0.00 N ATOM 225 CA PHE A 14 31.577 -19.253 -19.156 1.00 0.00 C ATOM 226 C PHE A 14 32.951 -18.887 -19.709 1.00 0.00 C ATOM 227 O PHE A 14 33.145 -18.817 -20.923 1.00 0.00 O ATOM 228 CB PHE A 14 31.398 -20.773 -19.170 1.00 0.00 C ATOM 229 CG PHE A 14 32.565 -21.519 -18.590 1.00 0.00 C ATOM 230 CD1 PHE A 14 33.622 -21.911 -19.394 1.00 0.00 C ATOM 231 CD2 PHE A 14 32.605 -21.828 -17.240 1.00 0.00 C ATOM 232 CE1 PHE A 14 34.697 -22.598 -18.863 1.00 0.00 C ATOM 233 CE2 PHE A 14 33.677 -22.515 -16.703 1.00 0.00 C ATOM 234 CZ PHE A 14 34.725 -22.900 -17.516 1.00 0.00 C ATOM 0 H PHE A 14 30.673 -18.611 -20.936 1.00 0.00 H new ATOM 0 HA PHE A 14 31.511 -18.895 -18.129 1.00 0.00 H new ATOM 0 HB2 PHE A 14 30.498 -21.030 -18.611 1.00 0.00 H new ATOM 0 HB3 PHE A 14 31.240 -21.103 -20.197 1.00 0.00 H new ATOM 0 HD1 PHE A 14 33.606 -21.677 -20.448 1.00 0.00 H new ATOM 0 HD2 PHE A 14 31.789 -21.528 -16.600 1.00 0.00 H new ATOM 0 HE1 PHE A 14 35.515 -22.899 -19.501 1.00 0.00 H new ATOM 0 HE2 PHE A 14 33.695 -22.751 -15.649 1.00 0.00 H new ATOM 0 HZ PHE A 14 35.565 -23.436 -17.099 1.00 0.00 H new ATOM 244 N ARG A 15 33.901 -18.653 -18.809 1.00 0.00 N ATOM 245 CA ARG A 15 35.257 -18.292 -19.206 1.00 0.00 C ATOM 246 C ARG A 15 36.245 -19.390 -18.824 1.00 0.00 C ATOM 247 O ARG A 15 36.600 -19.540 -17.655 1.00 0.00 O ATOM 248 CB ARG A 15 35.667 -16.972 -18.552 1.00 0.00 C ATOM 249 CG ARG A 15 36.216 -15.950 -19.535 1.00 0.00 C ATOM 250 CD ARG A 15 36.121 -14.537 -18.981 1.00 0.00 C ATOM 251 NE ARG A 15 36.861 -13.579 -19.798 1.00 0.00 N ATOM 252 CZ ARG A 15 36.445 -13.147 -20.983 1.00 0.00 C ATOM 253 NH1 ARG A 15 35.300 -13.587 -21.487 1.00 0.00 N ATOM 254 NH2 ARG A 15 37.174 -12.274 -21.666 1.00 0.00 N ATOM 0 H ARG A 15 33.757 -18.707 -17.801 1.00 0.00 H new ATOM 0 HA ARG A 15 35.273 -18.173 -20.289 1.00 0.00 H new ATOM 0 HB2 ARG A 15 34.803 -16.545 -18.042 1.00 0.00 H new ATOM 0 HB3 ARG A 15 36.421 -17.172 -17.790 1.00 0.00 H new ATOM 0 HG2 ARG A 15 37.256 -16.184 -19.762 1.00 0.00 H new ATOM 0 HG3 ARG A 15 35.664 -16.012 -20.473 1.00 0.00 H new ATOM 0 HD2 ARG A 15 35.074 -14.237 -18.929 1.00 0.00 H new ATOM 0 HD3 ARG A 15 36.508 -14.520 -17.962 1.00 0.00 H new ATOM 0 HE ARG A 15 37.746 -13.222 -19.439 1.00 0.00 H new ATOM 0 HH11 ARG A 15 34.737 -14.258 -20.964 1.00 0.00 H new ATOM 0 HH12 ARG A 15 34.982 -13.254 -22.397 1.00 0.00 H new ATOM 0 HH21 ARG A 15 38.055 -11.934 -21.281 1.00 0.00 H new ATOM 0 HH22 ARG A 15 36.853 -11.943 -22.576 1.00 0.00 H new ATOM 268 N GLU A 16 36.685 -20.155 -19.818 1.00 0.00 N ATOM 269 CA GLU A 16 37.632 -21.240 -19.585 1.00 0.00 C ATOM 270 C GLU A 16 38.970 -20.698 -19.092 1.00 0.00 C ATOM 271 O GLU A 16 39.722 -21.396 -18.411 1.00 0.00 O ATOM 272 CB GLU A 16 37.839 -22.050 -20.867 1.00 0.00 C ATOM 273 CG GLU A 16 38.654 -21.321 -21.922 1.00 0.00 C ATOM 274 CD GLU A 16 38.616 -22.016 -23.270 1.00 0.00 C ATOM 275 OE1 GLU A 16 38.981 -23.208 -23.334 1.00 0.00 O ATOM 276 OE2 GLU A 16 38.223 -21.365 -24.261 1.00 0.00 O ATOM 0 H GLU A 16 36.401 -20.044 -20.791 1.00 0.00 H new ATOM 0 HA GLU A 16 37.217 -21.891 -18.815 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.337 -22.987 -20.618 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.866 -22.308 -21.285 1.00 0.00 H new ATOM 0 HG2 GLU A 16 38.276 -20.305 -22.030 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.688 -21.242 -21.587 1.00 0.00 H new ATOM 283 N ASP A 17 39.260 -19.449 -19.440 1.00 0.00 N ATOM 284 CA ASP A 17 40.507 -18.812 -19.032 1.00 0.00 C ATOM 285 C ASP A 17 40.540 -18.598 -17.522 1.00 0.00 C ATOM 286 O ASP A 17 41.610 -18.521 -16.920 1.00 0.00 O ATOM 287 CB ASP A 17 40.680 -17.474 -19.752 1.00 0.00 C ATOM 288 CG ASP A 17 41.328 -17.629 -21.114 1.00 0.00 C ATOM 289 OD1 ASP A 17 41.496 -18.782 -21.564 1.00 0.00 O ATOM 290 OD2 ASP A 17 41.668 -16.597 -21.730 1.00 0.00 O ATOM 0 H ASP A 17 38.649 -18.858 -20.003 1.00 0.00 H new ATOM 0 HA ASP A 17 41.330 -19.473 -19.305 1.00 0.00 H new ATOM 0 HB2 ASP A 17 39.706 -16.999 -19.868 1.00 0.00 H new ATOM 0 HB3 ASP A 17 41.288 -16.810 -19.137 1.00 0.00 H new ATOM 295 N MET A 18 39.361 -18.503 -16.917 1.00 0.00 N ATOM 296 CA MET A 18 39.255 -18.299 -15.477 1.00 0.00 C ATOM 297 C MET A 18 38.903 -19.603 -14.767 1.00 0.00 C ATOM 298 O MET A 18 39.340 -19.847 -13.644 1.00 0.00 O ATOM 299 CB MET A 18 38.201 -17.235 -15.167 1.00 0.00 C ATOM 300 CG MET A 18 38.741 -15.815 -15.205 1.00 0.00 C ATOM 301 SD MET A 18 37.730 -14.661 -14.257 1.00 0.00 S ATOM 302 CE MET A 18 36.235 -14.632 -15.242 1.00 0.00 C ATOM 0 H MET A 18 38.465 -18.564 -17.401 1.00 0.00 H new ATOM 0 HA MET A 18 40.224 -17.957 -15.112 1.00 0.00 H new ATOM 0 HB2 MET A 18 37.385 -17.324 -15.884 1.00 0.00 H new ATOM 0 HB3 MET A 18 37.780 -17.429 -14.180 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.758 -15.807 -14.814 1.00 0.00 H new ATOM 0 HG3 MET A 18 38.795 -15.479 -16.240 1.00 0.00 H new ATOM 0 HE1 MET A 18 35.366 -14.600 -14.584 1.00 0.00 H new ATOM 0 HE2 MET A 18 36.238 -13.750 -15.882 1.00 0.00 H new ATOM 0 HE3 MET A 18 36.189 -15.528 -15.860 1.00 0.00 H new ATOM 312 N GLY A 19 38.108 -20.437 -15.431 1.00 0.00 N ATOM 313 CA GLY A 19 37.710 -21.705 -14.848 1.00 0.00 C ATOM 314 C GLY A 19 36.396 -21.611 -14.099 1.00 0.00 C ATOM 315 O GLY A 19 36.046 -22.507 -13.329 1.00 0.00 O ATOM 0 H GLY A 19 37.733 -20.257 -16.362 1.00 0.00 H new ATOM 0 HA2 GLY A 19 37.623 -22.453 -15.636 1.00 0.00 H new ATOM 0 HA3 GLY A 19 38.489 -22.049 -14.167 1.00 0.00 H new ATOM 319 N LEU A 20 35.665 -20.525 -14.323 1.00 0.00 N ATOM 320 CA LEU A 20 34.382 -20.316 -13.662 1.00 0.00 C ATOM 321 C LEU A 20 33.325 -19.852 -14.659 1.00 0.00 C ATOM 322 O LEU A 20 33.637 -19.530 -15.805 1.00 0.00 O ATOM 323 CB LEU A 20 34.525 -19.288 -12.539 1.00 0.00 C ATOM 324 CG LEU A 20 35.455 -18.108 -12.823 1.00 0.00 C ATOM 325 CD1 LEU A 20 34.864 -17.210 -13.899 1.00 0.00 C ATOM 326 CD2 LEU A 20 35.717 -17.316 -11.551 1.00 0.00 C ATOM 0 H LEU A 20 35.939 -19.775 -14.958 1.00 0.00 H new ATOM 0 HA LEU A 20 34.062 -21.267 -13.237 1.00 0.00 H new ATOM 0 HB2 LEU A 20 33.535 -18.896 -12.304 1.00 0.00 H new ATOM 0 HB3 LEU A 20 34.884 -19.802 -11.647 1.00 0.00 H new ATOM 0 HG LEU A 20 36.406 -18.499 -13.186 1.00 0.00 H new ATOM 0 HD11 LEU A 20 35.539 -16.376 -14.088 1.00 0.00 H new ATOM 0 HD12 LEU A 20 34.729 -17.782 -14.817 1.00 0.00 H new ATOM 0 HD13 LEU A 20 33.900 -16.828 -13.564 1.00 0.00 H new ATOM 0 HD21 LEU A 20 36.381 -16.480 -11.773 1.00 0.00 H new ATOM 0 HD22 LEU A 20 34.774 -16.936 -11.158 1.00 0.00 H new ATOM 0 HD23 LEU A 20 36.184 -17.963 -10.809 1.00 0.00 H new ATOM 338 N ASN A 21 32.073 -19.819 -14.214 1.00 0.00 N ATOM 339 CA ASN A 21 30.969 -19.393 -15.068 1.00 0.00 C ATOM 340 C ASN A 21 30.356 -18.093 -14.555 1.00 0.00 C ATOM 341 O ASN A 21 30.314 -17.848 -13.350 1.00 0.00 O ATOM 342 CB ASN A 21 29.898 -20.484 -15.134 1.00 0.00 C ATOM 343 CG ASN A 21 28.840 -20.322 -14.060 1.00 0.00 C ATOM 344 OD1 ASN A 21 29.106 -20.529 -12.876 1.00 0.00 O ATOM 345 ND2 ASN A 21 27.633 -19.949 -14.470 1.00 0.00 N ATOM 0 H ASN A 21 31.797 -20.082 -13.268 1.00 0.00 H new ATOM 0 HA ASN A 21 31.362 -19.219 -16.069 1.00 0.00 H new ATOM 0 HB2 ASN A 21 29.422 -20.463 -16.115 1.00 0.00 H new ATOM 0 HB3 ASN A 21 30.371 -21.460 -15.030 1.00 0.00 H new ATOM 0 HD21 ASN A 21 26.881 -19.823 -13.793 1.00 0.00 H new ATOM 0 HD22 ASN A 21 27.458 -19.789 -15.462 1.00 0.00 H new ATOM 352 N TYR A 22 29.882 -17.265 -15.479 1.00 0.00 N ATOM 353 CA TYR A 22 29.273 -15.989 -15.122 1.00 0.00 C ATOM 354 C TYR A 22 27.902 -15.839 -15.775 1.00 0.00 C ATOM 355 O TYR A 22 27.622 -16.449 -16.806 1.00 0.00 O ATOM 356 CB TYR A 22 30.181 -14.832 -15.542 1.00 0.00 C ATOM 357 CG TYR A 22 30.202 -14.590 -17.034 1.00 0.00 C ATOM 358 CD1 TYR A 22 29.247 -13.785 -17.642 1.00 0.00 C ATOM 359 CD2 TYR A 22 31.178 -15.168 -17.838 1.00 0.00 C ATOM 360 CE1 TYR A 22 29.262 -13.562 -19.005 1.00 0.00 C ATOM 361 CE2 TYR A 22 31.202 -14.949 -19.201 1.00 0.00 C ATOM 362 CZ TYR A 22 30.242 -14.146 -19.780 1.00 0.00 C ATOM 363 OH TYR A 22 30.262 -13.927 -21.139 1.00 0.00 O ATOM 0 H TYR A 22 29.908 -17.454 -16.481 1.00 0.00 H new ATOM 0 HA TYR A 22 29.144 -15.966 -14.040 1.00 0.00 H new ATOM 0 HB2 TYR A 22 29.852 -13.922 -15.039 1.00 0.00 H new ATOM 0 HB3 TYR A 22 31.196 -15.036 -15.201 1.00 0.00 H new ATOM 0 HD1 TYR A 22 28.479 -13.325 -17.038 1.00 0.00 H new ATOM 0 HD2 TYR A 22 31.930 -15.799 -17.389 1.00 0.00 H new ATOM 0 HE1 TYR A 22 28.511 -12.934 -19.461 1.00 0.00 H new ATOM 0 HE2 TYR A 22 31.969 -15.404 -19.811 1.00 0.00 H new ATOM 0 HH TYR A 22 31.017 -14.409 -21.537 1.00 0.00 H new ATOM 373 N VAL A 23 27.051 -15.020 -15.165 1.00 0.00 N ATOM 374 CA VAL A 23 25.710 -14.786 -15.686 1.00 0.00 C ATOM 375 C VAL A 23 25.225 -13.381 -15.344 1.00 0.00 C ATOM 376 O VAL A 23 25.455 -12.885 -14.241 1.00 0.00 O ATOM 377 CB VAL A 23 24.705 -15.813 -15.131 1.00 0.00 C ATOM 378 CG1 VAL A 23 24.830 -15.919 -13.619 1.00 0.00 C ATOM 379 CG2 VAL A 23 23.286 -15.440 -15.532 1.00 0.00 C ATOM 0 H VAL A 23 27.267 -14.508 -14.310 1.00 0.00 H new ATOM 0 HA VAL A 23 25.768 -14.894 -16.769 1.00 0.00 H new ATOM 0 HB VAL A 23 24.935 -16.788 -15.560 1.00 0.00 H new ATOM 0 HG11 VAL A 23 24.112 -16.649 -13.245 1.00 0.00 H new ATOM 0 HG12 VAL A 23 25.840 -16.236 -13.359 1.00 0.00 H new ATOM 0 HG13 VAL A 23 24.628 -14.947 -13.168 1.00 0.00 H new ATOM 0 HG21 VAL A 23 22.589 -16.176 -15.131 1.00 0.00 H new ATOM 0 HG22 VAL A 23 23.042 -14.455 -15.133 1.00 0.00 H new ATOM 0 HG23 VAL A 23 23.208 -15.421 -16.619 1.00 0.00 H new ATOM 389 N ARG A 24 24.551 -12.746 -16.298 1.00 0.00 N ATOM 390 CA ARG A 24 24.034 -11.397 -16.098 1.00 0.00 C ATOM 391 C ARG A 24 22.553 -11.432 -15.732 1.00 0.00 C ATOM 392 O ARG A 24 21.746 -12.050 -16.426 1.00 0.00 O ATOM 393 CB ARG A 24 24.239 -10.558 -17.360 1.00 0.00 C ATOM 394 CG ARG A 24 25.602 -9.889 -17.432 1.00 0.00 C ATOM 395 CD ARG A 24 26.710 -10.905 -17.662 1.00 0.00 C ATOM 396 NE ARG A 24 27.510 -10.584 -18.841 1.00 0.00 N ATOM 397 CZ ARG A 24 28.316 -9.531 -18.917 1.00 0.00 C ATOM 398 NH1 ARG A 24 28.427 -8.701 -17.889 1.00 0.00 N ATOM 399 NH2 ARG A 24 29.013 -9.306 -20.024 1.00 0.00 N ATOM 0 H ARG A 24 24.350 -13.143 -17.216 1.00 0.00 H new ATOM 0 HA ARG A 24 24.584 -10.942 -15.274 1.00 0.00 H new ATOM 0 HB2 ARG A 24 24.110 -11.195 -18.235 1.00 0.00 H new ATOM 0 HB3 ARG A 24 23.465 -9.792 -17.407 1.00 0.00 H new ATOM 0 HG2 ARG A 24 25.606 -9.156 -18.238 1.00 0.00 H new ATOM 0 HG3 ARG A 24 25.791 -9.346 -16.506 1.00 0.00 H new ATOM 0 HD2 ARG A 24 27.356 -10.942 -16.785 1.00 0.00 H new ATOM 0 HD3 ARG A 24 26.274 -11.897 -17.779 1.00 0.00 H new ATOM 0 HE ARG A 24 27.446 -11.202 -19.650 1.00 0.00 H new ATOM 0 HH11 ARG A 24 27.893 -8.870 -17.037 1.00 0.00 H new ATOM 0 HH12 ARG A 24 29.047 -7.893 -17.950 1.00 0.00 H new ATOM 0 HH21 ARG A 24 28.930 -9.942 -20.817 1.00 0.00 H new ATOM 0 HH22 ARG A 24 29.632 -8.497 -20.082 1.00 0.00 H new ATOM 413 N TYR A 25 22.204 -10.765 -14.638 1.00 0.00 N ATOM 414 CA TYR A 25 20.821 -10.721 -14.178 1.00 0.00 C ATOM 415 C TYR A 25 20.188 -9.367 -14.481 1.00 0.00 C ATOM 416 O TYR A 25 20.841 -8.328 -14.380 1.00 0.00 O ATOM 417 CB TYR A 25 20.752 -11.005 -12.676 1.00 0.00 C ATOM 418 CG TYR A 25 21.433 -12.292 -12.271 1.00 0.00 C ATOM 419 CD1 TYR A 25 20.917 -13.524 -12.652 1.00 0.00 C ATOM 420 CD2 TYR A 25 22.594 -12.276 -11.508 1.00 0.00 C ATOM 421 CE1 TYR A 25 21.535 -14.703 -12.283 1.00 0.00 C ATOM 422 CE2 TYR A 25 23.221 -13.450 -11.135 1.00 0.00 C ATOM 423 CZ TYR A 25 22.687 -14.661 -11.525 1.00 0.00 C ATOM 424 OH TYR A 25 23.307 -15.833 -11.157 1.00 0.00 O ATOM 0 H TYR A 25 22.860 -10.247 -14.053 1.00 0.00 H new ATOM 0 HA TYR A 25 20.263 -11.490 -14.713 1.00 0.00 H new ATOM 0 HB2 TYR A 25 21.210 -10.176 -12.137 1.00 0.00 H new ATOM 0 HB3 TYR A 25 19.707 -11.045 -12.370 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.017 -13.561 -13.247 1.00 0.00 H new ATOM 0 HD2 TYR A 25 23.014 -11.330 -11.201 1.00 0.00 H new ATOM 0 HE1 TYR A 25 21.119 -15.652 -12.586 1.00 0.00 H new ATOM 0 HE2 TYR A 25 24.123 -13.420 -10.542 1.00 0.00 H new ATOM 0 HH TYR A 25 24.106 -15.628 -10.627 1.00 0.00 H new ATOM 434 N ARG A 26 18.912 -9.387 -14.853 1.00 0.00 N ATOM 435 CA ARG A 26 18.190 -8.161 -15.171 1.00 0.00 C ATOM 436 C ARG A 26 17.176 -7.829 -14.081 1.00 0.00 C ATOM 437 O ARG A 26 16.191 -8.545 -13.895 1.00 0.00 O ATOM 438 CB ARG A 26 17.480 -8.298 -16.519 1.00 0.00 C ATOM 439 CG ARG A 26 18.172 -7.556 -17.651 1.00 0.00 C ATOM 440 CD ARG A 26 17.264 -6.500 -18.261 1.00 0.00 C ATOM 441 NE ARG A 26 16.346 -7.069 -19.244 1.00 0.00 N ATOM 442 CZ ARG A 26 16.687 -7.334 -20.501 1.00 0.00 C ATOM 443 NH1 ARG A 26 17.917 -7.083 -20.924 1.00 0.00 N ATOM 444 NH2 ARG A 26 15.795 -7.852 -21.336 1.00 0.00 N ATOM 0 H ARG A 26 18.357 -10.238 -14.941 1.00 0.00 H new ATOM 0 HA ARG A 26 18.913 -7.348 -15.230 1.00 0.00 H new ATOM 0 HB2 ARG A 26 17.411 -9.355 -16.778 1.00 0.00 H new ATOM 0 HB3 ARG A 26 16.460 -7.926 -16.422 1.00 0.00 H new ATOM 0 HG2 ARG A 26 19.080 -7.084 -17.277 1.00 0.00 H new ATOM 0 HG3 ARG A 26 18.475 -8.266 -18.421 1.00 0.00 H new ATOM 0 HD2 ARG A 26 16.693 -6.013 -17.471 1.00 0.00 H new ATOM 0 HD3 ARG A 26 17.872 -5.730 -18.736 1.00 0.00 H new ATOM 0 HE ARG A 26 15.391 -7.274 -18.950 1.00 0.00 H new ATOM 0 HH11 ARG A 26 18.605 -6.685 -20.285 1.00 0.00 H new ATOM 0 HH12 ARG A 26 18.176 -7.287 -21.889 1.00 0.00 H new ATOM 0 HH21 ARG A 26 14.847 -8.047 -21.013 1.00 0.00 H new ATOM 0 HH22 ARG A 26 16.057 -8.055 -22.301 1.00 0.00 H new ATOM 458 N VAL A 27 17.423 -6.738 -13.362 1.00 0.00 N ATOM 459 CA VAL A 27 16.531 -6.311 -12.290 1.00 0.00 C ATOM 460 C VAL A 27 16.029 -4.891 -12.528 1.00 0.00 C ATOM 461 O VAL A 27 16.802 -3.997 -12.873 1.00 0.00 O ATOM 462 CB VAL A 27 17.231 -6.374 -10.920 1.00 0.00 C ATOM 463 CG1 VAL A 27 18.512 -5.554 -10.935 1.00 0.00 C ATOM 464 CG2 VAL A 27 16.294 -5.893 -9.822 1.00 0.00 C ATOM 0 H VAL A 27 18.233 -6.134 -13.502 1.00 0.00 H new ATOM 0 HA VAL A 27 15.684 -6.997 -12.288 1.00 0.00 H new ATOM 0 HB VAL A 27 17.495 -7.411 -10.714 1.00 0.00 H new ATOM 0 HG11 VAL A 27 18.992 -5.611 -9.958 1.00 0.00 H new ATOM 0 HG12 VAL A 27 19.187 -5.948 -11.695 1.00 0.00 H new ATOM 0 HG13 VAL A 27 18.276 -4.515 -11.163 1.00 0.00 H new ATOM 0 HG21 VAL A 27 16.804 -5.944 -8.860 1.00 0.00 H new ATOM 0 HG22 VAL A 27 15.998 -4.863 -10.022 1.00 0.00 H new ATOM 0 HG23 VAL A 27 15.408 -6.527 -9.797 1.00 0.00 H new ATOM 474 N SER A 28 14.728 -4.690 -12.339 1.00 0.00 N ATOM 475 CA SER A 28 14.121 -3.379 -12.536 1.00 0.00 C ATOM 476 C SER A 28 13.281 -2.983 -11.325 1.00 0.00 C ATOM 477 O SER A 28 12.526 -3.792 -10.787 1.00 0.00 O ATOM 478 CB SER A 28 13.253 -3.380 -13.795 1.00 0.00 C ATOM 479 OG SER A 28 12.787 -4.684 -14.093 1.00 0.00 O ATOM 0 H SER A 28 14.075 -5.418 -12.050 1.00 0.00 H new ATOM 0 HA SER A 28 14.921 -2.649 -12.656 1.00 0.00 H new ATOM 0 HB2 SER A 28 12.404 -2.710 -13.656 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.828 -2.995 -14.637 1.00 0.00 H new ATOM 0 HG SER A 28 12.233 -4.657 -14.901 1.00 0.00 H new ATOM 485 N GLY A 29 13.418 -1.730 -10.902 1.00 0.00 N ATOM 486 CA GLY A 29 12.667 -1.246 -9.759 1.00 0.00 C ATOM 487 C GLY A 29 13.547 -0.555 -8.737 1.00 0.00 C ATOM 488 O GLY A 29 13.050 0.114 -7.830 1.00 0.00 O ATOM 0 H GLY A 29 14.036 -1.041 -11.331 1.00 0.00 H new ATOM 0 HA2 GLY A 29 11.899 -0.552 -10.100 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.153 -2.083 -9.285 1.00 0.00 H new ATOM 492 N LEU A 30 14.857 -0.716 -8.882 1.00 0.00 N ATOM 493 CA LEU A 30 15.810 -0.103 -7.962 1.00 0.00 C ATOM 494 C LEU A 30 15.865 1.408 -8.164 1.00 0.00 C ATOM 495 O LEU A 30 15.218 1.949 -9.060 1.00 0.00 O ATOM 496 CB LEU A 30 17.201 -0.707 -8.161 1.00 0.00 C ATOM 497 CG LEU A 30 17.242 -2.179 -8.572 1.00 0.00 C ATOM 498 CD1 LEU A 30 17.589 -2.313 -10.046 1.00 0.00 C ATOM 499 CD2 LEU A 30 18.240 -2.944 -7.715 1.00 0.00 C ATOM 0 H LEU A 30 15.284 -1.266 -9.627 1.00 0.00 H new ATOM 0 HA LEU A 30 15.476 -0.303 -6.944 1.00 0.00 H new ATOM 0 HB2 LEU A 30 17.723 -0.124 -8.920 1.00 0.00 H new ATOM 0 HB3 LEU A 30 17.760 -0.594 -7.232 1.00 0.00 H new ATOM 0 HG LEU A 30 16.253 -2.608 -8.413 1.00 0.00 H new ATOM 0 HD11 LEU A 30 17.613 -3.368 -10.320 1.00 0.00 H new ATOM 0 HD12 LEU A 30 16.837 -1.800 -10.645 1.00 0.00 H new ATOM 0 HD13 LEU A 30 18.566 -1.867 -10.232 1.00 0.00 H new ATOM 0 HD21 LEU A 30 18.256 -3.990 -8.021 1.00 0.00 H new ATOM 0 HD22 LEU A 30 19.233 -2.514 -7.841 1.00 0.00 H new ATOM 0 HD23 LEU A 30 17.946 -2.877 -6.667 1.00 0.00 H new ATOM 511 N ASP A 31 16.644 2.083 -7.325 1.00 0.00 N ATOM 512 CA ASP A 31 16.787 3.532 -7.413 1.00 0.00 C ATOM 513 C ASP A 31 18.256 3.927 -7.517 1.00 0.00 C ATOM 514 O ASP A 31 19.146 3.126 -7.231 1.00 0.00 O ATOM 515 CB ASP A 31 16.150 4.203 -6.195 1.00 0.00 C ATOM 516 CG ASP A 31 14.797 3.613 -5.850 1.00 0.00 C ATOM 517 OD1 ASP A 31 14.761 2.564 -5.173 1.00 0.00 O ATOM 518 OD2 ASP A 31 13.773 4.200 -6.257 1.00 0.00 O ATOM 0 H ASP A 31 17.186 1.650 -6.577 1.00 0.00 H new ATOM 0 HA ASP A 31 16.274 3.870 -8.314 1.00 0.00 H new ATOM 0 HB2 ASP A 31 16.816 4.102 -5.338 1.00 0.00 H new ATOM 0 HB3 ASP A 31 16.039 5.270 -6.388 1.00 0.00 H new ATOM 523 N GLU A 32 18.503 5.167 -7.928 1.00 0.00 N ATOM 524 CA GLU A 32 19.865 5.668 -8.071 1.00 0.00 C ATOM 525 C GLU A 32 20.649 5.489 -6.775 1.00 0.00 C ATOM 526 O GLU A 32 21.791 5.030 -6.786 1.00 0.00 O ATOM 527 CB GLU A 32 19.850 7.144 -8.473 1.00 0.00 C ATOM 528 CG GLU A 32 19.298 7.391 -9.867 1.00 0.00 C ATOM 529 CD GLU A 32 20.248 6.938 -10.958 1.00 0.00 C ATOM 530 OE1 GLU A 32 21.449 7.271 -10.874 1.00 0.00 O ATOM 531 OE2 GLU A 32 19.791 6.253 -11.897 1.00 0.00 O ATOM 0 H GLU A 32 17.778 5.843 -8.168 1.00 0.00 H new ATOM 0 HA GLU A 32 20.357 5.092 -8.855 1.00 0.00 H new ATOM 0 HB2 GLU A 32 19.253 7.702 -7.751 1.00 0.00 H new ATOM 0 HB3 GLU A 32 20.865 7.537 -8.419 1.00 0.00 H new ATOM 0 HG2 GLU A 32 18.349 6.867 -9.976 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.091 8.454 -9.989 1.00 0.00 H new ATOM 538 N GLU A 33 20.027 5.857 -5.659 1.00 0.00 N ATOM 539 CA GLU A 33 20.668 5.739 -4.354 1.00 0.00 C ATOM 540 C GLU A 33 20.660 4.291 -3.873 1.00 0.00 C ATOM 541 O GLU A 33 21.630 3.816 -3.281 1.00 0.00 O ATOM 542 CB GLU A 33 19.961 6.632 -3.331 1.00 0.00 C ATOM 543 CG GLU A 33 20.522 6.508 -1.925 1.00 0.00 C ATOM 544 CD GLU A 33 21.953 7.000 -1.822 1.00 0.00 C ATOM 545 OE1 GLU A 33 22.399 7.724 -2.737 1.00 0.00 O ATOM 546 OE2 GLU A 33 22.626 6.661 -0.826 1.00 0.00 O ATOM 0 H GLU A 33 19.082 6.239 -5.632 1.00 0.00 H new ATOM 0 HA GLU A 33 21.703 6.064 -4.455 1.00 0.00 H new ATOM 0 HB2 GLU A 33 20.037 7.670 -3.653 1.00 0.00 H new ATOM 