USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=21 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 71 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 114 THR OG1 : rot -83:sc= 0.494 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -166:sc= -0.223 (180deg=-0.552) USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 41 GLN : amide:sc= 0.177 X(o=0.18,f=0) USER MOD Single : A 43 ASN : amide:sc= -0.42 K(o=-0.42,f=-2.8) USER MOD Single : A 45 MET CE :methyl -119:sc= -0.691 (180deg=-1) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot -24:sc= 0.447 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 108:sc= 0.00956 USER MOD Single : A 58 ASN : amide:sc= 0.116 K(o=0.12,f=-4.6!) USER MOD Single : A 59 LYS NZ :NH3+ 166:sc= -0.0373 (180deg=-0.264) 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 K(o=0,f=-0.79) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.42 X(o=-0.42,f=-0.17) USER MOD Single : A 83 GLN : amide:sc= -0.0817 X(o=-0.082,f=-0.19) USER MOD Single : A 89 ASN : amide:sc= -5.26! K(o=-5.3!,f=0.31) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot -80:sc= 0.0218 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 89:sc= 0.569 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0.04) USER MOD Single : A 99 HIS : no HD1:sc= -0.211 X(o=-0.21,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -1.11 K(o=-1.1,f=-0.21) USER MOD Single : A 101 LYS NZ :NH3+ 163:sc= -0.0583 (180deg=-0.405) USER MOD Single : A 111 MET CE :methyl 133:sc= -0.173 (180deg=-0.798) 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 164:sc= -0.316 (180deg=-0.793) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 242 N ALA A 19 20.294 1.718 4.805 1.00 0.00 N ATOM 243 CA ALA A 19 19.632 2.967 5.169 1.00 0.00 C ATOM 244 C ALA A 19 18.570 3.354 4.143 1.00 0.00 C ATOM 245 O ALA A 19 17.634 4.092 4.454 1.00 0.00 O ATOM 246 CB ALA A 19 20.657 4.084 5.313 1.00 0.00 C ATOM 0 HA ALA A 19 19.133 2.815 6.126 1.00 0.00 H new ATOM 0 HB1 ALA A 19 20.150 5.010 5.585 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.374 3.821 6.090 1.00 0.00 H new ATOM 0 HB3 ALA A 19 21.181 4.221 4.367 1.00 0.00 H new ATOM 252 N GLU A 20 18.722 2.852 2.920 1.00 0.00 N ATOM 253 CA GLU A 20 17.776 3.149 1.848 1.00 0.00 C ATOM 254 C GLU A 20 16.359 2.760 2.255 1.00 0.00 C ATOM 255 O GLU A 20 15.414 3.517 2.038 1.00 0.00 O ATOM 256 CB GLU A 20 18.175 2.407 0.570 1.00 0.00 C ATOM 257 CG GLU A 20 17.634 3.041 -0.705 1.00 0.00 C ATOM 258 CD GLU A 20 16.120 3.007 -0.787 1.00 0.00 C ATOM 259 OE1 GLU A 20 15.562 1.915 -1.018 1.00 0.00 O ATOM 260 OE2 GLU A 20 15.493 4.075 -0.622 1.00 0.00 O ATOM 0 H GLU A 20 19.490 2.239 2.647 1.00 0.00 H new ATOM 0 HA GLU A 20 17.800 4.222 1.659 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.263 2.365 0.510 1.00 0.00 H new ATOM 0 HB3 GLU A 20 17.819 1.379 0.632 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.972 4.076 -0.762 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.051 2.522 -1.568 1.00 0.00 H new ATOM 267 N PHE A 21 16.219 1.576 2.847 1.00 0.00 N ATOM 268 CA PHE A 21 14.916 1.090 3.290 1.00 0.00 C ATOM 269 C PHE A 21 14.224 2.125 4.171 1.00 0.00 C ATOM 270 O PHE A 21 13.041 2.418 3.991 1.00 0.00 O ATOM 271 CB PHE A 21 15.069 -0.230 4.054 1.00 0.00 C ATOM 272 CG PHE A 21 13.795 -0.717 4.685 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.906 -1.506 3.973 1.00 0.00 C ATOM 274 CD2 PHE A 21 13.486 -0.380 5.994 1.00 0.00 C ATOM 275 CE1 PHE A 21 11.733 -1.950 4.554 1.00 0.00 C ATOM 276 CE2 PHE A 21 12.314 -0.820 6.579 1.00 0.00 C ATOM 277 CZ PHE A 21 11.437 -1.606 5.859 1.00 0.00 C ATOM 0 H PHE A 21 16.992 0.936 3.031 1.00 0.00 H new ATOM 0 HA PHE A 21 14.300 0.918 2.407 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.440 -0.994 3.370 1.00 0.00 H new ATOM 0 HB3 PHE A 21 15.823 -0.104 4.831 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.132 -1.777 2.952 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.169 0.233 6.563 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.049 -2.565 3.989 1.00 0.00 H new ATOM 0 HE2 PHE A 21 12.084 -0.549 7.599 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.521 -1.952 6.315 1.00 0.00 H new ATOM 287 N ASP A 22 14.970 2.675 5.124 1.00 0.00 N ATOM 288 CA ASP A 22 14.429 3.681 6.032 1.00 0.00 C ATOM 289 C ASP A 22 13.907 4.882 5.254 1.00 0.00 C ATOM 290 O ASP A 22 12.861 5.441 5.582 1.00 0.00 O ATOM 291 CB ASP A 22 15.498 4.130 7.029 1.00 0.00 C ATOM 292 CG ASP A 22 15.963 3.000 7.927 1.00 0.00 C ATOM 293 OD1 ASP A 22 16.905 2.280 7.536 1.00 0.00 O ATOM 294 OD2 ASP A 22 15.383 2.835 9.021 1.00 0.00 O ATOM 0 H ASP A 22 15.949 2.442 5.288 1.00 0.00 H new ATOM 0 HA ASP A 22 13.600 3.233 6.580 1.00 0.00 H new ATOM 0 HB2 ASP A 22 16.352 4.533 6.485 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.101 4.939 7.643 1.00 0.00 H new ATOM 299 N ALA A 23 14.646 5.272 4.220 1.00 0.00 N ATOM 300 CA ALA A 23 14.257 6.403 3.387 1.00 0.00 C ATOM 301 C ALA A 23 12.914 6.145 2.714 1.00 0.00 C ATOM 302 O ALA A 23 12.073 7.040 2.620 1.00 0.00 O ATOM 303 CB ALA A 23 15.326 6.684 2.343 1.00 0.00 C ATOM 0 H ALA A 23 15.517 4.821 3.940 1.00 0.00 H new ATOM 0 HA ALA A 23 14.155 7.279 4.028 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.021 7.531 1.729 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.268 6.917 2.840 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.457 5.806 1.711 1.00 0.00 H new ATOM 309 N VAL A 24 12.720 4.913 2.249 1.00 0.00 N ATOM 310 CA VAL A 24 11.477 4.532 1.587 1.00 0.00 C ATOM 311 C VAL A 24 10.284 4.722 2.515 1.00 0.00 C ATOM 312 O VAL A 24 9.250 5.253 2.110 1.00 0.00 O ATOM 313 CB VAL A 24 11.517 3.067 1.110 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.247 2.716 0.349 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.745 2.817 0.251 1.00 0.00 C ATOM 0 H VAL A 24 13.408 4.163 2.319 1.00 0.00 H new ATOM 0 HA VAL A 24 11.368 5.182 0.719 1.00 0.00 H new ATOM 0 HB VAL A 24 11.578 2.423 1.987 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.295 1.678 0.021 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.383 2.851 1.000 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.152 3.367 -0.520 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.755 1.777 -0.076 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.719 3.471 -0.621 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.644 3.023 0.832 1.00 0.00 H new ATOM 325 N VAL A 25 10.434 4.282 3.762 1.00 0.00 N ATOM 326 CA VAL A 25 9.369 4.410 4.749 1.00 0.00 C ATOM 327 C VAL A 25 8.998 5.873 4.961 1.00 0.00 C ATOM 328 O VAL A 25 7.827 6.208 5.137 1.00 0.00 O ATOM 329 CB VAL A 25 9.772 3.790 6.101 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.638 3.909 7.108 1.00 0.00 C ATOM 331 CG2 VAL A 25 10.184 2.337 5.921 1.00 0.00 C ATOM 0 H VAL A 25 11.282 3.835 4.111 1.00 0.00 H new ATOM 0 HA VAL A 25 8.507 3.869 4.358 1.00 0.00 H new ATOM 0 HB VAL A 25 10.628 4.342 6.489 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.944 3.465 8.055 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.397 4.961 7.262 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.759 3.387 6.730 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.465 1.916 6.886 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.349 1.771 5.508 1.00 0.00 H new ATOM 0 HG23 VAL A 25 11.033 2.281 5.240 1.00 0.00 H new ATOM 341 N GLY A 26 10.007 6.741 4.944 1.00 0.00 N ATOM 342 CA GLY A 26 9.766 8.160 5.133 1.00 0.00 C ATOM 343 C GLY A 26 8.880 8.742 4.050 1.00 0.00 C ATOM 344 O GLY A 26 7.883 9.402 4.343 1.00 0.00 O ATOM 0 H GLY A 26 10.985 6.487 4.803 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.301 8.321 6.105 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.719 8.690 5.144 1.00 0.00 H new ATOM 348 N TYR A 27 9.245 8.495 2.795 1.00 0.00 N ATOM 349 CA TYR A 27 8.473 8.996 1.664 1.00 0.00 C ATOM 350 C TYR A 27 7.037 8.490 1.722 1.00 0.00 C ATOM 351 O TYR A 27 6.105 9.196 1.338 1.00 0.00 O ATOM 352 CB TYR A 27 9.120 8.573 0.343 1.00 0.00 C ATOM 353 CG TYR A 27 10.524 9.106 0.152 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.795 10.463 0.277 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.576 8.252 -0.156 1.00 0.00 C ATOM 356 CE1 TYR A 27 12.076 10.954 0.102 1.00 0.00 C ATOM 357 CE2 TYR A 27 12.859 8.736 -0.332 1.00 0.00 C ATOM 358 CZ TYR A 27 13.104 10.086 -0.201 1.00 0.00 C ATOM 359 OH TYR A 27 14.380 10.570 -0.376 1.00 0.00 O ATOM 0 H TYR A 27 10.069 7.952 2.537 1.00 0.00 H new ATOM 0 HA TYR A 27 8.462 10.084 1.720 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.145 7.484 0.294 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.496 8.915 -0.482 1.00 0.00 H new ATOM 0 HD1 TYR A 27 9.992 11.145 0.515 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.388 7.193 -0.260 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.270 12.012 0.202 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.666 8.059 -0.571 1.00 0.00 H new ATOM 0 HH TYR A 27 14.986 9.828 -0.583 1.00 0.00 H new ATOM 369 N LEU A 28 6.868 7.264 2.208 1.00 0.00 N ATOM 370 CA LEU A 28 5.543 6.664 2.320 1.00 0.00 C ATOM 371 C LEU A 28 4.657 7.475 3.260 1.00 0.00 C ATOM 372 O LEU A 28 3.511 7.779 2.934 1.00 0.00 O ATOM 373 CB LEU A 28 5.652 5.221 2.820 1.00 0.00 C ATOM 374 CG LEU A 28 6.235 4.222 1.815 1.00 0.00 C ATOM 375 CD1 LEU A 28 6.429 2.862 2.467 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.333 4.102 0.594 1.00 0.00 C ATOM 0 H LEU A 28 7.630 6.668 2.530 1.00 0.00 H new ATOM 0 HA LEU A 28 5.087 6.663 1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.270 5.211 3.718 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.659 4.879 3.113 1.00 0.00 H new ATOM 0 HG LEU A 28 7.207 4.592 1.490 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.844 2.165 1.739 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.114 2.957 3.309 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.468 2.488 2.821 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.764 3.388 -0.108 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.346 3.757 0.903 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.242 5.075 0.112 1.00 0.00 H new ATOM 388 N GLU A 29 5.197 7.826 4.424 1.00 0.00 N ATOM 389 CA GLU A 29 4.454 8.604 5.410 1.00 0.00 C ATOM 390 C GLU A 29 3.996 9.935 4.820 1.00 0.00 C ATOM 391 O GLU A 29 2.877 10.381 5.070 1.00 0.00 O ATOM 392 CB GLU A 29 5.314 8.856 6.649 1.00 0.00 C ATOM 393 CG GLU A 29 5.768 7.583 7.346 1.00 0.00 C ATOM 394 CD GLU A 29 6.677 7.861 8.528 1.00 0.00 C ATOM 395 OE1 GLU A 29 7.900 8.004 8.316 1.00 0.00 O ATOM 396 OE2 GLU A 29 6.166 7.935 9.665 1.00 0.00 O ATOM 0 H GLU A 29 6.146 7.584 4.707 1.00 0.00 H new ATOM 0 HA GLU A 29 3.574 8.029 5.698 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.192 9.434 6.360 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.749 9.465 7.355 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.894 7.028 7.686 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.291 6.948 6.631 1.00 0.00 H new ATOM 403 N ASP A 30 4.868 10.562 4.036 1.00 0.00 N ATOM 404 CA ASP A 30 4.554 11.843 3.412 1.00 0.00 C ATOM 405 C ASP A 30 3.382 11.709 2.443 1.00 0.00 C ATOM 406 O ASP A 30 2.589 12.638 2.284 1.00 0.00 O ATOM 407 CB ASP A 30 5.777 12.389 2.673 1.00 0.00 C ATOM 408 CG ASP A 30 6.946 12.658 3.601 1.00 0.00 C ATOM 409 OD1 ASP A 30 6.853 13.603 4.413 1.00 0.00 O ATOM 410 OD2 ASP A 30 7.953 11.925 3.516 1.00 0.00 O ATOM 0 H ASP A 30 5.798 10.204 3.818 1.00 0.00 H new ATOM 0 HA ASP A 30 4.271 12.539 4.202 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.082 11.676 1.907 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.505 13.311 2.160 1.00 0.00 H new ATOM 415 N ILE A 31 3.279 10.550 1.800 1.00 0.00 N ATOM 416 CA ILE A 31 2.206 10.298 0.843 1.00 0.00 C ATOM 417 C ILE A 31 0.894 9.972 1.554 1.00 0.00 C ATOM 418 O ILE A 31 -0.176 10.406 1.130 1.00 0.00 O ATOM 419 CB ILE A 31 2.565 9.140 -0.111 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.856 9.458 -0.871 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.423 8.874 -1.084 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.411 8.282 -1.646 1.00 0.00 C ATOM 0 H ILE A 31 3.925 9.770 1.924 1.00 0.00 H new ATOM 0 HA ILE A 31 2.080 11.212 0.262 1.00 0.00 H new ATOM 0 HB ILE A 31 2.725 8.240 0.482 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.668 10.280 -1.561 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.609 9.803 -0.162 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.695 8.054 -1.749 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.525 8.607 -0.527 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.231 9.770 -1.674 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.325 8.583 -2.158 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.632 7.465 -0.959 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.676 7.950 -2.380 1.00 0.00 H new ATOM 434 N ILE A 32 0.986 9.209 2.639 1.00 0.00 N ATOM 435 CA ILE A 32 -0.194 8.821 3.405 1.00 0.00 C ATOM 436 C ILE A 32 -0.858 10.033 4.058 1.00 0.00 C ATOM 437 O ILE A 32 -2.075 10.060 4.242 1.00 0.00 O ATOM 438 CB ILE A 32 0.163 7.788 4.496 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.813 6.555 3.864 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.079 7.388 5.282 1.00 0.00 C ATOM 441 CD1 ILE A 32 1.462 5.627 4.870 1.00 0.00 C ATOM 0 H ILE A 32 1.865 8.847 3.008 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.894 8.370 2.701 1.00 0.00 H new ATOM 0 HB ILE A 32 0.873 8.244 5.185 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.057 6.002 3.307 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.565 6.880 3.145 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.807 6.660 6.046 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.508 8.270 5.758 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.812 6.948 4.605 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.901 4.776 4.349 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.242 6.164 5.410 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.711 5.272 5.575 1.00 0.00 H new ATOM 453 N MET A 33 -0.052 11.034 4.403 1.00 0.00 N ATOM 454 CA MET A 33 -0.567 12.245 5.038 1.00 0.00 C ATOM 455 C MET A 33 -0.810 13.347 4.011 1.00 0.00 C ATOM 456 O MET A 33 -1.122 14.482 4.370 1.00 0.00 O ATOM 457 CB MET A 33 0.406 12.742 6.109 1.00 0.00 C ATOM 458 CG MET A 33 0.668 11.732 7.214 1.00 0.00 C ATOM 459 SD MET A 33 1.740 12.378 8.512 1.00 0.00 S ATOM 460 CE MET A 33 3.229 12.733 7.582 1.00 0.00 C ATOM 0 H MET A 33 0.957 11.031 4.254 1.00 0.00 H new ATOM 0 HA MET A 33 -1.519 11.994 5.506 1.00 0.00 H new ATOM 0 HB2 MET A 33 1.352 13.002 5.635 1.00 0.00 H new ATOM 0 HB3 MET A 33 0.010 13.656 6.551 1.00 0.00 