USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 915 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 112 MET CE :methyl -129:sc= -0.295 (180deg=-0.792) USER MOD Set 1.2: A 113 MET CE :methyl 171:sc= -0.912 (180deg=-1.35) USER MOD Set 1.3: A 126 MET CE :methyl 136:sc= -1.91 (180deg=-4.72!) USER MOD Set 2.1: A 31 ASN : amide:sc= -1.26! K(o=-2!,f=-3.5) USER MOD Set 2.2: A 106 TYR OH : rot 172:sc= -0.77! USER MOD Single : A 20 LYS NZ :NH3+ 157:sc= 0.512 (180deg=-1.29!) USER MOD Single : A 22 GLN :FLIP amide:sc= -0.0269 F(o=-1.7!,f=-0.027) USER MOD Single : A 23 GLN :FLIP amide:sc= -1.49 F(o=-7.9!,f=-1.5) USER MOD Single : A 32 LYS NZ :NH3+ -170:sc= 1.31 (180deg=1.06) USER MOD Single : A 33 GLN :FLIP amide:sc= -0.545 F(o=-2,f=-0.55) USER MOD Single : A 39 LYS NZ :NH3+ 165:sc= -0.0526 (180deg=-0.298) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -39:sc= 0.42 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -143:sc= 1.34 (180deg=0.288) USER MOD Single : A 54 LYS NZ :NH3+ 161:sc= 2.08 (180deg=1.59) USER MOD Single : A 56 LYS NZ :NH3+ -160:sc= 1.16 (180deg=0.0378) USER MOD Single : A 57 TYR OH : rot 12:sc= 1.26 USER MOD Single : A 58 MET CE :methyl 145:sc= -0.0841 (180deg=-1.05) USER MOD Single : A 63 ASN : amide:sc= 0.324 K(o=0.32,f=-4.3!) USER MOD Single : A 65 ASN : amide:sc= 0.404 X(o=0.4,f=-0.084) USER MOD Single : A 71 MET CE :methyl -173:sc= 0 (180deg=-0.00351) USER MOD Single : A 72 SER OG : rot 133:sc= 1.19 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl -112:sc= -1.69! (180deg=-2.38!) USER MOD Single : A 79 LYS NZ :NH3+ -169:sc= -0.0198 (180deg=-0.167) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ -169:sc= -0.0159 (180deg=-0.157) USER MOD Single : A 97 SER OG : rot -83:sc= -0.286 USER MOD Single : A 98 SER OG : rot -6:sc= 1.03 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0048) USER MOD Single : A 118 SER OG : rot 79:sc= 0.699 USER MOD Single : A 122 LYS NZ :NH3+ -123:sc= 1.41 (180deg=-0.665) USER MOD Single : A 123 MET CE :methyl -168:sc= -0.0364 (180deg=-0.249) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 245 N LEU A 18 10.432 4.827 -8.421 1.00 23.31 N ATOM 246 CA LEU A 18 10.537 3.841 -9.476 1.00 42.34 C ATOM 247 C LEU A 18 9.965 2.484 -9.013 1.00 62.33 C ATOM 248 O LEU A 18 9.532 1.673 -9.832 1.00 74.41 O ATOM 249 CB LEU A 18 12.032 3.759 -9.906 1.00 71.11 C ATOM 250 CG LEU A 18 12.392 3.156 -11.293 1.00 60.45 C ATOM 251 CD1 LEU A 18 12.107 1.675 -11.405 1.00 70.41 C ATOM 252 CD2 LEU A 18 11.682 3.922 -12.390 1.00 71.11 C ATOM 0 HA LEU A 18 9.942 4.130 -10.343 1.00 42.34 H new ATOM 0 HB2 LEU A 18 12.439 4.770 -9.873 1.00 71.11 H new ATOM 0 HB3 LEU A 18 12.559 3.178 -9.149 1.00 71.11 H new ATOM 0 HG LEU A 18 13.471 3.260 -11.407 1.00 60.45 H new ATOM 0 HD11 LEU A 18 12.383 1.326 -12.400 1.00 70.41 H new ATOM 0 HD12 LEU A 18 12.687 1.135 -10.657 1.00 70.41 H new ATOM 0 HD13 LEU A 18 11.045 1.495 -11.239 1.00 70.41 H new ATOM 0 HD21 LEU A 18 11.940 3.493 -13.358 1.00 71.11 H new ATOM 0 HD22 LEU A 18 10.604 3.858 -12.240 1.00 71.11 H new ATOM 0 HD23 LEU A 18 11.990 4.967 -12.362 1.00 71.11 H new ATOM 264 N LEU A 19 9.916 2.275 -7.697 1.00 21.22 N ATOM 265 CA LEU A 19 9.368 1.041 -7.122 1.00 1.01 C ATOM 266 C LEU A 19 7.920 0.842 -7.572 1.00 51.13 C ATOM 267 O LEU A 19 7.494 -0.283 -7.868 1.00 62.45 O ATOM 268 CB LEU A 19 9.431 1.073 -5.594 1.00 64.31 C ATOM 269 CG LEU A 19 10.824 1.231 -4.972 1.00 53.44 C ATOM 270 CD1 LEU A 19 10.732 1.270 -3.455 1.00 54.23 C ATOM 271 CD2 LEU A 19 11.736 0.104 -5.417 1.00 62.43 C ATOM 0 H LEU A 19 10.250 2.946 -7.005 1.00 21.22 H new ATOM 0 HA LEU A 19 9.974 0.208 -7.478 1.00 1.01 H new ATOM 0 HB2 LEU A 19 8.805 1.894 -5.243 1.00 64.31 H new ATOM 0 HB3 LEU A 19 8.990 0.151 -5.215 1.00 64.31 H new ATOM 0 HG LEU A 19 11.247 2.175 -5.316 1.00 53.44 H new ATOM 0 HD11 LEU A 19 11.731 1.382 -3.033 1.00 54.23 H new ATOM 0 HD12 LEU A 19 10.112 2.113 -3.150 1.00 54.23 H new ATOM 0 HD13 LEU A 19 10.288 0.343 -3.093 1.00 54.23 H new ATOM 0 HD21 LEU A 19 12.720 0.233 -4.966 1.00 62.43 H new ATOM 0 HD22 LEU A 19 11.315 -0.851 -5.103 1.00 62.43 H new ATOM 0 HD23 LEU A 19 11.830 0.119 -6.503 1.00 62.43 H new ATOM 283 N LYS A 20 7.193 1.951 -7.656 1.00 14.11 N ATOM 284 CA LYS A 20 5.815 1.966 -8.110 1.00 5.35 C ATOM 285 C LYS A 20 5.725 1.461 -9.546 1.00 73.10 C ATOM 286 O LYS A 20 4.833 0.711 -9.881 1.00 23.41 O ATOM 287 CB LYS A 20 5.231 3.415 -7.942 1.00 74.32 C ATOM 288 CG LYS A 20 3.807 3.700 -8.493 1.00 4.51 C ATOM 289 CD LYS A 20 3.776 3.823 -10.024 1.00 63.41 C ATOM 290 CE LYS A 20 2.385 4.138 -10.538 1.00 1.21 C ATOM 291 NZ LYS A 20 2.362 4.268 -12.011 1.00 23.32 N ATOM 0 H LYS A 20 7.552 2.873 -7.407 1.00 14.11 H new ATOM 0 HA LYS A 20 5.212 1.291 -7.503 1.00 5.35 H new ATOM 0 HB2 LYS A 20 5.230 3.653 -6.878 1.00 74.32 H new ATOM 0 HB3 LYS A 20 5.920 4.110 -8.423 1.00 74.32 H new ATOM 0 HG2 LYS A 20 3.135 2.899 -8.184 1.00 4.51 H new ATOM 0 HG3 LYS A 20 3.429 4.622 -8.051 1.00 4.51 H new ATOM 0 HD2 LYS A 20 4.465 4.606 -10.339 1.00 63.41 H new ATOM 0 HD3 LYS A 20 4.126 2.892 -10.470 1.00 63.41 H new ATOM 0 HE2 LYS A 20 1.697 3.350 -10.232 1.00 1.21 H new ATOM 0 HE3 LYS A 20 2.031 5.064 -10.085 1.00 1.21 H new ATOM 0 HZ1 LYS A 20 1.398 4.094 -12.360 1.00 23.32 H new ATOM 0 HZ2 LYS A 20 2.659 5.228 -12.279 1.00 23.32 H new ATOM 0 HZ3 LYS A 20 3.013 3.574 -12.431 1.00 23.32 H new ATOM 305 N ALA A 21 6.694 1.834 -10.353 1.00 40.32 N ATOM 306 CA ALA A 21 6.697 1.505 -11.776 1.00 12.52 C ATOM 307 C ALA A 21 6.970 0.034 -11.982 1.00 32.44 C ATOM 308 O ALA A 21 6.290 -0.632 -12.761 1.00 30.41 O ATOM 309 CB ALA A 21 7.738 2.337 -12.502 1.00 71.13 C ATOM 0 H ALA A 21 7.505 2.374 -10.049 1.00 40.32 H new ATOM 0 HA ALA A 21 5.713 1.733 -12.185 1.00 12.52 H new ATOM 0 HB1 ALA A 21 7.732 2.084 -13.562 1.00 71.13 H new ATOM 0 HB2 ALA A 21 7.507 3.395 -12.381 1.00 71.13 H new ATOM 0 HB3 ALA A 21 8.724 2.130 -12.086 1.00 71.13 H new ATOM 315 N GLN A 22 7.963 -0.467 -11.259 1.00 12.22 N ATOM 316 CA GLN A 22 8.360 -1.873 -11.316 1.00 34.50 C ATOM 317 C GLN A 22 7.185 -2.747 -10.977 1.00 31.50 C ATOM 318 O GLN A 22 6.875 -3.724 -11.660 1.00 63.23 O ATOM 319 CB GLN A 22 9.418 -2.153 -10.260 1.00 33.04 C ATOM 320 CG GLN A 22 10.660 -1.317 -10.349 1.00 1.22 C ATOM 321 CD GLN A 22 11.631 -1.617 -9.229 1.00 44.34 C ATOM 322 OE1 GLN A 22 11.110 -1.977 -8.081 1.00 51.24 O flip ATOM 323 NE2 GLN A 22 12.835 -1.504 -9.391 1.00 10.43 N flip ATOM 0 H GLN A 22 8.520 0.091 -10.612 1.00 12.22 H new ATOM 0 HA GLN A 22 8.734 -2.078 -12.319 1.00 34.50 H new ATOM 0 HB2 GLN A 22 8.972 -2.005 -9.276 1.00 33.04 H new ATOM 0 HB3 GLN A 22 9.703 -3.203 -10.326 1.00 33.04 H new ATOM 0 HG2 GLN A 22 11.148 -1.494 -11.308 1.00 1.22 H new ATOM 0 HG3 GLN A 22 10.389 -0.262 -10.320 1.00 1.22 H new ATOM 0 HE21 GLN A 22 13.203 -1.222 -10.299 1.00 10.43 H new ATOM 0 HE22 GLN A 22 13.473 -1.692 -8.618 1.00 10.43 H new ATOM 332 N GLN A 23 6.529 -2.383 -9.917 1.00 63.00 N ATOM 333 CA GLN A 23 5.478 -3.171 -9.399 1.00 14.15 C ATOM 334 C GLN A 23 4.184 -2.959 -10.085 1.00 1.12 C ATOM 335 O GLN A 23 3.359 -3.819 -10.039 1.00 11.41 O ATOM 336 CB GLN A 23 5.357 -2.996 -7.931 1.00 4.11 C ATOM 337 CG GLN A 23 6.613 -3.408 -7.230 1.00 30.22 C ATOM 338 CD GLN A 23 6.513 -3.327 -5.779 1.00 70.11 C ATOM 339 OE1 GLN A 23 5.790 -2.407 -5.327 1.00 44.34 O flip ATOM 340 NE2 GLN A 23 7.124 -4.089 -5.068 1.00 53.14 N flip ATOM 0 H GLN A 23 6.716 -1.528 -9.394 1.00 63.00 H new ATOM 0 HA GLN A 23 5.746 -4.208 -9.601 1.00 14.15 H new ATOM 0 HB2 GLN A 23 5.136 -1.953 -7.704 1.00 4.11 H new ATOM 0 HB3 GLN A 23 4.520 -3.587 -7.560 1.00 4.11 H new ATOM 0 HG2 GLN A 23 6.861 -4.431 -7.514 1.00 30.22 H new ATOM 0 HG3 GLN A 23 7.434 -2.775 -7.567 1.00 30.22 H new ATOM 0 HE21 GLN A 23 7.700 -4.822 -5.482 1.00 53.14 H new ATOM 0 HE22 GLN A 23 7.064 -3.999 -4.054 1.00 53.14 H new ATOM 349 N GLU A 24 4.007 -1.825 -10.724 1.00 51.04 N ATOM 350 CA GLU A 24 2.795 -1.561 -11.491 1.00 63.20 C ATOM 351 C GLU A 24 2.627 -2.610 -12.572 1.00 12.21 C ATOM 352 O GLU A 24 1.512 -3.052 -12.865 1.00 4.20 O ATOM 353 CB GLU A 24 2.830 -0.157 -12.058 1.00 32.40 C ATOM 354 CG GLU A 24 1.680 0.204 -12.964 1.00 30.43 C ATOM 355 CD GLU A 24 1.696 1.657 -13.285 1.00 40.31 C ATOM 356 OE1 GLU A 24 2.778 2.202 -13.584 1.00 42.43 O ATOM 357 OE2 GLU A 24 0.655 2.308 -13.146 1.00 53.12 O ATOM 0 H GLU A 24 4.686 -1.063 -10.732 1.00 51.04 H new ATOM 0 HA GLU A 24 1.927 -1.624 -10.835 1.00 63.20 H new ATOM 0 HB2 GLU A 24 2.853 0.551 -11.229 1.00 32.40 H new ATOM 0 HB3 GLU A 24 3.760 -0.030 -12.612 1.00 32.40 H new ATOM 0 HG2 GLU A 24 1.740 -0.377 -13.884 1.00 30.43 H new ATOM 0 HG3 GLU A 24 0.737 -0.056 -12.483 1.00 30.43 H new ATOM 364 N GLU A 25 3.748 -3.037 -13.121 1.00 24.41 N ATOM 365 CA GLU A 25 3.773 -4.112 -14.076 1.00 62.42 C ATOM 366 C GLU A 25 3.214 -5.387 -13.449 1.00 4.13 C ATOM 367 O GLU A 25 2.401 -6.076 -14.049 1.00 41.40 O ATOM 368 CB GLU A 25 5.200 -4.347 -14.563 1.00 34.34 C ATOM 369 CG GLU A 25 5.788 -3.184 -15.338 1.00 45.43 C ATOM 370 CD GLU A 25 5.008 -2.906 -16.594 1.00 