USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 910 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 69 TYR OH : rot 117:sc= 0.818 USER MOD Set 1.2: A 114 THR OG1 : rot -84:sc= 1.26 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -164:sc= -0.149 (180deg=-0.622) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 ASN : amide:sc= -0.514 K(o=-0.51,f=-2.1!) USER MOD Single : A 45 MET CE :methyl -166:sc= -0.317 (180deg=-1.32) USER MOD Single : A 47 LYS NZ :NH3+ -168:sc= -0.044 (180deg=-0.265) USER MOD Single : A 48 TYR OH : rot -142:sc= 0.327 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.958 K(o=-0.96,f=-0.0057) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 0.551 K(o=0.55,f=-0.014) USER MOD Single : A 71 SER OG : rot 84:sc= 0.843 USER MOD Single : A 75 LYS NZ :NH3+ -165:sc= -0.0422 (180deg=-0.291) USER MOD Single : A 76 TYR OH : rot 165:sc= -0.222 USER MOD Single : A 80 GLN : amide:sc= -5.79! C(o=-5.8!,f=-8!) USER MOD Single : A 83 GLN : amide:sc= -0.795 K(o=-0.8,f=-5!) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot -82:sc= 1.11 USER MOD Single : A 95 THR OG1 : rot -6:sc= -0.787 USER MOD Single : A 96 THR OG1 : rot 83:sc= 0.587 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 99 HIS : no HE2:sc= -2.14 K(o=-2.1,f=-2.8!) USER MOD Single : A 100 HIS : no HE2:sc= -0.286 K(o=-0.29,f=-1.4) USER MOD Single : A 101 LYS NZ :NH3+ -164:sc= -0.0652 (180deg=-0.317) USER MOD Single : A 111 MET CE :methyl 141:sc= -0.299 (180deg=-3.26!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 162:sc= -0.0923 (180deg=-0.549) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 242 N ALA A 19 20.190 2.083 5.452 1.00 0.00 N ATOM 243 CA ALA A 19 19.449 3.325 5.649 1.00 0.00 C ATOM 244 C ALA A 19 18.451 3.568 4.520 1.00 0.00 C ATOM 245 O ALA A 19 17.477 4.301 4.690 1.00 0.00 O ATOM 246 CB ALA A 19 20.411 4.497 5.763 1.00 0.00 C ATOM 0 HA ALA A 19 18.884 3.233 6.577 1.00 0.00 H new ATOM 0 HB1 ALA A 19 19.847 5.418 5.910 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.077 4.340 6.612 1.00 0.00 H new ATOM 0 HB3 ALA A 19 21.000 4.574 4.849 1.00 0.00 H new ATOM 252 N GLU A 20 18.702 2.950 3.368 1.00 0.00 N ATOM 253 CA GLU A 20 17.833 3.110 2.205 1.00 0.00 C ATOM 254 C GLU A 20 16.387 2.755 2.541 1.00 0.00 C ATOM 255 O GLU A 20 15.466 3.501 2.207 1.00 0.00 O ATOM 256 CB GLU A 20 18.328 2.234 1.053 1.00 0.00 C ATOM 257 CG GLU A 20 17.543 2.421 -0.235 1.00 0.00 C ATOM 258 CD GLU A 20 17.702 3.812 -0.818 1.00 0.00 C ATOM 259 OE1 GLU A 20 16.934 4.713 -0.419 1.00 0.00 O ATOM 260 OE2 GLU A 20 18.592 4.000 -1.673 1.00 0.00 O ATOM 0 H GLU A 20 19.500 2.334 3.215 1.00 0.00 H new ATOM 0 HA GLU A 20 17.866 4.157 1.904 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.378 2.456 0.864 1.00 0.00 H new ATOM 0 HB3 GLU A 20 18.273 1.188 1.354 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.873 1.684 -0.967 1.00 0.00 H new ATOM 0 HG3 GLU A 20 16.487 2.230 -0.044 1.00 0.00 H new ATOM 267 N PHE A 21 16.189 1.617 3.203 1.00 0.00 N ATOM 268 CA PHE A 21 14.846 1.180 3.575 1.00 0.00 C ATOM 269 C PHE A 21 14.170 2.219 4.463 1.00 0.00 C ATOM 270 O PHE A 21 13.003 2.554 4.261 1.00 0.00 O ATOM 271 CB PHE A 21 14.897 -0.172 4.298 1.00 0.00 C ATOM 272 CG PHE A 21 13.550 -0.825 4.459 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.661 -0.389 5.431 1.00 0.00 C ATOM 274 CD2 PHE A 21 13.174 -1.878 3.639 1.00 0.00 C ATOM 275 CE1 PHE A 21 11.425 -0.990 5.580 1.00 0.00 C ATOM 276 CE2 PHE A 21 11.938 -2.483 3.785 1.00 0.00 C ATOM 277 CZ PHE A 21 11.064 -2.038 4.756 1.00 0.00 C ATOM 0 H PHE A 21 16.936 0.985 3.491 1.00 0.00 H new ATOM 0 HA PHE A 21 14.263 1.066 2.661 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.553 -0.845 3.745 1.00 0.00 H new ATOM 0 HB3 PHE A 21 15.342 -0.030 5.283 1.00 0.00 H new ATOM 0 HD1 PHE A 21 12.938 0.430 6.079 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.854 -2.230 2.877 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.742 -0.640 6.340 1.00 0.00 H new ATOM 0 HE2 PHE A 21 11.658 -3.302 3.140 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.099 -2.509 4.871 1.00 0.00 H new ATOM 287 N ASP A 22 14.911 2.725 5.444 1.00 0.00 N ATOM 288 CA ASP A 22 14.384 3.725 6.366 1.00 0.00 C ATOM 289 C ASP A 22 13.871 4.945 5.610 1.00 0.00 C ATOM 290 O ASP A 22 12.814 5.489 5.934 1.00 0.00 O ATOM 291 CB ASP A 22 15.462 4.143 7.368 1.00 0.00 C ATOM 292 CG ASP A 22 15.977 2.973 8.181 1.00 0.00 C ATOM 293 OD1 ASP A 22 15.387 2.683 9.244 1.00 0.00 O ATOM 294 OD2 ASP A 22 16.970 2.346 7.756 1.00 0.00 O ATOM 0 H ASP A 22 15.880 2.458 5.621 1.00 0.00 H new ATOM 0 HA ASP A 22 13.549 3.281 6.908 1.00 0.00 H new ATOM 0 HB2 ASP A 22 16.292 4.604 6.833 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.056 4.899 8.040 1.00 0.00 H new ATOM 299 N ALA A 23 14.628 5.372 4.605 1.00 0.00 N ATOM 300 CA ALA A 23 14.245 6.524 3.798 1.00 0.00 C ATOM 301 C ALA A 23 12.879 6.304 3.160 1.00 0.00 C ATOM 302 O ALA A 23 12.029 7.195 3.163 1.00 0.00 O ATOM 303 CB ALA A 23 15.293 6.792 2.728 1.00 0.00 C ATOM 0 H ALA A 23 15.509 4.938 4.330 1.00 0.00 H new ATOM 0 HA ALA A 23 14.182 7.395 4.451 1.00 0.00 H new ATOM 0 HB1 ALA A 23 14.993 7.655 2.133 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.254 6.994 3.202 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.384 5.919 2.081 1.00 0.00 H new ATOM 309 N VAL A 24 12.676 5.107 2.616 1.00 0.00 N ATOM 310 CA VAL A 24 11.410 4.765 1.978 1.00 0.00 C ATOM 311 C VAL A 24 10.258 4.862 2.972 1.00 0.00 C ATOM 312 O VAL A 24 9.178 5.348 2.637 1.00 0.00 O ATOM 313 CB VAL A 24 11.443 3.344 1.384 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.169 3.064 0.601 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.669 3.162 0.504 1.00 0.00 C ATOM 0 H VAL A 24 13.370 4.360 2.605 1.00 0.00 H new ATOM 0 HA VAL A 24 11.256 5.481 1.171 1.00 0.00 H new ATOM 0 HB VAL A 24 11.504 2.628 2.204 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.210 2.056 0.188 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.308 3.150 1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.075 3.785 -0.211 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.675 2.152 0.093 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.642 3.885 -0.311 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.570 3.318 1.098 1.00 0.00 H new ATOM 325 N VAL A 25 10.496 4.392 4.196 1.00 0.00 N ATOM 326 CA VAL A 25 9.479 4.433 5.241 1.00 0.00 C ATOM 327 C VAL A 25 8.991 5.860 5.457 1.00 0.00 C ATOM 328 O VAL A 25 7.795 6.098 5.636 1.00 0.00 O ATOM 329 CB VAL A 25 10.014 3.869 6.572 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.941 3.923 7.650 1.00 0.00 C ATOM 331 CG2 VAL A 25 10.515 2.445 6.382 1.00 0.00 C ATOM 0 H VAL A 25 11.383 3.980 4.486 1.00 0.00 H new ATOM 0 HA VAL A 25 8.648 3.810 4.909 1.00 0.00 H new ATOM 0 HB VAL A 25 10.851 4.488 6.896 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.340 3.520 8.581 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.632 4.957 7.805 1.00 0.00 H new ATOM 0 HG13 VAL A 25 8.081 3.331 7.337 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.889 2.061 7.331 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.697 1.815 6.033 1.00 0.00 H new ATOM 0 HG23 VAL A 25 11.318 2.437 5.645 1.00 0.00 H new ATOM 341 N GLY A 26 9.926 6.806 5.442 1.00 0.00 N ATOM 342 CA GLY A 26 9.568 8.199 5.624 1.00 0.00 C ATOM 343 C GLY A 26 8.653 8.693 4.524 1.00 0.00 C ATOM 344 O GLY A 26 7.663 9.377 4.788 1.00 0.00 O ATOM 0 H GLY A 26 10.922 6.632 5.307 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.077 8.325 6.589 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.472 8.807 5.645 1.00 0.00 H new ATOM 348 N TYR A 27 8.984 8.340 3.283 1.00 0.00 N ATOM 349 CA TYR A 27 8.181 8.743 2.137 1.00 0.00 C ATOM 350 C TYR A 27 6.770 8.179 2.248 1.00 0.00 C ATOM 351 O TYR A 27 5.794 8.860 1.938 1.00 0.00 O ATOM 352 CB TYR A 27 8.831 8.277 0.831 1.00 0.00 C ATOM 353 CG TYR A 27 10.150 8.953 0.527 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.247 10.338 0.474 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.297 8.205 0.288 1.00 0.00 C ATOM 356 CE1 TYR A 27 11.449 10.959 0.193 1.00 0.00 C ATOM 357 CE2 TYR A 27 12.503 8.820 0.008 1.00 0.00 C ATOM 358 CZ TYR A 27 12.573 10.196 -0.039 1.00 0.00 C ATOM 359 OH TYR A 27 13.771 10.812 -0.318 1.00 0.00 O ATOM 0 H TYR A 27 9.802 7.777 3.049 1.00 0.00 H new ATOM 0 HA TYR A 27 8.124 9.831 2.129 1.00 0.00 H new ATOM 0 HB2 TYR A 27 8.989 7.200 0.880 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.141 8.461 0.007 1.00 0.00 H new ATOM 0 HD1 TYR A 27 9.368 10.939 0.655 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.245 7.127 0.322 1.00 0.00 H new ATOM 0 HE1 TYR A 27 11.507 12.037 0.155 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.386 8.225 -0.173 1.00 0.00 H new ATOM 0 HH TYR A 27 14.464 10.133 -0.455 1.00 0.00 H new ATOM 369 N LEU A 28 6.674 6.928 2.695 1.00 0.00 N ATOM 370 CA LEU A 28 5.383 6.267 2.851 1.00 0.00 C ATOM 371 C LEU A 28 4.469 7.073 3.768 1.00 0.00 C ATOM 372 O LEU A 28 3.285 7.245 3.483 1.00 0.00 O ATOM 373 CB LEU A 28 5.573 4.854 3.409 1.00 0.00 C ATOM 374 CG LEU A 28 6.281 3.875 2.468 1.00 0.00 C ATOM 375 CD1 LEU A 28 6.579 2.567 3.184 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.435 3.621 1.227 1.00 0.00 C ATOM 0 H LEU A 28 7.476 6.353 2.955 1.00 0.00 H new ATOM 0 HA LEU A 28 4.914 6.200 1.869 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.143 4.920 4.336 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.595 4.446 3.664 1.00 0.00 H new ATOM 0 HG LEU A 28 7.226 4.321 2.157 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.082 1.884 2.500 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.223 2.760 4.042 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.646 2.118 3.524 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.954 2.923 0.570 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.475 3.197 1.522 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.270 4.561 0.700 1.00 0.00 H new ATOM 388 N GLU A 29 5.029 7.570 4.869 1.00 0.00 N ATOM 389 CA GLU A 29 4.262 8.364 5.822 1.00 0.00 C ATOM 390 C GLU A 29 3.696 9.609 5.149 1.00 0.00 C ATOM 391 O GLU A 29 2.522 9.939 5.319 1.00 0.00 O ATOM 392 CB GLU A 29 5.134 8.767 7.014 1.00 0.00 C ATOM 393 CG GLU A 29 5.620 7.589 7.844 1.00 0.00 C ATOM 394 CD GLU A 29 6.471 8.020 9.021 1.00 0.00 C ATOM 395 OE1 GLU A 29 5.898 8.303 10.094 1.00 0.00 O ATOM 396 OE2 GLU A 29 7.710 8.076 8.871 1.00 0.00 O ATOM 0 H GLU A 29 6.008 7.437 5.121 1.00 0.00 H new ATOM 0 HA GLU A 29 3.435 7.752 6.183 1.00 0.00 H new ATOM 0 HB2 GLU A 29 5.997 9.323 6.649 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.567 9.442 7.655 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.761 7.026 8.208 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.197 6.915 7.210 1.00 0.00 H new ATOM 403 N ASP A 30 4.540 10.297 4.385 1.00 0.00 N ATOM 404 CA ASP A 30 4.119 11.503 3.680 1.00 0.00 C ATOM 405 C ASP A 30 2.945 11.202 2.753 1.00 0.00 C ATOM 406 O ASP A 30 2.079 12.050 2.538 1.00 0.00 O ATOM 407 CB ASP A 30 5.285 12.091 2.882 1.00 0.00 C ATOM 408 CG ASP A 30 4.917 13.389 2.190 1.00 0.00 C ATOM 409 OD1 ASP A 30 4.373 13.330 1.067 1.00 0.00 O ATOM 410 OD2 ASP A 30 5.174 14.465 2.771 1.00 0.00 O ATOM 0 H ASP A 30 5.516 10.041 4.239 1.00 0.00 H new ATOM 0 HA ASP A 30 3.797 12.236 4.420 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.128 12.266 3.551 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.614 11.366 2.137 1.00 0.00 H new ATOM 415 N ILE A 31 2.924 9.989 2.206 1.00 0.00 N ATOM 416 CA ILE A 31 1.853 9.574 1.307 1.00 0.00 C ATOM 417 C ILE A 31 0.532 9.449 2.058 1.00 0.00 C ATOM 418 O ILE A 31 -0.504 9.916 1.588 1.00 0.00 O ATOM 419 CB ILE A 31 2.172 8.226 0.628 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.493 8.314 -0.137 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.038 7.820 -0.305 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.022 6.970 -0.591 1.00 0.00 C ATOM 0 H ILE A 31 3.636 9.278 2.370 1.00 0.00 H new ATOM 0 HA ILE A 31 1.767 10.344 0.540 1.00 0.00 H new ATOM 0 HB ILE A 31 2.272 7.463 1.400 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.356 8.954 -1.008 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.239 8.793 0.497 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.278 6.867 -0.776 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.115 7.720 0.266 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.908 8.582 -1.073 1.00 0.00 H new ATOM 0 HD11 ILE A 31 4.961 7.111 -1.126 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.191 6.333 0.277 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.295 6.497 -1.251 1.00 0.00 H new ATOM 434 N ILE A 32 0.577 8.818 3.227 1.00 0.00 N ATOM 435 CA ILE A 32 -0.618 8.629 4.043 1.00 0.00 C ATOM 436 C ILE A 32 -1.281 9.965 4.370 1.00 0.00 C ATOM 437 O ILE A 32 -2.508 10.075 4.373 1.00 0.00 O ATOM 438 CB ILE A 32 -0.291 7.895 5.359 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.419 6.571 5.068 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.562 7.655 6.163 1.00 0.00 C ATOM 441 CD1 ILE A 32 0.946 5.877 6.308 1.00 0.00 C ATOM 0 H ILE A 32 1.429 8.428 3.631 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.306 8.020 3.457 1.00 0.00 H new ATOM 0 HB ILE A 32 0.377 8.522 5.950 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.273 5.903 4.555 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.249 6.756 4.386 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.314 7.136 7.089 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -2.030 8.611 6.397 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -2.252 7.046 5.579 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.436 4.946 6.023 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.663 6.526 6.811 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.118 5.659 6.983 1.00 0.00 H new ATOM 453 N MET A 33 -0.465 10.979 4.644 1.00 0.00 N ATOM 454 CA MET A 33 -0.978 12.303 4.978 1.00 0.00 C ATOM 455 C MET A 33 -0.997 13.217 3.755 1.00 0.00 C ATOM 456 O MET A 33 -1.240 14.418 3.873 1.00 0.00 O ATOM 457 CB MET A 33 -0.132 12.934 6.087 1.00 0.00 C ATOM 458 CG MET A 33 -0.073 12.101 7.357 1.00 0.00 C ATOM 459 SD MET A 33 -1.699 11.830 8.091 1.00 0.00 S ATOM 460 CE MET A 33 -2.212 13.514 8.422 1.00 0.00 C ATOM 0 H MET A 33 0.553 10.909 4.641 1.00 0.00 H new ATOM 0 HA MET A 33 -2.003 12.185 5.329 1.00 0.00 H new ATOM 0 HB2 MET A 33 0.881 13.088 5.716 1.00 0.00 H new ATOM 0 HB3 MET A 33 -0.537 13.917 6.326 1.00 0.00 H new ATOM 0 HG2 MET A 33 0.385 11.137 7.133 1.00 0.00 H new