USER MOD reduce.3.24.130724 H: found=0, std=0, add=618, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 619 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 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= -0.145 K(o=-0.15,f=-2.4!) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 GLN : amide:sc= -0.0242 X(o=-0.024,f=-0.49) USER MOD Single : A 167 THR OG1 : rot 180:sc= -0.0573 USER MOD Single : A 173 CYS SG : rot 180:sc= -0.0606 USER MOD Single : A 176 THR OG1 : rot -100:sc= 1.96 USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 LYS NZ :NH3+ 168:sc= -0.0154 (180deg=-0.186) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 187 MET CE :methyl -164:sc= -0.0766 (180deg=-0.456) USER MOD Single : A 194 CYS SG : rot -28:sc= 0.474 USER MOD Single : A 195 CYS SG : rot 180:sc= 0 USER MOD Single : A 198 TYR OH : rot 180:sc= -0.0555 USER MOD Single : A 201 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 205 LYS NZ :NH3+ 174:sc= 1.16 (180deg=1.13) USER MOD Single : A 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 THR OG1 : rot 180:sc= 0 USER MOD Single : A 215 SER OG : rot 180:sc= 0 USER MOD Single : A 218 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 223 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 114 N LYS A 154 7.417 15.503 -7.553 1.00 63.41 N ATOM 115 CA LYS A 154 7.947 14.129 -7.505 1.00 3.30 C ATOM 116 C LYS A 154 6.824 13.067 -7.417 1.00 14.12 C ATOM 117 O LYS A 154 5.745 13.336 -6.880 1.00 44.32 O ATOM 118 CB LYS A 154 8.921 14.017 -6.320 1.00 41.23 C ATOM 119 CG LYS A 154 10.069 15.023 -6.411 1.00 32.34 C ATOM 120 CD LYS A 154 10.884 15.109 -5.126 1.00 34.24 C ATOM 121 CE LYS A 154 11.896 16.249 -5.194 1.00 51.34 C ATOM 122 NZ LYS A 154 12.622 16.439 -3.914 1.00 74.31 N ATOM 0 HA LYS A 154 8.476 13.926 -8.436 1.00 3.30 H new ATOM 0 HB2 LYS A 154 8.376 14.175 -5.389 1.00 41.23 H new ATOM 0 HB3 LYS A 154 9.329 13.007 -6.283 1.00 41.23 H new ATOM 0 HG2 LYS A 154 10.726 14.743 -7.234 1.00 32.34 H new ATOM 0 HG3 LYS A 154 9.665 16.008 -6.646 1.00 32.34 H new ATOM 0 HD2 LYS A 154 10.217 15.261 -4.278 1.00 34.24 H new ATOM 0 HD3 LYS A 154 11.404 14.166 -4.958 1.00 34.24 H new ATOM 0 HE2 LYS A 154 12.614 16.047 -5.989 1.00 51.34 H new ATOM 0 HE3 LYS A 154 11.381 17.173 -5.457 1.00 51.34 H new ATOM 0 HZ1 LYS A 154 13.297 17.224 -4.011 1.00 74.31 H new ATOM 0 HZ2 LYS A 154 11.942 16.659 -3.158 1.00 74.31 H new ATOM 0 HZ3 LYS A 154 13.136 15.568 -3.674 1.00 74.31 H new ATOM 136 N PRO A 155 7.067 11.844 -7.950 1.00 1.51 N ATOM 137 CA PRO A 155 6.027 10.789 -8.082 1.00 45.42 C ATOM 138 C PRO A 155 5.396 10.340 -6.747 1.00 2.23 C ATOM 139 O PRO A 155 6.064 10.278 -5.711 1.00 41.23 O ATOM 140 CB PRO A 155 6.785 9.618 -8.737 1.00 53.33 C ATOM 141 CG PRO A 155 8.226 9.887 -8.457 1.00 42.44 C ATOM 142 CD PRO A 155 8.370 11.383 -8.467 1.00 35.43 C ATOM 0 HA PRO A 155 5.178 11.160 -8.656 1.00 45.42 H new ATOM 0 HB2 PRO A 155 6.473 8.662 -8.317 1.00 53.33 H new ATOM 0 HB3 PRO A 155 6.593 9.573 -9.809 1.00 53.33 H new ATOM 0 HG2 PRO A 155 8.522 9.472 -7.494 1.00 42.44 H new ATOM 0 HG3 PRO A 155 8.864 9.427 -9.212 1.00 42.44 H new ATOM 0 HD2 PRO A 155 9.195 11.714 -7.836 1.00 35.43 H new ATOM 0 HD3 PRO A 155 8.564 11.763 -9.470 1.00 35.43 H new ATOM 150 N ILE A 156 4.100 10.001 -6.796 1.00 14.02 N ATOM 151 CA ILE A 156 3.344 9.580 -5.602 1.00 53.21 C ATOM 152 C ILE A 156 2.504 8.310 -5.859 1.00 11.21 C ATOM 153 O ILE A 156 2.334 7.876 -6.999 1.00 3.20 O ATOM 154 CB ILE A 156 2.381 10.701 -5.126 1.00 74.02 C ATOM 155 CG1 ILE A 156 1.384 11.057 -6.248 1.00 71.14 C ATOM 156 CG2 ILE A 156 3.165 11.936 -4.677 1.00 62.44 C ATOM 157 CD1 ILE A 156 0.296 12.024 -5.828 1.00 2.43 C ATOM 0 H ILE A 156 3.548 10.010 -7.654 1.00 14.02 H new ATOM 0 HA ILE A 156 4.090 9.368 -4.836 1.00 53.21 H new ATOM 0 HB ILE A 156 1.817 10.335 -4.268 1.00 74.02 H new ATOM 0 HG12 ILE A 156 1.934 11.488 -7.085 1.00 71.14 H new ATOM 0 HG13 ILE A 156 0.919 10.140 -6.610 1.00 71.14 H new ATOM 0 HG21 ILE A 156 2.470 12.708 -4.348 1.00 62.44 H new ATOM 0 HG22 ILE A 156 3.826 11.668 -3.853 1.00 62.44 H new ATOM 0 HG23 ILE A 156 3.758 12.313 -5.510 1.00 62.44 H new ATOM 0 HD11 ILE A 156 -0.362 12.222 -6.674 1.00 2.43 H new ATOM 0 HD12 ILE A 156 -0.282 11.589 -5.013 1.00 2.43 H new ATOM 0 HD13 ILE A 156 0.748 12.958 -5.494 1.00 2.43 H new ATOM 169 N VAL A 157 1.981 7.723 -4.781 1.00 11.43 N ATOM 170 CA VAL A 157 1.053 6.584 -4.863 1.00 44.35 C ATOM 171 C VAL A 157 -0.158 6.815 -3.942 1.00 21.31 C ATOM 172 O VAL A 157 -0.008 7.318 -2.829 1.00 41.45 O ATOM 173 CB VAL A 157 1.744 5.252 -4.465 1.00 41.40 C ATOM 174 CG1 VAL A 157 0.766 4.080 -4.554 1.00 13.50 C ATOM 175 CG2 VAL A 157 2.977 4.993 -5.330 1.00 35.11 C ATOM 0 H VAL A 157 2.186 8.020 -3.827 1.00 11.43 H new ATOM 0 HA VAL A 157 0.724 6.509 -5.900 1.00 44.35 H new ATOM 0 HB VAL A 157 2.071 5.344 -3.429 1.00 41.40 H new ATOM 0 HG11 VAL A 157 1.275 3.159 -4.270 1.00 13.50 H new ATOM 0 HG12 VAL A 157 -0.073 4.254 -3.880 1.00 13.50 H new ATOM 0 HG13 VAL A 157 0.397 3.991 -5.576 1.00 13.50 H new ATOM 0 HG21 VAL A 157 3.441 4.054 -5.030 1.00 35.11 H new ATOM 0 HG22 VAL A 157 2.681 4.933 -6.377 1.00 35.11 H new ATOM 0 HG23 VAL A 157 3.690 5.808 -5.201 1.00 35.11 H new ATOM 185 N ARG A 158 -1.352 6.441 -4.407 1.00 33.21 N ATOM 186 CA ARG A 158 -2.595 6.684 -3.659 1.00 2.32 C ATOM 187 C ARG A 158 -3.120 5.398 -2.998 1.00 14.44 C ATOM 188 O ARG A 158 -3.716 4.549 -3.658 1.00 61.11 O ATOM 189 CB ARG A 158 -3.654 7.265 -4.606 1.00 62.14 C ATOM 190 CG ARG A 158 -3.302 8.649 -5.145 1.00 24.21 C ATOM 191 CD ARG A 158 -4.232 9.075 -6.275 1.00 11.02 C ATOM 192 NE ARG A 158 -3.974 10.446 -6.707 1.00 20.14 N ATOM 193 CZ ARG A 158 -3.633 10.791 -7.922 1.00 55.01 C ATOM 194 NH1 ARG A 158 -3.505 9.901 -8.856 1.00 64.42 N ATOM 195 NH2 ARG A 158 -3.439 12.039 -8.200 1.00 72.25 N ATOM 0 H ARG A 158 -1.488 5.967 -5.300 1.00 33.21 H new ATOM 0 HA ARG A 158 -2.382 7.397 -2.862 1.00 2.32 H new ATOM 0 HB2 ARG A 158 -3.792 6.583 -5.445 1.00 62.14 H new ATOM 0 HB3 ARG A 158 -4.607 7.321 -4.080 1.00 62.14 H new ATOM 0 HG2 ARG A 158 -3.357 9.378 -4.336 1.00 24.21 H new ATOM 0 HG3 ARG A 158 -2.273 8.647 -5.504 1.00 24.21 H new ATOM 0 HD2 ARG A 158 -4.108 8.399 -7.121 1.00 11.02 H new ATOM 0 HD3 ARG A 158 -5.267 8.987 -5.945 1.00 11.02 H new ATOM 0 HE ARG A 158 -4.066 11.187 -6.012 1.00 20.14 H new ATOM 0 HH11 ARG A 158 -3.671 8.916 -8.648 1.00 64.42 H new ATOM 0 HH12 ARG A 158 -3.239 10.186 -9.799 1.00 64.42 H new ATOM 0 HH21 ARG A 158 -3.552 12.747 -7.474 1.00 72.25 H new ATOM 0 HH22 ARG A 158 -3.173 12.316 -9.145 1.00 72.25 H new ATOM 209 N VAL A 159 -2.897 5.263 -1.690 1.00 24.21 N ATOM 210 CA VAL A 159 -3.312 4.062 -0.950 1.00 11.50 C ATOM 211 C VAL A 159 -4.584 4.317 -0.122 1.00 13.44 C ATOM 212 O VAL A 159 -4.760 5.389 0.455 1.00 74.32 O ATOM 213 CB VAL A 159 -2.185 3.568 -0.005 1.00 12.42 C ATOM 214 CG1 VAL A 159 -2.582 2.264 0.690 1.00 23.03 C ATOM 215 CG2 VAL A 159 -0.872 3.401 -0.774 1.00 51.13 C ATOM 0 H VAL A 159 -2.432 5.968 -1.118 1.00 24.21 H new ATOM 0 HA VAL A 159 -3.523 3.294 -1.694 1.00 11.50 H new ATOM 0 HB VAL A 159 -2.035 4.323 0.767 1.00 12.42 H new ATOM 0 HG11 VAL A 159 -1.774 1.941 1.346 1.00 23.03 H new ATOM 0 HG12 VAL A 159 -3.485 2.426 1.279 1.00 23.03 H new ATOM 0 HG13 VAL A 159 -2.771 1.495 -0.059 1.00 23.03 H new ATOM 0 HG21 VAL A 159 -0.094 3.054 -0.094 1.00 51.13 H new ATOM 0 HG22 VAL A 159 -1.008 2.672 -1.572 1.00 51.13 H new ATOM 0 HG23 VAL A 159 -0.578 4.359 -1.204 1.00 51.13 H new ATOM 225 N PHE A 160 -5.465 3.321 -0.071 1.00 64.40 N ATOM 226 CA PHE A 160 -6.704 3.409 0.708 1.00 25.42 C ATOM 227 C PHE A 160 -6.692 2.422 1.885 1.00 1.11 C ATOM 228 O PHE A 160 -6.712 1.204 1.694 1.00 11.50 O ATOM 229 CB PHE A 160 -7.916 3.146 -0.197 1.00 72.23 C ATOM 230 CG PHE A 160 -8.115 4.207 -1.256 1.00 73.41 C ATOM 231 CD1 PHE A 160 -7.404 4.165 -2.449 1.00 44.11 C ATOM 232 CD2 PHE A 160 -9.003 5.256 -1.050 1.00 24.13 C ATOM 233 CE1 PHE A 160 -7.577 5.143 -3.411 1.00 3.11 C ATOM 234 CE2 PHE A 160 -9.175 6.236 -2.008 1.00 50.44 C ATOM 235 CZ PHE A 160 -8.461 6.181 -3.189 1.00 42.00 C ATOM 0 H PHE A 160 -5.345 2.436 -0.563 1.00 64.40 H new ATOM 0 HA PHE A 160 -6.777 4.417 1.117 1.00 25.42 H new ATOM 0 HB2 PHE A 160 -7.795 2.177 -0.682 1.00 72.23 H new ATOM 0 HB3 PHE A 160 -8.813 3.084 0.419 1.00 72.23 H new ATOM 0 HD1 PHE A 160 -6.708 3.359 -2.627 1.00 44.11 H new ATOM 0 HD2 PHE A 160 -9.566 5.306 -0.129 1.00 24.13 H new ATOM 0 HE1 PHE A 160 -7.021 5.095 -4.336 1.00 3.11 H new ATOM 0 HE2 PHE A 160 -9.868 7.046 -1.834 1.00 50.44 H new ATOM 0 HZ PHE A 160 -8.594 6.948 -3.938 1.00 42.00 H new ATOM 245 N LEU A 161 -6.664 2.966 3.098 1.00 1.15 