12.41 C ATOM 371 OE1 GLU A 25 5.285 -3.548 -17.637 1.00 73.41 O ATOM 372 OE2 GLU A 25 4.109 -2.060 -16.577 1.00 13.21 O ATOM 0 H GLU A 25 4.665 -2.643 -12.912 1.00 24.41 H new ATOM 0 HA GLU A 25 3.151 -3.839 -14.928 1.00 62.42 H new ATOM 0 HB2 GLU A 25 5.836 -4.556 -13.703 1.00 34.34 H new ATOM 0 HB3 GLU A 25 5.216 -5.236 -15.194 1.00 34.34 H new ATOM 0 HG2 GLU A 25 5.796 -2.294 -14.709 1.00 45.43 H new ATOM 0 HG3 GLU A 25 6.825 -3.403 -15.594 1.00 45.43 H new ATOM 379 N ARG A 26 3.638 -5.675 -12.229 1.00 64.05 N ATOM 380 CA ARG A 26 3.206 -6.883 -11.533 1.00 62.41 C ATOM 381 C ARG A 26 1.772 -6.730 -11.008 1.00 35.31 C ATOM 382 O ARG A 26 0.989 -7.668 -11.059 1.00 23.51 O ATOM 383 CB ARG A 26 4.156 -7.233 -10.378 1.00 64.30 C ATOM 384 CG ARG A 26 5.623 -7.297 -10.779 1.00 72.21 C ATOM 385 CD ARG A 26 6.498 -7.865 -9.667 1.00 24.11 C ATOM 386 NE ARG A 26 6.339 -7.172 -8.371 1.00 64.50 N ATOM 387 CZ ARG A 26 7.234 -7.247 -7.360 1.00 54.31 C ATOM 388 NH1 ARG A 26 8.407 -7.818 -7.553 1.00 74.13 N ATOM 389 NH2 ARG A 26 6.957 -6.716 -6.175 1.00 14.43 N ATOM 0 H ARG A 26 4.282 -5.090 -11.697 1.00 64.05 H new ATOM 0 HA ARG A 26 3.229 -7.700 -12.254 1.00 62.41 H new ATOM 0 HB2 ARG A 26 4.038 -6.492 -9.587 1.00 64.30 H new ATOM 0 HB3 ARG A 26 3.862 -8.195 -9.959 1.00 64.30 H new ATOM 0 HG2 ARG A 26 5.728 -7.913 -11.672 1.00 72.21 H new ATOM 0 HG3 ARG A 26 5.971 -6.297 -11.039 1.00 72.21 H new ATOM 0 HD2 ARG A 26 6.262 -8.921 -9.535 1.00 24.11 H new ATOM 0 HD3 ARG A 26 7.542 -7.807 -9.974 1.00 24.11 H new ATOM 0 HE ARG A 26 5.504 -6.603 -8.231 1.00 64.50 H new ATOM 0 HH11 ARG A 26 8.642 -8.205 -8.467 1.00 74.13 H new ATOM 0 HH12 ARG A 26 9.080 -7.873 -6.788 1.00 74.13 H new ATOM 0 HH21 ARG A 26 6.064 -6.247 -6.022 1.00 14.43 H new ATOM 0 HH22 ARG A 26 7.637 -6.777 -5.417 1.00 14.43 H new ATOM 403 N LEU A 27 1.453 -5.533 -10.513 1.00 10.33 N ATOM 404 CA LEU A 27 0.125 -5.197 -9.983 1.00 33.42 C ATOM 405 C LEU A 27 -0.940 -5.469 -11.025 1.00 44.21 C ATOM 406 O LEU A 27 -1.921 -6.173 -10.768 1.00 52.12 O ATOM 407 CB LEU A 27 0.072 -3.702 -9.552 1.00 14.23 C ATOM 408 CG LEU A 27 0.952 -3.271 -8.349 1.00 53.24 C ATOM 409 CD1 LEU A 27 0.849 -1.775 -8.132 1.00 31.43 C ATOM 410 CD2 LEU A 27 0.477 -3.968 -7.118 1.00 61.12 C ATOM 0 H LEU A 27 2.115 -4.759 -10.467 1.00 10.33 H new ATOM 0 HA LEU A 27 -0.064 -5.821 -9.110 1.00 33.42 H new ATOM 0 HB2 LEU A 27 0.356 -3.094 -10.411 1.00 14.23 H new ATOM 0 HB3 LEU A 27 -0.963 -3.457 -9.316 1.00 14.23 H new ATOM 0 HG LEU A 27 1.989 -3.535 -8.559 1.00 53.24 H new ATOM 0 HD11 LEU A 27 1.471 -1.487 -7.285 1.00 31.43 H new ATOM 0 HD12 LEU A 27 1.189 -1.253 -9.027 1.00 31.43 H new ATOM 0 HD13 LEU A 27 -0.188 -1.507 -7.928 1.00 31.43 H new ATOM 0 HD21 LEU A 27 1.092 -3.668 -6.270 1.00 61.12 H new ATOM 0 HD22 LEU A 27 -0.562 -3.699 -6.926 1.00 61.12 H new ATOM 0 HD23 LEU A 27 0.553 -5.046 -7.258 1.00 61.12 H new ATOM 422 N ASP A 28 -0.706 -4.942 -12.216 1.00 52.23 N ATOM 423 CA ASP A 28 -1.624 -5.093 -13.341 1.00 42.44 C ATOM 424 C ASP A 28 -1.804 -6.579 -13.706 1.00 43.35 C ATOM 425 O ASP A 28 -2.889 -7.001 -14.120 1.00 22.15 O ATOM 426 CB ASP A 28 -1.109 -4.265 -14.539 1.00 33.03 C ATOM 427 CG ASP A 28 -1.999 -4.315 -15.767 1.00 14.35 C ATOM 428 OD1 ASP A 28 -3.117 -3.757 -15.735 1.00 63.20 O ATOM 429 OD2 ASP A 28 -1.584 -4.897 -16.789 1.00 11.41 O ATOM 0 H ASP A 28 0.127 -4.395 -12.434 1.00 52.23 H new ATOM 0 HA ASP A 28 -2.607 -4.715 -13.060 1.00 42.44 H new ATOM 0 HB2 ASP A 28 -1.000 -3.226 -14.227 1.00 33.03 H new ATOM 0 HB3 ASP A 28 -0.116 -4.622 -14.811 1.00 33.03 H new ATOM 434 N GLU A 29 -0.750 -7.373 -13.491 1.00 21.32 N ATOM 435 CA GLU A 29 -0.780 -8.819 -13.777 1.00 62.42 C ATOM 436 C GLU A 29 -1.593 -9.579 -12.742 1.00 23.42 C ATOM 437 O GLU A 29 -2.338 -10.501 -13.077 1.00 53.53 O ATOM 438 CB GLU A 29 0.626 -9.413 -13.860 1.00 54.22 C ATOM 439 CG GLU A 29 1.483 -8.867 -14.982 1.00 40.30 C ATOM 440 CD GLU A 29 0.908 -9.119 -16.355 1.00 64.22 C ATOM 441 OE1 GLU A 29 0.961 -10.264 -16.828 1.00 51.23 O ATOM 442 OE2 GLU A 29 0.426 -8.166 -16.995 1.00 71.24 O ATOM 0 H GLU A 29 0.140 -7.041 -13.119 1.00 21.32 H new ATOM 0 HA GLU A 29 -1.260 -8.928 -14.749 1.00 62.42 H new ATOM 0 HB2 GLU A 29 1.136 -9.235 -12.913 1.00 54.22 H new ATOM 0 HB3 GLU A 29 0.542 -10.493 -13.979 1.00 54.22 H new ATOM 0 HG2 GLU A 29 1.611 -7.794 -14.842 1.00 40.30 H new ATOM 0 HG3 GLU A 29 2.474 -9.317 -14.924 1.00 40.30 H new ATOM 449 N ILE A 30 -1.445 -9.200 -11.483 1.00 34.12 N ATOM 450 CA ILE A 30 -2.152 -9.866 -10.399 1.00 3.32 C ATOM 451 C ILE A 30 -3.664 -9.680 -10.552 1.00 65.45 C ATOM 452 O ILE A 30 -4.444 -10.612 -10.315 1.00 60.34 O ATOM 453 CB ILE A 30 -1.651 -9.404 -8.999 1.00 62.34 C ATOM 454 CG1 ILE A 30 -0.142 -9.670 -8.875 1.00 10.13 C ATOM 455 CG2 ILE A 30 -2.395 -10.148 -7.901 1.00 21.20 C ATOM 456 CD1 ILE A 30 0.478 -9.199 -7.573 1.00 74.14 C ATOM 0 H ILE A 30 -0.841 -8.434 -11.185 1.00 34.12 H new ATOM 0 HA ILE A 30 -1.933 -10.932 -10.465 1.00 3.32 H new ATOM 0 HB ILE A 30 -1.841 -8.336 -8.892 1.00 62.34 H new ATOM 0 HG12 ILE A 30 0.035 -10.740 -8.980 1.00 10.13 H new ATOM 0 HG13 ILE A 30 0.369 -9.180 -9.704 1.00 10.13 H new ATOM 0 HG21 ILE A 30 -2.035 -9.815 -6.928 1.00 21.20 H new ATOM 0 HG22 ILE A 30 -3.463 -9.944 -7.982 1.00 21.20 H new ATOM 0 HG23 ILE A 30 -2.222 -11.219 -8.005 1.00 21.20 H new ATOM 0 HD11 ILE A 30 1.544 -9.428 -7.574 1.00 74.14 H new ATOM 0 HD12 ILE A 30 0.338 -8.123 -7.472 1.00 74.14 H new ATOM 0 HD13 ILE A 30 -0.002 -9.708 -6.737 1.00 74.14 H new ATOM 468 N ASN A 31 -4.064 -8.493 -10.990 1.00 22.43 N ATOM 469 CA ASN A 31 -5.477 -8.206 -11.284 1.00 5.12 C ATOM 470 C ASN A 31 -6.024 -9.164 -12.302 1.00 42.13 C ATOM 471 O ASN A 31 -7.085 -9.734 -12.107 1.00 22.31 O ATOM 472 CB ASN A 31 -5.669 -6.773 -11.777 1.00 43.41 C ATOM 473 CG ASN A 31 -5.578 -5.755 -10.679 1.00 13.30 C ATOM 474 OD1 ASN A 31 -4.930 -5.971 -9.684 1.00 32.23 O ATOM 475 ND2 ASN A 31 -6.223 -4.635 -10.862 1.00 3.40 N ATOM 0 H ASN A 31 -3.434 -7.707 -11.152 1.00 22.43 H new ATOM 0 HA ASN A 31 -6.025 -8.328 -10.350 1.00 5.12 H new ATOM 0 HB2 ASN A 31 -4.916 -6.551 -12.533 1.00 43.41 H new ATOM 0 HB3 ASN A 31 -6.642 -6.689 -12.262 1.00 43.41 H new ATOM 0 HD21 ASN A 31 -6.190 -3.905 -10.150 1.00 3.40 H new ATOM 0 HD22 ASN A 31 -6.760 -4.490 -11.717 1.00 3.40 H new ATOM 482 N LYS A 32 -5.271 -9.366 -13.373 1.00 60.12 N ATOM 483 CA LYS A 32 -5.670 -10.259 -14.462 1.00 72.20 C ATOM 484 C LYS A 32 -5.901 -11.668 -13.947 1.00 74.33 C ATOM 485 O LYS A 32 -6.865 -12.311 -14.320 1.00 3.34 O ATOM 486 CB LYS A 32 -4.598 -10.268 -15.548 1.00 20.03 C ATOM 487 CG LYS A 32 -4.346 -8.904 -16.139 1.00 51.30 C ATOM 488 CD LYS A 32 -3.176 -8.909 -17.095 1.00 32.41 C ATOM 489 CE LYS A 32 -2.894 -7.507 -17.579 1.00 75.55 C ATOM 490 NZ LYS A 32 -1.690 -7.434 -18.422 1.00 42.13 N ATOM 0 H LYS A 32 -4.366 -8.918 -13.516 1.00 60.12 H new ATOM 0 HA LYS A 32 -6.605 -9.891 -14.884 1.00 72.20 H new ATOM 0 HB2 LYS A 32 -3.668 -10.654 -15.130 1.00 20.03 H new ATOM 0 HB3 LYS A 32 -4.899 -10.952 -16.342 1.00 20.03 H new ATOM 0 HG2 LYS A 32 -5.240 -8.565 -16.662 1.00 51.30 H new ATOM 0 HG3 LYS A 32 -4.156 -8.191 -15.337 1.00 51.30 H new ATOM 0 HD2 LYS A 32 -2.294 -9.315 -16.600 1.00 32.41 H new ATOM 0 HD3 LYS A 32 -3.393 -9.558 -17.943 1.00 32.41 H new ATOM 0 HE2 LYS A 32 -3.752 -7.141 -18.144 1.00 75.55 H new ATOM 0 HE3 LYS A 32 -2.773 -6.847 -16.720 1.00 75.55 H new ATOM 0 HZ1 LYS A 32 -1.443 -6.438 -18.589 1.00 42.13 H new ATOM 0 HZ2 LYS A 32 -0.900 -7.911 -17.942 1.00 42.13 H new ATOM 0 HZ3 LYS A 32 -1.875 -7.902 -19.332 1.00 42.13 H new ATOM 504 N GLN A 33 -5.026 -12.115 -13.068 1.00 64.10 N ATOM 505 CA GLN A 33 -5.122 -13.442 -12.475 1.00 41.43 C ATOM 506 C GLN A 33 -6.441 -13.643 -11.720 1.00 5.20 C ATOM 507 O GLN A 33 -7.143 -14.632 -11.946 1.00 13.25 O ATOM 508 CB GLN A 33 -3.911 -13.696 -11.574 1.00 13.41 C ATOM 509 CG GLN A 33 -2.619 -13.857 -12.354 1.00 24.24 C ATOM 510 CD GLN A 33 -1.379 -13.881 -11.492 1.00 23.12 C ATOM 511 OE1 GLN A 33 -0.757 -12.736 -11.344 1.00 43.23 O flip ATOM 512 NE2 GLN A 33 -0.958 -14.934 -11.005 1.00 71.15 N flip ATOM 0 H GLN A 33 -4.227 -11.571 -12.742 1.00 64.10 H new ATOM 0 HA GLN A 33 -5.118 -14.176 -13.281 1.00 41.43 H new ATOM 0 HB2 GLN A 33 -3.806 -12.868 -10.873 1.00 13.41 H new ATOM 0 HB3 GLN A 33 -4.087 -14.594 -10.982 1.00 13.41 H new ATOM 0 HG2 GLN A 33 -2.667 -14.782 -12.929 1.00 24.24 H new ATOM 0 HG3 GLN A 33 -2.535 -13.040 -13.070 1.00 24.24 H new ATOM 0 HE21 GLN A 33 -1.474 -15.803 -11.145 1.00 71.15 H new ATOM 0 HE22 GLN A 33 -0.094 -14.936 -10.463 1.00 71.15 H new ATOM 521 N PHE A 34 -6.782 -12.703 -10.850 1.00 74.33 N ATOM 522 CA PHE A 34 -8.038 -12.788 -10.096 1.00 14.33 C ATOM 523 C PHE A 34 -9.269 -12.500 -10.956 1.00 21.00 C ATOM 524 O PHE A 34 -10.322 -13.087 -10.755 1.00 54.24 O ATOM 525 CB PHE A 34 -8.017 -11.916 -8.838 1.00 32.31 C ATOM 526 CG PHE A 34 -7.058 -12.400 -7.782 1.00 33.14 C ATOM 527 CD1 PHE A 34 -7.433 -13.405 -6.906 1.00 1.52 C ATOM 528 CD2 PHE A 34 -5.793 -11.859 -7.662 1.00 42.52 C ATOM 529 CE1 PHE A 34 -6.567 -13.860 -5.935 1.00 24.35 C ATOM 530 CE2 PHE A 34 -4.920 -12.310 -6.690 1.00 33.32 C ATOM 531 CZ PHE A 34 -5.309 -13.311 -5.825 1.00 14.10 C ATOM 0 H PHE A 34 -6.218 -11.878 -10.646 1.00 74.33 H new ATOM 0 HA PHE A 34 -8.120 -13.826 -9.772 1.00 14.33 H new ATOM 0 HB2 PHE A 34 -7.751 -10.897 -9.118 1.00 32.31 H new ATOM 0 HB3 PHE A 34 -9.021 -11.879 -8.415 1.00 32.31 H new ATOM 0 HD1 PHE A 34 -8.419 -13.839 -6.985 1.00 1.52 H new ATOM 0 HD2 PHE A 34 -5.482 -11.074 -8.336 1.00 42.52 H new ATOM 0 HE1 PHE A 34 -6.875 -14.646 -5.261 1.00 24.35 H new ATOM 0 HE2 PHE A 34 -3.933 -11.879 -6.608 1.00 33.32 H new ATOM 0 HZ PHE A 34 -4.629 -13.663 -5.064 1.00 14.10 H new ATOM 541 N LEU A 35 -9.119 -11.595 -11.903 1.00 33.42 N ATOM 542 CA LEU A 35 -10.199 -11.216 -12.815 1.00 73.15 C ATOM 543 C LEU A 35 -10.584 -12.373 -13.721 1.00 54.12 C ATOM 544 O LEU A 35 -11.760 -12.657 -13.926 1.00 20.00 O ATOM 545 CB LEU A 35 -9.742 -10.068 -13.691 1.00 44.22 C ATOM 546 CG LEU A 35 -10.721 -9.602 -14.756 1.00 61.24 C ATOM 547 CD1 LEU A 35 -11.918 -8.887 -14.154 1.00 54.45 C ATOM 548 CD2 LEU A 35 -10.012 -8.764 -15.772 1.00 12.40 C ATOM 0 H LEU A 35 -8.245 -11.096 -12.068 1.00 33.42 H new ATOM 0 HA LEU A 35 -11.060 -10.928 -12.211 1.00 73.15 H new ATOM 0 HB2 LEU A 35 -9.507 -9.220 -13.048 1.00 44.22 H new ATOM 0 HB3 LEU A 35 -8.815 -10.362 -14.183 1.00 44.22 H new ATOM 0 HG LEU A 35 -11.121 -10.480 -15.263 1.00 61.24 H new ATOM 0 HD11 LEU A 35 -12.592 -8.571 -14.951 1.00 54.45 H new ATOM 0 HD12 LEU A 35 -12.445 -9.563 -13.480 1.00 54.45 H new ATOM 0 HD13 LEU A 35 -11.578 -8.013 -13.598 1.00 54.45 H new ATOM 0 HD21 LEU A 35 -10.721 -8.435 -16.531 1.00 12.40 H new ATOM 0 HD22 LEU A 35 -9.573 -7.894 -15.284 1.00 12.40 H new ATOM 0 HD23 LEU A 35 -9.224 -9.352 -16.243 1.00 12.40 H new ATOM 560 N ASP A 36 -9.576 -13.018 -14.266 1.00 43.31 N ATOM 561 CA ASP A 36 -9.755 -14.130 -15.193 1.00 31.03 C ATOM 562 C ASP A 36 -10.318 -15.349 -14.484 1.00 42.14 C ATOM 563 O ASP A 36 -10.887 -16.249 -15.123 1.00 2.34 O ATOM 564 CB ASP A 36 -8.416 -14.455 -15.880 1.00 1.14 C ATOM 565 CG ASP A 36 -8.481 -15.608 -16.856 1.00 13.43 C ATOM 566 OD1 ASP A 36 -8.983 -15.413 -17.991 1.00 41.03 O ATOM 567 OD2 ASP A 36 -7.990 -16.703 -16.528 1.00 3.45 O ATOM 0 H ASP A 36 -8.599 -12.789 -14.081 1.00 43.31 H new ATOM 0 HA ASP A 36 -10.477 -13.838 -15.955 1.00 31.03 H new ATOM 0 HB2 ASP A 36 -8.067 -13.567 -16.407 1.00 1.14 H new ATOM 0 HB3 ASP A 36 -7.674 -14.684 -15.115 1.00 1.14 H new ATOM 572 N ASP A 37 -10.198 -15.357 -13.161 1.00 52.52 N ATOM 573 CA ASP A 37 -10.698 -16.467 -12.367 1.00 12.22 C ATOM 574 C ASP A 37 -12.220 -16.506 -12.431 1.00 73.32 C ATOM 575 O ASP A 37 -12.895 -15.509 -12.140 1.00 12.11 O ATOM 576 CB ASP A 37 -10.234 -16.370 -10.923 1.00 24.32 C ATOM 577 CG ASP A 37 -10.795 -17.484 -10.069 1.00 23.41 C ATOM 578 OD1 ASP A 37 -11.960 -17.381 -9.644 1.00 0.21 O ATOM 579 OD2 ASP A 37 -10.058 -18.484 -9.803 1.00 4.35 O ATOM 0 H ASP A 37 -9.761 -14.611 -12.621 1.00 52.52 H new ATOM 0 HA ASP A 37 -10.296 -17.390 -12.784 1.00 12.22 H new ATOM 0 HB2 ASP A 37 -9.145 -16.402 -10.890 1.00 24.32 H new ATOM 0 HB3 ASP A 37 -10.538 -15.408 -10.509 1.00 24.32 H new ATOM 584 N PRO A 38 -12.786 -17.654 -12.801 1.00 54.14 N ATOM 585 CA PRO A 38 -14.217 -17.789 -13.025 1.00 43.01 C ATOM 586 C PRO A 38 -15.115 -17.637 -11.794 1.00 73.30 C ATOM 587 O PRO A 38 -16.330 -17.474 -11.950 1.00 2.43 O ATOM 588 CB PRO A 38 -14.366 -19.168 -13.631 1.00 74.13 C ATOM 589 CG PRO A 38 -13.179 -19.924 -13.152 1.00 53.03 C ATOM 590 CD PRO A 38 -12.069 -18.922 -13.053 1.00 43.35 C ATOM 0 HA PRO A 38 -14.557 -16.971 -13.660 1.00 43.01 H new ATOM 0 HB2 PRO A 38 -15.293 -19.643 -13.310 1.00 74.13 H new ATOM 0 HB3 PRO A 38 -14.392 -19.121 -14.720 1.00 74.13 H new ATOM 0 HG2 PRO A 38 -13.375 -20.387 -12.185 1.00 53.03 H new ATOM 0 HG3 PRO A 38 -12.921 -20.726 -13.844 1.00 53.03 H new ATOM 0 HD2 PRO A 38 -11.379 -19.163 -12.244 1.00 43.35 H new ATOM 0 HD3 PRO A 38 -11.482 -18.878 -13.970 1.00 43.35 H new ATOM 598 N LYS A 39 -14.576 -17.688 -10.579 1.00 51.40 N ATOM 599 CA LYS A 39 -15.461 -17.508 -9.439 1.00 24.54 C ATOM 600 C LYS A 39 -15.701 -16.050 -9.235 1.00 22.51 C ATOM 601 O LYS A 39 -16.845 -15.605 -9.060 1.00 14.33 O ATOM 602 CB LYS A 39 -14.962 -18.106 -8.108 1.00 5.34 C ATOM 603 CG LYS A 39 -14.674 -19.603 -8.087 1.00 23.54 C ATOM 604 CD LYS A 39 -13.238 -19.917 -8.469 1.00 41.15 C ATOM 605 CE LYS A 39 -12.245 -19.377 -7.409 1.00 74.52 C ATOM 606 NZ LYS A 39 -12.471 -19.983 -6.079 1.00 53.41 N ATOM 0 H LYS A 39 -13.591 -17.843 -10.366 1.00 51.40 H new ATOM 0 HA LYS A 39 -16.368 -18.056 -9.693 1.00 24.54 H new ATOM 0 HB2 LYS A 39 -14.050 -17.582 -7.822 1.00 5.34 H new ATOM 0 HB3 LYS A 39 -15.706 -17.893 -7.341 1.00 5.34 H new ATOM 0 HG2 LYS A 39 -14.877 -19.996 -7.091 1.00 23.54 H new ATOM 0 HG3 LYS A 39 -15.350 -20.111 -8.775 1.00 23.54 H new ATOM 0 HD2 LYS A 39 -13.114 -20.995 -8.572 1.00 41.15 H new ATOM 0 HD3 LYS A 39 -13.013 -19.476 -9.440 1.00 41.15 H new ATOM 0 HE2 LYS A 39 -11.224 -19.581 -7.732 1.00 74.52 H new ATOM 0 HE3 LYS A 39 -12.346 -18.294 -7.336 1.00 74.52 H new ATOM 0 HZ1 LYS A 39 -11.649 -19.799 -5.469 1.00 53.41 H new ATOM 0 HZ2 LYS A 39 -13.321 -19.567 -5.648 1.00 53.41 H new ATOM 0 HZ3 LYS A 39 -12.602 -21.009 -6.183 1.00 53.41 H new ATOM 620 N TYR A 40 -14.629 -15.301 -9.298 1.00 51.51 N ATOM 621 CA TYR A 40 -14.682 -13.892 -9.045 1.00 44.14 C ATOM 622 C TYR A 40 -15.261 -13.153 -10.228 1.00 42.54 C ATOM 623 O TYR A 40 -16.022 -12.212 -10.055 1.00 61.10 O ATOM 624 CB TYR A 40 -13.297 -13.344 -8.732 1.00 51.42 C ATOM 625 CG TYR A 40 -12.575 -14.063 -7.625 1.00 51.32 C ATOM 626 CD1 TYR A 40 -13.107 -14.144 -6.347 1.00 44.22 C ATOM 627 CD2 TYR A 40 -11.349 -14.644 -7.861 1.00 12.04 C ATOM 628 CE1 TYR A 40 -12.428 -14.792 -5.336 1.00 62.54 C ATOM 629 CE2 TYR A 40 -10.659 -15.294 -6.874 1.00 23.23 C ATOM 630 CZ TYR A 40 -11.203 -15.368 -5.598 1.00 23.53 C ATOM 631 OH TYR A 40 -10.519 -16.009 -4.577 1.00 53.45 O ATOM 0 H TYR A 40 -13.700 -15.654 -9.526 1.00 51.51 H new ATOM 0 HA TYR A 40 -15.328 -13.738 -8.181 1.00 44.14 H new ATOM 0 HB2 TYR A 40 -12.689 -13.391 -9.635 1.00 51.42 H new ATOM 0 HB3 TYR A 40 -13.389 -12.291 -8.465 1.00 51.42 H new ATOM 0 HD1 TYR A 40 -14.066 -13.693 -6.140 1.00 44.22 H new ATOM 0 HD2 TYR A 40 -10.921 -14.585 -8.851 1.00 12.04 H new ATOM 0 HE1 TYR A 40 -12.854 -14.848 -4.345 1.00 62.54 H new ATOM 0 HE2 TYR A 40 -9.701 -15.745 -7.085 1.00 23.23 H new ATOM 0 HH TYR A 40 -9.673 -16.363 -4.922 1.00 53.45 H new ATOM 641 N SER A 41 -14.947 -13.623 -11.435 1.00 3.21 N ATOM 642 CA SER A 41 -15.359 -12.944 -12.669 1.00 40.31 C ATOM 643 C SER A 41 -16.883 -12.803 -12.771 1.00 74.13 C ATOM 644 O SER A 41 -17.391 -11.929 -13.471 1.00 30.02 O ATOM 645 CB SER A 41 -14.805 -13.693 -13.892 1.00 11.45 C ATOM 646 OG SER A 41 -15.150 -13.052 -15.115 1.00 53.01 O ATOM 0 H SER A 41 -14.407 -14.475 -11.587 1.00 3.21 H new ATOM 0 HA SER A 41 -14.945 -11.936 -12.644 1.00 40.31 H new ATOM 0 HB2 SER A 41 -13.720 -13.762 -13.813 1.00 11.45 H new ATOM 0 HB3 SER A 41 -15.190 -14.713 -13.897 1.00 11.45 H new ATOM 0 HG SER A 41 -14.778 -13.559 -15.866 1.00 53.01 H new ATOM 652 N SER A 42 -17.597 -13.622 -12.042 1.00 54.15 N ATOM 653 CA SER A 42 -19.019 -13.630 -12.116 1.00 40.30 C ATOM 654 C SER A 42 -19.656 -12.581 -11.171 1.00 74.44 C ATOM 655 O SER A 42 -20.880 -12.496 -11.092 1.00 15.22 O ATOM 656 CB SER A 42 -19.537 -15.048 -11.806 1.00 1.24 C ATOM 657 OG SER A 42 -20.943 -15.166 -12.015 1.00 21.42 O ATOM 0 H SER A 42 -17.203 -14.296 -11.386 1.00 54.15 H new ATOM 0 HA SER A 42 -19.314 -13.352 -13.128 1.00 40.30 H new ATOM 0 HB2 SER A 42 -19.016 -15.769 -12.436 1.00 1.24 H new ATOM 0 HB3 SER A 42 -19.303 -15.300 -10.772 1.00 1.24 H new ATOM 0 HG SER A 42 -21.390 -14.352 -11.702 1.00 21.42 H new ATOM 663 N ASP A 43 -18.845 -11.779 -10.466 1.00 15.14 N ATOM 664 CA ASP A 43 -19.413 -10.780 -9.578 1.00 34.23 C ATOM 665 C ASP A 43 -19.596 -9.469 -10.333 1.00 22.15 C ATOM 666 O ASP A 43 -18.761 -9.099 -11.169 1.00 0.23 O ATOM 667 CB ASP A 43 -18.547 -10.585 -8.336 1.00 4.34 C ATOM 668 CG ASP A 43 -19.100 -9.540 -7.388 1.00 23.25 C ATOM 669 OD1 ASP A 43 -18.830 -8.347 -7.577 1.00 44.25 O ATOM 670 OD2 ASP A 43 -19.837 -9.906 -6.447 1.00 14.24 O ATOM 0 H ASP A 43 -17.826 -11.806 -10.497 1.00 15.14 H new ATOM 0 HA ASP A 43 -20.388 -11.129 -9.237 1.00 34.23 H new ATOM 0 HB2 ASP A 43 -18.458 -11.535 -7.809 1.00 4.34 H new ATOM 0 HB3 ASP A 43 -17.542 -10.295 -8.642 1.00 4.34 H new ATOM 675 N GLU A 44 -20.670 -8.776 -10.030 1.00 11.40 N ATOM 676 CA GLU A 44 -21.065 -7.557 -10.731 1.00 75.41 C ATOM 677 C GLU A 44 -20.124 -6.373 -10.505 1.00 31.32 C ATOM 678 O GLU A 44 -20.133 -5.417 -11.285 1.00 40.55 O ATOM 679 CB GLU A 44 -22.482 -7.176 -10.335 1.00 53.33 C ATOM 680 CG GLU A 44 -23.512 -8.225 -10.688 1.00 34.30 C ATOM 681 CD GLU A 44 -23.586 -8.470 -12.168 1.00 3.12 C ATOM 682 OE1 GLU A 44 -24.339 -7.758 -12.850 1.00 41.20 O ATOM 683 OE2 GLU A 44 -22.892 -9.370 -12.670 1.00 65.54 O ATOM 0 H GLU A 44 -21.309 -9.040 -9.280 1.00 11.40 H new ATOM 0 HA GLU A 44 -21.009 -7.785 -11.795 1.00 75.41 H new ATOM 0 HB2 GLU A 44 -22.514 -6.995 -9.261 1.00 53.33 H new ATOM 0 HB3 GLU A 44 -22.748 -6.239 -10.824 1.00 53.33 H new ATOM 0 HG2 GLU A 44 -23.268 -9.157 -10.179 1.00 34.30 H new ATOM 0 HG3 GLU A 44 -24.490 -7.909 -10.324 1.00 34.30 H new ATOM 690 N ASP A 45 -19.322 -6.422 -9.466 1.00 2.23 N ATOM 691 CA ASP A 45 -18.431 -5.309 -9.170 1.00 20.24 C ATOM 692 C ASP A 45 -16.988 -5.739 -9.218 1.00 31.13 C ATOM 693 O ASP A 45 -16.097 -4.913 -9.067 1.00 44.35 O ATOM 694 CB ASP A 45 -18.721 -4.703 -7.786 1.00 44.31 C ATOM 695 CG ASP A 45 -20.098 -4.093 -7.640 1.00 21.04 C ATOM 696 OD1 ASP A 45 -21.049 -4.818 -7.265 1.00 53.21 O ATOM 697 OD2 ASP A 45 -20.246 -2.871 -7.856 1.00 71.32 O ATOM 0 H ASP A 45 -19.263 -7.206 -8.816 1.00 2.23 H new ATOM 0 HA ASP A 45 -18.612 -4.554 -9.935 1.00 20.24 H new ATOM 0 HB2 ASP A 45 -18.601 -5.480 -7.031 1.00 44.31 H new ATOM 0 HB3 ASP A 45 -17.975 -3.937 -7.576 1.00 44.31 H new ATOM 702 N LEU A 46 -16.757 -7.024 -9.452 1.00 74.23 N ATOM 703 CA LEU A 46 -15.408 -7.605 -9.429 1.00 53.31 C ATOM 704 C LEU A 46 -14.382 -6.853 -10.300 1.00 21.12 C ATOM 705 O LEU A 46 -13.341 -6.439 -9.783 1.00 72.21 O ATOM 706 CB LEU A 46 -15.451 -9.118 -9.701 1.00 63.15 C ATOM 707 CG LEU A 46 -14.143 -9.956 -9.620 1.00 74.54 C ATOM 708 CD1 LEU A 46 -13.208 -9.727 -10.789 1.00 14.53 C ATOM 709 CD2 LEU A 46 -13.432 -9.723 -8.290 1.00 43.31 C ATOM 0 H LEU A 46 -17.493 -7.697 -9.663 1.00 74.23 H new ATOM 0 HA LEU A 46 -15.032 -7.470 -8.415 1.00 53.31 H new ATOM 0 HB2 LEU A 46 -16.161 -9.555 -8.998 1.00 63.15 H new ATOM 0 HB3 LEU A 46 -15.865 -9.257 -10.700 1.00 63.15 H new ATOM 0 HG LEU A 46 -14.444 -11.002 -9.679 1.00 74.54 H new ATOM 0 HD11 LEU A 46 -12.317 -10.343 -10.668 1.00 14.53 H new ATOM 0 HD12 LEU A 46 -13.712 -9.997 -11.717 1.00 14.53 H new ATOM 0 HD13 LEU A 46 -12.921 -8.676 -10.825 1.00 14.53 H new ATOM 0 HD21 LEU A 46 -12.520 -10.319 -8.256 1.00 43.31 H new ATOM 0 HD22 LEU A 46 -13.179 -8.667 -8.193 1.00 43.31 H new ATOM 0 HD23 LEU A 46 -14.088 -10.016 -7.470 1.00 43.31 H new ATOM 721 N PRO A 47 -14.644 -6.649 -11.624 1.00 33.14 N ATOM 722 CA PRO A 47 -13.722 -5.913 -12.504 1.00 22.23 C ATOM 723 C PRO A 47 -13.417 -4.514 -11.970 1.00 63.25 C ATOM 724 O PRO A 47 -12.319 -3.996 -12.140 1.00 70.13 O ATOM 725 CB PRO A 47 -14.487 -5.819 -13.837 1.00 4.32 C ATOM 726 CG PRO A 47 -15.898 -6.162 -13.494 1.00 24.41 C ATOM 727 CD PRO A 47 -15.816 -7.133 -12.377 1.00 1.32 C ATOM 0 HA PRO A 47 -12.756 -6.411 -12.589 1.00 22.23 H new ATOM 0 HB2 PRO A 47 -14.416 -4.818 -14.264 1.00 4.32 H new ATOM 0 HB3 PRO A 47 -14.081 -6.510 -14.576 1.00 4.32 H new ATOM 0 HG2 PRO A 47 -16.456 -5.273 -13.200 1.00 24.41 H new ATOM 0 HG3 PRO A 47 -16.415 -6.594 -14.351 1.00 24.41 H new ATOM 0 HD2 PRO A 47 -16.720 -7.130 -11.768 1.00 1.32 H new ATOM 0 HD3 PRO A 47 -15.676 -8.153 -12.735 1.00 1.32 H new ATOM 735 N SER A 48 -14.386 -3.932 -11.297 1.00 33.25 N ATOM 736 CA SER A 48 -14.244 -2.604 -10.756 1.00 32.12 C ATOM 737 C SER A 48 -13.415 -2.642 -9.465 1.00 52.30 C ATOM 738 O SER A 48 -12.656 -1.716 -9.172 1.00 34.50 O ATOM 739 CB SER A 48 -15.628 -2.016 -10.504 1.00 21.22 C ATOM 740 OG SER A 48 -16.416 -2.081 -11.692 1.00 52.03 O ATOM 0 H SER A 48 -15.290 -4.367 -11.112 1.00 33.25 H new ATOM 0 HA SER A 48 -13.717 -1.970 -11.469 1.00 32.12 H new ATOM 0 HB2 SER A 48 -16.122 -2.563 -9.701 1.00 21.22 H new ATOM 0 HB3 SER A 48 -15.537 -0.981 -10.176 1.00 21.22 H new ATOM 0 HG SER A 48 -17.303 -1.702 -11.517 1.00 52.03 H new ATOM 746 N LYS A 49 -13.553 -3.739 -8.717 1.00 13.40 N ATOM 747 CA LYS A 49 -12.825 -3.927 -7.471 1.00 73.14 C ATOM 748 C LYS A 49 -11.335 -3.961 -7.704 1.00 71.14 C ATOM 749 O LYS A 49 -10.600 -3.265 -7.029 1.00 30.00 O ATOM 750 CB LYS A 49 -13.279 -5.190 -6.717 1.00 20.04 C ATOM 751 CG LYS A 49 -14.739 -5.171 -6.282 1.00 24.41 C ATOM 752 CD LYS A 49 -15.026 -3.974 -5.403 1.00 10.14 C ATOM 753 CE LYS A 49 -16.468 -3.930 -4.952 1.00 21.25 C ATOM 754 NZ LYS A 49 -16.738 -2.743 -4.109 1.00 25.41 N ATOM 0 H LYS A 49 -14.170 -4.514 -8.960 1.00 13.40 H new ATOM 0 HA LYS A 49 -13.057 -3.067 -6.843 1.00 73.14 H new ATOM 0 HB2 LYS A 49 -13.114 -6.058 -7.355 1.00 20.04 H new ATOM 0 HB3 LYS A 49 -12.651 -5.318 -5.835 1.00 20.04 H new ATOM 0 HG2 LYS A 49 -15.384 -5.145 -7.160 1.00 24.41 H new ATOM 0 HG3 LYS A 49 -14.973 -6.088 -5.742 1.00 24.41 H new ATOM 0 HD2 LYS A 49 -14.375 -4.002 -4.530 1.00 10.14 H new ATOM 0 HD3 LYS A 49 -14.789 -3.060 -5.948 1.00 10.14 H new ATOM 0 HE2 LYS A 49 -17.122 -3.915 -5.824 1.00 21.25 H new ATOM 0 HE3 LYS A 49 -16.703 -4.836 -4.393 1.00 21.25 H new ATOM 0 HZ1 LYS A 49 -17.407 -2.998 -3.354 1.00 25.41 H new ATOM 0 HZ2 LYS A 49 -15.849 -2.409 -3.685 1.00 25.41 H new ATOM 0 HZ3 LYS A 49 -17.148 -1.988 -4.694 1.00 25.41 H new ATOM 768 N LEU A 50 -10.890 -4.762 -8.670 1.00 32.13 N ATOM 769 CA LEU A 50 -9.458 -4.833 -8.995 1.00 73.12 C ATOM 770 C LEU A 50 -8.920 -3.489 -9.424 1.00 54.32 C ATOM 771 O LEU A 50 -7.833 -3.075 -8.993 1.00 40.25 O ATOM 772 CB LEU A 50 -9.127 -5.889 -10.071 1.00 1.25 C ATOM 773 CG LEU A 50 -9.126 -7.372 -9.661 1.00 41.12 C ATOM 774 CD1 LEU A 50 -8.169 -7.624 -8.522 1.00 2.30 C ATOM 775 CD2 LEU A 50 -10.505 -7.880 -9.337 1.00 4.43 C ATOM 0 H LEU A 50 -11.486 -5.365 -9.237 1.00 32.13 H new ATOM 0 HA LEU A 50 -8.968 -5.142 -8.072 1.00 73.12 H new ATOM 0 HB2 LEU A 50 -9.842 -5.770 -10.885 1.00 1.25 H new ATOM 0 HB3 LEU A 50 -8.142 -5.655 -10.475 1.00 1.25 H new ATOM 0 HG LEU A 50 -8.778 -7.937 -10.526 1.00 41.12 H new ATOM 0 HD11 LEU A 50 -8.191 -8.681 -8.255 1.00 2.30 H new ATOM 0 HD12 LEU A 50 -7.160 -7.348 -8.827 1.00 2.30 H new ATOM 0 HD13 LEU A 50 -8.464 -7.026 -7.660 1.00 2.30 H new ATOM 0 HD21 LEU A 50 -10.448 -8.931 -9.054 1.00 4.43 H new ATOM 0 HD22 LEU A 50 -10.920 -7.303 -8.510 1.00 4.43 H new ATOM 0 HD23 LEU A 50 -11.147 -7.774 -10.212 1.00 4.43 H new ATOM 787 N GLU A 51 -9.675 -2.801 -10.251 1.00 53.50 N ATOM 788 CA GLU A 51 -9.267 -1.514 -10.744 1.00 53.40 C ATOM 789 C GLU A 51 -9.132 -0.496 -9.639 1.00 2.22 C ATOM 790 O GLU A 51 -8.061 0.069 -9.470 1.00 15.33 O ATOM 791 CB GLU A 51 -10.211 -1.027 -11.823 1.00 53.11 C ATOM 792 CG GLU A 51 -10.123 -1.827 -13.109 1.00 4.50 C ATOM 793 CD GLU A 51 -8.797 -1.635 -13.814 1.00 72.24 C ATOM 794 OE1 GLU A 51 -7.748 -2.023 -13.271 1.00 62.22 O ATOM 795 OE2 GLU A 51 -8.788 -1.057 -14.906 1.00 35.54 O ATOM 0 H GLU A 51 -10.581 -3.118 -10.596 1.00 53.50 H new ATOM 0 HA GLU A 51 -8.277 -1.636 -11.183 1.00 53.40 H new ATOM 0 HB2 GLU A 51 -11.233 -1.070 -11.447 1.00 53.11 H new ATOM 0 HB3 GLU A 51 -9.994 0.019 -12.039 1.00 53.11 H new ATOM 0 HG2 GLU A 51 -10.264 -2.885 -12.887 1.00 4.50 H new ATOM 0 HG3 GLU A 51 -10.933 -1.530 -13.775 1.00 4.50 H new ATOM 802 N GLY A 52 -10.195 -0.315 -8.857 1.00 52.12 N ATOM 803 CA GLY A 52 -10.181 0.663 -7.774 1.00 21.24 C ATOM 804 C GLY A 52 -9.133 0.337 -6.737 1.00 60.04 C ATOM 805 O GLY A 52 -8.523 1.236 -6.133 1.00 73.31 O ATOM 0 H GLY A 52 -11.070 -0.829 -8.953 1.00 52.12 H new ATOM 0 HA2 GLY A 52 -9.991 1.655 -8.183 1.00 21.24 H new ATOM 0 HA3 GLY A 52 -11.162 0.696 -7.301 1.00 21.24 H new ATOM 809 N PHE A 53 -8.913 -0.941 -6.547 1.00 64.25 N ATOM 810 CA PHE A 53 -7.939 -1.424 -5.621 1.00 61.53 C ATOM 811 C PHE A 53 -6.523 -1.064 -6.049 1.00 12.14 C ATOM 812 O PHE A 53 -5.776 -0.473 -5.263 1.00 52.02 O ATOM 813 CB PHE A 53 -8.098 -2.925 -5.411 1.00 75.51 C ATOM 814 CG PHE A 53 -7.046 -3.544 -4.569 1.00 73.53 C ATOM 815 CD1 PHE A 53 -6.901 -3.191 -3.250 1.00 35.03 C ATOM 816 CD2 PHE A 53 -6.204 -4.493 -5.100 1.00 14.45 C ATOM 817 CE1 PHE A 53 -5.930 -3.771 -2.478 1.00 51.04 C ATOM 818 CE2 PHE A 53 -5.235 -5.078 -4.330 1.00 24.23 C ATOM 819 CZ PHE A 53 -5.098 -4.721 -3.021 1.00 60.42 C ATOM 0 H PHE A 53 -9.416 -1.678 -7.041 1.00 64.25 H new ATOM 0 HA PHE A 53 -8.112 -0.929 -4.666 1.00 61.53 H new ATOM 0 HB2 PHE A 53 -9.069 -3.114 -4.954 1.00 75.51 H new ATOM 0 HB3 PHE A 53 -8.103 -3.417 -6.384 1.00 75.51 H new ATOM 0 HD1 PHE A 53 -7.558 -2.450 -2.818 1.00 35.03 H new ATOM 0 HD2 PHE A 53 -6.308 -4.780 -6.136 1.00 14.45 H new ATOM 0 HE1 PHE A 53 -5.818 -3.482 -1.443 1.00 51.04 H new ATOM 0 HE2 PHE A 53 -4.580 -5.822 -4.759 1.00 24.23 H new ATOM 0 HZ PHE A 53 -4.336 -5.184 -2.411 1.00 60.42 H new ATOM 829 N LYS A 54 -6.144 -1.403 -7.289 1.00 63.34 N ATOM 830 CA LYS A 54 -4.790 -1.104 -7.743 1.00 53.41 C ATOM 831 C LYS A 54 -4.504 0.395 -7.754 1.00 41.34 C ATOM 832 O LYS A 54 -3.368 0.804 -7.517 1.00 73.12 O ATOM 833 CB LYS A 54 -4.379 -1.846 -9.066 1.00 20.42 C ATOM 834 CG LYS A 54 -5.012 -1.438 -10.411 1.00 31.43 C ATOM 835 CD LYS A 54 -4.411 -0.146 -10.960 1.00 23.14 C ATOM 836 CE LYS A 54 -4.810 0.108 -12.411 1.00 33.32 C ATOM 837 NZ LYS A 54 -6.266 0.230 -12.590 1.00 41.12 N ATOM 0 H LYS A 54 -6.739 -1.870 -7.973 1.00 63.34 H new ATOM 0 HA LYS A 54 -4.122 -1.529 -6.994 1.00 53.41 H new ATOM 0 HB2 LYS A 54 -3.299 -1.743 -9.172 1.00 20.42 H new ATOM 0 HB3 LYS A 54 -4.585 -2.906 -8.920 1.00 20.42 H new ATOM 0 HG2 LYS A 54 -4.871 -2.240 -11.136 