ATOM 0 HG3 MET A 33 0.570 12.599 8.083 1.00 0.00 H new ATOM 0 HE1 MET A 33 -3.049 13.509 9.120 1.00 0.00 H new ATOM 0 HE2 MET A 33 -1.381 14.069 8.857 1.00 0.00 H new ATOM 0 HE3 MET A 33 -2.519 13.991 7.491 1.00 0.00 H new ATOM 470 N ASP A 34 -0.741 12.644 2.583 1.00 0.00 N ATOM 471 CA ASP A 34 -0.734 13.414 1.343 1.00 0.00 C ATOM 472 C ASP A 34 -2.158 13.779 0.925 1.00 0.00 C ATOM 473 O ASP A 34 -3.056 12.937 0.948 1.00 0.00 O ATOM 474 CB ASP A 34 -0.046 12.623 0.229 1.00 0.00 C ATOM 475 CG ASP A 34 0.067 13.415 -1.058 1.00 0.00 C ATOM 476 OD1 ASP A 34 -0.869 13.346 -1.879 1.00 0.00 O ATOM 477 OD2 ASP A 34 1.093 14.104 -1.244 1.00 0.00 O ATOM 0 H ASP A 34 -0.536 11.652 2.465 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.178 14.335 1.517 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.950 12.327 0.559 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.604 11.706 0.040 1.00 0.00 H new ATOM 482 N ASP A 35 -2.353 15.040 0.544 1.00 0.00 N ATOM 483 CA ASP A 35 -3.666 15.523 0.126 1.00 0.00 C ATOM 484 C ASP A 35 -4.232 14.682 -1.014 1.00 0.00 C ATOM 485 O ASP A 35 -5.359 14.193 -0.935 1.00 0.00 O ATOM 486 CB ASP A 35 -3.580 16.989 -0.303 1.00 0.00 C ATOM 487 CG ASP A 35 -4.918 17.537 -0.756 1.00 0.00 C ATOM 488 OD1 ASP A 35 -5.673 18.044 0.099 1.00 0.00 O ATOM 489 OD2 ASP A 35 -5.212 17.459 -1.968 1.00 0.00 O ATOM 0 H ASP A 35 -1.617 15.746 0.516 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.339 15.435 0.979 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.208 17.587 0.529 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -2.857 17.086 -1.113 1.00 0.00 H new ATOM 494 N GLU A 36 -3.446 14.520 -2.074 1.00 0.00 N ATOM 495 CA GLU A 36 -3.871 13.741 -3.233 1.00 0.00 C ATOM 496 C GLU A 36 -4.230 12.313 -2.834 1.00 0.00 C ATOM 497 O GLU A 36 -5.060 11.670 -3.476 1.00 0.00 O ATOM 498 CB GLU A 36 -2.769 13.721 -4.296 1.00 0.00 C ATOM 499 CG GLU A 36 -2.422 15.097 -4.838 1.00 0.00 C ATOM 500 CD GLU A 36 -1.235 15.070 -5.780 1.00 0.00 C ATOM 501 OE1 GLU A 36 -1.443 14.861 -6.994 1.00 0.00 O ATOM 502 OE2 GLU A 36 -0.095 15.258 -5.305 1.00 0.00 O ATOM 0 H GLU A 36 -2.510 14.918 -2.155 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.760 14.217 -3.647 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.872 13.271 -3.870 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.084 13.083 -5.122 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.287 15.506 -5.361 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.206 15.767 -4.006 1.00 0.00 H new ATOM 509 N PHE A 37 -3.604 11.825 -1.768 1.00 0.00 N ATOM 510 CA PHE A 37 -3.855 10.471 -1.286 1.00 0.00 C ATOM 511 C PHE A 37 -5.166 10.399 -0.510 1.00 0.00 C ATOM 512 O PHE A 37 -5.865 9.387 -0.551 1.00 0.00 O ATOM 513 CB PHE A 37 -2.699 10.000 -0.405 1.00 0.00 C ATOM 514 CG PHE A 37 -2.841 8.582 0.074 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.610 7.519 -0.785 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.206 8.314 1.384 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.740 6.215 -0.345 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.337 7.012 1.829 1.00 0.00 C ATOM 519 CZ PHE A 37 -3.104 5.961 0.962 1.00 0.00 C ATOM 0 H PHE A 37 -2.919 12.347 -1.221 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.934 9.814 -2.152 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.767 10.094 -0.963 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.621 10.660 0.459 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.325 7.712 -1.809 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.390 9.132 2.065 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.557 5.395 -1.024 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.621 6.816 2.852 1.00 0.00 H new ATOM 0 HZ PHE A 37 -3.207 4.943 1.307 1.00 0.00 H new ATOM 529 N GLN A 38 -5.493 11.475 0.199 1.00 0.00 N ATOM 530 CA GLN A 38 -6.724 11.528 0.982 1.00 0.00 C ATOM 531 C GLN A 38 -7.949 11.536 0.073 1.00 0.00 C ATOM 532 O GLN A 38 -8.905 10.792 0.298 1.00 0.00 O ATOM 533 CB GLN A 38 -6.731 12.768 1.881 1.00 0.00 C ATOM 534 CG GLN A 38 -5.683 12.728 2.981 1.00 0.00 C ATOM 535 CD GLN A 38 -5.649 14.001 3.804 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.667 14.673 3.972 1.00 0.00 O ATOM 537 NE2 GLN A 38 -4.474 14.338 4.323 1.00 0.00 N ATOM 0 H GLN A 38 -4.925 12.320 0.248 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.765 10.636 1.607 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.567 13.653 1.266 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.717 12.873 2.334 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -5.883 11.881 3.637 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -4.702 12.561 2.536 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.656 13.751 4.158 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -4.389 15.184 4.887 1.00 0.00 H new ATOM 546 N LEU A 39 -7.915 12.381 -0.952 1.00 0.00 N ATOM 547 CA LEU A 39 -9.022 12.486 -1.896 1.00 0.00 C ATOM 548 C LEU A 39 -9.141 11.222 -2.743 1.00 0.00 C ATOM 549 O LEU A 39 -10.236 10.692 -2.930 1.00 0.00 O ATOM 550 CB LEU A 39 -8.828 13.704 -2.804 1.00 0.00 C ATOM 551 CG LEU A 39 -9.949 13.948 -3.817 1.00 0.00 C ATOM 552 CD1 LEU A 39 -11.246 14.303 -3.107 1.00 0.00 C ATOM 553 CD2 LEU A 39 -9.552 15.048 -4.789 1.00 0.00 C ATOM 0 H LEU A 39 -7.132 13.004 -1.150 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.943 12.606 -1.325 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.726 14.591 -2.178 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.890 13.587 -3.346 1.00 0.00 H new ATOM 0 HG LEU A 39 -10.111 13.029 -4.381 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -12.030 14.473 -3.845 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.537 13.484 -2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -11.102 15.208 -2.517 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.359 15.211 -5.504 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.364 15.970 -4.238 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.649 14.753 -5.323 1.00 0.00 H new ATOM 565 N LEU A 40 -8.010 10.748 -3.252 1.00 0.00 N ATOM 566 CA LEU A 40 -7.981 9.548 -4.084 1.00 0.00 C ATOM 567 C LEU A 40 -8.486 8.329 -3.315 1.00 0.00 C ATOM 568 O LEU A 40 -9.215 7.499 -3.859 1.00 0.00 O ATOM 569 CB LEU A 40 -6.558 9.288 -4.583 1.00 0.00 C ATOM 570 CG LEU A 40 -6.389 8.040 -5.453 1.00 0.00 C ATOM 571 CD1 LEU A 40 -6.958 8.275 -6.844 1.00 0.00 C ATOM 572 CD2 LEU A 40 -4.924 7.642 -5.532 1.00 0.00 C ATOM 0 H LEU A 40 -7.097 11.177 -3.103 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.641 9.715 -4.935 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.226 10.156 -5.153 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.898 9.202 -3.720 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.943 7.222 -4.993 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.828 7.376 -7.447 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.020 8.511 -6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -6.435 9.107 -7.315 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.822 6.753 -6.154 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.348 8.458 -5.968 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.550 7.429 -4.530 1.00 0.00 H new ATOM 584 N GLN A 41 -8.092 8.228 -2.050 1.00 0.00 N ATOM 585 CA GLN A 41 -8.494 7.104 -1.210 1.00 0.00 C ATOM 586 C GLN A 41 -10.000 7.104 -0.961 1.00 0.00 C ATOM 587 O GLN A 41 -10.665 6.081 -1.124 1.00 0.00 O ATOM 588 CB GLN A 41 -7.746 7.143 0.127 1.00 0.00 C ATOM 589 CG GLN A 41 -8.120 6.009 1.068 1.00 0.00 C ATOM 590 CD GLN A 41 -7.360 6.062 2.380 1.00 0.00 C ATOM 591 OE1 GLN A 41 -7.798 6.700 3.338 1.00 0.00 O ATOM 592 NE2 GLN A 41 -6.217 5.387 2.432 1.00 0.00 N ATOM 0 H GLN A 41 -7.495 8.911 -1.583 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.237 6.187 -1.740 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.674 7.106 -0.065 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.949 8.094 0.619 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.190 6.049 1.271 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.924 5.056 0.577 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.891 4.872 1.614 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.665 5.384 3.290 1.00 0.00 H new ATOM 601 N ARG A 42 -10.536 8.252 -0.563 1.00 0.00 N ATOM 602 CA ARG A 42 -11.964 8.368 -0.289 1.00 0.00 C ATOM 603 C ARG A 42 -12.784 8.257 -1.571 1.00 0.00 C ATOM 604 O ARG A 42 -13.907 7.751 -1.557 1.00 0.00 O ATOM 605 CB ARG A 42 -12.267 9.696 0.406 1.00 0.00 C ATOM 606 CG ARG A 42 -13.716 9.836 0.840 1.00 0.00 C ATOM 607 CD ARG A 42 -13.997 11.213 1.415 1.00 0.00 C ATOM 608 NE ARG A 42 -13.787 12.271 0.430 1.00 0.00 N ATOM 609 CZ ARG A 42 -13.973 13.562 0.682 1.00 0.00 C ATOM 610 NH1 ARG A 42 -14.365 13.958 1.885 1.00 0.00 N ATOM 611 NH2 ARG A 42 -13.768 14.463 -0.271 1.00 0.00 N ATOM 0 H ARG A 42 -10.006 9.112 -0.423 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.244 7.546 0.370 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.623 9.795 1.280 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.017 10.515 -0.268 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.371 9.657 -0.013 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -13.948 9.075 1.586 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -15.025 11.252 1.776 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.350 11.385 2.275 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.480 12.003 -0.505 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.525 13.270 2.621 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.507 14.950 2.074 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.467 14.165 -1.199 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.911 15.454 -0.075 1.00 0.00 H new ATOM 625 N ASN A 43 -12.219 8.730 -2.676 1.00 0.00 N ATOM 626 CA ASN A 43 -12.904 8.692 -3.964 1.00 0.00 C ATOM 627 C ASN A 43 -13.139 7.255 -4.423 1.00 0.00 C ATOM 628 O ASN A 43 -14.237 6.905 -4.856 1.00 0.00 O ATOM 629 CB ASN A 43 -12.094 9.453 -5.017 1.00 0.00 C ATOM 630 CG ASN A 43 -12.864 9.661 -6.308 1.00 0.00 C ATOM 631 OD1 ASN A 43 -13.717 8.854 -6.676 1.00 0.00 O ATOM 632 ND2 ASN A 43 -12.566 10.752 -7.005 1.00 0.00 N ATOM 0 H ASN A 43 -11.288 9.145 -2.706 1.00 0.00 H new ATOM 0 HA ASN A 43 -13.875 9.173 -3.842 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.800 10.422 -4.613 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.176 8.905 -5.230 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.051 10.946 -7.881 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.852 11.396 -6.664 1.00 0.00 H new ATOM 639 N PHE A 44 -12.104 6.426 -4.326 1.00 0.00 N ATOM 640 CA PHE A 44 -12.202 5.032 -4.744 1.00 0.00 C ATOM 641 C PHE A 44 -12.999 4.208 -3.734 1.00 0.00 C ATOM 642 O PHE A 44 -13.801 3.353 -4.114 1.00 0.00 O ATOM 643 CB PHE A 44 -10.797 4.437 -4.954 1.00 0.00 C ATOM 644 CG PHE A 44 -10.355 3.470 -3.886 1.00 0.00 C ATOM 645 CD1 PHE A 44 -10.680 2.125 -3.967 1.00 0.00 C ATOM 646 CD2 PHE A 44 -9.615 3.911 -2.805 1.00 0.00 C ATOM 647 CE1 PHE A 44 -10.275 1.240 -2.986 1.00 0.00 C ATOM 648 CE2 PHE A 44 -9.206 3.032 -1.820 1.00 0.00 C ATOM 649 CZ PHE A 44 -9.537 1.695 -1.910 1.00 0.00 C ATOM 0 H PHE A 44 -11.190 6.695 -3.962 1.00 0.00 H new ATOM 0 HA PHE A 44 -12.737 4.997 -5.693 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.773 3.928 -5.918 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.076 5.253 -5.007 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -11.256 1.765 -4.806 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -9.353 4.956 -2.729 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -10.535 0.194 -3.060 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.628 3.391 -0.981 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.220 1.006 -1.141 1.00 0.00 H new ATOM 659 N MET A 45 -12.780 4.472 -2.450 1.00 0.00 N ATOM 660 CA MET A 45 -13.474 3.746 -1.393 1.00 0.00 C ATOM 661 C MET A 45 -14.968 4.060 -1.410 1.00 0.00 C ATOM 662 O MET A 45 -15.785 3.266 -0.945 1.00 0.00 O ATOM 663 CB MET A 45 -12.866 4.082 -0.026 1.00 0.00 C ATOM 664 CG MET A 45 -13.516 5.267 0.674 1.00 0.00 C ATOM 665 SD MET A 45 -12.722 5.666 2.244 1.00 0.00 S ATOM 666 CE MET A 45 -12.872 4.108 3.119 1.00 0.00 C ATOM 0 H MET A 45 -12.128 5.182 -2.117 1.00 0.00 H new ATOM 0 HA MET A 45 -13.351 2.678 -1.573 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.944 3.206 0.619 1.00 0.00 H new ATOM 0 HB3 MET A 45 -11.804 4.289 -0.155 1.00 0.00 H new ATOM 0 HG2 MET A 45 -13.476 6.138 0.019 1.00 0.00 H new ATOM 0 HG3 MET A 45 -14.569 5.048 0.849 1.00 0.00 H new ATOM 0 HE1 MET A 45 -12.657 4.262 4.176 1.00 0.00 H new ATOM 0 HE2 MET A 45 -13.886 3.724 3.007 1.00 0.00 H new ATOM 0 HE3 MET A 45 -12.164 3.389 2.706 1.00 0.00 H new ATOM 676 N ASP A 46 -15.312 5.225 -1.949 1.00 0.00 N ATOM 677 CA ASP A 46 -16.706 5.653 -2.034 1.00 0.00 C ATOM 678 C ASP A 46 -17.516 4.717 -2.927 1.00 0.00 C ATOM 679 O ASP A 46 -18.715 4.529 -2.719 1.00 0.00 O ATOM 680 CB ASP A 46 -16.790 7.081 -2.573 1.00 0.00 C ATOM 681 CG ASP A 46 -18.217 7.589 -2.638 1.00 0.00 C ATOM 682 OD1 ASP A 46 -18.878 7.371 -3.676 1.00 0.00 O ATOM 683 OD2 ASP A 46 -18.674 8.203 -1.651 1.00 0.00 O ATOM 0 H ASP A 46 -14.644 5.892 -2.335 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.127 5.621 -1.029 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.200 7.742 -1.938 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.348 7.118 -3.569 1.00 0.00 H new ATOM 688 N LYS A 47 -16.859 4.139 -3.925 1.00 0.00 N ATOM 689 CA LYS A 47 -17.522 3.230 -4.856 1.00 0.00 C ATOM 690 C LYS A 47 -17.369 1.783 -4.400 1.00 0.00 C ATOM 691 O LYS A 47 -18.310 0.991 -4.474 1.00 0.00 O ATOM 692 CB LYS A 47 -16.934 3.406 -6.259 1.00 0.00 C ATOM 693 CG LYS A 47 -17.869 2.977 -7.381 1.00 0.00 C ATOM 694 CD LYS A 47 -17.873 1.467 -7.567 1.00 0.00 C ATOM 695 CE LYS A 47 -18.789 1.051 -8.708 1.00 0.00 C ATOM 696 NZ LYS A 47 -20.198 1.470 -8.468 1.00 0.00 N ATOM 0 H LYS A 47 -15.867 4.283 -4.112 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.585 3.470 -4.879 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.669 4.454 -6.402 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -16.011 2.831 -6.330 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -18.881 3.319 -7.162 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -17.565 3.457 -8.311 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -16.859 1.121 -7.768 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -18.197 0.986 -6.644 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -18.433 1.491 -9.639 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -18.748 -0.031 -8.