USER MOD reduce.3.24.130724 H: found=0, std=0, add=414, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 416 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 THR OG1 : rot 170:sc= -2.23! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.878 USER MOD Single : A 10 SER OG : rot 44:sc= 0.166 USER MOD Single : A 11 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.0806) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.744 USER MOD Single : A 40 LYS NZ :NH3+ -122:sc= 0 (180deg=-0.121) USER MOD Single : A 43 SER OG : rot 6:sc= 0.335! USER MOD Single : A 70 SER OG : rot 180:sc= -0.145 USER MOD Single : A 73 LYS NZ :NH3+ -142:sc= 0 (180deg=-0.0343) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 161 N SER A 10 64.447 4.121 7.880 1.00 15.00 N ATOM 162 CA SER A 10 63.598 2.909 8.120 1.00 15.00 C ATOM 163 C SER A 10 63.761 1.906 6.972 1.00 15.00 C ATOM 164 O SER A 10 64.174 2.260 5.884 1.00 15.00 O ATOM 165 CB SER A 10 62.160 3.426 8.178 1.00 15.00 C ATOM 166 OG SER A 10 62.037 4.356 9.246 1.00 15.00 O ATOM 0 HA SER A 10 63.880 2.391 9.037 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.894 3.902 7.234 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.469 2.596 8.322 1.00 15.00 H new ATOM 0 HG SER A 10 62.811 4.957 9.248 1.00 15.00 H new ATOM 172 N LYS A 11 63.437 0.658 7.216 1.00 15.00 N ATOM 173 CA LYS A 11 63.586 -0.394 6.158 1.00 15.00 C ATOM 174 C LYS A 11 62.335 -0.441 5.272 1.00 15.00 C ATOM 175 O LYS A 11 61.220 -0.472 5.762 1.00 15.00 O ATOM 176 CB LYS A 11 63.741 -1.713 6.922 1.00 15.00 C ATOM 177 CG LYS A 11 65.047 -1.699 7.722 1.00 15.00 C ATOM 178 CD LYS A 11 64.922 -2.638 8.925 1.00 15.00 C ATOM 179 CE LYS A 11 65.057 -4.089 8.458 1.00 15.00 C ATOM 180 NZ LYS A 11 66.524 -4.332 8.380 1.00 15.00 N ATOM 0 H LYS A 11 63.074 0.321 8.107 1.00 15.00 H new ATOM 0 HA LYS A 11 64.435 -0.196 5.504 1.00 15.00 H new ATOM 0 HB2 LYS A 11 62.894 -1.857 7.593 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.740 -2.550 6.224 1.00 15.00 H new ATOM 0 HG2 LYS A 11 65.877 -2.012 7.088 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.268 -0.686 8.060 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.693 -2.408 9.660 1.00 15.00 H new ATOM 0 HD3 LYS A 11 63.960 -2.491 9.416 1.00 15.00 H new ATOM 0 HE2 LYS A 11 64.580 -4.775 9.158 1.00 15.00 H new ATOM 0 HE3 LYS A 11 64.580 -4.238 7.489 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 66.730 -4.956 7.574 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 67.020 -3.427 8.253 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 66.848 -4.784 9.259 1.00 15.00 H new ATOM 194 N ILE A 12 62.514 -0.450 3.972 1.00 15.00 N ATOM 195 CA ILE A 12 61.341 -0.501 3.044 1.00 15.00 C ATOM 196 C ILE A 12 61.579 -1.557 1.958 1.00 15.00 C ATOM 197 O ILE A 12 62.701 -1.794 1.543 1.00 15.00 O ATOM 198 CB ILE A 12 61.237 0.905 2.429 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.989 1.938 3.540 1.00 15.00 C ATOM 200 CG2 ILE A 12 60.068 0.951 1.433 1.00 15.00 C ATOM 201 CD1 ILE A 12 61.073 3.353 2.960 1.00 15.00 C ATOM 0 H ILE A 12 63.425 -0.424 3.513 1.00 15.00 H new ATOM 0 HA ILE A 12 60.421 -0.775 3.559 1.00 15.00 H new ATOM 0 HB ILE A 12 62.168 1.136 1.912 1.00 15.00 H new ATOM 0 HG12 ILE A 12 60.008 1.776 3.988 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.726 1.816 4.334 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.998 1.949 1.000 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.237 0.222 0.640 1.00 15.00 H new ATOM 0 HG23 ILE A 12 59.139 0.715 1.951 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.897 4.082 3.751 1.00 15.00 H new ATOM 0 HD12 ILE A 12 62.063 3.513 2.533 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.319 3.473 2.182 1.00 15.00 H new ATOM 213 N SER A 13 60.524 -2.188 1.502 1.00 15.00 N ATOM 214 CA SER A 13 60.642 -3.160 0.376 1.00 15.00 C ATOM 215 C SER A 13 59.836 -2.654 -0.822 1.00 15.00 C ATOM 216 O SER A 13 58.697 -2.247 -0.685 1.00 15.00 O ATOM 217 CB SER A 13 60.049 -4.463 0.912 1.00 15.00 C ATOM 218 OG SER A 13 60.197 -5.483 -0.068 1.00 15.00 O ATOM 0 H SER A 13 59.579 -2.068 1.867 1.00 15.00 H new ATOM 0 HA SER A 13 61.671 -3.294 0.042 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.552 -4.753 1.835 1.00 15.00 H new ATOM 0 HB3 SER A 13 58.995 -4.324 1.154 1.00 15.00 H new ATOM 0 HG SER A 13 59.820 -6.321 0.272 1.00 15.00 H new ATOM 224 N LEU A 14 60.421 -2.678 -1.994 1.00 15.00 N ATOM 225 CA LEU A 14 59.739 -2.111 -3.195 1.00 15.00 C ATOM 226 C LEU A 14 59.650 -3.164 -4.304 1.00 15.00 C ATOM 227 O LEU A 14 60.594 -3.889 -4.556 1.00 15.00 O ATOM 228 CB LEU A 14 60.628 -0.948 -3.635 1.00 15.00 C ATOM 229 CG LEU A 14 59.808 0.034 -4.471 1.00 15.00 C ATOM 230 CD1 LEU A 14 58.869 0.821 -3.556 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.752 1.001 -5.188 1.00 15.00 C ATOM 0 H LEU A 14 61.347 -3.068 -2.170 1.00 15.00 H new ATOM 0 HA LEU A 14 58.719 -1.792 -2.979 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.041 -0.442 -2.762 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.471 -1.321 -4.216 1.00 15.00 H new ATOM 0 HG LEU A 14 59.221 -0.515 -5.207 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.284 1.522 -4.151 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.198 0.132 -3.043 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.455 1.371 -2.820 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.169 1.703 -5.785 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.338 1.551 -4.451 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.422 0.440 -5.839 1.00 15.00 H new ATOM 243 N ILE A 15 58.522 -3.249 -4.963 1.00 15.00 N ATOM 244 CA ILE A 15 58.380 -4.197 -6.110 1.00 15.00 C ATOM 245 C ILE A 15 58.326 -3.397 -7.416 1.00 15.00 C ATOM 246 O ILE A 15 57.463 -2.554 -7.596 1.00 15.00 O ATOM 247 CB ILE A 15 57.057 -4.945 -5.864 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.135 -5.708 -4.534 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.806 -5.945 -6.999 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.741 -6.207 -4.146 1.00 15.00 C ATOM 0 H ILE A 15 57.689 -2.699 -4.754 1.00 15.00 H new ATOM 0 HA ILE A 15 59.213 -4.896 -6.188 1.00 15.00 H new ATOM 0 HB ILE A 15 56.243 -4.221 -5.827 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.821 -6.550 -4.626 