1.00 31.43 H new ATOM 0 HG3 LYS A 54 -6.087 -1.311 -10.282 1.00 31.43 H new ATOM 0 HD2 LYS A 54 -4.735 0.693 -10.344 1.00 23.14 H new ATOM 0 HD3 LYS A 54 -3.324 -0.194 -10.887 1.00 23.14 H new ATOM 0 HE2 LYS A 54 -4.328 1.021 -12.761 1.00 33.32 H new ATOM 0 HE3 LYS A 54 -4.439 -0.707 -13.033 1.00 33.32 H new ATOM 0 HZ1 LYS A 54 -6.466 0.708 -13.491 1.00 41.12 H new ATOM 0 HZ2 LYS A 54 -6.695 -0.717 -12.598 1.00 41.12 H new ATOM 0 HZ3 LYS A 54 -6.667 0.785 -11.807 1.00 41.12 H new ATOM 851 N GLU A 55 -5.560 1.206 -7.998 1.00 72.24 N ATOM 852 CA GLU A 55 -5.449 2.673 -7.980 1.00 41.11 C ATOM 853 C GLU A 55 -4.887 3.130 -6.633 1.00 63.30 C ATOM 854 O GLU A 55 -3.913 3.869 -6.559 1.00 60.30 O ATOM 855 CB GLU A 55 -6.838 3.324 -8.097 1.00 0.43 C ATOM 856 CG GLU A 55 -7.663 2.977 -9.307 1.00 35.43 C ATOM 857 CD GLU A 55 -7.027 3.362 -10.591 1.00 33.31 C ATOM 858 OE1 GLU A 55 -6.994 4.551 -10.901 1.00 73.33 O ATOM 859 OE2 GLU A 55 -6.593 2.474 -11.329 1.00 55.43 O ATOM 0 H GLU A 55 -6.497 0.863 -8.209 1.00 72.24 H new ATOM 0 HA GLU A 55 -4.807 2.962 -8.812 1.00 41.11 H new ATOM 0 HB2 GLU A 55 -7.412 3.057 -7.210 1.00 0.43 H new ATOM 0 HB3 GLU A 55 -6.706 4.406 -8.077 1.00 0.43 H new ATOM 0 HG2 GLU A 55 -7.851 1.903 -9.312 1.00 35.43 H new ATOM 0 HG3 GLU A 55 -8.632 3.470 -9.229 1.00 35.43 H new ATOM 866 N LYS A 56 -5.533 2.667 -5.574 1.00 51.52 N ATOM 867 CA LYS A 56 -5.178 3.044 -4.219 1.00 65.14 C ATOM 868 C LYS A 56 -3.953 2.336 -3.701 1.00 31.21 C ATOM 869 O LYS A 56 -3.136 2.948 -3.038 1.00 43.42 O ATOM 870 CB LYS A 56 -6.337 2.816 -3.232 1.00 5.24 C ATOM 871 CG LYS A 56 -7.470 3.882 -3.122 1.00 12.01 C ATOM 872 CD LYS A 56 -8.216 4.214 -4.415 1.00 23.41 C ATOM 873 CE LYS A 56 -7.462 5.203 -5.307 1.00 30.30 C ATOM 874 NZ LYS A 56 -7.264 6.518 -4.653 1.00 73.02 N ATOM 0 H LYS A 56 -6.318 2.019 -5.632 1.00 51.52 H new ATOM 0 HA LYS A 56 -4.954 4.109 -4.281 1.00 65.14 H new ATOM 0 HB2 LYS A 56 -6.805 1.866 -3.491 1.00 5.24 H new ATOM 0 HB3 LYS A 56 -5.903 2.697 -2.239 1.00 5.24 H new ATOM 0 HG2 LYS A 56 -8.197 3.534 -2.387 1.00 12.01 H new ATOM 0 HG3 LYS A 56 -7.037 4.803 -2.731 1.00 12.01 H new ATOM 0 HD2 LYS A 56 -8.393 3.294 -4.972 1.00 23.41 H new ATOM 0 HD3 LYS A 56 -9.193 4.629 -4.167 1.00 23.41 H new ATOM 0 HE2 LYS A 56 -6.492 4.782 -5.572 1.00 30.30 H new ATOM 0 HE3 LYS A 56 -8.013 5.342 -6.237 1.00 30.30 H new ATOM 0 HZ1 LYS A 56 -7.069 7.239 -5.376 1.00 73.02 H new ATOM 0 HZ2 LYS A 56 -8.124 6.778 -4.128 1.00 73.02 H new ATOM 0 HZ3 LYS A 56 -6.461 6.461 -3.995 1.00 73.02 H new ATOM 888 N TYR A 57 -3.806 1.051 -4.014 1.00 22.14 N ATOM 889 CA TYR A 57 -2.773 0.239 -3.411 1.00 31.12 C ATOM 890 C TYR A 57 -1.387 0.770 -3.755 1.00 44.45 C ATOM 891 O TYR A 57 -0.505 0.830 -2.900 1.00 32.35 O ATOM 892 CB TYR A 57 -2.933 -1.215 -3.851 1.00 71.55 C ATOM 893 CG TYR A 57 -2.091 -2.200 -3.080 1.00 10.21 C ATOM 894 CD1 TYR A 57 -0.799 -2.493 -3.460 1.00 44.52 C ATOM 895 CD2 TYR A 57 -2.609 -2.854 -1.970 1.00 12.25 C ATOM 896 CE1 TYR A 57 -0.045 -3.406 -2.759 1.00 32.04 C ATOM 897 CE2 TYR A 57 -1.861 -3.769 -1.262 1.00 21.33 C ATOM 898 CZ TYR A 57 -0.581 -4.042 -1.666 1.00 25.01 C ATOM 899 OH TYR A 57 0.179 -4.941 -0.974 1.00 1.13 O ATOM 0 H TYR A 57 -4.395 0.556 -4.684 1.00 22.14 H new ATOM 0 HA TYR A 57 -2.878 0.288 -2.327 1.00 31.12 H new ATOM 0 HB2 TYR A 57 -3.981 -1.498 -3.752 1.00 71.55 H new ATOM 0 HB3 TYR A 57 -2.681 -1.291 -4.909 1.00 71.55 H new ATOM 0 HD1 TYR A 57 -0.372 -1.999 -4.320 1.00 44.52 H new ATOM 0 HD2 TYR A 57 -3.620 -2.641 -1.655 1.00 12.25 H new ATOM 0 HE1 TYR A 57 0.967 -3.622 -3.068 1.00 32.04 H new ATOM 0 HE2 TYR A 57 -2.279 -4.265 -0.399 1.00 21.33 H new ATOM 0 HH TYR A 57 1.112 -4.872 -1.264 1.00 1.13 H new ATOM 909 N MET A 58 -1.208 1.183 -4.995 1.00 2.13 N ATOM 910 CA MET A 58 0.071 1.718 -5.438 1.00 2.33 C ATOM 911 C MET A 58 0.376 3.104 -4.842 1.00 1.10 C ATOM 912 O MET A 58 1.477 3.617 -5.015 1.00 22.20 O ATOM 913 CB MET A 58 0.187 1.763 -6.961 1.00 33.21 C ATOM 914 CG MET A 58 -0.839 2.645 -7.622 1.00 33.25 C ATOM 915 SD MET A 58 -0.610 2.795 -9.405 1.00 33.01 S ATOM 916 CE MET A 58 -0.805 1.091 -9.919 1.00 4.44 C ATOM 0 H MET A 58 -1.930 1.160 -5.715 1.00 2.13 H new ATOM 0 HA MET A 58 0.820 1.022 -5.060 1.00 2.33 H new ATOM 0 HB2 MET A 58 1.183 2.115 -7.230 1.00 33.21 H new ATOM 0 HB3 MET A 58 0.090 0.751 -7.354 1.00 33.21 H new ATOM 0 HG2 MET A 58 -1.833 2.246 -7.423 1.00 33.25 H new ATOM 0 HG3 MET A 58 -0.798 3.637 -7.173 1.00 33.25 H new ATOM 0 HE1 MET A 58 -1.297 1.058 -10.891 1.00 4.44 H new ATOM 0 HE2 MET A 58 0.175 0.619 -9.992 1.00 4.44 H new ATOM 0 HE3 MET A 58 -1.411 0.557 -9.187 1.00 4.44 H new ATOM 926 N GLU A 59 -0.596 3.712 -4.156 1.00 41.12 N ATOM 927 CA GLU A 59 -0.370 5.014 -3.540 1.00 62.10 C ATOM 928 C GLU A 59 0.439 4.849 -2.257 1.00 30.41 C ATOM 929 O GLU A 59 1.197 5.741 -1.861 1.00 41.12 O ATOM 930 CB GLU A 59 -1.689 5.734 -3.226 1.00 5.20 C ATOM 931 CG GLU A 59 -2.583 6.007 -4.427 1.00 34.04 C ATOM 932 CD GLU A 59 -3.851 6.743 -4.039 1.00 63.12 C ATOM 933 OE1 GLU A 59 -4.835 6.098 -3.624 1.00 75.24 O ATOM 934 OE2 GLU A 59 -3.885 7.988 -4.131 1.00 53.44 O ATOM 0 H GLU A 59 -1.531 3.328 -4.017 1.00 41.12 H new ATOM 0 HA GLU A 59 0.184 5.624 -4.254 1.00 62.10 H new ATOM 0 HB2 GLU A 59 -2.248 5.136 -2.506 1.00 5.20 H new ATOM 0 HB3 GLU A 59 -1.459 6.683 -2.742 1.00 5.20 H new ATOM 0 HG2 GLU A 59 -2.033 6.596 -5.161 1.00 34.04 H new ATOM 0 HG3 GLU A 59 -2.844 5.063 -4.906 1.00 34.04 H new ATOM 941 N PHE A 60 0.286 3.694 -1.625 1.00 54.22 N ATOM 942 CA PHE A 60 0.979 3.385 -0.379 1.00 5.03 C ATOM 943 C PHE A 60 2.427 3.046 -0.699 1.00 64.54 C ATOM 944 O PHE A 60 2.729 2.666 -1.835 1.00 41.41 O ATOM 945 CB PHE A 60 0.321 2.181 0.319 1.00 13.13 C ATOM 946 CG PHE A 60 -1.155 2.338 0.637 1.00 54.14 C ATOM 947 CD1 PHE A 60 -2.110 2.070 -0.321 1.00 32.22 C ATOM 948 CD2 PHE A 60 -1.579 2.750 1.882 1.00 70.35 C ATOM 949 CE1 PHE A 60 -3.454 2.208 -0.048 1.00 52.43 C ATOM 950 CE2 PHE A 60 -2.929 2.892 2.159 1.00 72.30 C ATOM 951 CZ PHE A 60 -3.862 2.621 1.192 1.00 2.32 C ATOM 0 H PHE A 60 -0.320 2.945 -1.959 1.00 54.22 H new ATOM 0 HA PHE A 60 0.925 4.247 0.285 1.00 5.03 H new ATOM 0 HB2 PHE A 60 0.447 1.303 -0.314 1.00 13.13 H new ATOM 0 HB3 PHE A 60 0.856 1.984 1.248 1.00 13.13 H new ATOM 0 HD1 PHE A 60 -1.799 1.746 -1.303 1.00 32.22 H new ATOM 0 HD2 PHE A 60 -0.851 2.965 2.650 1.00 70.35 H new ATOM 0 HE1 PHE A 60 -4.185 1.990 -0.812 1.00 52.43 H new ATOM 0 HE2 PHE A 60 -3.247 3.217 3.139 1.00 72.30 H new ATOM 0 HZ PHE A 60 -4.914 2.733 1.407 1.00 2.32 H new ATOM 961 N ASP A 61 3.321 3.197 0.264 1.00 24.10 N ATOM 962 CA ASP A 61 4.723 2.865 0.025 1.00 65.23 C ATOM 963 C ASP A 61 4.899 1.368 -0.042 1.00 42.11 C ATOM 964 O ASP A 61 4.948 0.675 0.972 1.00 53.43 O ATOM 965 CB ASP A 61 5.680 3.500 1.051 1.00 0.31 C ATOM 966 CG ASP A 61 7.140 3.174 0.753 1.00 62.15 C ATOM 967 OD1 ASP A 61 7.708 3.752 -0.209 1.00 75.51 O ATOM 968 OD2 ASP A 61 7.741 2.332 1.459 1.00 21.02 O ATOM 0 H ASP A 61 3.112 3.540 1.202 1.00 24.10 H new ATOM 0 HA ASP A 61 4.995 3.297 -0.938 1.00 65.23 H new ATOM 0 HB2 ASP A 61 5.544 4.581 1.052 1.00 0.31 H new ATOM 0 HB3 ASP A 61 5.427 3.146 2.050 1.00 0.31 H new ATOM 973 N LEU A 62 4.921 0.889 -1.253 1.00 32.42 N ATOM 974 CA LEU A 62 5.043 -0.501 -1.568 1.00 22.43 C ATOM 975 C LEU A 62 6.448 -0.994 -1.228 1.00 13.14 C ATOM 976 O LEU A 62 7.445 -0.368 -1.610 1.00 11.13 O ATOM 977 CB LEU A 62 4.812 -0.682 -3.063 1.00 14.25 C ATOM 978 CG LEU A 62 3.474 -0.186 -3.662 1.00 34.12 C ATOM 979 CD1 LEU A 62 3.533 -0.169 -5.176 1.00 4.13 C ATOM 980 CD2 LEU A 62 2.397 -1.127 -3.301 1.00 44.03 C ATOM 0 H LEU A 62 4.851 1.483 -2.080 1.00 32.42 H new ATOM 0 HA LEU A 62 4.312 -1.068 -0.992 1.00 22.43 H new ATOM 0 HB2 LEU A 62 5.621 -0.174 -3.589 1.00 14.25 H new ATOM 0 HB3 LEU A 62 4.904 -1.745 -3.288 1.00 14.25 H new ATOM 0 HG LEU A 62 3.291 0.816 -3.273 1.00 34.12 H new ATOM 0 HD11 LEU A 62 2.581 0.183 -5.573 1.00 4.13 H new ATOM 0 HD12 LEU A 62 4.331 0.498 -5.502 1.00 4.13 H new ATOM 0 HD13 LEU A 62 3.729 -1.176 -5.544 1.00 4.13 H new ATOM 0 HD21 LEU A 62 1.454 -0.779 -3.722 1.00 44.03 H new ATOM 0 HD22 LEU A 62 2.629 -2.115 -3.698 1.00 44.03 H new ATOM 0 HD23 LEU A 62 2.311 -1.183 -2.216 1.00 44.03 H new ATOM 992 N ASN A 63 6.525 -2.079 -0.509 1.00 0.12 N ATOM 993 CA ASN A 63 7.792 -2.692 -0.157 1.00 34.53 C ATOM 994 C ASN A 63 8.223 -3.635 -1.311 1.00 44.41 C ATOM 995 O ASN A 63 7.667 -3.551 -2.393 1.00 13.43 O ATOM 996 CB ASN A 63 7.611 -3.450 1.150 1.00 43.23 C ATOM 997 CG ASN A 63 8.902 -3.728 1.869 1.00 41.54 C ATOM 998 OD1 ASN A 63 9.553 -4.745 1.653 1.00 4.35 O ATOM 999 ND2 ASN A 63 9.277 -2.826 2.726 1.00 62.43 N ATOM 0 H ASN A 63 5.710 -2.572 -0.145 1.00 0.12 H new ATOM 0 HA ASN A 63 8.573 -1.945 -0.018 1.00 34.53 H new ATOM 0 HB2 ASN A 63 6.956 -2.876 1.806 1.00 43.23 H new ATOM 0 HB3 ASN A 63 7.108 -4.395 0.945 1.00 43.23 H new ATOM 0 HD21 ASN A 63 10.143 -2.949 3.250 1.00 62.43 H new ATOM 0 HD22 ASN A 63 8.705 -1.995 2.875 1.00 62.43 H new ATOM 1006 N GLY A 64 9.179 -4.526 -1.067 1.00 51.31 N ATOM 1007 