USER MOD reduce.3.24.130724 H: found=0, std=0, add=414, rem=0, adj=14 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 121:sc= -2.23! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -1.01 USER MOD Single : A 10 SER OG : rot 30:sc= 0.16 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -140:sc= -1.01 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.0649) 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= -1.16 K(o=-1.2,f=-8.3!) USER MOD Single : A 34 SER OG : rot -57:sc= 0.0256 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.684 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 0:sc= 0.772! USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 161 N SER A 10 64.214 4.271 7.973 1.00 15.00 N ATOM 162 CA SER A 10 63.384 3.037 8.143 1.00 15.00 C ATOM 163 C SER A 10 63.623 2.069 6.978 1.00 15.00 C ATOM 164 O SER A 10 64.080 2.462 5.923 1.00 15.00 O ATOM 165 CB SER A 10 61.936 3.527 8.143 1.00 15.00 C ATOM 166 OG SER A 10 61.740 4.414 9.236 1.00 15.00 O ATOM 0 HA SER A 10 63.632 2.499 9.058 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.711 4.033 7.204 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.254 2.681 8.220 1.00 15.00 H new ATOM 0 HG SER A 10 62.581 4.875 9.438 1.00 15.00 H new ATOM 172 N LYS A 11 63.313 0.810 7.169 1.00 15.00 N ATOM 173 CA LYS A 11 63.548 -0.206 6.094 1.00 15.00 C ATOM 174 C LYS A 11 62.296 -0.359 5.225 1.00 15.00 C ATOM 175 O LYS A 11 61.192 -0.472 5.729 1.00 15.00 O ATOM 176 CB LYS A 11 63.848 -1.508 6.842 1.00 15.00 C ATOM 177 CG LYS A 11 64.337 -2.569 5.855 1.00 15.00 C ATOM 178 CD LYS A 11 64.719 -3.838 6.621 1.00 15.00 C ATOM 179 CE LYS A 11 65.409 -4.823 5.674 1.00 15.00 C ATOM 180 NZ LYS A 11 66.347 -5.594 6.538 1.00 15.00 N ATOM 0 H LYS A 11 62.905 0.440 8.028 1.00 15.00 H new ATOM 0 HA LYS A 11 64.361 0.078 5.426 1.00 15.00 H new ATOM 0 HB2 LYS A 11 64.604 -1.333 7.607 1.00 15.00 H new ATOM 0 HB3 LYS A 11 62.952 -1.859 7.354 1.00 15.00 H new ATOM 0 HG2 LYS A 11 63.557 -2.791 5.127 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.196 -2.195 5.298 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.383 -3.589 7.449 1.00 15.00 H new ATOM 0 HD3 LYS A 11 63.829 -4.296 7.052 1.00 15.00 H new ATOM 0 HE2 LYS A 11 64.685 -5.480 5.192 1.00 15.00 H new ATOM 0 HE3 LYS A 11 65.943 -4.300 4.880 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 66.858 -6.291 5.960 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 67.028 -4.943 6.978 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 65.810 -6.087 7.280 1.00 15.00 H new ATOM 194 N ILE A 12 62.460 -0.366 3.923 1.00 15.00 N ATOM 195 CA ILE A 12 61.279 -0.456 3.009 1.00 15.00 C ATOM 196 C ILE A 12 61.530 -1.521 1.934 1.00 15.00 C ATOM 197 O ILE A 12 62.651 -1.739 1.510 1.00 15.00 O ATOM 198 CB ILE A 12 61.140 0.939 2.375 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.895 1.985 3.473 1.00 15.00 C ATOM 200 CG2 ILE A 12 59.954 0.951 1.400 1.00 15.00 C ATOM 201 CD1 ILE A 12 60.978 3.392 2.874 1.00 15.00 C ATOM 0 H ILE A 12 63.364 -0.313 3.454 1.00 15.00 H new ATOM 0 HA ILE A 12 60.370 -0.743 3.538 1.00 15.00 H new ATOM 0 HB ILE A 12 62.058 1.177 1.838 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.915 1.829 3.925 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.634 1.873 4.267 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.860 1.941 0.954 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.121 0.213 0.615 1.00 15.00 H new ATOM 0 HG23 ILE A 12 59.038 0.707 1.938 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.804 4.131 3.656 1.00 15.00 H new ATOM 0 HD12 ILE A 12 61.967 3.546 2.443 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.222 3.501 2.096 1.00 15.00 H new ATOM 213 N SER A 13 60.484 -2.180 1.499 1.00 15.00 N ATOM 214 CA SER A 13 60.607 -3.154 0.374 1.00 15.00 C ATOM 215 C SER A 13 59.804 -2.651 -0.827 1.00 15.00 C ATOM 216 O SER A 13 58.657 -2.268 -0.696 1.00 15.00 O ATOM 217 CB SER A 13 60.015 -4.457 0.909 1.00 15.00 C ATOM 218 OG SER A 13 59.980 -5.420 -0.135 1.00 15.00 O ATOM 0 H SER A 13 59.543 -2.083 1.880 1.00 15.00 H new ATOM 0 HA SER A 13 61.637 -3.287 0.044 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.614 -4.827 1.741 1.00 15.00 H new ATOM 0 HB3 SER A 13 59.010 -4.283 1.293 1.00 15.00 H new ATOM 0 HG SER A 13 59.145 -5.930 -0.082 1.00 15.00 H new ATOM 224 N LEU A 14 60.401 -2.650 -1.992 1.00 15.00 N ATOM 225 CA LEU A 14 59.725 -2.073 -3.192 1.00 15.00 C ATOM 226 C LEU A 14 59.631 -3.120 -4.305 1.00 15.00 C ATOM 227 O LEU A 14 60.579 -3.832 -4.577 1.00 15.00 O ATOM 228 CB LEU A 14 60.624 -0.915 -3.623 1.00 15.00 C ATOM 229 CG LEU A 14 59.810 0.092 -4.435 1.00 15.00 C ATOM 230 CD1 LEU A 14 58.897 0.883 -3.498 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.761 1.053 -5.153 1.00 15.00 C ATOM 0 H LEU A 14 61.333 -3.027 -2.164 1.00 15.00 H new ATOM 0 HA LEU A 14 58.707 -1.748 -2.978 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.053 -0.429 -2.747 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.456 -1.290 -4.219 1.00 15.00 H new ATOM 0 HG LEU A 14 59.204 -0.438 -5.170 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.316 1.601 -4.077 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.221 0.199 -2.985 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.502 1.414 -2.763 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.182 1.772 -5.733 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.366 1.583 -4.418 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.412 0.489 -5.821 1.00 15.00 H new ATOM 243 N ILE A 15 58.494 -3.215 -4.945 1.00 15.00 N ATOM 244 CA ILE A 15 58.339 -4.168 -6.088 1.00 15.00 C ATOM 245 C ILE A 15 58.252 -3.371 -7.393 1.00 15.00 C ATOM 246 O ILE A 15 57.365 -2.552 -7.565 1.00 15.00 O ATOM 247 CB ILE A 15 57.030 -4.930 -5.815 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.132 -5.678 -4.478 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.773 -5.946 -6.935 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.742 -6.157 -4.051 1.00 15.00 C ATOM 0 H ILE A 15 57.660 -2.670 -4.724 1.00 15.00 H new ATOM 0 HA ILE A 15 59.177 -4.859 -6.181 1.00 15.00 H new ATOM 0 HB ILE A 15 56.210 -4.214 -5.775 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.807 -6.528 -4.576 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.553 -5.024 -3.715 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.845 -6.481 -6.735 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.692 -5.424 -7.888 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.599 -6.656 -6.979 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.816 -6.688 -3.102 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.081 -5.298 -3.936 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.339 -6.826 -4.811 1.00 15.00 H new ATOM 262 N SER A 16 59.163 -3.610 -8.305 1.00 15.00 N ATOM 263 CA SER A 16 59.265 -2.747 -9.524 1.00 15.00 C ATOM 264 C SER A 16 58.418 -3.315 -10.668 1.00 15.00 C ATOM 265 O SER A 16 57.898 -4.412 -10.586 1.00 15.00 O ATOM 266 CB SER A 16 60.748 -2.760 -9.899 1.00 15.00 C ATOM 267 OG SER A 16 61.442 -1.812 -9.099 1.00 15.00 O ATOM 0 H SER A 16 59.843 -4.369 -8.257 1.00 15.00 H new ATOM 0 HA SER A 16 58.897 -1.738 -9.337 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.165 -3.756 -9.747 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.870 -2.521 -10.955 1.00 15.00 H new ATOM 0 HG SER A 16 62.393 -1.819 -9.335 1.00 15.00 H new ATOM 273 N LYS A 17 58.283 -2.567 -11.740 1.00 15.00 N ATOM 274 CA LYS A 17 57.429 -3.021 -12.892 1.00 15.00 C ATOM 275 C LYS A 17 57.930 -4.354 -13.480 1.00 15.00 C ATOM 276 O LYS A 17 57.196 -5.043 -14.167 1.00 15.00 O ATOM 277 CB LYS A 17 57.514 -1.896 -13.939 1.00 15.00 C ATOM 278 CG LYS A 17 58.960 -1.719 -14.426 1.00 15.00 C ATOM 279 CD LYS A 17 59.033 -0.530 -15.384 1.00 15.00 C ATOM 280 CE LYS A 17 60.392 -0.523 -16.088 1.00 15.00 C ATOM 281 NZ LYS A 17 60.236 -1.463 -17.233 1.00 15.00 N ATOM 0 H LYS A 17 58.728 -1.658 -11.869 1.00 15.00 H new ATOM 0 HA LYS A 17 56.403 -3.202 -12.572 1.00 15.00 H new ATOM 0 HB2 LYS A 17 56.866 -2.128 -14.784 1.00 15.00 H new ATOM 0 HB3 LYS A 17 57.153 -0.962 -13.508 1.00 15.00 H new ATOM 0 HG2 LYS A 17 59.624 -1.557 -13.577 1.00 15.00 H new ATOM 0 HG3 LYS A 17 59.300 -2.625 -14.928 1.00 15.00 H new ATOM 0 HD2 LYS A 17 58.231 -0.593 -16.120 1.00 15.00 H new ATOM 0 HD3 LYS A 17 58.891 0.401 -14.836 1.00 15.00 H new ATOM 0 HE2 LYS A 17 60.654 0.478 -16.431 1.00 15.00 H new ATOM 0 HE3 LYS A 17 61.187 -0.847 -15.416 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 61.120 -1.993 -17.370 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 59.462 -2.128 -17.033 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 60.017 -0.926 -18.096 1.00 15.00 H new ATOM 295 N ALA A 18 59.164 -4.722 -13.219 1.00 15.00 N ATOM 296 CA ALA A 18 59.710 -5.997 -13.786 1.00 15.00 C ATOM 297 C ALA A 18 59.479 -7.177 -12.828 1.00 15.00 C ATOM 298 O ALA A 18 60.110 -8.209 -12.954 1.00 15.00 O ATOM 299 CB ALA A 18 61.208 -5.743 -13.965 1.00 15.00 C ATOM 0 H ALA A 18 59.815 -4.194 -12.638 1.00 15.00 H new ATOM 0 HA ALA A 18 59.218 -6.261 -14.722 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.681 -6.634 -14.378 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.356 -4.905 -14.646 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.655 -5.509 -12.999 1.00 15.00 H new ATOM 305 N GLU A 19 58.582 -7.035 -11.869 1.00 15.00 N ATOM 306 CA GLU A 19 58.249 -8.163 -10.929 1.00 15.00 C ATOM 307 C GLU A 19 59.502 -8.641 -10.185 1.00 15.00 C ATOM 308 O GLU A 19 59.605 -9.794 -9.808 1.00 15.00 O ATOM 309 CB GLU A 19 57.666 -9.289 -11.796 1.00 15.00 C ATOM 310 CG GLU A 19 56.368 -8.812 -12.454 1.00 15.00 C ATOM 311 CD GLU A 19 55.751 -9.958 -13.258 1.00 15.00 C ATOM 312 OE1 GLU A 19 56.259 -10.244 -14.330 1.00 15.00 O ATOM 313 OE2 GLU A 19 54.782 -10.531 -12.788 1.00 15.00 O ATOM 0 H GLU A 19 58.062 -6.175 -11.697 1.00 15.00 H new ATOM 0 HA GLU A 19 57.537 -7.843 -10.168 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.386 -9.583 -12.560 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.473 -10.170 -11.184 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.667 -8.469 -11.693 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.570 -7.963 -13.107 1.00 15.00 H new ATOM 320 N ILE A 20 60.452 -7.760 -9.976 1.00 15.00 N ATOM 321 CA ILE A 20 61.629 -8.102 -9.118 1.00 15.00 C ATOM 322 C ILE A 20 61.483 -7.401 -7.762 1.00 15.00 C ATOM 323 O ILE A 20 60.927 -6.321 -7.673 1.00 15.00 O ATOM 324 CB ILE A 20 62.860 -7.578 -9.877 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.974 -8.288 -11.230 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.128 -7.852 -9.060 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.993 -7.559 -12.108 1.00 15.00 C ATOM 0 H ILE A 20 60.462 -6.817 -10.364 1.00 15.00 H new ATOM 0 HA ILE A 20 61.714 -9.172 -8.928 1.00 15.00 H new ATOM 0 HB ILE A 20 62.750 -6.505 -10.033 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.280 -9.324 -11.084 1.00 15.00 H new ATOM 0 HG13 ILE A 20 62.003 -8.309 -11.724 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.997 -7.479 -9.602 1.00 15.00 H new ATOM 0 HG22 ILE A 20 64.056 -7.347 -8.097 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.233 -8.925 -8.900 1.00 15.00 H new ATOM 0 HD11 ILE A 20 64.073 -8.065 -13.070 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.668 -6.531 -12.265 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.965 -7.561 -11.615 1.00 15.00 H new ATOM 339 N ARG A 21 61.978 -8.012 -6.711 1.00 15.00 N ATOM 340 CA ARG A 21 61.823 -7.420 -5.348 1.00 15.00 C ATOM 341 C ARG A 21 63.148 -6.815 -4.873 1.00 15.00 C ATOM 342 O ARG A 21 64.142 -7.505 -4.737 1.00 15.00 O ATOM 343 CB ARG A 21 61.419 -8.594 -4.455 1.00 15.00 C ATOM 344 CG ARG A 21 61.004 -8.074 -3.076 1.00 15.00 C ATOM 345 CD ARG A 21 60.621 -9.255 -2.180 1.00 15.00 C ATOM 346 NE ARG A 21 60.202 -8.641 -0.882 1.00 15.00 N ATOM 347 CZ ARG A 21 61.087 -8.177 -0.018 1.00 15.00 C ATOM 348 NH1 ARG A 21 62.376 -8.212 -0.266 1.00 15.00 N ATOM 349 NH2 ARG A 21 60.669 -7.666 1.107 1.00 15.00 N ATOM 0 H ARG A 21 62.484 -8.897 -6.741 1.00 15.00 H new ATOM 0 HA ARG A 21 61.087 -6.616 -5.329 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.595 -9.143 -4.910 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.251 -9.291 -4.356 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.823 -7.512 -2.626 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.162 -7.388 -3.172 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.811 -9.837 -2.620 1.00 