0 HB3 GLU A 33 18.900 6.381 -3.313 1.00 0.00 H new ATOM 0 HG2 GLU A 33 19.896 7.076 -1.237 1.00 0.00 H new ATOM 0 HG3 GLU A 33 20.477 5.465 -1.610 1.00 0.00 H new ATOM 553 N LEU A 34 19.559 3.595 -4.130 1.00 0.00 N ATOM 554 CA LEU A 34 19.423 2.200 -3.724 1.00 0.00 C ATOM 555 C LEU A 34 20.499 1.336 -4.374 1.00 0.00 C ATOM 556 O LEU A 34 21.015 0.402 -3.760 1.00 0.00 O ATOM 557 CB LEU A 34 18.036 1.673 -4.095 1.00 0.00 C ATOM 558 CG LEU A 34 17.006 1.636 -2.965 1.00 0.00 C ATOM 559 CD1 LEU A 34 17.430 0.648 -1.889 1.00 0.00 C ATOM 560 CD2 LEU A 34 16.817 3.024 -2.371 1.00 0.00 C ATOM 0 H LEU A 34 18.747 3.973 -4.618 1.00 0.00 H new ATOM 0 HA LEU A 34 19.547 2.149 -2.642 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.639 2.290 -4.901 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.147 0.664 -4.491 1.00 0.00 H new ATOM 0 HG LEU A 34 16.053 1.306 -3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 34 16.685 0.635 -1.093 1.00 0.00 H new ATOM 0 HD12 LEU A 34 17.515 -0.348 -2.323 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.394 0.948 -1.479 1.00 0.00 H new ATOM 0 HD21 LEU A 34 16.081 2.979 -1.568 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.767 3.382 -1.973 1.00 0.00 H new ATOM 0 HD23 LEU A 34 16.468 3.707 -3.146 1.00 0.00 H new ATOM 572 N THR A 35 20.834 1.655 -5.620 1.00 0.00 N ATOM 573 CA THR A 35 21.849 0.909 -6.353 1.00 0.00 C ATOM 574 C THR A 35 23.144 0.812 -5.554 1.00 0.00 C ATOM 575 O THR A 35 23.812 -0.221 -5.564 1.00 0.00 O ATOM 576 CB THR A 35 22.149 1.560 -7.717 1.00 0.00 C ATOM 577 OG1 THR A 35 20.961 1.593 -8.515 1.00 0.00 O ATOM 578 CG2 THR A 35 23.240 0.797 -8.452 1.00 0.00 C ATOM 0 H THR A 35 20.417 2.425 -6.143 1.00 0.00 H new ATOM 0 HA THR A 35 21.449 -0.092 -6.516 1.00 0.00 H new ATOM 0 HB THR A 35 22.496 2.578 -7.541 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.312 2.206 -8.111 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.435 1.275 -9.412 1.00 0.00 H new ATOM 0 HG22 THR A 35 24.151 0.799 -7.854 1.00 0.00 H new ATOM 0 HG23 THR A 35 22.917 -0.231 -8.617 1.00 0.00 H new ATOM 586 N GLU A 36 23.490 1.893 -4.863 1.00 0.00 N ATOM 587 CA GLU A 36 24.706 1.927 -4.058 1.00 0.00 C ATOM 588 C GLU A 36 24.647 0.892 -2.939 1.00 0.00 C ATOM 589 O GLU A 36 25.678 0.421 -2.457 1.00 0.00 O ATOM 590 CB GLU A 36 24.913 3.323 -3.466 1.00 0.00 C ATOM 591 CG GLU A 36 25.387 4.350 -4.481 1.00 0.00 C ATOM 592 CD GLU A 36 26.580 5.148 -3.990 1.00 0.00 C ATOM 593 OE1 GLU A 36 27.672 4.557 -3.852 1.00 0.00 O ATOM 594 OE2 GLU A 36 26.421 6.361 -3.743 1.00 0.00 O ATOM 0 H GLU A 36 22.947 2.756 -4.844 1.00 0.00 H new ATOM 0 HA GLU A 36 25.548 1.687 -4.707 1.00 0.00 H new ATOM 0 HB2 GLU A 36 23.976 3.665 -3.026 1.00 0.00 H new ATOM 0 HB3 GLU A 36 25.641 3.261 -2.657 1.00 0.00 H new ATOM 0 HG2 GLU A 36 25.651 3.843 -5.409 1.00 0.00 H new ATOM 0 HG3 GLU A 36 24.569 5.032 -4.712 1.00 0.00 H new ATOM 601 N LYS A 37 23.433 0.541 -2.529 1.00 0.00 N ATOM 602 CA LYS A 37 23.237 -0.439 -1.467 1.00 0.00 C ATOM 603 C LYS A 37 23.538 -1.849 -1.965 1.00 0.00 C ATOM 604 O LYS A 37 24.349 -2.566 -1.377 1.00 0.00 O ATOM 605 CB LYS A 37 21.802 -0.369 -0.939 1.00 0.00 C ATOM 606 CG LYS A 37 21.393 1.016 -0.470 1.00 0.00 C ATOM 607 CD LYS A 37 21.777 1.249 0.982 1.00 0.00 C ATOM 608 CE LYS A 37 21.077 2.472 1.555 1.00 0.00 C ATOM 609 NZ LYS A 37 21.706 2.926 2.826 1.00 0.00 N ATOM 0 H LYS A 37 22.569 0.921 -2.916 1.00 0.00 H new ATOM 0 HA LYS A 37 23.928 -0.203 -0.658 1.00 0.00 H new ATOM 0 HB2 LYS A 37 21.119 -0.694 -1.724 1.00 0.00 H new ATOM 0 HB3 LYS A 37 21.694 -1.070 -0.112 1.00 0.00 H new ATOM 0 HG2 LYS A 37 21.868 1.769 -1.098 1.00 0.00 H new ATOM 0 HG3 LYS A 37 20.316 1.137 -0.587 1.00 0.00 H new ATOM 0 HD2 LYS A 37 21.519 0.370 1.573 1.00 0.00 H new ATOM 0 HD3 LYS A 37 22.857 1.378 1.058 1.00 0.00 H new ATOM 0 HE2 LYS A 37 21.106 3.282 0.826 1.00 0.00 H new ATOM 0 HE3 LYS A 37 20.027 2.240 1.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 21.200 3.761 3.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 21.656 2.162 3.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 22.701 3.172 2.652 1.00 0.00 H new ATOM 623 N LEU A 38 22.883 -2.240 -3.052 1.00 0.00 N ATOM 624 CA LEU A 38 23.082 -3.564 -3.631 1.00 0.00 C ATOM 625 C LEU A 38 24.506 -3.721 -4.154 1.00 0.00 C ATOM 626 O LEU A 38 25.178 -4.711 -3.866 1.00 0.00 O ATOM 627 CB LEU A 38 22.081 -3.804 -4.763 1.00 0.00 C ATOM 628 CG LEU A 38 20.618 -3.495 -4.442 1.00 0.00 C ATOM 629 CD1 LEU A 38 20.338 -3.715 -2.963 1.00 0.00 C ATOM 630 CD2 LEU A 38 20.273 -2.069 -4.845 1.00 0.00 C ATOM 0 H LEU A 38 22.209 -1.659 -3.551 1.00 0.00 H new ATOM 0 HA LEU A 38 22.919 -4.304 -2.848 1.00 0.00 H new ATOM 0 HB2 LEU A 38 22.380 -3.200 -5.619 1.00 0.00 H new ATOM 0 HB3 LEU A 38 22.152 -4.848 -5.069 1.00 0.00 H new ATOM 0 HG LEU A 38 19.989 -4.176 -5.015 1.00 0.00 H new ATOM 0 HD11 LEU A 38 19.292 -3.490 -2.753 1.00 0.00 H new ATOM 0 HD12 LEU A 38 20.545 -4.753 -2.704 1.00 0.00 H new ATOM 0 HD13 LEU A 38 20.976 -3.059 -2.370 1.00 0.00 H new ATOM 0 HD21 LEU A 38 19.228 -1.867 -4.609 1.00 0.00 H new ATOM 0 HD22 LEU A 38 20.909 -1.373 -4.299 1.00 0.00 H new ATOM 0 HD23 LEU A 38 20.434 -1.945 -5.916 1.00 0.00 H new ATOM 642 N ILE A 39 24.960 -2.737 -4.923 1.00 0.00 N ATOM 643 CA ILE A 39 26.305 -2.765 -5.484 1.00 0.00 C ATOM 644 C ILE A 39 27.350 -2.978 -4.395 1.00 0.00 C ATOM 645 O ILE A 39 28.417 -3.538 -4.646 1.00 0.00 O ATOM 646 CB ILE A 39 26.626 -1.462 -6.240 1.00 0.00 C ATOM 647 CG1 ILE A 39 27.793 -1.682 -7.206 1.00 0.00 C ATOM 648 CG2 ILE A 39 26.948 -0.345 -5.259 1.00 0.00 C ATOM 649 CD1 ILE A 39 28.265 -0.414 -7.882 1.00 0.00 C ATOM 0 H ILE A 39 24.416 -1.911 -5.172 1.00 0.00 H new ATOM 0 HA ILE A 39 26.338 -3.600 -6.184 1.00 0.00 H new ATOM 0 HB ILE A 39 25.749 -1.170 -6.818 1.00 0.00 H new ATOM 0 HG12 ILE A 39 28.626 -2.125 -6.661 1.00 0.00 H new ATOM 0 HG13 ILE A 39 27.492 -2.400 -7.969 1.00 0.00 H new ATOM 0 HG21 ILE A 39 27.173 0.569 -5.809 1.00 0.00 H new ATOM 0 HG22 ILE A 39 26.091 -0.175 -4.607 1.00 0.00 H new ATOM 0 HG23 ILE A 39 27.811 -0.627 -4.657 1.00 0.00 H new ATOM 0 HD11 ILE A 39 29.093 -0.645 -8.552 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.445 0.020 -8.455 1.00 0.00 H new ATOM 0 HD13 ILE A 39 28.597 0.299 -7.127 1.00 0.00 H new ATOM 661 N GLU A 40 27.035 -2.529 -3.184 1.00 0.00 N ATOM 662 CA GLU A 40 27.948 -2.672 -2.055 1.00 0.00 C ATOM 663 C GLU A 40 27.911 -4.094 -1.503 1.00 0.00 C ATOM 664 O GLU A 40 28.952 -4.714 -1.287 1.00 0.00 O ATOM 665 CB GLU A 40 27.589 -1.674 -0.952 1.00 0.00 C ATOM 666 CG GLU A 40 28.418 -0.401 -0.989 1.00 0.00 C ATOM 667 CD GLU A 40 28.492 0.286 0.360 1.00 0.00 C ATOM 668 OE1 GLU A 40 27.451 0.365 1.045 1.00 0.00 O ATOM 669 OE2 GLU A 40 29.593 0.746 0.731 1.00 0.00 O ATOM 0 H GLU A 40 26.156 -2.064 -2.959 1.00 0.00 H new ATOM 0 HA GLU A 40 28.958 -2.464 -2.408 1.00 0.00 H new ATOM 0 HB2 GLU A 40 26.534 -1.413 -1.039 1.00 0.00 H new ATOM 0 HB3 GLU A 40 27.720 -2.155 0.018 1.00 0.00 H new ATOM 0 HG2 GLU A 40 29.427 -0.638 -1.327 1.00 0.00 H new ATOM 0 HG3 GLU A 40 27.990 0.286 -1.719 1.00 0.00 H new ATOM 676 N ARG A 41 26.704 -4.603 -1.275 1.00 0.00 N ATOM 677 CA ARG A 41 26.531 -5.950 -0.746 1.00 0.00 C ATOM 678 C ARG A 41 27.023 -6.994 -1.744 1.00 0.00 C ATOM 679 O ARG A 41 27.731 -7.933 -1.379 1.00 0.00 O ATOM 680 CB ARG A 41 25.060 -6.204 -0.410 1.00 0.00 C ATOM 681 CG ARG A 41 24.456 -5.154 0.508 1.00 0.00 C ATOM 682 CD ARG A 41 23.480 -5.774 1.497 1.00 0.00 C ATOM 683 NE ARG A 41 24.164 -6.364 2.644 1.00 0.00 N ATOM 684 CZ ARG A 41 23.553 -6.684 3.779 1.00 0.00 C ATOM 685 NH1 ARG A 41 22.251 -6.473 3.917 1.00 0.00 N ATOM 686 NH2 ARG A 41 24.244 -7.217 4.779 1.00 0.00 N ATOM 0 H ARG A 41 25.832 -4.103 -1.448 1.00 0.00 H new ATOM 0 HA ARG A 41 27.125 -6.034 0.164 1.00 0.00 H new ATOM 0 HB2 ARG A 41 24.485 -6.239 -1.336 1.00 0.00 H new ATOM 0 HB3 ARG A 41 24.967 -7.183 0.061 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.251 -4.643 1.051 1.00 0.00 H new ATOM 0 HG3 ARG A 41 23.942 -4.400 -0.088 1.00 0.00 H new ATOM 0 HD2 ARG A 41 22.782 -5.012 1.844 1.00 0.00 H new ATOM 0 HD3 ARG A 41 22.891 -6.540 0.993 1.00 0.00 H new ATOM 0 HE ARG A 41 25.166 -6.540 2.570 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.717 -6.064 3.150 1.00 0.00 H new ATOM 0 HH12 ARG A 41 21.784 -6.720 4.790 1.00 0.00 H new ATOM 0 HH21 ARG A 41 25.245 -7.381 4.676 1.00 0.00 H new ATOM 0 HH22 ARG A 41 23.774 -7.462 5.650 1.00 0.00 H new ATOM 700 N LEU A 42 26.643 -6.823 -3.006 1.00 0.00 N ATOM 701 CA LEU A 42 27.045 -7.751 -4.058 1.00 0.00 C ATOM 702 C LEU A 42 28.493 -7.509 -4.472 1.00 0.00 C ATOM 703 O LEU A 42 29.250 -8.454 -4.699 1.00 0.00 O ATOM 704 CB LEU A 42 26.124 -7.606 -5.271 1.00 0.00 C ATOM 705 CG LEU A 42 24.630 -7.797 -5.007 1.00 0.00 C ATOM 706 CD1 LEU A 42 23.813 -7.333 -6.202 1.00 0.00 C ATOM 707 CD2 LEU A 42 24.328 -9.253 -4.683 1.00 0.00 C ATOM 0 H LEU A 42 26.058 -6.051 -3.325 1.00 0.00 H new ATOM 0 HA LEU A 42 26.963 -8.765 -3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 42 26.273 -6.614 -5.698 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.434 -8.328 -6.026 1.00 0.00 H new ATOM 0 HG LEU A 42 24.352 -7.189 -4.146 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.752 -7.477 -5.996 1.00 0.00 H new ATOM 0 HD12 LEU A 42 24.007 -6.276 -6.387 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.093 -7.913 -7.081 1.00 0.00 H new ATOM 0 HD21 LEU A 42 23.260 -9.371 -4.498 1.00 0.00 H new ATOM 0 HD22 LEU A 42 24.622 -9.881 -5.524 1.00 0.00 H new ATOM 0 HD23 LEU A 42 24.885 -9.551 -3.795 1.00 0.00 H new ATOM 719 N ASP A 43 28.872 -6.240 -4.568 1.00 0.00 N ATOM 720 CA ASP A 43 30.230 -5.874 -4.951 1.00 0.00 C ATOM 721 C ASP A 43 30.588 -6.464 -6.312 1.00 0.00 C ATOM 722 O ASP A 43 31.626 -7.106 -6.467 1.00 0.00 O ATOM 723 CB ASP A 43 31.228 -6.354 -3.896 1.00 0.00 C ATOM 724 CG ASP A 43 32.419 -5.426 -3.761 1.00 0.00 C ATOM 725 OD1 ASP A 43 32.239 -4.202 -3.931 1.00 0.00 O ATOM 726 OD2 ASP A 43 33.531 -5.923 -3.487 1.00 0.00 O ATOM 0 H ASP A 43 28.257 -5.447 -4.386 1.00 0.00 H new ATOM 0 HA ASP A 43 30.281 -4.787 -5.020 1.00 0.00 H new ATOM 0 HB2 ASP A 43 30.723 -6.435 -2.933 1.00 0.00 H new ATOM 0 HB3 ASP A 43 31.577 -7.353 -4.158 1.00 0.00 H new ATOM 731 N GLU A 44 29.720 -6.242 -7.294 1.00 0.00 N ATOM 732 CA GLU A 44 29.944 -6.754 -8.641 1.00 0.00 C ATOM 733 C GLU A 44 29.689 -5.670 -9.684 1.00 0.00 C ATOM 734 O GLU A 44 29.362 -4.532 -9.346 1.00 0.00 O ATOM 735 CB GLU A 44 29.041 -7.959 -8.910 1.00 0.00 C ATOM 736 CG GLU A 44 27.674 -7.854 -8.254 1.00 0.00 C ATOM 737 CD GLU A 44 26.816 -6.763 -8.865 1.00 0.00 C ATOM 738 OE1 GLU A 44 27.028 -6.435 -10.051 1.00 0.00 O ATOM 739 OE2 GLU A 44 25.932 -6.238 -8.156 1.00 0.00 O ATOM 0 H GLU A 44 28.856 -5.712 -7.182 1.00 0.00 H new ATOM 0 HA GLU A 44 30.986 -7.067 -8.714 1.00 0.00 H new ATOM 0 HB2 GLU A 44 28.910 -8.071 -9.986 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.538 -8.861 -8.553 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.158 -8.810 -8.343 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.800 -7.658 -7.189 1.00 0.00 H new ATOM 746 N ASP A 45 29.841 -6.031 -10.954 1.00 0.00 N ATOM 747 CA ASP A 45 29.627 -5.091 -12.047 1.00 0.00 C ATOM 748 C ASP A 45 28.153 -4.717 -12.162 1.00 0.00 C ATOM 749 O ASP A 45 27.310 -5.558 -12.478 1.00 0.00 O ATOM 750 CB ASP A 45 30.118 -5.690 -13.367 1.00 0.00 C ATOM 751 CG ASP A 45 30.971 -4.720 -14.161 1.00 0.00 C ATOM 752 OD1 ASP A 45 31.721 -3.941 -13.536 1.00 0.00 O ATOM 753 OD2 ASP A 45 30.887 -4.738 -15.407 1.00 0.00 O ATOM 0 H ASP A 45 30.112 -6.968 -11.251 1.00 0.00 H new ATOM 0 HA ASP A 45 30.197 -4.187 -11.832 1.00 0.00 H new ATOM 0 HB2 ASP A 45 30.694 -6.592 -13.161 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.260 -5.990 -13.968 1.00 0.00 H new ATOM 758 N THR A 46 27.846 -3.450 -11.901 1.00 0.00 N ATOM 759 CA THR A 46 26.474 -2.965 -11.972 1.00 0.00 C ATOM 760 C THR A 46 26.364 -1.759 -12.898 1.00 0.00 C ATOM 761 O THR A 46 27.259 -0.916 -12.942 1.00 0.00 O ATOM 762 CB THR A 46 25.942 -2.578 -10.579 1.00 0.00 C ATOM 763 OG1 THR A 46 26.695 -1.478 -10.055 1.00 0.00 O ATOM 764 CG2 THR A 46 26.024 -3.757 -9.622 1.00 0.00 C ATOM 0 H THR A 46 28.530 -2.741 -11.638 1.00 0.00 H new ATOM 0 HA THR A 46 25.871 -3.781 -12.370 1.00 0.00 H new ATOM 0 HB THR A 46 24.897 -2.286 -10.682 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.134 -0.674 -10.042 1.00 0.00 H new ATOM 0 HG21 THR A 46 25.643 -3.460 -8.645 1.00 0.00 H new ATOM 0 HG22 THR A 46 25.426 -4.582 -10.009 1.00 0.00 H new ATOM 0 HG23 THR A 46 27.062 -4.075 -9.525 1.00 0.00 H new ATOM 772 N GLU A 47 25.261 -1.684 -13.637 1.00 0.00 N ATOM 773 CA GLU A 47 25.036 -0.581 -14.562 1.00 0.00 C ATOM 774 C GLU A 47 23.557 -0.465 -14.922 1.00 0.00 C ATOM 775 O GLU A 47 22.869 -1.471 -15.092 1.00 0.00 O ATOM 776 CB GLU A 47 25.867 -0.773 -15.832 1.00 0.00 C ATOM 777 CG GLU A 47 27.184 -0.015 -15.818 1.00 0.00 C ATOM 778 CD GLU A 47 27.599 0.459 -17.198 1.00 0.00 C ATOM 779 OE1 GLU A 47 26.809 1.185 -17.837 1.00 0.00 O ATOM 780 OE2 GLU A 47 28.713 0.105 -17.637 1.00 0.00 O ATOM 0 H GLU A 47 24.510 -2.374 -13.612 1.00 0.00 H new ATOM 0 HA GLU A 47 25.346 0.341 -14.069 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.070 -1.835 -15.966 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.281 -0.450 -16.692 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.097 0.845 -15.154 1.00 0.00 H new ATOM 0 HG3 GLU A 47 27.964 -0.657 -15.409 1.00 0.00 H new ATOM 787 N ARG A 48 23.076 0.769 -15.035 1.00 0.00 N ATOM 788 CA ARG A 48 21.680 1.016 -15.372 1.00 0.00 C ATOM 789 C ARG A 48 21.489 1.079 -16.885 1.00 0.00 C ATOM 790 O ARG A 48 22.185 1.820 -17.578 1.00 0.00 O ATOM 791 CB ARG A 48 21.202 2.321 -14.733 1.00 0.00 C ATOM 792 CG ARG A 48 21.380 2.361 -13.224 1.00 0.00 C ATOM 793 CD ARG A 48 21.993 3.677 -12.769 1.00 0.00 C ATOM 794 NE ARG A 48 23.356 3.845 -13.264 1.00 0.00 N ATOM 795 CZ ARG A 48 24.149 4.849 -12.905 1.00 0.00 C ATOM 796 NH1 ARG A 48 23.717 5.768 -12.053 1.00 0.00 N ATOM 797 NH2 ARG A 48 25.378 4.933 -13.398 1.00 0.00 N ATOM 0 H ARG A 48 23.633 1.613 -14.898 1.00 0.00 H new ATOM 0 HA ARG A 48 21.087 0.189 -14.982 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.747 3.154 -15.177 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.148 2.467 -14.970 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.414 2.222 -12.739 1.00 0.00 H new ATOM 0 HG3 ARG A 48 22.017 1.534 -12.910 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.376 4.505 -13.119 1.00 0.00 H new ATOM 0 HD3 ARG A 48 21.995 3.719 -11.680 1.00 0.00 H new ATOM 0 HE ARG A 48 23.719 3.154 -13.921 1.00 0.00 H new ATOM 0 HH11 ARG A 48 22.773 5.706 -11.671 1.00 0.00 H new ATOM 0 HH12 ARG A 48 24.328 6.537 -11.779 1.00 0.00 H new ATOM 0 HH21 ARG A 48 25.714 4.227 -14.053 1.00 0.00 H new ATOM 0 HH22 ARG A 48 25.987 5.704 -13.122 1.00 0.00 H new ATOM 811 N ASP A 49 20.541 0.296 -17.389 1.00 0.00 N ATOM 812 CA ASP A 49 20.258 0.263 -18.819 1.00 0.00 C ATOM 813 C ASP A 49 18.761 0.111 -19.073 1.00 0.00 C ATOM 814 O ASP A 49 18.159 -0.899 -18.710 1.00 0.00 O ATOM 815 CB ASP A 49 21.019 -0.885 -19.485 1.00 0.00 C ATOM 816 CG ASP A 49 21.102 -0.728 -20.990 1.00 0.00 C ATOM 817 OD1 ASP A 49 21.461 0.375 -21.454 1.00 0.00 O ATOM 818 OD2 ASP A 49 20.809 -1.708 -21.706 1.00 0.00 O ATOM 0 H ASP A 49 19.956 -0.324 -16.829 1.00 0.00 H new ATOM 0 HA ASP A 49 20.588 1.207 -19.252 1.00 0.00 H new ATOM 0 HB2 ASP A 49 22.026 -0.937 -19.072 1.00 0.00 H new ATOM 0 HB3 ASP A 49 20.528 -1.829 -19.248 1.00 0.00 H new ATOM 823 N ASP A 50 18.167 1.122 -19.697 1.00 0.00 N ATOM 824 CA ASP A 50 16.741 1.102 -20.000 1.00 0.00 C ATOM 825 C ASP A 50 15.918 0.924 -18.728 1.00 0.00 C ATOM 826 O ASP A 50 14.788 0.438 -18.770 1.00 0.00 O ATOM 827 CB ASP A 50 16.423 -0.021 -20.989 1.00 0.00 C ATOM 828 CG ASP A 50 17.511 -0.200 -22.030 1.00 0.00 C ATOM 829 OD1 ASP A 50 17.917 0.810 -22.643 1.00 0.00 O ATOM 830 OD2 ASP A 50 17.956 -1.349 -22.231 1.00 0.00 O ATOM 0 H ASP A 50 18.651 1.966 -20.003 1.00 0.00 H new ATOM 0 HA ASP A 50 16.477 2.058 -20.452 1.00 0.00 H new ATOM 0 HB2 ASP A 50 16.289 -0.955 -20.443 1.00 0.00 H new ATOM 0 HB3 ASP A 50 15.478 0.195 -21.488 1.00 0.00 H new ATOM 835 N GLY A 51 16.493 1.319 -17.596 1.00 0.00 N ATOM 836 CA GLY A 51 15.800 1.194 -16.327 1.00 0.00 C ATOM 837 C GLY A 51 16.090 -0.123 -15.635 1.00 0.00 C ATOM 838 O GLY A 51 15.581 -0.385 -14.546 1.00 0.00 O ATOM 0 H GLY A 51 17.427 1.724 -17.535 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.093 2.016 -15.674 1.00 0.00 H new ATOM 0 HA3 GLY A 51 14.726 1.285 -16.492 1.00 0.00 H new ATOM 842 N ASP A 52 16.910 -0.955 -16.269 1.00 0.00 N ATOM 843 CA ASP A 52 17.267 -2.252 -15.708 1.00 0.00 C ATOM 844 C ASP A 52 18.672 -2.218 -15.113 1.00 0.00 C ATOM 845 O ASP A 52 19.417 -1.258 -15.308 1.00 0.00 O ATOM 846 CB ASP A 52 17.181 -3.338 -16.782 1.00 0.00 C ATOM 847 CG ASP A 52 18.546 -3.848 -17.201 1.00 0.00 C ATOM 848 OD1 ASP A 52 19.157 -3.238 -18.104 1.00 0.00 O ATOM 849 OD2 ASP A 52 19.004 -4.857 -16.624 1.00 0.00 O ATOM 0 H ASP A 52 17.340 -0.754 -17.172 1.00 0.00 H new ATOM 0 HA ASP A 52 16.559 -2.483 -14.912 1.00 0.00 H new ATOM 0 HB2 ASP A 52 16.585 -4.170 -16.406 1.00 0.00 H new ATOM 0 HB3 ASP A 52 16.661 -2.942 -17.654 1.00 0.00 H new ATOM 854 N LEU A 53 19.026 -3.272 -14.386 1.00 0.00 N ATOM 855 CA LEU A 53 20.341 -3.363 -13.761 1.00 0.00 C ATOM 856 C LEU A 53 20.997 -4.706 -14.067 1.00 0.00 C ATOM 857 O LEU A 53 20.378 -5.759 -13.918 1.00 0.00 O ATOM 858 CB LEU A 53 20.222 -3.175 -12.247 1.00 0.00 C ATOM 859 CG LEU A 53 21.090 -2.073 -11.638 1.00 0.00 C ATOM 860 CD1 LEU A 53 22.556 -2.306 -11.966 1.00 0.00 C ATOM 861 CD2 LEU A 53 20.641 -0.706 -12.134 1.00 0.00 C ATOM 0 H LEU A 53 18.421 -4.075 -14.215 1.00 0.00 H new ATOM 0 HA LEU A 53 20.967 -2.571 -14.172 1.00 0.00 H new ATOM 0 HB2 LEU A 53 19.180 -2.963 -12.008 1.00 0.00 H new ATOM 0 HB3 LEU A 53 20.475 -4.118 -11.763 1.00 0.00 H new ATOM 0 HG LEU A 53 20.973 -2.101 -10.555 1.00 0.00 H new ATOM 0 HD11 LEU A 53 23.158 -1.512 -11.524 1.00 0.00 H new ATOM 0 HD12 LEU A 53 22.871 -3.268 -11.562 1.00 0.00 H new ATOM 0 HD13 LEU A 53 22.691 -2.305 -13.048 1.00 0.00 H new ATOM 0 HD21 LEU A 53 21.269 0.066 -11.691 1.00 0.00 H new ATOM 0 HD22 LEU A 53 20.729 -0.666 -13.220 1.00 0.00 H new ATOM 0 HD23 LEU A 53 19.603 -0.538 -11.847 1.00 0.00 H new ATOM 873 N ILE A 54 22.255 -4.659 -14.495 1.00 0.00 N ATOM 874 CA ILE A 54 22.996 -5.872 -14.819 1.00 0.00 C ATOM 875 C ILE A 54 23.886 -6.299 -13.656 1.00 0.00 C ATOM 876 O ILE A 54 24.528 -5.467 -13.015 1.00 0.00 O ATOM 877 