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -20.822 1.000 -9.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -20.480 1.202 -7.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -20.277 2.501 -8.578 1.00 0.00 H new ATOM 710 N TYR A 48 -16.175 1.448 -3.928 1.00 0.00 N ATOM 711 CA TYR A 48 -15.881 0.098 -3.462 1.00 0.00 C ATOM 712 C TYR A 48 -16.790 -0.315 -2.308 1.00 0.00 C ATOM 713 O TYR A 48 -17.383 -1.392 -2.335 1.00 0.00 O ATOM 714 CB TYR A 48 -14.418 -0.003 -3.031 1.00 0.00 C ATOM 715 CG TYR A 48 -13.458 -0.265 -4.170 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.496 0.499 -5.330 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.511 -1.278 -4.084 1.00 0.00 C ATOM 718 CE1 TYR A 48 -12.619 0.260 -6.371 1.00 0.00 C ATOM 719 CE2 TYR A 48 -11.630 -1.523 -5.118 1.00 0.00 C ATOM 720 CZ TYR A 48 -11.689 -0.751 -6.259 1.00 0.00 C ATOM 721 OH TYR A 48 -10.813 -0.991 -7.291 1.00 0.00 O ATOM 0 H TYR A 48 -15.391 2.096 -3.857 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.066 -0.583 -4.293 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.132 0.924 -2.534 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.321 -0.802 -2.296 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.223 1.293 -5.420 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.463 -1.885 -3.192 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.662 0.862 -7.267 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.899 -2.314 -5.034 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.674 -1.957 -7.384 1.00 0.00 H new ATOM 731 N TYR A 49 -16.897 0.540 -1.293 1.00 0.00 N ATOM 732 CA TYR A 49 -17.728 0.236 -0.131 1.00 0.00 C ATOM 733 C TYR A 49 -19.184 0.007 -0.535 1.00 0.00 C ATOM 734 O TYR A 49 -19.966 -0.561 0.227 1.00 0.00 O ATOM 735 CB TYR A 49 -17.620 1.353 0.919 1.00 0.00 C ATOM 736 CG TYR A 49 -18.779 2.330 0.931 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.808 3.417 0.068 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.839 2.168 1.815 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.862 4.313 0.083 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.895 3.059 1.836 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.902 4.129 0.968 1.00 0.00 C ATOM 742 OH TYR A 49 -21.952 5.020 0.987 1.00 0.00 O ATOM 0 H TYR A 49 -16.423 1.442 -1.252 1.00 0.00 H new ATOM 0 HA TYR A 49 -17.359 -0.689 0.313 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.537 0.898 1.906 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.698 1.907 0.745 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -17.994 3.566 -0.627 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.837 1.331 2.498 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.870 5.153 -0.596 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.711 2.917 2.529 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.602 4.746 1.668 1.00 0.00 H new ATOM 752 N LEU A 50 -19.542 0.448 -1.739 1.00 0.00 N ATOM 753 CA LEU A 50 -20.903 0.279 -2.239 1.00 0.00 C ATOM 754 C LEU A 50 -21.104 -1.124 -2.802 1.00 0.00 C ATOM 755 O LEU A 50 -22.078 -1.801 -2.474 1.00 0.00 O ATOM 756 CB LEU A 50 -21.215 1.325 -3.312 1.00 0.00 C ATOM 757 CG LEU A 50 -21.339 2.763 -2.804 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.468 3.731 -3.968 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.530 2.899 -1.866 1.00 0.00 C ATOM 0 H LEU A 50 -18.911 0.923 -2.384 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.589 0.418 -1.403 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.431 1.290 -4.069 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.147 1.049 -3.805 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.434 3.009 -2.249 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.555 4.749 -3.587 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -20.586 3.656 -4.603 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.356 3.484 -4.550 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.601 3.929 -1.515 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.444 2.632 -2.397 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.399 2.233 -1.013 1.00 0.00 H new ATOM 771 N GLU A 51 -20.177 -1.555 -3.652 1.00 0.00 N ATOM 772 CA GLU A 51 -20.253 -2.881 -4.256 1.00 0.00 C ATOM 773 C GLU A 51 -20.021 -3.967 -3.209 1.00 0.00 C ATOM 774 O GLU A 51 -20.616 -5.043 -3.271 1.00 0.00 O ATOM 775 CB GLU A 51 -19.223 -3.014 -5.380 1.00 0.00 C ATOM 776 CG GLU A 51 -19.440 -2.036 -6.524 1.00 0.00 C ATOM 777 CD GLU A 51 -20.786 -2.219 -7.198 1.00 0.00 C ATOM 778 OE1 GLU A 51 -20.869 -3.021 -8.152 1.00 0.00 O ATOM 779 OE2 GLU A 51 -21.757 -1.560 -6.772 1.00 0.00 O ATOM 0 H GLU A 51 -19.366 -1.007 -3.938 1.00 0.00 H new ATOM 0 HA GLU A 51 -21.252 -3.007 -4.672 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.226 -2.862 -4.967 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.254 -4.031 -5.772 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -19.362 -1.017 -6.146 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -18.648 -2.163 -7.262 1.00 0.00 H new ATOM 786 N PHE A 52 -19.155 -3.671 -2.247 1.00 0.00 N ATOM 787 CA PHE A 52 -18.842 -4.614 -1.181 1.00 0.00 C ATOM 788 C PHE A 52 -19.940 -4.624 -0.123 1.00 0.00 C ATOM 789 O PHE A 52 -19.858 -3.913 0.879 1.00 0.00 O ATOM 790 CB PHE A 52 -17.500 -4.263 -0.536 1.00 0.00 C ATOM 791 CG PHE A 52 -16.309 -4.755 -1.310 1.00 0.00 C ATOM 792 CD1 PHE A 52 -15.952 -4.166 -2.512 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.545 -5.807 -0.831 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.854 -4.617 -3.222 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.448 -6.263 -1.536 1.00 0.00 C ATOM 796 CZ PHE A 52 -14.102 -5.666 -2.733 1.00 0.00 C ATOM 0 H PHE A 52 -18.656 -2.783 -2.184 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.776 -5.609 -1.620 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.431 -3.180 -0.429 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.469 -4.685 0.469 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.538 -3.345 -2.899 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.810 -6.276 0.105 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.585 -4.149 -4.158 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -13.862 -7.085 -1.152 1.00 0.00 H new ATOM 0 HZ PHE A 52 -13.244 -6.020 -3.285 1.00 0.00 H new ATOM 806 N GLU A 53 -20.972 -5.427 -0.359 1.00 0.00 N ATOM 807 CA GLU A 53 -22.087 -5.533 0.574 1.00 0.00 C ATOM 808 C GLU A 53 -22.003 -6.830 1.374 1.00 0.00 C ATOM 809 O GLU A 53 -21.561 -7.857 0.860 1.00 0.00 O ATOM 810 CB GLU A 53 -23.419 -5.466 -0.177 1.00 0.00 C ATOM 811 CG GLU A 53 -23.585 -6.558 -1.222 1.00 0.00 C ATOM 812 CD GLU A 53 -24.896 -6.447 -1.975 1.00 0.00 C ATOM 813 OE1 GLU A 53 -25.904 -7.011 -1.498 1.00 0.00 O ATOM 814 OE2 GLU A 53 -24.917 -5.796 -3.040 1.00 0.00 O ATOM 0 H GLU A 53 -21.059 -6.014 -1.189 1.00 0.00 H new ATOM 0 HA GLU A 53 -22.029 -4.694 1.268 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -24.236 -5.536 0.542 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -23.504 -4.494 -0.663 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -22.758 -6.508 -1.930 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -23.530 -7.532 -0.736 1.00 0.00 H new ATOM 821 N ASP A 54 -22.426 -6.772 2.633 1.00 0.00 N ATOM 822 CA ASP A 54 -22.395 -7.943 3.501 1.00 0.00 C ATOM 823 C ASP A 54 -23.363 -9.015 3.007 1.00 0.00 C ATOM 824 O ASP A 54 -24.547 -9.000 3.345 1.00 0.00 O ATOM 825 CB ASP A 54 -22.739 -7.551 4.938 1.00 0.00 C ATOM 826 CG ASP A 54 -22.798 -8.750 5.864 1.00 0.00 C ATOM 827 OD1 ASP A 54 -21.731 -9.338 6.142 1.00 0.00 O ATOM 828 OD2 ASP A 54 -23.911 -9.102 6.310 1.00 0.00 O ATOM 0 H ASP A 54 -22.793 -5.929 3.074 1.00 0.00 H new ATOM 0 HA ASP A 54 -21.385 -8.353 3.477 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -21.995 -6.846 5.308 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -23.700 -7.037 4.952 1.00 0.00 H new ATOM 833 N THR A 55 -22.849 -9.939 2.202 1.00 0.00 N ATOM 834 CA THR A 55 -23.659 -11.021 1.657 1.00 0.00 C ATOM 835 C THR A 55 -22.850 -12.311 1.566 1.00 0.00 C ATOM 836 O THR A 55 -21.679 -12.345 1.942 1.00 0.00 O ATOM 837 CB THR A 55 -24.206 -10.672 0.260 1.00 0.00 C ATOM 838 OG1 THR A 55 -23.127 -10.318 -0.614 1.00 0.00 O ATOM 839 CG2 THR A 55 -25.202 -9.524 0.333 1.00 0.00 C ATOM 0 H THR A 55 -21.871 -9.959 1.912 1.00 0.00 H new ATOM 0 HA THR A 55 -24.499 -11.163 2.338 1.00 0.00 H new ATOM 0 HB THR A 55 -24.720 -11.550 -0.131 1.00 0.00 H new ATOM 0 HG1 THR A 55 -23.483 -10.099 -1.501 1.00 0.00 H new ATOM 0 HG21 THR A 55 -25.572 -9.299 -0.667 1.00 0.00 H new ATOM 0 HG22 THR A 55 -26.037 -9.807 0.973 1.00 0.00 H new ATOM 0 HG23 THR A 55 -24.711 -8.642 0.745 1.00 0.00 H new ATOM 847 N GLU A 56 -23.482 -13.368 1.064 1.00 0.00 N ATOM 848 CA GLU A 56 -22.816 -14.658 0.922 1.00 0.00 C ATOM 849 C GLU A 56 -22.673 -15.041 -0.548 1.00 0.00 C ATOM 850 O GLU A 56 -22.221 -16.141 -0.870 1.00 0.00 O ATOM 851 CB GLU A 56 -23.588 -15.741 1.677 1.00 0.00 C ATOM 852 CG GLU A 56 -23.624 -15.522 3.182 1.00 0.00 C ATOM 853 CD GLU A 56 -24.308 -16.655 3.920 1.00 0.00 C ATOM 854 OE1 GLU A 56 -23.620 -17.639 4.267 1.00 0.00 O ATOM 855 OE2 GLU A 56 -25.532 -16.561 4.150 1.00 0.00 O ATOM 0 H GLU A 56 -24.452 -13.356 0.750 1.00 0.00 H new ATOM 0 HA GLU A 56 -21.817 -14.572 1.351 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -24.610 -15.779 1.299 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -23.135 -16.711 1.469 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -22.605 -15.414 3.554 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -24.143 -14.588 3.397 1.00 0.00 H new ATOM 862 N GLU A 57 -23.059 -14.130 -1.434 1.00 0.00 N ATOM 863 CA GLU A 57 -22.970 -14.373 -2.870 1.00 0.00 C ATOM 864 C GLU A 57 -21.643 -13.863 -3.422 1.00 0.00 C ATOM 865 O GLU A 57 -21.132 -12.831 -2.988 1.00 0.00 O ATOM 866 CB GLU A 57 -24.137 -13.701 -3.596 1.00 0.00 C ATOM 867 CG GLU A 57 -24.157 -13.958 -5.095 1.00 0.00 C ATOM 868 CD GLU A 57 -25.358 -13.336 -5.778 1.00 0.00 C ATOM 869 OE1 GLU A 57 -25.309 -12.124 -6.077 1.00 0.00 O ATOM 870 OE2 GLU A 57 -26.349 -14.059 -6.012 1.00 0.00 O ATOM 0 H GLU A 57 -23.437 -13.216 -1.184 1.00 0.00 H new ATOM 0 HA GLU A 57 -23.023 -15.449 -3.039 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -25.073 -14.054 -3.164 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -24.091 -12.626 -3.422 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -23.245 -13.561 -5.540 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -24.158 -15.033 -5.275 1.00 0.00 H new ATOM 877 N ASN A 58 -21.091 -14.596 -4.383 1.00 0.00 N ATOM 878 CA ASN A 58 -19.821 -14.223 -4.997 1.00 0.00 C ATOM 879 C ASN A 58 -19.990 -13.985 -6.494 1.00 0.00 C ATOM 880 O ASN A 58 -20.163 -14.929 -7.266 1.00 0.00 O ATOM 881 CB ASN A 58 -18.778 -15.317 -4.758 1.00 0.00 C ATOM 882 CG ASN A 58 -17.409 -14.947 -5.299 1.00 0.00 C ATOM 883 OD1 ASN A 58 -16.652 -15.810 -5.742 1.00 0.00 O ATOM 884 ND2 ASN A 58 -17.083 -13.660 -5.261 1.00 0.00 N ATOM 0 H ASN A 58 -21.503 -15.452 -4.754 1.00 0.00 H new ATOM 0 HA ASN A 58 -19.480 -13.296 -4.536 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -18.701 -15.513 -3.689 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -19.113 -16.242 -5.228 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.174 -13.354 -5.608 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -17.742 -12.978 -4.885 1.00 0.00 H new ATOM 891 N LYS A 59 -19.939 -12.720 -6.900 1.00 0.00 N ATOM 892 CA LYS A 59 -20.085 -12.365 -8.307 1.00 0.00 C ATOM 893 C LYS A 59 -18.723 -12.204 -8.970 1.00 0.00 C ATOM 894 O LYS A 59 -17.702 -12.076 -8.293 1.00 0.00 O ATOM 895 CB LYS A 59 -20.892 -11.073 -8.453 1.00 0.00 C ATOM 896 CG LYS A 59 -22.298 -11.170 -7.884 1.00 0.00 C ATOM 897 CD LYS A 59 -23.093 -9.899 -8.139 1.00 0.00 C ATOM 898 CE LYS A 59 -22.552 -8.727 -7.333 1.00 0.00 C ATOM 899 NZ LYS A 59 -23.320 -7.477 -7.587 1.00 0.00 N ATOM 0 H LYS A 59 -19.798 -11.926 -6.276 1.00 0.00 H new ATOM 0 HA LYS A 59 -20.620 -13.174 -8.804 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -20.361 -10.263 -7.952 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -20.953 -10.809 -9.509 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -22.815 -12.019 -8.331 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -22.245 -11.358 -6.812 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -23.061 -9.656 -9.201 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -24.139 -10.066 -7.882 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -22.592 -8.968 -6.271 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -21.504 -8.566 -7.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -22.920 -6.703 -7.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -23.261 -7.233 -8.