N ATOM 246 CA LEU A 161 -6.615 2.164 4.324 1.00 71.20 C ATOM 247 C LEU A 161 -8.030 1.750 4.771 1.00 34.20 C ATOM 248 O LEU A 161 -9.022 2.353 4.358 1.00 31.32 O ATOM 249 CB LEU A 161 -5.925 2.968 5.442 1.00 74.53 C ATOM 250 CG LEU A 161 -4.475 3.401 5.157 1.00 43.43 C ATOM 251 CD1 LEU A 161 -3.918 4.224 6.320 1.00 2.55 C ATOM 252 CD2 LEU A 161 -3.593 2.182 4.879 1.00 31.12 C ATOM 0 H LEU A 161 -6.674 3.973 3.263 1.00 1.15 H new ATOM 0 HA LEU A 161 -6.044 1.258 4.121 1.00 71.20 H new ATOM 0 HB2 LEU A 161 -6.518 3.860 5.642 1.00 74.53 H new ATOM 0 HB3 LEU A 161 -5.933 2.369 6.353 1.00 74.53 H new ATOM 0 HG LEU A 161 -4.474 4.030 4.267 1.00 43.43 H new ATOM 0 HD11 LEU A 161 -2.893 4.520 6.098 1.00 2.55 H new ATOM 0 HD12 LEU A 161 -4.530 5.115 6.461 1.00 2.55 H new ATOM 0 HD13 LEU A 161 -3.934 3.625 7.230 1.00 2.55 H new ATOM 0 HD21 LEU A 161 -2.572 2.509 4.680 1.00 31.12 H new ATOM 0 HD22 LEU A 161 -3.600 1.522 5.747 1.00 31.12 H new ATOM 0 HD23 LEU A 161 -3.977 1.645 4.012 1.00 31.12 H new ATOM 264 N PRO A 162 -8.147 0.712 5.620 1.00 0.21 N ATOM 265 CA PRO A 162 -9.450 0.286 6.162 1.00 54.55 C ATOM 266 C PRO A 162 -10.127 1.386 7.003 1.00 15.24 C ATOM 267 O PRO A 162 -9.508 2.403 7.335 1.00 53.50 O ATOM 268 CB PRO A 162 -9.099 -0.936 7.032 1.00 23.43 C ATOM 269 CG PRO A 162 -7.638 -0.804 7.317 1.00 74.24 C ATOM 270 CD PRO A 162 -7.042 -0.131 6.111 1.00 50.24 C ATOM 0 HA PRO A 162 -10.166 0.063 5.371 1.00 54.55 H new ATOM 0 HB2 PRO A 162 -9.681 -0.944 7.953 1.00 23.43 H new ATOM 0 HB3 PRO A 162 -9.316 -1.868 6.509 1.00 23.43 H new ATOM 0 HG2 PRO A 162 -7.467 -0.214 8.218 1.00 74.24 H new ATOM 0 HG3 PRO A 162 -7.183 -1.780 7.484 1.00 74.24 H new ATOM 0 HD2 PRO A 162 -6.167 0.463 6.372 1.00 50.24 H new ATOM 0 HD3 PRO A 162 -6.723 -0.855 5.361 1.00 50.24 H new ATOM 278 N ASN A 163 -11.400 1.174 7.342 1.00 41.31 N ATOM 279 CA ASN A 163 -12.178 2.145 8.130 1.00 33.24 C ATOM 280 C ASN A 163 -12.337 3.494 7.397 1.00 62.04 C ATOM 281 O ASN A 163 -12.422 4.550 8.032 1.00 15.43 O ATOM 282 CB ASN A 163 -11.546 2.348 9.520 1.00 53.15 C ATOM 283 CG ASN A 163 -11.613 1.094 10.379 1.00 52.31 C ATOM 284 OD1 ASN A 163 -11.578 -0.024 9.878 1.00 14.24 O ATOM 285 ND2 ASN A 163 -11.717 1.268 11.680 1.00 24.44 N ATOM 0 H ASN A 163 -11.920 0.336 7.084 1.00 41.31 H new ATOM 0 HA ASN A 163 -13.178 1.730 8.259 1.00 33.24 H new ATOM 0 HB2 ASN A 163 -10.505 2.648 9.402 1.00 53.15 H new ATOM 0 HB3 ASN A 163 -12.057 3.163 10.032 1.00 53.15 H new ATOM 0 HD21 ASN A 163 -11.771 0.460 12.300 1.00 24.44 H new ATOM 0 HD22 ASN A 163 -11.744 2.211 12.068 1.00 24.44 H new ATOM 292 N LYS A 164 -12.398 3.436 6.060 1.00 14.21 N ATOM 293 CA LYS A 164 -12.658 4.614 5.208 1.00 20.42 C ATOM 294 C LYS A 164 -11.498 5.630 5.209 1.00 61.52 C ATOM 295 O LYS A 164 -11.691 6.803 4.883 1.00 41.42 O ATOM 296 CB LYS A 164 -13.969 5.306 5.631 1.00 53.14 C ATOM 297 CG LYS A 164 -15.200 4.406 5.561 1.00 70.20 C ATOM 298 CD LYS A 164 -15.486 3.928 4.140 1.00 64.12 C ATOM 299 CE LYS A 164 -16.699 3.003 4.090 1.00 3.01 C ATOM 300 NZ LYS A 164 -17.058 2.629 2.697 1.00 43.33 N ATOM 0 H LYS A 164 -12.269 2.572 5.534 1.00 14.21 H new ATOM 0 HA LYS A 164 -12.751 4.243 4.188 1.00 20.42 H new ATOM 0 HB2 LYS A 164 -13.860 5.675 6.651 1.00 53.14 H new ATOM 0 HB3 LYS A 164 -14.131 6.175 4.993 1.00 53.14 H new ATOM 0 HG2 LYS A 164 -15.054 3.543 6.210 1.00 70.20 H new ATOM 0 HG3 LYS A 164 -16.066 4.948 5.941 1.00 70.20 H new ATOM 0 HD2 LYS A 164 -15.658 4.789 3.494 1.00 64.12 H new ATOM 0 HD3 LYS A 164 -14.613 3.405 3.749 1.00 64.12 H new ATOM 0 HE2 LYS A 164 -16.491 2.101 4.665 1.00 3.01 H new ATOM 0 HE3 LYS A 164 -17.549 3.494 4.564 1.00 3.01 H new ATOM 0 HZ1 LYS A 164 -17.887 2.001 2.709 1.00 43.33 H new ATOM 0 HZ2 LYS A 164 -17.282 3.487 2.154 1.00 43.33 H new ATOM 0 HZ3 LYS A 164 -16.257 2.137 2.252 1.00 43.33 H new ATOM 314 N GLN A 165 -10.291 5.175 5.534 1.00 51.34 N ATOM 315 CA GLN A 165 -9.116 6.059 5.577 1.00 51.14 C ATOM 316 C GLN A 165 -8.265 5.933 4.300 1.00 51.23 C ATOM 317 O GLN A 165 -8.416 4.985 3.532 1.00 24.34 O ATOM 318 CB GLN A 165 -8.263 5.731 6.808 1.00 64.13 C ATOM 319 CG GLN A 165 -9.017 5.872 8.129 1.00 3.00 C ATOM 320 CD GLN A 165 -9.456 7.300 8.415 1.00 14.40 C ATOM 321 OE1 GLN A 165 -8.786 8.261 8.045 1.00 50.34 O ATOM 322 NE2 GLN A 165 -10.589 7.455 9.068 1.00 64.32 N ATOM 0 H GLN A 165 -10.095 4.203 5.772 1.00 51.34 H new ATOM 0 HA GLN A 165 -9.472 7.087 5.641 1.00 51.14 H new ATOM 0 HB2 GLN A 165 -7.889 4.711 6.720 1.00 64.13 H new ATOM 0 HB3 GLN A 165 -7.394 6.389 6.823 1.00 64.13 H new ATOM 0 HG2 GLN A 165 -9.894 5.225 8.111 1.00 3.00 H new ATOM 0 HG3 GLN A 165 -8.381 5.524 8.943 1.00 3.00 H new ATOM 0 HE21 GLN A 165 -11.124 6.638 9.363 1.00 64.32 H new ATOM 0 HE22 GLN A 165 -10.932 8.392 9.279 1.00 64.32 H new ATOM 331 N ARG A 166 -7.376 6.896 4.066 1.00 63.24 N ATOM 332 CA ARG A 166 -6.458 6.837 2.919 1.00 22.54 C ATOM 333 C ARG A 166 -5.178 7.651 3.166 1.00 61.34 C ATOM 334 O ARG A 166 -5.116 8.465 4.086 1.00 12.34 O ATOM 335 CB ARG A 166 -7.169 7.296 1.623 1.00 41.25 C ATOM 336 CG ARG A 166 -7.987 8.588 1.748 1.00 74.01 C ATOM 337 CD ARG A 166 -7.115 9.832 1.910 1.00 63.34 C ATOM 338 NE ARG A 166 -7.911 11.047 2.070 1.00 71.15 N ATOM 339 CZ ARG A 166 -7.427 12.258 1.994 1.00 53.04 C ATOM 340 NH1 ARG A 166 -6.168 12.450 1.769 1.00 62.12 N ATOM 341 NH2 ARG A 166 -8.202 13.280 2.155 1.00 32.44 N ATOM 0 H ARG A 166 -7.268 7.725 4.650 1.00 63.24 H new ATOM 0 HA ARG A 166 -6.157 5.797 2.795 1.00 22.54 H new ATOM 0 HB2 ARG A 166 -6.418 7.434 0.845 1.00 41.25 H new ATOM 0 HB3 ARG A 166 -7.831 6.497 1.288 1.00 41.25 H new ATOM 0 HG2 ARG A 166 -8.613 8.702 0.863 1.00 74.01 H new ATOM 0 HG3 ARG A 166 -8.657 8.506 2.604 1.00 74.01 H new ATOM 0 HD2 ARG A 166 -6.466 9.708 2.777 1.00 63.34 H new ATOM 0 HD3 ARG A 166 -6.468 9.936 1.039 1.00 63.34 H new ATOM 0 HE ARG A 166 -8.909 10.943 2.253 1.00 71.15 H new ATOM 0 HH11 ARG A 166 -5.544 11.652 1.649 1.00 62.12 H new ATOM 0 HH12 ARG A 166 -5.799 13.399 1.711 1.00 62.12 H new ATOM 0 HH21 ARG A 166 -9.195 13.142 2.342 1.00 32.44 H new ATOM 0 HH22 ARG A 166 -7.820 14.224 2.095 1.00 32.44 H new ATOM 355 N THR A 167 -4.163 7.420 2.341 1.00 32.45 N ATOM 356 CA THR A 167 -2.888 8.145 2.442 1.00 60.23 C ATOM 357 C THR A 167 -2.142 8.151 1.102 1.00 1.44 C ATOM 358 O THR A 167 -2.344 7.272 0.261 1.00 62.35 O ATOM 359 CB THR A 167 -1.958 7.540 3.525 1.00 24.42 C ATOM 360 OG1 THR A 167 -0.719 8.264 3.576 1.00 64.32 O ATOM 361 CG2 THR A 167 -1.675 6.063 3.255 1.00 15.44 C ATOM 0 H THR A 167 -4.193 6.733 1.588 1.00 32.45 H new ATOM 0 HA THR A 167 -3.142 9.166 2.725 1.00 60.23 H new ATOM 0 HB THR A 167 -2.470 7.623 4.484 1.00 24.42 H new ATOM 0 HG1 THR A 167 -0.141 7.874 4.264 1.00 64.32 H new ATOM 0 HG21 THR A 167 -1.020 5.670 4.033 1.00 15.44 H new ATOM 0 HG22 THR A 167 -2.613 5.507 3.255 1.00 15.44 H new ATOM 0 HG23 THR A 167 -1.190 5.957 2.285 1.00 15.44 H new ATOM 369 N VAL A 168 -1.276 9.141 0.908 1.00 25.11 N ATOM 370 CA VAL A 168 -0.492 9.259 -0.326 1.00 73.23 C ATOM 371 C VAL A 168 1.013 9.281 -0.021 1.00 5.51 C ATOM 372 O VAL A 168 1.500 10.165 0.686 1.00 75.34 O ATOM 373 CB VAL A 168 -0.875 10.536 -1.120 1.00 24.31 C ATOM 374 CG1 VAL A 168 -0.054 10.649 -2.403 1.00 0.43 C ATOM 375 CG2 VAL A 168 -2.372 10.547 -1.430 1.00 40.45 C ATOM 0 H VAL A 168 -1.096 9.878 1.590 1.00 25.11 H new ATOM 0 HA VAL A 168 -0.721 8.385 -0.936 1.00 73.23 H new ATOM 0 HB VAL A 168 -0.647 11.403 -0.499 1.00 24.31 H new ATOM 0 HG11 VAL A 168 -0.342 11.552 -2.941 1.00 0.43 H new ATOM 0 HG12 VAL A 168 1.006 10.697 -2.154 1.00 0.43 H new ATOM 0 HG13 VAL A 168 -0.239 9.778 -3.032 1.00 0.43 H new ATOM 0 HG21 VAL A 168 -2.622 11.450 -1.987 1.00 40.45 H new ATOM 0 HG22 VAL A 168 -2.627 9.671 -2.026 1.00 40.45 H new ATOM 0 HG23 VAL A 168 -2.937 10.528 -0.498 1.00 40.45 H new ATOM 385 N VAL A 169 1.745 8.310 -0.566 1.00 64.53 N ATOM 386 CA VAL A 169 3.184 8.168 -0.291 1.00 2.43 C ATOM 387 C VAL A 169 4.043 8.429 -1.546 1.00 52.30 C ATOM 388 O VAL A 169 3.619 8.151 -2.668 1.00 34.34 O ATOM 389 CB VAL A 169 3.508 6.753 0.264 1.00 54.11 C ATOM 390 CG1 VAL A 169 2.794 6.515 1.597 1.00 23.44 C ATOM 391 CG2 VAL A 169 3.137 5.670 -0.751 1.00 13.54 C ATOM 0 H VAL A 169 1.369 7.607 -1.202 1.00 64.53 H new ATOM 0 HA VAL A 169 3.432 8.920 0.459 1.00 2.43 H new ATOM 0 HB VAL A 169 4.582 6.698 0.439 1.00 54.11 H new ATOM 0 HG11 VAL A 169 3.036 5.518 1.966 1.00 23.44 H new ATOM 0 HG12 VAL A 169 3.120 7.260 2.323 1.00 23.44 H new ATOM 0 HG13 VAL A 169 1.717 6.597 1.452 1.00 23.44 H new ATOM 0 HG21 VAL A 169 3.373 4.689 -0.339 1.00 13.54 H new ATOM 0 HG22 VAL A 169 2.070 5.725 -0.968 1.00 13.54 H new ATOM 0 HG23 VAL A 169 3.703 