H new ATOM 0 HG2 MET A 33 -0.282 11.426 7.653 1.00 0.00 H new ATOM 0 HG3 MET A 33 1.123 10.840 6.784 1.00 0.00 H new ATOM 0 HE1 MET A 33 4.057 12.901 8.271 1.00 0.00 H new ATOM 0 HE2 MET A 33 3.462 11.889 6.933 1.00 0.00 H new ATOM 0 HE3 MET A 33 3.075 13.626 6.976 1.00 0.00 H new ATOM 470 N ASP A 34 -0.668 13.007 2.734 1.00 0.00 N ATOM 471 CA ASP A 34 -0.872 13.974 1.661 1.00 0.00 C ATOM 472 C ASP A 34 -2.359 14.254 1.459 1.00 0.00 C ATOM 473 O ASP A 34 -3.176 13.333 1.438 1.00 0.00 O ATOM 474 CB ASP A 34 -0.253 13.460 0.360 1.00 0.00 C ATOM 475 CG ASP A 34 -0.323 14.481 -0.757 1.00 0.00 C ATOM 476 OD1 ASP A 34 -1.344 14.507 -1.474 1.00 0.00 O ATOM 477 OD2 ASP A 34 0.644 15.255 -0.915 1.00 0.00 O ATOM 0 H ASP A 34 -0.413 12.072 2.417 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.381 14.905 1.943 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.788 13.191 0.538 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.768 12.551 0.050 1.00 0.00 H new ATOM 482 N ASP A 35 -2.701 15.531 1.310 1.00 0.00 N ATOM 483 CA ASP A 35 -4.091 15.936 1.117 1.00 0.00 C ATOM 484 C ASP A 35 -4.698 15.271 -0.115 1.00 0.00 C ATOM 485 O ASP A 35 -5.785 14.697 -0.048 1.00 0.00 O ATOM 486 CB ASP A 35 -4.186 17.458 0.983 1.00 0.00 C ATOM 487 CG ASP A 35 -3.632 18.181 2.196 1.00 0.00 C ATOM 488 OD1 ASP A 35 -4.391 18.380 3.167 1.00 0.00 O ATOM 489 OD2 ASP A 35 -2.439 18.549 2.172 1.00 0.00 O ATOM 0 H ASP A 35 -2.035 16.303 1.319 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.655 15.613 1.992 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.642 17.776 0.094 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.228 17.743 0.838 1.00 0.00 H new ATOM 494 N GLU A 36 -3.991 15.353 -1.240 1.00 0.00 N ATOM 495 CA GLU A 36 -4.466 14.761 -2.487 1.00 0.00 C ATOM 496 C GLU A 36 -4.666 13.255 -2.338 1.00 0.00 C ATOM 497 O GLU A 36 -5.463 12.651 -3.056 1.00 0.00 O ATOM 498 CB GLU A 36 -3.479 15.049 -3.621 1.00 0.00 C ATOM 499 CG GLU A 36 -3.943 14.549 -4.980 1.00 0.00 C ATOM 500 CD GLU A 36 -5.211 15.234 -5.453 1.00 0.00 C ATOM 501 OE1 GLU A 36 -6.310 14.765 -5.091 1.00 0.00 O ATOM 502 OE2 GLU A 36 -5.103 16.239 -6.187 1.00 0.00 O ATOM 0 H GLU A 36 -3.089 15.823 -1.313 1.00 0.00 H new ATOM 0 HA GLU A 36 -5.429 15.212 -2.729 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.309 16.124 -3.678 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.521 14.588 -3.382 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.152 14.712 -5.712 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -4.113 13.474 -4.928 1.00 0.00 H new ATOM 509 N PHE A 37 -3.937 12.656 -1.401 1.00 0.00 N ATOM 510 CA PHE A 37 -4.036 11.220 -1.158 1.00 0.00 C ATOM 511 C PHE A 37 -5.333 10.879 -0.434 1.00 0.00 C ATOM 512 O PHE A 37 -6.013 9.913 -0.781 1.00 0.00 O ATOM 513 CB PHE A 37 -2.837 10.739 -0.337 1.00 0.00 C ATOM 514 CG PHE A 37 -2.880 9.273 -0.014 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.581 8.328 -0.982 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.218 8.839 1.258 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.619 6.978 -0.687 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.257 7.491 1.559 1.00 0.00 C ATOM 519 CZ PHE A 37 -2.958 6.559 0.585 1.00 0.00 C ATOM 0 H PHE A 37 -3.272 13.141 -0.798 1.00 0.00 H new ATOM 0 HA PHE A 37 -4.036 10.711 -2.122 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.921 10.955 -0.886 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.792 11.306 0.593 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.315 8.650 -1.978 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.454 9.563 2.024 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.384 6.251 -1.451 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.521 7.167 2.555 1.00 0.00 H new ATOM 0 HZ PHE A 37 -2.989 5.505 0.817 1.00 0.00 H new ATOM 529 N GLN A 38 -5.669 11.675 0.575 1.00 0.00 N ATOM 530 CA GLN A 38 -6.885 11.460 1.349 1.00 0.00 C ATOM 531 C GLN A 38 -8.124 11.680 0.487 1.00 0.00 C ATOM 532 O GLN A 38 -9.125 10.979 0.631 1.00 0.00 O ATOM 533 CB GLN A 38 -6.915 12.399 2.556 1.00 0.00 C ATOM 534 CG GLN A 38 -5.755 12.188 3.515 1.00 0.00 C ATOM 535 CD GLN A 38 -5.751 13.186 4.656 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.201 14.321 4.505 1.00 0.00 O ATOM 537 NE2 GLN A 38 -5.240 12.764 5.807 1.00 0.00 N ATOM 0 H GLN A 38 -5.115 12.477 0.876 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.888 10.428 1.699 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.903 13.431 2.205 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.852 12.257 3.094 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -5.804 11.178 3.921 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -4.816 12.266 2.966 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -4.878 11.814 5.886 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -5.210 13.390 6.612 1.00 0.00 H new ATOM 546 N LEU A 39 -8.044 12.657 -0.409 1.00 0.00 N ATOM 547 CA LEU A 39 -9.156 12.974 -1.296 1.00 0.00 C ATOM 548 C LEU A 39 -9.383 11.860 -2.312 1.00 0.00 C ATOM 549 O LEU A 39 -10.497 11.361 -2.462 1.00 0.00 O ATOM 550 CB LEU A 39 -8.890 14.296 -2.022 1.00 0.00 C ATOM 551 CG LEU A 39 -9.931 14.681 -3.075 1.00 0.00 C ATOM 552 CD1 LEU A 39 -11.295 14.879 -2.433 1.00 0.00 C ATOM 553 CD2 LEU A 39 -9.499 15.937 -3.814 1.00 0.00 C ATOM 0 H LEU A 39 -7.220 13.243 -0.540 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.056 13.071 -0.689 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.833 15.094 -1.281 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.914 14.238 -2.503 1.00 0.00 H new ATOM 0 HG LEU A 39 -10.009 13.867 -3.796 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -12.021 15.152 -3.199 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.608 13.953 -1.950 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -11.235 15.674 -1.689 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.250 16.197 -4.559 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.392 16.758 -3.105 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.544 15.758 -4.308 1.00 0.00 H new ATOM 565 N LEU A 40 -8.318 11.476 -3.007 1.00 0.00 N ATOM 566 CA LEU A 40 -8.396 10.424 -4.015 1.00 0.00 C ATOM 567 C LEU A 40 -8.878 9.109 -3.406 1.00 0.00 C ATOM 568 O LEU A 40 -9.808 8.483 -3.914 1.00 0.00 O ATOM 569 CB LEU A 40 -7.026 10.232 -4.676 1.00 0.00 C ATOM 570 CG LEU A 40 -6.953 9.127 -5.731 1.00 0.00 C ATOM 571 CD1 LEU A 40 -6.002 9.523 -6.850 1.00 0.00 C ATOM 572 CD2 LEU A 40 -6.510 7.816 -5.100 1.00 0.00 C ATOM 0 H LEU A 40 -7.388 11.878 -2.891 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.120 10.728 -4.770 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.731 11.173 -5.140 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.294 10.016 -3.898 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.948 8.989 -6.154 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.962 8.726 -7.592 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.356 10.440 -7.321 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.006 9.687 -6.440 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.464 7.041 -5.865 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.525 7.943 -4.652 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.224 7.523 -4.330 1.00 0.00 H new ATOM 584 N GLN A 41 -8.241 8.700 -2.314 1.00 0.00 N ATOM 585 CA GLN A 41 -8.596 7.455 -1.638 1.00 0.00 C ATOM 586 C GLN A 41 -10.060 7.451 -1.199 1.00 0.00 C ATOM 587 O GLN A 41 -10.781 6.483 -1.436 1.00 0.00 O ATOM 588 CB GLN A 41 -7.686 7.234 -0.427 1.00 0.00 C ATOM 589 CG GLN A 41 -8.004 5.970 0.352 1.00 0.00 C ATOM 590 CD GLN A 41 -7.055 5.745 1.514 1.00 0.00 C ATOM 591 OE1 GLN A 41 -7.296 6.211 2.627 1.00 0.00 O ATOM 592 NE2 GLN A 41 -5.966 5.029 1.258 1.00 0.00 N ATOM 0 H GLN A 41 -7.475 9.212 -1.877 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.457 6.640 -2.349 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.650 7.191 -0.765 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.769 8.092 0.240 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.025 6.027 0.728 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.959 5.113 -0.320 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.806 4.662 0.320 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.290 4.846 1.999 1.00 0.00 H new ATOM 601 N ARG A 42 -10.494 8.531 -0.560 1.00 0.00 N ATOM 602 CA ARG A 42 -11.871 8.635 -0.085 1.00 0.00 C ATOM 603 C ARG A 42 -12.859 8.677 -1.249 1.00 0.00 C ATOM 604 O ARG A 42 -13.970 8.157 -1.150 1.00 0.00 O ATOM 605 CB ARG A 42 -12.039 9.882 0.786 1.00 0.00 C ATOM 606 CG ARG A 42 -13.434 10.034 1.372 1.00 0.00 C ATOM 607 CD ARG A 42 -13.545 11.287 2.225 1.00 0.00 C ATOM 608 NE ARG A 42 -14.877 11.438 2.807 1.00 0.00 N ATOM 609 CZ ARG A 42 -15.141 12.221 3.849 1.00 0.00 C ATOM 610 NH1 ARG A 42 -14.170 12.915 4.427 1.00 0.00 N ATOM 611 NH2 ARG A 42 -16.380 12.311 4.315 1.00 0.00 N ATOM 0 H ARG A 42 -9.915 9.346 -0.359 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.085 7.748 0.511 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.314 9.847 1.600 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.806 10.765 0.190 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.166 10.075 0.566 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -13.674 9.159 1.976 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.803 11.249 3.023 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.314 12.161 1.616 1.00 0.00 H new ATOM 0 HE ARG A 42 -15.647 10.914 2.391 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.216 12.850 4.073 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.377 13.514 5.226 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -17.131 11.779 3.874 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -16.582 12.912 5.114 1.00 0.00 H new ATOM 625 N ASN A 43 -12.446 9.295 -2.350 1.00 0.00 N ATOM 626 CA ASN A 43 -13.299 9.413 -3.529 1.00 0.00 C ATOM 627 C ASN A 43 -13.599 8.047 -4.141 1.00 0.00 C ATOM 628 O ASN A 43 -14.750 7.739 -4.453 1.00 0.00 O ATOM 629 CB ASN A 43 -12.643 10.324 -4.568 1.00 0.00 C ATOM 630 CG ASN A 43 -12.821 11.794 -4.242 1.00 0.00 C ATOM 631 OD1 ASN A 43 -12.961 12.170 -3.077 1.00 0.00 O ATOM 632 ND2 ASN A 43 -12.814 12.636 -5.270 1.00 0.00 N ATOM 0 H ASN A 43 -11.525 9.722 -2.452 1.00 0.00 H new ATOM 0 HA ASN A 43 -14.245 9.853 -3.213 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.579 10.094 -4.629 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -13.070 10.118 -5.549 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.927 13.637 -5.110 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.695 12.281 -6.219 1.00 0.00 H new ATOM 639 N PHE A 44 -12.565 7.228 -4.311 1.00 0.00 N ATOM 640 CA PHE A 44 -12.733 5.900 -4.891 1.00 0.00 C ATOM 641 C PHE A 44 -13.407 4.945 -3.910 1.00 0.00 C ATOM 642 O PHE A 44 -14.344 4.234 -4.271 1.00 0.00 O ATOM 643 CB PHE A 44 -11.383 5.335 -5.341 1.00 0.00 C ATOM 644 CG PHE A 44 -10.947 5.841 -6.686 1.00 0.00 C ATOM 645 CD1 PHE A 44 -10.215 7.012 -6.798 1.00 0.00 C ATOM 646 CD2 PHE A 44 -11.270 5.146 -7.840 1.00 0.00 C ATOM 647 CE1 PHE A 44 -9.814 7.480 -8.034 1.00 0.00 C ATOM 648 CE2 PHE A 44 -10.872 5.608 -9.079 1.00 0.00 C ATOM 649 CZ PHE A 44 -10.142 6.777 -9.177 1.00 0.00 C ATOM 0 H PHE A 44 -11.605 7.460 -4.056 1.00 0.00 H new ATOM 0 HA PHE A 44 -13.381 5.999 -5.762 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.625 5.591 -4.601 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.444 4.247 -5.372 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.955 7.566 -5.908 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.840 4.231 -7.770 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.245 8.395 -8.107 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -11.131 5.056 -9.970 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.829 7.140 -10.145 1.00 0.00 H new ATOM 659 N MET A 45 -12.930 4.934 -2.668 1.00 0.00 N ATOM 660 CA MET A 45 -13.495 4.062 -1.641 1.00 0.00 C ATOM 661 C MET A 45 -14.985 4.334 -1.448 1.00 0.00 C ATOM 662 O MET A 45 -15.731 3.460 -1.008 1.00 0.00 O ATOM 663 CB MET A 45 -12.755 4.243 -0.314 1.00 0.00 C ATOM 664 CG MET A 45 -11.338 3.694 -0.329 1.00 0.00 C ATOM 665 SD MET A 45 -10.535 3.797 1.283 1.00 0.00 S ATOM 666 CE MET A 45 -11.562 2.688 2.245 1.00 0.00 C ATOM 0 H MET A 45 -12.156 5.517 -2.349 1.00 0.00 H new ATOM 0 HA MET A 45 -13.373 3.032 -1.976 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.722 5.304 -0.067 1.00 0.00 H new ATOM 0 HB3 MET A 45 -13.319 3.749 0.477 1.00 0.00 H new ATOM 0 HG2 MET A 45 -11.359 2.654 -0.654 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.747 4.245 -1.061 1.00 0.00 H new ATOM 0 HE1 MET A 45 -12.024 3.239 3.064 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.339 2.267 1.607 1.00 0.00 H new ATOM 0 HE3 MET A 45 -10.949 1.883 2.650 1.00 0.00 H new ATOM 676 N ASP A 46 -15.409 5.552 -1.776 1.00 0.00 N ATOM 677 CA ASP A 46 -16.812 5.934 -1.645 1.00 0.00 C ATOM 678 C ASP A 46 -17.704 5.015 -2.473 1.00 0.00 C ATOM 679 O ASP A 46 -18.858 4.769 -2.121 1.00 0.00 O ATOM 680 CB ASP A 46 -17.010 7.388 -2.078 1.00 0.00 C ATOM 681 CG ASP A 46 -18.430 7.870 -1.854 1.00 0.00 C ATOM 682 OD1 ASP A 46 -18.750 8.264 -0.713 1.00 0.00 O ATOM 683 OD2 ASP A 46 -19.223 7.850 -2.819 1.00 0.00 O ATOM 0 H ASP A 46 -14.802 6.290 -2.134 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.094 5.835 -0.597 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.321 8.026 -1.524 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.758 7.487 -3.134 1.00 0.00 H new ATOM 688 N LYS A 47 -17.164 4.516 -3.579 1.00 0.00 N ATOM 689 CA LYS A 47 -17.907 3.624 -4.462 1.00 0.00 C ATOM 690 C LYS A 47 -17.579 2.163 -4.163 1.00 0.00 C ATOM 691 O LYS A 47 -18.458 1.301 -4.179 1.00 0.00 O ATOM 692 CB LYS A 47 -17.580 3.940 -5.922 1.00 0.00 C ATOM 693 CG LYS A 47 -18.006 5.333 -6.363 1.00 0.00 C ATOM 694 CD LYS A 47 -19.515 5.513 -6.284 1.00 0.00 C ATOM 695 CE LYS A 47 -19.936 6.899 -6.744 1.00 0.00 C ATOM 696 NZ LYS A 47 -21.407 7.101 -6.622 1.00 0.00 N ATOM 0 H LYS A 47 -16.212 4.715 -3.886 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.971 3.781 -4.288 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.506 3.834 -6.074 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -18.067 3.203 -6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -17.518 6.078 -5.735 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -17.672 5.509 -7.386 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -20.005 4.760 -6.901 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -19.848 5.352 -5.259 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -19.416 7.652 -6.152 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -19.634 7.045 -7.