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.530 -5.058 -3.753 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.869 -6.471 -6.820 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.747 -5.411 -7.948 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.624 -6.664 -7.038 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.798 -6.748 -3.202 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.068 -5.357 -4.037 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.363 -6.872 -4.923 1.00 15.00 H new ATOM 262 N SER A 16 59.242 -3.658 -8.318 1.00 15.00 N ATOM 263 CA SER A 16 59.379 -2.798 -9.535 1.00 15.00 C ATOM 264 C SER A 16 58.544 -3.353 -10.695 1.00 15.00 C ATOM 265 O SER A 16 57.973 -4.423 -10.607 1.00 15.00 O ATOM 266 CB SER A 16 60.869 -2.835 -9.882 1.00 15.00 C ATOM 267 OG SER A 16 61.561 -1.886 -9.081 1.00 15.00 O ATOM 0 H SER A 16 59.903 -4.433 -8.263 1.00 15.00 H new ATOM 0 HA SER A 16 59.023 -1.784 -9.355 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.270 -3.834 -9.710 1.00 15.00 H new ATOM 0 HB3 SER A 16 61.014 -2.611 -10.939 1.00 15.00 H new ATOM 0 HG SER A 16 62.516 -1.908 -9.299 1.00 15.00 H new ATOM 273 N LYS A 17 58.480 -2.626 -11.787 1.00 15.00 N ATOM 274 CA LYS A 17 57.638 -3.061 -12.954 1.00 15.00 C ATOM 275 C LYS A 17 58.085 -4.432 -13.490 1.00 15.00 C ATOM 276 O LYS A 17 57.329 -5.112 -14.161 1.00 15.00 O ATOM 277 CB LYS A 17 57.842 -1.983 -14.023 1.00 15.00 C ATOM 278 CG LYS A 17 56.832 -2.186 -15.155 1.00 15.00 C ATOM 279 CD LYS A 17 57.081 -1.150 -16.254 1.00 15.00 C ATOM 280 CE LYS A 17 55.997 -1.274 -17.328 1.00 15.00 C ATOM 281 NZ LYS A 17 56.514 -0.493 -18.485 1.00 15.00 N ATOM 0 H LYS A 17 58.977 -1.745 -11.922 1.00 15.00 H new ATOM 0 HA LYS A 17 56.592 -3.169 -12.667 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.718 -0.993 -13.584 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.858 -2.033 -14.415 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.924 -3.193 -15.562 1.00 15.00 H new ATOM 0 HG3 LYS A 17 55.816 -2.088 -14.772 1.00 15.00 H new ATOM 0 HD2 LYS A 17 57.075 -0.146 -15.830 1.00 15.00 H new ATOM 0 HD3 LYS A 17 58.065 -1.303 -16.696 1.00 15.00 H new ATOM 0 HE2 LYS A 17 55.827 -2.316 -17.599 1.00 15.00 H new ATOM 0 HE3 LYS A 17 55.045 -0.876 -16.976 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 55.826 -0.530 -19.264 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 56.660 0.496 -18.199 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 57.418 -0.899 -18.802 1.00 15.00 H new ATOM 295 N ALA A 18 59.301 -4.842 -13.203 1.00 15.00 N ATOM 296 CA ALA A 18 59.802 -6.150 -13.735 1.00 15.00 C ATOM 297 C ALA A 18 59.507 -7.300 -12.758 1.00 15.00 C ATOM 298 O ALA A 18 60.088 -8.363 -12.860 1.00 15.00 O ATOM 299 CB ALA A 18 61.312 -5.961 -13.892 1.00 15.00 C ATOM 0 H ALA A 18 59.965 -4.328 -12.625 1.00 15.00 H new ATOM 0 HA ALA A 18 59.315 -6.413 -14.674 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.755 -6.879 -14.279 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.506 -5.144 -14.586 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.752 -5.726 -12.923 1.00 15.00 H new ATOM 305 N GLU A 19 58.610 -7.098 -11.809 1.00 15.00 N ATOM 306 CA GLU A 19 58.229 -8.187 -10.843 1.00 15.00 C ATOM 307 C GLU A 19 59.463 -8.704 -10.091 1.00 15.00 C ATOM 308 O GLU A 19 59.523 -9.855 -9.700 1.00 15.00 O ATOM 309 CB GLU A 19 57.592 -9.304 -11.683 1.00 15.00 C ATOM 310 CG GLU A 19 56.320 -8.782 -12.356 1.00 15.00 C ATOM 311 CD GLU A 19 55.625 -9.925 -13.101 1.00 15.00 C ATOM 312 OE1 GLU A 19 54.412 -10.012 -13.012 1.00 15.00 O ATOM 313 OE2 GLU A 19 56.318 -10.691 -13.751 1.00 15.00 O ATOM 0 H GLU A 19 58.122 -6.214 -11.664 1.00 15.00 H new ATOM 0 HA GLU A 19 57.535 -7.819 -10.088 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.297 -9.652 -12.437 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.355 -10.159 -11.049 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.648 -8.360 -11.608 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.568 -7.979 -13.051 1.00 15.00 H new ATOM 320 N ILE A 20 60.443 -7.855 -9.891 1.00 15.00 N ATOM 321 CA ILE A 20 61.603 -8.226 -9.022 1.00 15.00 C ATOM 322 C ILE A 20 61.473 -7.498 -7.678 1.00 15.00 C ATOM 323 O ILE A 20 60.976 -6.387 -7.616 1.00 15.00 O ATOM 324 CB ILE A 20 62.855 -7.758 -9.783 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.947 -8.492 -11.126 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.109 -8.066 -8.957 1.00 15.00 C ATOM 327 CD1 ILE A 20 64.001 -7.819 -12.007 1.00 15.00 C ATOM 0 H ILE A 20 60.489 -6.919 -10.294 1.00 15.00 H new ATOM 0 HA ILE A 20 61.651 -9.295 -8.814 1.00 15.00 H new ATOM 0 HB ILE A 20 62.785 -6.684 -9.955 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.208 -9.538 -10.963 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.979 -8.479 -11.626 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.993 -7.733 -9.500 1.00 15.00 H new ATOM 0 HG22 ILE A 20 64.052 -7.545 -8.001 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.174 -9.140 -8.781 1.00 15.00 H new ATOM 0 HD11 ILE A 20 64.065 -8.342 -12.961 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.721 -6.780 -12.181 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.969 -7.855 -11.508 1.00 15.00 H new ATOM 339 N ARG A 21 61.915 -8.118 -6.611 1.00 15.00 N ATOM 340 CA ARG A 21 61.762 -7.498 -5.259 1.00 15.00 C ATOM 341 C ARG A 21 63.100 -6.927 -4.778 1.00 15.00 C ATOM 342 O ARG A 21 64.074 -7.643 -4.633 1.00 15.00 O ATOM 343 CB ARG A 21 61.311 -8.642 -4.350 1.00 15.00 C ATOM 344 CG ARG A 21 60.869 -8.075 -2.999 1.00 15.00 C ATOM 345 CD ARG A 21 60.503 -9.227 -2.056 1.00 15.00 C ATOM 346 NE ARG A 21 59.231 -9.801 -2.604 1.00 15.00 N ATOM 347 CZ ARG A 21 58.464 -10.591 -1.877 1.00 15.00 C ATOM 348 NH1 ARG A 21 58.780 -10.915 -0.643 1.00 15.00 N ATOM 349 NH2 ARG A 21 57.365 -11.065 -2.395 1.00 15.00 N ATOM 0 H ARG A 21 62.376 -9.028 -6.619 1.00 15.00 H new ATOM 0 HA ARG A 21 61.051 -6.672 -5.263 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.489 -9.187 -4.814 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.126 -9.352 -4.210 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.669 -7.476 -2.565 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.013 -7.414 -3.133 1.00 15.00 H new ATOM 0 HD2 ARG A 21 