5.823 -1.670 1.00 13.54 H new ATOM 401 N PRO A 170 5.266 8.977 -1.374 1.00 35.34 N ATOM 402 CA PRO A 170 6.193 9.210 -2.499 1.00 71.51 C ATOM 403 C PRO A 170 6.745 7.901 -3.104 1.00 45.33 C ATOM 404 O PRO A 170 7.281 7.046 -2.388 1.00 24.34 O ATOM 405 CB PRO A 170 7.319 10.040 -1.863 1.00 22.53 C ATOM 406 CG PRO A 170 7.283 9.684 -0.414 1.00 25.15 C ATOM 407 CD PRO A 170 5.833 9.429 -0.085 1.00 22.35 C ATOM 0 HA PRO A 170 5.700 9.706 -3.335 1.00 71.51 H new ATOM 0 HB2 PRO A 170 8.286 9.800 -2.305 1.00 22.53 H new ATOM 0 HB3 PRO A 170 7.156 11.107 -2.012 1.00 22.53 H new ATOM 0 HG2 PRO A 170 7.890 8.801 -0.214 1.00 25.15 H new ATOM 0 HG3 PRO A 170 7.685 10.492 0.197 1.00 25.15 H new ATOM 0 HD2 PRO A 170 5.724 8.671 0.690 1.00 22.35 H new ATOM 0 HD3 PRO A 170 5.338 10.330 0.278 1.00 22.35 H new ATOM 415 N ALA A 171 6.622 7.760 -4.424 1.00 75.10 N ATOM 416 CA ALA A 171 7.057 6.547 -5.127 1.00 51.12 C ATOM 417 C ALA A 171 8.549 6.596 -5.493 1.00 24.31 C ATOM 418 O ALA A 171 8.991 7.471 -6.240 1.00 25.53 O ATOM 419 CB ALA A 171 6.216 6.351 -6.381 1.00 33.21 C ATOM 0 H ALA A 171 6.223 8.474 -5.033 1.00 75.10 H new ATOM 0 HA ALA A 171 6.916 5.703 -4.452 1.00 51.12 H new ATOM 0 HB1 ALA A 171 6.542 5.450 -6.900 1.00 33.21 H new ATOM 0 HB2 ALA A 171 5.167 6.251 -6.103 1.00 33.21 H new ATOM 0 HB3 ALA A 171 6.337 7.212 -7.038 1.00 33.21 H new ATOM 425 N ARG A 172 9.324 5.651 -4.959 1.00 20.50 N ATOM 426 CA ARG A 172 10.762 5.563 -5.249 1.00 40.43 C ATOM 427 C ARG A 172 11.208 4.114 -5.503 1.00 3.12 C ATOM 428 O ARG A 172 10.563 3.161 -5.062 1.00 10.32 O ATOM 429 CB ARG A 172 11.578 6.147 -4.087 1.00 2.41 C ATOM 430 CG ARG A 172 11.271 7.608 -3.781 1.00 60.21 C ATOM 431 CD ARG A 172 12.141 8.131 -2.646 1.00 24.33 C ATOM 432 NE ARG A 172 11.888 7.418 -1.397 1.00 13.12 N ATOM 433 CZ ARG A 172 12.756 7.284 -0.429 1.00 31.22 C ATOM 434 NH1 ARG A 172 13.954 7.771 -0.535 1.00 60.24 N ATOM 435 NH2 ARG A 172 12.419 6.646 0.641 1.00 5.03 N ATOM 0 H ARG A 172 8.982 4.932 -4.321 1.00 20.50 H new ATOM 0 HA ARG A 172 10.942 6.140 -6.156 1.00 40.43 H new ATOM 0 HB2 ARG A 172 11.392 5.553 -3.192 1.00 2.41 H new ATOM 0 HB3 ARG A 172 12.639 6.051 -4.318 1.00 2.41 H new ATOM 0 HG2 ARG A 172 11.434 8.211 -4.674 1.00 60.21 H new ATOM 0 HG3 ARG A 172 10.219 7.712 -3.514 1.00 60.21 H new ATOM 0 HD2 ARG A 172 13.192 8.029 -2.917 1.00 24.33 H new ATOM 0 HD3 ARG A 172 11.951 9.195 -2.502 1.00 24.33 H new ATOM 0 HE ARG A 172 10.969 6.994 -1.271 1.00 13.12 H new ATOM 0 HH11 ARG A 172 14.230 8.267 -1.383 1.00 60.24 H new ATOM 0 HH12 ARG A 172 14.620 7.658 0.229 1.00 60.24 H new ATOM 0 HH21 ARG A 172 11.482 6.252 0.726 1.00 5.03 H new ATOM 0 HH22 ARG A 172 13.089 6.536 1.402 1.00 5.03 H new ATOM 449 N CYS A 173 12.322 3.959 -6.215 1.00 20.32 N ATOM 450 CA CYS A 173 12.931 2.641 -6.439 1.00 74.41 C ATOM 451 C CYS A 173 13.776 2.226 -5.229 1.00 65.44 C ATOM 452 O CYS A 173 14.400 3.069 -4.578 1.00 24.41 O ATOM 453 CB CYS A 173 13.802 2.649 -7.702 1.00 1.13 C ATOM 454 SG CYS A 173 14.608 1.069 -8.057 1.00 10.32 S ATOM 0 H CYS A 173 12.827 4.731 -6.650 1.00 20.32 H new ATOM 0 HA CYS A 173 12.126 1.919 -6.574 1.00 74.41 H new ATOM 0 HB2 CYS A 173 13.183 2.928 -8.555 1.00 1.13 H new ATOM 0 HB3 CYS A 173 14.567 3.419 -7.598 1.00 1.13 H new ATOM 0 HG CYS A 173 15.317 1.177 -9.141 1.00 10.32 H new ATOM 460 N GLY A 174 13.784 0.933 -4.916 1.00 20.51 N ATOM 461 CA GLY A 174 14.516 0.446 -3.750 1.00 21.21 C ATOM 462 C GLY A 174 13.685 0.507 -2.470 1.00 44.44 C ATOM 463 O GLY A 174 14.060 -0.055 -1.442 1.00 31.52 O ATOM 0 H GLY A 174 13.298 0.210 -5.447 1.00 20.51 H new ATOM 0 HA2 GLY A 174 14.831 -0.583 -3.926 1.00 21.21 H new ATOM 0 HA3 GLY A 174 15.422 1.039 -3.620 1.00 21.21 H new ATOM 467 N VAL A 175 12.555 1.209 -2.532 1.00 62.24 N ATOM 468 CA VAL A 175 11.625 1.293 -1.406 1.00 24.10 C ATOM 469 C VAL A 175 10.446 0.338 -1.622 1.00 4.01 C ATOM 470 O VAL A 175 9.686 0.487 -2.577 1.00 73.24 O ATOM 471 CB VAL A 175 11.085 2.735 -1.226 1.00 52.54 C ATOM 472 CG1 VAL A 175 10.176 2.830 0.001 1.00 50.13 C ATOM 473 CG2 VAL A 175 12.236 3.735 -1.134 1.00 24.00 C ATOM 0 H VAL A 175 12.259 1.732 -3.356 1.00 62.24 H new ATOM 0 HA VAL A 175 12.171 1.010 -0.506 1.00 24.10 H new ATOM 0 HB VAL A 175 10.488 2.986 -2.103 1.00 52.54 H new ATOM 0 HG11 VAL A 175 9.810 3.852 0.105 1.00 50.13 H new ATOM 0 HG12 VAL A 175 9.331 2.153 -0.119 1.00 50.13 H new ATOM 0 HG13 VAL A 175 10.738 2.554 0.893 1.00 50.13 H new ATOM 0 HG21 VAL A 175 11.835 4.741 -1.008 1.00 24.00 H new ATOM 0 HG22 VAL A 175 12.867 3.486 -0.281 1.00 24.00 H new ATOM 0 HG23 VAL A 175 12.829 3.693 -2.048 1.00 24.00 H new ATOM 483 N THR A 176 10.304 -0.648 -0.746 1.00 61.25 N ATOM 484 CA THR A 176 9.230 -1.638 -0.876 1.00 51.31 C ATOM 485 C THR A 176 7.903 -1.108 -0.323 1.00 43.11 C ATOM 486 O THR A 176 7.878 -0.152 0.458 1.00 43.44 O ATOM 487 CB THR A 176 9.564 -2.949 -0.129 1.00 1.14 C ATOM 488 OG1 THR A 176 9.436 -2.761 1.288 1.00 62.35 O ATOM 489 CG2 THR A 176 10.977 -3.420 -0.452 1.00 33.44 C ATOM 0 H THR A 176 10.913 -0.788 0.060 1.00 61.25 H new ATOM 0 HA THR A 176 9.136 -1.836 -1.944 1.00 51.31 H new ATOM 0 HB THR A 176 8.858 -3.710 -0.461 1.00 1.14 H new ATOM 0 HG1 THR A 176 10.323 -2.624 1.681 1.00 62.35 H new ATOM 0 HG21 THR A 176 11.185 -4.344 0.087 1.00 33.44 H new ATOM 0 HG22 THR A 176 11.065 -3.598 -1.524 1.00 33.44 H new ATOM 0 HG23 THR A 176 11.693 -2.655 -0.151 1.00 33.44 H new ATOM 497 N VAL A 177 6.803 -1.740 -0.724 1.00 35.34 N ATOM 498 CA VAL A 177 5.480 -1.417 -0.179 1.00 41.21 C ATOM 499 C VAL A 177 5.479 -1.538 1.358 1.00 31.44 C ATOM 500 O VAL A 177 4.782 -0.799 2.055 1.00 2.12 O ATOM 501 CB VAL A 177 4.392 -2.352 -0.771 1.00 71.43 C ATOM 502 CG1 VAL A 177 3.006 -2.006 -0.227 1.00 62.43 C ATOM 503 CG2 VAL A 177 4.406 -2.299 -2.298 1.00 24.01 C ATOM 0 H VAL A 177 6.798 -2.481 -1.425 1.00 35.34 H new ATOM 0 HA VAL A 177 5.251 -0.388 -0.457 1.00 41.21 H new ATOM 0 HB VAL A 177 4.624 -3.371 -0.462 1.00 71.43 H new ATOM 0 HG11 VAL A 177 2.266 -2.679 -0.661 1.00 62.43 H new ATOM 0 HG12 VAL A 177 3.003 -2.115 0.858 1.00 62.43 H new ATOM 0 HG13 VAL A 177 2.759 -0.977 -0.489 1.00 62.43 H new ATOM 0 HG21 VAL A 177 3.636 -2.962 -2.692 1.00 24.01 H new ATOM 0 HG22 VAL A 177 4.211 -1.279 -2.628 1.00 24.01 H new ATOM 0 HG23 VAL A 177 5.382 -2.619 -2.664 1.00 24.01 H new ATOM 513 N ARG A 178 6.293 -2.456 1.874 1.00 25.52 N ATOM 514 CA ARG A 178 6.396 -2.690 3.311 1.00 23.11 C ATOM 515 C ARG A 178 7.149 -1.547 3.997 1.00 11.04 C ATOM 516 O ARG A 178 6.623 -0.905 4.903 1.00 60.12 O ATOM 517 CB ARG A 178 7.104 -4.028 3.581 1.00 25.15 C ATOM 518 CG ARG A 178 6.899 -4.561 4.996 1.00 21.12 C ATOM 519 CD ARG A 178 7.553 -5.925 5.196 1.00 4.23 C ATOM 520 NE ARG A 178 8.948 -5.937 4.768 1.00 1.25 N ATOM 521 CZ ARG A 178 9.967 -5.756 5.559 1.00 0.32 C ATOM 522 NH1 ARG A 178 9.804 -5.570 6.834 1.00 34.03 N ATOM 523 NH2 ARG A 178 11.159 -5.776 5.070 1.00 13.12 N ATOM 0 H ARG A 178 6.896 -3.055 1.311 1.00 25.52 H new ATOM 0 HA ARG A 178 5.388 -2.732 3.724 1.00 23.11 H new ATOM 0 HB2 ARG A 178 6.743 -4.769 2.868 1.00 25.15 H new ATOM 0 HB3 ARG A 178 8.172 -3.906 3.400 1.00 25.15 H new ATOM 0 HG2 ARG A 178 7.313 -3.852 5.713 1.00 21.12 H new ATOM 0 HG3 ARG A 178 5.832 -4.637 5.203 1.00 21.12 H new ATOM 0 HD2 ARG A 178 7.496 -6.202 6.249 1.00 4.23 H new ATOM 0 HD3 ARG A 178 6.997 -6.678 4.637 1.00 4.23 H new ATOM 0 HE ARG A 178 9.139 -6.099 3.779 1.00 1.25 H new ATOM 0 HH11 ARG A 178 8.865 -5.564 7.233 1.00 34.03 H new ATOM 0 HH12 ARG A 178 10.615 -5.430 7.437 1.00 34.03 H new ATOM 0 HH21 ARG A 178 11.298 -5.933 4.072 1.00 13.12 H new ATOM 0 HH22 ARG A 178 11.963 -5.635 5.681 1.00 13.12 H new ATOM 537 N ASP A 179 8.375 -1.284 3.543 1.00 60.13 N ATOM 538 CA ASP A 179 9.204 -0.220 4.120 1.00 63.12 C ATOM 539 C ASP A 179 8.547 1.160 3.966 1.00 13.04 C ATOM 540 O ASP A 179 8.802 2.076 4.753 1.00 52.12 O ATOM 541 CB ASP A 179 10.595 -0.220 3.478 1.00 55.03 C ATOM 542 CG ASP A 179 11.392 -1.459 3.840 1.00 52.03 C ATOM 543 OD1 ASP A 179 11.901 -1.526 4.977 1.00 75.41 O ATOM 544 OD2 ASP A 179 11.516 -2.366 2.995 1.00 13.54 O ATOM 0 H ASP A 179 8.818 -1.792 2.777 1.00 60.13 H new ATOM 0 HA ASP A 179 9.303 -0.422 5.186 1.00 63.12 H new ATOM 0 HB2 ASP A 179 10.493 -0.159 2.394 1.00 55.03 H new ATOM 0 HB3 ASP A 179 11.141 0.668 3.798 1.00 55.03 H new ATOM 549 N SER A 180 7.705 1.298 2.950 1.00 75.32 N ATOM 550 CA SER A 180 6.947 2.535 2.729 1.00 2.11 C ATOM 551 C SER A 180 5.751 2.630 3.686 1.00 23.01 C ATOM 552 O SER A 180 5.679 3.532 4.526 1.00 4.43 O ATOM 553 CB SER A 180 6.449 2.609 1.279 1.00 61.11 C ATOM 554 OG SER A 180 5.698 3.790 1.046 1.00 20.33 O ATOM 0 H SER A 180 7.525 0.568 2.260 