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -24.316 -7.621 -7.323 1.00 0.00 H new ATOM 913 N LEU A 60 -18.715 -12.214 -10.299 1.00 0.00 N ATOM 914 CA LEU A 60 -17.479 -12.070 -11.058 1.00 0.00 C ATOM 915 C LEU A 60 -17.057 -10.608 -11.149 1.00 0.00 C ATOM 916 O LEU A 60 -15.960 -10.300 -11.614 1.00 0.00 O ATOM 917 CB LEU A 60 -17.643 -12.658 -12.462 1.00 0.00 C ATOM 918 CG LEU A 60 -17.703 -14.187 -12.523 1.00 0.00 C ATOM 919 CD1 LEU A 60 -19.024 -14.697 -11.967 1.00 0.00 C ATOM 920 CD2 LEU A 60 -17.499 -14.672 -13.949 1.00 0.00 C ATOM 0 H LEU A 60 -19.552 -12.320 -10.873 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.697 -12.619 -10.533 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -18.555 -12.256 -12.903 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -16.813 -12.317 -13.081 1.00 0.00 H new ATOM 0 HG LEU A 60 -16.898 -14.586 -11.906 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -19.045 -15.786 -12.020 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -19.127 -14.382 -10.929 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -19.847 -14.289 -12.553 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -17.545 -15.761 -13.973 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -18.281 -14.262 -14.588 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -16.525 -14.342 -14.310 1.00 0.00 H new ATOM 932 N ILE A 61 -17.935 -9.713 -10.707 1.00 0.00 N ATOM 933 CA ILE A 61 -17.651 -8.283 -10.735 1.00 0.00 C ATOM 934 C ILE A 61 -16.471 -7.942 -9.824 1.00 0.00 C ATOM 935 O ILE A 61 -15.831 -6.900 -9.977 1.00 0.00 O ATOM 936 CB ILE A 61 -18.882 -7.459 -10.302 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.624 -5.962 -10.487 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.242 -7.761 -8.854 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.417 -5.553 -11.929 1.00 0.00 C ATOM 0 H ILE A 61 -18.850 -9.953 -10.325 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.397 -8.026 -11.763 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.723 -7.742 -10.935 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.466 -5.404 -10.078 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.744 -5.680 -9.909 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -20.112 -7.172 -8.565 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.471 -8.822 -8.750 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.401 -7.506 -8.209 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.240 -4.479 -11.981 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.556 -6.083 -12.338 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.305 -5.802 -12.509 1.00 0.00 H new ATOM 951 N TYR A 62 -16.184 -8.832 -8.882 1.00 0.00 N ATOM 952 CA TYR A 62 -15.086 -8.625 -7.948 1.00 0.00 C ATOM 953 C TYR A 62 -13.733 -8.771 -8.642 1.00 0.00 C ATOM 954 O TYR A 62 -12.706 -8.354 -8.104 1.00 0.00 O ATOM 955 CB TYR A 62 -15.190 -9.607 -6.778 1.00 0.00 C ATOM 956 CG TYR A 62 -16.316 -9.284 -5.819 1.00 0.00 C ATOM 957 CD1 TYR A 62 -17.609 -9.730 -6.058 1.00 0.00 C ATOM 958 CD2 TYR A 62 -16.084 -8.527 -4.677 1.00 0.00 C ATOM 959 CE1 TYR A 62 -18.640 -9.431 -5.187 1.00 0.00 C ATOM 960 CE2 TYR A 62 -17.109 -8.225 -3.800 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.385 -8.680 -4.060 1.00 0.00 C ATOM 962 OH TYR A 62 -19.409 -8.381 -3.190 1.00 0.00 O ATOM 0 H TYR A 62 -16.696 -9.703 -8.745 1.00 0.00 H new ATOM 0 HA TYR A 62 -15.160 -7.607 -7.564 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.335 -10.614 -7.170 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.247 -9.610 -6.231 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -17.813 -10.320 -6.939 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -15.086 -8.169 -4.471 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -19.640 -9.784 -5.389 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.912 -7.636 -2.916 1.00 0.00 H new ATOM 0 HH TYR A 62 -19.061 -7.846 -2.447 1.00 0.00 H new ATOM 972 N THR A 63 -13.733 -9.357 -9.839 1.00 0.00 N ATOM 973 CA THR A 63 -12.493 -9.540 -10.588 1.00 0.00 C ATOM 974 C THR A 63 -12.017 -8.219 -11.203 1.00 0.00 C ATOM 975 O THR A 63 -10.873 -7.818 -10.989 1.00 0.00 O ATOM 976 CB THR A 63 -12.639 -10.607 -11.692 1.00 0.00 C ATOM 977 OG1 THR A 63 -13.056 -11.852 -11.116 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.326 -10.805 -12.435 1.00 0.00 C ATOM 0 H THR A 63 -14.569 -9.709 -10.306 1.00 0.00 H new ATOM 0 HA THR A 63 -11.746 -9.888 -9.875 1.00 0.00 H new ATOM 0 HB THR A 63 -13.391 -10.261 -12.402 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.148 -12.525 -11.823 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.456 -11.562 -13.208 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.023 -9.865 -12.896 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.557 -11.130 -11.734 1.00 0.00 H new ATOM 986 N PRO A 64 -12.878 -7.513 -11.974 1.00 0.00 N ATOM 987 CA PRO A 64 -12.505 -6.229 -12.574 1.00 0.00 C ATOM 988 C PRO A 64 -12.232 -5.179 -11.506 1.00 0.00 C ATOM 989 O PRO A 64 -11.324 -4.359 -11.643 1.00 0.00 O ATOM 990 CB PRO A 64 -13.731 -5.840 -13.410 1.00 0.00 C ATOM 991 CG PRO A 64 -14.856 -6.616 -12.822 1.00 0.00 C ATOM 992 CD PRO A 64 -14.254 -7.903 -12.336 1.00 0.00 C ATOM 0 HA PRO A 64 -11.592 -6.299 -13.165 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -13.921 -4.768 -13.358 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.587 -6.088 -14.462 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.323 -6.069 -12.003 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.632 -6.803 -13.564 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.797 -8.305 -11.481 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.265 -8.671 -13.110 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.028 -5.213 -10.439 1.00 0.00 N ATOM 1001 CA ILE A 65 -12.862 -4.277 -9.336 1.00 0.00 C ATOM 1002 C ILE A 65 -11.511 -4.483 -8.658 1.00 0.00 C ATOM 1003 O ILE A 65 -10.869 -3.524 -8.224 1.00 0.00 O ATOM 1004 CB ILE A 65 -13.991 -4.433 -8.295 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.343 -4.087 -8.923 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -13.726 -3.553 -7.080 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.525 -4.380 -8.024 1.00 0.00 C ATOM 0 H ILE A 65 -13.792 -5.878 -10.318 1.00 0.00 H new ATOM 0 HA ILE A 65 -12.908 -3.270 -9.750 1.00 0.00 H new ATOM 0 HB ILE A 65 -14.016 -5.472 -7.965 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.351 -3.029 -9.186 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.456 -4.647 -9.851 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.533 -3.677 -6.358 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -12.781 -3.842 -6.621 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.675 -2.510 -7.391 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.448 -4.109 -8.537 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.543 -5.442 -7.781 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.436 -3.800 -7.106 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.082 -5.740 -8.572 1.00 0.00 N ATOM 1020 CA PHE A 66 -9.804 -6.067 -7.951 1.00 0.00 C ATOM 1021 C PHE A 66 -8.656 -5.420 -8.720 1.00 0.00 C ATOM 1022 O PHE A 66 -7.790 -4.774 -8.129 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.608 -7.583 -7.891 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.360 -8.001 -7.162 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.370 -8.175 -5.787 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.177 -8.222 -7.851 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -7.226 -8.560 -5.113 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.030 -8.607 -7.183 1.00 0.00 C ATOM 1029 CZ PHE A 66 -6.055 -8.776 -5.813 1.00 0.00 C ATOM 0 H PHE A 66 -11.600 -6.545 -8.924 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.809 -5.676 -6.934 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.472 -8.034 -7.403 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.575 -7.977 -8.907 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.283 -8.008 -5.235 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.152 -8.092 -8.923 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -7.248 -8.692 -4.041 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.115 -8.775 -7.732 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.160 -9.077 -5.289 1.00 0.00 H new ATOM 1039 N ASN A 67 -8.653 -5.598 -10.040 1.00 0.00 N ATOM 1040 CA ASN A 67 -7.613 -5.021 -10.884 1.00 0.00 C ATOM 1041 C ASN A 67 -7.653 -3.498 -10.822 1.00 0.00 C ATOM 1042 O ASN A 67 -6.635 -2.832 -11.008 1.00 0.00 O ATOM 1043 CB ASN A 67 -7.773 -5.486 -12.332 1.00 0.00 C ATOM 1044 CG ASN A 67 -7.483 -6.965 -12.505 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -6.335 -7.366 -12.695 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -8.527 -7.782 -12.451 1.00 0.00 N ATOM 0 H ASN A 67 -9.357 -6.136 -10.545 1.00 0.00 H new ATOM 0 HA ASN A 67 -6.648 -5.363 -10.510 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -8.789 -5.277 -12.667 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.103 -4.911 -12.971 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -8.395 -8.787 -12.569 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -9.461 -7.406 -12.291 1.00 0.00 H new ATOM 1053 N GLU A 68 -8.839 -2.954 -10.562 1.00 0.00 N ATOM 1054 CA GLU A 68 -9.015 -1.510 -10.470 1.00 0.00 C ATOM 1055 C GLU A 68 -8.235 -0.949 -9.287 1.00 0.00 C ATOM 1056 O GLU A 68 -7.615 0.109 -9.386 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.498 -1.162 -10.328 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.760 0.319 -10.100 1.00 0.00 C ATOM 1059 CD GLU A 68 -10.257 1.183 -11.238 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -10.898 1.188 -12.309 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -9.219 1.856 -11.059 1.00 0.00 O ATOM 0 H GLU A 68 -9.692 -3.493 -10.411 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.632 -1.061 -11.386 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.025 -1.481 -11.228 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.917 -1.728 -9.496 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.831 0.479 -9.973 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.279 0.630 -9.173 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.274 -1.665 -8.170 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.573 -1.247 -6.962 1.00 0.00 C ATOM 1070 C TYR A 69 -6.062 -1.345 -7.149 1.00 0.00 C ATOM 1071 O TYR A 69 -5.308 -0.494 -6.678 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.012 -2.111 -5.777 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.254 -1.831 -4.498 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -7.517 -0.694 -3.747 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.279 -2.708 -4.040 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -6.830 -0.439 -2.575 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -5.589 -2.460 -2.870 1.00 0.00 C ATOM 1078 CZ TYR A 69 -5.868 -1.323 -2.141 1.00 0.00 C ATOM 1079 OH TYR A 69 -5.182 -1.073 -0.975 1.00 0.00 O ATOM 0 H TYR A 69 -8.786 -2.542 -8.076 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.826 -0.206 -6.761 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.076 -1.952 -5.599 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.886 -3.161 -6.040 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -8.270 0.003 -4.084 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.057 -3.599 -4.609 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -7.047 0.450 -2.002 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -4.835 -3.153 -2.527 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.377 -1.778 -0.323 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.632 -2.393 -7.842 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.215 -2.619 -8.096 1.00 0.00 C ATOM 1091 C ILE A 70 -3.674 -1.648 -9.143 1.00 0.00 C ATOM 1092 O ILE A 70 -2.492 -1.307 -9.135 1.00 0.00 O ATOM 1093 CB ILE A 70 -3.959 -4.068 -8.558 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.544 -5.061 -7.547 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.469 -4.313 -8.754 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -3.937 -4.954 -6.161 1.00 0.00 C ATOM 0 H ILE A 70 -6.248 -3.102 -8.239 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.691 -2.447 -7.156 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.456 -4.219 -9.516 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.620 -4.901 -7.475 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.397 -6.074 -7.921 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.309 -5.341 -9.080 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.084 -3.629 -9.510 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.946 -4.145 -7.813 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.402 -5.688 -5.503 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.865 -5.144 -6.217 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.107 -3.953 -5.766 1.00 0.00 H new ATOM 1108 N SER A 71 -4.539 -1.210 -10.049 1.00 0.00 N ATOM 1109 CA SER A 71 -4.133 -0.288 -11.103 1.00 0.00 C ATOM 1110 C SER A 71 -4.266 1.169 -10.667 1.00 0.00 C ATOM 1111 O SER A 71 -3.550 2.038 -11.160 1.00 0.00 O ATOM 1112 CB SER A 71 -4.967 -0.531 -12.361 1.00 0.00 C ATOM 1113 OG SER A 71 -4.782 -1.848 -12.848 1.00 0.00 O ATOM 0 H SER A 71 -5.523 -1.477 -10.076 1.00 0.00 H new ATOM 0 HA SER A 71 -3.081 -0.476 -11.317 1.00 0.00 H new ATOM 0 HB2 SER A 71 -6.022 -0.366 -12.140 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.687 0.188 -13.131 1.00 0.00 H new ATOM 0 HG SER A 71 -5.377 -2.461 -12.367 1.00 0.00 H new ATOM 1119 N LEU A 72 -5.195 1.438 -9.756 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.416 2.800 -9.277 1.00 0.00 C ATOM 1121 C LEU A 72 -4.555 3.128 -8.058 1.00 0.00 C ATOM 1122 O LEU A 72 -3.694 4.009 -8.111 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.904 2.994 -8.944 1.00 0.00 C ATOM 1124 CG LEU A 72 -7.344 4.420 -8.573 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -7.025 4.730 -7.117 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -6.698 5.448 -9.491 1.00 0.00 C ATOM 0 H LEU A 72 -5.805 0.736 -9.336 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.123 3.485 -10.072 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.491 2.668 -9.803 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.157 2.332 -8.116 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.425 4.477 -8.705 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.347 5.745 -6.882 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.549 4.025 -6.472 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.951 4.643 -6.953 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.027 6.448 -9.206 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.613 5.384 -9.403 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.991 5.250 -10.522 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.784 2.404 -6.967 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.066 2.639 -5.715 1.00 0.00 C ATOM 1140 C VAL A 73 -2.617 2.160 -5.758 1.00 0.00 C ATOM 1141 O VAL A 73 -1.691 2.956 -5.601 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.783 1.960 -4.533 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.071 2.260 -3.223 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.236 2.403 -4.470 1.00 0.00 C ATOM 0 H VAL A 73 -5.464 1.645 -6.923 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.057 3.720 -5.577 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.757 0.882 -4.690 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.596 1.770 -2.403 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.047 1.889 -3.272 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.059 3.337 -3.054 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.729 1.915 -3.630 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.281 3.484 -4.339 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.741 2.128 -5.396 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.423 0.860 -5.965 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.079 0.286 -5.995 1.00 0.00 C ATOM 1156 C GLU A 74 -0.169 1.031 -6.966 1.00 0.00 C ATOM 1157 O GLU A 74 0.975 1.346 -6.636 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.133 -1.198 -6.363 1.00 0.00 C ATOM 1159 CG GLU A 74 0.218 -1.889 -6.289 1.00 0.00 C ATOM 1160 CD GLU A 74 0.166 -3.328 -6.761 1.00 0.00 C ATOM 1161 OE1 GLU A 74 -0.154 -4.212 -5.938 1.00 0.00 O ATOM 1162 OE2 GLU A 74 0.447 -3.573 -7.954 1.00 0.00 O ATOM 0 H GLU A 74 -3.174 0.187 -6.114 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.661 0.390 -4.994 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -1.829 -1.705 -5.695 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.530 -1.300 -7.373 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.937 -1.338 -6.895 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.580 -1.861 -5.261 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.674 1.315 -8.163 1.00 0.00 N ATOM 1170 CA LYS A 75 0.114 2.022 -9.166 1.00 0.00 C ATOM 1171 C LYS A 75 0.419 3.449 -8.724 1.00 0.00 C ATOM 1172 O LYS A 75 1.505 3.963 -8.982 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.605 2.036 -10.514 1.00 0.00 C ATOM 1174 CG LYS A 75 -0.694 0.668 -11.169 1.00 0.00 C ATOM 1175 CD LYS A 75 -1.139 0.772 -12.619 1.00 0.00 C ATOM 1176 CE LYS A 75 -1.215 -0.595 -13.278 1.00 0.00 C ATOM 1177 NZ LYS A 75 0.090 -1.309 -13.233 1.00 0.00 N ATOM 0 H LYS A 75 -1.618 1.068 -8.460 1.00 0.00 H new ATOM 0 HA LYS A 75 1.057 1.487 -9.277 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.612 2.430 -10.375 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -0.086 2.719 -11.187 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.277 0.176 -11.120 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.396 0.044 -10.616 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.115 1.255 -12.667 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -0.443 1.404 -13.170 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.975 -1.196 -12.779 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.530 -0.480 -14.