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -21.654 8.058 -6.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -21.904 6.399 -7.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -21.692 6.987 -5.628 1.00 0.00 H new ATOM 710 N TYR A 48 -16.306 1.895 -3.897 1.00 0.00 N ATOM 711 CA TYR A 48 -15.848 0.542 -3.599 1.00 0.00 C ATOM 712 C TYR A 48 -16.612 -0.069 -2.426 1.00 0.00 C ATOM 713 O TYR A 48 -17.098 -1.196 -2.516 1.00 0.00 O ATOM 714 CB TYR A 48 -14.348 0.544 -3.293 1.00 0.00 C ATOM 715 CG TYR A 48 -13.468 0.538 -4.523 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.571 1.537 -5.484 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.530 -0.468 -4.724 1.00 0.00 C ATOM 718 CE1 TYR A 48 -12.766 1.533 -6.608 1.00 0.00 C ATOM 719 CE2 TYR A 48 -11.721 -0.478 -5.844 1.00 0.00 C ATOM 720 CZ TYR A 48 -11.843 0.524 -6.782 1.00 0.00 C ATOM 721 OH TYR A 48 -11.040 0.517 -7.899 1.00 0.00 O ATOM 0 H TYR A 48 -15.569 2.600 -3.881 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.040 -0.069 -4.481 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.111 1.423 -2.694 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.111 -0.329 -2.685 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.292 2.330 -5.350 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.432 -1.256 -3.992 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.860 2.316 -7.346 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.997 -1.267 -5.984 1.00 0.00 H new ATOM 0 HH TYR A 48 -11.476 1.021 -8.618 1.00 0.00 H new ATOM 731 N TYR A 49 -16.714 0.674 -1.327 1.00 0.00 N ATOM 732 CA TYR A 49 -17.410 0.185 -0.138 1.00 0.00 C ATOM 733 C TYR A 49 -18.883 -0.096 -0.430 1.00 0.00 C ATOM 734 O TYR A 49 -19.530 -0.860 0.287 1.00 0.00 O ATOM 735 CB TYR A 49 -17.266 1.184 1.019 1.00 0.00 C ATOM 736 CG TYR A 49 -18.467 2.083 1.234 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.611 3.268 0.523 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.453 1.747 2.154 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.702 4.093 0.725 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.547 2.565 2.360 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.667 3.737 1.642 1.00 0.00 C ATOM 742 OH TYR A 49 -21.754 4.557 1.845 1.00 0.00 O ATOM 0 H TYR A 49 -16.326 1.613 -1.234 1.00 0.00 H new ATOM 0 HA TYR A 49 -16.947 -0.757 0.157 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.075 0.630 1.938 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.391 1.808 0.836 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -17.859 3.549 -0.199 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.362 0.830 2.718 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.797 5.012 0.167 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.304 2.289 3.079 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.340 4.161 2.523 1.00 0.00 H new ATOM 752 N LEU A 50 -19.409 0.522 -1.483 1.00 0.00 N ATOM 753 CA LEU A 50 -20.806 0.328 -1.862 1.00 0.00 C ATOM 754 C LEU A 50 -21.006 -1.031 -2.523 1.00 0.00 C ATOM 755 O LEU A 50 -21.965 -1.743 -2.224 1.00 0.00 O ATOM 756 CB LEU A 50 -21.264 1.441 -2.808 1.00 0.00 C ATOM 757 CG LEU A 50 -21.412 2.820 -2.167 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.679 3.875 -3.230 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.528 2.811 -1.133 1.00 0.00 C ATOM 0 H LEU A 50 -18.891 1.160 -2.088 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.409 0.364 -0.955 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.551 1.514 -3.629 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.222 1.155 -3.242 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.478 3.067 -1.663 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.782 4.851 -2.756 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -20.848 3.900 -3.935 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.599 3.631 -3.762 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.619 3.801 -0.687 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.468 2.542 -1.615 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.298 2.083 -0.355 1.00 0.00 H new ATOM 771 N GLU A 51 -20.095 -1.383 -3.424 1.00 0.00 N ATOM 772 CA GLU A 51 -20.169 -2.657 -4.130 1.00 0.00 C ATOM 773 C GLU A 51 -19.963 -3.828 -3.173 1.00 0.00 C ATOM 774 O GLU A 51 -20.638 -4.854 -3.276 1.00 0.00 O ATOM 775 CB GLU A 51 -19.120 -2.705 -5.243 1.00 0.00 C ATOM 776 CG GLU A 51 -19.217 -1.547 -6.223 1.00 0.00 C ATOM 777 CD GLU A 51 -20.537 -1.522 -6.968 1.00 0.00 C ATOM 778 OE1 GLU A 51 -21.500 -0.917 -6.453 1.00 0.00 O ATOM 779 OE2 GLU A 51 -20.608 -2.110 -8.068 1.00 0.00 O ATOM 0 H GLU A 51 -19.296 -0.804 -3.683 1.00 0.00 H new ATOM 0 HA GLU A 51 -21.163 -2.743 -4.568 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.127 -2.708 -4.794 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.225 -3.642 -5.790 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -19.091 -0.608 -5.684 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -18.400 -1.614 -6.941 1.00 0.00 H new ATOM 786 N PHE A 52 -19.030 -3.667 -2.242 1.00 0.00 N ATOM 787 CA PHE A 52 -18.730 -4.711 -1.270 1.00 0.00 C ATOM 788 C PHE A 52 -19.832 -4.818 -0.219 1.00 0.00 C ATOM 789 O PHE A 52 -19.781 -4.161 0.820 1.00 0.00 O ATOM 790 CB PHE A 52 -17.384 -4.437 -0.595 1.00 0.00 C ATOM 791 CG PHE A 52 -16.195 -4.769 -1.454 1.00 0.00 C ATOM 792 CD1 PHE A 52 -15.965 -4.089 -2.639 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.310 -5.766 -1.076 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.874 -4.395 -3.430 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.217 -6.077 -1.863 1.00 0.00 C ATOM 796 CZ PHE A 52 -13.998 -5.390 -3.041 1.00 0.00 C ATOM 0 H PHE A 52 -18.468 -2.822 -2.140 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.674 -5.661 -1.802 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.336 -3.385 -0.316 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.327 -5.015 0.328 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.647 -3.310 -2.948 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.476 -6.306 -0.156 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.706 -3.857 -4.351 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -13.535 -6.856 -1.557 1.00 0.00 H new ATOM 0 HZ PHE A 52 -13.144 -5.630 -3.657 1.00 0.00 H new ATOM 806 N GLU A 53 -20.832 -5.648 -0.504 1.00 0.00 N ATOM 807 CA GLU A 53 -21.945 -5.850 0.417 1.00 0.00 C ATOM 808 C GLU A 53 -21.722 -7.094 1.270 1.00 0.00 C ATOM 809 O GLU A 53 -21.055 -8.037 0.844 1.00 0.00 O ATOM 810 CB GLU A 53 -23.261 -5.977 -0.355 1.00 0.00 C ATOM 811 CG GLU A 53 -23.661 -4.711 -1.094 1.00 0.00 C ATOM 812 CD GLU A 53 -23.890 -3.538 -0.158 1.00 0.00 C ATOM 813 OE1 GLU A 53 -22.908 -2.841 0.172 1.00 0.00 O ATOM 814 OE2 GLU A 53 -25.053 -3.317 0.242 1.00 0.00 O ATOM 0 H GLU A 53 -20.894 -6.191 -1.365 1.00 0.00 H new ATOM 0 HA GLU A 53 -22.002 -4.982 1.074 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -23.174 -6.793 -1.072 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -24.055 -6.247 0.341 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -22.883 -4.452 -1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -24.571 -4.899 -1.664 1.00 0.00 H new ATOM 821 N ASP A 54 -22.282 -7.091 2.475 1.00 0.00 N ATOM 822 CA ASP A 54 -22.140 -8.221 3.386 1.00 0.00 C ATOM 823 C ASP A 54 -23.060 -9.367 2.979 1.00 0.00 C ATOM 824 O ASP A 54 -24.237 -9.389 3.338 1.00 0.00 O ATOM 825 CB ASP A 54 -22.446 -7.791 4.822 1.00 0.00 C ATOM 826 CG ASP A 54 -22.236 -8.915 5.819 1.00 0.00 C ATOM 827 OD1 ASP A 54 -23.176 -9.712 6.020 1.00 0.00 O ATOM 828 OD2 ASP A 54 -21.133 -8.997 6.398 1.00 0.00 O ATOM 0 H ASP A 54 -22.838 -6.319 2.843 1.00 0.00 H new ATOM 0 HA ASP A 54 -21.109 -8.570 3.332 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -21.809 -6.948 5.090 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -23.477 -7.443 4.882 1.00 0.00 H new ATOM 833 N THR A 55 -22.515 -10.315 2.223 1.00 0.00 N ATOM 834 CA THR A 55 -23.283 -11.469 1.768 1.00 0.00 C ATOM 835 C THR A 55 -22.423 -12.727 1.752 1.00 0.00 C ATOM 836 O THR A 55 -21.204 -12.658 1.918 1.00 0.00 O ATOM 837 CB THR A 55 -23.866 -11.245 0.360 1.00 0.00 C ATOM 838 OG1 THR A 55 -22.820 -10.905 -0.558 1.00 0.00 O ATOM 839 CG2 THR A 55 -24.913 -10.142 0.375 1.00 0.00 C ATOM 0 H THR A 55 -21.544 -10.307 1.912 1.00 0.00 H new ATOM 0 HA THR A 55 -24.104 -11.597 2.474 1.00 0.00 H new ATOM 0 HB THR A 55 -24.342 -12.171 0.039 1.00 0.00 H new ATOM 0 HG1 THR A 55 -22.659 -11.658 -1.164 1.00 0.00 H new ATOM 0 HG21 THR A 55 -25.309 -10.003 -0.631 1.00 0.00 H new ATOM 0 HG22 THR A 55 -25.723 -10.419 1.049 1.00 0.00 H new ATOM 0 HG23 THR A 55 -24.458 -9.213 0.717 1.00 0.00 H new ATOM 847 N GLU A 56 -23.061 -13.874 1.549 1.00 0.00 N ATOM 848 CA GLU A 56 -22.351 -15.147 1.511 1.00 0.00 C ATOM 849 C GLU A 56 -22.052 -15.560 0.071 1.00 0.00 C ATOM 850 O GLU A 56 -21.194 -16.407 -0.177 1.00 0.00 O ATOM 851 CB GLU A 56 -23.171 -16.234 2.210 1.00 0.00 C ATOM 852 CG GLU A 56 -23.483 -15.918 3.665 1.00 0.00 C ATOM 853 CD GLU A 56 -24.279 -17.017 4.342 1.00 0.00 C ATOM 854 OE1 GLU A 56 -25.525 -16.972 4.276 1.00 0.00 O ATOM 855 OE2 GLU A 56 -23.657 -17.921 4.937 1.00 0.00 O ATOM 0 H GLU A 56 -24.068 -13.949 1.408 1.00 0.00 H new ATOM 0 HA GLU A 56 -21.404 -15.024 2.037 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -24.106 -16.377 1.669 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -22.627 -17.177 2.160 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -22.550 -15.763 4.207 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -24.042 -14.984 3.718 1.00 0.00 H new ATOM 862 N GLU A 57 -22.765 -14.953 -0.874 1.00 0.00 N ATOM 863 CA GLU A 57 -22.576 -15.255 -2.290 1.00 0.00 C ATOM 864 C GLU A 57 -21.635 -14.243 -2.938 1.00 0.00 C ATOM 865 O GLU A 57 -21.875 -13.037 -2.883 1.00 0.00 O ATOM 866 CB GLU A 57 -23.920 -15.253 -3.025 1.00 0.00 C ATOM 867 CG GLU A 57 -24.884 -16.332 -2.557 1.00 0.00 C ATOM 868 CD GLU A 57 -25.413 -16.082 -1.158 1.00 0.00 C ATOM 869 OE1 GLU A 57 -26.181 -15.114 -0.978 1.00 0.00 O ATOM 870 OE2 GLU A 57 -25.062 -16.857 -0.244 1.00 0.00 O ATOM 0 H GLU A 57 -23.479 -14.249 -0.685 1.00 0.00 H new ATOM 0 HA GLU A 57 -22.131 -16.247 -2.365 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -24.391 -14.279 -2.896 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -23.739 -15.381 -4.092 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -25.722 -16.390 -3.252 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -24.380 -17.298 -2.583 1.00 0.00 H new ATOM 877 N ASN A 58 -20.565 -14.741 -3.552 1.00 0.00 N ATOM 878 CA ASN A 58 -19.593 -13.875 -4.214 1.00 0.00 C ATOM 879 C ASN A 58 -20.031 -13.562 -5.641 1.00 0.00 C ATOM 880 O ASN A 58 -20.842 -14.283 -6.222 1.00 0.00 O ATOM 881 CB ASN A 58 -18.210 -14.530 -4.223 1.00 0.00 C ATOM 882 CG ASN A 58 -18.178 -15.810 -5.037 1.00 0.00 C ATOM 883 OD1 ASN A 58 -19.174 -16.527 -5.129 1.00 0.00 O ATOM 884 ND2 ASN A 58 -17.027 -16.101 -5.632 1.00 0.00 N ATOM 0 H ASN A 58 -20.349 -15.736 -3.605 1.00 0.00 H new ATOM 0 HA ASN A 58 -19.537 -12.941 -3.655 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -17.482 -13.828 -4.628 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -17.908 -14.747 -3.198 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.943 -16.949 -6.193 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -16.227 -15.477 -5.528 1.00 0.00 H new ATOM 891 N LYS A 59 -19.491 -12.484 -6.200 1.00 0.00 N ATOM 892 CA LYS A 59 -19.833 -12.078 -7.558 1.00 0.00 C ATOM 893 C LYS A 59 -18.583 -11.943 -8.421 1.00 0.00 C ATOM 894 O LYS A 59 -17.467 -11.855 -7.909 1.00 0.00 O ATOM 895 CB LYS A 59 -20.601 -10.756 -7.538 1.00 0.00 C ATOM 896 CG LYS A 59 -21.870 -10.806 -6.702 1.00 0.00 C ATOM 897 CD LYS A 59 -22.629 -9.490 -6.760 1.00 0.00 C ATOM 898 CE LYS A 59 -23.876 -9.530 -5.892 1.00 0.00 C ATOM 899 NZ LYS A 59 -23.547 -9.753 -4.457 1.00 0.00 N ATOM 0 H LYS A 59 -18.816 -11.877 -5.735 1.00 0.00 H new ATOM 0 HA LYS A 59 -20.466 -12.852 -7.992 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -19.950 -9.972 -7.150 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -20.859 -10.479 -8.560 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -22.510 -11.612 -7.059 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -21.616 -11.035 -5.667 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -21.980 -8.679 -6.430 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -22.909 -9.275 -7.791 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -24.422 -8.593 -5.998 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -24.536 -10.324 -6.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -24.381 -9.540 -3.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -23.268 -10.745 -4.