1.00 75.32 H new ATOM 0 HA SER A 180 7.618 3.372 2.924 1.00 2.11 H new ATOM 0 HB2 SER A 180 7.300 2.578 0.599 1.00 61.11 H new ATOM 0 HB3 SER A 180 5.834 1.736 1.060 1.00 61.11 H new ATOM 0 HG SER A 180 5.397 3.808 0.114 1.00 20.33 H new ATOM 560 N LEU A 181 4.828 1.675 3.578 1.00 32.43 N ATOM 561 CA LEU A 181 3.569 1.727 4.330 1.00 62.23 C ATOM 562 C LEU A 181 3.747 1.458 5.833 1.00 3.53 C ATOM 563 O LEU A 181 2.900 1.858 6.623 1.00 31.34 O ATOM 564 CB LEU A 181 2.540 0.748 3.746 1.00 33.54 C ATOM 565 CG LEU A 181 2.042 1.084 2.329 1.00 44.11 C ATOM 566 CD1 LEU A 181 0.972 0.090 1.884 1.00 71.54 C ATOM 567 CD2 LEU A 181 1.509 2.516 2.267 1.00 11.44 C ATOM 0 H LEU A 181 4.926 0.856 2.978 1.00 32.43 H new ATOM 0 HA LEU A 181 3.203 2.749 4.228 1.00 62.23 H new ATOM 0 HB2 LEU A 181 2.979 -0.249 3.732 1.00 33.54 H new ATOM 0 HB3 LEU A 181 1.681 0.708 4.415 1.00 33.54 H new ATOM 0 HG LEU A 181 2.886 1.006 1.644 1.00 44.11 H new ATOM 0 HD11 LEU A 181 0.633 0.345 0.880 1.00 71.54 H new ATOM 0 HD12 LEU A 181 1.389 -0.917 1.881 1.00 71.54 H new ATOM 0 HD13 LEU A 181 0.128 0.131 2.573 1.00 71.54 H new ATOM 0 HD21 LEU A 181 1.162 2.732 1.256 1.00 11.44 H new ATOM 0 HD22 LEU A 181 0.680 2.626 2.966 1.00 11.44 H new ATOM 0 HD23 LEU A 181 2.304 3.212 2.534 1.00 11.44 H new ATOM 579 N LYS A 182 4.836 0.798 6.242 1.00 24.21 N ATOM 580 CA LYS A 182 5.045 0.518 7.673 1.00 35.42 C ATOM 581 C LYS A 182 5.228 1.818 8.478 1.00 51.42 C ATOM 582 O LYS A 182 5.191 1.809 9.708 1.00 52.21 O ATOM 583 CB LYS A 182 6.224 -0.449 7.901 1.00 32.33 C ATOM 584 CG LYS A 182 7.613 0.133 7.645 1.00 32.50 C ATOM 585 CD LYS A 182 8.692 -0.947 7.780 1.00 32.13 C ATOM 586 CE LYS A 182 10.109 -0.380 7.690 1.00 0.42 C ATOM 587 NZ LYS A 182 10.410 0.563 8.800 1.00 43.04 N ATOM 0 H LYS A 182 5.571 0.454 5.624 1.00 24.21 H new ATOM 0 HA LYS A 182 4.145 0.024 8.038 1.00 35.42 H new ATOM 0 HB2 LYS A 182 6.183 -0.807 8.930 1.00 32.33 H new ATOM 0 HB3 LYS A 182 6.089 -1.317 7.256 1.00 32.33 H new ATOM 0 HG2 LYS A 182 7.651 0.568 6.646 1.00 32.50 H new ATOM 0 HG3 LYS A 182 7.810 0.939 8.351 1.00 32.50 H new ATOM 0 HD2 LYS A 182 8.570 -1.459 8.734 1.00 32.13 H new ATOM 0 HD3 LYS A 182 8.553 -1.693 6.998 1.00 32.13 H new ATOM 0 HE2 LYS A 182 10.828 -1.199 7.707 1.00 0.42 H new ATOM 0 HE3 LYS A 182 10.233 0.133 6.736 1.00 0.42 H new ATOM 0 HZ1 LYS A 182 11.430 0.764 8.818 1.00 43.04 H new ATOM 0 HZ2 LYS A 182 9.885 1.449 8.655 1.00 43.04 H new ATOM 0 HZ3 LYS A 182 10.125 0.137 9.705 1.00 43.04 H new ATOM 601 N LYS A 183 5.425 2.935 7.777 1.00 72.52 N ATOM 602 CA LYS A 183 5.393 4.257 8.411 1.00 64.21 C ATOM 603 C LYS A 183 3.936 4.705 8.630 1.00 51.41 C ATOM 604 O LYS A 183 3.557 5.123 9.728 1.00 52.13 O ATOM 605 CB LYS A 183 6.134 5.289 7.553 1.00 23.11 C ATOM 606 CG LYS A 183 7.609 4.962 7.330 1.00 72.42 C ATOM 607 CD LYS A 183 8.336 6.090 6.601 1.00 42.23 C ATOM 608 CE LYS A 183 7.765 6.339 5.209 1.00 21.11 C ATOM 609 NZ LYS A 183 8.392 7.522 4.565 1.00 11.35 N ATOM 0 H LYS A 183 5.608 2.953 6.774 1.00 72.52 H new ATOM 0 HA LYS A 183 5.894 4.186 9.376 1.00 64.21 H new ATOM 0 HB2 LYS A 183 5.638 5.366 6.585 1.00 23.11 H new ATOM 0 HB3 LYS A 183 6.056 6.266 8.029 1.00 23.11 H new ATOM 0 HG2 LYS A 183 8.090 4.781 8.291 1.00 72.42 H new ATOM 0 HG3 LYS A 183 7.694 4.042 6.752 1.00 72.42 H new ATOM 0 HD2 LYS A 183 8.266 7.005 7.189 1.00 42.23 H new ATOM 0 HD3 LYS A 183 9.395 5.844 6.519 1.00 42.23 H new ATOM 0 HE2 LYS A 183 7.924 5.458 4.587 1.00 21.11 H new ATOM 0 HE3 LYS A 183 6.688 6.490 5.278 1.00 21.11 H new ATOM 0 HZ1 LYS A 183 7.980 7.662 3.620 1.00 11.35 H new ATOM 0 HZ2 LYS A 183 8.219 8.366 5.147 1.00 11.35 H new ATOM 0 HZ3 LYS A 183 9.417 7.367 4.477 1.00 11.35 H new ATOM 623 N ALA A 184 3.123 4.596 7.576 1.00 52.22 N ATOM 624 CA ALA A 184 1.694 4.930 7.648 1.00 5.21 C ATOM 625 C ALA A 184 0.964 4.042 8.666 1.00 74.44 C ATOM 626 O ALA A 184 0.093 4.503 9.402 1.00 1.24 O ATOM 627 CB ALA A 184 1.053 4.794 6.268 1.00 23.32 C ATOM 0 H ALA A 184 3.430 4.277 6.657 1.00 52.22 H new ATOM 0 HA ALA A 184 1.604 5.964 7.982 1.00 5.21 H new ATOM 0 HB1 ALA A 184 -0.006 5.044 6.333 1.00 23.32 H new ATOM 0 HB2 ALA A 184 1.544 5.472 5.570 1.00 23.32 H new ATOM 0 HB3 ALA A 184 1.163 3.769 5.915 1.00 23.32 H new ATOM 633 N LEU A 185 1.328 2.764 8.703 1.00 4.21 N ATOM 634 CA LEU A 185 0.764 1.824 9.671 1.00 23.00 C ATOM 635 C LEU A 185 1.239 2.148 11.096 1.00 62.23 C ATOM 636 O LEU A 185 0.463 2.076 12.045 1.00 74.52 O ATOM 637 CB LEU A 185 1.134 0.383 9.296 1.00 1.43 C ATOM 638 CG LEU A 185 0.616 -0.092 7.925 1.00 41.32 C ATOM 639 CD1 LEU A 185 1.060 -1.524 7.644 1.00 64.42 C ATOM 640 CD2 LEU A 185 -0.907 0.031 7.846 1.00 42.23 C ATOM 0 H LEU A 185 2.015 2.352 8.071 1.00 4.21 H new ATOM 0 HA LEU A 185 -0.321 1.923 9.647 1.00 23.00 H new ATOM 0 HB2 LEU A 185 2.220 0.289 9.309 1.00 1.43 H new ATOM 0 HB3 LEU A 185 0.747 -0.286 10.064 1.00 1.43 H new ATOM 0 HG LEU A 185 1.047 0.552 7.159 1.00 41.32 H new ATOM 0 HD11 LEU A 185 0.683 -1.838 6.671 1.00 64.42 H new ATOM 0 HD12 LEU A 185 2.149 -1.574 7.644 1.00 64.42 H new ATOM 0 HD13 LEU A 185 0.666 -2.185 8.416 1.00 64.42 H new ATOM 0 HD21 LEU A 185 -1.249 -0.310 6.869 1.00 42.23 H new ATOM 0 HD22 LEU A 185 -1.362 -0.581 8.624 1.00 42.23 H new ATOM 0 HD23 LEU A 185 -1.196 1.072 7.988 1.00 42.23 H new ATOM 652 N MET A 186 2.511 2.529 11.233 1.00 1.13 N ATOM 653 CA MET A 186 3.067 2.922 12.537 1.00 12.23 C ATOM 654 C MET A 186 2.287 4.100 13.152 1.00 12.55 C ATOM 655 O MET A 186 1.908 4.064 14.325 1.00 60.32 O ATOM 656 CB MET A 186 4.551 3.287 12.393 1.00 54.53 C ATOM 657 CG MET A 186 5.215 3.721 13.695 1.00 60.55 C ATOM 658 SD MET A 186 6.974 4.080 13.496 1.00 25.42 S ATOM 659 CE MET A 186 7.388 4.645 15.148 1.00 14.53 C ATOM 0 H MET A 186 3.177 2.575 10.461 1.00 1.13 H new ATOM 0 HA MET A 186 2.971 2.070 13.210 1.00 12.23 H new ATOM 0 HB2 MET A 186 5.088 2.427 11.993 1.00 54.53 H new ATOM 0 HB3 MET A 186 4.647 4.091 11.663 1.00 54.53 H new ATOM 0 HG2 MET A 186 4.709 4.607 14.078 1.00 60.55 H new ATOM 0 HG3 MET A 186 5.091 2.936 14.441 1.00 60.55 H new ATOM 0 HE1 MET A 186 8.445 4.906 15.189 1.00 14.53 H new ATOM 0 HE2 MET A 186 6.788 5.521 15.394 1.00 14.53 H new ATOM 0 HE3 MET A 186 7.182 3.851 15.866 1.00 14.53 H new ATOM 669 N MET A 187 2.039 5.139 12.351 1.00 41.24 N ATOM 670 CA MET A 187 1.274 6.304 12.822 1.00 23.42 C ATOM 671 C MET A 187 -0.222 5.964 13.019 1.00 71.01 C ATOM 672 O MET A 187 -0.988 6.769 13.548 1.00 62.02 O ATOM 673 CB MET A 187 1.437 7.490 11.853 1.00 10.44 C ATOM 674 CG MET A 187 0.891 7.235 10.456 1.00 71.24 C ATOM 675 SD MET A 187 1.255 8.577 9.304 1.00 51.23 S ATOM 676 CE MET A 187 0.426 9.953 10.099 1.00 42.15 C ATOM 0 H MET A 187 2.352 5.201 11.382 1.00 41.24 H new ATOM 0 HA MET A 187 1.677 6.590 13.793 1.00 23.42 H new ATOM 0 HB2 MET A 187 0.934 8.360 12.274 1.00 10.44 H new ATOM 0 HB3 MET A 187 2.495 7.740 11.777 1.00 10.44 H new ATOM 0 HG2 MET A 187 1.313 6.307 10.070 1.00 71.24 H new ATOM 0 HG3 MET A 187 -0.188 7.095 10.513 1.00 71.24 H new ATOM 0 HE1 MET A 187 0.315 10.771 9.387 1.00 42.15 H new ATOM 0 HE2 MET A 187 -0.558 9.635 10.443 1.00 42.15 H new ATOM 0 HE3 MET A 187 1.017 10.291 10.950 1.00 42.15 H new ATOM 686 N ARG A 188 -0.632 4.766 12.590 1.00 64.54 N ATOM 687 CA ARG A 188 -2.012 4.289 12.796 1.00 24.42 C ATOM 688 C ARG A 188 -2.087 3.197 13.882 1.00 51.43 C ATOM 689 O ARG A 188 -3.167 2.893 14.392 1.00 13.52 O ATOM 690 CB ARG A 188 -2.600 3.754 11.478 1.00 63.52 C ATOM 691 CG ARG A 188 -2.821 4.816 10.393 1.00 24.34 C ATOM 692 CD ARG A 188 -3.929 5.810 10.759 1.00 42.44 C ATOM 693 NE ARG A 188 -3.538 6.706 11.847 1.00 72.40 N ATOM 694 CZ ARG A 188 -4.245 6.920 12.926 1.00 73.35 C ATOM 695 NH1 ARG A 188 -5.391 6.343 13.094 1.00 32.25 N ATOM 696 NH2 ARG A 188 -3.800 7.711 13.839 1.00 21.12 N ATOM 0 H ARG A 188 -0.031 4.105 12.097 1.00 64.54 H new ATOM 0 HA ARG A 188 -2.600 5.142 13.136 1.00 24.42 H new ATOM 0 HB2 ARG A 188 -1.934 2.986 11.085 1.00 63.52 H new ATOM 0 HB3 ARG A 188 -3.553 3.270 11.692 1.00 63.52 H new ATOM 0 HG2 ARG A 188 -1.891 5.359 10.227 1.00 24.34 H new ATOM 0 HG3 ARG A 188 -3.075 4.324 9.454 1.00 24.34 H new ATOM 0 HD2 ARG A 188 -4.188 6.401 9.880 1.00 42.44 H new ATOM 0 HD3 ARG A 188 -4.825 5.261 11.049 1.00 42.44 H new ATOM 0 HE ARG A 188 -2.650 7.199 11.758 1.00 72.40 H new ATOM 0 HH11 ARG A 188 -5.754 5.712 12.380 1.00 32.25 H new ATOM 0 HH12 ARG A 188 -5.932 6.519 13.941 1.00 32.25 H new ATOM 0 HH21 ARG A 188 -2.897 8.170 13.720 1.00 21.12 H new ATOM 0 HH22 ARG A 188 -4.351 7.879 14.681 1.00 21.12 H new ATOM 710 N GLY A 189 -0.944 2.618 14.236 1.00 32.25 N ATOM 711 CA GLY A 189 -0.916 1.535 15.220 1.00 70.51 C ATOM 712 C GLY