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.072 -2.107 -13.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.853 -0.654 -13.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.258 -1.666 -12.271 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.541 4.090 -8.062 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.352 5.458 -7.591 1.00 0.00 C ATOM 1193 C TYR A 76 0.883 5.563 -6.697 1.00 0.00 C ATOM 1194 O TYR A 76 1.704 6.465 -6.866 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.591 5.940 -6.831 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.447 7.334 -6.258 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -0.904 7.532 -4.994 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.849 8.450 -6.982 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -0.766 8.802 -4.469 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -1.713 9.724 -6.461 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.172 9.894 -5.205 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.034 11.160 -4.683 1.00 0.00 O ATOM 0 H TYR A 76 -1.452 3.687 -7.841 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.202 6.095 -8.463 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.450 5.919 -7.502 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.803 5.243 -6.020 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -0.585 6.679 -4.413 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -2.274 8.321 -7.966 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -0.342 8.939 -3.485 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -2.029 10.582 -7.036 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.136 11.822 -5.399 1.00 0.00 H new ATOM 1212 N ILE A 77 1.009 4.639 -5.750 1.00 0.00 N ATOM 1213 CA ILE A 77 2.141 4.636 -4.828 1.00 0.00 C ATOM 1214 C ILE A 77 3.463 4.434 -5.565 1.00 0.00 C ATOM 1215 O ILE A 77 4.406 5.204 -5.387 1.00 0.00 O ATOM 1216 CB ILE A 77 1.994 3.538 -3.753 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.640 3.663 -3.048 1.00 0.00 C ATOM 1218 CG2 ILE A 77 3.133 3.628 -2.746 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.353 2.539 -2.073 1.00 0.00 C ATOM 0 H ILE A 77 0.342 3.882 -5.600 1.00 0.00 H new ATOM 0 HA ILE A 77 2.147 5.612 -4.343 1.00 0.00 H new ATOM 0 HB ILE A 77 2.041 2.564 -4.239 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.605 4.613 -2.514 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.149 3.690 -3.799 1.00 0.00 H new ATOM 0 HG21 ILE A 77 3.016 2.848 -1.994 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.085 3.497 -3.261 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.114 4.604 -2.262 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.623 2.696 -1.613 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.355 1.587 -2.604 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.120 2.524 -1.299 1.00 0.00 H new ATOM 1231 N GLU A 78 3.523 3.396 -6.391 1.00 0.00 N ATOM 1232 CA GLU A 78 4.734 3.084 -7.147 1.00 0.00 C ATOM 1233 C GLU A 78 5.157 4.248 -8.043 1.00 0.00 C ATOM 1234 O GLU A 78 6.323 4.640 -8.056 1.00 0.00 O ATOM 1235 CB GLU A 78 4.516 1.832 -8.000 1.00 0.00 C ATOM 1236 CG GLU A 78 5.771 1.362 -8.721 1.00 0.00 C ATOM 1237 CD GLU A 78 5.540 0.109 -9.542 1.00 0.00 C ATOM 1238 OE1 GLU A 78 5.077 0.234 -10.695 1.00 0.00 O ATOM 1239 OE2 GLU A 78 5.823 -0.995 -9.033 1.00 0.00 O ATOM 0 H GLU A 78 2.747 2.754 -6.556 1.00 0.00 H new ATOM 0 HA GLU A 78 5.532 2.904 -6.427 1.00 0.00 H new ATOM 0 HB2 GLU A 78 4.150 1.027 -7.363 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.738 2.035 -8.736 1.00 0.00 H new ATOM 0 HG2 GLU A 78 6.130 2.158 -9.374 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.556 1.172 -7.989 1.00 0.00 H new ATOM 1246 N GLU A 79 4.201 4.795 -8.787 1.00 0.00 N ATOM 1247 CA GLU A 79 4.474 5.900 -9.703 1.00 0.00 C ATOM 1248 C GLU A 79 4.982 7.143 -8.975 1.00 0.00 C ATOM 1249 O GLU A 79 6.057 7.655 -9.287 1.00 0.00 O ATOM 1250 CB GLU A 79 3.218 6.253 -10.501 1.00 0.00 C ATOM 1251 CG GLU A 79 2.786 5.170 -11.477 1.00 0.00 C ATOM 1252 CD GLU A 79 1.571 5.572 -12.288 1.00 0.00 C ATOM 1253 OE1 GLU A 79 0.438 5.339 -11.814 1.00 0.00 O ATOM 1254 OE2 GLU A 79 1.750 6.121 -13.395 1.00 0.00 O ATOM 0 H GLU A 79 3.227 4.491 -8.774 1.00 0.00 H new ATOM 0 HA GLU A 79 5.260 5.565 -10.380 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.401 6.450 -9.807 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.397 7.176 -11.053 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.611 4.944 -12.152 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.565 4.256 -10.926 1.00 0.00 H new ATOM 1261 N GLN A 80 4.208 7.626 -8.005 1.00 0.00 N ATOM 1262 CA GLN A 80 4.591 8.821 -7.261 1.00 0.00 C ATOM 1263 C GLN A 80 5.949 8.633 -6.590 1.00 0.00 C ATOM 1264 O GLN A 80 6.677 9.600 -6.365 1.00 0.00 O ATOM 1265 CB GLN A 80 3.512 9.190 -6.233 1.00 0.00 C ATOM 1266 CG GLN A 80 3.463 8.277 -5.018 1.00 0.00 C ATOM 1267 CD GLN A 80 4.492 8.643 -3.964 1.00 0.00 C ATOM 1268 OE1 GLN A 80 4.990 7.781 -3.245 1.00 0.00 O ATOM 1269 NE2 GLN A 80 4.814 9.929 -3.866 1.00 0.00 N ATOM 0 H GLN A 80 3.321 7.212 -7.719 1.00 0.00 H new ATOM 0 HA GLN A 80 4.680 9.647 -7.966 1.00 0.00 H new ATOM 0 HB2 GLN A 80 3.682 10.213 -5.897 1.00 0.00 H new ATOM 0 HB3 GLN A 80 2.539 9.174 -6.724 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.467 8.320 -4.577 1.00 0.00 H new ATOM 0 HG3 GLN A 80 3.626 7.247 -5.336 1.00 0.00 H new ATOM 0 HE21 GLN A 80 4.376 10.613 -4.483 1.00 0.00 H new ATOM 0 HE22 GLN A 80 5.499 10.232 -3.173 1.00 0.00 H new ATOM 1278 N LEU A 81 6.284 7.386 -6.271 1.00 0.00 N ATOM 1279 CA LEU A 81 7.567 7.077 -5.648 1.00 0.00 C ATOM 1280 C LEU A 81 8.702 7.232 -6.655 1.00 0.00 C ATOM 1281 O LEU A 81 9.752 7.794 -6.341 1.00 0.00 O ATOM 1282 CB LEU A 81 7.566 5.653 -5.086 1.00 0.00 C ATOM 1283 CG LEU A 81 6.897 5.486 -3.720 1.00 0.00 C ATOM 1284 CD1 LEU A 81 6.851 4.017 -3.328 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.632 6.295 -2.661 1.00 0.00 C ATOM 0 H LEU A 81 5.687 6.575 -6.433 1.00 0.00 H new ATOM 0 HA LEU A 81 7.721 7.779 -4.829 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.064 5.000 -5.800 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.598 5.310 -5.011 1.00 0.00 H new ATOM 0 HG LEU A 81 5.875 5.859 -3.790 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.372 3.915 -2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.282 3.460 -4.072 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.866 3.622 -3.277 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.141 6.163 -1.697 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.664 5.952 -2.593 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.618 7.350 -2.934 1.00 0.00 H new ATOM 1297 N LEU A 82 8.482 6.729 -7.868 1.00 0.00 N ATOM 1298 CA LEU A 82 9.486 6.808 -8.926 1.00 0.00 C ATOM 1299 C LEU A 82 9.752 8.258 -9.320 1.00 0.00 C ATOM 1300 O LEU A 82 10.814 8.579 -9.854 1.00 0.00 O ATOM 1301 CB LEU A 82 9.035 6.010 -10.155 1.00 0.00 C ATOM 1302 CG LEU A 82 8.887 4.502 -9.940 1.00 0.00 C ATOM 1303 CD1 LEU A 82 8.227 3.856 -11.149 1.00 0.00 C ATOM 1304 CD2 LEU A 82 10.242 3.862 -9.673 1.00 0.00 C ATOM 0 H LEU A 82 7.617 6.262 -8.142 1.00 0.00 H new ATOM 0 HA LEU A 82 10.411 6.378 -8.542 1.00 0.00 H new ATOM 0 HB2 LEU A 82 8.078 6.407 -10.494 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.752 6.177 -10.959 1.00 0.00 H new ATOM 0 HG LEU A 82 8.253 4.341 -9.068 1.00 0.00 H new ATOM 0 HD11 LEU A 82 8.129 2.784 -10.980 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.239 4.291 -11.300 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.839 4.030 -12.034 1.00 0.00 H new ATOM 0 HD21 LEU A 82 10.115 2.790 -9.523 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.900 4.034 -10.525 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.683 4.304 -8.779 1.00 0.00 H new ATOM 1316 N GLN A 83 8.779 9.128 -9.059 1.00 0.00 N ATOM 1317 CA GLN A 83 8.911 10.546 -9.386 1.00 0.00 C ATOM 1318 C GLN A 83 10.131 11.155 -8.701 1.00 0.00 C ATOM 1319 O GLN A 83 10.650 12.182 -9.138 1.00 0.00 O ATOM 1320 CB GLN A 83 7.648 11.307 -8.974 1.00 0.00 C ATOM 1321 CG GLN A 83 6.409 10.909 -9.762 1.00 0.00 C ATOM 1322 CD GLN A 83 6.420 11.432 -11.186 1.00 0.00 C ATOM 1323 OE1 GLN A 83 7.479 11.614 -11.787 1.00 0.00 O ATOM 1324 NE2 GLN A 83 5.236 11.678 -11.734 1.00 0.00 N ATOM 0 H GLN A 83 7.892 8.877 -8.623 1.00 0.00 H new ATOM 0 HA GLN A 83 9.044 10.631 -10.465 1.00 0.00 H new ATOM 0 HB2 GLN A 83 7.463 11.138 -7.913 1.00 0.00 H new ATOM 0 HB3 GLN A 83 7.821 12.376 -9.101 1.00 0.00 H new ATOM 0 HG2 GLN A 83 6.330 9.822 -9.780 1.00 0.00 H new ATOM 0 HG3 GLN A 83 5.523 11.284 -9.250 1.00 0.00 H new ATOM 0 HE21 GLN A 83 4.383 11.513 -11.200 1.00 0.00 H new ATOM 0 HE22 GLN A 83 5.180 12.032 -12.689 1.00 0.00 H new ATOM 1333 N ARG A 84 10.585 10.513 -7.629 1.00 0.00 N ATOM 1334 CA ARG A 84 11.743 10.992 -6.883 1.00 0.00 C ATOM 1335 C ARG A 84 12.859 9.950 -6.880 1.00 0.00 C ATOM 1336 O ARG A 84 14.031 10.281 -6.697 1.00 0.00 O ATOM 1337 CB ARG A 84 11.342 11.332 -5.448 1.00 0.00 C ATOM 1338 CG ARG A 84 10.239 12.372 -5.356 1.00 0.00 C ATOM 1339 CD ARG A 84 9.906 12.701 -3.911 1.00 0.00 C ATOM 1340 NE ARG A 84 11.060 13.242 -3.197 1.00 0.00 N ATOM 1341 CZ ARG A 84 11.031 13.621 -1.923 1.00 0.00 C ATOM 1342 NH1 ARG A 84 9.913 13.510 -1.219 1.00 0.00 N ATOM 1343 NH2 ARG A 84 12.123 14.110 -1.351 1.00 0.00 N ATOM 0 H ARG A 84 10.168 9.659 -7.258 1.00 0.00 H new ATOM 0 HA ARG A 84 12.115 11.892 -7.373 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.015 10.422 -4.946 1.00 0.00 H new ATOM 0 HB3 ARG A 84 12.218 11.695 -4.911 1.00 0.00 H new ATOM 0 HG2 ARG A 84 10.548 13.279 -5.875 1.00 0.00 H new ATOM 0 HG3 ARG A 84 9.346 12.004 -5.862 1.00 0.00 H new ATOM 0 HD2 ARG A 84 9.090 13.423 -3.882 1.00 0.00 H new ATOM 0 HD3 ARG A 84 9.555 11.802 -3.405 1.00 0.00 H new ATOM 0 HE ARG A 84 11.939 13.334 -3.706 1.00 0.00 H new ATOM 0 HH11 ARG A 84 9.071 13.133 -1.655 1.00 0.00 H new ATOM 0 HH12 ARG A 84 9.895 13.802 -0.242 1.00 0.00 H new ATOM 0 HH21 ARG A 84 12.986 14.195 -1.889 1.00 0.00 H new ATOM 0 HH22 ARG A 84 12.100 14.401 -0.374 1.00 0.00 H new ATOM 1357 N ILE A 85 12.485 8.689 -7.085 1.00 0.00 N ATOM 1358 CA ILE A 85 13.453 7.597 -7.105 1.00 0.00 C ATOM 1359 C ILE A 85 13.237 6.694 -8.321 1.00 0.00 C ATOM 1360 O ILE A 85 12.467 5.736 -8.257 1.00 0.00 O ATOM 1361 CB ILE A 85 13.361 6.742 -5.825 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.423 7.635 -4.582 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.479 5.708 -5.798 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.132 6.899 -3.290 1.00 0.00 C ATOM 0 H ILE A 85 11.519 8.399 -7.239 1.00 0.00 H new ATOM 0 HA ILE A 85 14.442 8.051 -7.161 1.00 0.00 H new ATOM 0 HB ILE A 85 12.406 6.217 -5.824 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.413 8.086 -4.518 1.00 0.00 H new ATOM 0 HG13 ILE A 85 12.708 8.450 -4.695 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.401 5.112 -4.889 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.393 5.056 -6.668 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.444 6.215 -5.818 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.194 7.595 -2.453 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.130 6.471 -3.333 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.862 6.101 -3.153 1.00 0.00 H new ATOM 1376 N PRO A 86 13.913 6.988 -9.449 1.00 0.00 N ATOM 1377 CA PRO A 86 13.780 6.191 -10.672 1.00 0.00 C ATOM 1378 C PRO A 86 14.463 4.833 -10.557 1.00 0.00 C ATOM 1379 O PRO A 86 14.438 4.033 -11.493 1.00 0.00 O ATOM 1380 CB PRO A 86 14.473 7.049 -11.731 1.00 0.00 C ATOM 1381 CG PRO A 86 15.466 7.858 -10.972 1.00 0.00 C ATOM 1382 CD PRO A 86 14.852 8.114 -9.622 1.00 0.00 C ATOM 0 HA PRO A 86 12.738 5.966 -10.900 1.00 0.00 H new ATOM 0 HB2 PRO A 86 14.960 6.431 -12.485 1.00 0.00 H new ATOM 0 HB3 PRO A 86 13.759 7.686 -12.253 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.411 7.324 -10.875 1.00 0.00 H new ATOM 0 HG3 PRO A 86 15.680 8.795 -11.487 1.00 0.00 H new ATOM 0 HD2 PRO A 86 15.606 8.132 -8.835 1.00 0.00 H new ATOM 0 HD3 PRO A 86 14.337 9.074 -9.591 1.00 0.00 H new ATOM 1390 N GLU A 87 15.072 4.580 -9.403 1.00 0.00 N ATOM 1391 CA GLU A 87 15.760 3.317 -9.161 1.00 0.00 C ATOM 1392 C GLU A 87 15.040 2.505 -8.089 1.00 0.00 C ATOM 1393 O GLU A 87 15.579 1.526 -7.571 1.00 0.00 O ATOM 1394 CB GLU A 87 17.210 3.570 -8.742 1.00 0.00 C ATOM 1395 CG GLU A 87 17.344 4.343 -7.441 1.00 0.00 C ATOM 1396 CD GLU A 87 18.790 4.538 -7.026 1.00 0.00 C ATOM 1397 OE1 GLU A 87 19.336 3.650 -6.339 1.00 0.00 O ATOM 1398 OE2 GLU A 87 19.377 5.578 -7.391 1.00 0.00 O ATOM 0 H GLU A 87 15.103 5.233 -8.620 1.00 0.00 H new ATOM 0 HA GLU A 87 15.756 2.746 -10.089 