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -22.762 -9.130 -4.180 1.00 0.00 H new ATOM 913 N LEU A 60 -18.781 -11.933 -9.735 1.00 0.00 N ATOM 914 CA LEU A 60 -17.675 -11.810 -10.676 1.00 0.00 C ATOM 915 C LEU A 60 -17.233 -10.355 -10.810 1.00 0.00 C ATOM 916 O LEU A 60 -16.179 -10.066 -11.375 1.00 0.00 O ATOM 917 CB LEU A 60 -18.086 -12.365 -12.043 1.00 0.00 C ATOM 918 CG LEU A 60 -16.973 -12.416 -13.091 1.00 0.00 C ATOM 919 CD1 LEU A 60 -15.874 -13.377 -12.659 1.00 0.00 C ATOM 920 CD2 LEU A 60 -17.536 -12.822 -14.444 1.00 0.00 C ATOM 0 H LEU A 60 -19.699 -12.009 -10.173 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.833 -12.388 -10.294 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -18.478 -13.373 -11.904 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -18.902 -11.756 -12.433 1.00 0.00 H new ATOM 0 HG LEU A 60 -16.540 -11.420 -13.182 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -15.091 -13.399 -13.417 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.451 -13.044 -11.711 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -16.291 -14.377 -12.539 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -16.731 -12.853 -15.178 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -17.995 -13.808 -14.366 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -18.286 -12.096 -14.759 1.00 0.00 H new ATOM 932 N ILE A 61 -18.045 -9.443 -10.280 1.00 0.00 N ATOM 933 CA ILE A 61 -17.743 -8.017 -10.344 1.00 0.00 C ATOM 934 C ILE A 61 -16.523 -7.668 -9.490 1.00 0.00 C ATOM 935 O ILE A 61 -15.907 -6.615 -9.668 1.00 0.00 O ATOM 936 CB ILE A 61 -18.951 -7.170 -9.887 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.707 -5.684 -10.166 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.235 -7.397 -8.408 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.612 -5.351 -11.640 1.00 0.00 C ATOM 0 H ILE A 61 -18.917 -9.667 -9.801 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.521 -7.784 -11.385 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.825 -7.486 -10.457 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.515 -5.102 -9.722 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.785 -5.377 -9.673 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -20.089 -6.792 -8.104 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.458 -8.450 -8.238 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.362 -7.111 -7.822 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.439 -4.282 -11.761 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.786 -5.905 -12.086 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.543 -5.626 -12.136 1.00 0.00 H new ATOM 951 N TYR A 62 -16.173 -8.561 -8.572 1.00 0.00 N ATOM 952 CA TYR A 62 -15.031 -8.341 -7.691 1.00 0.00 C ATOM 953 C TYR A 62 -13.710 -8.458 -8.448 1.00 0.00 C ATOM 954 O TYR A 62 -12.681 -7.960 -7.989 1.00 0.00 O ATOM 955 CB TYR A 62 -15.054 -9.334 -6.527 1.00 0.00 C ATOM 956 CG TYR A 62 -16.156 -9.072 -5.523 1.00 0.00 C ATOM 957 CD1 TYR A 62 -16.158 -7.914 -4.755 1.00 0.00 C ATOM 958 CD2 TYR A 62 -17.190 -9.981 -5.342 1.00 0.00 C ATOM 959 CE1 TYR A 62 -17.161 -7.670 -3.836 1.00 0.00 C ATOM 960 CE2 TYR A 62 -18.196 -9.745 -4.425 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.177 -8.588 -3.674 1.00 0.00 C ATOM 962 OH TYR A 62 -19.177 -8.350 -2.759 1.00 0.00 O ATOM 0 H TYR A 62 -16.662 -9.443 -8.418 1.00 0.00 H new ATOM 0 HA TYR A 62 -15.109 -7.327 -7.299 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.169 -10.343 -6.924 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.093 -9.301 -6.014 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -15.363 -7.193 -4.878 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -17.208 -10.888 -5.928 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -17.149 -6.765 -3.247 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -18.993 -10.462 -4.297 1.00 0.00 H new ATOM 0 HH TYR A 62 -19.815 -9.094 -2.770 1.00 0.00 H new ATOM 972 N THR A 63 -13.737 -9.110 -9.609 1.00 0.00 N ATOM 973 CA THR A 63 -12.527 -9.280 -10.408 1.00 0.00 C ATOM 974 C THR A 63 -12.104 -7.966 -11.077 1.00 0.00 C ATOM 975 O THR A 63 -10.954 -7.547 -10.936 1.00 0.00 O ATOM 976 CB THR A 63 -12.698 -10.373 -11.484 1.00 0.00 C ATOM 977 OG1 THR A 63 -13.080 -11.610 -10.871 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.405 -10.569 -12.265 1.00 0.00 C ATOM 0 H THR A 63 -14.576 -9.526 -10.014 1.00 0.00 H new ATOM 0 HA THR A 63 -11.744 -9.592 -9.717 1.00 0.00 H new ATOM 0 HB THR A 63 -13.479 -10.053 -12.174 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.188 -12.297 -11.561 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.549 -11.344 -13.018 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.130 -9.634 -12.754 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.610 -10.869 -11.583 1.00 0.00 H new ATOM 986 N PRO A 64 -13.015 -7.290 -11.813 1.00 0.00 N ATOM 987 CA PRO A 64 -12.695 -6.021 -12.478 1.00 0.00 C ATOM 988 C PRO A 64 -12.416 -4.901 -11.481 1.00 0.00 C ATOM 989 O PRO A 64 -11.494 -4.107 -11.672 1.00 0.00 O ATOM 990 CB PRO A 64 -13.952 -5.708 -13.294 1.00 0.00 C ATOM 991 CG PRO A 64 -15.043 -6.454 -12.612 1.00 0.00 C ATOM 992 CD PRO A 64 -14.408 -7.703 -12.074 1.00 0.00 C ATOM 0 HA PRO A 64 -11.792 -6.099 -13.083 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.156 -4.637 -13.312 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.841 -6.028 -14.330 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.480 -5.860 -11.809 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.848 -6.692 -13.307 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.903 -8.047 -11.166 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.457 -8.521 -12.793 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.216 -4.840 -10.419 1.00 0.00 N ATOM 1001 CA ILE A 65 -13.042 -3.812 -9.397 1.00 0.00 C ATOM 1002 C ILE A 65 -11.668 -3.921 -8.745 1.00 0.00 C ATOM 1003 O ILE A 65 -10.998 -2.914 -8.509 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.129 -3.907 -8.306 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.517 -3.684 -8.916 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -13.863 -2.895 -7.198 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.649 -3.852 -7.924 1.00 0.00 C ATOM 0 H ILE A 65 -13.986 -5.486 -10.245 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.131 -2.848 -9.898 1.00 0.00 H new ATOM 0 HB ILE A 65 -14.098 -4.906 -7.872 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.562 -2.681 -9.339 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.660 -4.384 -9.739 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.639 -2.976 -6.437 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -12.891 -3.096 -6.747 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.868 -1.888 -7.616 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.601 -3.679 -8.426 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.631 -4.864 -7.519 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.531 -3.134 -7.112 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.252 -5.151 -8.462 1.00 0.00 N ATOM 1020 CA PHE A 66 -9.958 -5.397 -7.837 1.00 0.00 C ATOM 1021 C PHE A 66 -8.818 -4.905 -8.724 1.00 0.00 C ATOM 1022 O PHE A 66 -7.886 -4.258 -8.248 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.790 -6.890 -7.548 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.524 -7.222 -6.812 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.429 -7.021 -5.445 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.431 -7.739 -7.489 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -7.265 -7.328 -4.766 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.264 -8.048 -6.815 1.00 0.00 C ATOM 1029 CZ PHE A 66 -6.181 -7.842 -5.451 1.00 0.00 C ATOM 0 H PHE A 66 -11.793 -5.994 -8.656 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.923 -4.843 -6.899 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.642 -7.236 -6.963 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.807 -7.438 -8.490 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.273 -6.620 -4.904 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.491 -7.902 -8.555 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -7.203 -7.166 -3.700 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.419 -8.450 -7.354 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.271 -8.082 -4.922 1.00 0.00 H new ATOM 1039 N ASN A 67 -8.899 -5.219 -10.014 1.00 0.00 N ATOM 1040 CA ASN A 67 -7.871 -4.808 -10.966 1.00 0.00 C ATOM 1041 C ASN A 67 -7.780 -3.287 -11.048 1.00 0.00 C ATOM 1042 O ASN A 67 -6.714 -2.735 -11.323 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.168 -5.385 -12.352 1.00 0.00 C ATOM 1044 CG ASN A 67 -8.128 -6.901 -12.369 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -7.386 -7.524 -11.609 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -8.928 -7.503 -13.241 1.00 0.00 N ATOM 0 H ASN A 67 -9.664 -5.755 -10.424 1.00 0.00 H new ATOM 0 HA ASN A 67 -6.914 -5.194 -10.615 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.151 -5.047 -12.680 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.442 -4.997 -13.067 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -8.944 -8.521 -13.300 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -9.527 -6.947 -13.852 1.00 0.00 H new ATOM 1053 N GLU A 68 -8.901 -2.617 -10.805 1.00 0.00 N ATOM 1054 CA GLU A 68 -8.947 -1.159 -10.855 1.00 0.00 C ATOM 1055 C GLU A 68 -8.199 -0.549 -9.675 1.00 0.00 C ATOM 1056 O GLU A 68 -7.526 0.472 -9.815 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.398 -0.672 -10.861 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.533 0.841 -10.924 1.00 0.00 C ATOM 1059 CD GLU A 68 -11.976 1.296 -11.007 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -12.491 1.432 -12.138 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -12.592 1.517 -9.944 1.00 0.00 O ATOM 0 H GLU A 68 -9.790 -3.059 -10.571 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.460 -0.838 -11.776 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -10.916 -1.110 -11.714 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.898 -1.036 -9.963 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -10.068 1.280 -10.041 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -9.988 1.215 -11.791 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.325 -1.180 -8.513 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.662 -0.702 -7.304 1.00 0.00 C ATOM 1070 C TYR A 69 -6.146 -0.824 -7.429 1.00 0.00 C ATOM 1071 O TYR A 69 -5.401 0.051 -6.987 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.153 -1.495 -6.090 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.640 -0.972 -4.768 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -8.222 0.138 -4.166 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.578 -1.588 -4.119 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -7.758 0.618 -2.956 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -6.110 -1.115 -2.908 1.00 0.00 C ATOM 1078 CZ TYR A 69 -6.702 -0.012 -2.332 1.00 0.00 C ATOM 1079 OH TYR A 69 -6.237 0.462 -1.126 1.00 0.00 O ATOM 0 H TYR A 69 -8.881 -2.025 -8.382 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.910 0.351 -7.170 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.243 -1.482 -6.076 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.848 -2.536 -6.201 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.050 0.633 -4.652 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -6.110 -2.451 -4.568 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.220 1.482 -2.502 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.284 -1.607 -2.415 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.491 -0.095 -0.821 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.699 -1.919 -8.034 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.275 -2.170 -8.218 1.00 0.00 C ATOM 1091 C ILE A 70 -3.688 -1.282 -9.312 1.00 0.00 C ATOM 1092 O ILE A 70 -2.506 -0.944 -9.283 1.00 0.00 O ATOM 1093 CB ILE A 70 -4.012 -3.651 -8.567 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.645 -4.567 -7.513 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.516 -3.917 -8.681 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -4.077 -4.383 -6.120 1.00 0.00 C ATOM 0 H ILE A 70 -6.306 -2.650 -8.407 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.787 -1.933 -7.273 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.471 -3.866 -9.532 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.719 -4.384 -7.484 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.507 -5.605 -7.817 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.351 -4.966 -8.927 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.094 -3.289 -9.465 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.032 -3.687 -7.732 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.575 -5.065 -5.431 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.008 -4.595 -6.132 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.239 -3.356 -5.794 1.00 0.00 H new ATOM 1108 N SER A 71 -4.511 -0.910 -10.281 1.00 0.00 N ATOM 1109 CA SER A 71 -4.053 -0.069 -11.380 1.00 0.00 C ATOM 1110 C SER A 71 -4.063 1.409 -11.000 1.00 0.00 C ATOM 1111 O SER A 71 -3.224 2.181 -11.463 1.00 0.00 O ATOM 1112 CB SER A 71 -4.926 -0.292 -12.616 1.00 0.00 C ATOM 1113 OG SER A 71 -4.488 0.509 -13.700 1.00 0.00 O ATOM 0 H SER A 71 -5.495 -1.175 -10.330 1.00 0.00 H new ATOM 0 HA SER A 71 -3.025 -0.352 -11.605 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.896 -1.344 -12.901 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.963 -0.055 -12.380 1.00 0.00 H new ATOM 0 HG SER A 71 -5.061 0.347 -14.479 1.00 0.00 H new ATOM 1119 N LEU A 72 -5.021 1.804 -10.167 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.142 3.198 -9.750 1.00 0.00 C ATOM 1121 C LEU A 72 -4.340 3.508 -8.485 1.00 0.00 C ATOM 1122 O LEU A 72 -3.417 4.324 -8.508 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.623 3.550 -9.538 1.00 0.00 C ATOM 1124 CG LEU A 72 -6.941 5.031 -9.263 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -6.774 5.358 -7.786 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -6.069 5.946 -10.115 1.00 0.00 C ATOM 0 H LEU A 72 -5.723 1.181 -9.768 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.724 3.812 -10.548 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.178 3.240 -10.423 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -6.999 2.959 -8.703 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.982 5.203 -9.536 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.004 6.410 -7.618 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.452 4.740 -7.198 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.746 5.159 -7.483 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -6.315 6.986 -9.900 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.019 5.766 -9.884 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.249 5.741 -11.170 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.688 2.845 -7.384 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.034 3.086 -6.099 1.00 0.00 C ATOM 1140 C VAL A 73 -2.610 2.535 -6.032 1.00 0.00 C ATOM 1141 O VAL A 73 -1.666 3.285 -5.783 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.858 2.497 -4.939 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.183 2.773 -3.602 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.269 3.064 -4.957 1.00 0.00 C ATOM 0 H VAL A 73 -5.420 2.136 -7.356 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.973 4.170 -6.001 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.916 1.416 -5.069 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.783 2.348 -2.797 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.192 2.320 -3.594 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.091 3.849 -3.456 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.842 2.640 -4.132 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.227 4.148 -4.850 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.751 2.811 -5.901 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.456 1.231 -6.239 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.136 0.604 -6.174 1.00 0.00 C ATOM 1156 C GLU A 74 -0.135 1.341 -7.061 1.00 0.00 C ATOM 1157 O GLU A 74 1.006 1.576 -6.660 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.223 -0.871 -6.576 1.00 0.00 C ATOM 1159 CG GLU A 74 0.015 -1.684 -6.225 1.00 0.00 C ATOM 1160 CD GLU A 74 1.183 -1.411 -7.154 1.00 0.00 C ATOM 1161 OE1 GLU A 74 1.119 -1.832 -8.328 1.00 0.00 O ATOM 1162 OE2 GLU A 74 2.163 -0.780 -6.706 1.00 0.00 O ATOM 0 H GLU A 74 -3.221 0.590 -6.452 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.784 0.664 -5.144 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -2.089 -1.319 -6.089 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.394 -0.934 -7.651 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.312 -1.460 -5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -0.231 -2.745 -6.261 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.565 1.711 -8.262 1.00 0.00 N ATOM 1170 CA LYS A 75 0.303 2.426 -9.193 1.00 0.00 C ATOM 1171 C LYS A 75 0.520 3.866 -8.740 1.00 0.00 C ATOM 1172 O LYS A 75 1.542 4.475 -9.055 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.283 2.403 -10.604 1.00 0.00 C ATOM 1174 CG LYS A 75 -0.258 1.027 -11.246 1.00 0.00 C ATOM 1175 CD LYS A 75 -0.605 1.095 -12.724 1.00 0.00 C ATOM 1176 CE LYS A 75 -0.558 -0.280 -13.371 1.00 0.00 C ATOM 1177 NZ LYS A 75 -0.906 -0.227 -14.818 1.00 0.00 N ATOM 0 H LYS A 75 -1.505 1.529 -8.614 1.00 0.00 H new ATOM 0 HA LYS A 75 1.268 1.919 -9.206 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.312 2.760 -10.568 1.00 0.00 H new ATOM 0 HB3 LYS A 75 0.274 3.099 -11.232 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.731 0.585 -11.123 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -0.965 0.373 -10.735 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.601 1.522 -12.846 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.092 1.761 -13.232 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.440 -0.702 -13.253 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.249 -0.947 -12.