61.293 -9.978 -2.028 1.00 15.00 H new ATOM 0 HD3 ARG A 21 60.365 -8.871 -1.035 1.00 15.00 H new ATOM 0 HE ARG A 21 58.953 -9.576 -3.559 1.00 15.00 H new ATOM 0 HH11 ARG A 21 59.637 -10.554 -0.224 1.00 15.00 H new ATOM 0 HH12 ARG A 21 58.168 -11.528 -0.104 1.00 15.00 H new ATOM 0 HH21 ARG A 21 57.107 -10.824 -3.352 1.00 15.00 H new ATOM 0 HH22 ARG A 21 56.764 -11.677 -1.843 1.00 15.00 H new ATOM 363 N TYR A 22 63.146 -5.641 -4.529 1.00 15.00 N ATOM 364 CA TYR A 22 64.387 -5.011 -3.985 1.00 15.00 C ATOM 365 C TYR A 22 64.146 -4.550 -2.546 1.00 15.00 C ATOM 366 O TYR A 22 63.121 -3.976 -2.243 1.00 15.00 O ATOM 367 CB TYR A 22 64.647 -3.799 -4.882 1.00 15.00 C ATOM 368 CG TYR A 22 65.087 -4.151 -6.282 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.466 -4.292 -6.577 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.122 -4.333 -7.303 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.879 -4.613 -7.893 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.535 -4.654 -8.619 1.00 15.00 C ATOM 373 CZ TYR A 22 65.914 -4.793 -8.914 1.00 15.00 C ATOM 374 OH TYR A 22 66.316 -5.107 -10.196 1.00 15.00 O ATOM 0 H TYR A 22 62.370 -4.997 -4.681 1.00 15.00 H new ATOM 0 HA TYR A 22 65.229 -5.703 -3.975 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.738 -3.201 -4.938 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.411 -3.175 -4.419 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.202 -4.155 -5.798 1.00 15.00 H new ATOM 0 HD2 TYR A 22 63.071 -4.227 -7.078 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.930 -4.721 -8.118 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.799 -4.793 -9.397 1.00 15.00 H new ATOM 0 HH TYR A 22 65.529 -5.197 -10.773 1.00 15.00 H new ATOM 384 N GLU A 23 65.082 -4.795 -1.662 1.00 15.00 N ATOM 385 CA GLU A 23 64.962 -4.257 -0.272 1.00 15.00 C ATOM 386 C GLU A 23 66.123 -3.305 0.016 1.00 15.00 C ATOM 387 O GLU A 23 67.247 -3.553 -0.379 1.00 15.00 O ATOM 388 CB GLU A 23 65.036 -5.486 0.637 1.00 15.00 C ATOM 389 CG GLU A 23 64.702 -5.080 2.075 1.00 15.00 C ATOM 390 CD GLU A 23 64.906 -6.278 3.005 1.00 15.00 C ATOM 391 OE1 GLU A 23 64.048 -6.505 3.842 1.00 15.00 O ATOM 392 OE2 GLU A 23 65.918 -6.946 2.866 1.00 15.00 O ATOM 0 H GLU A 23 65.923 -5.344 -1.843 1.00 15.00 H new ATOM 0 HA GLU A 23 64.040 -3.696 -0.119 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.338 -6.249 0.292 1.00 15.00 H new ATOM 0 HB3 GLU A 23 66.033 -5.924 0.594 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.338 -4.252 2.387 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.671 -4.731 2.135 1.00 15.00 H new ATOM 399 N GLY A 24 65.856 -2.223 0.705 1.00 15.00 N ATOM 400 CA GLY A 24 66.930 -1.235 1.018 1.00 15.00 C ATOM 401 C GLY A 24 66.432 -0.291 2.110 1.00 15.00 C ATOM 402 O GLY A 24 65.325 -0.431 2.595 1.00 15.00 O ATOM 0 H GLY A 24 64.933 -1.982 1.066 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.832 -1.751 1.348 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.195 -0.671 0.124 1.00 15.00 H new ATOM 406 N ILE A 25 67.235 0.668 2.507 1.00 15.00 N ATOM 407 CA ILE A 25 66.792 1.619 3.575 1.00 15.00 C ATOM 408 C ILE A 25 66.519 2.996 2.965 1.00 15.00 C ATOM 409 O ILE A 25 67.214 3.433 2.065 1.00 15.00 O ATOM 410 CB ILE A 25 67.944 1.699 4.591 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.420 0.288 5.002 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.464 2.456 5.836 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.262 -0.525 5.599 1.00 15.00 C ATOM 0 H ILE A 25 68.172 0.832 2.140 1.00 15.00 H new ATOM 0 HA ILE A 25 65.872 1.283 4.054 1.00 15.00 H new ATOM 0 HB ILE A 25 68.780 2.223 4.128 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.825 -0.231 4.134 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.227 0.369 5.730 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.276 2.516 6.561 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.154 3.462 5.553 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.620 1.928 6.280 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.620 -1.515 5.881 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.875 -0.014 6.481 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.468 -0.624 4.859 1.00 15.00 H new ATOM 425 N LEU A 26 65.511 3.678 3.451 1.00 15.00 N ATOM 426 CA LEU A 26 65.154 5.020 2.885 1.00 15.00 C ATOM 427 C LEU A 26 66.278 6.023 3.154 1.00 15.00 C ATOM 428 O LEU A 26 66.486 6.437 4.277 1.00 15.00 O ATOM 429 CB LEU A 26 63.878 5.439 3.622 1.00 15.00 C ATOM 430 CG LEU A 26 63.253 6.654 2.932 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.671 6.236 1.581 1.00 15.00 C ATOM 432 CD2 LEU A 26 62.136 7.216 3.815 1.00 15.00 C ATOM 0 H LEU A 26 64.917 3.363 4.218 1.00 15.00 H new ATOM 0 HA LEU A 26 65.008 4.984 1.805 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.168 4.612 3.636 1.00 15.00 H new ATOM 0 HB3 LEU A 26 64.109 5.678 4.660 1.00 15.00 H new ATOM 0 HG LEU A 26 64.017 7.416 2.775 1.00 15.00 H new ATOM 0 HD11 LEU A 26 62.227 7.103 1.092 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.464 5.832 0.952 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.906 5.475 1.734 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.688 8.082 3.328 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.374 6.452 3.969 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.549 7.515 4.778 1.00 15.00 H new ATOM 444 N TYR A 27 66.998 6.413 2.129 1.00 15.00 N ATOM 445 CA TYR A 27 68.150 7.345 2.326 1.00 15.00 C ATOM 446 C TYR A 27 67.700 8.798 2.143 1.00 15.00 C ATOM 447 O TYR A 27 67.940 9.638 2.992 1.00 15.00 O ATOM 448 CB TYR A 27 69.165 6.959 1.250 1.00 15.00 C ATOM 449 CG TYR A 27 70.465 7.721 1.352 1.00 15.00 C ATOM 450 CD1 TYR A 27 71.296 7.552 2.485 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.851 8.605 0.315 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.513 8.268 2.584 1.00 15.00 C ATOM 453 CE2 TYR A 27 72.069 9.321 0.414 1.00 15.00 C ATOM 454 CZ TYR A 27 72.901 9.153 1.549 1.00 15.00 C ATOM 455 OH TYR A 27 74.087 9.850 1.644 1.00 15.00 O ATOM 0 H TYR A 27 66.836 6.125 1.164 1.00 15.00 H new ATOM 0 HA TYR A 27 68.570 7.269 3.329 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.372 5.891 1.322 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.726 7.133 0.268 1.00 15.00 H new ATOM 0 HD1 TYR