CA GLY A 64 9.731 -5.399 -2.118 1.00 2.34 C ATOM 1008 C GLY A 64 8.703 -6.281 -2.811 1.00 2.52 C ATOM 1009 O GLY A 64 8.762 -6.477 -4.030 1.00 45.53 O ATOM 0 H GLY A 64 9.595 -4.669 -0.147 1.00 51.31 H new ATOM 0 HA2 GLY A 64 10.222 -4.778 -2.867 1.00 2.34 H new ATOM 0 HA3 GLY A 64 10.499 -6.035 -1.678 1.00 2.34 H new ATOM 1013 N ASN A 65 7.749 -6.782 -2.060 1.00 21.44 N ATOM 1014 CA ASN A 65 6.705 -7.666 -2.624 1.00 41.20 C ATOM 1015 C ASN A 65 5.525 -6.822 -3.008 1.00 31.21 C ATOM 1016 O ASN A 65 4.524 -7.317 -3.525 1.00 45.42 O ATOM 1017 CB ASN A 65 6.208 -8.688 -1.581 1.00 33.21 C ATOM 1018 CG ASN A 65 7.259 -9.636 -1.047 1.00 64.21 C ATOM 1019 OD1 ASN A 65 8.177 -10.049 -1.750 1.00 33.20 O ATOM 1020 ND2 ASN A 65 7.157 -9.942 0.226 1.00 65.14 N ATOM 0 H ASN A 65 7.658 -6.605 -1.060 1.00 21.44 H new ATOM 0 HA ASN A 65 7.133 -8.194 -3.476 1.00 41.20 H new ATOM 0 HB2 ASN A 65 5.775 -8.143 -0.742 1.00 33.21 H new ATOM 0 HB3 ASN A 65 5.406 -9.276 -2.027 1.00 33.21 H new ATOM 0 HD21 ASN A 65 7.856 -10.543 0.664 1.00 65.14 H new ATOM 0 HD22 ASN A 65 6.379 -9.579 0.777 1.00 65.14 H new ATOM 1027 N GLY A 66 5.662 -5.541 -2.791 1.00 21.35 N ATOM 1028 CA GLY A 66 4.560 -4.657 -2.923 1.00 3.43 C ATOM 1029 C GLY A 66 3.829 -4.612 -1.617 1.00 71.13 C ATOM 1030 O GLY A 66 2.661 -4.303 -1.560 1.00 31.25 O ATOM 0 H GLY A 66 6.538 -5.094 -2.520 1.00 21.35 H new ATOM 0 HA2 GLY A 66 4.905 -3.660 -3.199 1.00 3.43 H new ATOM 0 HA3 GLY A 66 3.895 -4.996 -3.718 1.00 3.43 H new ATOM 1034 N ASP A 67 4.558 -4.925 -0.557 1.00 34.41 N ATOM 1035 CA ASP A 67 3.992 -5.040 0.786 1.00 64.24 C ATOM 1036 C ASP A 67 3.646 -3.660 1.282 1.00 44.45 C ATOM 1037 O ASP A 67 4.291 -2.691 0.902 1.00 55.35 O ATOM 1038 CB ASP A 67 5.021 -5.606 1.796 1.00 23.21 C ATOM 1039 CG ASP A 67 5.853 -6.772 1.306 1.00 11.13 C ATOM 1040 OD1 ASP A 67 6.825 -6.529 0.549 1.00 61.22 O ATOM 1041 OD2 ASP A 67 5.600 -7.929 1.712 1.00 72.13 O ATOM 0 H ASP A 67 5.561 -5.107 -0.600 1.00 34.41 H new ATOM 0 HA ASP A 67 3.128 -5.701 0.720 1.00 64.24 H new ATOM 0 HB2 ASP A 67 5.695 -4.801 2.089 1.00 23.21 H new ATOM 0 HB3 ASP A 67 4.487 -5.917 2.694 1.00 23.21 H new ATOM 1046 N ILE A 68 2.655 -3.568 2.102 1.00 15.45 N ATOM 1047 CA ILE A 68 2.326 -2.316 2.741 1.00 15.24 C ATOM 1048 C ILE A 68 2.428 -2.514 4.227 1.00 63.52 C ATOM 1049 O ILE A 68 1.711 -3.333 4.791 1.00 1.50 O ATOM 1050 CB ILE A 68 0.905 -1.820 2.381 1.00 63.34 C ATOM 1051 CG1 ILE A 68 0.788 -1.577 0.877 1.00 21.32 C ATOM 1052 CG2 ILE A 68 0.562 -0.540 3.158 1.00 32.32 C ATOM 1053 CD1 ILE A 68 -0.589 -1.151 0.439 1.00 52.41 C ATOM 0 H ILE A 68 2.047 -4.347 2.355 1.00 15.45 H new ATOM 0 HA ILE A 68 3.023 -1.556 2.389 1.00 15.24 H new ATOM 0 HB ILE A 68 0.192 -2.594 2.664 1.00 63.34 H new ATOM 0 HG12 ILE A 68 1.506 -0.811 0.584 1.00 21.32 H new ATOM 0 HG13 ILE A 68 1.062 -2.490 0.348 1.00 21.32 H new ATOM 0 HG21 ILE A 68 -0.441 -0.209 2.889 1.00 32.32 H new ATOM 0 HG22 ILE A 68 0.603 -0.742 4.228 1.00 32.32 H new ATOM 0 HG23 ILE A 68 1.280 0.241 2.908 1.00 32.32 H new ATOM 0 HD11 ILE A 68 -0.596 -0.997 -0.640 1.00 52.41 H new ATOM 0 HD12 ILE A 68 -1.310 -1.926 0.700 1.00 52.41 H new ATOM 0 HD13 ILE A 68 -0.859 -0.221 0.940 1.00 52.41 H new ATOM 1065 N ASP A 69 3.335 -1.823 4.850 1.00 35.31 N ATOM 1066 CA ASP A 69 3.510 -1.953 6.279 1.00 42.21 C ATOM 1067 C ASP A 69 2.736 -0.887 7.030 1.00 21.14 C ATOM 1068 O ASP A 69 2.266 0.087 6.434 1.00 3.20 O ATOM 1069 CB ASP A 69 4.984 -1.926 6.677 1.00 73.04 C ATOM 1070 CG ASP A 69 5.661 -0.637 6.315 1.00 11.20 C ATOM 1071 OD1 ASP A 69 5.596 0.311 7.109 1.00 14.54 O ATOM 1072 OD2 ASP A 69 6.279 -0.554 5.228 1.00 40.33 O ATOM 0 H ASP A 69 3.968 -1.163 4.399 1.00 35.31 H new ATOM 0 HA ASP A 69 3.109 -2.927 6.559 1.00 42.21 H new ATOM 0 HB2 ASP A 69 5.068 -2.086 7.752 1.00 73.04 H new ATOM 0 HB3 ASP A 69 5.502 -2.752 6.190 1.00 73.04 H new ATOM 1077 N ILE A 70 2.610 -1.083 8.343 1.00 10.50 N ATOM 1078 CA ILE A 70 1.873 -0.188 9.226 1.00 14.52 C ATOM 1079 C ILE A 70 2.399 1.256 9.199 1.00 41.53 C ATOM 1080 O ILE A 70 1.632 2.202 9.337 1.00 52.03 O ATOM 1081 CB ILE A 70 1.739 -0.777 10.686 1.00 51.14 C ATOM 1082 CG1 ILE A 70 3.072 -1.022 11.385 1.00 14.11 C ATOM 1083 CG2 ILE A 70 0.922 -2.033 10.693 1.00 34.10 C ATOM 1084 CD1 ILE A 70 3.571 0.168 12.125 1.00 54.12 C ATOM 0 H ILE A 70 3.024 -1.880 8.827 1.00 10.50 H new ATOM 0 HA ILE A 70 0.861 -0.125 8.827 1.00 14.52 H new ATOM 0 HB ILE A 70 1.227 -0.002 11.257 1.00 51.14 H new ATOM 0 HG12 ILE A 70 2.963 -1.855 12.080 1.00 14.11 H new ATOM 0 HG13 ILE A 70 3.814 -1.319 10.644 1.00 14.11 H new ATOM 0 HG21 ILE A 70 0.848 -2.413 11.712 1.00 34.10 H new ATOM 0 HG22 ILE A 70 -0.077 -1.819 10.312 1.00 34.10 H new ATOM 0 HG23 ILE A 70 1.399 -2.781 10.060 1.00 34.10 H new ATOM 0 HD11 ILE A 70 4.522 -0.071 12.600 1.00 54.12 H new ATOM 0 HD12 ILE A 70 3.710 0.996 11.430 1.00 54.12 H new ATOM 0 HD13 ILE A 70 2.846 0.452 12.888 1.00 54.12 H new ATOM 1096 N MET A 71 3.694 1.425 8.961 1.00 41.44 N ATOM 1097 CA MET A 71 4.274 2.758 8.885 1.00 61.44 C ATOM 1098 C MET A 71 3.932 3.394 7.564 1.00 23.01 C ATOM 1099 O MET A 71 3.540 4.552 7.513 1.00 52.25 O ATOM 1100 CB MET A 71 5.787 2.748 9.096 1.00 22.23 C ATOM 1101 CG MET A 71 6.220 2.334 10.485 1.00 72.41 C ATOM 1102 SD MET A 71 5.607 3.463 11.749 1.00 4.22 S ATOM 1103 CE MET A 71 6.263 2.697 13.223 1.00 34.42 C ATOM 0 H MET A 71 4.356 0.663 8.819 1.00 41.44 H new ATOM 0 HA MET A 71 3.844 3.347 9.695 1.00 61.44 H new ATOM 0 HB2 MET A 71 6.239 2.071 8.371 1.00 22.23 H new ATOM 0 HB3 MET A 71 6.177 3.744 8.888 1.00 22.23 H new ATOM 0 HG2 MET A 71 5.858 1.327 10.692 1.00 72.41 H new ATOM 0 HG3 MET A 71 7.308 2.297 10.529 1.00 72.41 H new ATOM 0 HE1 MET A 71 5.869 3.205 14.103 1.00 34.42 H new ATOM 0 HE2 MET A 71 5.971 1.647 13.248 1.00 34.42 H new ATOM 0 HE3 MET A 71 7.350 2.771 13.218 1.00 34.42 H new ATOM 1113 N SER A 72 4.067 2.627 6.500 1.00 43.04 N ATOM 1114 CA SER A 72 3.723 3.081 5.164 1.00 64.23 C ATOM 1115 C SER A 72 2.226 3.417 5.062 1.00 0.34 C ATOM 1116 O SER A 72 1.836 4.383 4.401 1.00 55.41 O ATOM 1117 CB SER A 72 4.122 2.022 4.145 1.00 24.42 C ATOM 1118 OG SER A 72 5.521 1.779 4.220 1.00 52.23 O ATOM 0 H SER A 72 4.419 1.670 6.536 1.00 43.04 H new ATOM 0 HA SER A 72 4.274 3.997 4.950 1.00 64.23 H new ATOM 0 HB2 SER A 72 3.573 1.099 4.333 1.00 24.42 H new ATOM 0 HB3 SER A 72 3.855 2.352 3.141 1.00 24.42 H new ATOM 0 HG SER A 72 5.685 0.813 4.232 1.00 52.23 H new ATOM 1124 N LEU A 73 1.404 2.627 5.731 1.00 44.11 N ATOM 1125 CA LEU A 73 -0.031 2.867 5.808 1.00 73.14 C ATOM 1126 C LEU A 73 -0.266 4.174 6.587 1.00 12.42 C ATOM 1127 O LEU A 73 -1.005 5.035 6.143 1.00 33.12 O ATOM 1128 CB LEU A 73 -0.706 1.670 6.520 1.00 51.22 C ATOM 1129 CG LEU A 73 -2.233 1.703 6.677 1.00 41.43 C ATOM 1130 CD1 LEU A 73 -2.904 1.711 5.329 1.00 40.43 C ATOM 1131 CD2 LEU A 73 -2.717 0.515 7.493 1.00 5.13 C ATOM 0 H LEU A 73 1.712 1.798 6.239 1.00 44.11 H new ATOM 0 HA LEU A 73 -0.463 2.964 4.812 1.00 73.14 H new ATOM 0 HB2 LEU A 73 -0.444 0.764 5.974 1.00 51.22 H new ATOM 0 HB3 LEU A 73 -0.268 1.581 7.514 1.00 51.22 H new ATOM 0 HG LEU A 73 -2.498 2.619 7.206 1.00 41.43 H new ATOM 0 HD11 LEU A 73 -3.986 1.734 5.461 1.00 40.43 H new ATOM 0 HD12 LEU A 73 -2.588 2.592 4.770 1.00 40.43 H new ATOM 0 HD13 LEU A 73 -2.625 0.813 4.778 1.00 40.43 H new ATOM 0 HD21 LEU A 73 -3.802 0.559 7.591 1.00 5.13 H new ATOM 0 HD22 LEU A 73 -2.435 -0.410 6.991 1.00 5.13 H new ATOM 0 HD23 LEU A 73 -2.261 0.544 8.483 1.00 5.13 H new ATOM 1143 N LYS A 74 0.401 4.321 7.733 1.00 63.50 N ATOM 1144 CA LYS A 74 0.310 5.553 8.529 1.00 62.34 C ATOM 1145 C LYS A 74 0.772 6.764 7.754 1.00 41.12 C ATOM 1146 O LYS A 74 0.169 7.805 7.845 1.00 13.41 O ATOM 1147 CB LYS A 74 1.034 5.405 9.893 1.00 33.25 C ATOM 1148 CG LYS A 74 1.270 6.702 10.723 1.00 14.11 C ATOM 1149 CD LYS A 74 2.496 7.500 10.262 1.00 72.41 C ATOM 1150 CE LYS A 74 3.772 6.672 10.338 1.00 34.05 C ATOM 1151 NZ LYS A 74 4.960 7.468 9.968 1.00 2.34 N ATOM 0 H LYS A 74 1.009 3.606 8.132 1.00 63.50 H new ATOM 0 HA LYS A 74 -0.744 5.720 8.751 1.00 62.34 H new ATOM 0 HB2 LYS A 74 0.458 4.712 10.507 1.00 33.25 H new ATOM 0 HB3 LYS A 74 2.003 4.940 9.711 1.00 33.25 H new ATOM 0 HG2 LYS A 74 0.386 7.335 10.654 1.00 14.11 H new ATOM 0 HG3 LYS A 74 1.391 6.436 11.773 1.00 14.11 H new ATOM 0 HD2 LYS A 74 2.344 7.840 9.238 1.00 72.41 H new ATOM 0 HD3 LYS A 74 2.603 8.391 10.881 1.00 72.41 H new ATOM 0 HE2 LYS A 74 3.894 6.283 11.349 1.00 34.05 H new ATOM 0 HE3 LYS A 74 3.688 5.812 9.674 1.00 34.05 H new ATOM 0 HZ1 LYS A 74 5.810 6.872 10.031 1.00 2.34 H new ATOM 0 HZ2 LYS A 74 4.854 7.818 8.994 1.00 2.34 H new ATOM 0 HZ3 LYS A 74 5.053 8.275 10.618 1.00 2.34 H new ATOM 1165 N ARG A 75 1.837 6.599 6.975 1.00 34.31 N ATOM 1166 CA ARG A 75 2.398 7.672 6.138 1.00 63.53 C ATOM 1167 C ARG A 75 1.289 8.255 5.262 1.00 55.22 C ATOM 1168 O ARG A 75 1.213 9.447 5.033 1.00 71.31 O ATOM 1169 CB ARG A 75 3.501 7.089 5.241 1.00 14.43 C ATOM 1170 CG ARG A 75 4.270 8.111 4.421 1.00 43.21 C ATOM 1171 CD ARG A 75 5.253 7.431 3.478 1.00 4.32 C ATOM 1172 NE ARG