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.722 2.613 -8.640 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.717 4.120 -9.535 1.00 0.00 H new ATOM 0 HG2 GLU A 87 16.866 5.317 -7.550 1.00 0.00 H new ATOM 0 HG3 GLU A 87 16.811 3.813 -6.651 1.00 0.00 H new ATOM 1405 N PHE A 88 13.818 2.917 -7.764 1.00 0.00 N ATOM 1406 CA PHE A 88 13.022 2.232 -6.750 1.00 0.00 C ATOM 1407 C PHE A 88 12.437 0.934 -7.298 1.00 0.00 C ATOM 1408 O PHE A 88 12.016 0.867 -8.453 1.00 0.00 O ATOM 1409 CB PHE A 88 11.892 3.141 -6.258 1.00 0.00 C ATOM 1410 CG PHE A 88 11.159 2.598 -5.062 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.643 2.810 -3.783 1.00 0.00 C ATOM 1412 CD2 PHE A 88 9.983 1.878 -5.218 1.00 0.00 C ATOM 1413 CE1 PHE A 88 10.973 2.316 -2.681 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.307 1.382 -4.119 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.803 1.601 -2.849 1.00 0.00 C ATOM 0 H PHE A 88 13.357 3.722 -8.188 1.00 0.00 H new ATOM 0 HA PHE A 88 13.679 1.990 -5.915 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.306 4.118 -6.007 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.181 3.295 -7.070 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.557 3.369 -3.645 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.591 1.703 -6.209 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.363 2.488 -1.689 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.392 0.824 -4.253 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.277 1.214 -1.989 1.00 0.00 H new ATOM 1425 N ASN A 89 12.417 -0.096 -6.457 1.00 0.00 N ATOM 1426 CA ASN A 89 11.875 -1.393 -6.844 1.00 0.00 C ATOM 1427 C ASN A 89 10.812 -1.837 -5.848 1.00 0.00 C ATOM 1428 O ASN A 89 11.122 -2.454 -4.828 1.00 0.00 O ATOM 1429 CB ASN A 89 12.989 -2.438 -6.925 1.00 0.00 C ATOM 1430 CG ASN A 89 14.067 -2.059 -7.922 1.00 0.00 C ATOM 1431 OD1 ASN A 89 15.049 -1.403 -7.574 1.00 0.00 O ATOM 1432 ND2 ASN A 89 13.889 -2.475 -9.171 1.00 0.00 N ATOM 0 H ASN A 89 12.771 -0.056 -5.501 1.00 0.00 H new ATOM 0 HA ASN A 89 11.418 -1.296 -7.829 1.00 0.00 H new ATOM 0 HB2 ASN A 89 13.438 -2.564 -5.940 1.00 0.00 H new ATOM 0 HB3 ASN A 89 12.561 -3.400 -7.206 1.00 0.00 H new ATOM 0 HD21 ASN A 89 14.582 -2.253 -9.886 1.00 0.00 H new ATOM 0 HD22 ASN A 89 13.060 -3.016 -9.415 1.00 0.00 H new ATOM 1439 N MET A 90 9.559 -1.512 -6.144 1.00 0.00 N ATOM 1440 CA MET A 90 8.449 -1.867 -5.268 1.00 0.00 C ATOM 1441 C MET A 90 8.265 -3.379 -5.207 1.00 0.00 C ATOM 1442 O MET A 90 7.620 -3.900 -4.297 1.00 0.00 O ATOM 1443 CB MET A 90 7.159 -1.200 -5.747 1.00 0.00 C ATOM 1444 CG MET A 90 6.034 -1.245 -4.725 1.00 0.00 C ATOM 1445 SD MET A 90 4.572 -0.338 -5.263 1.00 0.00 S ATOM 1446 CE MET A 90 3.549 -0.451 -3.799 1.00 0.00 C ATOM 0 H MET A 90 9.286 -1.003 -6.985 1.00 0.00 H new ATOM 0 HA MET A 90 8.682 -1.509 -4.265 1.00 0.00 H new ATOM 0 HB2 MET A 90 7.369 -0.160 -5.998 1.00 0.00 H new ATOM 0 HB3 MET A 90 6.826 -1.688 -6.663 1.00 0.00 H new ATOM 0 HG2 MET A 90 5.763 -2.283 -4.534 1.00 0.00 H new ATOM 0 HG3 MET A 90 6.388 -0.829 -3.782 1.00 0.00 H new ATOM 0 HE1 MET A 90 2.605 0.065 -3.974 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.353 -1.499 -3.572 1.00 0.00 H new ATOM 0 HE3 MET A 90 4.065 0.012 -2.958 1.00 0.00 H new ATOM 1456 N ALA A 91 8.837 -4.079 -6.182 1.00 0.00 N ATOM 1457 CA ALA A 91 8.739 -5.532 -6.239 1.00 0.00 C ATOM 1458 C ALA A 91 9.527 -6.174 -5.105 1.00 0.00 C ATOM 1459 O ALA A 91 8.976 -6.920 -4.295 1.00 0.00 O ATOM 1460 CB ALA A 91 9.238 -6.040 -7.583 1.00 0.00 C ATOM 0 H ALA A 91 9.373 -3.663 -6.943 1.00 0.00 H new ATOM 0 HA ALA A 91 7.691 -5.809 -6.124 1.00 0.00 H new ATOM 0 HB1 ALA A 91 9.160 -7.127 -7.613 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.633 -5.610 -8.382 1.00 0.00 H new ATOM 0 HB3 ALA A 91 10.279 -5.747 -7.719 1.00 0.00 H new ATOM 1466 N ALA A 92 10.821 -5.877 -5.052 1.00 0.00 N ATOM 1467 CA ALA A 92 11.689 -6.421 -4.016 1.00 0.00 C ATOM 1468 C ALA A 92 11.405 -5.767 -2.669 1.00 0.00 C ATOM 1469 O ALA A 92 11.643 -6.361 -1.617 1.00 0.00 O ATOM 1470 CB ALA A 92 13.150 -6.236 -4.400 1.00 0.00 C ATOM 0 H ALA A 92 11.292 -5.262 -5.716 1.00 0.00 H new ATOM 0 HA ALA A 92 11.484 -7.488 -3.924 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.787 -6.647 -3.617 1.00 0.00 H new ATOM 0 HB2 ALA A 92 13.348 -6.754 -5.338 1.00 0.00 H new ATOM 0 HB3 ALA A 92 13.363 -5.174 -4.520 1.00 0.00 H new ATOM 1476 N PHE A 93 10.892 -4.541 -2.707 1.00 0.00 N ATOM 1477 CA PHE A 93 10.577 -3.804 -1.489 1.00 0.00 C ATOM 1478 C PHE A 93 9.423 -4.460 -0.737 1.00 0.00 C ATOM 1479 O PHE A 93 9.500 -4.667 0.473 1.00 0.00 O ATOM 1480 CB PHE A 93 10.228 -2.350 -1.821 1.00 0.00 C ATOM 1481 CG PHE A 93 9.848 -1.531 -0.618 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.794 -1.197 0.338 1.00 0.00 C ATOM 1483 CD2 PHE A 93 8.543 -1.097 -0.444 1.00 0.00 C ATOM 1484 CE1 PHE A 93 10.445 -0.447 1.445 1.00 0.00 C ATOM 1485 CE2 PHE A 93 8.189 -0.348 0.661 1.00 0.00 C ATOM 1486 CZ PHE A 93 9.142 -0.022 1.607 1.00 0.00 C ATOM 0 H PHE A 93 10.686 -4.037 -3.569 1.00 0.00 H new ATOM 0 HA PHE A 93 11.458 -3.820 -0.848 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.082 -1.884 -2.312 1.00 0.00 H new ATOM 0 HB3 PHE A 93 9.404 -2.337 -2.534 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.815 -1.526 0.217 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.794 -1.348 -1.181 1.00 0.00 H new ATOM 0 HE1 PHE A 93 11.192 -0.194 2.183 1.00 0.00 H new ATOM 0 HE2 PHE A 93 7.168 -0.017 0.786 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.868 0.564 2.472 1.00 0.00 H new ATOM 1496 N THR A 94 8.355 -4.787 -1.460 1.00 0.00 N ATOM 1497 CA THR A 94 7.188 -5.418 -0.853 1.00 0.00 C ATOM 1498 C THR A 94 7.515 -6.821 -0.358 1.00 0.00 C ATOM 1499 O THR A 94 7.120 -7.209 0.743 1.00 0.00 O ATOM 1500 CB THR A 94 6.007 -5.496 -1.837 1.00 0.00 C ATOM 1501 OG1 THR A 94 6.430 -6.090 -3.069 1.00 0.00 O ATOM 1502 CG2 THR A 94 5.433 -4.112 -2.103 1.00 0.00 C ATOM 0 H THR A 94 8.274 -4.626 -2.464 1.00 0.00 H new ATOM 0 HA THR A 94 6.902 -4.793 -0.007 1.00 0.00 H new ATOM 0 HB THR A 94 5.230 -6.114 -1.388 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.864 -5.411 -3.627 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.600 -4.192 -2.801 1.00 0.00 H new ATOM 0 HG22 THR A 94 5.082 -3.678 -1.167 1.00 0.00 H new ATOM 0 HG23 THR A 94 6.206 -3.474 -2.532 1.00 0.00 H new ATOM 1510 N THR A 95 8.241 -7.579 -1.175 1.00 0.00 N ATOM 1511 CA THR A 95 8.622 -8.940 -0.820 1.00 0.00 C ATOM 1512 C THR A 95 9.392 -8.970 0.493 1.00 0.00 C ATOM 1513 O THR A 95 9.164 -9.834 1.338 1.00 0.00 O ATOM 1514 CB THR A 95 9.482 -9.585 -1.918 1.00 0.00 C ATOM 1515 OG1 THR A 95 10.568 -8.718 -2.264 1.00 0.00 O ATOM 1516 CG2 THR A 95 8.647 -9.883 -3.154 1.00 0.00 C ATOM 0 H THR A 95 8.577 -7.272 -2.088 1.00 0.00 H new ATOM 0 HA THR A 95 7.698 -9.508 -0.710 1.00 0.00 H new ATOM 0 HB THR A 95 9.879 -10.524 -1.533 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.472 -7.867 -1.788 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.277 -10.339 -3.918 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.841 -10.568 -2.892 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.224 -8.955 -3.539 1.00 0.00 H new ATOM 1524 N THR A 96 10.309 -8.025 0.655 1.00 0.00 N ATOM 1525 CA THR A 96 11.114 -7.939 1.866 1.00 0.00 C ATOM 1526 C THR A 96 10.313 -7.351 3.027 1.00 0.00 C ATOM 1527 O THR A 96 10.559 -7.670 4.188 1.00 0.00 O ATOM 1528 CB THR A 96 12.379 -7.086 1.639 1.00 0.00 C ATOM 1529 OG1 THR A 96 13.143 -7.622 0.553 1.00 0.00 O ATOM 1530 CG2 THR A 96 13.239 -7.041 2.894 1.00 0.00 C ATOM 0 H THR A 96 10.514 -7.306 -0.039 1.00 0.00 H new ATOM 0 HA THR A 96 11.411 -8.957 2.119 1.00 0.00 H new ATOM 0 HB THR A 96 12.064 -6.071 1.398 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.775 -7.300 -0.296 1.00 0.00 H new ATOM 0 HG21 THR A 96 14.124 -6.433 2.707 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.666 -6.605 3.712 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.543 -8.052 3.163 1.00 0.00 H new ATOM 1538 N LEU A 97 9.349 -6.499 2.698 1.00 0.00 N ATOM 1539 CA LEU A 97 8.513 -5.843 3.700 1.00 0.00 C ATOM 1540 C LEU A 97 7.658 -6.841 4.484 1.00 0.00 C ATOM 1541 O LEU A 97 7.424 -6.656 5.679 1.00 0.00 O ATOM 1542 CB LEU A 97 7.609 -4.804 3.034 1.00 0.00 C ATOM 1543 CG LEU A 97 7.514 -3.458 3.760 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.626 -2.498 2.986 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.988 -3.646 5.176 1.00 0.00 C ATOM 0 H LEU A 97 9.125 -6.244 1.736 1.00 0.00 H new ATOM 0 HA LEU A 97 9.183 -5.353 4.407 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.971 -4.627 2.021 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.606 -5.222 2.946 1.00 0.00 H new ATOM 0 HG LEU A 97 8.515 -3.031 3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.570 -1.547 3.516 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.045 -2.336 1.993 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.626 -2.922 2.894 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.928 -2.678 5.674 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.996 -4.097 5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.662 -4.298 5.731 1.00 0.00 H new ATOM 1557 N GLN A 98 7.191 -7.890 3.812 1.00 0.00 N ATOM 1558 CA GLN A 98 6.335 -8.890 4.449 1.00 0.00 C ATOM 1559 C GLN A 98 6.930 -9.395 5.764 1.00 0.00 C ATOM 1560 O GLN A 98 6.202 -9.630 6.727 1.00 0.00 O ATOM 1561 CB GLN A 98 6.091 -10.070 3.504 1.00 0.00 C ATOM 1562 CG GLN A 98 7.277 -11.014 3.382 1.00 0.00 C ATOM 1563 CD GLN A 98 7.035 -12.136 2.392 1.00 0.00 C ATOM 1564 OE1 GLN A 98 5.899 -12.564 2.187 1.00 0.00 O ATOM 1565 NE2 GLN A 98 8.106 -12.619 1.774 1.00 0.00 N ATOM 0 H GLN A 98 7.390 -8.071 2.828 1.00 0.00 H new ATOM 0 HA GLN A 98 5.385 -8.404 4.674 1.00 0.00 H new ATOM 0 HB2 GLN A 98 5.226 -10.632 3.856 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.841 -9.686 2.515 1.00 0.00 H new ATOM 0 HG2 GLN A 98 8.156 -10.448 3.075 1.00 0.00 H new ATOM 0 HG3 GLN A 98 7.498 -11.440 4.360 1.00 0.00 H new ATOM 0 HE21 GLN A 98 9.028 -12.233 1.976 1.00 0.00 H new ATOM 0 HE22 GLN A 98 8.006 -13.376 1.098 1.00 0.00 H new ATOM 1574 N HIS A 99 8.249 -9.563 5.803 1.00 0.00 N ATOM 1575 CA HIS A 99 8.913 -10.035 7.014 1.00 0.00 C ATOM 1576 C HIS A 99 9.607 -8.884 7.734 1.00 0.00 C ATOM 1577 O HIS A 99 9.805 -8.928 8.950 1.00 0.00 O ATOM 1578 CB HIS A 99 9.921 -11.143 6.688 1.00 0.00 C ATOM 1579 CG HIS A 99 10.919 -10.773 5.636 1.00 0.00 C ATOM 1580 ND1 HIS A 99 10.919 -11.331 4.374 1.00 0.00 N ATOM 1581 CD2 HIS A 99 11.965 -9.912 5.664 1.00 0.00 C ATOM 1582 CE1 HIS A 99 11.921 -10.830 3.674 1.00 0.00 C ATOM 1583 NE2 HIS A 99 12.569 -9.966 4.433 1.00 0.00 N ATOM 0 H HIS A 99 8.874 -9.381 5.018 1.00 0.00 H new ATOM 0 HA HIS A 99 8.151 -10.447 7.675 1.00 0.00 H new ATOM 0 HB2 HIS A 99 10.454 -11.414 7.599 1.00 0.00 H new ATOM 0 HB3 HIS A 99 9.377 -12.029 6.361 1.00 0.00 H new ATOM 0 HD1 HIS A 99 10.250 -12.022 4.035 1.00 0.00 H new ATOM 0 HD2 HIS A 99 12.267 -9.298 6.499 1.00 0.00 H new ATOM 0 HE1 HIS A 99 12.168 -11.084 2.654 1.00 0.00 H new ATOM 1592 N HIS A 100 9.962 -7.849 6.981 1.00 0.00 N ATOM 1593 CA HIS A 100 10.630 -6.687 7.551 1.00 0.00 C ATOM 1594 C HIS A 100 9.654 -5.877 8.396 1.00 0.00 C ATOM 1595 O HIS A 100 10.041 -4.922 9.070 1.00 0.00 O ATOM 1596 CB HIS A 100 11.220 -5.812 6.443 1.00 0.00 C ATOM 1597 CG HIS A 100 12.276 -4.866 6.923 1.00 0.00 C ATOM 1598 ND1 HIS A 100 11.990 -3.664 7.537 1.00 0.00 N ATOM 1599 CD2 HIS A 100 13.627 -4.950 6.877 1.00 0.00 C ATOM 1600 CE1 HIS A 100 13.120 -3.050 7.845 1.00 0.00 C ATOM 1601 NE2 HIS A 100 14.125 -3.810 7.455 1.00 0.00 N ATOM 0 H HIS A 100 9.798 -7.792 5.976 1.00 0.00 H new ATOM 0 HA HIS A 100 11.442 -7.035 8.190 1.00 0.00 H new ATOM 0 HB2 HIS A 100 11.644 -6.455 5.671 1.00 0.00 H new ATOM 0 HB3 HIS A 100 10.417 -5.241 5.977 1.00 0.00 H new ATOM 0 HD1 HIS A 100 11.054 -3.305 7.724 1.00 0.00 H new ATOM 0 HD2 HIS A 100 14.205 -5.763 6.462 1.00 0.00 H new ATOM 0 HE1 HIS A 100 13.205 -2.090 8.333 1.00 0.00 H new ATOM 1610 N LYS A 101 8.384 -6.269 8.353 1.00 0.00 N ATOM 1611 CA LYS A 101 7.344 -5.588 9.114 1.00 0.00 C ATOM 1612 C LYS A 101 7.578 -5.747 10.613 1.00 0.00 C ATOM 1613 O LYS A 101 7.054 -4.977 11.417 1.00 0.00 O ATOM 1614 CB LYS A 101 5.964 -6.136 8.740 1.00 0.00 C ATOM 1615 CG LYS A 101 5.788 -7.615 9.051 1.00 0.00 C ATOM 1616 CD LYS A 101 4.406 -8.111 8.656 1.00 0.00 C ATOM 1617 CE LYS A 101 3.317 -7.497 9.523 1.00 0.00 C ATOM 1618 NZ LYS A 101 3.482 -7.851 10.960 1.00 0.00 N ATOM 0 H LYS A 101 8.051 -7.057 7.797 1.00 0.00 H new ATOM 0 HA LYS A 101 7.383 -4.527 8.867 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.201 -5.569 9.273 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.795 -5.975 7.675 1.00 0.00 H new ATOM 0 HG2 LYS A 101 6.547 -8.191 8.522 1.00 0.00 H new ATOM 0 HG3 LYS A 101 5.945 -7.784 10.116 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.218 -7.869 7.610 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.371 -9.197 8.743 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.334 -6.413 9.413 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.342 -7.838 9.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.598 -7.653 11.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 3.711 -8.862 11.