A 27 71.001 6.876 3.274 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.217 8.733 -0.550 1.00 15.00 H new ATOM 0 HE1 TYR A 27 73.146 8.139 3.449 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.364 9.996 -0.376 1.00 15.00 H new ATOM 0 HH TYR A 27 74.201 10.411 0.849 1.00 15.00 H new ATOM 465 N THR A 28 67.051 9.097 1.044 1.00 15.00 N ATOM 466 CA THR A 28 66.585 10.497 0.799 1.00 15.00 C ATOM 467 C THR A 28 65.230 10.492 0.088 1.00 15.00 C ATOM 468 O THR A 28 64.970 9.660 -0.761 1.00 15.00 O ATOM 469 CB THR A 28 67.658 11.131 -0.091 1.00 15.00 C ATOM 470 OG1 THR A 28 67.981 10.241 -1.150 1.00 15.00 O ATOM 471 CG2 THR A 28 68.910 11.417 0.739 1.00 15.00 C ATOM 0 H THR A 28 66.824 8.431 0.306 1.00 15.00 H new ATOM 0 HA THR A 28 66.451 11.051 1.728 1.00 15.00 H new ATOM 0 HB THR A 28 67.280 12.065 -0.505 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.543 10.704 -1.806 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.672 11.868 0.104 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.661 12.102 1.549 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.291 10.485 1.156 1.00 15.00 H new ATOM 479 N ILE A 29 64.370 11.421 0.431 1.00 15.00 N ATOM 480 CA ILE A 29 63.003 11.456 -0.179 1.00 15.00 C ATOM 481 C ILE A 29 62.829 12.752 -0.982 1.00 15.00 C ATOM 482 O ILE A 29 63.014 13.837 -0.463 1.00 15.00 O ATOM 483 CB ILE A 29 62.025 11.423 1.009 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.266 10.171 1.865 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.583 11.397 0.492 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.535 10.319 3.204 1.00 15.00 C ATOM 0 H ILE A 29 64.557 12.159 1.110 1.00 15.00 H new ATOM 0 HA ILE A 29 62.832 10.624 -0.862 1.00 15.00 H new ATOM 0 HB ILE A 29 62.189 12.314 1.615 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.910 9.285 1.340 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.334 10.033 2.035 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.894 11.374 1.336 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.395 12.289 -0.106 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.433 10.510 -0.123 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.706 9.431 3.812 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.912 11.196 3.729 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.466 10.436 3.024 1.00 15.00 H new ATOM 498 N ASP A 30 62.474 12.644 -2.241 1.00 15.00 N ATOM 499 CA ASP A 30 62.225 13.866 -3.065 1.00 15.00 C ATOM 500 C ASP A 30 60.738 13.960 -3.416 1.00 15.00 C ATOM 501 O ASP A 30 60.275 13.338 -4.354 1.00 15.00 O ATOM 502 CB ASP A 30 63.066 13.673 -4.327 1.00 15.00 C ATOM 503 CG ASP A 30 63.083 14.973 -5.133 1.00 15.00 C ATOM 504 OD1 ASP A 30 62.193 15.155 -5.946 1.00 15.00 O ATOM 505 OD2 ASP A 30 63.989 15.764 -4.923 1.00 15.00 O ATOM 0 H ASP A 30 62.346 11.759 -2.733 1.00 15.00 H new ATOM 0 HA ASP A 30 62.490 14.784 -2.541 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.083 13.386 -4.059 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.655 12.864 -4.931 1.00 15.00 H new ATOM 510 N THR A 31 59.990 14.733 -2.666 1.00 15.00 N ATOM 511 CA THR A 31 58.512 14.815 -2.900 1.00 15.00 C ATOM 512 C THR A 31 58.216 15.576 -4.194 1.00 15.00 C ATOM 513 O THR A 31 57.300 15.244 -4.920 1.00 15.00 O ATOM 514 CB THR A 31 57.950 15.573 -1.692 1.00 15.00 C ATOM 515 OG1 THR A 31 58.440 14.983 -0.496 1.00 15.00 O ATOM 516 CG2 THR A 31 56.423 15.504 -1.708 1.00 15.00 C ATOM 0 H THR A 31 60.338 15.311 -1.901 1.00 15.00 H new ATOM 0 HA THR A 31 58.063 13.827 -3.004 1.00 15.00 H new ATOM 0 HB THR A 31 58.264 16.616 -1.739 1.00 15.00 H new ATOM 0 HG1 THR A 31 58.083 15.467 0.278 1.00 15.00 H new ATOM 0 HG21 THR A 31 56.025 16.043 -0.848 1.00 15.00 H new ATOM 0 HG22 THR A 31 56.048 15.957 -2.626 1.00 15.00 H new ATOM 0 HG23 THR A 31 56.105 14.462 -1.661 1.00 15.00 H new ATOM 524 N GLU A 32 58.994 16.589 -4.493 1.00 15.00 N ATOM 525 CA GLU A 32 58.657 17.503 -5.638 1.00 15.00 C ATOM 526 C GLU A 32 58.564 16.723 -6.957 1.00 15.00 C ATOM 527 O GLU A 32 57.823 17.093 -7.849 1.00 15.00 O ATOM 528 CB GLU A 32 59.805 18.515 -5.701 1.00 15.00 C ATOM 529 CG GLU A 32 59.432 19.654 -6.653 1.00 15.00 C ATOM 530 CD GLU A 32 58.370 20.545 -6.003 1.00 15.00 C ATOM 531 OE1 GLU A 32 57.463 20.960 -6.706 1.00 15.00 O ATOM 532 OE2 GLU A 32 58.483 20.802 -4.815 1.00 15.00 O ATOM 0 H GLU A 32 59.851 16.825 -3.993 1.00 15.00 H new ATOM 0 HA GLU A 32 57.690 17.985 -5.491 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.010 18.911 -4.706 1.00 15.00 H new ATOM 0 HB3 GLU A 32 60.717 18.025 -6.043 1.00 15.00 H new ATOM 0 HG2 GLU A 32 60.317 20.243 -6.894 1.00 15.00 H new ATOM 0 HG3 GLU A 32 59.054 19.247 -7.591 1.00 15.00 H new ATOM 539 N ASN A 33 59.308 15.651 -7.083 1.00 15.00 N ATOM 540 CA ASN A 33 59.318 14.884 -8.371 1.00 15.00 C ATOM 541 C ASN A 33 58.754 13.465 -8.188 1.00 15.00 C ATOM 542 O ASN A 33 58.912 12.621 -9.051 1.00 15.00 O ATOM 543 CB ASN A 33 60.791 14.819 -8.779 1.00 15.00 C ATOM 544 CG ASN A 33 61.298 16.223 -9.126 1.00 15.00 C ATOM 545 OD1 ASN A 33 60.545 17.061 -9.586 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.554 16.517 -8.927 1.00 15.00 N ATOM 0 H ASN A 33 59.909 15.273 -6.351 1.00 15.00 H new ATOM 0 HA ASN A 33 58.694 15.364 -9.124 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.384 14.399 -7.967 1.00 15.00 H new ATOM 0 HB3 ASN A 33 60.911 14.157 -9.637 1.00 15.00 H new ATOM 0 HD21 ASN A 33 62.903 17.448 -9.157 1.00 15.00 H new ATOM 0 HD22 ASN A 33 63.187 15.816 -8.542 1.00 15.00 H new ATOM 553 N SER A 34 58.095 13.191 -7.077 1.00 15.00 N ATOM 554 CA SER A 34 57.583 11.802 -6.796 1.00 15.00 C ATOM 555 C SER A 34 58.688 10.748 -6.997 1.00 15.00 C ATOM 556 O SER A 34 58.491 9.743 -7.658 1.00 15.00 O ATOM 557 CB SER A 34 56.438 11.587 -7.793 1.00 15.00 C ATOM 558 OG SER A 34 55.495 10.679 -7.236 1.00 15.00 O ATOM 0 H SER A 34 57.889 13.875 -6.349 1.00 15.00 H new ATOM 0 HA SER A 34 57.251 11.698 -5.763 1.00 15.00 H new ATOM 0 HB2 SER A 34 55.955 12.537 -8.020 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.827 11.195 -8.732 1.00 15.00 H new ATOM 0 HG SER A 34 54.761 10.540 -7.870 1.00 15.00 H new ATOM 564 N THR A 35 59.848 10.977 -6.427 1.00 15.00 N ATOM 565 CA THR A 35 60.985 10.021 -6.610 1.00 15.00 C ATOM 566 C THR A 35 