A 75 6.079 8.397 2.746 1.00 10.04 N ATOM 1173 CZ ARG A 75 6.153 8.505 1.410 1.00 31.51 C ATOM 1174 NH1 ARG A 75 5.379 7.757 0.628 1.00 74.51 N ATOM 1175 NH2 ARG A 75 6.995 9.374 0.862 1.00 71.22 N ATOM 0 H ARG A 75 2.342 5.716 6.901 1.00 34.31 H new ATOM 0 HA ARG A 75 2.816 8.455 6.771 1.00 63.53 H new ATOM 0 HB2 ARG A 75 4.207 6.543 5.867 1.00 14.43 H new ATOM 0 HB3 ARG A 75 3.051 6.365 4.562 1.00 14.43 H new ATOM 0 HG2 ARG A 75 3.572 8.720 3.846 1.00 43.21 H new ATOM 0 HG3 ARG A 75 4.808 8.786 5.087 1.00 43.21 H new ATOM 0 HD2 ARG A 75 5.898 6.763 4.049 1.00 4.32 H new ATOM 0 HD3 ARG A 75 4.704 6.813 2.767 1.00 4.32 H new ATOM 0 HE ARG A 75 6.645 9.041 3.299 1.00 10.04 H new ATOM 0 HH11 ARG A 75 4.723 7.095 1.043 1.00 74.51 H new ATOM 0 HH12 ARG A 75 5.442 7.845 -0.386 1.00 74.51 H new ATOM 0 HH21 ARG A 75 7.584 9.958 1.456 1.00 71.22 H new ATOM 0 HH22 ARG A 75 7.053 9.458 -0.153 1.00 71.22 H new ATOM 1189 N MET A 76 0.437 7.377 4.822 1.00 61.35 N ATOM 1190 CA MET A 76 -0.704 7.689 4.000 1.00 22.55 C ATOM 1191 C MET A 76 -1.811 8.333 4.820 1.00 33.51 C ATOM 1192 O MET A 76 -2.205 9.460 4.552 1.00 32.24 O ATOM 1193 CB MET A 76 -1.182 6.399 3.398 1.00 73.20 C ATOM 1194 CG MET A 76 -0.211 5.822 2.404 1.00 64.53 C ATOM 1195 SD MET A 76 -0.330 6.613 0.814 1.00 23.32 S ATOM 1196 CE MET A 76 -1.983 6.068 0.413 1.00 61.04 C ATOM 0 H MET A 76 0.518 6.382 5.032 1.00 61.35 H new ATOM 0 HA MET A 76 -0.426 8.403 3.224 1.00 22.55 H new ATOM 0 HB2 MET A 76 -1.354 5.674 4.194 1.00 73.20 H new ATOM 0 HB3 MET A 76 -2.141 6.566 2.907 1.00 73.20 H new ATOM 0 HG2 MET A 76 0.804 5.928 2.786 1.00 64.53 H new ATOM 0 HG3 MET A 76 -0.399 4.754 2.292 1.00 64.53 H new ATOM 0 HE1 MET A 76 -1.942 5.365 -0.419 1.00 61.04 H new ATOM 0 HE2 MET A 76 -2.425 5.579 1.281 1.00 61.04 H new ATOM 0 HE3 MET A 76 -2.591 6.928 0.132 1.00 61.04 H new ATOM 1206 N LEU A 77 -2.289 7.615 5.828 1.00 41.03 N ATOM 1207 CA LEU A 77 -3.365 8.079 6.718 1.00 62.44 C ATOM 1208 C LEU A 77 -3.062 9.436 7.351 1.00 31.21 C ATOM 1209 O LEU A 77 -3.952 10.274 7.500 1.00 41.40 O ATOM 1210 CB LEU A 77 -3.668 7.027 7.804 1.00 54.41 C ATOM 1211 CG LEU A 77 -4.563 5.823 7.411 1.00 33.54 C ATOM 1212 CD1 LEU A 77 -4.058 5.082 6.202 1.00 21.13 C ATOM 1213 CD2 LEU A 77 -4.688 4.875 8.577 1.00 24.33 C ATOM 0 H LEU A 77 -1.943 6.684 6.060 1.00 41.03 H new ATOM 0 HA LEU A 77 -4.251 8.211 6.097 1.00 62.44 H new ATOM 0 HB2 LEU A 77 -2.717 6.635 8.165 1.00 54.41 H new ATOM 0 HB3 LEU A 77 -4.142 7.537 8.643 1.00 54.41 H new ATOM 0 HG LEU A 77 -5.540 6.229 7.148 1.00 33.54 H new ATOM 0 HD11 LEU A 77 -4.727 4.251 5.978 1.00 21.13 H new ATOM 0 HD12 LEU A 77 -4.023 5.759 5.349 1.00 21.13 H new ATOM 0 HD13 LEU A 77 -3.058 4.698 6.402 1.00 21.13 H new ATOM 0 HD21 LEU A 77 -5.318 4.032 8.294 1.00 24.33 H new ATOM 0 HD22 LEU A 77 -3.700 4.512 8.858 1.00 24.33 H new ATOM 0 HD23 LEU A 77 -5.137 5.396 9.423 1.00 24.33 H new ATOM 1225 N GLU A 78 -1.814 9.638 7.701 1.00 21.54 N ATOM 1226 CA GLU A 78 -1.340 10.868 8.305 1.00 24.11 C ATOM 1227 C GLU A 78 -1.553 12.062 7.353 1.00 71.21 C ATOM 1228 O GLU A 78 -2.027 13.138 7.760 1.00 71.40 O ATOM 1229 CB GLU A 78 0.143 10.696 8.651 1.00 11.10 C ATOM 1230 CG GLU A 78 0.777 11.875 9.305 1.00 3.33 C ATOM 1231 CD GLU A 78 2.213 11.628 9.683 1.00 43.10 C ATOM 1232 OE1 GLU A 78 3.105 11.849 8.839 1.00 43.31 O ATOM 1233 OE2 GLU A 78 2.480 11.212 10.829 1.00 0.22 O ATOM 0 H GLU A 78 -1.082 8.940 7.573 1.00 21.54 H new ATOM 0 HA GLU A 78 -1.905 11.077 9.213 1.00 24.11 H new ATOM 0 HB2 GLU A 78 0.250 9.833 9.309 1.00 11.10 H new ATOM 0 HB3 GLU A 78 0.690 10.469 7.736 1.00 11.10 H new ATOM 0 HG2 GLU A 78 0.725 12.730 8.631 1.00 3.33 H new ATOM 0 HG3 GLU A 78 0.211 12.138 10.198 1.00 3.33 H new ATOM 1240 N LYS A 79 -1.210 11.849 6.101 1.00 3.20 N ATOM 1241 CA LYS A 79 -1.365 12.853 5.040 1.00 25.31 C ATOM 1242 C LYS A 79 -2.829 13.011 4.621 1.00 75.31 C ATOM 1243 O LYS A 79 -3.301 14.127 4.376 1.00 61.41 O ATOM 1244 CB LYS A 79 -0.551 12.452 3.811 1.00 51.23 C ATOM 1245 CG LYS A 79 0.938 12.351 4.039 1.00 24.01 C ATOM 1246 CD LYS A 79 1.634 11.851 2.786 1.00 34.14 C ATOM 1247 CE LYS A 79 3.139 11.769 2.968 1.00 33.21 C ATOM 1248 NZ LYS A 79 3.750 13.099 3.221 1.00 64.51 N ATOM 0 H LYS A 79 -0.810 10.969 5.775 1.00 3.20 H new ATOM 0 HA LYS A 79 -1.007 13.802 5.441 1.00 25.31 H new ATOM 0 HB2 LYS A 79 -0.915 11.490 3.451 1.00 51.23 H new ATOM 0 HB3 LYS A 79 -0.734 13.179 3.019 1.00 51.23 H new ATOM 0 HG2 LYS A 79 1.336 13.326 4.319 1.00 24.01 H new ATOM 0 HG3 LYS A 79 1.140 11.674 4.869 1.00 24.01 H new ATOM 0 HD2 LYS A 79 1.246 10.867 2.524 1.00 34.14 H new ATOM 0 HD3 LYS A 79 1.405 12.516 1.954 1.00 34.14 H new ATOM 0 HE2 LYS A 79 3.366 11.103 3.800 1.00 33.21 H new ATOM 0 HE3 LYS A 79 3.587 11.330 2.077 1.00 33.21 H new ATOM 0 HZ1 LYS A 79 4.785 13.024 3.153 1.00 64.51 H new ATOM 0 HZ2 LYS A 79 3.405 13.780 2.514 1.00 64.51 H new ATOM 0 HZ3 LYS A 79 3.488 13.426 4.173 1.00 64.51 H new ATOM 1262 N LEU A 80 -3.528 11.902 4.540 1.00 71.33 N ATOM 1263 CA LEU A 80 -4.904 11.873 4.075 1.00 52.33 C ATOM 1264 C LEU A 80 -5.891 12.279 5.169 1.00 61.12 C ATOM 1265 O LEU A 80 -5.499 12.665 6.278 1.00 62.04 O ATOM 1266 CB LEU A 80 -5.251 10.479 3.550 1.00 61.33 C ATOM 1267 CG LEU A 80 -4.392 9.954 2.393 1.00 30.13 C ATOM 1268 CD1 LEU A 80 -4.865 8.586 1.970 1.00 10.41 C ATOM 1269 CD2 LEU A 80 -4.406 10.914 1.213 1.00 63.32 C ATOM 0 H LEU A 80 -3.159 10.986 4.796 1.00 71.33 H new ATOM 0 HA LEU A 80 -4.991 12.601 3.269 1.00 52.33 H new ATOM 0 HB2 LEU A 80 -5.177 9.774 4.378 1.00 61.33 H new ATOM 0 HB3 LEU A 80 -6.292 10.484 3.228 1.00 61.33 H new ATOM 0 HG LEU A 80 -3.363 9.877 2.745 1.00 30.13 H new ATOM 0 HD11 LEU A 80 -4.247 8.225 1.148 1.00 10.41 H new ATOM 0 HD12 LEU A 80 -4.787 7.898 2.812 1.00 10.41 H new ATOM 0 HD13 LEU A 80 -5.903 8.645 1.644 1.00 10.41 H new ATOM 0 HD21 LEU A 80 -3.788 10.513 0.410 1.00 63.32 H new ATOM 0 HD22 LEU A 80 -5.429 11.037 0.857 1.00 63.32 H new ATOM 0 HD23 LEU A 80 -4.012 11.881 1.526 1.00 63.32 H new ATOM 1281 N GLY A 81 -7.172 12.181 4.852 1.00 52.24 N ATOM 1282 CA GLY A 81 -8.207 12.551 5.792 1.00 11.23 C ATOM 1283 C GLY A 81 -8.710 11.370 6.599 1.00 24.41 C ATOM 1284 O GLY A 81 -9.695 11.482 7.325 1.00 62.23 O ATOM 0 H GLY A 81 -7.515 11.848 3.951 1.00 52.24 H new ATOM 0 HA2 GLY A 81 -7.822 13.312 6.470 1.00 11.23 H new ATOM 0 HA3 GLY A 81 -9.041 12.999 5.251 1.00 11.23 H new ATOM 1288 N VAL A 82 -8.049 10.242 6.454 1.00 74.31 N ATOM 1289 CA VAL A 82 -8.381 9.039 7.199 1.00 42.10 C ATOM 1290 C VAL A 82 -7.427 8.873 8.400 1.00 60.43 C ATOM 1291 O VAL A 82 -6.303 8.447 8.252 1.00 45.02 O ATOM 1292 CB VAL A 82 -8.392 7.760 6.276 1.00 24.02 C ATOM 1293 CG1 VAL A 82 -7.128 7.655 5.430 1.00 72.53 C ATOM 1294 CG2 VAL A 82 -8.584 6.486 7.097 1.00 2.41 C ATOM 0 H VAL A 82 -7.262 10.129 5.814 1.00 74.31 H new ATOM 0 HA VAL A 82 -9.395 9.149 7.584 1.00 42.10 H new ATOM 0 HB VAL A 82 -9.239 7.870 5.599 1.00 24.02 H new ATOM 0 HG11 VAL A 82 -7.178 6.760 4.810 1.00 72.53 H new ATOM 0 HG12 VAL A 82 -7.043 8.534 4.791 1.00 72.53 H new ATOM 0 HG13 VAL A 82 -6.257 7.596 6.083 1.00 72.53 H new ATOM 0 HG21 VAL A 82 -8.587 5.622 6.433 1.00 2.41 H new ATOM 0 HG22 VAL A 82 -7.769 6.389 7.814 1.00 2.41 H new ATOM 0 HG23 VAL A 82 -9.533 6.537 7.631 1.00 2.41 H new ATOM 1304 N PRO A 83 -7.852 9.267 9.602 1.00 12.33 N ATOM 1305 CA PRO A 83 -7.013 9.203 10.766 1.00 74.12 C ATOM 1306 C PRO A 83 -7.211 7.941 11.616 1.00 63.01 C ATOM 1307 O PRO A 83 -8.275 7.727 12.199 1.00 52.33 O ATOM 1308 CB PRO A 83 -7.439 10.451 11.549 1.00 63.23 C ATOM 1309 CG PRO A 83 -8.841 10.774 11.078 1.00 0.30 C ATOM 1310 CD PRO A 83 -9.159 9.840 9.927 1.00 10.33 C ATOM 0 HA PRO A 83 -5.958 9.165 10.495 1.00 74.12 H new ATOM 0 HB2 PRO A 83 -7.420 10.264 12.623 1.00 63.23 H new ATOM 0 HB3 PRO A 83 -6.761 11.283 11.358 1.00 63.23 H new ATOM 0 HG2 PRO A 83 -9.558 10.642 11.888 1.00 0.30 H new ATOM 0 HG3 PRO A 83 -8.909 11.814 10.758 1.00 0.30 H new ATOM 0 HD2 PRO A 83 -9.876 9.072 10.216 1.00 10.33 H new ATOM 0 HD3 PRO A 83 -9.588 10.374 9.079 1.00 10.33 H new ATOM 1318 N LYS A 84 -6.204 7.095 11.651 1.00 23.04 N ATOM 1319 CA LYS A 84 -6.208 5.945 12.539 1.00 44.12 C ATOM 1320 C LYS A 84 -4.993 6.013 13.452 1.00 74.55 C ATOM 1321 O LYS A 84 -3.999 6.664 13.121 1.00 45.25 O ATOM 1322 CB LYS A 84 -6.265 4.612 11.774 1.00 73.34 C ATOM 1323 CG LYS A 84 -7.525 4.431 10.925 1.00 52.44 C ATOM 1324 CD LYS A 84 -8.783 4.477 11.786 1.00 71.44 C ATOM 1325 CE LYS A 84 -10.046 4.290 10.960 1.00 41.33 C ATOM 1326 NZ LYS A 84 -11.261 4.301 11.810 1.00 54.33 N ATOM 0 H LYS A 84 -5.367 7.180 11.074 1.00 23.04 H new ATOM 0 HA LYS A 84 -7.115 5.981 13.142 1.00 44.12 H new ATOM 0 HB2 LYS A 84 -5.391 4.539 11.127 1.00 73.34 H new ATOM 0 HB3 LYS A 84 -6.201 3.792 12.489 1.00 73.34 H new ATOM 0 HG2 LYS A 84 -7.571 5.213 10.167 1.00 52.44 H new ATOM 0 HG3 LYS A 84 -7.477 3.478 10.397 1.00 52.44 H new ATOM 0 HD2 LYS A 84 -8.730 3.699 12.548 1.00 71.44 H new ATOM 0 HD3 LYS A 84 -8.830 5.432 12.309 1.00 71.44 H new ATOM 0 HE2 LYS A 84 -10.115 5.083 10.215 1.00 