15.00 H new ATOM 0 HD3 ARG A 21 61.463 -9.934 -2.041 1.00 15.00 H new ATOM 0 HE ARG A 21 59.209 -8.579 -0.659 1.00 15.00 H new ATOM 0 HH11 ARG A 21 62.716 -8.605 -1.144 1.00 15.00 H new ATOM 0 HH12 ARG A 21 63.037 -7.847 0.419 1.00 15.00 H new ATOM 0 HH21 ARG A 21 59.670 -7.629 1.310 1.00 15.00 H new ATOM 0 HH22 ARG A 21 61.341 -7.304 1.784 1.00 15.00 H new ATOM 363 N TYR A 22 63.161 -5.528 -4.620 1.00 15.00 N ATOM 364 CA TYR A 22 64.388 -4.867 -4.080 1.00 15.00 C ATOM 365 C TYR A 22 64.136 -4.411 -2.641 1.00 15.00 C ATOM 366 O TYR A 22 63.094 -3.866 -2.338 1.00 15.00 O ATOM 367 CB TYR A 22 64.618 -3.650 -4.978 1.00 15.00 C ATOM 368 CG TYR A 22 65.052 -3.991 -6.384 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.428 -4.152 -6.680 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.084 -4.139 -7.408 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.836 -4.461 -8.000 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.492 -4.448 -8.727 1.00 15.00 C ATOM 373 CZ TYR A 22 65.868 -4.608 -9.025 1.00 15.00 C ATOM 374 OH TYR A 22 66.266 -4.908 -10.311 1.00 15.00 O ATOM 0 H TYR A 22 62.367 -4.904 -4.766 1.00 15.00 H new ATOM 0 HA TYR A 22 65.248 -5.537 -4.072 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.698 -3.068 -5.025 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.375 -3.013 -4.521 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.165 -4.039 -5.899 1.00 15.00 H new ATOM 0 HD2 TYR A 22 63.035 -4.016 -7.182 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.885 -4.585 -8.226 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.754 -4.562 -9.507 1.00 15.00 H new ATOM 0 HH TYR A 22 65.478 -4.975 -10.890 1.00 15.00 H new ATOM 384 N GLU A 23 65.077 -4.628 -1.757 1.00 15.00 N ATOM 385 CA GLU A 23 64.925 -4.122 -0.358 1.00 15.00 C ATOM 386 C GLU A 23 66.101 -3.212 0.000 1.00 15.00 C ATOM 387 O GLU A 23 67.231 -3.482 -0.356 1.00 15.00 O ATOM 388 CB GLU A 23 64.929 -5.376 0.517 1.00 15.00 C ATOM 389 CG GLU A 23 64.498 -5.012 1.938 1.00 15.00 C ATOM 390 CD GLU A 23 64.485 -6.272 2.804 1.00 15.00 C ATOM 391 OE1 GLU A 23 65.450 -7.016 2.747 1.00 15.00 O ATOM 392 OE2 GLU A 23 63.510 -6.472 3.510 1.00 15.00 O ATOM 0 H GLU A 23 65.943 -5.133 -1.943 1.00 15.00 H new ATOM 0 HA GLU A 23 64.016 -3.535 -0.224 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.253 -6.124 0.102 1.00 15.00 H new ATOM 0 HB3 GLU A 23 65.925 -5.819 0.531 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.182 -4.275 2.359 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.508 -4.557 1.924 1.00 15.00 H new ATOM 399 N GLY A 24 65.837 -2.141 0.707 1.00 15.00 N ATOM 400 CA GLY A 24 66.923 -1.185 1.077 1.00 15.00 C ATOM 401 C GLY A 24 66.399 -0.232 2.152 1.00 15.00 C ATOM 402 O GLY A 24 65.267 -0.343 2.582 1.00 15.00 O ATOM 0 H GLY A 24 64.909 -1.887 1.045 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.793 -1.728 1.446 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.246 -0.623 0.200 1.00 15.00 H new ATOM 406 N ILE A 25 67.209 0.702 2.592 1.00 15.00 N ATOM 407 CA ILE A 25 66.748 1.646 3.660 1.00 15.00 C ATOM 408 C ILE A 25 66.498 3.032 3.057 1.00 15.00 C ATOM 409 O ILE A 25 67.241 3.493 2.210 1.00 15.00 O ATOM 410 CB ILE A 25 67.880 1.704 4.701 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.296 0.282 5.139 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.401 2.494 5.925 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.099 -0.479 5.727 1.00 15.00 C ATOM 0 H ILE A 25 68.162 0.851 2.261 1.00 15.00 H new ATOM 0 HA ILE A 25 65.815 1.315 4.116 1.00 15.00 H new ATOM 0 HB ILE A 25 68.743 2.195 4.252 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.696 -0.264 4.285 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.093 0.343 5.880 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.200 2.538 6.665 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.131 3.506 5.622 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.531 2.001 6.359 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.415 -1.478 6.029 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.717 0.058 6.595 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.314 -0.559 4.975 1.00 15.00 H new ATOM 425 N LEU A 26 65.454 3.696 3.495 1.00 15.00 N ATOM 426 CA LEU A 26 65.101 5.037 2.923 1.00 15.00 C ATOM 427 C LEU A 26 66.202 6.053 3.231 1.00 15.00 C ATOM 428 O LEU A 26 66.382 6.452 4.365 1.00 15.00 O ATOM 429 CB LEU A 26 63.796 5.438 3.618 1.00 15.00 C ATOM 430 CG LEU A 26 63.192 6.661 2.924 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.650 6.257 1.553 1.00 15.00 C ATOM 432 CD2 LEU A 26 62.049 7.216 3.778 1.00 15.00 C ATOM 0 H LEU A 26 64.827 3.365 4.229 1.00 15.00 H new ATOM 0 HA LEU A 26 64.993 5.003 1.839 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.090 4.608 3.592 1.00 15.00 H new ATOM 0 HB3 LEU A 26 63.986 5.662 4.668 1.00 15.00 H new ATOM 0 HG LEU A 26 63.961 7.424 2.800 1.00 15.00 H new ATOM 0 HD11 LEU A 26 62.220 7.129 1.060 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.462 5.859 0.944 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.881 5.494 1.676 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.617 8.087 3.286 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.282 6.451 3.901 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.433 7.505 4.756 1.00 15.00 H new ATOM 444 N TYR A 27 66.936 6.470 2.227 1.00 15.00 N ATOM 445 CA TYR A 27 68.056 7.432 2.457 1.00 15.00 C ATOM 446 C TYR A 27 67.572 8.871 2.253 1.00 15.00 C ATOM 447 O TYR A 27 67.762 9.720 3.106 1.00 15.00 O ATOM 448 CB TYR A 27 69.115 7.069 1.416 1.00 15.00 C ATOM 449 CG TYR A 27 70.382 7.882 1.538 1.00 15.00 C ATOM 450 CD1 TYR A 27 71.157 7.808 2.721 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.791 8.721 0.474 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.343 8.573 2.840 1.00 15.00 C ATOM 453 CE2 TYR A 27 71.977 9.486 0.593 1.00 15.00 C ATOM 454 CZ TYR A 27 72.754 9.412 1.776 1.00 15.00 C ATOM 455 OH TYR A 27 73.908 10.158 1.891 1.00 15.00 O ATOM 0 H TYR A 27 66.806 6.184 1.257 1.00 15.00 H new ATOM 0 HA TYR A 27 68.447 7.371 3.473 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.360 6.011 1.512 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.697 7.210 0.419 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.844 