61.628 9.688 -5.260 1.00 15.00 C ATOM 567 O THR A 35 61.658 10.504 -4.358 1.00 15.00 O ATOM 568 CB THR A 35 61.983 10.754 -7.513 1.00 15.00 C ATOM 569 OG1 THR A 35 62.193 12.067 -7.015 1.00 15.00 O ATOM 570 CG2 THR A 35 61.439 10.832 -8.943 1.00 15.00 C ATOM 0 H THR A 35 60.056 11.786 -5.842 1.00 15.00 H new ATOM 0 HA THR A 35 60.658 9.076 -7.045 1.00 15.00 H new ATOM 0 HB THR A 35 62.926 10.208 -7.520 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.832 12.537 -7.590 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.155 11.355 -9.577 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.281 9.824 -9.328 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.492 11.373 -8.943 1.00 15.00 H new ATOM 578 N VAL A 36 62.143 8.491 -5.122 1.00 15.00 N ATOM 579 CA VAL A 36 62.778 8.082 -3.831 1.00 15.00 C ATOM 580 C VAL A 36 64.149 7.452 -4.107 1.00 15.00 C ATOM 581 O VAL A 36 64.310 6.693 -5.046 1.00 15.00 O ATOM 582 CB VAL A 36 61.815 7.053 -3.214 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.365 6.559 -1.874 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.446 7.701 -2.981 1.00 15.00 C ATOM 0 H VAL A 36 62.151 7.777 -5.851 1.00 15.00 H new ATOM 0 HA VAL A 36 62.942 8.925 -3.160 1.00 15.00 H new ATOM 0 HB VAL A 36 61.714 6.212 -3.900 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.677 5.831 -1.444 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.337 6.091 -2.030 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.473 7.402 -1.192 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.767 6.969 -2.544 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.555 8.546 -2.302 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.042 8.049 -3.932 1.00 15.00 H new ATOM 594 N ALA A 37 65.130 7.765 -3.297 1.00 15.00 N ATOM 595 CA ALA A 37 66.481 7.146 -3.471 1.00 15.00 C ATOM 596 C ALA A 37 66.786 6.220 -2.291 1.00 15.00 C ATOM 597 O ALA A 37 66.666 6.611 -1.143 1.00 15.00 O ATOM 598 CB ALA A 37 67.468 8.321 -3.507 1.00 15.00 C ATOM 0 H ALA A 37 65.054 8.423 -2.522 1.00 15.00 H new ATOM 0 HA ALA A 37 66.545 6.544 -4.377 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.482 7.941 -3.633 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.221 8.978 -4.341 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.403 8.879 -2.573 1.00 15.00 H new ATOM 604 N LEU A 38 67.181 5.001 -2.570 1.00 15.00 N ATOM 605 CA LEU A 38 67.460 4.022 -1.475 1.00 15.00 C ATOM 606 C LEU A 38 68.935 3.621 -1.500 1.00 15.00 C ATOM 607 O LEU A 38 69.504 3.398 -2.553 1.00 15.00 O ATOM 608 CB LEU A 38 66.579 2.803 -1.778 1.00 15.00 C ATOM 609 CG LEU A 38 65.095 3.191 -1.746 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.249 1.987 -2.168 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.698 3.612 -0.328 1.00 15.00 C ATOM 0 H LEU A 38 67.322 4.642 -3.514 1.00 15.00 H new ATOM 0 HA LEU A 38 67.248 4.440 -0.491 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.834 2.397 -2.757 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.771 2.017 -1.047 1.00 15.00 H new ATOM 0 HG LEU A 38 64.926 4.022 -2.430 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.194 2.258 -2.147 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.525 1.684 -3.178 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.425 1.160 -1.480 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.643 3.886 -0.312 1.00 15.00 H new ATOM 0 HD22 LEU A 38 64.868 2.783 0.359 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.300 4.467 -0.020 1.00 15.00 H new ATOM 623 N ALA A 39 69.553 3.529 -0.349 1.00 15.00 N ATOM 624 CA ALA A 39 70.987 3.115 -0.291 1.00 15.00 C ATOM 625 C ALA A 39 71.110 1.773 0.434 1.00 15.00 C ATOM 626 O ALA A 39 70.182 1.329 1.088 1.00 15.00 O ATOM 627 CB ALA A 39 71.690 4.219 0.499 1.00 15.00 C ATOM 0 H ALA A 39 69.124 3.724 0.556 1.00 15.00 H new ATOM 0 HA ALA A 39 71.424 2.988 -1.281 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.751 3.986 0.585 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.568 5.171 -0.018 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.252 4.289 1.495 1.00 15.00 H new ATOM 633 N LYS A 40 72.250 1.122 0.320 1.00 15.00 N ATOM 634 CA LYS A 40 72.444 -0.230 0.952 1.00 15.00 C ATOM 635 C LYS A 40 71.302 -1.178 0.552 1.00 15.00 C ATOM 636 O LYS A 40 70.603 -1.720 1.390 1.00 15.00 O ATOM 637 CB LYS A 40 72.448 0.020 2.467 1.00 15.00 C ATOM 638 CG LYS A 40 73.673 0.855 2.845 1.00 15.00 C ATOM 639 CD LYS A 40 73.734 1.014 4.366 1.00 15.00 C ATOM 640 CE LYS A 40 74.879 1.960 4.736 1.00 15.00 C ATOM 641 NZ LYS A 40 76.112 1.131 4.625 1.00 15.00 N ATOM 0 H LYS A 40 73.061 1.473 -0.189 1.00 15.00 H new ATOM 0 HA LYS A 40 73.370 -0.703 0.626 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.536 0.539 2.763 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.463 -0.929 3.003 1.00 15.00 H new ATOM 0 HG2 LYS A 40 74.581 0.373 2.483 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.620 1.834 2.368 1.00 15.00 H new ATOM 0 HD2 LYS A 40 72.788 1.407 4.739 1.00 15.00 H new ATOM 0 HD3 LYS A 40 73.884 0.043 4.838 1.00 15.00 H new ATOM 0 HE2 LYS A 40 74.917 2.817 4.063 1.00 15.00 H new ATOM 0 HE3 LYS A 40 74.757 2.353 5.745 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 76.611 1.127 5.538 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 75.854 0.157 4.367 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 76.733 1.530 3.893 1.00 15.00 H new ATOM 655 N VAL A 41 71.115 -1.378 -0.731 1.00 15.00 N ATOM 656 CA VAL A 41 69.940 -2.166 -1.213 1.00 15.00 C ATOM 657 C VAL A 41 70.411 -3.381 -2.025 1.00 15.00 C ATOM 658 O VAL A 41 71.437 -3.340 -2.679 1.00 15.00 O ATOM 659 CB VAL A 41 69.129 -1.183 -2.080 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.934 -0.762 -3.315 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.823 -1.847 -2.529 1.00 15.00 C ATOM 0 H VAL A 41 71.729 -1.027 -1.466 1.00 15.00 H new ATOM 0 HA VAL A 41 69.338 -2.563 -0.396 1.00 15.00 H new ATOM 0 HB VAL A 41 68.908 -0.298 -1.484 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.345 -0.068 -3.914 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.857 -0.275 -2.999 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.174 -1.643 -3.911 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.252 -1.149 -3.142 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.050 -2.740 -3.112 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.236 -2.125 -1.653 1.00 15.00 H new ATOM 671 N ARG A 42 69.665 -4.455 -1.982 1.00 15.00 N ATOM 672 CA ARG A 42 70.032 -5.669 -2.772 1.00 15.00 C ATOM 673 C ARG A 42 68.774 -6.315 -3.365 1.00 15.00 C ATOM 674 O ARG A 42 67.692 -6.194 -2.819 1.00 15.00 O ATOM 675 CB ARG A 42 70.727 -6.614 -1.777 1.00 15.00 C ATOM 676 CG ARG A 42 69.784 -6.970 -0.618 1.00 15.00 C ATOM 677 CD ARG A 42 70.586 -7.631 0.506 1.00 15.00 C ATOM 678 NE ARG A 42 69.566 -8.047 1.519 1.00 15.00 N ATOM 679 CZ ARG A 42 68.807 -9.112 1.340 1.00 15.00 C ATOM 680 NH1 ARG A 42 68.894 -9.846 0.254 1.00 15.00 N ATOM 681 NH2 ARG A 42 67.944 -9.441 2.262 1.00 15.00 N ATOM 0 H ARG A 42 68.812 -4.544 -1.430 1.00 15.00 H new ATOM 0 HA ARG A 42 70.686 -5.432 -3.611 1.00 15.00 H new ATOM 0 HB2 ARG A 42 71.041 -7.523 -2.290 1.00 15.00 H new ATOM 0 HB3 ARG A 42 71.628 -6.141 -1.387 1.00 15.00 H new ATOM 0 HG2 ARG A 42 69.290 -6.072 -0.247 1.00 15.00 H new ATOM 0 HG3 ARG A 42 69.001 -7.644 -0.966 1.00 15.00 H new ATOM 0 HD2 ARG A 42 71.148 -8.489 0.137 1.00 15.00 H new ATOM 0 HD3 ARG A 42 71.308 -6.937 0.936 1.00 15.00 H new ATOM 0 HE ARG A 42 69.455 -7.494 2.369 1.00 15.00 H new ATOM 0 HH11 ARG A 42 69.561 -9.598 -0.477 1.00 15.00 H new ATOM 0 HH12 ARG A 42 68.295 -10.664 0.142 1.00 15.00 H new ATOM 0 HH21 ARG A 42 67.862 -8.878 3.108 1.00 15.00 H new ATOM 0 HH22 ARG A 42 67.351 -10.262 2.136 1.00 15.00 H new ATOM 695 N SER A 43 68.914 -6.996 -4.475 1.00 15.00 N ATOM 696 CA SER A 43 67.737 -7.663 -5.110 1.00 15.00 C ATOM 697 C SER A 43 67.699 -9.142 -4.708 1.00 15.00 C ATOM 698 O SER A 43 68.693 -9.839 -4.793 1.00 15.00 O ATOM 699 CB SER A 43 67.962 -7.501 -6.617 1.00 15.00 C ATOM 700 OG SER A 43 68.949 -8.427 -7.057 1.00 15.00 O ATOM 0 H SER A 43 69.797 -7.119 -4.970 1.00 15.00 H new ATOM 0 HA SER A 43 66.785 -7.231 -4.800 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.028 -7.668 -7.154 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.280 -6.482 -6.840 1.00 15.00 H new ATOM 0 HG SER A 43 69.195 -9.020 -6.316 1.00 15.00 H new ATOM 706 N PHE A 44 66.558 -9.622 -4.272 1.00 15.00 N ATOM 707 CA PHE A 44 66.484 -11.019 -3.736 1.00 15.00 C ATOM 708 C PHE A 44 66.636 -12.037 -4.871 1.00 15.00 C ATOM 709 O PHE A 44 67.295 -13.049 -4.718 1.00 15.00 O ATOM 710 CB PHE A 44 65.098 -11.137 -3.093 1.00 15.00 C ATOM 711 CG PHE A 44 65.076 -10.748 -1.633 1.00 15.00 C ATOM 712 CD1 PHE A 44 64.871 -11.737 -0.641 1.00 15.00 C ATOM 713 CD2 PHE A 44 65.261 -9.396 -1.258 1.00 15.00 C ATOM 714 CE1 PHE A 44 64.851 -11.373 0.727 1.00 15.00 C ATOM 715 CE2 PHE A 44 65.241 -9.031 0.111 1.00 15.00 C ATOM 716 CZ PHE A 44 65.036 -10.021 1.104 1.00 15.00 C ATOM 0 H PHE A 44 65.677 -9.108 -4.264 1.00 15.00 H new ATOM 0 HA PHE A 44 67.281 -11.220 -3.020 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.398 -10.506 -3.640 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.746 -12.164 -3.193 1.00 15.00 H new ATOM 0 HD1 PHE A 44 64.730 -12.769 -0.928 1.00 15.00 H new ATOM 0 HD2 PHE A 44 65.417 -8.642 -2.015 1.00 15.00 H new ATOM 0 HE1 PHE A 44 64.694 -12.127 1.484 1.00 15.00 H new ATOM 0 HE2 PHE A 44 65.382 -7.999 0.397 1.00 15.00 H new ATOM 0 HZ PHE A 44 65.021 -9.744 2.148 1.00 15.00 H new ATOM 984 N PHE A 62 74.261 -2.882 -3.932 1.00 15.00 N ATOM 985 CA PHE A 62 74.333 -1.562 -4.628 1.00 15.00 C ATOM 986 C PHE A 62 74.331 -0.425 -3.602 1.00 15.00 C ATOM 987 O PHE A 62 73.482 -0.369 -2.731 1.00 15.00 O ATOM 988 CB PHE A 62 73.077 -1.507 -5.495 1.00 15.00 C ATOM 989 CG PHE A 62 73.071 -2.524 -6.612 1.00 15.00 C ATOM 990 CD1 PHE A 62 73.831 -2.293 -7.784 1.00 15.00 C ATOM 991 CD2 PHE A 62 72.304 -3.708 -6.486 1.00 15.00 C ATOM 992 CE1 PHE A 62 73.825 -3.246 -8.831 1.00 15.00 C ATOM 993 CE2 PHE A 62 72.298 -4.662 -7.533 1.00 15.00 C ATOM 994 CZ PHE A 62 73.059 -4.432 -8.705 1.00 15.00 C ATOM 0 HA PHE A 62 75.242 -1.452 -5.220 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.202 -1.667 -4.864 1.00 15.00 H new ATOM 0 HB3 PHE A 62 72.984 -0.509 -5.923 1.00 15.00 H new ATOM 0 HD1 PHE A 62 74.415 -1.390 -7.879 1.00 15.00 H new ATOM 0 HD2 PHE A 62 71.724 -3.883 -5.592 1.00 15.00 H new ATOM 0 HE1 PHE A 62 74.404 -3.069 -9.725 1.00 15.00 H new ATOM 0 HE2 PHE A 62 71.713 -5.565 -7.438 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.056 -5.160 -9.503 1.00 15.00 H new ATOM 1004 N GLU A 63 75.277 0.476 -3.705 1.00 15.00 N ATOM 1005 CA GLU A 63 75.372 1.595 -2.713 1.00 15.00 C ATOM 1006 C GLU A 63 74.185 2.554 -2.863 1.00 15.00 C ATOM 1007 O GLU A 63 73.621 3.004 -1.882 1.00 15.00 O ATOM 1008 CB GLU A 63 76.683 2.317 -3.036 1.00 15.00 C ATOM 1009 CG GLU A 63 77.865 1.397 -2.718 1.00 15.00 C ATOM 1010 CD GLU A 63 79.178 2.156 -2.924 1.00 15.00 C ATOM 1011 OE1 GLU A 63 80.058 2.013 -2.092 1.00 15.00 O ATOM 1012 OE2 GLU A 63 79.283 2.866 -3.910 1.00 15.00 O ATOM 0 H GLU A 63 75.990 0.486 -4.435 1.00 15.00 H new ATOM 0 HA GLU A 63 75.352 1.225 -1.688 1.00 15.00 H new ATOM 0 HB2 GLU A 63 76.704 2.603 -4.088 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.757 3.236 -2.455 1.00 15.00 H new ATOM 0 HG2 GLU A 63 77.796 1.042 -1.690 1.00 15.00 H new ATOM 0 HG3 GLU A 63 77.837 0.517 -3.361 1.00 15.00 H new ATOM 1019 N TYR A 64 73.805 2.868 -4.079 1.00 15.00 N ATOM 1020 CA TYR A 64 72.703 3.857 -4.292 1.00 15.00 C ATOM 1021 C TYR A 64 71.955 3.558 -5.596 1.00 15.00 C ATOM 1022 O TYR A 64 72.540 3.531 -6.664 1.00 15.00 O ATOM 1023 CB TYR A 64 73.411 5.209 -4.381 1.00 15.00 C ATOM 1024 CG TYR A 64 72.486 6.394 -4.220 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.490 6.656 -5.194 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.619 7.248 -3.099 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.630 7.770 -5.044 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.757 8.362 -2.950 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.764 8.623 -3.922 1.00 15.00 C ATOM 1030 OH TYR A 64 69.924 9.709 -3.778 1.00 15.00 O ATOM 0 H TYR A 64 74.211 2.482 -4.932 1.00 15.00 H new ATOM 0 HA TYR A 64 71.962 3.828 -3.494 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.183 5.256 -3.613 1.00 15.00 H new ATOM 0 HB3 TYR A 64 73.915 5.282 -5.345 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.387 6.006 -6.050 