CB ILE A 54 23.867 -5.680 -16.074 1.00 0.00 C ATOM 878 CG1 ILE A 54 23.124 -4.840 -17.114 1.00 0.00 C ATOM 879 CG2 ILE A 54 24.260 -7.029 -16.657 1.00 0.00 C ATOM 880 CD1 ILE A 54 21.791 -5.427 -17.524 1.00 0.00 C ATOM 0 H ILE A 54 22.781 -3.795 -14.625 1.00 0.00 H new ATOM 0 HA ILE A 54 22.259 -6.651 -15.014 1.00 0.00 H new ATOM 0 HB ILE A 54 24.776 -5.150 -15.790 1.00 0.00 H new ATOM 0 HG12 ILE A 54 22.963 -3.839 -16.713 1.00 0.00 H new ATOM 0 HG13 ILE A 54 23.752 -4.732 -17.998 1.00 0.00 H new ATOM 0 HG21 ILE A 54 24.875 -6.877 -17.544 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.825 -7.595 -15.916 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.362 -7.583 -16.930 1.00 0.00 H new ATOM 0 HD11 ILE A 54 21.320 -4.779 -18.263 1.00 0.00 H new ATOM 0 HD12 ILE A 54 21.946 -6.416 -17.955 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.145 -5.509 -16.650 1.00 0.00 H new ATOM 892 N ILE A 55 23.920 -7.601 -13.392 1.00 0.00 N ATOM 893 CA ILE A 55 24.734 -8.139 -12.309 1.00 0.00 C ATOM 894 C ILE A 55 25.447 -9.416 -12.740 1.00 0.00 C ATOM 895 O ILE A 55 24.809 -10.418 -13.066 1.00 0.00 O ATOM 896 CB ILE A 55 23.883 -8.436 -11.060 1.00 0.00 C ATOM 897 CG1 ILE A 55 23.040 -7.215 -10.688 1.00 0.00 C ATOM 898 CG2 ILE A 55 24.774 -8.846 -9.898 1.00 0.00 C ATOM 899 CD1 ILE A 55 22.139 -7.443 -9.495 1.00 0.00 C ATOM 0 H ILE A 55 23.394 -8.302 -13.913 1.00 0.00 H new ATOM 0 HA ILE A 55 25.474 -7.378 -12.062 1.00 0.00 H new ATOM 0 HB ILE A 55 23.210 -9.263 -11.285 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.703 -6.376 -10.477 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.429 -6.931 -11.545 1.00 0.00 H new ATOM 0 HG21 ILE A 55 24.158 -9.053 -9.023 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.334 -9.742 -10.167 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.469 -8.038 -9.670 1.00 0.00 H new ATOM 0 HD11 ILE A 55 21.572 -6.535 -9.289 1.00 0.00 H new ATOM 0 HD12 ILE A 55 21.451 -8.260 -9.710 1.00 0.00 H new ATOM 0 HD13 ILE A 55 22.744 -7.698 -8.625 1.00 0.00 H new ATOM 911 N THR A 56 26.776 -9.375 -12.738 1.00 0.00 N ATOM 912 CA THR A 56 27.577 -10.528 -13.127 1.00 0.00 C ATOM 913 C THR A 56 28.362 -11.078 -11.942 1.00 0.00 C ATOM 914 O THR A 56 29.203 -10.387 -11.366 1.00 0.00 O ATOM 915 CB THR A 56 28.560 -10.173 -14.259 1.00 0.00 C ATOM 916 OG1 THR A 56 27.914 -9.337 -15.225 1.00 0.00 O ATOM 917 CG2 THR A 56 29.083 -11.430 -14.937 1.00 0.00 C ATOM 0 H THR A 56 27.320 -8.555 -12.471 1.00 0.00 H new ATOM 0 HA THR A 56 26.883 -11.289 -13.484 1.00 0.00 H new ATOM 0 HB THR A 56 29.403 -9.638 -13.822 1.00 0.00 H new ATOM 0 HG1 THR A 56 28.359 -8.464 -15.252 1.00 0.00 H new ATOM 0 HG21 THR A 56 29.775 -11.153 -15.732 1.00 0.00 H new ATOM 0 HG22 THR A 56 29.601 -12.050 -14.205 1.00 0.00 H new ATOM 0 HG23 THR A 56 28.249 -11.989 -15.360 1.00 0.00 H new ATOM 925 N VAL A 57 28.083 -12.327 -11.581 1.00 0.00 N ATOM 926 CA VAL A 57 28.765 -12.970 -10.465 1.00 0.00 C ATOM 927 C VAL A 57 29.300 -14.341 -10.864 1.00 0.00 C ATOM 928 O VAL A 57 28.534 -15.249 -11.187 1.00 0.00 O ATOM 929 CB VAL A 57 27.828 -13.131 -9.252 1.00 0.00 C ATOM 930 CG1 VAL A 57 27.532 -11.778 -8.623 1.00 0.00 C ATOM 931 CG2 VAL A 57 26.541 -13.830 -9.663 1.00 0.00 C ATOM 0 H VAL A 57 27.389 -12.913 -12.046 1.00 0.00 H new ATOM 0 HA VAL A 57 29.598 -12.324 -10.189 1.00 0.00 H new ATOM 0 HB VAL A 57 28.329 -13.749 -8.507 1.00 0.00 H new ATOM 0 HG11 VAL A 57 26.869 -11.911 -7.768 1.00 0.00 H new ATOM 0 HG12 VAL A 57 28.464 -11.319 -8.292 1.00 0.00 H new ATOM 0 HG13 VAL A 57 27.051 -11.133 -9.358 1.00 0.00 H new ATOM 0 HG21 VAL A 57 25.891 -13.936 -8.794 1.00 0.00 H new ATOM 0 HG22 VAL A 57 26.034 -13.240 -10.426 1.00 0.00 H new ATOM 0 HG23 VAL A 57 26.775 -14.817 -10.063 1.00 0.00 H new ATOM 941 N PHE A 58 30.621 -14.484 -10.840 1.00 0.00 N ATOM 942 CA PHE A 58 31.260 -15.744 -11.200 1.00 0.00 C ATOM 943 C PHE A 58 32.088 -16.286 -10.038 1.00 0.00 C ATOM 944 O PHE A 58 32.670 -15.522 -9.268 1.00 0.00 O ATOM 945 CB PHE A 58 32.150 -15.556 -12.430 1.00 0.00 C ATOM 946 CG PHE A 58 33.028 -14.339 -12.355 1.00 0.00 C ATOM 947 CD1 PHE A 58 34.127 -14.314 -11.511 1.00 0.00 C ATOM 948 CD2 PHE A 58 32.755 -13.222 -13.127 1.00 0.00 C ATOM 949 CE1 PHE A 58 34.937 -13.196 -11.439 1.00 0.00 C ATOM 950 CE2 PHE A 58 33.561 -12.101 -13.059 1.00 0.00 C ATOM 951 CZ PHE A 58 34.654 -12.089 -12.215 1.00 0.00 C ATOM 0 H PHE A 58 31.270 -13.743 -10.575 1.00 0.00 H new ATOM 0 HA PHE A 58 30.477 -16.465 -11.433 1.00 0.00 H new ATOM 0 HB2 PHE A 58 32.777 -16.439 -12.553 1.00 0.00 H new ATOM 0 HB3 PHE A 58 31.520 -15.486 -13.317 1.00 0.00 H new ATOM 0 HD1 PHE A 58 34.353 -15.177 -10.903 1.00 0.00 H new ATOM 0 HD2 PHE A 58 31.902 -13.227 -13.790 1.00 0.00 H new ATOM 0 HE1 PHE A 58 35.790 -13.188 -10.777 1.00 0.00 H new ATOM 0 HE2 PHE A 58 33.336 -11.236 -13.665 1.00 0.00 H new ATOM 0 HZ PHE A 58 35.287 -11.215 -12.162 1.00 0.00 H new ATOM 961 N TYR A 59 32.134 -17.608 -9.919 1.00 0.00 N ATOM 962 CA TYR A 59 32.888 -18.253 -8.850 1.00 0.00 C ATOM 963 C TYR A 59 33.506 -19.561 -9.332 1.00 0.00 C ATOM 964 O TYR A 59 32.871 -20.333 -10.049 1.00 0.00 O ATOM 965 CB TYR A 59 31.981 -18.517 -7.646 1.00 0.00 C ATOM 966 CG TYR A 59 31.102 -17.342 -7.281 1.00 0.00 C ATOM 967 CD1 TYR A 59 29.893 -17.125 -7.932 1.00 0.00 C ATOM 968 CD2 TYR A 59 31.479 -16.451 -6.284 1.00 0.00 C ATOM 969 CE1 TYR A 59 29.087 -16.053 -7.602 1.00 0.00 C ATOM 970 CE2 TYR A 59 30.678 -15.376 -5.947 1.00 0.00 C ATOM 971 CZ TYR A 59 29.484 -15.182 -6.608 1.00 0.00 C ATOM 972 OH TYR A 59 28.683 -14.113 -6.276 1.00 0.00 O ATOM 0 H TYR A 59 31.658 -18.254 -10.549 1.00 0.00 H new ATOM 0 HA TYR A 59 33.692 -17.581 -8.550 1.00 0.00 H new ATOM 0 HB2 TYR A 59 31.350 -19.380 -7.859 1.00 0.00 H new ATOM 0 HB3 TYR A 59 32.599 -18.779 -6.787 1.00 0.00 H new ATOM 0 HD1 TYR A 59 29.579 -17.806 -8.709 1.00 0.00 H new ATOM 0 HD2 TYR A 59 32.413 -16.601 -5.764 1.00 0.00 H new ATOM 0 HE1 TYR A 59 28.152 -15.897 -8.119 1.00 0.00 H new ATOM 0 HE2 TYR A 59 30.986 -14.692 -5.170 1.00 0.00 H new ATOM 0 HH TYR A 59 29.106 -13.598 -5.557 1.00 0.00 H new ATOM 982 N GLU A 60 34.750 -19.803 -8.930 1.00 0.00 N ATOM 983 CA GLU A 60 35.455 -21.018 -9.321 1.00 0.00 C ATOM 984 C GLU A 60 35.273 -22.114 -8.275 1.00 0.00 C ATOM 985 O GLU A 60 34.545 -21.939 -7.298 1.00 0.00 O ATOM 986 CB GLU A 60 36.945 -20.729 -9.518 1.00 0.00 C ATOM 987 CG GLU A 60 37.746 -20.756 -8.227 1.00 0.00 C ATOM 988 CD GLU A 60 38.856 -19.723 -8.208 1.00 0.00 C ATOM 989 OE1 GLU A 60 39.746 -19.791 -9.081 1.00 0.00 O ATOM 990 OE2 GLU A 60 38.834 -18.846 -7.319 1.00 0.00 O ATOM 0 H GLU A 60 35.290 -19.175 -8.335 1.00 0.00 H new ATOM 0 HA GLU A 60 35.031 -21.365 -10.263 1.00 0.00 H new ATOM 0 HB2 GLU A 60 37.361 -21.463 -10.209 1.00 0.00 H new ATOM 0 HB3 GLU A 60 37.058 -19.751 -9.986 1.00 0.00 H new ATOM 0 HG2 GLU A 60 37.077 -20.580 -7.385 1.00 0.00 H new ATOM 0 HG3 GLU A 60 38.176 -21.748 -8.091 1.00 0.00 H new ATOM 997 N ARG A 61 35.939 -23.244 -8.487 1.00 0.00 N ATOM 998 CA ARG A 61 35.850 -24.369 -7.564 1.00 0.00 C ATOM 999 C ARG A 61 35.954 -23.895 -6.118 1.00 0.00 C ATOM 1000 O ARG A 61 35.279 -24.420 -5.233 1.00 0.00 O ATOM 1001 CB ARG A 61 36.953 -25.387 -7.859 1.00 0.00 C ATOM 1002 CG ARG A 61 38.329 -24.763 -8.026 1.00 0.00 C ATOM 1003 CD ARG A 61 39.344 -25.778 -8.527 1.00 0.00 C ATOM 1004 NE ARG A 61 39.877 -26.599 -7.443 1.00 0.00 N ATOM 1005 CZ ARG A 61 40.546 -27.731 -7.639 1.00 0.00 C ATOM 1006 NH1 ARG A 61 40.762 -28.172 -8.870 1.00 0.00 N ATOM 1007 NH2 ARG A 61 40.999 -28.422 -6.601 1.00 0.00 N ATOM 0 H ARG A 61 36.547 -23.405 -9.290 1.00 0.00 H new ATOM 0 HA ARG A 61 34.879 -24.845 -7.703 1.00 0.00 H new ATOM 0 HB2 ARG A 61 36.990 -26.115 -7.049 1.00 0.00 H new ATOM 0 HB3 ARG A 61 36.698 -25.933 -8.767 1.00 0.00 H new ATOM 0 HG2 ARG A 61 38.269 -23.930 -8.727 1.00 0.00 H new ATOM 0 HG3 ARG A 61 38.662 -24.354 -7.072 1.00 0.00 H new ATOM 0 HD2 ARG A 61 38.876 -26.421 -9.273 1.00 0.00 H new ATOM 0 HD3 ARG A 61 40.163 -25.257 -9.024 1.00 0.00 H new ATOM 0 HE ARG A 61 39.728 -26.287 -6.483 1.00 0.00 H new ATOM 0 HH11 ARG A 61 40.415 -27.643 -9.670 1.00 0.00 H new ATOM 0 HH12 ARG A 61 41.276 -29.041 -9.018 1.00 0.00 H new ATOM 0 HH21 ARG A 61 40.834 -28.085 -5.653 1.00 0.00 H new ATOM 0 HH22 ARG A 61 41.512 -29.291 -6.751 1.00 0.00 H new ATOM 1021 N GLU A 62 36.804 -22.900 -5.886 1.00 0.00 N ATOM 1022 CA GLU A 62 36.997 -22.357 -4.546 1.00 0.00 C ATOM 1023 C GLU A 62 35.657 -22.018 -3.899 1.00 0.00 C ATOM 1024 O GLU A 62 35.466 -22.221 -2.700 1.00 0.00 O ATOM 1025 CB GLU A 62 37.880 -21.108 -4.600 1.00 0.00 C ATOM 1026 CG GLU A 62 39.359 -21.415 -4.764 1.00 0.00 C ATOM 1027 CD GLU A 62 40.032 -21.762 -3.450 1.00 0.00 C ATOM 1028 OE1 GLU A 62 39.848 -21.008 -2.472 1.00 0.00 O ATOM 1029 OE2 GLU A 62 40.742 -22.788 -3.401 1.00 0.00 O ATOM 0 H GLU A 62 37.370 -22.454 -6.608 1.00 0.00 H new ATOM 0 HA GLU A 62 37.492 -23.117 -3.941 1.00 0.00 H new ATOM 0 HB2 GLU A 62 37.554 -20.479 -5.428 1.00 0.00 H new ATOM 0 HB3 GLU A 62 37.736 -20.532 -3.686 1.00 0.00 H new ATOM 0 HG2 GLU A 62 39.479 -22.245 -5.460 1.00 0.00 H new ATOM 0 HG3 GLU A 62 39.858 -20.553 -5.207 1.00 0.00 H new ATOM 1036 N TYR A 63 34.734 -21.500 -4.701 1.00 0.00 N ATOM 1037 CA TYR A 63 33.413 -21.130 -4.206 1.00 0.00 C ATOM 1038 C TYR A 63 