7.168 3.533 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.199 8.778 -0.428 1.00 15.00 H new ATOM 0 HE1 TYR A 27 72.934 8.516 3.742 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.290 10.126 -0.219 1.00 15.00 H new ATOM 0 HH TYR A 27 74.045 10.677 1.071 1.00 15.00 H new ATOM 465 N THR A 28 66.951 9.148 1.132 1.00 15.00 N ATOM 466 CA THR A 28 66.478 10.541 0.858 1.00 15.00 C ATOM 467 C THR A 28 65.138 10.517 0.117 1.00 15.00 C ATOM 468 O THR A 28 64.899 9.669 -0.721 1.00 15.00 O ATOM 469 CB THR A 28 67.563 11.171 -0.018 1.00 15.00 C ATOM 470 OG1 THR A 28 67.920 10.269 -1.056 1.00 15.00 O ATOM 471 CG2 THR A 28 68.794 11.483 0.835 1.00 15.00 C ATOM 0 H THR A 28 66.752 8.471 0.396 1.00 15.00 H new ATOM 0 HA THR A 28 66.320 11.104 1.778 1.00 15.00 H new ATOM 0 HB THR A 28 67.183 12.094 -0.456 1.00 15.00 H new ATOM 0 HG1 THR A 28 67.758 10.691 -1.926 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.566 11.932 0.210 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.520 12.178 1.628 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.174 10.561 1.276 1.00 15.00 H new ATOM 479 N ILE A 29 64.268 11.449 0.424 1.00 15.00 N ATOM 480 CA ILE A 29 62.924 11.485 -0.236 1.00 15.00 C ATOM 481 C ILE A 29 62.782 12.780 -1.048 1.00 15.00 C ATOM 482 O ILE A 29 62.961 13.866 -0.529 1.00 15.00 O ATOM 483 CB ILE A 29 61.903 11.454 0.916 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.103 10.192 1.768 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.481 11.447 0.347 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.315 10.324 3.074 1.00 15.00 C ATOM 0 H ILE A 29 64.432 12.189 1.106 1.00 15.00 H new ATOM 0 HA ILE A 29 62.776 10.652 -0.924 1.00 15.00 H new ATOM 0 HB ILE A 29 62.051 12.338 1.536 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.769 9.313 1.217 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.162 10.050 1.983 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.762 11.425 1.166 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.324 12.345 -0.250 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.344 10.566 -0.280 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.458 9.428 3.677 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.670 11.194 3.627 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.255 10.445 2.849 1.00 15.00 H new ATOM 498 N ASP A 30 62.463 12.668 -2.316 1.00 15.00 N ATOM 499 CA ASP A 30 62.258 13.886 -3.157 1.00 15.00 C ATOM 500 C ASP A 30 60.783 14.003 -3.551 1.00 15.00 C ATOM 501 O ASP A 30 60.335 13.370 -4.489 1.00 15.00 O ATOM 502 CB ASP A 30 63.131 13.666 -4.393 1.00 15.00 C ATOM 503 CG ASP A 30 63.188 14.955 -5.214 1.00 15.00 C ATOM 504 OD1 ASP A 30 64.063 15.763 -4.952 1.00 15.00 O ATOM 505 OD2 ASP A 30 62.354 15.113 -6.091 1.00 15.00 O ATOM 0 H ASP A 30 62.336 11.782 -2.804 1.00 15.00 H new ATOM 0 HA ASP A 30 62.524 14.805 -2.634 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.136 13.369 -4.093 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.726 12.855 -4.998 1.00 15.00 H new ATOM 510 N THR A 31 60.033 14.809 -2.841 1.00 15.00 N ATOM 511 CA THR A 31 58.566 14.924 -3.124 1.00 15.00 C ATOM 512 C THR A 31 58.332 15.664 -4.444 1.00 15.00 C ATOM 513 O THR A 31 57.424 15.343 -5.188 1.00 15.00 O ATOM 514 CB THR A 31 57.987 15.724 -1.952 1.00 15.00 C ATOM 515 OG1 THR A 31 58.430 15.154 -0.728 1.00 15.00 O ATOM 516 CG2 THR A 31 56.460 15.687 -2.011 1.00 15.00 C ATOM 0 H THR A 31 60.372 15.393 -2.077 1.00 15.00 H new ATOM 0 HA THR A 31 58.094 13.946 -3.220 1.00 15.00 H new ATOM 0 HB THR A 31 58.325 16.758 -2.015 1.00 15.00 H new ATOM 0 HG1 THR A 31 58.062 15.665 0.023 1.00 15.00 H new ATOM 0 HG21 THR A 31 56.050 16.256 -1.177 1.00 15.00 H new ATOM 0 HG22 THR A 31 56.121 16.124 -2.950 1.00 15.00 H new ATOM 0 HG23 THR A 31 56.118 14.654 -1.948 1.00 15.00 H new ATOM 524 N GLU A 32 59.150 16.645 -4.743 1.00 15.00 N ATOM 525 CA GLU A 32 58.872 17.544 -5.915 1.00 15.00 C ATOM 526 C GLU A 32 58.789 16.740 -7.220 1.00 15.00 C ATOM 527 O GLU A 32 58.082 17.115 -8.137 1.00 15.00 O ATOM 528 CB GLU A 32 60.052 18.519 -5.968 1.00 15.00 C ATOM 529 CG GLU A 32 60.023 19.427 -4.737 1.00 15.00 C ATOM 530 CD GLU A 32 61.162 20.445 -4.822 1.00 15.00 C ATOM 531 OE1 GLU A 32 61.814 20.660 -3.813 1.00 15.00 O ATOM 532 OE2 GLU A 32 61.363 20.994 -5.894 1.00 15.00 O ATOM 0 H GLU A 32 60.001 16.865 -4.226 1.00 15.00 H new ATOM 0 HA GLU A 32 57.917 18.058 -5.804 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.991 17.967 -6.003 1.00 15.00 H new ATOM 0 HB3 GLU A 32 60.000 19.119 -6.876 1.00 15.00 H new ATOM 0 HG2 GLU A 32 59.065 19.943 -4.676 1.00 15.00 H new ATOM 0 HG3 GLU A 32 60.122 18.830 -3.830 1.00 15.00 H new ATOM 539 N ASN A 33 59.503 15.644 -7.306 1.00 15.00 N ATOM 540 CA ASN A 33 59.519 14.851 -8.577 1.00 15.00 C ATOM 541 C ASN A 33 58.922 13.447 -8.374 1.00 15.00 C ATOM 542 O ASN A 33 59.079 12.582 -9.215 1.00 15.00 O ATOM 543 CB ASN A 33 60.998 14.749 -8.957 1.00 15.00 C ATOM 544 CG ASN A 33 61.530 16.131 -9.346 1.00 15.00 C ATOM 545 OD1 ASN A 33 61.068 17.140 -8.851 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.496 16.220 -10.220 1.00 15.00 N ATOM 0 H ASN A 33 60.075 15.264 -6.552 1.00 15.00 H new ATOM 0 HA ASN A 33 58.918 15.327 -9.352 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.571 14.351 -8.120 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.122 14.054 -9.788 1.00 15.00 H new ATOM 0 HD21 ASN A 33 62.861 17.135 -10.486 1.00 15.00 H new ATOM 0 HD22 ASN A 33 62.886 15.375 -10.637 1.00 15.00 H new ATOM 553 N SER A 34 58.238 13.212 -7.269 1.00 15.00 N ATOM 554 CA SER A 34 57.695 11.840 -6.966 1.00 15.00 C ATOM 555 C SER A 34 58.785 10.761 -7.123 1.00 15.00 C ATOM 556 O SER A 34 58.580 9.744 -7.762 1.00 15.00 O ATOM 557 CB SER A 34 56.565 11.621 -7.979 1.00 15.00 C ATOM 558 OG SER A 34 55.743 10.548 -7.542 1.00 15.00 O ATOM 0 H SER A 34 58.032 13.917 -6.561 1.00 15.00 H new ATOM 0 HA SER A 34 57.342 11.767 -5.937 1.00 15.00 H new ATOM 0 HB2 SER A 34 55.972 12.530 -8.082 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.980 11.399 -8.962 1.00 15.00 H new ATOM 0 HG SER A 34 56.291 9.745 -7.418 1.00 15.00 H new ATOM 564 N THR A 35 59.938 10.984 -6.538 1.00 15.00 N ATOM 565 CA THR A 35 61.061 10.004 -6.679 1.00 15.00 C ATOM 566 