A 189 -1.243 0.168 14.611 1.00 24.42 C ATOM 713 O GLY A 189 -1.960 -0.637 15.211 1.00 35.31 O ATOM 0 H GLY A 189 -0.031 2.876 13.861 1.00 32.25 H new ATOM 0 HA2 GLY A 189 0.071 1.495 15.681 1.00 70.51 H new ATOM 0 HA3 GLY A 189 -1.630 1.754 16.014 1.00 70.51 H new ATOM 717 N LEU A 190 -0.719 -0.083 13.413 1.00 72.01 N ATOM 718 CA LEU A 190 -0.955 -1.342 12.690 1.00 21.33 C ATOM 719 C LEU A 190 0.366 -1.945 12.184 1.00 70.43 C ATOM 720 O LEU A 190 1.410 -1.289 12.207 1.00 41.43 O ATOM 721 CB LEU A 190 -1.901 -1.094 11.503 1.00 32.31 C ATOM 722 CG LEU A 190 -3.307 -0.589 11.872 1.00 44.21 C ATOM 723 CD1 LEU A 190 -4.100 -0.233 10.616 1.00 62.23 C ATOM 724 CD2 LEU A 190 -4.053 -1.628 12.711 1.00 1.15 C ATOM 0 H LEU A 190 -0.120 0.574 12.913 1.00 72.01 H new ATOM 0 HA LEU A 190 -1.413 -2.050 13.380 1.00 21.33 H new ATOM 0 HB2 LEU A 190 -1.436 -0.368 10.836 1.00 32.31 H new ATOM 0 HB3 LEU A 190 -2.003 -2.023 10.942 1.00 32.31 H new ATOM 0 HG LEU A 190 -3.198 0.315 12.471 1.00 44.21 H new ATOM 0 HD11 LEU A 190 -5.091 0.122 10.900 1.00 62.23 H new ATOM 0 HD12 LEU A 190 -3.578 0.550 10.066 1.00 62.23 H new ATOM 0 HD13 LEU A 190 -4.198 -1.116 9.985 1.00 62.23 H new ATOM 0 HD21 LEU A 190 -5.045 -1.250 12.961 1.00 1.15 H new ATOM 0 HD22 LEU A 190 -4.150 -2.553 12.143 1.00 1.15 H new ATOM 0 HD23 LEU A 190 -3.497 -1.822 13.628 1.00 1.15 H new ATOM 736 N ILE A 191 0.312 -3.196 11.721 1.00 52.32 N ATOM 737 CA ILE A 191 1.500 -3.892 11.200 1.00 13.21 C ATOM 738 C ILE A 191 1.205 -4.575 9.851 1.00 71.32 C ATOM 739 O ILE A 191 0.072 -4.987 9.592 1.00 61.31 O ATOM 740 CB ILE A 191 2.022 -4.950 12.211 1.00 73.12 C ATOM 741 CG1 ILE A 191 0.892 -5.908 12.630 1.00 51.23 C ATOM 742 CG2 ILE A 191 2.643 -4.273 13.430 1.00 44.10 C ATOM 743 CD1 ILE A 191 1.330 -6.997 13.590 1.00 72.33 C ATOM 0 H ILE A 191 -0.542 -3.753 11.695 1.00 52.32 H new ATOM 0 HA ILE A 191 2.270 -3.135 11.050 1.00 13.21 H new ATOM 0 HB ILE A 191 2.798 -5.537 11.720 1.00 73.12 H new ATOM 0 HG12 ILE A 191 0.093 -5.330 13.093 1.00 51.23 H new ATOM 0 HG13 ILE A 191 0.473 -6.372 11.737 1.00 51.23 H new ATOM 0 HG21 ILE A 191 3.002 -5.033 14.125 1.00 44.10 H new ATOM 0 HG22 ILE A 191 3.478 -3.648 13.113 1.00 44.10 H new ATOM 0 HG23 ILE A 191 1.894 -3.655 13.924 1.00 44.10 H new ATOM 0 HD11 ILE A 191 0.477 -7.629 13.837 1.00 72.33 H new ATOM 0 HD12 ILE A 191 2.108 -7.602 13.124 1.00 72.33 H new ATOM 0 HD13 ILE A 191 1.721 -6.543 14.501 1.00 72.33 H new ATOM 755 N PRO A 192 2.224 -4.691 8.967 1.00 40.23 N ATOM 756 CA PRO A 192 2.076 -5.318 7.637 1.00 74.34 C ATOM 757 C PRO A 192 1.330 -6.665 7.656 1.00 15.43 C ATOM 758 O PRO A 192 0.399 -6.876 6.881 1.00 35.21 O ATOM 759 CB PRO A 192 3.530 -5.516 7.190 1.00 72.12 C ATOM 760 CG PRO A 192 4.273 -4.407 7.848 1.00 51.12 C ATOM 761 CD PRO A 192 3.604 -4.198 9.185 1.00 42.10 C ATOM 0 HA PRO A 192 1.473 -4.698 6.973 1.00 74.34 H new ATOM 0 HB2 PRO A 192 3.912 -6.489 7.499 1.00 72.12 H new ATOM 0 HB3 PRO A 192 3.622 -5.468 6.105 1.00 72.12 H new ATOM 0 HG2 PRO A 192 5.325 -4.662 7.973 1.00 51.12 H new ATOM 0 HG3 PRO A 192 4.234 -3.499 7.246 1.00 51.12 H new ATOM 0 HD2 PRO A 192 4.108 -4.754 9.976 1.00 42.10 H new ATOM 0 HD3 PRO A 192 3.613 -3.148 9.478 1.00 42.10 H new ATOM 769 N GLU A 193 1.725 -7.566 8.556 1.00 23.24 N ATOM 770 CA GLU A 193 1.115 -8.908 8.630 1.00 21.21 C ATOM 771 C GLU A 193 -0.316 -8.880 9.205 1.00 41.33 C ATOM 772 O GLU A 193 -0.930 -9.928 9.417 1.00 34.44 O ATOM 773 CB GLU A 193 1.999 -9.875 9.441 1.00 14.22 C ATOM 774 CG GLU A 193 2.463 -9.342 10.798 1.00 42.11 C ATOM 775 CD GLU A 193 3.760 -8.543 10.712 1.00 60.22 C ATOM 776 OE1 GLU A 193 4.842 -9.164 10.668 1.00 34.21 O ATOM 777 OE2 GLU A 193 3.702 -7.297 10.686 1.00 73.13 O ATOM 0 H GLU A 193 2.460 -7.399 9.243 1.00 23.24 H new ATOM 0 HA GLU A 193 1.043 -9.270 7.604 1.00 21.21 H new ATOM 0 HB2 GLU A 193 1.447 -10.801 9.601 1.00 14.22 H new ATOM 0 HB3 GLU A 193 2.877 -10.126 8.846 1.00 14.22 H new ATOM 0 HG2 GLU A 193 1.681 -8.711 11.221 1.00 42.11 H new ATOM 0 HG3 GLU A 193 2.603 -10.179 11.482 1.00 42.11 H new ATOM 784 N CYS A 194 -0.843 -7.685 9.460 1.00 5.11 N ATOM 785 CA CYS A 194 -2.241 -7.518 9.888 1.00 23.24 C ATOM 786 C CYS A 194 -3.116 -6.979 8.743 1.00 20.24 C ATOM 787 O CYS A 194 -4.345 -6.930 8.854 1.00 41.51 O ATOM 788 CB CYS A 194 -2.313 -6.566 11.090 1.00 43.15 C ATOM 789 SG CYS A 194 -3.989 -6.204 11.669 1.00 5.54 S ATOM 0 H CYS A 194 -0.325 -6.810 9.379 1.00 5.11 H new ATOM 0 HA CYS A 194 -2.623 -8.497 10.176 1.00 23.24 H new ATOM 0 HB2 CYS A 194 -1.744 -6.999 11.913 1.00 43.15 H new ATOM 0 HB3 CYS A 194 -1.825 -5.629 10.823 1.00 43.15 H new ATOM 0 HG CYS A 194 -4.822 -6.305 10.676 1.00 5.54 H new ATOM 795 N CYS A 195 -2.479 -6.594 7.636 1.00 2.44 N ATOM 796 CA CYS A 195 -3.178 -5.960 6.506 1.00 74.02 C ATOM 797 C CYS A 195 -2.820 -6.616 5.161 1.00 5.14 C ATOM 798 O CYS A 195 -1.864 -7.381 5.066 1.00 45.52 O ATOM 799 CB CYS A 195 -2.839 -4.466 6.460 1.00 33.40 C ATOM 800 SG CYS A 195 -3.373 -3.537 7.920 1.00 52.04 S ATOM 0 H CYS A 195 -1.476 -6.709 7.493 1.00 2.44 H new ATOM 0 HA CYS A 195 -4.248 -6.096 6.663 1.00 74.02 H new ATOM 0 HB2 CYS A 195 -1.761 -4.353 6.346 1.00 33.40 H new ATOM 0 HB3 CYS A 195 -3.301 -4.027 5.575 1.00 33.40 H new ATOM 0 HG CYS A 195 -3.039 -2.288 7.786 1.00 52.04 H new ATOM 806 N ALA A 196 -3.599 -6.305 4.122 1.00 63.42 N ATOM 807 CA ALA A 196 -3.381 -6.869 2.781 1.00 53.12 C ATOM 808 C ALA A 196 -3.499 -5.800 1.687 1.00 41.31 C ATOM 809 O ALA A 196 -4.541 -5.159 1.548 1.00 15.41 O ATOM 810 CB ALA A 196 -4.382 -7.990 2.520 1.00 75.14 C ATOM 0 H ALA A 196 -4.390 -5.664 4.181 1.00 63.42 H new ATOM 0 HA ALA A 196 -2.367 -7.266 2.749 1.00 53.12 H new ATOM 0 HB1 ALA A 196 -4.215 -8.403 1.525 1.00 75.14 H new ATOM 0 HB2 ALA A 196 -4.252 -8.775 3.265 1.00 75.14 H new ATOM 0 HB3 ALA A 196 -5.396 -7.594 2.583 1.00 75.14 H new ATOM 816 N VAL A 197 -2.434 -5.614 0.907 1.00 24.21 N ATOM 817 CA VAL A 197 -2.427 -4.617 -0.174 1.00 63.53 C ATOM 818 C VAL A 197 -2.800 -5.247 -1.526 1.00 41.12 C ATOM 819 O VAL A 197 -2.135 -6.169 -1.999 1.00 44.00 O ATOM 820 CB VAL A 197 -1.042 -3.933 -0.304 1.00 50.52 C ATOM 821 CG1 VAL A 197 -1.044 -2.888 -1.422 1.00 72.04 C ATOM 822 CG2 VAL A 197 -0.622 -3.303 1.023 1.00 62.43 C ATOM 0 H VAL A 197 -1.564 -6.138 1.000 1.00 24.21 H new ATOM 0 HA VAL A 197 -3.175 -3.869 0.090 1.00 63.53 H new ATOM 0 HB VAL A 197 -0.314 -4.701 -0.565 1.00 50.52 H new ATOM 0 HG11 VAL A 197 -0.059 -2.425 -1.489 1.00 72.04 H new ATOM 0 HG12 VAL A 197 -1.284 -3.370 -2.370 1.00 72.04 H new ATOM 0 HG13 VAL A 197 -1.790 -2.124 -1.204 1.00 72.04 H new ATOM 0 HG21 VAL A 197 0.353 -2.829 0.908 1.00 62.43 H new ATOM 0 HG22 VAL A 197 -1.357 -2.555 1.319 1.00 62.43 H new ATOM 0 HG23 VAL A 197 -0.562 -4.076 1.790 1.00 62.43 H new ATOM 832 N TYR A 198 -3.857 -4.734 -2.148 1.00 73.35 N ATOM 833 CA TYR A 198 -4.323 -5.243 -3.441 1.00 71.42 C ATOM 834 C TYR A 198 -4.740 -4.098 -4.382 1.00 62.15 C ATOM 835 O TYR A 198 -5.310 -3.091 -3.951 1.00 14.41 O ATOM 836 CB TYR A 198 -5.495 -6.221 -3.243 1.00 61.44 C ATOM 837 CG TYR A 198 -6.704 -5.596 -2.566 1.00 22.32 C ATOM 838 CD1 TYR A 198 -6.715 -5.377 -1.195 1.00 24.40 C ATOM 839 CD2 TYR A 198 -7.823 -5.210 -3.298 1.00 0.03 C ATOM 840 CE1 TYR A 198 -7.797 -4.791 -0.576 1.00 15.45 C ATOM 841 CE2 TYR A 198 -8.914 -4.626 -2.680 1.00 15.55 C ATOM 842 CZ TYR A 198 -8.894 -4.419 -1.317 1.00 34.45 C ATOM 843 OH TYR A 198 -9.977 -3.829 -0.693 1.00 11.33 O ATOM 0 H TYR A 198 -4.412 -3.962 -1.778 1.00 73.35 H new ATOM 0 HA TYR A 198 -3.492 -5.773 -3.906 1.00 71.42 H new ATOM 0 HB2 TYR A 198 -5.796 -6.615 -4.214 1.00 61.44 H new ATOM 0 HB3 TYR A 198 -5.154 -7.068 -2.648 1.00 61.44 H new ATOM 0 HD1 TYR A 198 -5.860 -5.671 -0.604 1.00 24.40 H new ATOM 0 HD2 TYR A 198 -7.840 -5.369 -4.366 1.00 0.03 H new ATOM 0 HE1 TYR A 198 -7.784 -4.624 0.491 1.00 15.45 H new ATOM 0 HE2 TYR A 198 -9.776 -4.334 -3.261 1.00 15.55 H new ATOM 0 HH TYR A 198 -10.667 -3.626 -1.358 1.00 11.33 H new ATOM 853 N ARG A 199 -4.437 -4.262 -5.664 1.00 43.42 N ATOM 854 CA ARG A 199 -4.851 -3.314 -6.705 1.00 33.35 C ATOM 855 C ARG A 199 -5.910 -3.959 -7.612 1.00 64.21 C ATOM 856 O ARG A 199 -5.690 -5.038 -8.169 1.00 3.13 O ATOM 857 CB ARG A 199 -3.624 -2.864 -7.521 1.00 55.41 C ATOM 858 CG ARG A 199 -2.837 -4.019 -8.138 1.00 71.00 C ATOM 859 CD ARG A 199 -1.437 -3.601 -8.582 1.00 41.11 C ATOM 860 NE ARG A 199 -1.439 -2.706 -9.741 1.00 61.51 N ATOM 861 CZ ARG A 199 -0.821 -2.967 -10.861 1.00 43.51 C ATOM 862 NH1 ARG A 199 -0.202 -4.095 -11.024 1.00 23.35 N ATOM 863 NH2 ARG A 199 -0.822 -2.096 -11.816 1.00 11.53 N ATOM 0 H ARG A 199 -3.898 -5.053 -6.017 1.00 43.42 H new ATOM 0 HA ARG A 199 -5.294 -2.434 -6.238 1.00 33.35 H new ATOM 0 HB2 ARG A 199 -3.953 -2.195 -8.316 1.00 55.41 H new ATOM 0 HB3 ARG A 199 -2.961 -2.289 -6.875 1.00 55.41 H new ATOM 0 HG2 ARG A 199 -2.758 -4.829 -7.413 1.00 71.00 H new ATOM 0 HG3 ARG A 199 -3.385 -4.411 -8.995 1.00 71.00 H new ATOM 0 HD2 ARG A 199 -0.932 -3.107 -7.751 1.00 41.11 H new ATOM 0 HD3 ARG A 199 -0.858 -4.493 -8.822 1.00 41.11 H new ATOM 0 HE ARG A 199 -1.953 -1.828 -9.669 1.00 61.51 H new ATOM 0 HH11 ARG A 199 -0.196 -4.786 -10.274 1.00 23.35 H new ATOM 0 HH12 ARG A 199 0.278 -4.291 -11.902 1.00 23.35 H new ATOM 0 HH21 ARG A 199 -1.305 -1.206 -11.694 1.00 11.53 H new ATOM 0 HH22 ARG A 199 -0.340 -2.299 -12.692 1.00 11.53 H new ATOM 877 N ILE A 200 -7.065 -3.315 -7.744 1.00 0.04 N ATOM 878 CA ILE A 200 -8.177 -3.893 -8.499 1.00 71.22 C ATOM 879 C ILE A 200 -8.140 -3.471 -9.976 1.00 71.31 C ATOM 880 O ILE A 200 -8.433 -2.322 -10.317 1.00 52.14 O ATOM 881 CB ILE A 200 -9.541 -3.503 -7.881 1.00 14.35 C ATOM 882 CG1 ILE A 200 -9.581 -3.889 -6.390 1.00 51.20 C ATOM 883 CG2 ILE A 200 -10.689 -4.168 -8.646 1.00 41.35 C ATOM 884 CD1 ILE A 200 -10.875 -3.522 -5.693 1.00 71.32 C ATOM 0 H ILE A 200 -7.258 -2.398 -7.342 1.00 0.04 H new ATOM 0 HA ILE A 200 -8.063 -4.976 -8.445 1.00 71.22 H new ATOM 0 HB ILE A 200 -9.663 -2.423 -7.960 1.00 14.35 H new ATOM 0 HG12 ILE A 200 -9.424 -4.964 -6.299 1.00 51.20 H new ATOM 0 HG13 ILE A 200 -8.753 -3.401 -5.877 1.00 51.20 H new ATOM 0 HG21 ILE A 200 -11.640 -3.882 -8.196 1.00 41.35 H new ATOM 0 HG22 ILE A 200 -10.668 -3.845 -9.687 1.00 41.35 H new ATOM 0 HG23 ILE A 200 -10.578 -5.251 -8.600 1.00 41.35 H new ATOM 0 HD11 ILE A 200 -10.824 -3.826 -4.648 1.00 71.32 H new ATOM 0 HD12 ILE A 200 -11.026 -2.444 -5.750 1.00 71.32 H new ATOM 0 HD13 ILE A 200 -11.707 -4.031 -6.179 1.00 71.32 H new ATOM 896 N GLN A 201 -7.784 -4.413 -10.845 1.00 53.54 N ATOM 897 CA GLN A 201 -7.693 -4.159 -12.286 1.00 61.54 C ATOM 898 C GLN A 201 -8.350 -5.305 -13.069 1.00 45.51 C ATOM 899 O GLN A 201 -8.147 -6.474 -12.743 1.00 3.45 O ATOM 900 CB GLN A 201 -6.220 -4.004 -12.693 1.00 3.03 C ATOM 901 CG GLN A 201 -6.020 -3.517 -14.123 1.00 1.22 C ATOM 902 CD GLN A 201 -4.555 -3.352 -14.487 1.00 5.23 C ATOM 903 OE1 GLN A 201 -3.920 -4.266 -15.005 1.00 22.24 O ATOM 904 NE2 GLN A 201 -4.004 -2.188 -14.209 1.00 25.54 N ATOM 0 H GLN A 201 -7.551 -5.369 -10.576 1.00 53.54 H new ATOM 0 HA GLN A 201 -8.222 -3.235 -12.521 1.00 61.54 H new ATOM 0 HB2 GLN A 201 -5.737 -3.304 -12.011 1.00 3.03 H new ATOM 0 HB3 GLN A 201 -5.718 -4.964 -12.573 1.00 3.03 H new ATOM 0 HG2 GLN A 201 -6.484 -4.224 -14.811 1.00 1.22 H new ATOM 0 HG3 GLN A 201 -6.532 -2.563 -14.253 1.00 1.22 H new ATOM 0 HE21 GLN A 201 -4.561 -1.450 -13.778 1.00 25.54 H new ATOM 0 HE22 GLN A 201 -3.020 -2.025 -14.424 1.00 25.54 H new ATOM 913 N ASP A 202 -9.145 -4.966 -14.091 1.00 31.31 N ATOM 914 CA ASP A 202 -9.925 -5.965 -14.843 1.00 72.40 C ATOM 915 C ASP A 202 -10.893 -6.723 -13.911 1.00 44.31 C ATOM 916 O ASP A 202 -11.272 -7.866 -14.176 1.00 4.23 O ATOM 917 CB ASP A 202 -8.990 -6.949 -15.564 1.00 20.21 C ATOM 918 CG ASP A 202 -8.121 -6.263 -16.604 1.00 1.12 C ATOM 919 OD1 ASP A 202 -8.599 -6.050 -17.737 1.00 73.03 O ATOM 920 OD2 ASP A 202 -6.956 -5.929 -16.296 1.00 11.25 O ATOM 0 H ASP A 202 -9.267 -4.008 -14.419 1.00 31.31 H new ATOM 0 HA ASP A 202 -10.517 -5.439 -15.592 1.00 72.40 H new ATOM 0 HB2 ASP A 202 -8.353 -7.444 -14.831 1.00 20.21 H new ATOM 0 HB3 ASP A 202 -9.585 -7.725 -16.046 1.00 20.21 H new ATOM 925 N GLY A 203 -11.302 -6.056 -12.828 1.00 3.53 N ATOM 926 CA GLY A 203 -12.155 -6.683 -11.819 1.00 25.11 C ATOM 927 C GLY A 203 -11.392 -7.626 -10.889 1.00 1.10 C ATOM 928 O GLY A 203 -11.969 -8.212 -9.973 1.00 3.02 O ATOM 0 H GLY A 203 -11.057 -5.086 -12.629 1.00 3.53 H new ATOM 0 HA2 GLY A 203 -12.635 -5.906 -11.224 1.00 25.11 H new ATOM 0 HA3 GLY A 203 -12.949 -7.239 -12.318 1.00 25.11 H new ATOM 932 N GLU A 204 -10.088 -7.750 -11.117 1.00 62.04 N ATOM 933 CA GLU A 204 -9.235 -8.682 -10.370 1.00 43.22 C ATOM 934 C GLU A 204 -8.523 -8.000 -9.195 1.00 34.40 C ATOM 935 O GLU A 204 -7.843 -6.988 -9.374 1.00 14.14 O ATOM 936 CB GLU A 204 -8.176 -9.272 -11.313 1.00 64.02 C ATOM 937 CG GLU A 204 -8.747 -10.052 -12.493 1.00 41.22 C ATOM 938 CD GLU A 204 -9.357 -11.378 -12.077 1.00 51.32 C ATOM 939 OE1 GLU A 204 -8.595 -12.350 -11.896 1.00 11.14 O ATOM 940 OE2 GLU A 204 -10.593 -11.457 -11.939 1.00 73.13 O ATOM 0 H GLU A 204 -9.589 -7.210 -11.823 1.00 62.04 H new ATOM 0 HA GLU A 204 -9.879 -9.464 -9.969 1.00 43.22 H new ATOM 0 HB2 GLU A 204 -7.555 -8.461 -11.695 1.00 64.02 H new ATOM 0 HB3 GLU A 204 -7.523 -9.930 -10.740 1.00 64.02 H new ATOM 0 HG2 GLU A 204 -9.506 -9.448 -12.990 1.00 41.22 H new ATOM 0 HG3 GLU A 204 -7.956 -10.233 -13.221 1.00 41.22 H new ATOM 947 N LYS A 205 -8.674 -8.558 -7.995 1.00 10.53 N ATOM 948 CA LYS A 205 -7.881 -8.114 -6.844 1.00 14.43 C ATOM 949 C LYS A 205 -6.458 -8.678 -6.927 1.00 33.13 C ATOM 950 O LYS A 205 -6.222 -9.840 -6.592 1.00 63.24 O ATOM 951 CB LYS A 205 -8.524 -8.546 -5.519 1.00 51.43 C ATOM 952 CG LYS A 205 -9.807 -7.802 -5.165 1.00 32.33 C ATOM 953 CD LYS A 205 -10.318 -8.221 -3.789 1.00 31.32 C ATOM 954 CE LYS A 205 -11.539 -7.418 -3.351 1.00 32.32 C ATOM 955 NZ LYS A 205 -11.946 -7.765 -1.963 1.00 0.53 N ATOM 0 H LYS A 205 -9.331 -9.312 -7.793 1.00 10.53 H new ATOM 0 HA LYS A 205 -7.845 -7.025 -6.872 1.00 14.43 H new ATOM 0 HB2 LYS A 205 -8.739 -9.613 -5.566 1.00 51.43 H new ATOM 0 HB3 LYS A 205 -7.802 -8.401 -4.715 1.00 51.43 H new ATOM 0 HG2 LYS A 205 -9.624 -6.728 -5.178 1.00 32.33 H new ATOM 0 HG3 LYS A 205 -10.569 -8.005 -5.918 1.00 32.33 H new ATOM 0 HD2 LYS A 205 -10.571 -9.281 -3.806 1.00 31.32 H new ATOM 0 HD3 LYS A 205 -9.522 -8.095 -3.055 1.00 31.32 H new ATOM 0 HE2 LYS A 205 -11.317 -6.353 -3.411 1.00 32.32 H new ATOM 0 HE3 LYS A 205 -12.367 -7.610 -4.034 1.00 32.32 H new ATOM 0 HZ1 LYS A 205 -12.713 -7.133 -1.658 1.00 0.53 H new ATOM 0 HZ2 LYS A 205 -12.278 -8.750 -1.935 1.00 0.53 H new ATOM 0 HZ3 LYS A 205 -11.132 -7.655 -1.325 1.00 0.53 H new ATOM 969 N LYS A 206 -5.523 -7.867 -7.403 1.00 53.21 N ATOM 970 CA LYS A 206 -4.118 -8.277 -7.491 1.00 14.54 C ATOM 971 C LYS A 206 -3.353 -7.922 -6.205 1.00 50.41 C ATOM 972 O LYS A 206 -3.081 -6.749 -5.945 1.00 4.41 O ATOM 973 CB LYS A 206 -3.446 -7.615 -8.705 1.00 52.41 C ATOM 974 CG LYS A 206 -4.004 -8.072 -10.051 1.00 62.12 C ATOM 975 CD LYS A 206 -3.793 -9.567 -10.264 1.00 11.43 C ATOM 976 CE LYS A 206 -4.312 -10.031 -11.619 1.00 22.14 C ATOM 977 NZ LYS A 206 -4.074 -11.483 -11.840 1.00 23.13 N ATOM 0 H LYS A 206 -5.707 -6.920 -7.735 1.00 53.21 H new ATOM 0 HA LYS A 206 -4.091 -9.360 -7.614 1.00 14.54 H new ATOM 0 HB2 LYS A 206 -3.559 -6.534 -8.625 1.00 52.41 H new ATOM 0 HB3 LYS A 206 -2.377 -7.827 -8.676 1.00 52.41 H new ATOM 0 HG2 LYS A 206 -5.068 -7.843 -10.102 1.00 62.12 H new ATOM 0 HG3 LYS A 206 -3.520 -7.517 -10.854 1.00 62.12 H new ATOM 0 HD2 LYS A 206 -2.731 -9.798 -10.185 1.00 11.43 H new ATOM 0 HD3 LYS A 206 -4.299 -10.121 -9.473 1.00 11.43 H new ATOM 0 HE2 LYS A 206 -5.380 -9.824 -11.688 1.00 22.14 H new ATOM 0 HE3 LYS A 206 -3.825 -9.459 -12.409 1.00 22.14 H new ATOM 0 HZ1 LYS A 206 -4.442 -11.757 -12.773 1.00 23.13 H new ATOM 0 HZ2 LYS A 206 -3.053 -11.678 -11.800 1.00 23.13 H new ATOM 0 HZ3 LYS A 206 -4.560 -12.031 -11.102 1.00 23.13 H new ATOM 991 N PRO A 207 -3.010 -8.929 -5.372 1.00 32.44 N ATOM 992 CA PRO A 207 -2.260 -8.711 -4.126 1.00 14.35 C ATOM 993 C PRO A 207 -0.773 -8.434 -4.392 1.00 3.42 C ATOM 994 O PRO A 207 -0.112 -9.182 -5.118 1.00 10.54 O ATOM 995 CB PRO A 207 -2.437 -10.036 -3.350 1.00 2.44 C ATOM 996 CG PRO A 207 -3.413 -10.849 -4.146 1.00 34.02 C ATOM 997 CD PRO A 207 -3.318 -10.352 -5.561 1.00 65.32 C ATOM 0 HA PRO A 207 -2.623 -7.841 -3.579 1.00 14.35 H new ATOM 0 HB2 PRO A 207 -1.486 -10.558 -3.246 1.00 2.44 H new ATOM 0 HB3 PRO A 207 -2.811 -9.852 -2.343 1.00 2.44 H new ATOM 0 HG2 PRO A 207 -3.172 -11.911 -4.089 1.00 34.02 H new ATOM 0 HG3 PRO A 207 -4.425 -10.730 -3.759 1.00 34.02 H new ATOM 0 HD2 PRO A 207 -2.537 -10.866 -6.121 1.00 65.32 H new ATOM 0 HD3 PRO A 207 -4.250 -10.497 -6.107 1.00 65.32 H new ATOM 1005 N ILE A 208 -0.252 -7.359 -3.811 1.00 42.30 N ATOM 1006 CA ILE A 208 1.154 -6.991 -3.995 1.00 52.45 C ATOM 1007 C ILE A 208 2.003 -7.457 -2.805 1.00 61.23 C ATOM 1008 O ILE A 208 1.729 -7.092 -1.660 1.00 22.24 O ATOM 1009 CB ILE A 208 1.348 -5.456 -4.162 1.00 4.21 C ATOM 1010 CG1 ILE A 208 0.513 -4.900 -5.333 1.00 52.22 C ATOM 1011 CG2 ILE A 208 2.827 -5.124 -4.366 1.00 34.32 C ATOM 1012 CD1 ILE A 208 -0.954 -4.711 -5.010 1.00 63.40 C ATOM 0 H ILE A 208 -0.778 -6.726 -3.209 1.00 42.30 H new ATOM 0 HA ILE A 208 