32.324 -21.941 -4.902 1.00 0.00 C ATOM 1039 O TYR A 63 31.139 -21.617 -4.812 1.00 0.00 O ATOM 1040 CB TYR A 63 33.166 -19.635 -4.419 1.00 0.00 C ATOM 1041 CG TYR A 63 33.317 -18.811 -3.160 1.00 0.00 C ATOM 1042 CD1 TYR A 63 34.571 -18.411 -2.715 1.00 0.00 C ATOM 1043 CD2 TYR A 63 32.206 -18.433 -2.416 1.00 0.00 C ATOM 1044 CE1 TYR A 63 34.714 -17.659 -1.565 1.00 0.00 C ATOM 1045 CE2 TYR A 63 32.339 -17.680 -1.266 1.00 0.00 C ATOM 1046 CZ TYR A 63 33.595 -17.296 -0.844 1.00 0.00 C ATOM 1047 OH TYR A 63 33.732 -16.546 0.302 1.00 0.00 O ATOM 0 H TYR A 63 34.876 -21.327 -5.696 1.00 0.00 H new ATOM 0 HA TYR A 63 33.378 -21.349 -3.139 1.00 0.00 H new ATOM 0 HB2 TYR A 63 33.862 -19.264 -5.172 1.00 0.00 H new ATOM 0 HB3 TYR A 63 32.161 -19.494 -4.817 1.00 0.00 H new ATOM 0 HD1 TYR A 63 35.449 -18.693 -3.278 1.00 0.00 H new ATOM 0 HD2 TYR A 63 31.221 -18.733 -2.743 1.00 0.00 H new ATOM 0 HE1 TYR A 63 35.696 -17.357 -1.232 1.00 0.00 H new ATOM 0 HE2 TYR A 63 31.465 -17.393 -0.700 1.00 0.00 H new ATOM 0 HH TYR A 63 32.848 -16.375 0.689 1.00 0.00 H new ATOM 1057 N PHE A 64 32.734 -22.997 -5.596 1.00 0.00 N ATOM 1058 CA PHE A 64 31.795 -23.855 -6.308 1.00 0.00 C ATOM 1059 C PHE A 64 31.108 -23.092 -7.437 1.00 0.00 C ATOM 1060 O PHE A 64 30.190 -22.301 -7.216 1.00 0.00 O ATOM 1061 CB PHE A 64 30.747 -24.413 -5.342 1.00 0.00 C ATOM 1062 CG PHE A 64 30.789 -25.908 -5.211 1.00 0.00 C ATOM 1063 CD1 PHE A 64 31.957 -26.551 -4.833 1.00 0.00 C ATOM 1064 CD2 PHE A 64 29.661 -26.671 -5.465 1.00 0.00 C ATOM 1065 CE1 PHE A 64 31.999 -27.927 -4.710 1.00 0.00 C ATOM 1066 CE2 PHE A 64 29.696 -28.047 -5.343 1.00 0.00 C ATOM 1067 CZ PHE A 64 30.867 -28.676 -4.967 1.00 0.00 C ATOM 0 H PHE A 64 33.711 -23.279 -5.680 1.00 0.00 H new ATOM 0 HA PHE A 64 32.356 -24.683 -6.742 1.00 0.00 H new ATOM 0 HB2 PHE A 64 30.896 -23.966 -4.359 1.00 0.00 H new ATOM 0 HB3 PHE A 64 29.755 -24.114 -5.682 1.00 0.00 H new ATOM 0 HD1 PHE A 64 32.845 -25.970 -4.632 1.00 0.00 H new ATOM 0 HD2 PHE A 64 28.743 -26.185 -5.762 1.00 0.00 H new ATOM 0 HE1 PHE A 64 32.915 -28.416 -4.413 1.00 0.00 H new ATOM 0 HE2 PHE A 64 28.809 -28.630 -5.541 1.00 0.00 H new ATOM 0 HZ PHE A 64 30.897 -29.752 -4.874 1.00 0.00 H new ATOM 1077 N PRO A 65 31.562 -23.332 -8.676 1.00 0.00 N ATOM 1078 CA PRO A 65 31.006 -22.677 -9.863 1.00 0.00 C ATOM 1079 C PRO A 65 29.594 -23.157 -10.182 1.00 0.00 C ATOM 1080 O PRO A 65 29.233 -24.296 -9.887 1.00 0.00 O ATOM 1081 CB PRO A 65 31.973 -23.084 -10.978 1.00 0.00 C ATOM 1082 CG PRO A 65 32.573 -24.364 -10.510 1.00 0.00 C ATOM 1083 CD PRO A 65 32.653 -24.262 -9.012 1.00 0.00 C ATOM 0 HA PRO A 65 30.917 -21.599 -9.729 1.00 0.00 H new ATOM 0 HB2 PRO A 65 31.452 -23.215 -11.926 1.00 0.00 H new ATOM 0 HB3 PRO A 65 32.737 -22.323 -11.137 1.00 0.00 H new ATOM 0 HG2 PRO A 65 31.961 -25.214 -10.811 1.00 0.00 H new ATOM 0 HG3 PRO A 65 33.562 -24.513 -10.944 1.00 0.00 H new ATOM 0 HD2 PRO A 65 32.515 -25.232 -8.535 1.00 0.00 H new ATOM 0 HD3 PRO A 65 33.621 -23.881 -8.686 1.00 0.00 H new ATOM 1091 N PHE A 66 28.799 -22.281 -10.787 1.00 0.00 N ATOM 1092 CA PHE A 66 27.425 -22.615 -11.146 1.00 0.00 C ATOM 1093 C PHE A 66 27.376 -23.352 -12.482 1.00 0.00 C ATOM 1094 O PHE A 66 27.570 -22.755 -13.540 1.00 0.00 O ATOM 1095 CB PHE A 66 26.571 -21.348 -11.218 1.00 0.00 C ATOM 1096 CG PHE A 66 26.762 -20.429 -10.045 1.00 0.00 C ATOM 1097 CD1 PHE A 66 26.818 -20.933 -8.755 1.00 0.00 C ATOM 1098 CD2 PHE A 66 26.887 -19.062 -10.232 1.00 0.00 C ATOM 1099 CE1 PHE A 66 26.993 -20.090 -7.674 1.00 0.00 C ATOM 1100 CE2 PHE A 66 27.062 -18.214 -9.155 1.00 0.00 C ATOM 1101 CZ PHE A 66 27.117 -18.729 -7.874 1.00 0.00 C ATOM 0 H PHE A 66 29.082 -21.334 -11.039 1.00 0.00 H new ATOM 0 HA PHE A 66 27.024 -23.271 -10.374 1.00 0.00 H new ATOM 0 HB2 PHE A 66 26.811 -20.809 -12.135 1.00 0.00 H new ATOM 0 HB3 PHE A 66 25.520 -21.631 -11.281 1.00 0.00 H new ATOM 0 HD1 PHE A 66 26.724 -21.997 -8.593 1.00 0.00 H new ATOM 0 HD2 PHE A 66 26.847 -18.654 -11.231 1.00 0.00 H new ATOM 0 HE1 PHE A 66 27.033 -20.495 -6.674 1.00 0.00 H new ATOM 0 HE2 PHE A 66 27.156 -17.150 -9.314 1.00 0.00 H new ATOM 0 HZ PHE A 66 27.257 -18.069 -7.031 1.00 0.00 H new ATOM 1111 N GLY A 67 27.115 -24.654 -12.423 1.00 0.00 N ATOM 1112 CA GLY A 67 27.046 -25.452 -13.634 1.00 0.00 C ATOM 1113 C GLY A 67 26.361 -26.786 -13.411 1.00 0.00 C ATOM 1114 O GLY A 67 25.275 -26.845 -12.834 1.00 0.00 O ATOM 0 H GLY A 67 26.950 -25.171 -11.559 1.00 0.00 H new ATOM 0 HA2 GLY A 67 26.509 -24.895 -14.402 1.00 0.00 H new ATOM 0 HA3 GLY A 67 28.054 -25.623 -14.011 1.00 0.00 H new ATOM 1118 N SER A 68 26.996 -27.859 -13.871 1.00 0.00 N ATOM 1119 CA SER A 68 26.439 -29.198 -13.723 1.00 0.00 C ATOM 1120 C SER A 68 25.133 -29.332 -14.501 1.00 0.00 C ATOM 1121 O SER A 68 24.180 -29.953 -14.031 1.00 0.00 O ATOM 1122 CB SER A 68 26.201 -29.515 -12.245 1.00 0.00 C ATOM 1123 OG SER A 68 27.289 -29.081 -11.449 1.00 0.00 O ATOM 0 H SER A 68 27.896 -27.827 -14.349 1.00 0.00 H new ATOM 0 HA SER A 68 27.158 -29.910 -14.128 1.00 0.00 H new ATOM 0 HB2 SER A 68 25.284 -29.030 -11.909 1.00 0.00 H new ATOM 0 HB3 SER A 68 26.059 -30.588 -12.118 1.00 0.00 H new ATOM 0 HG SER A 68 27.112 -29.294 -10.509 1.00 0.00 H new ATOM 1129 N GLU A 69 25.099 -28.745 -15.693 1.00 0.00 N ATOM 1130 CA GLU A 69 23.910 -28.798 -16.535 1.00 0.00 C ATOM 1131 C GLU A 69 23.630 -30.226 -16.992 1.00 0.00 C ATOM 1132 O GLU A 69 22.495 -30.573 -17.319 1.00 0.00 O ATOM 1133 CB GLU A 69 24.079 -27.885 -17.752 1.00 0.00 C ATOM 1134 CG GLU A 69 25.357 -28.143 -18.533 1.00 0.00 C ATOM 1135 CD GLU A 69 25.228 -27.776 -19.999 1.00 0.00 C ATOM 1136 OE1 GLU A 69 24.124 -27.946 -20.558 1.00 0.00 O ATOM 1137 OE2 GLU A 69 26.231 -27.320 -20.587 1.00 0.00 O ATOM 0 H GLU A 69 25.880 -28.228 -16.097 1.00 0.00 H new ATOM 0 HA GLU A 69 23.062 -28.451 -15.944 1.00 0.00 H new ATOM 0 HB2 GLU A 69 23.225 -28.016 -18.416 1.00 0.00 H new ATOM 0 HB3 GLU A 69 24.069 -26.847 -17.421 1.00 0.00 H new ATOM 0 HG2 GLU A 69 26.172 -27.571 -18.089 1.00 0.00 H new ATOM 0 HG3 GLU A 69 25.624 -29.196 -18.448 1.00 0.00 H new ATOM 1144 N GLU A 70 24.673 -31.050 -17.013 1.00 0.00 N ATOM 1145 CA GLU A 70 24.539 -32.441 -17.431 1.00 0.00 C ATOM 1146 C GLU A 70 23.486 -33.162 -16.594 1.00 0.00 C ATOM 1147 O GLU A 70 22.901 -34.152 -17.033 1.00 0.00 O ATOM 1148 CB GLU A 70 25.882 -33.164 -17.313 1.00 0.00 C ATOM 1149 CG GLU A 70 26.840 -32.858 -18.452 1.00 0.00 C ATOM 1150 CD GLU A 70 28.051 -33.771 -18.457 1.00 0.00 C ATOM 1151 OE1 GLU A 70 29.058 -33.423 -17.806 1.00 0.00 O ATOM 1152 OE2 GLU A 70 27.992 -34.832 -19.112 1.00 0.00 O ATOM 0 H GLU A 70 25.619 -30.779 -16.746 1.00 0.00 H new ATOM 0 HA GLU A 70 24.219 -32.451 -18.473 1.00 0.00 H new ATOM 0 HB2 GLU A 70 26.352 -32.887 -16.369 1.00 0.00 H new ATOM 0 HB3 GLU A 70 25.705 -34.239 -17.277 1.00 0.00 H new ATOM 0 HG2 GLU A 70 26.313 -32.955 -19.401 1.00 0.00 H new ATOM 0 HG3 GLU A 70 27.171 -31.822 -18.375 1.00 0.00 H new ATOM 1159 N SER A 71 23.250 -32.657 -15.387 1.00 0.00 N ATOM 1160 CA SER A 71 22.271 -33.255 -14.487 1.00 0.00 C ATOM 1161 C SER A 71 20.864 -33.149 -15.067 1.00 0.00 C ATOM 1162 O SER A 71 20.176 -34.154 -15.244 1.00 0.00 O ATOM 1163 CB SER A 71 22.324 -32.573 -13.118 1.00 0.00 C ATOM 1164 OG SER A 71 23.408 -33.062 -12.347 1.00 0.00 O ATOM 0 H SER A 71 23.723 -31.836 -15.010 1.00 0.00 H new ATOM 0 HA SER A 71 22.518 -34.310 -14.370 1.00 0.00 H new ATOM 0 HB2 SER A 71 22.423 -31.495 -13.249 1.00 0.00 H new ATOM 0 HB3 SER A 71 21.388 -32.745 -12.586 1.00 0.00 H new ATOM 0 HG SER A 71 23.421 -32.610 -11.478 1.00 0.00 H new ATOM 1170 N LYS A 72 20.443 -31.923 -15.360 1.00 0.00 N ATOM 1171 CA LYS A 72 19.119 -31.683 -15.921 1.00 0.00 C ATOM 1172 C LYS A 72 19.050 -32.149 -17.372 1.00 0.00 C ATOM 1173 O LYS A 72 17.971 -32.434 -17.893 1.00 0.00 O ATOM 1174 CB LYS A 72 18.768 -30.196 -15.835 1.00 0.00 C ATOM 1175 CG LYS A 72 17.519 -29.912 -15.019 1.00 0.00 C ATOM 1176 CD LYS A 72 16.753 -28.720 -15.568 1.00 0.00 C ATOM 1177 CE LYS A 72 15.256 -28.985 -15.598 1.00 0.00 C ATOM 1178 NZ LYS A 72 14.647 -28.582 -16.896 1.00 0.00 N ATOM 0 H LYS A 72 21.000 -31.080 -15.218 1.00 0.00 H new ATOM 0 HA LYS A 72 18.396 -32.255 -15.339 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.608 -29.658 -15.397 1.00 0.00 H new ATOM 0 HB3 LYS A 72 18.630 -29.805 -16.843 1.00 0.00 H new ATOM 0 HG2 LYS A 72 16.875 -30.791 -15.020 1.00 0.00 H new ATOM 0 HG3 LYS A 72 17.796 -29.721 -13.982 1.00 0.00 H new ATOM 0 HD2 LYS A 72 16.956 -27.842 -14.955 1.00 0.00 H new ATOM 0 HD3 LYS A 72 17.104 -28.493 -16.575 1.00 0.00 H new ATOM 0 HE2 LYS A 72 15.071 -30.045 -15.424 1.00 0.00 H new ATOM 0 HE3 LYS A 72 14.774 -28.440 -14.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 13.807 -29.166 -17.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.370 -27.581 -16.