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.862 -1.185 -15.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.868 0.152 -14.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.231 0.389 -15.315 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.445 4.408 -8.005 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.345 5.777 -7.508 1.00 0.00 C ATOM 1193 C TYR A 76 0.886 5.938 -6.619 1.00 0.00 C ATOM 1194 O TYR A 76 1.689 6.851 -6.811 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.607 6.158 -6.731 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.669 7.621 -6.351 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -2.089 8.578 -7.267 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.307 8.044 -5.079 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -2.146 9.915 -6.925 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -1.362 9.379 -4.729 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.781 10.311 -5.656 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.836 11.642 -5.312 1.00 0.00 O ATOM 0 H TYR A 76 -1.303 3.923 -7.741 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.246 6.444 -8.365 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.482 5.911 -7.332 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.662 5.554 -5.825 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -2.375 8.271 -8.262 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.977 7.317 -4.351 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -2.475 10.647 -7.648 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -1.079 9.692 -3.735 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.547 11.752 -4.382 1.00 0.00 H new ATOM 1212 N ILE A 77 1.029 5.039 -5.648 1.00 0.00 N ATOM 1213 CA ILE A 77 2.160 5.076 -4.726 1.00 0.00 C ATOM 1214 C ILE A 77 3.470 4.761 -5.443 1.00 0.00 C ATOM 1215 O ILE A 77 4.472 5.452 -5.258 1.00 0.00 O ATOM 1216 CB ILE A 77 1.979 4.069 -3.571 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.648 4.309 -2.851 1.00 0.00 C ATOM 1218 CG2 ILE A 77 3.142 4.171 -2.592 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.315 3.243 -1.826 1.00 0.00 C ATOM 0 H ILE A 77 0.374 4.275 -5.480 1.00 0.00 H new ATOM 0 HA ILE A 77 2.199 6.088 -4.322 1.00 0.00 H new ATOM 0 HB ILE A 77 1.965 3.062 -3.989 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.681 5.280 -2.356 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.153 4.355 -3.589 1.00 0.00 H new ATOM 0 HG21 ILE A 77 3.000 3.455 -1.783 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.075 3.952 -3.111 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.184 5.180 -2.181 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.640 3.476 -1.355 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.249 2.273 -2.318 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.096 3.212 -1.066 1.00 0.00 H new ATOM 1231 N GLU A 78 3.452 3.714 -6.264 1.00 0.00 N ATOM 1232 CA GLU A 78 4.641 3.292 -6.999 1.00 0.00 C ATOM 1233 C GLU A 78 5.215 4.428 -7.844 1.00 0.00 C ATOM 1234 O GLU A 78 6.404 4.724 -7.766 1.00 0.00 O ATOM 1235 CB GLU A 78 4.310 2.094 -7.892 1.00 0.00 C ATOM 1236 CG GLU A 78 5.500 1.579 -8.686 1.00 0.00 C ATOM 1237 CD GLU A 78 5.170 0.342 -9.499 1.00 0.00 C ATOM 1238 OE1 GLU A 78 4.661 0.491 -10.630 1.00 0.00 O ATOM 1239 OE2 GLU A 78 5.422 -0.778 -9.003 1.00 0.00 O ATOM 0 H GLU A 78 2.626 3.142 -6.437 1.00 0.00 H new ATOM 0 HA GLU A 78 5.397 3.004 -6.268 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.920 1.286 -7.272 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.517 2.376 -8.584 1.00 0.00 H new ATOM 0 HG2 GLU A 78 5.853 2.364 -9.354 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.317 1.352 -8.002 1.00 0.00 H new ATOM 1246 N GLU A 79 4.367 5.067 -8.639 1.00 0.00 N ATOM 1247 CA GLU A 79 4.807 6.159 -9.503 1.00 0.00 C ATOM 1248 C GLU A 79 5.430 7.300 -8.701 1.00 0.00 C ATOM 1249 O GLU A 79 6.521 7.768 -9.024 1.00 0.00 O ATOM 1250 CB GLU A 79 3.634 6.684 -10.332 1.00 0.00 C ATOM 1251 CG GLU A 79 3.136 5.695 -11.373 1.00 0.00 C ATOM 1252 CD GLU A 79 1.911 6.195 -12.114 1.00 0.00 C ATOM 1253 OE1 GLU A 79 2.079 6.866 -13.155 1.00 0.00 O ATOM 1254 OE2 GLU A 79 0.784 5.917 -11.653 1.00 0.00 O ATOM 0 H GLU A 79 3.372 4.850 -8.705 1.00 0.00 H new ATOM 0 HA GLU A 79 5.573 5.762 -10.169 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.812 6.940 -9.663 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.936 7.604 -10.832 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.933 5.495 -12.089 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.900 4.749 -10.886 1.00 0.00 H new ATOM 1261 N GLN A 80 4.737 7.736 -7.654 1.00 0.00 N ATOM 1262 CA GLN A 80 5.217 8.835 -6.818 1.00 0.00 C ATOM 1263 C GLN A 80 6.589 8.539 -6.212 1.00 0.00 C ATOM 1264 O GLN A 80 7.383 9.453 -5.989 1.00 0.00 O ATOM 1265 CB GLN A 80 4.214 9.128 -5.701 1.00 0.00 C ATOM 1266 CG GLN A 80 2.885 9.672 -6.198 1.00 0.00 C ATOM 1267 CD GLN A 80 3.035 10.975 -6.960 1.00 0.00 C ATOM 1268 OE1 GLN A 80 2.967 12.058 -6.381 1.00 0.00 O ATOM 1269 NE2 GLN A 80 3.242 10.874 -8.268 1.00 0.00 N ATOM 0 H GLN A 80 3.841 7.346 -7.363 1.00 0.00 H new ATOM 0 HA GLN A 80 5.317 9.709 -7.461 1.00 0.00 H new ATOM 0 HB2 GLN A 80 4.034 8.212 -5.138 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.654 9.846 -5.009 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.412 8.931 -6.842 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.220 9.827 -5.349 1.00 0.00 H new ATOM 0 HE21 GLN A 80 3.291 9.955 -8.707 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.352 11.716 -8.833 1.00 0.00 H new ATOM 1278 N LEU A 81 6.867 7.267 -5.945 1.00 0.00 N ATOM 1279 CA LEU A 81 8.142 6.879 -5.350 1.00 0.00 C ATOM 1280 C LEU A 81 9.247 6.849 -6.396 1.00 0.00 C ATOM 1281 O LEU A 81 10.387 7.235 -6.135 1.00 0.00 O ATOM 1282 CB LEU A 81 8.024 5.507 -4.685 1.00 0.00 C ATOM 1283 CG LEU A 81 7.126 5.456 -3.449 1.00 0.00 C ATOM 1284 CD1 LEU A 81 6.945 4.020 -2.981 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.708 6.312 -2.334 1.00 0.00 C ATOM 0 H LEU A 81 6.231 6.491 -6.130 1.00 0.00 H new ATOM 0 HA LEU A 81 8.399 7.623 -4.596 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.644 4.797 -5.419 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.022 5.171 -4.403 1.00 0.00 H new ATOM 0 HG LEU A 81 6.148 5.856 -3.716 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.303 4.003 -2.100 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.486 3.433 -3.777 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.916 3.594 -2.730 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.057 6.265 -1.461 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.698 5.940 -2.069 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.787 7.345 -2.672 1.00 0.00 H new ATOM 1297 N LEU A 82 8.889 6.390 -7.584 1.00 0.00 N ATOM 1298 CA LEU A 82 9.829 6.268 -8.687 1.00 0.00 C ATOM 1299 C LEU A 82 10.284 7.632 -9.195 1.00 0.00 C ATOM 1300 O LEU A 82 11.351 7.749 -9.800 1.00 0.00 O ATOM 1301 CB LEU A 82 9.191 5.461 -9.820 1.00 0.00 C ATOM 1302 CG LEU A 82 8.986 3.959 -9.549 1.00 0.00 C ATOM 1303 CD1 LEU A 82 9.997 3.139 -10.334 1.00 0.00 C ATOM 1304 CD2 LEU A 82 9.097 3.625 -8.067 1.00 0.00 C ATOM 0 H LEU A 82 7.940 6.092 -7.811 1.00 0.00 H new ATOM 0 HA LEU A 82 10.714 5.746 -8.323 1.00 0.00 H new ATOM 0 HB2 LEU A 82 8.222 5.903 -10.053 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.812 5.568 -10.709 1.00 0.00 H new ATOM 0 HG LEU A 82 7.976 3.708 -9.874 1.00 0.00 H new ATOM 0 HD11 LEU A 82 9.841 2.079 -10.133 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.870 3.329 -11.400 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.006 3.420 -10.033 1.00 0.00 H new ATOM 0 HD21 LEU A 82 8.946 2.555 -7.923 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.086 3.904 -7.704 1.00 0.00 H new ATOM 0 HD23 LEU A 82 8.338 4.177 -7.512 1.00 0.00 H new ATOM 1316 N GLN A 83 9.476 8.659 -8.952 1.00 0.00 N ATOM 1317 CA GLN A 83 9.812 10.012 -9.386 1.00 0.00 C ATOM 1318 C GLN A 83 11.184 10.427 -8.859 1.00 0.00 C ATOM 1319 O GLN A 83 11.814 11.340 -9.391 1.00 0.00 O ATOM 1320 CB GLN A 83 8.750 11.005 -8.913 1.00 0.00 C ATOM 1321 CG GLN A 83 7.396 10.812 -9.575 1.00 0.00 C ATOM 1322 CD GLN A 83 7.424 11.111 -11.061 1.00 0.00 C ATOM 1323 OE1 GLN A 83 7.662 10.224 -11.881 1.00 0.00 O ATOM 1324 NE2 GLN A 83 7.183 12.368 -11.416 1.00 0.00 N ATOM 0 H GLN A 83 8.587 8.582 -8.459 1.00 0.00 H new ATOM 0 HA GLN A 83 9.842 10.018 -10.476 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.633 10.912 -7.833 1.00 0.00 H new ATOM 0 HB3 GLN A 83 9.100 12.019 -9.110 1.00 0.00 H new ATOM 0 HG2 GLN A 83 7.064 9.785 -9.421 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.664 11.459 -9.092 1.00 0.00 H new ATOM 0 HE21 GLN A 83 6.990 13.071 -10.703 1.00 0.00 H new ATOM 0 HE22 GLN A 83 7.191 12.630 -12.402 1.00 0.00 H new ATOM 1333 N ARG A 84 11.641 9.746 -7.810 1.00 0.00 N ATOM 1334 CA ARG A 84 12.939 10.042 -7.210 1.00 0.00 C ATOM 1335 C ARG A 84 13.839 8.810 -7.217 1.00 0.00 C ATOM 1336 O ARG A 84 15.064 8.926 -7.189 1.00 0.00 O ATOM 1337 CB ARG A 84 12.761 10.537 -5.776 1.00 0.00 C ATOM 1338 CG ARG A 84 11.928 11.803 -5.661 1.00 0.00 C ATOM 1339 CD ARG A 84 11.709 12.188 -4.207 1.00 0.00 C ATOM 1340 NE ARG A 84 10.952 13.429 -4.073 1.00 0.00 N ATOM 1341 CZ ARG A 84 10.596 13.951 -2.903 1.00 0.00 C ATOM 1342 NH1 ARG A 84 10.924 13.338 -1.773 1.00 0.00 N ATOM 1343 NH2 ARG A 84 9.912 15.086 -2.860 1.00 0.00 N ATOM 0 H ARG A 84 11.132 8.986 -7.359 1.00 0.00 H new ATOM 0 HA ARG A 84 13.412 10.823 -7.806 1.00 0.00 H new ATOM 0 HB2 ARG A 84 12.292 9.750 -5.186 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.743 10.719 -5.340 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.427 12.618 -6.184 1.00 0.00 H new ATOM 0 HG3 ARG A 84 10.965 11.653 -6.149 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.179 11.384 -3.696 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.674 12.298 -3.713 1.00 0.00 H new ATOM 0 HE ARG A 84 10.681 13.923 -4.923 1.00 0.00 H new ATOM 0 HH11 ARG A 84 11.450 12.465 -1.801 1.00 0.00 H new ATOM 0 HH12 ARG A 84 10.650 13.740 -0.877 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.657 15.561 -3.726 1.00 0.00 H new ATOM 0 HH22 ARG A 84 9.640 15.484 -1.961 1.00 0.00 H new ATOM 1357 N ILE A 85 13.224 7.632 -7.253 1.00 0.00 N ATOM 1358 CA ILE A 85 13.972 6.379 -7.256 1.00 0.00 C ATOM 1359 C ILE A 85 13.600 5.519 -8.465 1.00 0.00 C ATOM 1360 O ILE A 85 12.675 4.709 -8.395 1.00 0.00 O ATOM 1361 CB ILE A 85 13.715 5.572 -5.968 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.877 6.470 -4.738 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.659 4.382 -5.891 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.403 5.828 -3.451 1.00 0.00 C ATOM 0 H ILE A 85 12.211 7.519 -7.280 1.00 0.00 H new ATOM 0 HA ILE A 85 15.029 6.639 -7.310 1.00 0.00 H new ATOM 0 HB ILE A 85 12.692 5.197 -5.989 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.927 6.742 -4.633 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.323 7.395 -4.898 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.465 3.822 -4.976 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.499 3.735 -6.753 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.690 4.735 -5.889 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.548 6.522 -2.623 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.345 5.581 -3.536 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.974 4.918 -3.266 1.00 0.00 H new ATOM 1376 N PRO A 86 14.310 5.689 -9.597 1.00 0.00 N ATOM 1377 CA PRO A 86 14.041 4.917 -10.815 1.00 0.00 C ATOM 1378 C PRO A 86 14.449 3.455 -10.683 1.00 0.00 C ATOM 1379 O PRO A 86 13.987 2.598 -11.438 1.00 0.00 O ATOM 1380 CB PRO A 86 14.879 5.622 -11.883 1.00 0.00 C ATOM 1381 CG PRO A 86 15.977 6.298 -11.132 1.00 0.00 C ATOM 1382 CD PRO A 86 15.418 6.648 -9.780 1.00 0.00 C ATOM 0 HA PRO A 86 12.977 4.888 -11.048 1.00 0.00 H new ATOM 0 HB2 PRO A 86 15.276 4.910 -12.606 1.00 0.00 H new ATOM 0 HB3 PRO A 86 14.281 6.343 -12.441 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.842 5.642 -11.036 1.00 0.00 H new ATOM 0 HG3 PRO A 86 16.312 7.193 -11.657 1.00 0.00 H new ATOM 0 HD2 PRO A 86 16.170 6.545 -8.997 1.00 0.00 H new ATOM 0 HD3 PRO A 86 15.064 7.679 -9.748 1.00 0.00 H new ATOM 1390 N GLU A 87 15.314 3.180 -9.719 1.00 0.00 N ATOM 1391 CA GLU A 87 15.788 1.823 -9.470 1.00 0.00 C ATOM 1392 C GLU A 87 14.951 1.144 -8.390 1.00 0.00 C ATOM 1393 O GLU A 87 15.358 0.133 -7.818 1.00 0.00 O ATOM 1394 CB GLU A 87 17.258 1.843 -9.046 1.00 0.00 C ATOM 1395 CG GLU A 87 18.219 2.122 -10.190 1.00 0.00 C ATOM 1396 CD GLU A 87 18.040 3.505 -10.783 1.00 0.00 C ATOM 1397 OE1 GLU A 87 18.601 4.469 -10.222 1.00 0.00 O ATOM 1398 OE2 GLU A 87 17.344 3.621 -11.813 1.00 0.00 O ATOM 0 H GLU A 87 15.706 3.882 -9.091 1.00 0.00 H new ATOM 0 HA GLU A 87 15.689 1.256 -10.396 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.395 2.601 -8.275 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.511 0.883 -8.597 1.00 0.00 H new ATOM 0 HG2 GLU A 87 19.243 2.015 -9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 87 18.074 1.375 -10.971 1.00 0.00 H new ATOM 1405 N PHE A 88 13.779 1.707 -8.120 1.00 0.00 N ATOM 1406 CA PHE A 88 12.880 1.168 -7.106 1.00 0.00 C ATOM 1407 C PHE A 88 12.201 -0.110 -7.589 1.00 0.00 C ATOM 1408 O PHE A 88 11.942 -0.276 -8.781 1.00 0.00 O ATOM 1409 CB PHE A 88 11.819 2.200 -6.741 1.00 0.00 C ATOM 1410 CG PHE A 88 11.069 1.877 -5.479 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.599 2.200 -4.240 1.00 0.00 C ATOM 1412 CD2 PHE A 88 9.833 1.252 -5.533 1.00 0.00 C ATOM 1413 CE1 PHE A 88 10.910 1.905 -3.078 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.140 0.954 -4.375 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.680 1.281 -3.146 1.00 0.00 C ATOM 0 H PHE A 88 13.428 2.540 -8.592 1.00 0.00 H new ATOM 0 HA PHE A 88 13.478 0.930 -6.226 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.295 3.174 -6.630 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.109 2.284 -7.564 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.561 2.688 -4.181 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.406 0.995 -6.491 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.333 2.162 -2.118 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.178 0.466 -4.431 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.141 1.049 -2.240 1.00 0.00 H new ATOM 1425 N ASN A 89 11.916 -1.008 -6.653 1.00 0.00 N ATOM 1426 CA ASN A 89 11.257 -2.268 -6.973 1.00 0.00 C ATOM 1427 C ASN A 89 10.196 -2.590 -5.921 1.00 0.00 C ATOM 1428 O ASN A 89 10.502 -3.132 -4.859 1.00 0.00 O ATOM 1429 CB ASN A 89 12.285 -3.397 -7.064 1.00 0.00 C ATOM 1430 CG ASN A 89 11.790 -4.567 -7.889 1.00 0.00 C ATOM 1431 OD1 ASN A 89 11.918 -4.578 -9.113 1.00 0.00 O ATOM 1432 ND2 ASN A 89 11.227 -5.565 -7.220 1.00 0.00 N ATOM 0 H ASN A 89 12.132 -0.886 -5.664 1.00 0.00 H new ATOM 0 HA ASN A 89 10.766 -2.172 -7.941 1.00 0.00 H new ATOM 0 HB2 ASN A 89 13.206 -3.011 -7.502 1.00 0.00 H new ATOM 0 HB3 ASN A 89 12.530 -3.743 -6.060 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.880 -6.383 -7.721 1.00 0.00 H new ATOM 0 HD22 ASN A 89 11.141 -5.514 -6.205 1.00 0.00 H new ATOM 1439 N MET A 90 8.948 -2.240 -6.227 1.00 0.00 N ATOM 1440 CA MET A 90 7.831 -2.465 -5.312 1.00 0.00 C ATOM 1441 C MET A 90 7.685 -3.941 -4.947 1.00 0.00 C ATOM 1442 O MET A 90 7.371 -4.276 -3.806 1.00 0.00 O ATOM 1443 CB MET A 90 6.531 -1.955 -5.937 1.00 0.00 C ATOM 1444 CG MET A 90 5.766 -0.983 -5.054 1.00 0.00 C ATOM 1445 SD MET A 90 5.224 -1.728 -3.504 1.00 0.00 S ATOM 1446 CE MET A 90 4.404 -0.340 -2.725 1.00 0.00 C ATOM 0 H MET A 90 8.684 -1.797 -7.107 1.00 0.00 H new ATOM 0 HA MET A 90 8.039 -1.913 -4.395 1.00 0.00 H new ATOM 0 HB2 MET A 90 6.761 -1.467 -6.884 1.00 0.00 H new ATOM 0 HB3 MET A 90 5.890 -2.806 -6.165 1.00 0.00 H new ATOM 0 HG2 MET A 90 6.398 -0.122 -4.837 1.00 0.00 H new ATOM 0 HG3 MET A 90 4.897 -0.612 -5.597 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.014 -0.646 -1.754 1.00 0.00 H new ATOM 0 HE2 MET A 90 5.116 0.474 -2.590 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.582 -0.002 -3.356 1.00 0.00 H new ATOM 1456 N ALA A 91 7.911 -4.818 -5.920 1.00 0.00 N ATOM 1457 CA ALA A 91 7.794 -6.256 -5.695 1.00 0.00 C ATOM 1458 C ALA A 91 8.711 -6.725 -4.569 1.00 0.00 C ATOM 1459 O ALA A 91 8.271 -7.400 -3.636 1.00 0.00 O ATOM 1460 CB ALA A 91 8.101 -7.014 -6.978 1.00 0.00 C ATOM 0 H ALA A 91 8.176 -4.560 -6.871 1.00 0.00 H new ATOM 0 HA ALA A 91 6.768 -6.464 -5.393 1.00 0.00 H new ATOM 0 HB1 ALA A 91 8.011 -8.085 -6.798 1.00 0.00 H new ATOM 0 HB2 ALA A 91 7.396 -6.716 -7.754 1.00 0.00 H new ATOM 0 HB3 ALA A 91 9.116 -6.785 -7.302 1.00 0.00 H new ATOM 1466 N ALA A 92 9.986 -6.362 -4.661 1.00 0.00 N ATOM 1467 CA ALA A 92 10.970 -6.749 -3.656 1.00 0.00 C ATOM 1468 C ALA A 92 10.752 -5.996 -2.348 1.00 0.00 C ATOM 1469 O ALA A 92 11.105 -6.483 -1.273 1.00 0.00 O ATOM 1470 CB ALA A 92 12.379 -6.506 -4.173 1.00 0.00 C ATOM 0 H ALA A 92 10.363 -5.799 -5.423 1.00 0.00 H new ATOM 0 HA ALA A 92 10.843 -7.813 -3.458 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.102 -6.800 -3.412 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.542 -7.096 -5.075 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.505 -5.448 -4.404 1.00 0.00 H new ATOM 1476 N PHE A 93 10.167 -4.807 -2.446 1.00 0.00 N ATOM 1477 CA PHE A 93 9.908 -3.984 -1.272 1.00 0.00 C ATOM 1478 C PHE A 93 8.832 -4.603 -0.386 1.00 0.00 C ATOM 1479 O PHE A 93 8.992 -4.679 0.831 1.00 0.00 O ATOM 1480 CB PHE A 93 9.491 -2.572 -1.695 1.00 0.00 C ATOM 1481 CG PHE A 93 9.120 -1.680 -0.543 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.038 -1.397 0.456 1.00 0.00 C ATOM 1483 CD2 PHE A 93 7.853 -1.124 -0.460 1.00 0.00 C ATOM 1484 CE1 PHE A 93 9.699 -0.579 1.517 1.00 0.00 C ATOM 1485 CE2 PHE A 93 7.509 -0.303 0.599 1.00 0.00 C ATOM 1486 CZ PHE A 93 8.434 -0.031 1.587 1.00 0.00 C ATOM 0 H PHE A 93 9.863 -4.392 -3.327 1.00 0.00 H new ATOM 0 HA PHE A 93 10.831 -3.927 -0.694 1.00 0.00 H new ATOM 0 HB2 PHE A 93 10.309 -2.112 -2.250 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.643 -2.642 -2.376 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.030 -1.821 0.405 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.126 -1.334 -1.231 1.00 0.00 H new ATOM 0 HE1 PHE A 93 10.423 -0.369 2.290 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.519 0.124 0.653 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.168 0.610 2.414 1.00 0.00 H new ATOM 1496 N THR A 94 7.740 -5.052 -1.002 1.00 0.00 N ATOM 1497 CA THR A 94 6.634 -5.651 -0.262 1.00 0.00 C ATOM 1498 C THR A 94 7.019 -6.994 0.355 1.00 0.00 C ATOM 1499 O THR A 94 6.784 -7.229 1.541 1.00 0.00 O ATOM 1500 CB THR A 94 5.399 -5.851 -1.158 1.00 0.00 C ATOM 1501 OG1 THR A 94 5.748 -6.625 -2.312 1.00 0.00 O ATOM 1502 CG2 THR A 94 4.826 -4.510 -1.593 1.00 0.00 C ATOM 0 H THR A 94 7.599 -5.012 -2.011 1.00 0.00 H new ATOM 0 HA THR A 94 6.392 -4.952 0.538 1.00 0.00 H new ATOM 0 HB THR A 94 4.642 -6.383 -0.582 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.187 -6.049 -2.972 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.954 -4.675 -2.226 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.533 -3.937 -0.713 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.580 -3.956 -2.152 1.00 0.00 H new ATOM 1510 N THR A 95 7.609 -7.873 -0.453 1.00 0.00 N ATOM 1511 CA THR A 95 8.011 -9.191 0.026 1.00 0.00 C ATOM 1512 C THR A 95 8.931 -9.079 1.240 1.00 0.00 C ATOM 1513 O THR A 95 8.816 -9.853 2.187 1.00 0.00 O ATOM 1514 CB THR A 95 8.711 -10.011 -1.074 1.00 0.00 C ATOM 1515 OG1 THR A 95 9.050 -11.311 -0.577 1.00 0.00 O ATOM 1516 CG2 THR A 95 9.965 -9.309 -1.559 1.00 0.00 C ATOM 0 H THR A 95 7.818 -7.697 -1.436 1.00 0.00 H new ATOM 0 HA THR A 95 7.098 -9.711 0.316 1.00 0.00 H new ATOM 0 HB THR A 95 8.022 -10.110 -1.913 1.00 0.00 H new ATOM 0 HG1 THR A 95 9.493 -11.826 -1.283 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.440 -9.909 -2.335 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.701 -8.332 -1.965 1.00 0.00 H new ATOM 0 HG23 THR A 95 10.656 -9.181 -0.726 1.00 0.00 H new ATOM 1524 N THR A 96 9.850 -8.121 1.197 1.00 0.00 N ATOM 1525 CA THR A 96 10.779 -7.899 2.299 1.00 0.00 C ATOM 1526 C THR A 96 10.102 -7.149 3.444 1.00 0.00 C ATOM 1527 O THR A 96 10.463 -7.312 4.611 1.00 0.00 O ATOM 1528 CB THR A 96 12.021 -7.111 1.837 1.00 0.00 C ATOM 1529 OG1 THR A 96 12.675 -7.812 0.773 1.00 0.00 O ATOM 1530 CG2 THR A 96 12.997 -6.904 2.986 1.00 0.00 C ATOM 0 H THR A 96 9.972 -7.484 0.409 1.00 0.00 H new ATOM 0 HA THR A 96 11.096 -8.880 2.652 1.00 0.00 H new ATOM 0 HB THR A 96 11.690 -6.134 1.485 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.300 -7.526 -0.086 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.863 -6.346 2.631 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.507 -6.346 3.784 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.321 -7.872 3.367 1.00 0.00 H new ATOM 1538 N LEU A 97 9.115 -6.328 3.098 1.00 0.00 N ATOM 1539 CA LEU A 97 8.387 -5.532 4.082 1.00 0.00 C ATOM 1540 C LEU A 97 7.750 -6.409 5.156 1.00 0.00 C ATOM 1541 O LEU A 97 7.800 -6.081 6.342 1.00 0.00 O ATOM 1542 CB LEU A 97 7.308 -4.695 3.390 1.00 0.00 C ATOM 1543 CG LEU A 97 7.114 -3.284 3.952 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.173 -2.485 3.066 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.581 -3.343 5.375 1.00 0.00 C ATOM 0 H LEU A 97 8.799 -6.196 2.137 1.00 0.00 H new ATOM 0 HA LEU A 97 9.105 -4.872 4.568 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.556 -4.616 2.332 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.360 -5.228 3.456 1.00 0.00 H new ATOM 0 HG LEU A 97 8.083 -2.785 3.969 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.046 -1.485 3.479 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.592 -2.412 2.062 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.205 -2.984 3.020 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.450 -2.330 5.757 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.622 -3.861 5.383 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.289 -3.880 6.007 1.00 0.00 H new ATOM 1557 N GLN A 98 7.150 -7.522 4.737 1.00 0.00 N ATOM 1558 CA GLN A 98 6.494 -8.432 5.673 1.00 0.00 C ATOM 1559 C GLN A 98 7.433 -8.832 6.807 1.00 0.00 C ATOM 1560 O GLN A 98 6.994 -9.079 7.930 1.00 0.00 O ATOM 1561 CB GLN A 98 5.980 -9.678 4.944 1.00 0.00 C ATOM 1562 CG GLN A 98 7.075 -10.653 4.547 1.00 0.00 C ATOM 1563 CD GLN A 98 6.564 -11.784 3.677 1.00 0.00 C ATOM 1564 OE1 GLN A 98 6.545 -11.680 2.450 1.00 0.00 O ATOM 1565 NE2 GLN A 98 6.145 -12.875 4.308 1.00 0.00 N ATOM 0 H GLN A 98 7.105 -7.814 3.761 1.00 0.00 H new ATOM 0 HA GLN A 98 5.645 -7.905 6.108 1.00 0.00 H new ATOM 0 HB2 GLN A 98 5.264 -10.192 5.585 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.441 -9.367 4.049 1.00 0.00 H new ATOM 0 HG2 GLN A 98 7.859 -10.115 4.013 1.00 0.00 H new ATOM 0 HG3 GLN A 98 7.529 -11.069 5.446 1.00 0.00 H new ATOM 0 HE21 GLN A 98 6.178 -12.919 5.326 1.00 0.00 H new ATOM 0 HE22 GLN A 98 5.790 -13.668 3.774 1.00 0.00 H new ATOM 1574 N HIS A 99 8.727 -8.892 6.508 1.00 0.00 N ATOM 1575 CA HIS A 99 9.722 -9.251 7.509 1.00 0.00 C ATOM 1576 C HIS A 99 10.000 -8.069 8.429 1.00 0.00 C ATOM 1577 O HIS A 99 10.034 -8.210 9.653 1.00 0.00 O ATOM 1578 CB HIS A 99 11.020 -9.705 6.838 1.00 0.00 C ATOM 1579 CG HIS A 99 10.856 -10.915 5.971 1.00 0.00 C ATOM 1580 ND1 HIS A 99 10.994 -12.203 6.444 1.00 0.00 N ATOM 1581 CD2 HIS A 99 10.567 -11.029 4.654 1.00 0.00 C ATOM 1582 CE1 HIS A 99 10.797 -13.057 5.455 1.00 0.00 C ATOM 1583 NE2 HIS A 99 10.537 -12.369 4.358 1.00 0.00 N ATOM 0 H HIS A 99 9.109 -8.697 5.583 1.00 0.00 H new ATOM 0 HA HIS A 99 9.327 -10.076 8.102 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.413 -8.887 6.235 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.762 -9.918 7.608 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.392 -10.217 3.964 1.00 0.00 H new ATOM 0 HE1 HIS A 99 10.841 -14.133 5.531 1.00 0.00 H new ATOM 0 HE2 HIS A 99 10.345 -12.769 3.439 1.00 0.00 H new ATOM 1592 N HIS A 100 10.181 -6.897 7.829 1.00 0.00 N ATOM 1593 CA HIS A 100 10.455 -5.685 8.591 1.00 0.00 C ATOM 1594 C HIS A 100 9.208 -5.229 9.339 1.00 0.00 C ATOM 1595 O HIS A 100 9.249 -4.270 10.108 1.00 0.00 O ATOM 1596 CB HIS A 100 10.951 -4.573 7.667 1.00 0.00 C ATOM 1597 CG HIS A 100 12.323 -4.820 7.120 1.00 0.00 C ATOM 1598 ND1 HIS A 100 13.414 -4.039 7.439 1.00 0.00 N ATOM 1599 CD2 HIS A 100 12.780 -5.770 6.271 1.00 0.00 C ATOM 1600 CE1 HIS A 100 14.482 -4.498 6.811 1.00 0.00 C ATOM 1601 NE2 HIS A 100 14.124 -5.548 6.097 1.00 0.00 N ATOM 0 H HIS A 100 10.143 -6.761 6.819 1.00 0.00 H new ATOM 0 HA HIS A 100 11.235 -5.908 9.319 1.00 0.00 H new ATOM 0 HB2 HIS A 100 10.252 -4.461 6.838 1.00 0.00 H new ATOM 0 HB3 HIS A 100 10.950 -3.630 8.213 1.00 0.00 H new ATOM 0 HD2 HIS A 100 12.196 -6.556 5.815 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.478 -4.084 6.872 1.00 0.00 H new ATOM 0 HE2 HIS A 100 14.745 -6.105 5.510 1.00 0.00 H new ATOM 1610 N LYS A 101 8.102 -5.927 9.105 1.00 0.00 N ATOM 1611 CA LYS A 101 6.840 -5.605 9.759 1.00 0.00 C ATOM 1612 C LYS A 101 6.939 -5.846 11.261 1.00 0.00 C ATOM 1613 O LYS A 101 6.113 -5.360 12.035 1.00 0.00 O ATOM 1614 CB LYS A 101 5.708 -6.444 9.163 1.00 0.00 C ATOM 1615 CG LYS A 101 4.330 -6.069 9.684 1.00 0.00 C ATOM 1616 CD LYS A 101 3.236 -6.897 9.025 1.00 0.00 C ATOM 1617 CE LYS A 101 3.321 -8.360 9.428 1.00 0.00 C ATOM 1618 NZ LYS A 101 3.216 -8.536 10.903 1.00 0.00 N ATOM 0 H LYS A 101 8.055 -6.721 8.466 1.00 0.00 H new ATOM 0 HA LYS A 101 6.623 -4.550 9.592 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.719 -6.335 8.079 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.895 -7.496 9.379 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.297 -6.215 10.764 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.147 -5.010 9.500 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.260 -6.499 9.303 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.318 -6.812 7.941 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.524 -8.919 8.938 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.265 -8.779 9.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.990 -9.528 11.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.121 -8.282 11.