C THR A 35 61.669 9.683 -5.309 1.00 15.00 C ATOM 567 O THR A 35 61.676 10.507 -4.413 1.00 15.00 O ATOM 568 CB THR A 35 62.091 10.700 -7.573 1.00 15.00 C ATOM 569 OG1 THR A 35 62.320 12.017 -7.090 1.00 15.00 O ATOM 570 CG2 THR A 35 61.575 10.767 -9.014 1.00 15.00 C ATOM 0 H THR A 35 60.150 11.803 -5.968 1.00 15.00 H new ATOM 0 HA THR A 35 60.725 9.058 -7.104 1.00 15.00 H new ATOM 0 HB THR A 35 63.022 10.134 -7.554 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.980 12.464 -7.660 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.314 11.264 -9.642 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.402 9.757 -9.386 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.641 11.328 -9.040 1.00 15.00 H new ATOM 578 N VAL A 36 62.181 8.487 -5.148 1.00 15.00 N ATOM 579 CA VAL A 36 62.786 8.087 -3.839 1.00 15.00 C ATOM 580 C VAL A 36 64.162 7.453 -4.078 1.00 15.00 C ATOM 581 O VAL A 36 64.347 6.694 -5.013 1.00 15.00 O ATOM 582 CB VAL A 36 61.807 7.064 -3.241 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.328 6.570 -1.888 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.435 7.718 -3.035 1.00 15.00 C ATOM 0 H VAL A 36 62.206 7.767 -5.870 1.00 15.00 H new ATOM 0 HA VAL A 36 62.936 8.934 -3.170 1.00 15.00 H new ATOM 0 HB VAL A 36 61.717 6.223 -3.928 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.628 5.846 -1.471 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.301 6.098 -2.023 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.426 7.414 -1.205 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.744 6.989 -2.611 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.533 8.563 -2.354 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.051 8.067 -3.993 1.00 15.00 H new ATOM 594 N ALA A 37 65.123 7.760 -3.241 1.00 15.00 N ATOM 595 CA ALA A 37 66.480 7.145 -3.385 1.00 15.00 C ATOM 596 C ALA A 37 66.761 6.216 -2.201 1.00 15.00 C ATOM 597 O ALA A 37 66.623 6.605 -1.054 1.00 15.00 O ATOM 598 CB ALA A 37 67.464 8.322 -3.395 1.00 15.00 C ATOM 0 H ALA A 37 65.026 8.412 -2.462 1.00 15.00 H new ATOM 0 HA ALA A 37 66.566 6.545 -4.291 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.481 7.945 -3.498 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.235 8.981 -4.233 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.376 8.878 -2.461 1.00 15.00 H new ATOM 604 N LEU A 38 67.157 4.997 -2.478 1.00 15.00 N ATOM 605 CA LEU A 38 67.437 4.019 -1.383 1.00 15.00 C ATOM 606 C LEU A 38 68.912 3.620 -1.410 1.00 15.00 C ATOM 607 O LEU A 38 69.479 3.391 -2.463 1.00 15.00 O ATOM 608 CB LEU A 38 66.557 2.805 -1.692 1.00 15.00 C ATOM 609 CG LEU A 38 65.085 3.153 -1.462 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.204 2.095 -2.131 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.792 3.176 0.041 1.00 15.00 C ATOM 0 H LEU A 38 67.299 4.637 -3.422 1.00 15.00 H new ATOM 0 HA LEU A 38 67.227 4.433 -0.397 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.708 2.490 -2.725 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.844 1.966 -1.058 1.00 15.00 H new ATOM 0 HG LEU A 38 64.873 4.133 -1.889 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.154 2.340 -1.969 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.410 2.073 -3.201 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.419 1.117 -1.700 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.743 3.424 0.203 1.00 15.00 H new ATOM 0 HD22 LEU A 38 65.003 2.196 0.468 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.421 3.925 0.523 1.00 15.00 H new ATOM 623 N ALA A 39 69.534 3.535 -0.259 1.00 15.00 N ATOM 624 CA ALA A 39 70.973 3.138 -0.206 1.00 15.00 C ATOM 625 C ALA A 39 71.115 1.788 0.500 1.00 15.00 C ATOM 626 O ALA A 39 70.206 1.336 1.175 1.00 15.00 O ATOM 627 CB ALA A 39 71.660 4.242 0.599 1.00 15.00 C ATOM 0 H ALA A 39 69.105 3.724 0.647 1.00 15.00 H new ATOM 0 HA ALA A 39 71.412 3.028 -1.198 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.724 4.022 0.683 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.525 5.198 0.094 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.220 4.293 1.595 1.00 15.00 H new ATOM 633 N LYS A 40 72.254 1.140 0.345 1.00 15.00 N ATOM 634 CA LYS A 40 72.465 -0.221 0.952 1.00 15.00 C ATOM 635 C LYS A 40 71.310 -1.163 0.573 1.00 15.00 C ATOM 636 O LYS A 40 70.560 -1.619 1.418 1.00 15.00 O ATOM 637 CB LYS A 40 72.515 0.008 2.470 1.00 15.00 C ATOM 638 CG LYS A 40 73.757 0.831 2.822 1.00 15.00 C ATOM 639 CD LYS A 40 73.870 0.962 4.342 1.00 15.00 C ATOM 640 CE LYS A 40 75.044 1.880 4.689 1.00 15.00 C ATOM 641 NZ LYS A 40 74.708 2.445 6.026 1.00 15.00 N ATOM 0 H LYS A 40 73.051 1.500 -0.180 1.00 15.00 H new ATOM 0 HA LYS A 40 73.380 -0.691 0.591 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.616 0.528 2.800 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.540 -0.948 2.992 1.00 15.00 H new ATOM 0 HG2 LYS A 40 74.650 0.351 2.421 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.693 1.819 2.365 1.00 15.00 H new ATOM 0 HD2 LYS A 40 72.945 1.366 4.753 1.00 15.00 H new ATOM 0 HD3 LYS A 40 74.017 -0.020 4.792 1.00 15.00 H new ATOM 0 HE2 LYS A 40 75.983 1.327 4.719 1.00 15.00 H new ATOM 0 HE3 LYS A 40 75.162 2.668 3.946 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 75.467 3.086 6.333 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 73.813 2.972 5.965 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 74.608 1.672 6.715 1.00 15.00 H new ATOM 655 N VAL A 41 71.172 -1.455 -0.697 1.00 15.00 N ATOM 656 CA VAL A 41 69.980 -2.222 -1.172 1.00 15.00 C ATOM 657 C VAL A 41 70.423 -3.486 -1.923 1.00 15.00 C ATOM 658 O VAL A 41 71.435 -3.496 -2.601 1.00 15.00 O ATOM 659 CB VAL A 41 69.220 -1.248 -2.095 1.00 15.00 C ATOM 660 CG1 VAL A 41 70.070 -0.892 -3.320 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.907 -1.891 -2.558 1.00 15.00 C ATOM 0 H VAL A 41 71.836 -1.194 -1.426 1.00 15.00 H new ATOM 0 HA VAL A 41 69.348 -2.564 -0.352 1.00 15.00 H new ATOM 0 HB VAL A 41 69.007 -0.337 -1.536 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.517 -0.204 -3.959 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.997 -0.420 -2.995 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.302 -1.799 -3.878 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.373 -1.199 -3.210 