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.339 -28.717 -17.661 1.00 0.00 H new ATOM 1192 N VAL A 73 20.208 -32.226 -18.020 1.00 0.00 N ATOM 1193 CA VAL A 73 20.279 -32.661 -19.410 1.00 0.00 C ATOM 1194 C VAL A 73 19.601 -31.657 -20.335 1.00 0.00 C ATOM 1195 O VAL A 73 18.858 -32.034 -21.241 1.00 0.00 O ATOM 1196 CB VAL A 73 19.624 -34.042 -19.601 1.00 0.00 C ATOM 1197 CG1 VAL A 73 20.031 -34.646 -20.936 1.00 0.00 C ATOM 1198 CG2 VAL A 73 19.993 -34.969 -18.453 1.00 0.00 C ATOM 0 H VAL A 73 21.110 -31.993 -17.605 1.00 0.00 H new ATOM 0 HA VAL A 73 21.336 -32.731 -19.666 1.00 0.00 H new ATOM 0 HB VAL A 73 18.541 -33.915 -19.602 1.00 0.00 H new ATOM 0 HG11 VAL A 73 19.559 -35.621 -21.053 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.712 -33.989 -21.745 1.00 0.00 H new ATOM 0 HG13 VAL A 73 21.114 -34.761 -20.968 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.522 -35.940 -18.604 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.075 -35.092 -18.418 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.646 -34.540 -17.513 1.00 0.00 H new ATOM 1208 N LYS A 74 19.861 -30.375 -20.101 1.00 0.00 N ATOM 1209 CA LYS A 74 19.278 -29.314 -20.913 1.00 0.00 C ATOM 1210 C LYS A 74 19.750 -27.943 -20.439 1.00 0.00 C ATOM 1211 O LYS A 74 20.329 -27.815 -19.361 1.00 0.00 O ATOM 1212 CB LYS A 74 17.750 -29.385 -20.861 1.00 0.00 C ATOM 1213 CG LYS A 74 17.110 -29.703 -22.201 1.00 0.00 C ATOM 1214 CD LYS A 74 15.760 -29.022 -22.350 1.00 0.00 C ATOM 1215 CE LYS A 74 14.875 -29.750 -23.350 1.00 0.00 C ATOM 1216 NZ LYS A 74 15.225 -29.403 -24.755 1.00 0.00 N ATOM 0 H LYS A 74 20.473 -30.046 -19.354 1.00 0.00 H new ATOM 0 HA LYS A 74 19.608 -29.456 -21.942 1.00 0.00 H new ATOM 0 HB2 LYS A 74 17.454 -30.145 -20.137 1.00 0.00 H new ATOM 0 HB3 LYS A 74 17.362 -28.432 -20.500 1.00 0.00 H new ATOM 0 HG2 LYS A 74 17.771 -29.382 -23.006 1.00 0.00 H new ATOM 0 HG3 LYS A 74 16.987 -30.782 -22.300 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.262 -28.985 -21.381 1.00 0.00 H new ATOM 0 HD3 LYS A 74 15.905 -27.991 -22.674 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.973 -30.826 -23.206 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.831 -29.498 -23.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.600 -29.919 -25.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.107 -28.380 -24.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 16.213 -29.667 -24.942 1.00 0.00 H new ATOM 1230 N MET A 75 19.498 -26.922 -21.251 1.00 0.00 N ATOM 1231 CA MET A 75 19.896 -25.561 -20.912 1.00 0.00 C ATOM 1232 C MET A 75 19.057 -25.021 -19.758 1.00 0.00 C ATOM 1233 O MET A 75 19.485 -24.120 -19.036 1.00 0.00 O ATOM 1234 CB MET A 75 19.756 -24.647 -22.132 1.00 0.00 C ATOM 1235 CG MET A 75 20.734 -24.970 -23.249 1.00 0.00 C ATOM 1236 SD MET A 75 20.928 -23.611 -24.418 1.00 0.00 S ATOM 1237 CE MET A 75 20.869 -24.492 -25.975 1.00 0.00 C ATOM 0 H MET A 75 19.020 -27.011 -22.148 1.00 0.00 H new ATOM 0 HA MET A 75 20.940 -25.581 -20.600 1.00 0.00 H new ATOM 0 HB2 MET A 75 18.739 -24.723 -22.517 1.00 0.00 H new ATOM 0 HB3 MET A 75 19.903 -23.613 -21.820 1.00 0.00 H new ATOM 0 HG2 MET A 75 21.705 -25.214 -22.817 1.00 0.00 H new ATOM 0 HG3 MET A 75 20.390 -25.856 -23.782 1.00 0.00 H new ATOM 0 HE1 MET A 75 20.976 -23.785 -26.797 1.00 0.00 H new ATOM 0 HE2 MET A 75 21.681 -25.218 -26.013 1.00 0.00 H new ATOM 0 HE3 MET A 75 19.914 -25.010 -26.064 1.00 0.00 H new ATOM 1247 N ALA A 76 17.862 -25.576 -19.591 1.00 0.00 N ATOM 1248 CA ALA A 76 16.964 -25.151 -18.524 1.00 0.00 C ATOM 1249 C ALA A 76 17.686 -25.116 -17.181 1.00 0.00 C ATOM 1250 O ALA A 76 17.343 -24.325 -16.302 1.00 0.00 O ATOM 1251 CB ALA A 76 15.756 -26.073 -18.452 1.00 0.00 C ATOM 0 H ALA A 76 17.493 -26.321 -20.181 1.00 0.00 H new ATOM 0 HA ALA A 76 16.623 -24.141 -18.750 1.00 0.00 H new ATOM 0 HB1 ALA A 76 15.094 -25.744 -17.651 1.00 0.00 H new ATOM 0 HB2 ALA A 76 15.220 -26.045 -19.400 1.00 0.00 H new ATOM 0 HB3 ALA A 76 16.087 -27.092 -18.253 1.00 0.00 H new ATOM 1257 N ASP A 77 18.685 -25.978 -17.030 1.00 0.00 N ATOM 1258 CA ASP A 77 19.456 -26.045 -15.793 1.00 0.00 C ATOM 1259 C ASP A 77 20.199 -24.737 -15.544 1.00 0.00 C ATOM 1260 O ASP A 77 20.276 -24.260 -14.412 1.00 0.00 O ATOM 1261 CB ASP A 77 20.449 -27.207 -15.849 1.00 0.00 C ATOM 1262 CG ASP A 77 20.821 -27.717 -14.470 1.00 0.00 C ATOM 1263 OD1 ASP A 77 20.480 -27.042 -13.476 1.00 0.00 O ATOM 1264 OD2 ASP A 77 21.453 -28.790 -14.386 1.00 0.00 O ATOM 0 H ASP A 77 18.980 -26.640 -17.748 1.00 0.00 H new ATOM 0 HA ASP A 77 18.761 -26.210 -14.969 1.00 0.00 H new ATOM 0 HB2 ASP A 77 20.018 -28.022 -16.431 1.00 0.00 H new ATOM 0 HB3 ASP A 77 21.351 -26.886 -16.370 1.00 0.00 H new ATOM 1269 N PHE A 78 20.746 -24.160 -16.610 1.00 0.00 N ATOM 1270 CA PHE A 78 21.485 -22.908 -16.507 1.00 0.00 C ATOM 1271 C PHE A 78 20.567 -21.769 -16.072 1.00 0.00 C ATOM 1272 O PHE A 78 20.860 -21.052 -15.114 1.00 0.00 O ATOM 1273 CB PHE A 78 22.141 -22.566 -17.846 1.00 0.00 C ATOM 1274 CG PHE A 78 23.574 -23.006 -17.941 1.00 0.00 C ATOM 1275 CD1 PHE A 78 24.526 -22.504 -17.068 1.00 0.00 C ATOM 1276 CD2 PHE A 78 23.969 -23.921 -18.903 1.00 0.00 C ATOM 1277 CE1 PHE A 78 25.845 -22.907 -17.153 1.00 0.00 C ATOM 1278 CE2 PHE A 78 25.287 -24.328 -18.992 1.00 0.00 C ATOM 1279 CZ PHE A 78 26.227 -23.819 -18.117 1.00 0.00 C ATOM 0 H PHE A 78 20.691 -24.540 -17.555 1.00 0.00 H new ATOM 0 HA PHE A 78 22.261 -23.035 -15.752 1.00 0.00 H new ATOM 0 HB2 PHE A 78 21.572 -23.033 -18.650 1.00 0.00 H new ATOM 0 HB3 PHE A 78 22.089 -21.489 -18.002 1.00 0.00 H new ATOM 0 HD1 PHE A 78 24.234 -21.790 -16.313 1.00 0.00 H new ATOM 0 HD2 PHE A 78 23.239 -24.321 -19.591 1.00 0.00 H new ATOM 0 HE1 PHE A 78 26.577 -22.509 -16.466 1.00 0.00 H new ATOM 0 HE2 PHE A 78 25.582 -25.044 -19.745 1.00 0.00 H new ATOM 0 HZ PHE A 78 27.258 -24.133 -18.187 1.00 0.00 H new ATOM 1289 N ILE A 79 19.456 -21.608 -16.783 1.00 0.00 N ATOM 1290 CA ILE A 79 18.496 -20.557 -16.471 1.00 0.00 C ATOM 1291 C ILE A 79 17.826 -20.807 -15.124 1.00 0.00 C ATOM 1292 O ILE A 79 17.507 -19.868 -14.395 1.00 0.00 O ATOM 1293 CB ILE A 79 17.410 -20.446 -17.558 1.00 0.00 C ATOM 1294 CG1 ILE A 79 16.309 -19.481 -17.113 1.00 0.00 C ATOM 1295 CG2 ILE A 79 16.828 -21.817 -17.867 1.00 0.00 C ATOM 1296 CD1 ILE A 79 15.109 -20.173 -16.506 1.00 0.00 C ATOM 0 H ILE A 79 19.199 -22.192 -17.579 1.00 0.00 H new ATOM 0 HA ILE A 79 19.054 -19.622 -16.429 1.00 0.00 H new ATOM 0 HB ILE A 79 17.865 -20.053 -18.467 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.722 -18.782 -16.386 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.984 -18.893 -17.971 1.00 0.00 H new ATOM 0 HG21 ILE A 79 16.062 -21.722 -18.637 1.00 0.00 H new ATOM 0 HG22 ILE A 79 17.620 -22.477 -18.222 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.385 -22.236 -16.964 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.369 -19.428 -16.214 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.671 -20.851 -17.238 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.421 -20.739 -15.628 1.00 0.00 H new ATOM 1308 N ALA A 80 17.618 -22.078 -14.799 1.00 0.00 N ATOM 1309 CA ALA A 80 16.991 -22.452 -13.538 1.00 0.00 C ATOM 1310 C ALA A 80 17.927 -22.197 -12.362 1.00 0.00 C ATOM 1311 O ALA A 80 17.523 -21.632 -11.345 1.00 0.00 O ATOM 1312 CB ALA A 80 16.568 -23.913 -13.571 1.00 0.00 C ATOM 0 H ALA A 80 17.875 -22.867 -15.392 1.00 0.00 H new ATOM 0 HA ALA A 80 16.105 -21.832 -13.404 1.00 0.00 H new ATOM 0 HB1 ALA A 80 16.101 -24.178 -12.622 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.856 -24.067 -14.382 1.00 0.00 H new ATOM 0 HB3 ALA A 80 17.444 -24.542 -13.733 1.00 0.00 H new ATOM 1318 N ARG A 81 19.180 -22.617 -12.507 1.00 0.00 N ATOM 1319 CA ARG A 81 20.173 -22.435 -11.456 1.00 0.00 C ATOM 1320 C ARG A 81 20.593 -20.972 -11.351 1.00 0.00 C ATOM 1321 O ARG A 81 20.940 -20.492 -10.273 1.00 0.00 O ATOM 1322 CB ARG A 81 21.399 -23.311 -11.726 1.00 0.00 C ATOM 1323 CG ARG A 81 22.642 -22.867 -10.972 1.00 0.00 C ATOM 1324 CD ARG A 81 23.730 -23.929 -11.020 1.00 0.00 C ATOM 1325 NE ARG A 81 23.714 -24.672 -12.276 1.00 0.00 N ATOM 1326 CZ ARG A 81 24.039 -24.140 -13.449 1.00 0.00 C ATOM 1327 NH1 ARG A 81 24.403 -22.868 -13.526 1.00 0.00 N ATOM 1328 NH2 ARG A 81 24.000 -24.882 -14.549 1.00 0.00 N ATOM 0 H ARG A 81 19.531 -23.086 -13.342 1.00 0.00 H new ATOM 0 HA ARG A 81 19.722 -22.734 -10.510 1.00 0.00 H new ATOM 0 HB2 ARG A 81 21.167 -24.340 -11.453 1.00 0.00 H new ATOM 0 HB3 ARG A 81 21.611 -23.305 -12.795 1.00 0.00 H new ATOM 0 HG2 ARG A 81 23.018 -21.939 -11.402 1.00 0.00 H new ATOM 0 HG3 ARG A 81 22.384 -22.655 -9.934 1.00 0.00 H new ATOM 0 HD2 ARG A 81 24.704 -23.456 -10.891 1.00 0.00 H new ATOM 0 HD3 ARG A 81 23.598 -24.621 -10.188 1.00 0.00 H new ATOM 0 HE ARG A 81 23.438 -25.654 -12.252 1.00 0.00 H new ATOM 0 HH11 ARG A 81 24.434 -22.295 -12.683 1.00 0.00 H new ATOM 0 HH12 ARG A 81 24.652 -22.463 -14.428 1.00 0.00 H new ATOM 0 HH21 ARG A 81 23.720 -25.861 -14.494 1.00 0.00 H new ATOM 0 HH22 ARG A 81 24.250 -24.473 -15.449 1.00 0.00 H new ATOM 1342 N GLU A 82 20.560 -20.270 -12.480 1.00 0.00 N ATOM 1343 CA GLU A 82 20.939 -18.862 -12.514 1.00 0.00 C ATOM 1344 C GLU A 82 19.836 -17.988 -11.924 1.00 0.00 C ATOM 1345 O GLU A 82 20.092 -17.145 -11.065 1.00 0.00 O ATOM 1346 CB GLU A 82 21.236 -18.426 -13.951 1.00 0.00 C ATOM 1347 CG GLU A 82 22.602 -18.867 -14.450 1.00 0.00 C ATOM 1348 CD GLU A 82 22.800 -18.591 -15.927 1.00 0.00 C ATOM 1349 OE1 GLU A 82 21.914 -17.957 -16.537 1.00 0.00 O ATOM 1350 OE2 GLU A 82 23.843 -19.009 -16.474 1.00 0.00 O ATOM 0 H GLU A 82 20.275 -20.653 -13.382 1.00 0.00 H new ATOM 0 HA GLU A 82 21.839 -18.739 -11.911 1.00 0.00 H new ATOM 0 HB2 GLU A 82 20.469 -18.832 -14.611 1.00 0.00 H new ATOM 0 HB3 GLU A 82 21.169 -17.340 -14.014 1.00 0.00 H new ATOM 0 