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.253 -7.286 11.370 1.00 0.00 H new ATOM 1632 N ASP A 102 8.372 -6.750 10.980 1.00 0.00 N ATOM 1633 CA ASP A 102 8.676 -7.007 12.384 1.00 0.00 C ATOM 1634 C ASP A 102 9.616 -5.940 12.932 1.00 0.00 C ATOM 1635 O ASP A 102 9.872 -5.879 14.134 1.00 0.00 O ATOM 1636 CB ASP A 102 9.300 -8.393 12.549 1.00 0.00 C ATOM 1637 CG ASP A 102 8.336 -9.507 12.194 1.00 0.00 C ATOM 1638 OD1 ASP A 102 8.282 -9.890 11.006 1.00 0.00 O ATOM 1639 OD2 ASP A 102 7.636 -9.998 13.104 1.00 0.00 O ATOM 0 H ASP A 102 8.815 -7.396 10.326 1.00 0.00 H new ATOM 0 HA ASP A 102 7.744 -6.972 12.948 1.00 0.00 H new ATOM 0 HB2 ASP A 102 10.185 -8.467 11.917 1.00 0.00 H new ATOM 0 HB3 ASP A 102 9.632 -8.518 13.580 1.00 0.00 H new ATOM 1644 N GLU A 103 10.125 -5.100 12.037 1.00 0.00 N ATOM 1645 CA GLU A 103 11.035 -4.028 12.420 1.00 0.00 C ATOM 1646 C GLU A 103 10.311 -2.686 12.425 1.00 0.00 C ATOM 1647 O GLU A 103 10.317 -1.970 13.426 1.00 0.00 O ATOM 1648 CB GLU A 103 12.225 -3.977 11.460 1.00 0.00 C ATOM 1649 CG GLU A 103 13.068 -5.242 11.464 1.00 0.00 C ATOM 1650 CD GLU A 103 13.654 -5.548 12.828 1.00 0.00 C ATOM 1651 OE1 GLU A 103 14.738 -5.013 13.142 1.00 0.00 O ATOM 1652 OE2 GLU A 103 13.029 -6.324 13.582 1.00 0.00 O ATOM 0 H GLU A 103 9.922 -5.142 11.038 1.00 0.00 H new ATOM 0 HA GLU A 103 11.400 -4.230 13.427 1.00 0.00 H new ATOM 0 HB2 GLU A 103 11.858 -3.799 10.449 1.00 0.00 H new ATOM 0 HB3 GLU A 103 12.857 -3.129 11.724 1.00 0.00 H new ATOM 0 HG2 GLU A 103 12.456 -6.083 11.139 1.00 0.00 H new ATOM 0 HG3 GLU A 103 13.877 -5.138 10.740 1.00 0.00 H new ATOM 1659 N VAL A 104 9.688 -2.352 11.297 1.00 0.00 N ATOM 1660 CA VAL A 104 8.955 -1.100 11.168 1.00 0.00 C ATOM 1661 C VAL A 104 7.627 -1.167 11.913 1.00 0.00 C ATOM 1662 O VAL A 104 7.359 -2.126 12.639 1.00 0.00 O ATOM 1663 CB VAL A 104 8.681 -0.756 9.690 1.00 0.00 C ATOM 1664 CG1 VAL A 104 9.984 -0.620 8.919 1.00 0.00 C ATOM 1665 CG2 VAL A 104 7.781 -1.804 9.052 1.00 0.00 C ATOM 0 H VAL A 104 9.678 -2.934 10.459 1.00 0.00 H new ATOM 0 HA VAL A 104 9.580 -0.321 11.604 1.00 0.00 H new ATOM 0 HB VAL A 104 8.164 0.203 9.653 1.00 0.00 H new ATOM 0 HG11 VAL A 104 9.768 -0.377 7.879 1.00 0.00 H new ATOM 0 HG12 VAL A 104 10.586 0.175 9.359 1.00 0.00 H new ATOM 0 HG13 VAL A 104 10.534 -1.560 8.965 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.600 -1.542 8.009 1.00 0.00 H new ATOM 0 HG22 VAL A 104 8.265 -2.779 9.103 1.00 0.00 H new ATOM 0 HG23 VAL A 104 6.832 -1.842 9.586 1.00 0.00 H new ATOM 1675 N ALA A 105 6.799 -0.145 11.730 1.00 0.00 N ATOM 1676 CA ALA A 105 5.498 -0.092 12.383 1.00 0.00 C ATOM 1677 C ALA A 105 4.484 -0.964 11.651 1.00 0.00 C ATOM 1678 O ALA A 105 4.029 -0.624 10.555 1.00 0.00 O ATOM 1679 CB ALA A 105 5.004 1.344 12.460 1.00 0.00 C ATOM 0 H ALA A 105 7.006 0.657 11.135 1.00 0.00 H new ATOM 0 HA ALA A 105 5.610 -0.480 13.396 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.031 1.368 12.950 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.713 1.943 13.032 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.913 1.752 11.453 1.00 0.00 H new ATOM 1685 N GLY A 106 4.137 -2.091 12.263 1.00 0.00 N ATOM 1686 CA GLY A 106 3.176 -2.996 11.664 1.00 0.00 C ATOM 1687 C GLY A 106 1.830 -2.335 11.447 1.00 0.00 C ATOM 1688 O GLY A 106 1.104 -2.680 10.514 1.00 0.00 O ATOM 0 H GLY A 106 4.505 -2.394 13.165 1.00 0.00 H new ATOM 0 HA2 GLY A 106 3.562 -3.354 10.709 1.00 0.00 H new ATOM 0 HA3 GLY A 106 3.052 -3.869 12.305 1.00 0.00 H new ATOM 1692 N ASP A 107 1.498 -1.384 12.315 1.00 0.00 N ATOM 1693 CA ASP A 107 0.230 -0.670 12.225 1.00 0.00 C ATOM 1694 C ASP A 107 0.151 0.155 10.944 1.00 0.00 C ATOM 1695 O ASP A 107 -0.921 0.296 10.354 1.00 0.00 O ATOM 1696 CB ASP A 107 0.046 0.240 13.442 1.00 0.00 C ATOM 1697 CG ASP A 107 0.170 -0.515 14.751 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -0.845 -1.080 15.208 1.00 0.00 O ATOM 1699 OD2 ASP A 107 1.282 -0.541 15.318 1.00 0.00 O ATOM 0 H ASP A 107 2.092 -1.090 13.090 1.00 0.00 H new ATOM 0 HA ASP A 107 -0.570 -1.410 12.205 1.00 0.00 H new ATOM 0 HB2 ASP A 107 0.790 1.036 13.413 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -0.933 0.716 13.392 1.00 0.00 H new ATOM 1704 N ILE A 108 1.285 0.703 10.516 1.00 0.00 N ATOM 1705 CA ILE A 108 1.325 1.512 9.304 1.00 0.00 C ATOM 1706 C ILE A 108 1.173 0.645 8.060 1.00 0.00 C ATOM 1707 O ILE A 108 0.343 0.929 7.196 1.00 0.00 O ATOM 1708 CB ILE A 108 2.635 2.320 9.202 1.00 0.00 C ATOM 1709 CG1 ILE A 108 2.751 3.289 10.382 1.00 0.00 C ATOM 1710 CG2 ILE A 108 2.692 3.075 7.879 1.00 0.00 C ATOM 1711 CD1 ILE A 108 4.062 4.046 10.421 1.00 0.00 C ATOM 0 H ILE A 108 2.183 0.602 10.988 1.00 0.00 H new ATOM 0 HA ILE A 108 0.488 2.208 9.363 1.00 0.00 H new ATOM 0 HB ILE A 108 3.477 1.629 9.238 1.00 0.00 H new ATOM 0 HG12 ILE A 108 1.930 4.004 10.335 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.636 2.731 11.311 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.622 3.640 7.822 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.648 2.365 7.053 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.847 3.760 7.814 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.072 4.713 11.283 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.888 3.339 10.499 1.00 0.00 H new ATOM 0 HD13 ILE A 108 4.171 4.632 9.508 1.00 0.00 H new ATOM 1723 N PHE A 109 1.968 -0.419 7.973 1.00 0.00 N ATOM 1724 CA PHE A 109 1.898 -1.316 6.825 1.00 0.00 C ATOM 1725 C PHE A 109 0.561 -2.044 6.791 1.00 0.00 C ATOM 1726 O PHE A 109 0.077 -2.408 5.721 1.00 0.00 O ATOM 1727 CB PHE A 109 3.043 -2.331 6.831 1.00 0.00 C ATOM 1728 CG PHE A 109 2.989 -3.285 5.666 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.851 -2.810 4.369 1.00 0.00 C ATOM 1730 CD2 PHE A 109 3.060 -4.655 5.866 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.787 -3.680 3.296 1.00 0.00 C ATOM 1732 CE2 PHE A 109 2.995 -5.531 4.798 1.00 0.00 C ATOM 1733 CZ PHE A 109 2.858 -5.043 3.512 1.00 0.00 C ATOM 0 H PHE A 109 2.660 -0.678 8.676 1.00 0.00 H new ATOM 0 HA PHE A 109 1.993 -0.702 5.929 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.994 -1.798 6.814 1.00 0.00 H new ATOM 0 HB3 PHE A 109 3.013 -2.899 7.761 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.793 -1.746 4.195 1.00 0.00 H new ATOM 0 HD2 PHE A 109 3.167 -5.043 6.868 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.682 -3.295 2.292 1.00 0.00 H new ATOM 0 HE2 PHE A 109 3.051 -6.596 4.969 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.807 -5.726 2.677 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.031 -2.248 7.966 1.00 0.00 N ATOM 1744 CA ASP A 110 -1.312 -2.942 8.069 1.00 0.00 C ATOM 1745 C ASP A 110 -2.315 -2.382 7.067 1.00 0.00 C ATOM 1746 O ASP A 110 -3.222 -3.086 6.624 1.00 0.00 O ATOM 1747 CB ASP A 110 -1.869 -2.820 9.488 1.00 0.00 C ATOM 1748 CG ASP A 110 -3.189 -3.546 9.657 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -4.246 -2.916 9.432 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -3.169 -4.743 10.012 1.00 0.00 O ATOM 0 H ASP A 110 0.356 -1.943 8.859 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.146 -3.995 7.841 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.144 -3.222 10.196 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.003 -1.766 9.733 1.00 0.00 H new ATOM 1755 N MET A 111 -2.146 -1.112 6.713 1.00 0.00 N ATOM 1756 CA MET A 111 -3.028 -0.468 5.749 1.00 0.00 C ATOM 1757 C MET A 111 -2.747 -0.998 4.348 1.00 0.00 C ATOM 1758 O MET A 111 -3.652 -1.451 3.645 1.00 0.00 O ATOM 1759 CB MET A 111 -2.832 1.049 5.777 1.00 0.00 C ATOM 1760 CG MET A 111 -3.713 1.795 4.787 1.00 0.00 C ATOM 1761 SD MET A 111 -3.319 3.552 4.691 1.00 0.00 S ATOM 1762 CE MET A 111 -1.629 3.487 4.102 1.00 0.00 C ATOM 0 H MET A 111 -1.408 -0.511 7.079 1.00 0.00 H new ATOM 0 HA MET A 111 -4.060 -0.695 6.018 1.00 0.00 H new ATOM 0 HB2 MET A 111 -3.039 1.415 6.783 1.00 0.00 H new ATOM 0 HB3 MET A 111 -1.787 1.276 5.564 1.00 0.00 H new ATOM 0 HG2 MET A 111 -3.602 1.348 3.799 1.00 0.00 H new ATOM 0 HG3 MET A 111 -4.757 1.676 5.075 1.00 0.00 H new ATOM 0 HE1 MET A 111 -1.465 4.286 3.379 1.00 0.00 H new ATOM 0 HE2 MET A 111 -0.946 3.612 4.942 1.00 0.00 H new ATOM 0 HE3 MET A 111 -1.446 2.524 3.626 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.478 -0.948 3.956 1.00 0.00 N ATOM 1773 CA LEU A 112 -1.058 -1.420 2.645 1.00 0.00 C ATOM 1774 C LEU A 112 -1.239 -2.928 2.534 1.00 0.00 C ATOM 1775 O LEU A 112 -1.366 -3.469 1.440 1.00 0.00 O ATOM 1776 CB LEU A 112 0.402 -1.050 2.383 1.00 0.00 C ATOM 1777 CG LEU A 112 0.690 0.450 2.314 1.00 0.00 C ATOM 1778 CD1 LEU A 112 0.969 1.009 3.701 1.00 0.00 C ATOM 1779 CD2 LEU A 112 1.858 0.727 1.379 1.00 0.00 C ATOM 0 H LEU A 112 -0.720 -0.583 4.533 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.683 -0.936 1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.018 -1.486 3.170 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.713 -1.507 1.444 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.194 0.950 1.917 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.171 2.078 3.629 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.101 0.846 4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.835 0.504 4.129 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.048 1.800 1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.747 0.213 1.745 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.617 0.367 0.379 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.258 -3.595 3.683 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.411 -5.043 3.735 1.00 0.00 C ATOM 1793 C LEU A 113 -2.603 -5.497 2.901 1.00 0.00 C ATOM 1794 O LEU A 113 -2.631 -6.626 2.406 1.00 0.00 O ATOM 1795 CB LEU A 113 -1.573 -5.503 5.186 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.805 -7.004 5.377 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -0.654 -7.805 4.786 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -1.975 -7.328 6.852 1.00 0.00 C ATOM 0 H LEU A 113 -1.169 -3.151 4.597 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.513 -5.497 3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.680 -5.217 5.742 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.410 -4.964 5.629 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.719 -7.281 4.852 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.838 -8.869 4.932 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.574 -7.594 3.720 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.276 -7.526 5.282 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.139 -8.399 6.973 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.076 -7.035 7.395 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.832 -6.783 7.248 1.00 0.00 H new ATOM 1810 N THR A 114 -3.589 -4.616 2.750 1.00 0.00 N ATOM 1811 CA THR A 114 -4.782 -4.926 1.967 1.00 0.00 C ATOM 1812 C THR A 114 -4.434 -5.272 0.516 1.00 0.00 C ATOM 1813 O THR A 114 -5.320 -5.574 -0.284 1.00 0.00 O ATOM 1814 CB THR A 114 -5.779 -3.752 1.975 1.00 0.00 C ATOM 1815 OG1 THR A 114 -5.178 -2.595 1.383 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.222 -3.427 3.394 1.00 0.00 C ATOM 0 H THR A 114 -3.585 -3.682 3.160 1.00 0.00 H new ATOM 0 HA THR A 114 -5.242 -5.795 2.438 1.00 0.00 H new ATOM 0 HB THR A 114 -6.654 -4.045 1.395 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.652 -2.118 2.058 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.926 -2.595 3.374 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.705 -4.300 3.833 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.353 -3.153 3.993 1.00 0.00 H new ATOM 1824 N PHE A 115 -3.144 -5.228 0.182 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.689 -5.545 -1.170 1.00 0.00 C ATOM 1826 C PHE A 115 -2.969 -7.006 -1.509 1.00 0.00 C ATOM 1827 O PHE A 115 -3.111 -7.363 -2.679 1.00 0.00 O ATOM 1828 CB PHE A 115 -1.186 -5.266 -1.318 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.840 -3.819 -1.556 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -1.597 -3.040 -2.421 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.250 -3.238 -0.922 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -1.275 -1.717 -2.648 1.00 0.00 C ATOM 1833 CE2 PHE A 115 0.575 -1.915 -1.145 1.00 0.00 C ATOM 1834 CZ PHE A 115 -0.187 -1.152 -2.008 1.00 0.00 C ATOM 0 H PHE A 115 -2.397 -4.976 0.829 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.240 -4.908 -1.861 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.676 -5.605 -0.416 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.799 -5.860 -2.146 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.449 -3.475 -2.923 1.00 0.00 H new ATOM 0 HD2 PHE A 115 0.851 -3.828 -0.246 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.872 -1.124 -3.325 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.426 -1.476 -0.644 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.066 -0.117 -2.183 1.00 0.00 H new ATOM 1844 N THR A 116 -3.047 -7.846 -0.481 1.00 0.00 N ATOM 1845 CA THR A 116 -3.305 -9.267 -0.677 1.00 0.00 C ATOM 1846 C THR A 116 -4.331 -9.793 0.322 1.00 0.00 C ATOM 1847 O THR A 116 -5.064 -10.740 0.031 1.00 0.00 O ATOM 1848 CB THR A 116 -2.012 -10.095 -0.549 1.00 0.00 C ATOM 1849 OG1 THR A 116 -2.292 -11.483 -0.775 1.00 0.00 O ATOM 1850 CG2 THR A 116 -1.388 -9.917 0.828 1.00 0.00 C ATOM 0 H THR A 116 -2.935 -7.567 0.494 1.00 0.00 H new ATOM 0 HA THR A 116 -3.703 -9.374 -1.686 1.00 0.00 H new ATOM 0 HB THR A 116 -1.306 -9.740 -1.300 1.00 0.00 H new ATOM 0 HG1 THR A 116 -1.464 -12.001 -0.693 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.477 -10.511 0.894 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.148 -8.866 0.985 1.00 0.00 H new ATOM 0 HG23 THR A 116 -2.092 -10.247 1.592 1.00 0.00 H new ATOM 1858 N ASP A 117 -4.381 -9.180 1.502 1.00 0.00 N ATOM 1859 CA ASP A 117 -5.321 -9.599 2.535 1.00 0.00 C ATOM 1860 C ASP A 117 -6.733 -9.120 2.211 1.00 0.00 C ATOM 1861 O ASP A 117 -7.181 -8.087 2.711 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.886 -9.068 3.903 1.00 0.00 C ATOM 1863 CG ASP A 117 -5.522 -9.834 5.047 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -4.965 -10.879 5.443 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -6.575 -9.388 5.548 1.00 0.00 O ATOM 0 H ASP A 117 -3.784 -8.395 1.765 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.325 -10.689 2.566 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -3.801 -9.130 3.986 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.152 -8.014 3.982 1.00 0.00 H new ATOM 1870 N PHE A 118 -7.425 -9.878 1.366 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.786 -9.539 0.962 1.00 0.00 C ATOM 1872 C PHE A 118 -9.703 -9.427 2.175 1.00 0.00 C ATOM 1873 O PHE A 118 -10.672 -8.667 2.166 1.00 0.00 O ATOM 1874 CB PHE A 118 -9.324 -10.596 -0.005 1.00 0.00 C ATOM 1875 CG PHE A 118 -10.669 -10.261 -0.588 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -11.834 -10.652 0.053 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -10.767 -9.559 -1.778 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -13.071 -10.348 -0.483 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.000 -9.253 -2.318 1.00 0.00 C ATOM 1880 CZ PHE A 118 -13.154 -9.647 -1.670 1.00 0.00 C ATOM 0 H PHE A 118 -7.064 -10.735 0.946 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.763 -8.572 0.460 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -8.610 -10.728 -0.818 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -9.393 -11.550 0.517 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -11.774 -11.200 0.982 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -9.868 -9.247 -2.289 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -13.972 -10.658 0.026 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -12.062 -8.706 -3.247 1.00 0.00 H new ATOM 0 HZ PHE A 118 -14.119 -9.407 -2.091 1.00 0.00 H new ATOM 1890 N LEU A 