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.124 -2.809 -3.103 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.289 -2.122 -1.690 1.00 15.00 H new ATOM 671 N ARG A 42 69.665 -4.546 -1.797 1.00 15.00 N ATOM 672 CA ARG A 42 70.005 -5.819 -2.500 1.00 15.00 C ATOM 673 C ARG A 42 68.792 -6.314 -3.292 1.00 15.00 C ATOM 674 O ARG A 42 67.660 -6.081 -2.908 1.00 15.00 O ATOM 675 CB ARG A 42 70.347 -6.812 -1.386 1.00 15.00 C ATOM 676 CG ARG A 42 71.119 -8.001 -1.964 1.00 15.00 C ATOM 677 CD ARG A 42 71.462 -8.980 -0.837 1.00 15.00 C ATOM 678 NE ARG A 42 72.170 -10.113 -1.508 1.00 15.00 N ATOM 679 CZ ARG A 42 72.562 -11.179 -0.835 1.00 15.00 C ATOM 680 NH1 ARG A 42 72.335 -11.306 0.452 1.00 15.00 N ATOM 681 NH2 ARG A 42 73.186 -12.135 -1.467 1.00 15.00 N ATOM 0 H ARG A 42 68.817 -4.583 -1.231 1.00 15.00 H new ATOM 0 HA ARG A 42 70.828 -5.695 -3.204 1.00 15.00 H new ATOM 0 HB2 ARG A 42 70.943 -6.319 -0.618 1.00 15.00 H new ATOM 0 HB3 ARG A 42 69.433 -7.160 -0.905 1.00 15.00 H new ATOM 0 HG2 ARG A 42 70.521 -8.501 -2.726 1.00 15.00 H new ATOM 0 HG3 ARG A 42 72.031 -7.655 -2.450 1.00 15.00 H new ATOM 0 HD2 ARG A 42 72.095 -8.509 -0.085 1.00 15.00 H new ATOM 0 HD3 ARG A 42 70.563 -9.324 -0.326 1.00 15.00 H new ATOM 0 HE ARG A 42 72.355 -10.061 -2.510 1.00 15.00 H new ATOM 0 HH11 ARG A 42 71.844 -10.569 0.958 1.00 15.00 H new ATOM 0 HH12 ARG A 42 72.650 -12.141 0.945 1.00 15.00 H new ATOM 0 HH21 ARG A 42 73.365 -12.053 -2.468 1.00 15.00 H new ATOM 0 HH22 ARG A 42 73.495 -12.965 -0.960 1.00 15.00 H new ATOM 695 N SER A 43 69.020 -6.990 -4.391 1.00 15.00 N ATOM 696 CA SER A 43 67.886 -7.606 -5.146 1.00 15.00 C ATOM 697 C SER A 43 67.787 -9.096 -4.800 1.00 15.00 C ATOM 698 O SER A 43 68.747 -9.833 -4.934 1.00 15.00 O ATOM 699 CB SER A 43 68.237 -7.402 -6.623 1.00 15.00 C ATOM 700 OG SER A 43 69.286 -8.289 -6.991 1.00 15.00 O ATOM 0 H SER A 43 69.943 -7.142 -4.798 1.00 15.00 H new ATOM 0 HA SER A 43 66.922 -7.160 -4.902 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.360 -7.583 -7.244 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.542 -6.370 -6.795 1.00 15.00 H new ATOM 0 HG SER A 43 69.545 -8.829 -6.215 1.00 15.00 H new ATOM 706 N PHE A 44 66.634 -9.540 -4.359 1.00 15.00 N ATOM 707 CA PHE A 44 66.521 -10.937 -3.828 1.00 15.00 C ATOM 708 C PHE A 44 66.647 -11.958 -4.963 1.00 15.00 C ATOM 709 O PHE A 44 67.279 -12.987 -4.810 1.00 15.00 O ATOM 710 CB PHE A 44 65.134 -11.016 -3.184 1.00 15.00 C ATOM 711 CG PHE A 44 65.124 -10.616 -1.727 1.00 15.00 C ATOM 712 CD1 PHE A 44 64.908 -11.595 -0.726 1.00 15.00 C ATOM 713 CD2 PHE A 44 65.334 -9.265 -1.363 1.00 15.00 C ATOM 714 CE1 PHE A 44 64.900 -11.220 0.639 1.00 15.00 C ATOM 715 CE2 PHE A 44 65.326 -8.890 0.004 1.00 15.00 C ATOM 716 CZ PHE A 44 65.109 -9.869 1.005 1.00 15.00 C ATOM 0 H PHE A 44 65.770 -8.999 -4.343 1.00 15.00 H new ATOM 0 HA PHE A 44 67.313 -11.163 -3.114 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.449 -10.371 -3.735 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.757 -12.034 -3.276 1.00 15.00 H new ATOM 0 HD1 PHE A 44 64.750 -12.626 -1.004 1.00 15.00 H new ATOM 0 HD2 PHE A 44 65.500 -8.520 -2.127 1.00 15.00 H new ATOM 0 HE1 PHE A 44 64.734 -11.966 1.402 1.00 15.00 H new ATOM 0 HE2 PHE A 44 65.485 -7.859 0.282 1.00 15.00 H new ATOM 0 HZ PHE A 44 65.103 -9.584 2.047 1.00 15.00 H new ATOM 984 N PHE A 62 74.287 -2.980 -4.020 1.00 15.00 N ATOM 985 CA PHE A 62 74.253 -1.638 -4.677 1.00 15.00 C ATOM 986 C PHE A 62 74.280 -0.532 -3.620 1.00 15.00 C ATOM 987 O PHE A 62 73.461 -0.505 -2.720 1.00 15.00 O ATOM 988 CB PHE A 62 72.938 -1.610 -5.452 1.00 15.00 C ATOM 989 CG PHE A 62 72.860 -2.649 -6.545 1.00 15.00 C ATOM 990 CD1 PHE A 62 73.640 -2.502 -7.719 1.00 15.00 C ATOM 991 CD2 PHE A 62 72.007 -3.769 -6.398 1.00 15.00 C ATOM 992 CE1 PHE A 62 73.566 -3.476 -8.745 1.00 15.00 C ATOM 993 CE2 PHE A 62 71.932 -4.743 -7.423 1.00 15.00 C ATOM 994 CZ PHE A 62 72.713 -4.597 -8.597 1.00 15.00 C ATOM 0 HA PHE A 62 75.112 -1.474 -5.328 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.113 -1.763 -4.757 1.00 15.00 H new ATOM 0 HB3 PHE A 62 72.806 -0.621 -5.891 1.00 15.00 H new ATOM 0 HD1 PHE A 62 74.291 -1.647 -7.831 1.00 15.00 H new ATOM 0 HD2 PHE A 62 71.413 -3.881 -5.503 1.00 15.00 H new ATOM 0 HE1 PHE A 62 74.160 -3.364 -9.640 1.00 15.00 H new ATOM 0 HE2 PHE A 62 71.280 -5.597 -7.310 1.00 15.00 H new ATOM 0 HZ PHE A 62 72.658 -5.340 -9.378 1.00 15.00 H new ATOM 1004 N GLU A 63 75.219 0.377 -3.727 1.00 15.00 N ATOM 1005 CA GLU A 63 75.338 1.469 -2.708 1.00 15.00 C ATOM 1006 C GLU A 63 74.158 2.440 -2.818 1.00 15.00 C ATOM 1007 O GLU A 63 73.577 2.830 -1.822 1.00 15.00 O ATOM 1008 CB GLU A 63 76.653 2.187 -3.032 1.00 15.00 C ATOM 1009 CG GLU A 63 76.995 3.166 -1.908 1.00 15.00 C ATOM 1010 CD GLU A 63 78.243 3.966 -2.286 1.00 15.00 C ATOM 1011 OE1 GLU A 63 79.103 4.120 -1.434 1.00 15.00 O ATOM 1012 OE2 GLU A 63 78.319 4.411 -3.419 1.00 15.00 O ATOM 0 H GLU A 63 75.910 0.410 -4.477 1.00 15.00 H new ATOM 0 HA GLU A 63 75.329 1.075 -1.692 1.00 15.00 H new ATOM 0 HB2 GLU A 63 77.456 1.460 -3.151 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.564 2.721 -3.978 1.00 15.00 H new ATOM 0 HG2 GLU A 63 76.157 3.841 -1.733 1.00 15.00 H new ATOM 0 HG3 GLU A 63 77.167 2.623 -0.979 1.00 15.00 H new ATOM 1019 N TYR A 64 73.802 2.832 -4.019 1.00 15.00 N ATOM 1020 CA TYR A 64 72.703 3.831 -4.193 1.00 15.00 C ATOM 1021 C TYR A 64 71.955 3.583 -5.508 1.00 15.00 C ATOM 1022 O TYR A 64 72.543 3.595 -6.574 1.00 15.00 O ATOM 1023 CB TYR A 64 73.413 5.186 -4.230 1.00 15.00 C ATOM 1024 CG TYR A 64 72.486 6.368 -4.054 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.514 6.664 -5.041 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.596 7.186 -2.904 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.654 7.775 -4.876 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.735 8.298 -2.740 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.763 8.592 -3.726 1.00 15.00 C ATOM 1030 OH TYR A 64 69.925 9.676 -3.567 1.00 15.00 O ATOM 0 H TYR A 64 74.226 2.502 -4.886 1.00 15.00 H new ATOM 0 HA TYR A 64 71.962 3.773 -3.395 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.170 5.210 -3.446 1.00 15.00 H new ATOM 0 HB3 TYR A 64 73.936 5.285 -5.181 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.429 