HG2 GLU A 82 23.376 -18.352 -13.881 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.726 -19.934 -14.264 1.00 0.00 H new ATOM 1357 N GLU A 83 18.609 -18.196 -12.392 1.00 0.00 N ATOM 1358 CA GLU A 83 17.468 -17.425 -11.911 1.00 0.00 C ATOM 1359 C GLU A 83 17.313 -17.569 -10.400 1.00 0.00 C ATOM 1360 O GLU A 83 17.242 -16.576 -9.676 1.00 0.00 O ATOM 1361 CB GLU A 83 16.186 -17.879 -12.613 1.00 0.00 C ATOM 1362 CG GLU A 83 16.001 -17.274 -13.994 1.00 0.00 C ATOM 1363 CD GLU A 83 14.595 -17.463 -14.530 1.00 0.00 C ATOM 1364 OE1 GLU A 83 13.767 -18.072 -13.820 1.00 0.00 O ATOM 1365 OE2 GLU A 83 14.323 -17.003 -15.658 1.00 0.00 O ATOM 0 H GLU A 83 18.380 -18.891 -13.103 1.00 0.00 H new ATOM 0 HA GLU A 83 17.647 -16.375 -12.142 1.00 0.00 H new ATOM 0 HB2 GLU A 83 16.195 -18.965 -12.700 1.00 0.00 H new ATOM 0 HB3 GLU A 83 15.329 -17.616 -11.993 1.00 0.00 H new ATOM 0 HG2 GLU A 83 16.230 -16.209 -13.954 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.713 -17.728 -14.684 1.00 0.00 H new ATOM 1372 N ILE A 84 17.260 -18.811 -9.932 1.00 0.00 N ATOM 1373 CA ILE A 84 17.113 -19.085 -8.508 1.00 0.00 C ATOM 1374 C ILE A 84 18.285 -18.517 -7.715 1.00 0.00 C ATOM 1375 O ILE A 84 18.135 -18.134 -6.556 1.00 0.00 O ATOM 1376 CB ILE A 84 17.007 -20.597 -8.233 1.00 0.00 C ATOM 1377 CG1 ILE A 84 18.322 -21.295 -8.585 1.00 0.00 C ATOM 1378 CG2 ILE A 84 15.854 -21.199 -9.023 1.00 0.00 C ATOM 1379 CD1 ILE A 84 19.172 -21.626 -7.378 1.00 0.00 C ATOM 0 H ILE A 84 17.317 -19.644 -10.518 1.00 0.00 H new ATOM 0 HA ILE A 84 16.191 -18.600 -8.187 1.00 0.00 H new ATOM 0 HB ILE A 84 16.812 -20.745 -7.171 1.00 0.00 H new ATOM 0 HG12 ILE A 84 18.102 -22.214 -9.128 1.00 0.00 H new ATOM 0 HG13 ILE A 84 18.894 -20.657 -9.258 1.00 0.00 H new ATOM 0 HG21 ILE A 84 15.792 -22.268 -8.818 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.921 -20.718 -8.729 1.00 0.00 H new ATOM 0 HG23 ILE A 84 16.022 -21.043 -10.089 1.00 0.00 H new ATOM 0 HD11 ILE A 84 20.088 -22.119 -7.702 1.00 0.00 H new ATOM 0 HD12 ILE A 84 19.423 -20.708 -6.847 1.00 0.00 H new ATOM 0 HD13 ILE A 84 18.618 -22.290 -6.714 1.00 0.00 H new ATOM 1391 N GLU A 85 19.452 -18.463 -8.351 1.00 0.00 N ATOM 1392 CA GLU A 85 20.650 -17.940 -7.704 1.00 0.00 C ATOM 1393 C GLU A 85 20.424 -16.513 -7.214 1.00 0.00 C ATOM 1394 O GLU A 85 20.750 -16.178 -6.076 1.00 0.00 O ATOM 1395 CB GLU A 85 21.835 -17.978 -8.671 1.00 0.00 C ATOM 1396 CG GLU A 85 22.980 -18.858 -8.195 1.00 0.00 C ATOM 1397 CD GLU A 85 23.969 -18.108 -7.325 1.00 0.00 C ATOM 1398 OE1 GLU A 85 24.441 -17.033 -7.752 1.00 0.00 O ATOM 1399 OE2 GLU A 85 24.271 -18.596 -6.216 1.00 0.00 O ATOM 0 H GLU A 85 19.593 -18.775 -9.312 1.00 0.00 H new ATOM 0 HA GLU A 85 20.873 -18.570 -6.843 1.00 0.00 H new ATOM 0 HB2 GLU A 85 21.491 -18.337 -9.641 1.00 0.00 H new ATOM 0 HB3 GLU A 85 22.205 -16.963 -8.820 1.00 0.00 H new ATOM 0 HG2 GLU A 85 22.576 -19.702 -7.635 1.00 0.00 H new ATOM 0 HG3 GLU A 85 23.501 -19.269 -9.060 1.00 0.00 H new ATOM 1406 N MET A 86 19.865 -15.677 -8.083 1.00 0.00 N ATOM 1407 CA MET A 86 19.596 -14.285 -7.739 1.00 0.00 C ATOM 1408 C MET A 86 18.350 -14.173 -6.866 1.00 0.00 C ATOM 1409 O MET A 86 18.359 -13.491 -5.841 1.00 0.00 O ATOM 1410 CB MET A 86 19.421 -13.449 -9.008 1.00 0.00 C ATOM 1411 CG MET A 86 19.640 -11.960 -8.789 1.00 0.00 C ATOM 1412 SD MET A 86 21.358 -11.559 -8.417 1.00 0.00 S ATOM 1413 CE MET A 86 21.306 -11.476 -6.628 1.00 0.00 C ATOM 0 H MET A 86 19.590 -15.939 -9.030 1.00 0.00 H new ATOM 0 HA MET A 86 20.448 -13.904 -7.176 1.00 0.00 H new ATOM 0 HB2 MET A 86 20.120 -13.803 -9.766 1.00 0.00 H new ATOM 0 HB3 MET A 86 18.417 -13.606 -9.402 1.00 0.00 H new ATOM 0 HG2 MET A 86 19.329 -11.416 -9.681 1.00 0.00 H new ATOM 0 HG3 MET A 86 19.006 -11.620 -7.970 1.00 0.00 H new ATOM 0 HE1 MET A 86 21.412 -10.439 -6.309 1.00 0.00 H new ATOM 0 HE2 MET A 86 20.354 -11.870 -6.273 1.00 0.00 H new ATOM 0 HE3 MET A 86 22.121 -12.068 -6.212 1.00 0.00 H new ATOM 1423 N MET A 87 17.281 -14.846 -7.278 1.00 0.00 N ATOM 1424 CA MET A 87 16.028 -14.821 -6.532 1.00 0.00 C ATOM 1425 C MET A 87 16.251 -15.238 -5.082 1.00 0.00 C ATOM 1426 O MET A 87 15.832 -14.545 -4.155 1.00 0.00 O ATOM 1427 CB MET A 87 15.001 -15.745 -7.188 1.00 0.00 C ATOM 1428 CG MET A 87 14.632 -15.335 -8.605 1.00 0.00 C ATOM 1429 SD MET A 87 12.850 -15.235 -8.857 1.00 0.00 S ATOM 1430 CE MET A 87 12.478 -16.923 -9.325 1.00 0.00 C ATOM 0 H MET A 87 17.257 -15.415 -8.124 1.00 0.00 H new ATOM 0 HA MET A 87 15.647 -13.800 -6.544 1.00 0.00 H new ATOM 0 HB2 MET A 87 15.396 -16.761 -7.204 1.00 0.00 H new ATOM 0 HB3 MET A 87 14.098 -15.763 -6.577 1.00 0.00 H new ATOM 0 HG2 MET A 87 15.081 -14.367 -8.828 1.00 0.00 H new ATOM 0 HG3 MET A 87 15.055 -16.052 -9.308 1.00 0.00 H new ATOM 0 HE1 MET A 87 11.409 -17.021 -9.515 1.00 0.00 H new ATOM 0 HE2 MET A 87 13.032 -17.181 -10.228 1.00 0.00 H new ATOM 0 HE3 MET A 87 12.766 -17.596 -8.518 1.00 0.00 H new ATOM 1440 N VAL A 88 16.914 -16.375 -4.892 1.00 0.00 N ATOM 1441 CA VAL A 88 17.193 -16.884 -3.555 1.00 0.00 C ATOM 1442 C VAL A 88 18.096 -15.929 -2.781 1.00 0.00 C ATOM 1443 O VAL A 88 17.896 -15.698 -1.589 1.00 0.00 O ATOM 1444 CB VAL A 88 17.858 -18.272 -3.610 1.00 0.00 C ATOM 1445 CG1 VAL A 88 18.314 -18.700 -2.223 1.00 0.00 C ATOM 1446 CG2 VAL A 88 16.905 -19.296 -4.207 1.00 0.00 C ATOM 0 H VAL A 88 17.268 -16.961 -5.648 1.00 0.00 H new ATOM 0 HA VAL A 88 16.235 -16.969 -3.042 1.00 0.00 H new ATOM 0 HB VAL A 88 18.736 -18.210 -4.252 1.00 0.00 H new ATOM 0 HG11 VAL A 88 18.782 -19.683 -2.281 1.00 0.00 H new ATOM 0 HG12 VAL A 88 19.034 -17.978 -1.838 1.00 0.00 H new ATOM 0 HG13 VAL A 88 17.454 -18.746 -1.555 1.00 0.00 H new ATOM 0 HG21 VAL A 88 17.391 -20.271 -4.238 1.00 0.00 H new ATOM 0 HG22 VAL A 88 16.007 -19.358 -3.593 1.00 0.00 H new ATOM 0 HG23 VAL A 88 16.633 -18.994 -5.218 1.00 0.00 H new ATOM 1456 N PHE A 89 19.090 -15.377 -3.468 1.00 0.00 N ATOM 1457 CA PHE A 89 20.025 -14.447 -2.846 1.00 0.00 C ATOM 1458 C PHE A 89 19.288 -13.251 -2.251 1.00 0.00 C ATOM 1459 O PHE A 89 19.423 -12.951 -1.064 1.00 0.00 O ATOM 1460 CB PHE A 89 21.057 -13.967 -3.868 1.00 0.00 C ATOM 1461 CG PHE A 89 22.192 -13.196 -3.258 1.00 0.00 C ATOM 1462 CD1 PHE A 89 22.011 -11.889 -2.835 1.00 0.00 C ATOM 1463 CD2 PHE A 89 23.441 -13.778 -3.107 1.00 0.00 C ATOM 1464 CE1 PHE A 89 23.054 -11.177 -2.274 1.00 0.00 C ATOM 1465 CE2 PHE A 89 24.487 -13.071 -2.546 1.00 0.00 C ATOM 1466 CZ PHE A 89 24.293 -11.769 -2.128 1.00 0.00 C ATOM 0 H PHE A 89 19.269 -15.557 -4.456 1.00 0.00 H new ATOM 0 HA PHE A 89 20.539 -14.972 -2.041 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.459 -14.830 -4.399 1.00 0.00 H new ATOM 0 HB3 PHE A 89 20.559 -13.340 -4.608 1.00 0.00 H new ATOM 0 HD1 PHE A 89 21.044 -11.421 -2.945 1.00 0.00 H new ATOM 0 HD2 PHE A 89 23.598 -14.796 -3.432 1.00 0.00 H new ATOM 0 HE1 PHE A 89 22.900 -10.158 -1.950 1.00 0.00 H new ATOM 0 HE2 PHE A 89 25.455 -13.536 -2.434 1.00 0.00 H new ATOM 0 HZ PHE A 89 25.109 -11.215 -1.688 1.00 0.00 H new ATOM 1476 N LEU A 90 18.508 -12.571 -3.084 1.00 0.00 N ATOM 1477 CA LEU A 90 17.749 -11.406 -2.642 1.00 0.00 C ATOM 1478 C LEU A 90 16.759 -11.785 -1.546 1.00 0.00 C ATOM 1479 O LEU A 90 16.745 -11.184 -0.472 1.00 0.00 O ATOM 1480 CB LEU A 90 17.005 -10.780 -3.823 1.00 0.00 C ATOM 1481 CG LEU A 90 17.834 -10.530 -5.083 1.00 0.00 C ATOM 1482 CD1 LEU A 90 16.948 -10.553 -6.319 1.00 0.00 C ATOM 1483 CD2 LEU A 90 18.574 -9.204 -4.980 1.00 0.00 C ATOM 0 H LEU A 90 18.384 -12.806 -4.069 1.00 0.00 H new ATOM 0 HA LEU A 90 18.451 -10.678 -2.236 1.00 0.00 H new ATOM 0 HB2 LEU A 90 16.169 -11.429 -4.085 1.00 0.00 H new ATOM 0 HB3 LEU A 90 16.581 -9.830 -3.497 1.00 0.00 H new ATOM 0 HG LEU A 90 18.570 -11.329 -5.174 1.00 0.00 H new ATOM 0 HD11 LEU A 90 17.556 -10.373 -7.206 1.00 0.00 H new ATOM 0 HD12 LEU A 90 16.464 -11.526 -6.402 1.00 0.00 H new ATOM 0 HD13 LEU A 90 16.188 -9.776 -6.236 1.00 0.00 H new ATOM 0 HD21 LEU A 90 19.159 -9.042 -5.885 1.00 0.00 H new ATOM 0 HD22 LEU A 90 17.854 -8.394 -4.864 1.00 0.00 H new ATOM 0 HD23 LEU A 90 19.240 -9.225 -4.117 1.00 0.00 H new ATOM 1495 N SER A 91 15.932 -12.789 -1.823 1.00 0.00 N ATOM 1496 CA SER A 91 14.937 -13.248 -0.861 1.00 0.00 C ATOM 1497 C SER A 91 15.581 -13.530 0.493 1.00 0.00 C ATOM 1498 O SER A 91 15.048 -13.153 1.537 1.00 0.00 O ATOM 1499 CB SER A 91 14.239 -14.507 -1.379 1.00 0.00 C ATOM 1500 OG SER A 91 15.127 -15.611 -1.399 1.00 0.00 O ATOM 0 H SER A 91 15.932 -13.300 -2.706 1.00 0.00 H new ATOM 0 HA SER A 91 14.197 -12.457 -0.735 1.00 0.00 H new ATOM 0 HB2 SER A 91 13.382 -14.737 -0.747 1.00 0.00 H new ATOM 0 HB3 SER A 91 13.855 -14.327 -2.383 1.00 0.00 H new ATOM 0 HG SER A 91 16.036 -15.297 -1.589 1.00 0.00 H new ATOM 1506 N SER A 92 16.730 -14.198 0.467 1.00 0.00 N ATOM 1507 CA SER A 92 17.446 -14.535 1.692 1.00 0.00 C ATOM 1508 C SER A 92 17.856 -13.274 2.446 1.00 0.00 C ATOM 1509 O SER A 92 17.935 -13.269 3.675 1.00 0.00 O ATOM 1510 CB SER A 92 18.683 -15.376 1.370 1.00 0.00 C ATOM 1511 OG SER A 92 19.485 -15.564 2.523 1.00 0.00 O ATOM 0 H SER A 92 17.185 -14.516 -0.389 1.00 0.00 H new ATOM 0 HA SER A 92 16.777 -15.115 2.327 1.00 0.00 H new ATOM 0 HB2 SER A 92 18.376 -16.344 0.975 1.00 0.00 H new ATOM 0 HB3 SER A 92 19.268 -14.885 0.592 1.00 0.00 H new ATOM 0 HG SER A 92 20.268 -16.106 2.292 1.00 0.00 H new