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.464 -7.921 11.273 1.00 0.00 H new ATOM 1632 N ASP A 102 7.959 -6.597 11.669 1.00 0.00 N ATOM 1633 CA ASP A 102 8.169 -6.900 13.081 1.00 0.00 C ATOM 1634 C ASP A 102 8.621 -5.658 13.843 1.00 0.00 C ATOM 1635 O ASP A 102 8.759 -5.685 15.066 1.00 0.00 O ATOM 1636 CB ASP A 102 9.201 -8.016 13.238 1.00 0.00 C ATOM 1637 CG ASP A 102 8.688 -9.354 12.742 1.00 0.00 C ATOM 1638 OD1 ASP A 102 8.859 -9.648 11.541 1.00 0.00 O ATOM 1639 OD2 ASP A 102 8.115 -10.107 13.558 1.00 0.00 O ATOM 0 H ASP A 102 8.652 -7.006 11.042 1.00 0.00 H new ATOM 0 HA ASP A 102 7.220 -7.234 13.500 1.00 0.00 H new ATOM 0 HB2 ASP A 102 10.105 -7.751 12.689 1.00 0.00 H new ATOM 0 HB3 ASP A 102 9.480 -8.104 14.288 1.00 0.00 H new ATOM 1644 N GLU A 103 8.850 -4.572 13.112 1.00 0.00 N ATOM 1645 CA GLU A 103 9.285 -3.316 13.715 1.00 0.00 C ATOM 1646 C GLU A 103 8.440 -2.153 13.209 1.00 0.00 C ATOM 1647 O GLU A 103 7.939 -1.347 13.994 1.00 0.00 O ATOM 1648 CB GLU A 103 10.761 -3.063 13.403 1.00 0.00 C ATOM 1649 CG GLU A 103 11.317 -1.806 14.055 1.00 0.00 C ATOM 1650 CD GLU A 103 12.760 -1.540 13.671 1.00 0.00 C ATOM 1651 OE1 GLU A 103 13.663 -2.075 14.345 1.00 0.00 O ATOM 1652 OE2 GLU A 103 12.985 -0.794 12.694 1.00 0.00 O ATOM 0 H GLU A 103 8.741 -4.536 12.098 1.00 0.00 H new ATOM 0 HA GLU A 103 9.157 -3.393 14.795 1.00 0.00 H new ATOM 0 HB2 GLU A 103 11.345 -3.922 13.733 1.00 0.00 H new ATOM 0 HB3 GLU A 103 10.887 -2.988 12.323 1.00 0.00 H new ATOM 0 HG2 GLU A 103 10.705 -0.951 13.768 1.00 0.00 H new ATOM 0 HG3 GLU A 103 11.245 -1.901 15.138 1.00 0.00 H new ATOM 1659 N VAL A 104 8.291 -2.072 11.890 1.00 0.00 N ATOM 1660 CA VAL A 104 7.505 -1.014 11.267 1.00 0.00 C ATOM 1661 C VAL A 104 6.085 -0.987 11.822 1.00 0.00 C ATOM 1662 O VAL A 104 5.524 -2.028 12.166 1.00 0.00 O ATOM 1663 CB VAL A 104 7.450 -1.193 9.736 1.00 0.00 C ATOM 1664 CG1 VAL A 104 6.628 -0.089 9.086 1.00 0.00 C ATOM 1665 CG2 VAL A 104 8.856 -1.230 9.156 1.00 0.00 C ATOM 0 H VAL A 104 8.707 -2.730 11.230 1.00 0.00 H new ATOM 0 HA VAL A 104 7.996 -0.069 11.498 1.00 0.00 H new ATOM 0 HB VAL A 104 6.962 -2.144 9.522 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.606 -0.239 8.007 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.611 -0.114 9.477 1.00 0.00 H new ATOM 0 HG13 VAL A 104 7.078 0.879 9.308 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.800 -1.357 8.075 1.00 0.00 H new ATOM 0 HG22 VAL A 104 9.369 -0.296 9.386 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.407 -2.064 9.591 1.00 0.00 H new ATOM 1675 N ALA A 105 5.512 0.210 11.913 1.00 0.00 N ATOM 1676 CA ALA A 105 4.157 0.377 12.424 1.00 0.00 C ATOM 1677 C ALA A 105 3.175 -0.506 11.663 1.00 0.00 C ATOM 1678 O ALA A 105 2.854 -0.240 10.504 1.00 0.00 O ATOM 1679 CB ALA A 105 3.737 1.835 12.332 1.00 0.00 C ATOM 0 H ALA A 105 5.968 1.080 11.638 1.00 0.00 H new ATOM 0 HA ALA A 105 4.147 0.072 13.470 1.00 0.00 H new ATOM 0 HB1 ALA A 105 2.723 1.947 12.717 1.00 0.00 H new ATOM 0 HB2 ALA A 105 4.418 2.448 12.922 1.00 0.00 H new ATOM 0 HB3 ALA A 105 3.768 2.158 11.291 1.00 0.00 H new ATOM 1685 N GLY A 106 2.706 -1.561 12.320 1.00 0.00 N ATOM 1686 CA GLY A 106 1.768 -2.470 11.691 1.00 0.00 C ATOM 1687 C GLY A 106 0.429 -1.820 11.409 1.00 0.00 C ATOM 1688 O GLY A 106 -0.248 -2.175 10.447 1.00 0.00 O ATOM 0 H GLY A 106 2.959 -1.803 13.278 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.194 -2.837 10.757 1.00 0.00 H new ATOM 0 HA3 GLY A 106 1.619 -3.336 12.336 1.00 0.00 H new ATOM 1692 N ASP A 107 0.047 -0.866 12.253 1.00 0.00 N ATOM 1693 CA ASP A 107 -1.225 -0.167 12.093 1.00 0.00 C ATOM 1694 C ASP A 107 -1.270 0.608 10.780 1.00 0.00 C ATOM 1695 O ASP A 107 -2.294 0.630 10.099 1.00 0.00 O ATOM 1696 CB ASP A 107 -1.457 0.786 13.267 1.00 0.00 C ATOM 1697 CG ASP A 107 -1.513 0.063 14.598 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -2.600 -0.439 14.955 1.00 0.00 O ATOM 1699 OD2 ASP A 107 -0.471 0.000 15.285 1.00 0.00 O ATOM 0 H ASP A 107 0.599 -0.559 13.054 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.017 -0.916 12.074 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -0.658 1.527 13.293 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -2.390 1.328 13.112 1.00 0.00 H new ATOM 1704 N ILE A 108 -0.154 1.244 10.428 1.00 0.00 N ATOM 1705 CA ILE A 108 -0.081 2.025 9.198 1.00 0.00 C ATOM 1706 C ILE A 108 -0.026 1.125 7.967 1.00 0.00 C ATOM 1707 O ILE A 108 -0.784 1.318 7.017 1.00 0.00 O ATOM 1708 CB ILE A 108 1.147 2.955 9.191 1.00 0.00 C ATOM 1709 CG1 ILE A 108 1.116 3.882 10.410 1.00 0.00 C ATOM 1710 CG2 ILE A 108 1.193 3.763 7.899 1.00 0.00 C ATOM 1711 CD1 ILE A 108 2.335 4.771 10.535 1.00 0.00 C ATOM 0 H ILE A 108 0.707 1.233 10.975 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.988 2.629 9.161 1.00 0.00 H new ATOM 0 HB ILE A 108 2.049 2.346 9.245 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.226 4.508 10.355 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.025 3.277 11.312 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.066 4.415 7.909 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.256 3.085 7.048 1.00 0.00 H new ATOM 0 HG23 ILE A 108 0.290 4.367 7.815 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.239 5.398 11.422 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.229 4.153 10.622 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.416 5.403 9.651 1.00 0.00 H new ATOM 1723 N PHE A 109 0.869 0.141 7.990 1.00 0.00 N ATOM 1724 CA PHE A 109 1.009 -0.776 6.865 1.00 0.00 C ATOM 1725 C PHE A 109 -0.253 -1.612 6.678 1.00 0.00 C ATOM 1726 O PHE A 109 -0.567 -2.022 5.564 1.00 0.00 O ATOM 1727 CB PHE A 109 2.220 -1.696 7.039 1.00 0.00 C ATOM 1728 CG PHE A 109 2.413 -2.641 5.883 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.436 -2.167 4.580 1.00 0.00 C ATOM 1730 CD2 PHE A 109 2.558 -4.002 6.097 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.601 -3.030 3.512 1.00 0.00 C ATOM 1732 CE2 PHE A 109 2.723 -4.871 5.035 1.00 0.00 C ATOM 1733 CZ PHE A 109 2.743 -4.385 3.741 1.00 0.00 C ATOM 0 H PHE A 109 1.503 -0.040 8.768 1.00 0.00 H new ATOM 0 HA PHE A 109 1.164 -0.168 5.974 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.117 -1.088 7.158 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.102 -2.273 7.956 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.323 -1.109 4.397 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.542 -4.388 7.105 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.619 -2.646 2.503 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.836 -5.930 5.216 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.869 -5.064 2.910 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.971 -1.857 7.773 1.00 0.00 N ATOM 1744 CA ASP A 110 -2.195 -2.657 7.724 1.00 0.00 C ATOM 1745 C ASP A 110 -3.109 -2.183 6.600 1.00 0.00 C ATOM 1746 O ASP A 110 -3.882 -2.964 6.046 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.934 -2.586 9.062 1.00 0.00 C ATOM 1748 CG ASP A 110 -4.182 -3.446 9.080 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -5.247 -2.957 8.646 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -4.096 -4.610 9.527 1.00 0.00 O ATOM 0 H ASP A 110 -0.728 -1.514 8.702 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.913 -3.692 7.529 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -2.265 -2.905 9.861 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -3.206 -1.551 9.269 1.00 0.00 H new ATOM 1755 N MET A 111 -3.019 -0.900 6.268 1.00 0.00 N ATOM 1756 CA MET A 111 -3.822 -0.334 5.194 1.00 0.00 C ATOM 1757 C MET A 111 -3.301 -0.819 3.845 1.00 0.00 C ATOM 1758 O MET A 111 -4.052 -1.337 3.019 1.00 0.00 O ATOM 1759 CB MET A 111 -3.786 1.194 5.247 1.00 0.00 C ATOM 1760 CG MET A 111 -4.563 1.863 4.125 1.00 0.00 C ATOM 1761 SD MET A 111 -4.277 3.640 4.046 1.00 0.00 S ATOM 1762 CE MET A 111 -2.545 3.683 3.592 1.00 0.00 C ATOM 0 H MET A 111 -2.398 -0.234 6.728 1.00 0.00 H new ATOM 0 HA MET A 111 -4.854 -0.663 5.320 1.00 0.00 H new ATOM 0 HB2 MET A 111 -4.189 1.525 6.204 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.749 1.526 5.207 1.00 0.00 H new ATOM 0 HG2 MET A 111 -4.282 1.411 3.174 1.00 0.00 H new ATOM 0 HG3 MET A 111 -5.628 1.676 4.264 1.00 0.00 H new ATOM 0 HE1 MET A 111 -2.400 4.391 2.776 1.00 0.00 H new ATOM 0 HE2 MET A 111 -1.951 3.994 4.451 1.00 0.00 H new ATOM 0 HE3 MET A 111 -2.228 2.690 3.272 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.999 -0.650 3.645 1.00 0.00 N ATOM 1773 CA LEU A 112 -1.343 -1.063 2.411 1.00 0.00 C ATOM 1774 C LEU A 112 -1.381 -2.579 2.261 1.00 0.00 C ATOM 1775 O LEU A 112 -1.282 -3.107 1.156 1.00 0.00 O ATOM 1776 CB LEU A 112 0.106 -0.569 2.393 1.00 0.00 C ATOM 1777 CG LEU A 112 0.282 0.950 2.471 1.00 0.00 C ATOM 1778 CD1 LEU A 112 1.757 1.316 2.468 1.00 0.00 C ATOM 1779 CD2 LEU A 112 -0.439 1.632 1.316 1.00 0.00 C ATOM 0 H LEU A 112 -1.372 -0.226 4.329 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.880 -0.620 1.572 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.637 -1.023 3.229 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.583 -0.927 1.481 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.158 1.299 3.405 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.863 2.399 2.524 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.247 0.859 3.327 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.220 0.953 1.550 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -0.303 2.711 1.388 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.029 1.277 0.371 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.502 1.397 1.361 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.532 -3.270 3.385 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.574 -4.728 3.405 1.00 0.00 C ATOM 1793 C LEU A 113 -2.575 -5.260 2.385 1.00 0.00 C ATOM 1794 O LEU A 113 -2.429 -6.374 1.882 1.00 0.00 O ATOM 1795 CB LEU A 113 -1.938 -5.219 4.808 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.880 -6.736 5.013 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -0.499 -7.276 4.672 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -2.251 -7.087 6.446 1.00 0.00 C ATOM 0 H LEU A 113 -1.628 -2.838 4.304 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.587 -5.104 3.138 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.266 -4.747 5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.946 -4.877 5.043 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.601 -7.202 4.341 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.482 -8.355 4.825 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.269 -7.054 3.630 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.245 -6.806 5.316 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.206 -8.168 6.579 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.551 -6.608 7.131 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -3.262 -6.737 6.656 1.00 0.00 H new ATOM 1810 N THR A 114 -3.593 -4.457 2.086 1.00 0.00 N ATOM 1811 CA THR A 114 -4.621 -4.842 1.125 1.00 0.00 C ATOM 1812 C THR A 114 -4.036 -5.113 -0.263 1.00 0.00 C ATOM 1813 O THR A 114 -4.768 -5.453 -1.193 1.00 0.00 O ATOM 1814 CB THR A 114 -5.705 -3.755 1.005 1.00 0.00 C ATOM 1815 OG1 THR A 114 -5.130 -2.538 0.514 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.366 -3.501 2.351 1.00 0.00 C ATOM 0 H THR A 114 -3.727 -3.533 2.497 1.00 0.00 H new ATOM 0 HA THR A 114 -5.066 -5.762 1.504 1.00 0.00 H new ATOM 0 HB THR A 114 -6.463 -4.106 0.304 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.734 -2.039 1.259 1.00 0.00 H new ATOM 0 HG21 THR A 114 -7.128 -2.730 2.242 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.829 -4.421 2.708 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.615 -3.170 3.069 1.00 0.00 H new ATOM 1824 N PHE A 115 -2.719 -4.965 -0.403 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.056 -5.205 -1.682 1.00 0.00 C ATOM 1826 C PHE A 115 -2.172 -6.672 -2.085 1.00 0.00 C ATOM 1827 O PHE A 115 -2.085 -7.007 -3.267 1.00 0.00 O ATOM 1828 CB PHE A 115 -0.574 -4.809 -1.615 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.316 -3.328 -1.722 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -1.049 -2.538 -2.596 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.671 -2.728 -0.952 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -0.804 -1.182 -2.699 1.00 0.00 C ATOM 1833 CE2 PHE A 115 0.918 -1.372 -1.051 1.00 0.00 C ATOM 1834 CZ PHE A 115 0.180 -0.598 -1.925 1.00 0.00 C ATOM 0 H PHE A 115 -2.093 -4.681 0.351 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.553 -4.589 -2.431 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.157 -5.170 -0.675 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.039 -5.317 -2.417 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -1.820 -2.988 -3.203 1.00 0.00 H new ATOM 0 HD2 PHE A 115 1.253 -3.328 -0.268 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.381 -0.579 -3.384 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.688 -0.918 -0.445 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.372 0.462 -2.003 1.00 0.00 H new ATOM 1844 N THR A 116 -2.369 -7.542 -1.098 1.00 0.00 N ATOM 1845 CA THR A 116 -2.490 -8.972 -1.357 1.00 0.00 C ATOM 1846 C THR A 116 -3.511 -9.625 -0.430 1.00 0.00 C ATOM 1847 O THR A 116 -4.202 -10.569 -0.819 1.00 0.00 O ATOM 1848 CB THR A 116 -1.134 -9.686 -1.194 1.00 0.00 C ATOM 1849 OG1 THR A 116 -1.301 -11.099 -1.354 1.00 0.00 O ATOM 1850 CG2 THR A 116 -0.528 -9.393 0.171 1.00 0.00 C ATOM 0 H THR A 116 -2.448 -7.282 -0.115 1.00 0.00 H new ATOM 0 HA THR A 116 -2.830 -9.075 -2.388 1.00 0.00 H new ATOM 0 HB THR A 116 -0.457 -9.312 -1.962 1.00 0.00 H new ATOM 0 HG1 THR A 116 -0.434 -11.545 -1.250 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.428 -9.908 0.263 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.374 -8.319 0.278 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.204 -9.742 0.952 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.606 -9.120 0.797 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.542 -9.662 1.777 1.00 0.00 C ATOM 1860 C ASP A 117 -5.979 -9.293 1.417 1.00 0.00 C ATOM 1861 O ASP A 117 -6.489 -8.253 1.836 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.203 -9.149 3.177 1.00 0.00 C ATOM 1863 CG ASP A 117 -4.842 -9.984 4.270 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -6.084 -9.964 4.382 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -4.098 -10.659 5.013 1.00 0.00 O ATOM 0 H ASP A 117 -3.047 -8.337 1.136 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.452 -10.748 1.767 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -3.121 -9.150 3.309 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.535 -8.115 3.272 1.00 0.00 H new ATOM 1870 N PHE A 118 -6.626 -10.154 0.639 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.002 -9.921 0.210 1.00 0.00 C ATOM 1872 C PHE A 118 -8.949 -9.837 1.404 1.00 0.00 C ATOM 1873 O PHE A 118 -9.919 -9.079 1.383 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.453 -11.031 -0.740 1.00 0.00 C ATOM 1875 CG PHE A 118 -9.819 -10.806 -1.324 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -9.989 -9.976 -2.420 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -10.932 -11.421 -0.774 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.244 -9.766 -2.959 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.190 -11.214 -1.308 1.00 0.00 C ATOM 1880 CZ PHE A 118 -12.346 -10.385 -2.402 1.00 0.00 C ATOM 0 H PHE A 118 -6.219 -11.022 0.291 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.033 -8.965 -0.313 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -7.730 -11.119 -1.551 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.448 -11.980 -0.204 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.131 -9.488 -2.858 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -10.815 -12.070 0.082 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -11.363 -9.118 -3.815 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -13.050 -11.700 -0.871 1.00 0.00 H new ATOM 0 HZ PHE A 118 -13.328 -10.221 -2.821 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.663 -10.615 2.443 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.499 -10.623 3.640 1.00 0.00 C ATOM 1892 C LEU A 119 -9.516 -9.247 4.298 1.00 0.00 C ATOM 1893 O LEU A 119 -10.530 -8.826 4.857 1.00 0.00 O ATOM 1894 CB LEU A 119 -8.999 -11.673 4.636 1.00 0.00 C ATOM 1895 CG LEU A 119 -9.056 -13.121 4.139 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -8.431 -14.060 5.161 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -10.493 -13.530 3.848 1.00 0.00 C ATOM 0 H LEU A 119 -7.862 -11.246 2.481 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.516 -10.877 3.340 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.969 -11.437 4.902 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.590 -11.595 5.549 1.00 0.00 H new ATOM 0 HG LEU A 119 -8.485 -13.190 3.213 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.480 -15.084 4.792 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -7.389 -13.782 5.322 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.975 -13.987 6.103 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -10.514 -14.561 3.496 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -11.087 -13.445 4.758 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -10.909 -12.877 3.081 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.387 -8.548 4.226 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.267 -7.221 4.817 1.00 0.00 C ATOM 1911 C ALA A 120 -8.961 -6.171 3.956 1.00 0.00 C ATOM 1912 O ALA A 120 -9.510 -5.199 4.469 1.00 0.00 O ATOM 1913 CB ALA A 120 -6.801 -6.863 5.008 1.00 0.00 C ATOM 0 H ALA A 120 -7.541 -8.880 3.763 1.00 0.00 H new ATOM 0 HA ALA A 120 -8.758 -7.237 5.790 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -6.724 -5.870 5.450 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.332 -7.592 5.669 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.296 -6.871 4.042 1.00 0.00 H new ATOM 1919 N PHE A 121 -8.930 -6.381 2.645 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.546 -5.456 1.699 1.00 0.00 C ATOM 1921 C PHE A 121 -11.053 -5.358 1.934 1.00 0.00 C ATOM 1922 O PHE A 121 -11.598 -4.266 2.129 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.262 -5.925 0.269 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.472 -4.874 -0.783 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -8.876 -3.627 -0.671 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.254 -5.139 -1.896 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.059 -2.666 -1.647 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.442 -4.182 -2.874 1.00 0.00 C ATOM 1929 CZ PHE A 121 -9.843 -2.943 -2.749 1.00 0.00 C ATOM 0 H PHE A 121 -8.482 -7.188 2.211 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.118 -4.465 1.848 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.232 -6.277 0.213 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -9.903 -6.778 0.046 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.262 -3.404 0.189 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.723 -6.106 -2.000 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.589 -1.699 -1.548 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -11.056 -4.402 -3.735 1.00 0.00 H new ATOM 0 HZ PHE A 121 -9.988 -2.193 -3.512 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.720 -6.507 1.923 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.161 -6.558 2.133 1.00 0.00 C ATOM 1941 C LYS A 122 -13.522 -6.061 3.529 1.00 0.00 C ATOM 1942 O LYS A 122 -14.388 -5.201 3.686 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.677 -7.985 1.931 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.174 -8.130 2.153 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.641 -9.553 1.894 1.00 0.00 C ATOM 1946 CE LYS A 122 -17.126 -9.709 2.175 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.608 -11.087 1.879 1.00 0.00 N ATOM 0 H LYS A 122 -11.284 -7.417 1.771 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.636 -5.904 1.402 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.436 -8.309 0.919 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.151 -8.652 2.614 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.420 -7.846 3.176 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.708 -7.445 1.495 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.435 -9.822 0.858 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -15.076 -10.243 2.521 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.324 -9.472 3.220 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.686 -8.992 1.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.626 -11.150 2.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.443 -11.304 0.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -17.092 -11.770 2.470 1.00 0.00 H new ATOM 1961 N GLU A 123 -12.849 -6.607 4.538 1.00 0.00 N ATOM 1962 CA GLU A 123 -13.098 -6.220 5.922 1.00 0.00 C ATOM 1963 C GLU A 123 -12.859 -4.726 6.122 1.00 0.00 C ATOM 1964 O GLU A 123 -13.471 -4.100 6.988 1.00 0.00 O ATOM 1965 CB GLU A 123 -12.199 -7.021 6.867 1.00 0.00 C ATOM 1966 CG GLU A 123 -12.460 -6.745 8.339 1.00 0.00 C ATOM 1967 CD GLU A 123 -13.845 -7.180 8.778 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -14.791 -6.377 8.640 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -13.983 -8.324 9.261 1.00 0.00 O ATOM 0 H GLU A 123 -12.127 -7.319 4.423 1.00 0.00 H new ATOM 0 HA GLU A 123 -14.141 -6.437 6.151 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -12.341 -8.084 6.675 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.157 -6.793 6.643 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -11.713 -7.264 8.940 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -12.340 -5.679 8.532 1.00 0.00 H new ATOM 1976 N MET A 124 -11.964 -4.160 5.316 1.00 0.00 N ATOM 1977 CA MET A 124 -11.646 -2.740 5.407 1.00 0.00 C ATOM 1978 C MET A 124 -12.858 -1.891 5.037 1.00 0.00 C ATOM 1979 O MET A 124 -13.203 -0.945 5.745 1.00 0.00 O ATOM 1980 CB MET A 124 -10.468 -2.397 4.492 1.00 0.00 C ATOM 1981 CG MET A 124 -10.102 -0.921 4.494 1.00 0.00 C ATOM 1982 SD MET A 124 -8.684 -0.556 3.440 1.00 0.00 S ATOM 1983 CE MET A 124 -9.307 -1.073 1.841 1.00 0.00 C ATOM 0 H MET A 124 -11.448 -4.663 4.594 1.00 0.00 H new ATOM 0 HA MET A 124 -11.369 -2.519 6.438 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.599 -2.978 4.800 1.00 0.00 H new ATOM 0 HB3 MET A 124 -10.710 -2.701 3.474 1.00 0.00 H new ATOM 0 HG2 MET A 124 -10.959 -0.338 4.158 1.00 0.00 H new ATOM 0 HG3 MET A 124 -9.882 -0.606 5.514 1.00 0.00 H new ATOM 0 HE1 MET A 124 -8.677 -0.659 1.054 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.295 -2.161 1.780 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.328 -0.714 1.715 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.499 -2.234 3.923 1.00 0.00 N ATOM 1994 CA PHE A 125 -14.675 -1.498 3.467 1.00 0.00 C ATOM 1995 C PHE A 125 -15.858 -1.708 4.408 1.00 0.00 C ATOM 1996 O PHE A 125 -16.575 -0.762 4.735 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.056 -1.919 2.048 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.039 -1.526 1.015 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -13.707 -0.193 0.819 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.416 -2.487 0.239 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -12.774 0.170 -0.132 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.482 -2.130 -0.713 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.159 -0.800 -0.900 1.00 0.00 C ATOM 0 H PHE A 125 -13.226 -3.012 3.322 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.422 -0.438 3.467 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.190 -3.000 2.022 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.016 -1.472 1.790 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.184 0.569 1.417 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.663 -3.529 0.380 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.525 1.211 -0.275 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.004 -2.891 -1.312 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.428 -0.519 -1.644 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.058 -2.951 4.837 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.158 -3.280 5.738 1.00 0.00 C ATOM 2015 C LEU A 126 -17.071 -2.461 7.022 1.00 0.00 C ATOM 2016 O LEU A 126 -18.080 -1.955 7.516 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.145 -4.774 6.070 1.00 0.00 C ATOM 2018 CG LEU A 126 -17.268 -5.710 4.865 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.157 -7.161 5.307 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.580 -5.475 4.134 1.00 0.00 C ATOM 0 H LEU A 126 -15.474 -3.745 4.576 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.093 -3.036 5.234 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.219 -5.005 6.596 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -17.964 -4.984 6.758 1.00 0.00 H new ATOM 0 HG LEU A 126 -16.450 -5.493 4.177 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -17.246 -7.814 4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -16.191 -7.323 5.785 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -17.954 -7.388 6.015 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -18.647 -6.150 3.281 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -19.413 -5.662 4.812 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.622 -4.443 3.784 1.00 0.00 H new ATOM 2032 N ASP A 127 -15.862 -2.337 7.558 1.00 0.00 N ATOM 2033 CA ASP A 127 -15.642 -1.575 8.781 1.00 0.00 C ATOM 2034 C ASP A 127 -15.907 -0.092 8.542 1.00 0.00 C ATOM 2035 O ASP A 127 -16.515 0.584 9.374 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.211 -1.776 9.282 1.00 0.00 C ATOM 2037 CG ASP A 127 -13.881 -0.884 10.462 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -14.207 -1.268 11.605 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -13.297 0.198 10.244 1.00 0.00 O ATOM 0 H ASP A 127 -15.019 -2.755 7.164 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.336 -1.936 9.540 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.072 -2.819 9.568 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.513 -1.573 8.470 1.00 0.00 H new ATOM 2044 N TYR A 128 -15.448 0.404 7.398 1.00 0.00 N ATOM 2045 CA TYR A 128 -15.634 1.805 7.040 1.00 0.00 C ATOM 2046 C TYR A 128 -17.115 2.168 7.021 1.00 0.00 C ATOM 2047 O TYR A 128 -17.499 3.266 7.428 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.005 2.090 5.675 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.135 3.531 5.232 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -14.305 4.515 5.752 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.089 3.906 4.294 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -14.420 5.833 5.349 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -16.211 5.220 3.885 1.00 0.00 C ATOM 2054 CZ TYR A 128 -15.374 6.180 4.416 1.00 0.00 C ATOM 2055 OH TYR A 128 -15.492 7.490 4.012 1.00 0.00 O ATOM 0 H TYR A 128 -14.944 -0.145 6.702 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.140 2.418 7.793 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -13.948 1.824 5.709 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -15.471 1.447 4.929 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -13.557 4.247 6.483 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -16.747 3.157 3.877 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -13.766 6.586 5.763 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -16.957 5.494 3.154 1.00 0.00 H new ATOM 0 HH TYR A 128 -16.211 7.565 3.350 1.00 0.00 H new ATOM 2065 N ARG A 129 -17.943 1.244 6.542 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.382 1.469 6.477 1.00 0.00 C ATOM 2067 C ARG A 129 -19.992 1.452 7.875 1.00 0.00 C ATOM 2068 O ARG A 129 -20.944 2.179 8.155 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.055 0.410 5.602 1.00 0.00 C ATOM 2070 CG ARG A 129 -21.532 0.674 5.359 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.174 -0.434 4.541 1.00 0.00 C ATOM 2072 NE ARG A 129 -22.181 -1.709 5.253 1.00 0.00 N ATOM 2073 CZ ARG A 129 -22.948 -2.740 4.912 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -23.767 -2.646 3.871 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -22.897 -3.866 5.610 1.00 0.00 N ATOM 0 H ARG A 129 -17.642 0.334 6.194 1.00 0.00 H new ATOM 0 HA ARG A 129 -19.550 2.450 6.032 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -19.540 0.362 4.643 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -19.941 -0.566 6.074 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.047 0.766 6.315 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -21.651 1.625 4.840 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -23.197 -0.153 4.291 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -21.636 -0.548 3.600 1.00 0.00 H new ATOM 0 HE ARG A 129 -21.563 -1.814 6.057 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -23.809 -1.782 3.331 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -24.355 -3.438 3.611 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -22.269 -3.942 6.410 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -23.486 -4.656 5.347 1.00 0.00 H new ATOM 2089 N ALA A 130 -19.436 0.615 8.745 1.00 0.00 N ATOM 2090 CA ALA A 130 -19.920 0.505 10.116 1.00 0.00 C ATOM 2091 C ALA A 130 -19.782 1.834 10.848 1.00 0.00 C ATOM 2092 O ALA A 130 -20.622 2.190 11.675 1.00 0.00 O ATOM 2093 CB ALA A 130 -19.164 -0.588 10.856 1.00 0.00 C ATOM 0 H ALA A 130 -18.650 0.003 8.525 1.00 0.00 H new ATOM 0 HA ALA A 130 -20.977 0.241 10.085 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -19.535 -0.659 11.878 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -19.313 -1.541 10.349 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -18.101 -0.348 10.872 1.00 0.00 H new ATOM 2099 N GLU A 131 -18.715 2.565 10.535 1.00 0.00 N ATOM 2100 CA GLU A 131 -18.464 3.859 11.158 1.00 0.00 C ATOM 2101 C GLU A 131 -19.535 4.871 10.762 1.00 0.00 C ATOM 2102 O GLU A 131 -19.807 5.822 11.496 1.00 0.00 O ATOM 2103 CB GLU A 131 -17.080 4.378 10.759 1.00 0.00 C ATOM 2104 CG GLU A 131 -15.945 3.454 11.168 1.00 0.00 C ATOM 2105 CD GLU A 131 -14.588 3.968 10.731 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -13.958 4.714 11.508 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -14.154 3.623 9.612 1.00 0.00 O ATOM 0 H GLU A 131 -18.011 2.282 9.853 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.498 3.728 12.240 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.051 4.519 9.679 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.923 5.356 11.213 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -15.952 3.334 12.251 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.112 2.467 10.737 1.00 0.00 H new