6.041 -5.919 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.337 6.962 -2.151 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.913 8.000 -5.629 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.820 8.922 -1.863 1.00 15.00 H new ATOM 0 HH TYR A 64 70.132 10.129 -2.723 1.00 15.00 H new ATOM 1040 N ILE A 65 70.666 3.358 -5.434 1.00 15.00 N ATOM 1041 CA ILE A 65 69.841 3.242 -6.682 1.00 15.00 C ATOM 1042 C ILE A 65 68.599 4.136 -6.565 1.00 15.00 C ATOM 1043 O ILE A 65 68.067 4.336 -5.487 1.00 15.00 O ATOM 1044 CB ILE A 65 69.439 1.778 -6.944 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.668 0.946 -7.315 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.438 1.697 -8.086 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.337 -0.446 -7.806 1.00 15.00 C ATOM 0 H ILE A 65 70.147 3.249 -4.563 1.00 15.00 H new ATOM 0 HA ILE A 65 70.439 3.576 -7.530 1.00 15.00 H new ATOM 0 HB ILE A 65 68.989 1.387 -6.032 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.230 1.470 -8.088 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.319 0.869 -6.444 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.165 0.656 -8.257 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.546 2.268 -7.829 1.00 15.00 H new ATOM 0 HG23 ILE A 65 68.885 2.109 -8.991 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.259 -0.975 -8.049 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.802 -0.989 -7.027 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.711 -0.379 -8.696 1.00 15.00 H new ATOM 1059 N ILE A 66 68.139 4.670 -7.671 1.00 15.00 N ATOM 1060 CA ILE A 66 66.958 5.590 -7.641 1.00 15.00 C ATOM 1061 C ILE A 66 65.755 4.916 -8.313 1.00 15.00 C ATOM 1062 O ILE A 66 65.882 4.295 -9.352 1.00 15.00 O ATOM 1063 CB ILE A 66 67.392 6.838 -8.429 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.604 7.487 -7.752 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.245 7.857 -8.467 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.234 8.508 -8.701 1.00 15.00 C ATOM 0 H ILE A 66 68.533 4.507 -8.598 1.00 15.00 H new ATOM 0 HA ILE A 66 66.658 5.844 -6.624 1.00 15.00 H new ATOM 0 HB ILE A 66 67.652 6.536 -9.444 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.299 7.975 -6.827 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.335 6.725 -7.484 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.559 8.738 -9.026 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.377 7.410 -8.952 1.00 15.00 H new ATOM 0 HG23 ILE A 66 65.983 8.148 -7.450 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.096 8.969 -8.219 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.554 8.007 -9.614 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.501 9.277 -8.947 1.00 15.00 H new ATOM 1078 N PHE A 67 64.591 5.038 -7.722 1.00 15.00 N ATOM 1079 CA PHE A 67 63.352 4.495 -8.357 1.00 15.00 C ATOM 1080 C PHE A 67 62.280 5.585 -8.424 1.00 15.00 C ATOM 1081 O PHE A 67 62.167 6.407 -7.533 1.00 15.00 O ATOM 1082 CB PHE A 67 62.903 3.355 -7.442 1.00 15.00 C ATOM 1083 CG PHE A 67 63.858 2.185 -7.422 1.00 15.00 C ATOM 1084 CD1 PHE A 67 63.969 1.343 -8.555 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.642 1.930 -6.271 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.863 0.245 -8.537 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.537 0.832 -6.253 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.647 -0.010 -7.386 1.00 15.00 C ATOM 0 H PHE A 67 64.447 5.494 -6.821 1.00 15.00 H new ATOM 0 HA PHE A 67 63.524 4.151 -9.377 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.789 3.738 -6.428 1.00 15.00 H new ATOM 0 HB3 PHE A 67 61.921 3.007 -7.764 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.372 1.538 -9.433 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.558 2.572 -5.407 1.00 15.00 H new ATOM 0 HE1 PHE A 67 64.947 -0.398 -9.401 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.135 0.637 -5.375 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.329 -0.847 -7.372 1.00 15.00 H new ATOM 1098 N ARG A 68 61.496 5.598 -9.474 1.00 15.00 N ATOM 1099 CA ARG A 68 60.428 6.637 -9.610 1.00 15.00 C ATOM 1100 C ARG A 68 59.049 6.003 -9.411 1.00 15.00 C ATOM 1101 O ARG A 68 58.850 4.832 -9.679 1.00 15.00 O ATOM 1102 CB ARG A 68 60.571 7.175 -11.035 1.00 15.00 C ATOM 1103 CG ARG A 68 61.904 7.914 -11.174 1.00 15.00 C ATOM 1104 CD ARG A 68 61.968 8.604 -12.542 1.00 15.00 C ATOM 1105 NE ARG A 68 62.080 7.493 -13.543 1.00 15.00 N ATOM 1106 CZ ARG A 68 62.467 7.723 -14.783 1.00 15.00 C ATOM 1107 NH1 ARG A 68 62.766 8.933 -15.199 1.00 15.00 N ATOM 1108 NH2 ARG A 68 62.553 6.724 -15.619 1.00 15.00 N ATOM 0 H ARG A 68 61.550 4.932 -10.245 1.00 15.00 H new ATOM 0 HA ARG A 68 60.526 7.429 -8.867 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.522 6.354 -11.751 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.745 7.848 -11.265 1.00 15.00 H new ATOM 0 HG2 ARG A 68 62.007 8.651 -10.378 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.733 7.214 -11.069 1.00 15.00 H new ATOM 0 HD2 ARG A 68 61.077 9.206 -12.721 1.00 15.00 H new ATOM 0 HD3 ARG A 68 62.824 9.276 -12.603 1.00 15.00 H new ATOM 0 HE ARG A 68 61.852 6.540 -13.259 1.00 15.00 H new ATOM 0 HH11 ARG A 68 62.702 9.723 -14.557 1.00 15.00 H new ATOM 0 HH12 ARG A 68 63.063 9.082 -16.164 1.00 15.00 H new ATOM 0 HH21 ARG A 68 62.322 5.780 -15.311 1.00 15.00 H new ATOM 0 HH22 ARG A 68 62.851 6.888 -16.581 1.00 15.00 H new ATOM 1122 N GLY A 69 58.093 6.772 -8.942 1.00 15.00 N ATOM 1123 CA GLY A 69 56.719 6.223 -8.695 1.00 15.00 C ATOM 1124 C GLY A 69 56.138 5.611 -9.980 1.00 15.00 C ATOM 1125 O GLY A 69 55.298 4.732 -9.926 1.00 15.00 O ATOM 0 H GLY A 69 58.206 7.761 -8.719 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.760 5.466 -7.912 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.064 7.017 -8.336 1.00 15.00 H new ATOM 1129 N SER A 70 56.579 6.069 -11.130 1.00 15.00 N ATOM 1130 CA SER A 70 56.024 5.542 -12.419 1.00 15.00 C ATOM 1131 C SER A 70 56.394 4.065 -12.606 1.00 15.00 C ATOM 1132 O SER A 70 55.562 3.255 -12.970 1.00 15.00 O ATOM 1133 CB SER A 70 56.665 6.393 -13.518 1.00 15.00 C ATOM 1134 OG SER A 70 56.424 7.767 -13.247 1.00 15.00 O ATOM 0 H SER A 70 57.299 6.785 -11.231 1.00 15.00 H new ATOM 0 HA SER A 70 54.936 5.600 -12.440 1.00 15.00 H new