119 -9.389 -10.187 3.218 1.00 0.00 N ATOM 1891 CA LEU A 119 -10.184 -10.181 4.439 1.00 0.00 C ATOM 1892 C LEU A 119 -10.193 -8.797 5.083 1.00 0.00 C ATOM 1893 O LEU A 119 -11.231 -8.324 5.545 1.00 0.00 O ATOM 1894 CB LEU A 119 -9.638 -11.217 5.424 1.00 0.00 C ATOM 1895 CG LEU A 119 -10.506 -11.466 6.660 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -11.866 -12.017 6.256 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -9.804 -12.421 7.614 1.00 0.00 C ATOM 0 H LEU A 119 -8.587 -10.817 3.242 1.00 0.00 H new ATOM 0 HA LEU A 119 -11.210 -10.439 4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.507 -12.162 4.896 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.650 -10.896 5.753 1.00 0.00 H new ATOM 0 HG LEU A 119 -10.661 -10.516 7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -12.469 -12.188 7.148 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -12.371 -11.300 5.608 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -11.733 -12.958 5.722 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -10.433 -12.589 8.489 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -9.622 -13.370 7.110 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -8.854 -11.989 7.928 1.00 0.00 H new ATOM 1909 N ALA A 120 -9.029 -8.152 5.108 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.904 -6.822 5.694 1.00 0.00 C ATOM 1911 C ALA A 120 -9.472 -5.761 4.759 1.00 0.00 C ATOM 1912 O ALA A 120 -9.909 -4.697 5.200 1.00 0.00 O ATOM 1913 CB ALA A 120 -7.448 -6.521 6.015 1.00 0.00 C ATOM 0 H ALA A 120 -8.160 -8.529 4.729 1.00 0.00 H new ATOM 0 HA ALA A 120 -9.478 -6.802 6.620 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -7.370 -5.525 6.452 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -7.072 -7.259 6.724 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.857 -6.563 5.100 1.00 0.00 H new ATOM 1919 N PHE A 121 -9.455 -6.059 3.464 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.964 -5.139 2.453 1.00 0.00 C ATOM 1921 C PHE A 121 -11.472 -4.951 2.608 1.00 0.00 C ATOM 1922 O PHE A 121 -11.962 -3.826 2.738 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.634 -5.677 1.056 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.689 -4.644 -0.036 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -9.085 -3.408 0.127 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.339 -4.917 -1.230 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.128 -2.463 -0.880 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.383 -3.977 -2.241 1.00 0.00 C ATOM 1929 CZ PHE A 121 -9.777 -2.748 -2.065 1.00 0.00 C ATOM 0 H PHE A 121 -9.092 -6.935 3.088 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.486 -4.168 2.585 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.636 -6.115 1.075 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -10.330 -6.480 0.815 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.575 -3.181 1.051 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.816 -5.876 -1.371 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.654 -1.502 -0.740 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -10.890 -4.202 -3.167 1.00 0.00 H new ATOM 0 HZ PHE A 121 -9.811 -2.011 -2.854 1.00 0.00 H new ATOM 1939 N LYS A 122 -12.201 -6.063 2.605 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.650 -6.028 2.751 1.00 0.00 C ATOM 1941 C LYS A 122 -14.034 -5.487 4.123 1.00 0.00 C ATOM 1942 O LYS A 122 -14.928 -4.650 4.243 1.00 0.00 O ATOM 1943 CB LYS A 122 -14.236 -7.429 2.555 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.752 -7.483 2.663 1.00 0.00 C ATOM 1945 CD LYS A 122 -16.277 -8.880 2.381 1.00 0.00 C ATOM 1946 CE LYS A 122 -17.795 -8.926 2.422 1.00 0.00 C ATOM 1947 NZ LYS A 122 -18.316 -10.293 2.145 1.00 0.00 N ATOM 0 H LYS A 122 -11.810 -7.000 2.503 1.00 0.00 H new ATOM 0 HA LYS A 122 -14.059 -5.365 1.988 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.938 -7.803 1.576 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.804 -8.100 3.298 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -16.059 -7.172 3.662 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -16.194 -6.777 1.960 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.929 -9.209 1.402 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -15.871 -9.577 3.115 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -18.142 -8.597 3.401 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -18.199 -8.228 1.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -19.355 -10.283 2.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -18.006 -10.598 1.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -17.951 -10.955 2.859 1.00 0.00 H new ATOM 1961 N GLU A 123 -13.344 -5.966 5.154 1.00 0.00 N ATOM 1962 CA GLU A 123 -13.607 -5.529 6.521 1.00 0.00 C ATOM 1963 C GLU A 123 -13.410 -4.023 6.655 1.00 0.00 C ATOM 1964 O GLU A 123 -14.044 -3.375 7.489 1.00 0.00 O ATOM 1965 CB GLU A 123 -12.688 -6.266 7.498 1.00 0.00 C ATOM 1966 CG GLU A 123 -12.929 -5.903 8.956 1.00 0.00 C ATOM 1967 CD GLU A 123 -14.334 -6.239 9.418 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -14.556 -7.387 9.856 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -15.210 -5.353 9.342 1.00 0.00 O ATOM 0 H GLU A 123 -12.599 -6.657 5.069 1.00 0.00 H new ATOM 0 HA GLU A 123 -14.644 -5.764 6.761 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -12.825 -7.340 7.373 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.651 -6.046 7.244 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.209 -6.431 9.581 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -12.750 -4.837 9.095 1.00 0.00 H new ATOM 1976 N MET A 124 -12.525 -3.471 5.829 1.00 0.00 N ATOM 1977 CA MET A 124 -12.245 -2.040 5.851 1.00 0.00 C ATOM 1978 C MET A 124 -13.446 -1.247 5.346 1.00 0.00 C ATOM 1979 O MET A 124 -13.857 -0.266 5.965 1.00 0.00 O ATOM 1980 CB MET A 124 -11.017 -1.720 4.997 1.00 0.00 C ATOM 1981 CG MET A 124 -10.637 -0.247 5.001 1.00 0.00 C ATOM 1982 SD MET A 124 -9.150 0.093 4.038 1.00 0.00 S ATOM 1983 CE MET A 124 -9.685 -0.397 2.401 1.00 0.00 C ATOM 0 H MET A 124 -11.990 -3.994 5.136 1.00 0.00 H new ATOM 0 HA MET A 124 -12.044 -1.752 6.883 1.00 0.00 H new ATOM 0 HB2 MET A 124 -10.171 -2.305 5.358 1.00 0.00 H new ATOM 0 HB3 MET A 124 -11.207 -2.034 3.971 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.465 0.338 4.601 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.482 0.081 6.029 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.020 0.038 1.655 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.660 -1.484 2.320 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.702 -0.044 2.230 1.00 0.00 H new ATOM 1993 N PHE A 125 -14.000 -1.677 4.217 1.00 0.00 N ATOM 1994 CA PHE A 125 -15.152 -0.999 3.631 1.00 0.00 C ATOM 1995 C PHE A 125 -16.390 -1.136 4.513 1.00 0.00 C ATOM 1996 O PHE A 125 -17.112 -0.164 4.733 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.441 -1.547 2.234 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.331 -1.294 1.255 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -13.941 0.001 0.950 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.678 -2.348 0.642 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -12.919 0.237 0.052 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.656 -2.119 -0.257 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.274 -0.825 -0.553 1.00 0.00 C ATOM 0 H PHE A 125 -13.672 -2.487 3.691 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.907 0.060 3.555 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.618 -2.620 2.302 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.359 -1.095 1.857 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.442 0.834 1.420 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.971 -3.362 0.869 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.624 1.250 -0.177 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.155 -2.951 -0.729 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.474 -0.644 -1.255 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.633 -2.344 5.013 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.788 -2.594 5.871 1.00 0.00 C ATOM 2015 C LEU A 126 -17.703 -1.766 7.149 1.00 0.00 C ATOM 2016 O LEU A 126 -18.715 -1.264 7.643 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.892 -4.080 6.218 1.00 0.00 C ATOM 2018 CG LEU A 126 -18.669 -4.933 5.210 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.956 -4.971 3.867 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.866 -6.342 5.748 1.00 0.00 C ATOM 0 H LEU A 126 -16.049 -3.162 4.840 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.682 -2.298 5.323 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.885 -4.486 6.313 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -18.368 -4.176 7.194 1.00 0.00 H new ATOM 0 HG LEU A 126 -19.648 -4.477 5.061 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -18.527 -5.583 3.169 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -17.867 -3.958 3.474 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -16.962 -5.399 3.995 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -19.420 -6.935 5.020 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -17.894 -6.802 5.927 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -19.425 -6.300 6.682 1.00 0.00 H new ATOM 2032 N ASP A 127 -16.493 -1.625 7.681 1.00 0.00 N ATOM 2033 CA ASP A 127 -16.281 -0.855 8.900 1.00 0.00 C ATOM 2034 C ASP A 127 -16.503 0.632 8.640 1.00 0.00 C ATOM 2035 O ASP A 127 -17.063 1.343 9.475 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.868 -1.091 9.440 1.00 0.00 C ATOM 2037 CG ASP A 127 -14.581 -0.279 10.689 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -14.930 -0.744 11.794 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -14.005 0.822 10.561 1.00 0.00 O ATOM 0 H ASP A 127 -15.646 -2.034 7.287 1.00 0.00 H new ATOM 0 HA ASP A 127 -17.002 -1.188 9.646 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.739 -2.150 9.662 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -14.141 -0.836 8.669 1.00 0.00 H new ATOM 2044 N TYR A 128 -16.064 1.093 7.472 1.00 0.00 N ATOM 2045 CA TYR A 128 -16.217 2.493 7.097 1.00 0.00 C ATOM 2046 C TYR A 128 -17.687 2.837 6.893 1.00 0.00 C ATOM 2047 O TYR A 128 -18.128 3.941 7.211 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.426 2.791 5.822 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.526 4.230 5.363 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -14.734 5.217 5.934 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.414 4.598 4.359 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -14.822 6.531 5.518 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -16.508 5.911 3.937 1.00 0.00 C ATOM 2054 CZ TYR A 128 -15.710 6.873 4.520 1.00 0.00 C ATOM 2055 OH TYR A 128 -15.802 8.182 4.102 1.00 0.00 O ATOM 0 H TYR A 128 -15.600 0.517 6.770 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.826 3.109 7.907 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.378 2.545 5.990 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -15.782 2.139 5.024 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -14.038 4.953 6.716 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -17.040 3.846 3.901 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -14.198 7.287 5.972 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -17.202 6.182 3.155 1.00 0.00 H new ATOM 0 HH TYR A 128 -16.474 8.252 3.392 1.00 0.00 H new ATOM 2065 N ARG A 129 -18.442 1.880 6.360 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.865 2.075 6.113 1.00 0.00 C ATOM 2067 C ARG A 129 -20.628 2.198 7.427 1.00 0.00 C ATOM 2068 O ARG A 129 -21.576 2.975 7.536 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.421 0.911 5.291 1.00 0.00 C ATOM 2070 CG ARG A 129 -21.876 1.085 4.891 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.366 -0.090 4.062 1.00 0.00 C ATOM 2072 NE ARG A 129 -23.753 0.078 3.635 1.00 0.00 N ATOM 2073 CZ ARG A 129 -24.440 -0.851 2.979 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -23.874 -2.014 2.683 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -25.695 -0.620 2.619 1.00 0.00 N ATOM 0 H ARG A 129 -18.090 0.961 6.091 1.00 0.00 H new ATOM 0 HA ARG A 129 -19.993 3.000 5.551 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -19.818 0.793 4.391 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -20.319 -0.009 5.866 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.492 1.184 5.785 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -21.991 2.007 4.322 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -21.729 -0.205 3.185 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -22.275 -1.007 4.645 1.00 0.00 H new ATOM 0 HE ARG A 129 -24.220 0.958 3.853 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -22.909 -2.197 2.959 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -24.404 -2.725 2.179 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -26.135 0.272 2.846 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -26.221 -1.334 2.115 1.00 0.00 H new ATOM 2089 N ALA A 130 -20.207 1.424 8.423 1.00 0.00 N ATOM 2090 CA ALA A 130 -20.849 1.447 9.730 1.00 0.00 C ATOM 2091 C ALA A 130 -20.585 2.767 10.443 1.00 0.00 C ATOM 2092 O ALA A 130 -21.427 3.259 11.195 1.00 0.00 O ATOM 2093 CB ALA A 130 -20.367 0.278 10.578 1.00 0.00 C ATOM 0 H ALA A 130 -19.424 0.774 8.348 1.00 0.00 H new ATOM 0 HA ALA A 130 -21.925 1.351 9.583 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -20.856 0.309 11.552 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -20.612 -0.659 10.079 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -19.287 0.346 10.712 1.00 0.00 H new ATOM 2099 N GLU A 131 -19.409 3.340 10.199 1.00 0.00 N ATOM 2100 CA GLU A 131 -19.033 4.607 10.816 1.00 0.00 C ATOM 2101 C GLU A 131 -19.896 5.749 10.281 1.00 0.00 C ATOM 2102 O GLU A 131 -19.941 6.833 10.865 1.00 0.00 O ATOM 2103 CB GLU A 131 -17.551 4.899 10.560 1.00 0.00 C ATOM 2104 CG GLU A 131 -17.039 6.139 11.275 1.00 0.00 C ATOM 2105 CD GLU A 131 -15.565 6.390 11.023 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -15.241 7.085 10.038 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -14.735 5.893 11.814 1.00 0.00 O ATOM 0 H GLU A 131 -18.701 2.947 9.579 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.198 4.528 11.890 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.961 4.039 10.876 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.393 5.018 9.488 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.613 7.006 10.947 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.208 6.032 12.347 1.00 0.00 H new