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.378 7.050 -2.357 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.871 7.970 -5.786 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.858 9.012 -2.094 1.00 15.00 H new ATOM 0 HH TYR A 64 70.149 10.189 -2.954 1.00 15.00 H new ATOM 1040 N ILE A 65 70.665 3.333 -5.511 1.00 15.00 N ATOM 1041 CA ILE A 65 69.834 3.179 -6.749 1.00 15.00 C ATOM 1042 C ILE A 65 68.588 4.071 -6.644 1.00 15.00 C ATOM 1043 O ILE A 65 68.057 4.284 -5.568 1.00 15.00 O ATOM 1044 CB ILE A 65 69.452 1.687 -6.813 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.731 0.840 -6.926 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.565 1.422 -8.040 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.394 -0.651 -6.787 1.00 15.00 C ATOM 0 H ILE A 65 70.150 3.249 -4.635 1.00 15.00 H new ATOM 0 HA ILE A 65 70.368 3.480 -7.651 1.00 15.00 H new ATOM 0 HB ILE A 65 68.905 1.420 -5.909 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.213 1.023 -7.886 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.440 1.134 -6.152 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.301 0.365 -8.076 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.657 2.021 -7.969 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.107 1.692 -8.946 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.308 -1.240 -6.869 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.932 -0.831 -5.816 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.702 -0.943 -7.577 1.00 15.00 H new ATOM 1059 N ILE A 66 68.122 4.589 -7.757 1.00 15.00 N ATOM 1060 CA ILE A 66 66.951 5.521 -7.732 1.00 15.00 C ATOM 1061 C ILE A 66 65.725 4.840 -8.355 1.00 15.00 C ATOM 1062 O ILE A 66 65.829 4.148 -9.352 1.00 15.00 O ATOM 1063 CB ILE A 66 67.383 6.737 -8.571 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.606 7.401 -7.931 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.243 7.761 -8.636 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.240 8.373 -8.929 1.00 15.00 C ATOM 0 H ILE A 66 68.505 4.405 -8.684 1.00 15.00 H new ATOM 0 HA ILE A 66 66.674 5.811 -6.718 1.00 15.00 H new ATOM 0 HB ILE A 66 67.629 6.397 -9.577 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.312 7.933 -7.026 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.331 6.643 -7.635 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.557 8.618 -9.232 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.367 7.302 -9.095 1.00 15.00 H new ATOM 0 HG23 ILE A 66 65.993 8.092 -7.628 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.110 8.846 -8.474 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.548 7.829 -9.822 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.514 9.138 -9.203 1.00 15.00 H new ATOM 1078 N PHE A 67 64.568 5.033 -7.767 1.00 15.00 N ATOM 1079 CA PHE A 67 63.310 4.495 -8.366 1.00 15.00 C ATOM 1080 C PHE A 67 62.238 5.587 -8.397 1.00 15.00 C ATOM 1081 O PHE A 67 62.140 6.392 -7.489 1.00 15.00 O ATOM 1082 CB PHE A 67 62.886 3.352 -7.443 1.00 15.00 C ATOM 1083 CG PHE A 67 63.833 2.175 -7.466 1.00 15.00 C ATOM 1084 CD1 PHE A 67 63.902 1.346 -8.611 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.650 1.902 -6.343 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.789 0.242 -8.634 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.538 0.798 -6.365 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.607 -0.033 -7.510 1.00 15.00 C ATOM 0 H PHE A 67 64.443 5.543 -6.893 1.00 15.00 H new ATOM 0 HA PHE A 67 63.451 4.155 -9.392 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.812 3.728 -6.423 1.00 15.00 H new ATOM 0 HB3 PHE A 67 61.891 3.013 -7.731 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.278 1.555 -9.467 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.597 2.535 -5.470 1.00 15.00 H new ATOM 0 HE1 PHE A 67 64.842 -0.390 -9.508 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.162 0.590 -5.509 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.282 -0.876 -7.526 1.00 15.00 H new ATOM 1098 N ARG A 68 61.438 5.621 -9.435 1.00 15.00 N ATOM 1099 CA ARG A 68 60.372 6.666 -9.536 1.00 15.00 C ATOM 1100 C ARG A 68 58.992 6.025 -9.383 1.00 15.00 C ATOM 1101 O ARG A 68 58.800 4.865 -9.694 1.00 15.00 O ATOM 1102 CB ARG A 68 60.532 7.270 -10.934 1.00 15.00 C ATOM 1103 CG ARG A 68 61.880 7.989 -11.035 1.00 15.00 C ATOM 1104 CD ARG A 68 61.958 8.747 -12.365 1.00 15.00 C ATOM 1105 NE ARG A 68 63.373 9.235 -12.461 1.00 15.00 N ATOM 1106 CZ ARG A 68 63.714 10.190 -13.305 1.00 15.00 C ATOM 1107 NH1 ARG A 68 62.836 10.752 -14.103 1.00 15.00 N ATOM 1108 NH2 ARG A 68 64.957 10.584 -13.349 1.00 15.00 N ATOM 0 H ARG A 68 61.478 4.969 -10.218 1.00 15.00 H new ATOM 0 HA ARG A 68 60.461 7.422 -8.756 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.470 6.486 -11.689 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.720 7.969 -11.133 1.00 15.00 H new ATOM 0 HG2 ARG A 68 61.998 8.682 -10.202 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.695 7.268 -10.967 1.00 15.00 H new ATOM 0 HD2 ARG A 68 61.709 8.097 -13.203 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.253 9.578 -12.386 1.00 15.00 H new ATOM 0 HE ARG A 68 64.086 8.820 -11.861 1.00 15.00 H new ATOM 0 HH11 ARG A 68 61.861 10.452 -14.081 1.00 15.00 H new ATOM 0 HH12 ARG A 68 63.129 11.488 -14.745 1.00 15.00 H new ATOM 0 HH21 ARG A 68 65.650 10.155 -12.736 1.00 15.00 H new ATOM 0 HH22 ARG A 68 65.236 11.321 -13.996 1.00 15.00 H new ATOM 1122 N GLY A 69 58.026 6.775 -8.906 1.00 15.00 N ATOM 1123 CA GLY A 69 56.650 6.215 -8.698 1.00 15.00 C ATOM 1124 C GLY A 69 56.092 5.644 -10.012 1.00 15.00 C ATOM 1125 O GLY A 69 55.255 4.760 -10.001 1.00 15.00 O ATOM 0 H GLY A 69 58.132 7.757 -8.650 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.681 5.433 -7.940 1.00 15.00 H new ATOM 0 HA3 GLY A 69 55.987 6.995 -8.324 1.00 15.00 H new ATOM 1129 N SER A 70 56.548 6.142 -11.139 1.00 15.00 N ATOM 1130 CA SER A 70 56.006 5.664 -12.453 1.00 15.00 C ATOM 1131 C SER A 70 56.397 4.202 -12.704 1.00 15.00 C ATOM 1132 O SER A 70 55.600 3.418 -13.186 1.00 15.00 O ATOM 1133 CB SER A 70 56.639 6.572 -13.508 1.00 15.00 C ATOM 1134 OG SER A 70 58.037 6.320 -13.568 1.00 15.00 O ATOM 0 H SER A 70 57.271 6.858 -11.205 1.00 15.00 H new ATOM 0 HA SER A 70 54.917 5.707 -12.477 1.00 15.00 H new ATOM 0 HB2 