ATOM 0 HB2 SER A 70 57.737 6.202 -13.563 1.00 15.00 H new ATOM 0 HB3 SER A 70 56.252 6.124 -14.490 1.00 15.00 H new ATOM 0 HG SER A 70 56.834 8.316 -13.948 1.00 15.00 H new ATOM 1140 N ASP A 71 57.633 3.713 -12.358 1.00 15.00 N ATOM 1141 CA ASP A 71 58.079 2.300 -12.589 1.00 15.00 C ATOM 1142 C ASP A 71 57.695 1.410 -11.398 1.00 15.00 C ATOM 1143 O ASP A 71 57.425 0.234 -11.557 1.00 15.00 O ATOM 1144 CB ASP A 71 59.606 2.365 -12.761 1.00 15.00 C ATOM 1145 CG ASP A 71 60.270 2.906 -11.488 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.497 2.120 -10.582 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.542 4.093 -11.443 1.00 15.00 O ATOM 0 H ASP A 71 58.355 4.342 -12.006 1.00 15.00 H new ATOM 0 HA ASP A 71 57.601 1.865 -13.467 1.00 15.00 H new ATOM 0 HB2 ASP A 71 59.995 1.372 -12.987 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.855 3.005 -13.608 1.00 15.00 H new ATOM 1152 N ILE A 72 57.669 1.966 -10.209 1.00 15.00 N ATOM 1153 CA ILE A 72 57.309 1.154 -8.998 1.00 15.00 C ATOM 1154 C ILE A 72 55.843 0.709 -9.087 1.00 15.00 C ATOM 1155 O ILE A 72 54.984 1.458 -9.515 1.00 15.00 O ATOM 1156 CB ILE A 72 57.522 2.086 -7.790 1.00 15.00 C ATOM 1157 CG1 ILE A 72 58.990 2.528 -7.725 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.171 1.345 -6.494 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.110 3.755 -6.817 1.00 15.00 C ATOM 0 H ILE A 72 57.881 2.946 -10.023 1.00 15.00 H new ATOM 0 HA ILE A 72 57.917 0.253 -8.914 1.00 15.00 H new ATOM 0 HB ILE A 72 56.879 2.959 -7.903 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.609 1.717 -7.343 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.355 2.764 -8.725 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.323 2.009 -5.643 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.128 1.030 -6.526 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.812 0.469 -6.391 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.152 4.071 -6.769 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.503 4.566 -7.219 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.761 3.502 -5.816 1.00 15.00 H new ATOM 1171 N LYS A 73 55.559 -0.505 -8.684 1.00 15.00 N ATOM 1172 CA LYS A 73 54.156 -1.016 -8.744 1.00 15.00 C ATOM 1173 C LYS A 73 53.566 -1.118 -7.335 1.00 15.00 C ATOM 1174 O LYS A 73 52.424 -0.762 -7.107 1.00 15.00 O ATOM 1175 CB LYS A 73 54.266 -2.402 -9.380 1.00 15.00 C ATOM 1176 CG LYS A 73 52.868 -2.924 -9.717 1.00 15.00 C ATOM 1177 CD LYS A 73 52.975 -4.333 -10.301 1.00 15.00 C ATOM 1178 CE LYS A 73 51.596 -4.797 -10.776 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.742 -6.260 -11.012 1.00 15.00 N ATOM 0 H LYS A 73 56.242 -1.166 -8.315 1.00 15.00 H new ATOM 0 HA LYS A 73 53.502 -0.356 -9.314 1.00 15.00 H new ATOM 0 HB2 LYS A 73 54.874 -2.352 -10.283 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.767 -3.088 -8.697 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.248 -2.937 -8.821 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.383 -2.259 -10.431 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.679 -4.340 -11.133 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.363 -5.021 -9.549 1.00 15.00 H new ATOM 0 HE2 LYS A 73 50.831 -4.592 -10.027 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.297 -4.278 -11.687 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.836 -6.651 -11.340 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.472 -6.424 -11.734 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 52.020 -6.728 -10.126 1.00 15.00 H new ATOM 1193 N ASP A 74 54.337 -1.600 -6.390 1.00 15.00 N ATOM 1194 CA ASP A 74 53.810 -1.773 -4.998 1.00 15.00 C ATOM 1195 C ASP A 74 54.863 -1.357 -3.966 1.00 15.00 C ATOM 1196 O ASP A 74 56.046 -1.551 -4.166 1.00 15.00 O ATOM 1197 CB ASP A 74 53.501 -3.266 -4.876 1.00 15.00 C ATOM 1198 CG ASP A 74 52.718 -3.523 -3.588 1.00 15.00 C ATOM 1199 OD1 ASP A 74 51.790 -2.777 -3.322 1.00 15.00 O ATOM 1200 OD2 ASP A 74 53.059 -4.463 -2.889 1.00 15.00 O ATOM 0 H ASP A 74 55.309 -1.881 -6.522 1.00 15.00 H new ATOM 0 HA ASP A 74 52.931 -1.155 -4.814 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.923 -3.600 -5.738 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.427 -3.840 -4.871 1.00 15.00 H new ATOM 1205 N LEU A 75 54.434 -0.786 -2.864 1.00 15.00 N ATOM 1206 CA LEU A 75 55.397 -0.360 -1.802 1.00 15.00 C ATOM 1207 C LEU A 75 54.909 -0.827 -0.424 1.00 15.00 C ATOM 1208 O LEU A 75 53.770 -0.605 -0.056 1.00 15.00 O ATOM 1209 CB LEU A 75 55.410 1.169 -1.874 1.00 15.00 C ATOM 1210 CG LEU A 75 56.608 1.712 -1.091 1.00 15.00 C ATOM 1211 CD1 LEU A 75 56.970 3.104 -1.613 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.249 1.804 0.395 1.00 15.00 C ATOM 0 H LEU A 75 53.454 -0.597 -2.656 1.00 15.00 H new ATOM 0 HA LEU A 75 56.389 -0.786 -1.949 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.465 1.493 -2.913 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.483 1.570 -1.464 1.00 15.00 H new ATOM 0 HG LEU A 75 57.458 1.042 -1.219 1.00 15.00 H new ATOM 0 HD11 LEU A 75 57.823 3.491 -1.056 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.226 3.041 -2.671 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.119 3.773 -1.485 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.102 2.191 0.952 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.398 2.474 0.523 1.00 15.00 H new ATOM 0 HD23 LEU A 75 55.990 0.813 0.769 1.00 15.00 H new ATOM 1224 N THR A 76 55.766 -1.471 0.333 1.00 15.00 N ATOM 1225 CA THR A 76 55.375 -1.931 1.703 1.00 15.00 C ATOM 1226 C THR A 76 56.434 -1.506 2.727 1.00 15.00 C ATOM 1227 O THR A 76 57.617 -1.524 2.448 1.00 15.00 O ATOM 1228 CB THR A 76 55.307 -3.456 1.602 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.511 -3.820 0.484 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.690 -4.028 2.879 1.00 15.00 C ATOM 0 H THR A 76 56.722 -1.698 0.060 1.00 15.00 H new ATOM 0 HA THR A 76 54.428 -1.501 2.030 1.00 15.00 H new ATOM 0 HB THR A 76 56.313 -3.857 1.478 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.468 -4.797 0.417 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.642 -5.114 2.805 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.303 -3.749 3.736 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.684 -3.629 3.007 1.00 15.00 H new