1.478 -7.488 -4.909 1.00 52.45 H new ATOM 0 HB ILE A 208 0.997 -4.980 -3.246 1.00 4.21 H new ATOM 0 HG12 ILE A 208 0.932 -3.943 -5.642 1.00 52.22 H new ATOM 0 HG13 ILE A 208 0.603 -5.577 -6.183 1.00 52.22 H new ATOM 0 HG21 ILE A 208 2.946 -4.047 -4.481 1.00 34.32 H new ATOM 0 HG22 ILE A 208 3.398 -5.462 -3.501 1.00 34.32 H new ATOM 0 HG23 ILE A 208 3.193 -5.627 -5.261 1.00 34.32 H new ATOM 0 HD11 ILE A 208 -1.471 -4.317 -5.885 1.00 63.40 H new ATOM 0 HD12 ILE A 208 -1.391 -5.669 -4.731 1.00 63.40 H new ATOM 0 HD13 ILE A 208 -1.057 -4.010 -4.182 1.00 63.40 H new ATOM 1024 N GLY A 209 3.023 -8.269 -3.079 1.00 54.34 N ATOM 1025 CA GLY A 209 3.979 -8.639 -2.043 1.00 12.35 C ATOM 1026 C GLY A 209 4.589 -7.414 -1.373 1.00 53.22 C ATOM 1027 O GLY A 209 5.114 -6.528 -2.049 1.00 41.41 O ATOM 0 H GLY A 209 3.205 -8.677 -3.996 1.00 54.34 H new ATOM 0 HA2 GLY A 209 3.482 -9.254 -1.293 1.00 12.35 H new ATOM 0 HA3 GLY A 209 4.771 -9.247 -2.480 1.00 12.35 H new ATOM 1031 N TRP A 210 4.516 -7.359 -0.047 1.00 12.43 N ATOM 1032 CA TRP A 210 4.946 -6.181 0.706 1.00 71.11 C ATOM 1033 C TRP A 210 6.401 -5.773 0.393 1.00 13.41 C ATOM 1034 O TRP A 210 6.723 -4.588 0.380 1.00 22.25 O ATOM 1035 CB TRP A 210 4.749 -6.421 2.214 1.00 70.44 C ATOM 1036 CG TRP A 210 3.304 -6.413 2.640 1.00 3.32 C ATOM 1037 CD1 TRP A 210 2.400 -7.431 2.521 1.00 42.25 C ATOM 1038 CD2 TRP A 210 2.598 -5.327 3.259 1.00 43.02 C ATOM 1039 NE1 TRP A 210 1.180 -7.040 3.023 1.00 73.21 N ATOM 1040 CE2 TRP A 210 1.279 -5.758 3.484 1.00 1.31 C ATOM 1041 CE3 TRP A 210 2.958 -4.034 3.644 1.00 11.11 C ATOM 1042 CZ2 TRP A 210 0.319 -4.943 4.078 1.00 52.54 C ATOM 1043 CZ3 TRP A 210 2.007 -3.224 4.235 1.00 3.34 C ATOM 1044 CH2 TRP A 210 0.701 -3.681 4.447 1.00 21.34 C ATOM 0 H TRP A 210 4.161 -8.120 0.533 1.00 12.43 H new ATOM 0 HA TRP A 210 4.321 -5.345 0.392 1.00 71.11 H new ATOM 0 HB2 TRP A 210 5.193 -7.379 2.482 1.00 70.44 H new ATOM 0 HB3 TRP A 210 5.288 -5.653 2.769 1.00 70.44 H new ATOM 0 HD1 TRP A 210 2.612 -8.401 2.095 1.00 42.25 H new ATOM 0 HE1 TRP A 210 0.338 -7.615 3.047 1.00 73.21 H new ATOM 0 HE3 TRP A 210 3.963 -3.673 3.483 1.00 11.11 H new ATOM 0 HZ2 TRP A 210 -0.689 -5.293 4.242 1.00 52.54 H new ATOM 0 HZ3 TRP A 210 2.276 -2.223 4.538 1.00 3.34 H new ATOM 0 HH2 TRP A 210 -0.020 -3.025 4.911 1.00 21.34 H new ATOM 1055 N ASP A 211 7.275 -6.741 0.115 1.00 62.12 N ATOM 1056 CA ASP A 211 8.680 -6.433 -0.209 1.00 31.42 C ATOM 1057 C ASP A 211 8.899 -6.131 -1.709 1.00 24.30 C ATOM 1058 O ASP A 211 10.033 -6.160 -2.199 1.00 41.52 O ATOM 1059 CB ASP A 211 9.596 -7.570 0.251 1.00 31.21 C ATOM 1060 CG ASP A 211 9.684 -7.649 1.764 1.00 74.34 C ATOM 1061 OD1 ASP A 211 10.251 -6.721 2.381 1.00 24.24 O ATOM 1062 OD2 ASP A 211 9.174 -8.630 2.346 1.00 72.41 O ATOM 0 H ASP A 211 7.045 -7.735 0.106 1.00 62.12 H new ATOM 0 HA ASP A 211 8.936 -5.523 0.333 1.00 31.42 H new ATOM 0 HB2 ASP A 211 9.224 -8.517 -0.141 1.00 31.21 H new ATOM 0 HB3 ASP A 211 10.593 -7.423 -0.163 1.00 31.21 H new ATOM 1067 N THR A 212 7.821 -5.826 -2.430 1.00 51.12 N ATOM 1068 CA THR A 212 7.915 -5.373 -3.828 1.00 3.52 C ATOM 1069 C THR A 212 8.066 -3.844 -3.894 1.00 35.44 C ATOM 1070 O THR A 212 7.429 -3.119 -3.127 1.00 3.11 O ATOM 1071 CB THR A 212 6.673 -5.811 -4.655 1.00 62.31 C ATOM 1072 OG1 THR A 212 6.656 -7.242 -4.795 1.00 51.31 O ATOM 1073 CG2 THR A 212 6.650 -5.168 -6.042 1.00 23.54 C ATOM 0 H THR A 212 6.867 -5.883 -2.073 1.00 51.12 H new ATOM 0 HA THR A 212 8.799 -5.841 -4.261 1.00 3.52 H new ATOM 0 HB THR A 212 5.789 -5.475 -4.113 1.00 62.31 H new ATOM 0 HG1 THR A 212 5.870 -7.510 -5.315 1.00 51.31 H new ATOM 0 HG21 THR A 212 5.765 -5.503 -6.584 1.00 23.54 H new ATOM 0 HG22 THR A 212 6.624 -4.083 -5.940 1.00 23.54 H new ATOM 0 HG23 THR A 212 7.544 -5.459 -6.593 1.00 23.54 H new ATOM 1081 N ASP A 213 8.915 -3.357 -4.804 1.00 31.41 N ATOM 1082 CA ASP A 213 9.165 -1.913 -4.941 1.00 74.33 C ATOM 1083 C ASP A 213 7.872 -1.126 -5.222 1.00 0.05 C ATOM 1084 O ASP A 213 7.156 -1.409 -6.183 1.00 31.21 O ATOM 1085 CB ASP A 213 10.167 -1.649 -6.070 1.00 1.11 C ATOM 1086 CG ASP A 213 11.501 -2.328 -5.844 1.00 0.53 C ATOM 1087 OD1 ASP A 213 11.618 -3.532 -6.159 1.00 62.34 O ATOM 1088 OD2 ASP A 213 12.445 -1.664 -5.373 1.00 31.24 O ATOM 0 H ASP A 213 9.441 -3.938 -5.457 1.00 31.41 H new ATOM 0 HA ASP A 213 9.574 -1.571 -3.991 1.00 74.33 H new ATOM 0 HB2 ASP A 213 9.744 -1.995 -7.013 1.00 1.11 H new ATOM 0 HB3 ASP A 213 10.323 -0.575 -6.166 1.00 1.11 H new ATOM 1093 N ILE A 214 7.602 -0.116 -4.395 1.00 22.44 N ATOM 1094 CA ILE A 214 6.437 0.762 -4.579 1.00 63.31 C ATOM 1095 C ILE A 214 6.491 1.472 -5.950 1.00 61.23 C ATOM 1096 O ILE A 214 5.474 1.916 -6.483 1.00 62.24 O ATOM 1097 CB ILE A 214 6.359 1.818 -3.439 1.00 74.25 C ATOM 1098 CG1 ILE A 214 5.027 2.587 -3.484 1.00 20.01 C ATOM 1099 CG2 ILE A 214 7.541 2.788 -3.509 1.00 4.41 C ATOM 1100 CD1 ILE A 214 3.805 1.717 -3.251 1.00 23.01 C ATOM 0 H ILE A 214 8.176 0.119 -3.585 1.00 22.44 H new ATOM 0 HA ILE A 214 5.543 0.139 -4.545 1.00 63.31 H new ATOM 0 HB ILE A 214 6.410 1.284 -2.490 1.00 74.25 H new ATOM 0 HG12 ILE A 214 5.048 3.375 -2.731 1.00 20.01 H new ATOM 0 HG13 ILE A 214 4.933 3.075 -4.454 1.00 20.01 H new ATOM 0 HG21 ILE A 214 7.463 3.516 -2.701 1.00 4.41 H new ATOM 0 HG22 ILE A 214 8.474 2.233 -3.408 1.00 4.41 H new ATOM 0 HG23 ILE A 214 7.530 3.307 -4.467 1.00 4.41 H new ATOM 0 HD11 ILE A 214 2.906 2.332 -3.298 1.00 23.01 H new ATOM 0 HD12 ILE A 214 3.757 0.944 -4.018 1.00 23.01 H new ATOM 0 HD13 ILE A 214 3.873 1.249 -2.269 1.00 23.01 H new ATOM 1112 N SER A 215 7.701 1.558 -6.507 1.00 42.34 N ATOM 1113 CA SER A 215 7.929 2.121 -7.851 1.00 34.01 C ATOM 1114 C SER A 215 7.082 1.415 -8.926 1.00 44.24 C ATOM 1115 O SER A 215 6.732 2.011 -9.946 1.00 1.11 O ATOM 1116 CB SER A 215 9.420 2.011 -8.219 1.00 41.25 C ATOM 1117 OG SER A 215 9.668 2.437 -9.549 1.00 5.02 O ATOM 0 H SER A 215 8.553 1.241 -6.044 1.00 42.34 H new ATOM 0 HA SER A 215 7.626 3.168 -7.821 1.00 34.01 H new ATOM 0 HB2 SER A 215 10.010 2.614 -7.529 1.00 41.25 H new ATOM 0 HB3 SER A 215 9.748 0.978 -8.101 1.00 41.25 H new ATOM 0 HG SER A 215 10.624 2.354 -9.746 1.00 5.02 H new ATOM 1123 N TRP A 216 6.751 0.144 -8.694 1.00 32.24 N ATOM 1124 CA TRP A 216 5.933 -0.637 -9.639 1.00 53.54 C ATOM 1125 C TRP A 216 4.438 -0.273 -9.541 1.00 54.41 C ATOM 1126 O TRP A 216 3.625 -0.731 -10.343 1.00 2.34 O ATOM 1127 CB TRP A 216 6.118 -2.142 -9.379 1.00 14.54 C ATOM 1128 CG TRP A 216 7.497 -2.655 -9.696 1.00 62.11 C ATOM 1129 CD1 TRP A 216 8.683 -2.200 -9.192 1.00 50.34 C ATOM 1130 CD2 TRP A 216 7.829 -3.734 -10.580 1.00 53.04 C ATOM 1131 NE1 TRP A 216 9.728 -2.922 -9.715 1.00 30.02 N ATOM 1132 CE2 TRP A 216 9.231 -3.870 -10.569 1.00 34.24 C ATOM 1133 CE3 TRP A 216 7.078 -4.595 -11.383 1.00 4.52 C ATOM 1134 CZ2 TRP A 216 9.892 -4.833 -11.327 1.00 52.05 C ATOM 1135 CZ3 TRP A 216 7.734 -5.552 -12.133 1.00 71.24 C ATOM 1136 CH2 TRP A 216 9.130 -5.664 -12.099 1.00 73.31 C ATOM 0 H TRP A 216 7.034 -0.372 -7.861 1.00 32.24 H new ATOM 0 HA TRP A 216 6.272 -0.392 -10.646 1.00 53.54 H new ATOM 0 HB2 TRP A 216 5.897 -2.349 -8.332 1.00 14.54 H new ATOM 0 HB3 TRP A 216 5.391 -2.695 -9.974 1.00 14.54 H new ATOM 0 HD1 TRP A 216 8.784 -1.390 -8.485 1.00 50.34 H new ATOM 0 HE1 TRP A 216 10.715 -2.776 -9.502 1.00 30.02 H new ATOM 0 HE3 TRP A 216 6.002 -4.514 -11.417 1.00 4.52 H new ATOM 0 HZ2 TRP A 216 10.968 -4.920 -11.306 1.00 52.05 H new ATOM 0 HZ3 TRP A 216 7.162 -6.224 -12.755 1.00 71.24 H new ATOM 0 HH2 TRP A 216 9.614 -6.423 -12.695 1.00 73.31 H new ATOM 1147 N LEU A 217 4.088 0.551 -8.556 1.00 40.01 N ATOM 1148 CA LEU A 217 2.692 0.942 -8.306 1.00 24.24 C ATOM 1149 C LEU A 217 2.530 2.472 -8.372 1.00 65.43 C ATOM 1150 O LEU A 217 1.578 3.039 -7.831 1.00 15.22 O ATOM 1151 CB LEU A 217 2.264 0.420 -6.923 1.00 71.03 C ATOM 1152 CG LEU A 217 2.560 -1.071 -6.669 1.00 5.44 C ATOM 1153 CD1 LEU A 217 2.230 -1.456 -5.229 1.00 4.44 C ATOM 1154 CD2 LEU A 217 1.795 -1.955 -7.657 1.00 43.02 C ATOM 0 H LEU A 217 4.757 0.968 -7.908 1.00 40.01 H new ATOM 0 HA LEU A 217 2.057 0.505 -9.077 1.00 24.24 H new ATOM 0 HB2 LEU A 217 2.767 1.010 -6.157 1.00 71.03 H new ATOM 0 HB3 LEU A 217 1.194 0.588 -6.803 1.00 71.03 H new ATOM 0 HG LEU A 217 3.627 -1.233 -6.825 1.00 5.44 H new ATOM 0 HD11 LEU A 217 2.448 -2.513 -5.076 1.00 4.44 H new ATOM 0 HD12 LEU A 217 2.833 -0.859 -4.545 1.00 4.44 H new ATOM 0 HD13 LEU A 217 1.173 -1.272 -5.036 1.00 4.44 H new ATOM 0 HD21 LEU A 217 2.020 -3.003 -7.458 1.00 43.02 H new ATOM 0 HD22 LEU A 217 0.724 -1.786 -7.543 1.00 43.02 H new ATOM 0 HD23 LEU A 217 2.095 -1.707 -8.675 1.00 43.02 H new ATOM 1166 N THR A 218 3.461 3.127 -9.062 1.00 3.24 N ATOM 1167 CA THR