SER A 70 56.183 6.390 -14.481 1.00 15.00 H new ATOM 0 HB3 SER A 70 56.457 7.618 -13.261 1.00 15.00 H new ATOM 0 HG SER A 70 58.445 6.900 -14.245 1.00 15.00 H new ATOM 1140 N ASP A 71 57.614 3.833 -12.379 1.00 15.00 N ATOM 1141 CA ASP A 71 58.083 2.440 -12.674 1.00 15.00 C ATOM 1142 C ASP A 71 57.743 1.493 -11.514 1.00 15.00 C ATOM 1143 O ASP A 71 57.508 0.316 -11.718 1.00 15.00 O ATOM 1144 CB ASP A 71 59.605 2.550 -12.875 1.00 15.00 C ATOM 1145 CG ASP A 71 60.285 3.042 -11.590 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.616 4.213 -11.531 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.463 2.236 -10.693 1.00 15.00 O ATOM 0 H ASP A 71 58.301 4.434 -11.924 1.00 15.00 H new ATOM 0 HA ASP A 71 57.595 2.027 -13.557 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.011 1.579 -13.159 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.821 3.237 -13.693 1.00 15.00 H new ATOM 1152 N ILE A 72 57.718 1.999 -10.304 1.00 15.00 N ATOM 1153 CA ILE A 72 57.407 1.127 -9.121 1.00 15.00 C ATOM 1154 C ILE A 72 55.967 0.604 -9.221 1.00 15.00 C ATOM 1155 O ILE A 72 55.071 1.307 -9.653 1.00 15.00 O ATOM 1156 CB ILE A 72 57.574 2.027 -7.882 1.00 15.00 C ATOM 1157 CG1 ILE A 72 59.020 2.528 -7.794 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.247 1.232 -6.611 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.089 3.723 -6.843 1.00 15.00 C ATOM 0 H ILE A 72 57.899 2.978 -10.082 1.00 15.00 H new ATOM 0 HA ILE A 72 58.063 0.258 -9.070 1.00 15.00 H new ATOM 0 HB ILE A 72 56.894 2.875 -7.971 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.672 1.729 -7.439 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.377 2.816 -8.783 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.367 1.875 -5.739 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.218 0.875 -6.660 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.923 0.381 -6.530 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.117 4.079 -6.780 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.450 4.523 -7.217 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.749 3.420 -5.853 1.00 15.00 H new ATOM 1171 N LYS A 73 55.747 -0.626 -8.825 1.00 15.00 N ATOM 1172 CA LYS A 73 54.372 -1.206 -8.879 1.00 15.00 C ATOM 1173 C LYS A 73 53.721 -1.157 -7.494 1.00 15.00 C ATOM 1174 O LYS A 73 52.566 -0.797 -7.358 1.00 15.00 O ATOM 1175 CB LYS A 73 54.572 -2.655 -9.329 1.00 15.00 C ATOM 1176 CG LYS A 73 53.214 -3.283 -9.650 1.00 15.00 C ATOM 1177 CD LYS A 73 53.406 -4.751 -10.033 1.00 15.00 C ATOM 1178 CE LYS A 73 52.063 -5.352 -10.453 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.908 -4.981 -11.887 1.00 15.00 N ATOM 0 H LYS A 73 56.465 -1.255 -8.465 1.00 15.00 H new ATOM 0 HA LYS A 73 53.717 -0.656 -9.555 1.00 15.00 H new ATOM 0 HB2 LYS A 73 55.216 -2.688 -10.207 1.00 15.00 H new ATOM 0 HB3 LYS A 73 55.072 -3.224 -8.545 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.553 -3.205 -8.787 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.736 -2.743 -10.467 1.00 15.00 H new ATOM 0 HD2 LYS A 73 54.124 -4.833 -10.849 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.817 -5.307 -9.190 1.00 15.00 H new ATOM 0 HE2 LYS A 73 52.056 -6.434 -10.322 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.246 -4.953 -9.851 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.913 -4.750 -12.080 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.503 -4.154 -12.098 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 52.200 -5.780 -12.486 1.00 15.00 H new ATOM 1193 N ASP A 74 54.456 -1.515 -6.469 1.00 15.00 N ATOM 1194 CA ASP A 74 53.874 -1.525 -5.089 1.00 15.00 C ATOM 1195 C ASP A 74 54.939 -1.159 -4.049 1.00 15.00 C ATOM 1196 O ASP A 74 56.103 -1.472 -4.208 1.00 15.00 O ATOM 1197 CB ASP A 74 53.388 -2.959 -4.876 1.00 15.00 C ATOM 1198 CG ASP A 74 52.544 -3.029 -3.602 1.00 15.00 C ATOM 1199 OD1 ASP A 74 51.367 -2.722 -3.678 1.00 15.00 O ATOM 1200 OD2 ASP A 74 53.091 -3.391 -2.573 1.00 15.00 O ATOM 0 H ASP A 74 55.433 -1.801 -6.528 1.00 15.00 H new ATOM 0 HA ASP A 74 53.070 -0.797 -4.980 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.799 -3.286 -5.733 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.240 -3.635 -4.798 1.00 15.00 H new ATOM 1205 N LEU A 75 54.540 -0.499 -2.985 1.00 15.00 N ATOM 1206 CA LEU A 75 55.514 -0.108 -1.919 1.00 15.00 C ATOM 1207 C LEU A 75 54.997 -0.544 -0.543 1.00 15.00 C ATOM 1208 O LEU A 75 53.863 -0.277 -0.187 1.00 15.00 O ATOM 1209 CB LEU A 75 55.592 1.418 -2.002 1.00 15.00 C ATOM 1210 CG LEU A 75 56.806 1.918 -1.214 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.221 3.295 -1.735 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.445 2.026 0.270 1.00 15.00 C ATOM 0 H LEU A 75 53.576 -0.214 -2.811 1.00 15.00 H new ATOM 0 HA LEU A 75 56.488 -0.577 -2.055 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.668 1.731 -3.043 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.680 1.860 -1.602 1.00 15.00 H new ATOM 0 HG LEU A 75 57.631 1.216 -1.338 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.085 3.651 -1.174 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.479 3.222 -2.791 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.395 3.995 -1.611 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.310 2.382 0.830 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.619 2.727 0.394 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.149 1.046 0.645 1.00 15.00 H new ATOM 1224 N THR A 76 55.821 -1.214 0.228 1.00 15.00 N ATOM 1225 CA THR A 76 55.401 -1.644 1.600 1.00 15.00 C ATOM 1226 C THR A 76 56.478 -1.274 2.628 1.00 15.00 C ATOM 1227 O THR A 76 57.659 -1.422 2.377 1.00 15.00 O ATOM 1228 CB THR A 76 55.246 -3.163 1.507 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.430 -3.486 0.389 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.594 -3.691 2.786 1.00 15.00 C ATOM 0 H THR A 76 56.769 -1.482 -0.035 1.00 15.00 H new ATOM 0 HA THR A 76 54.480 -1.158 1.921 1.00 15.00 H new ATOM 0 HB THR A 76 56.227 -3.622 1.387 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.331 -4.459 0.327 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.484 -4.773 2.718 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.220 -3.443 3.643 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.612 -3.234 2.909 1.00 15.00 H new