A 218 3.522 4.594 -9.118 1.00 11.41 C ATOM 1168 C THR A 218 2.271 5.228 -9.756 1.00 62.32 C ATOM 1169 O THR A 218 1.864 4.860 -10.858 1.00 41.15 O ATOM 1170 CB THR A 218 4.771 5.069 -9.904 1.00 4.33 C ATOM 1171 OG1 THR A 218 5.964 4.563 -9.286 1.00 14.31 O ATOM 1172 CG2 THR A 218 4.844 6.594 -9.971 1.00 12.23 C ATOM 0 H THR A 218 4.194 2.662 -9.598 1.00 3.24 H new ATOM 0 HA THR A 218 3.578 4.924 -8.081 1.00 11.41 H new ATOM 0 HB THR A 218 4.688 4.683 -10.920 1.00 4.33 H new ATOM 0 HG1 THR A 218 6.140 3.655 -9.610 1.00 14.31 H new ATOM 0 HG21 THR A 218 5.732 6.892 -10.529 1.00 12.23 H new ATOM 0 HG22 THR A 218 3.955 6.979 -10.471 1.00 12.23 H new ATOM 0 HG23 THR A 218 4.897 7.000 -8.961 1.00 12.23 H new ATOM 1180 N GLY A 219 1.668 6.179 -9.042 1.00 64.43 N ATOM 1181 CA GLY A 219 0.601 7.004 -9.606 1.00 11.42 C ATOM 1182 C GLY A 219 -0.765 6.324 -9.717 1.00 74.42 C ATOM 1183 O GLY A 219 -1.666 6.861 -10.364 1.00 50.22 O ATOM 0 H GLY A 219 1.900 6.396 -8.073 1.00 64.43 H new ATOM 0 HA2 GLY A 219 0.494 7.899 -8.993 1.00 11.42 H new ATOM 0 HA3 GLY A 219 0.906 7.333 -10.599 1.00 11.42 H new ATOM 1187 N GLU A 220 -0.943 5.162 -9.092 1.00 12.31 N ATOM 1188 CA GLU A 220 -2.234 4.458 -9.154 1.00 54.53 C ATOM 1189 C GLU A 220 -2.781 4.108 -7.762 1.00 71.52 C ATOM 1190 O GLU A 220 -2.117 4.318 -6.741 1.00 74.21 O ATOM 1191 CB GLU A 220 -2.133 3.209 -10.038 1.00 71.30 C ATOM 1192 CG GLU A 220 -1.209 2.117 -9.517 1.00 74.41 C ATOM 1193 CD GLU A 220 -1.101 0.958 -10.496 1.00 73.54 C ATOM 1194 OE1 GLU A 220 -1.971 0.060 -10.470 1.00 11.32 O ATOM 1195 OE2 GLU A 220 -0.165 0.955 -11.321 1.00 53.33 O ATOM 0 H GLU A 220 -0.225 4.689 -8.543 1.00 12.31 H new ATOM 0 HA GLU A 220 -2.949 5.145 -9.607 1.00 54.53 H new ATOM 0 HB2 GLU A 220 -3.131 2.789 -10.161 1.00 71.30 H new ATOM 0 HB3 GLU A 220 -1.790 3.511 -11.028 1.00 71.30 H new ATOM 0 HG2 GLU A 220 -0.218 2.534 -9.336 1.00 74.41 H new ATOM 0 HG3 GLU A 220 -1.581 1.752 -8.560 1.00 74.41 H new ATOM 1202 N GLU A 221 -4.011 3.595 -7.737 1.00 64.03 N ATOM 1203 CA GLU A 221 -4.737 3.355 -6.486 1.00 13.22 C ATOM 1204 C GLU A 221 -4.445 1.966 -5.899 1.00 33.44 C ATOM 1205 O GLU A 221 -4.595 0.944 -6.573 1.00 62.43 O ATOM 1206 CB GLU A 221 -6.257 3.487 -6.697 1.00 40.03 C ATOM 1207 CG GLU A 221 -6.689 4.691 -7.531 1.00 22.14 C ATOM 1208 CD GLU A 221 -6.571 4.447 -9.032 1.00 34.35 C ATOM 1209 OE1 GLU A 221 -7.480 3.817 -9.614 1.00 23.23 O ATOM 1210 OE2 GLU A 221 -5.569 4.878 -9.637 1.00 44.13 O ATOM 0 H GLU A 221 -4.531 3.335 -8.575 1.00 64.03 H new ATOM 0 HA GLU A 221 -4.388 4.112 -5.783 1.00 13.22 H new ATOM 0 HB2 GLU A 221 -6.622 2.580 -7.179 1.00 40.03 H new ATOM 0 HB3 GLU A 221 -6.740 3.547 -5.722 1.00 40.03 H new ATOM 0 HG2 GLU A 221 -7.722 4.942 -7.289 1.00 22.14 H new ATOM 0 HG3 GLU A 221 -6.079 5.553 -7.259 1.00 22.14 H new ATOM 1217 N LEU A 222 -4.040 1.943 -4.637 1.00 73.11 N ATOM 1218 CA LEU A 222 -3.890 0.700 -3.879 1.00 2.43 C ATOM 1219 C LEU A 222 -4.959 0.625 -2.782 1.00 24.40 C ATOM 1220 O LEU A 222 -5.291 1.630 -2.165 1.00 14.33 O ATOM 1221 CB LEU A 222 -2.496 0.620 -3.243 1.00 4.52 C ATOM 1222 CG LEU A 222 -1.318 0.672 -4.227 1.00 15.30 C ATOM 1223 CD1 LEU A 222 0.012 0.656 -3.479 1.00 22.54 C ATOM 1224 CD2 LEU A 222 -1.391 -0.485 -5.222 1.00 42.24 C ATOM 0 H LEU A 222 -3.805 2.782 -4.107 1.00 73.11 H new ATOM 0 HA LEU A 222 -4.012 -0.138 -4.565 1.00 2.43 H new ATOM 0 HB2 LEU A 222 -2.391 1.441 -2.534 1.00 4.52 H new ATOM 0 HB3 LEU A 222 -2.429 -0.306 -2.671 1.00 4.52 H new ATOM 0 HG LEU A 222 -1.384 1.606 -4.786 1.00 15.30 H new ATOM 0 HD11 LEU A 222 0.833 0.693 -4.195 1.00 22.54 H new ATOM 0 HD12 LEU A 222 0.068 1.521 -2.818 1.00 22.54 H new ATOM 0 HD13 LEU A 222 0.087 -0.258 -2.889 1.00 22.54 H new ATOM 0 HD21 LEU A 222 -0.547 -0.428 -5.909 1.00 42.24 H new ATOM 0 HD22 LEU A 222 -1.356 -1.432 -4.683 1.00 42.24 H new ATOM 0 HD23 LEU A 222 -2.322 -0.422 -5.785 1.00 42.24 H new ATOM 1236 N HIS A 223 -5.503 -0.558 -2.544 1.00 72.22 N ATOM 1237 CA HIS A 223 -6.511 -0.743 -1.496 1.00 73.22 C ATOM 1238 C HIS A 223 -6.026 -1.765 -0.457 1.00 23.11 C ATOM 1239 O HIS A 223 -5.360 -2.737 -0.805 1.00 72.01 O ATOM 1240 CB HIS A 223 -7.843 -1.191 -2.117 1.00 73.32 C ATOM 1241 CG HIS A 223 -8.401 -0.213 -3.115 1.00 41.22 C ATOM 1242 ND1 HIS A 223 -9.374 0.710 -2.801 1.00 34.12 N ATOM 1243 CD2 HIS A 223 -8.121 -0.022 -4.429 1.00 32.10 C ATOM 1244 CE1 HIS A 223 -9.665 1.424 -3.869 1.00 35.51 C ATOM 1245 NE2 HIS A 223 -8.924 1.002 -4.872 1.00 25.23 N ATOM 0 H HIS A 223 -5.268 -1.407 -3.058 1.00 72.22 H new ATOM 0 HA HIS A 223 -6.667 0.209 -0.989 1.00 73.22 H new ATOM 0 HB2 HIS A 223 -7.701 -2.155 -2.606 1.00 73.32 H new ATOM 0 HB3 HIS A 223 -8.573 -1.342 -1.321 1.00 73.32 H new ATOM 0 HD2 HIS A 223 -7.401 -0.572 -5.017 1.00 32.10 H new ATOM 0 HE1 HIS A 223 -10.391 2.223 -3.914 1.00 35.51 H new ATOM 0 HE2 HIS A 223 -8.943 1.374 -5.822 1.00 25.23 H new ATOM 1254 N VAL A 224 -6.334 -1.534 0.818 1.00 12.03 N ATOM 1255 CA VAL A 224 -5.892 -2.439 1.894 1.00 14.41 C ATOM 1256 C VAL A 224 -7.065 -3.092 2.654 1.00 31.14 C ATOM 1257 O VAL A 224 -7.963 -2.408 3.143 1.00 60.04 O ATOM 1258 CB VAL A 224 -4.980 -1.692 2.904 1.00 44.44 C ATOM 1259 CG1 VAL A 224 -4.652 -2.575 4.107 1.00 71.35 C ATOM 1260 CG2 VAL A 224 -3.697 -1.220 2.218 1.00 63.24 C ATOM 0 H VAL A 224 -6.883 -0.736 1.137 1.00 12.03 H new ATOM 0 HA VAL A 224 -5.332 -3.235 1.404 1.00 14.41 H new ATOM 0 HB VAL A 224 -5.522 -0.819 3.267 1.00 44.44 H new ATOM 0 HG11 VAL A 224 -4.012 -2.026 4.798 1.00 71.35 H new ATOM 0 HG12 VAL A 224 -5.575 -2.857 4.614 1.00 71.35 H new ATOM 0 HG13 VAL A 224 -4.135 -3.473 3.769 1.00 71.35 H new ATOM 0 HG21 VAL A 224 -3.069 -0.698 2.940 1.00 63.24 H new ATOM 0 HG22 VAL A 224 -3.158 -2.081 1.823 1.00 63.24 H new ATOM 0 HG23 VAL A 224 -3.949 -0.544 1.401 1.00 63.24 H new ATOM 1270 N GLU A 225 -7.043 -4.428 2.737 1.00 41.50 N ATOM 1271 CA GLU A 225 -7.991 -5.188 3.573 1.00 34.22 C ATOM 1272 C GLU A 225 -7.329 -5.629 4.891 1.00 11.55 C ATOM 1273 O GLU A 225 -6.105 -5.599 5.024 1.00 53.34 O ATOM 1274 CB GLU A 225 -8.524 -6.424 2.821 1.00 34.42 C ATOM 1275 CG GLU A 225 -9.619 -6.107 1.807 1.00 72.20 C ATOM 1276 CD GLU A 225 -10.142 -7.335 1.071 1.00 10.44 C ATOM 1277 OE1 GLU A 225 -10.908 -8.116 1.673 1.00 50.22 O ATOM 1278 OE2 GLU A 225 -9.802 -7.517 -0.119 1.00 34.40 O ATOM 0 H GLU A 225 -6.375 -5.012 2.233 1.00 41.50 H new ATOM 0 HA GLU A 225 -8.828 -4.528 3.801 1.00 34.22 H new ATOM 0 HB2 GLU A 225 -7.695 -6.909 2.306 1.00 34.42 H new ATOM 0 HB3 GLU A 225 -8.911 -7.140 3.547 1.00 34.42 H new ATOM 0 HG2 GLU A 225 -10.448 -5.621 2.320 1.00 72.20 H new ATOM 0 HG3 GLU A 225 -9.233 -5.394 1.079 1.00 72.20 H new ATOM 1285 N VAL A 226 -8.146 -6.042 5.860 1.00 35.35 N ATOM 1286 CA VAL A 226 -7.645 -6.481 7.169 1.00 14.53 C ATOM 1287 C VAL A 226 -7.594 -8.016 7.267 1.00 5.11 C ATOM 1288 O VAL A 226 -8.618 -8.691 7.144 1.00 5.23 O ATOM 1289 CB VAL A 226 -8.529 -5.929 8.320 1.00 3.31 C ATOM 1290 CG1 VAL A 226 -7.978 -6.351 9.685 1.00 53.54 C ATOM 1291 CG2 VAL A 226 -8.648 -4.407 8.225 1.00 0.11 C ATOM 0 H VAL A 226 -9.161 -6.083 5.766 1.00 35.35 H new ATOM 0 HA VAL A 226 -6.634 -6.086 7.268 1.00 14.53 H new ATOM 0 HB VAL A 226 -9.527 -6.356 8.217 1.00 3.31 H new ATOM 0 HG11 VAL A 226 -8.615 -5.952 10.474 1.00 53.54 H new ATOM 0 HG12 VAL A 226 -7.960 -7.439 9.749 1.00 53.54 H new ATOM 0 HG13 VAL A 226 -6.966 -5.963 9.805 1.00 53.54 H new ATOM 0 HG21 VAL A 226 -9.271 -4.039 9.040 1.00 0.11 H new ATOM 0 HG22 VAL A 226 -7.657 -3.959 8.296 1.00 0.11 H new ATOM 0 HG23 VAL A 226 -9.101 -4.136 7.271 1.00 0.11 H new ATOM 1301 N LEU A 227 -6.400 -8.565 7.492 1.00 42.21 N ATOM 1302 CA LEU A 227 -6.240 -10.015 7.661 1.00 53.40 C ATOM 1303 C LEU A 227 -6.891 -10.483 8.974 1.00 50.45 C ATOM 1304 O LEU A 227 -7.849 -11.257 8.967 1.00 25.22 O ATOM 1305 CB LEU A 227 -4.751 -10.394 7.641 1.00 41.13 C ATOM 1306 CG LEU A 227 -3.990 -10.002 6.363 1.00 33.53 C ATOM 1307 CD1 LEU A 227 -2.524 -10.417 6.454 1.00 22.11 C ATOM 1308 CD2 LEU A 227 -4.646 -10.618 5.130 1.00 0.34 C ATOM 0 H LEU A 227 -5.532 -8.034 7.562 1.00 42.21 H new ATOM 0 HA LEU A 227 -6.740 -10.514 6.831 1.00 53.40 H new ATOM 0 HB2 LEU A 227 -4.262 -9.924 8.494 1.00 41.13 H new ATOM 0 HB3 LEU A 227 -4.665 -11.472 7.779 1.00 41.13 H new ATOM 0 HG LEU A 227 -4.032 -8.917 6.267 1.00 33.53 H new ATOM 0 HD11 LEU A 227 -2.007 -10.129 5.539 1.00 22.11 H new ATOM 0 HD12 LEU A 227 -2.058 -9.921 7.305 1.00 22.11 H new ATOM 0 HD13 LEU A 227 -2.459 -11.497 6.583 1.00 22.11 H new ATOM 0 HD21 LEU A 227 -4.090 -10.327 4.239 1.00 0.34 H new ATOM 0 HD22 LEU A 227 -4.643 -11.704 5.221 1.00 0.34 H new ATOM 0 HD23 LEU A 227 -5.674 -10.263 5.049 1.00 0.34 H new