41.33 H new ATOM 0 HE3 LYS A 84 -9.990 3.347 10.417 1.00 41.33 H new ATOM 0 HZ1 LYS A 84 -12.103 4.171 11.214 1.00 54.33 H new ATOM 0 HZ2 LYS A 84 -11.206 3.529 12.504 1.00 54.33 H new ATOM 0 HZ3 LYS A 84 -11.327 5.211 12.309 1.00 54.33 H new ATOM 1340 N THR A 85 -5.077 5.382 14.586 1.00 54.03 N ATOM 1341 CA THR A 85 -4.030 5.439 15.578 1.00 51.25 C ATOM 1342 C THR A 85 -3.107 4.216 15.427 1.00 21.41 C ATOM 1343 O THR A 85 -3.526 3.195 14.903 1.00 0.34 O ATOM 1344 CB THR A 85 -4.667 5.496 16.987 1.00 74.05 C ATOM 1345 OG1 THR A 85 -5.642 6.564 17.004 1.00 72.34 O ATOM 1346 CG2 THR A 85 -3.630 5.775 18.071 1.00 73.24 C ATOM 0 H THR A 85 -5.876 4.808 14.856 1.00 54.03 H new ATOM 0 HA THR A 85 -3.426 6.335 15.437 1.00 51.25 H new ATOM 0 HB THR A 85 -5.124 4.528 17.193 1.00 74.05 H new ATOM 0 HG1 THR A 85 -6.058 6.614 17.890 1.00 72.34 H new ATOM 0 HG21 THR A 85 -4.120 5.807 19.044 1.00 73.24 H new ATOM 0 HG22 THR A 85 -2.879 4.985 18.068 1.00 73.24 H new ATOM 0 HG23 THR A 85 -3.149 6.733 17.876 1.00 73.24 H new ATOM 1354 N HIS A 86 -1.874 4.345 15.901 1.00 0.33 N ATOM 1355 CA HIS A 86 -0.806 3.332 15.787 1.00 41.14 C ATOM 1356 C HIS A 86 -1.242 1.893 16.148 1.00 30.03 C ATOM 1357 O HIS A 86 -0.817 0.940 15.490 1.00 12.44 O ATOM 1358 CB HIS A 86 0.403 3.772 16.641 1.00 62.25 C ATOM 1359 CG HIS A 86 1.579 2.831 16.636 1.00 21.40 C ATOM 1360 ND1 HIS A 86 2.017 2.180 17.760 1.00 64.20 N ATOM 1361 CD2 HIS A 86 2.436 2.479 15.647 1.00 43.20 C ATOM 1362 CE1 HIS A 86 3.086 1.477 17.469 1.00 1.25 C ATOM 1363 NE2 HIS A 86 3.364 1.637 16.195 1.00 21.20 N ATOM 0 H HIS A 86 -1.569 5.184 16.395 1.00 0.33 H new ATOM 0 HA HIS A 86 -0.534 3.283 14.733 1.00 41.14 H new ATOM 0 HB2 HIS A 86 0.739 4.747 16.288 1.00 62.25 H new ATOM 0 HB3 HIS A 86 0.070 3.903 17.670 1.00 62.25 H new ATOM 0 HD2 HIS A 86 2.394 2.803 14.618 1.00 43.20 H new ATOM 0 HE1 HIS A 86 3.645 0.867 18.163 1.00 1.25 H new ATOM 0 HE2 HIS A 86 4.143 1.205 15.697 1.00 21.20 H new ATOM 1372 N LEU A 87 -2.064 1.727 17.169 1.00 2.01 N ATOM 1373 CA LEU A 87 -2.475 0.383 17.553 1.00 60.21 C ATOM 1374 C LEU A 87 -3.539 -0.138 16.561 1.00 63.02 C ATOM 1375 O LEU A 87 -3.412 -1.244 16.043 1.00 63.04 O ATOM 1376 CB LEU A 87 -2.971 0.377 19.021 1.00 62.34 C ATOM 1377 CG LEU A 87 -3.110 -0.985 19.751 1.00 51.51 C ATOM 1378 CD1 LEU A 87 -4.178 -1.871 19.151 1.00 34.04 C ATOM 1379 CD2 LEU A 87 -1.781 -1.710 19.768 1.00 11.42 C ATOM 0 H LEU A 87 -2.453 2.481 17.735 1.00 2.01 H new ATOM 0 HA LEU A 87 -1.625 -0.297 17.504 1.00 60.21 H new ATOM 0 HB2 LEU A 87 -2.289 0.997 19.603 1.00 62.34 H new ATOM 0 HB3 LEU A 87 -3.945 0.866 19.044 1.00 62.34 H new ATOM 0 HG LEU A 87 -3.421 -0.762 20.772 1.00 51.51 H new ATOM 0 HD11 LEU A 87 -4.227 -2.808 19.705 1.00 34.04 H new ATOM 0 HD12 LEU A 87 -5.143 -1.366 19.206 1.00 34.04 H new ATOM 0 HD13 LEU A 87 -3.936 -2.078 18.109 1.00 34.04 H new ATOM 0 HD21 LEU A 87 -1.893 -2.664 20.283 1.00 11.42 H new ATOM 0 HD22 LEU A 87 -1.450 -1.887 18.745 1.00 11.42 H new ATOM 0 HD23 LEU A 87 -1.041 -1.102 20.288 1.00 11.42 H new ATOM 1391 N GLU A 88 -4.556 0.691 16.276 1.00 42.23 N ATOM 1392 CA GLU A 88 -5.625 0.364 15.297 1.00 55.40 C ATOM 1393 C GLU A 88 -4.996 0.045 13.935 1.00 0.12 C ATOM 1394 O GLU A 88 -5.432 -0.835 13.210 1.00 50.01 O ATOM 1395 CB GLU A 88 -6.556 1.577 15.134 1.00 14.12 C ATOM 1396 CG GLU A 88 -7.705 1.372 14.152 1.00 54.23 C ATOM 1397 CD GLU A 88 -8.747 0.394 14.641 1.00 34.41 C ATOM 1398 OE1 GLU A 88 -8.442 -0.790 14.818 1.00 31.10 O ATOM 1399 OE2 GLU A 88 -9.898 0.829 14.881 1.00 34.24 O ATOM 0 H GLU A 88 -4.667 1.606 16.712 1.00 42.23 H new ATOM 0 HA GLU A 88 -6.188 -0.497 15.657 1.00 55.40 H new ATOM 0 HB2 GLU A 88 -6.971 1.833 16.109 1.00 14.12 H new ATOM 0 HB3 GLU A 88 -5.963 2.431 14.806 1.00 14.12 H new ATOM 0 HG2 GLU A 88 -8.182 2.332 13.958 1.00 54.23 H new ATOM 0 HG3 GLU A 88 -7.303 1.018 13.203 1.00 54.23 H new ATOM 1406 N LEU A 89 -3.970 0.779 13.644 1.00 2.42 N ATOM 1407 CA LEU A 89 -3.187 0.685 12.433 1.00 20.30 C ATOM 1408 C LEU A 89 -2.658 -0.754 12.247 1.00 54.22 C ATOM 1409 O LEU A 89 -2.824 -1.358 11.183 1.00 22.32 O ATOM 1410 CB LEU A 89 -2.040 1.663 12.624 1.00 20.15 C ATOM 1411 CG LEU A 89 -1.043 1.891 11.522 1.00 32.42 C ATOM 1412 CD1 LEU A 89 -1.694 2.572 10.332 1.00 40.13 C ATOM 1413 CD2 LEU A 89 0.073 2.739 12.074 1.00 32.12 C ATOM 0 H LEU A 89 -3.629 1.504 14.275 1.00 2.42 H new ATOM 0 HA LEU A 89 -3.773 0.920 11.544 1.00 20.30 H new ATOM 0 HB2 LEU A 89 -2.479 2.631 12.867 1.00 20.15 H new ATOM 0 HB3 LEU A 89 -1.481 1.337 13.501 1.00 20.15 H new ATOM 0 HG LEU A 89 -0.653 0.935 11.172 1.00 32.42 H new ATOM 0 HD11 LEU A 89 -0.951 2.725 9.549 1.00 40.13 H new ATOM 0 HD12 LEU A 89 -2.500 1.945 9.950 1.00 40.13 H new ATOM 0 HD13 LEU A 89 -2.099 3.535 10.641 1.00 40.13 H new ATOM 0 HD21 LEU A 89 0.812 2.920 11.294 1.00 32.12 H new ATOM 0 HD22 LEU A 89 -0.330 3.691 12.420 1.00 32.12 H new ATOM 0 HD23 LEU A 89 0.546 2.220 12.908 1.00 32.12 H new ATOM 1425 N LYS A 90 -2.057 -1.301 13.299 1.00 21.34 N ATOM 1426 CA LYS A 90 -1.564 -2.671 13.269 1.00 72.42 C ATOM 1427 C LYS A 90 -2.714 -3.673 13.272 1.00 4.44 C ATOM 1428 O LYS A 90 -2.630 -4.741 12.661 1.00 55.24 O ATOM 1429 CB LYS A 90 -0.626 -2.947 14.431 1.00 65.51 C ATOM 1430 CG LYS A 90 0.746 -2.331 14.271 1.00 23.11 C ATOM 1431 CD LYS A 90 1.586 -2.551 15.503 1.00 54.15 C ATOM 1432 CE LYS A 90 2.967 -1.981 15.325 1.00 75.35 C ATOM 1433 NZ LYS A 90 3.826 -2.232 16.499 1.00 73.12 N ATOM 0 H LYS A 90 -1.900 -0.815 14.182 1.00 21.34 H new ATOM 0 HA LYS A 90 -1.005 -2.791 12.341 1.00 72.42 H new ATOM 0 HB2 LYS A 90 -1.078 -2.569 15.348 1.00 65.51 H new ATOM 0 HB3 LYS A 90 -0.518 -4.025 14.550 1.00 65.51 H new ATOM 0 HG2 LYS A 90 1.245 -2.766 13.405 1.00 23.11 H new ATOM 0 HG3 LYS A 90 0.648 -1.262 14.080 1.00 23.11 H new ATOM 0 HD2 LYS A 90 1.105 -2.085 16.363 1.00 54.15 H new ATOM 0 HD3 LYS A 90 1.654 -3.618 15.715 1.00 54.15 H new ATOM 0 HE2 LYS A 90 3.428 -2.418 14.439 1.00 75.35 H new ATOM 0 HE3 LYS A 90 2.896 -0.907 15.151 1.00 75.35 H new ATOM 0 HZ1 LYS A 90 4.768 -1.823 16.334 1.00 73.12 H new ATOM 0 HZ2 LYS A 90 3.401 -1.793 17.341 1.00 73.12 H new ATOM 0 HZ3 LYS A 90 3.916 -3.257 16.651 1.00 73.12 H new ATOM 1447 N LYS A 91 -3.796 -3.302 13.945 1.00 31.14 N ATOM 1448 CA LYS A 91 -5.002 -4.121 14.028 1.00 13.23 C ATOM 1449 C LYS A 91 -5.604 -4.351 12.671 1.00 32.13 C ATOM 1450 O LYS A 91 -6.121 -5.433 12.388 1.00 2.44 O ATOM 1451 CB LYS A 91 -6.048 -3.449 14.913 1.00 5.41 C ATOM 1452 CG LYS A 91 -5.746 -3.460 16.393 1.00 33.21 C ATOM 1453 CD LYS A 91 -5.878 -4.859 16.984 1.00 3.11 C ATOM 1454 CE LYS A 91 -7.314 -5.391 16.866 1.00 13.21 C ATOM 1455 NZ LYS A 91 -8.293 -4.530 17.564 1.00 72.42 N ATOM 0 H LYS A 91 -3.863 -2.420 14.452 1.00 31.14 H new ATOM 0 HA LYS A 91 -4.708 -5.079 14.457 1.00 13.23 H new ATOM 0 HB2 LYS A 91 -6.162 -2.414 14.590 1.00 5.41 H new ATOM 0 HB3 LYS A 91 -7.007 -3.941 14.751 1.00 5.41 H new ATOM 0 HG2 LYS A 91 -4.735 -3.088 16.561 1.00 33.21 H new ATOM 0 HG3 LYS A 91 -6.426 -2.781 16.908 1.00 33.21 H new ATOM 0 HD2 LYS A 91 -5.195 -5.537 16.471 1.00 3.11 H new ATOM 0 HD3 LYS A 91 -5.581 -4.841 18.033 1.00 3.11 H new ATOM 0 HE2 LYS A 91 -7.586 -5.466 15.813 1.00 13.21 H new ATOM 0 HE3 LYS A 91 -7.361 -6.399 17.279 1.00 13.21 H new ATOM 0 HZ1 LYS A 91 -9.209 -5.019 17.617 1.00 72.42 H new ATOM 0 HZ2 LYS A 91 -7.953 -4.326 18.525 1.00 72.42 H new ATOM 0 HZ3 LYS A 91 -8.406 -3.638 17.041 1.00 72.42 H new ATOM 1469 N LEU A 92 -5.551 -3.348 11.833 1.00 74.32 N ATOM 1470 CA LEU A 92 -6.119 -3.470 10.529 1.00 64.23 C ATOM 1471 C LEU A 92 -5.279 -4.369 9.644 1.00 15.41 C ATOM 1472 O LEU A 92 -5.808 -5.187 8.907 1.00 73.43 O ATOM 1473 CB LEU A 92 -6.345 -2.121 9.854 1.00 62.30 C ATOM 1474 CG LEU A 92 -7.196 -1.089 10.605 1.00 65.43 C ATOM 1475 CD1 LEU A 92 -7.664 -0.010 9.662 1.00 63.30 C ATOM 1476 CD2 LEU A 92 -8.365 -1.726 11.317 1.00 55.24 C ATOM 0 H LEU A 92 -5.121 -2.445 12.035 1.00 74.32 H new ATOM 0 HA LEU A 92 -7.098 -3.929 10.667 1.00 64.23 H new ATOM 0 HB2 LEU A 92 -5.370 -1.675 9.658 1.00 62.30 H new ATOM 0 HB3 LEU A 92 -6.813 -2.303 8.886 1.00 62.30 H new ATOM 0 HG LEU A 92 -6.565 -0.638 11.371 1.00 65.43 H new ATOM 0 HD11 LEU A 92 -8.267 0.715 10.209 1.00 63.30 H new ATOM 0 HD12 LEU A 92 -6.800 0.492 9.226 1.00 63.30 H new ATOM 0 HD13 LEU A 92 -8.264 -0.455 8.868 1.00 63.30 H new ATOM 0 HD21 LEU A 92 -8.939 -0.957 11.835 1.00 55.24 H new ATOM 0 HD22 LEU A 92 -9.004 -2.228 10.590 1.00 55.24 H new ATOM 0 HD23 LEU A 92 -7.998 -2.454 12.041 1.00 55.24 H new ATOM 1488 N ILE A 93 -3.983 -4.250 9.725 1.00 11.13 N ATOM 1489 CA ILE A 93 -3.144 -5.087 8.900 1.00 53.02 C ATOM 1490 C ILE A 93 -3.157 -6.531 9.412 1.00 15.35 C ATOM 1491 O ILE A 93 -3.099 -7.491 8.628 1.00 21.45 O ATOM 1492 CB ILE A 93 -1.708 -4.539 8.735 1.00 1.14 C ATOM 1493 CG1 ILE A 93 -1.782 -3.121 8.151 1.00 35.10 C ATOM 1494 CG2 ILE A 93 -0.901 -5.449 7.825 1.00 25.13 C ATOM 1495 CD1 ILE A 93 -0.462 -2.549 7.673 1.00 30.13 C ATOM 0 H ILE A 93 -3.490 -3.600 10.337 1.00 11.13 H new ATOM 0 HA ILE A 93 -3.570 -5.077 7.897 1.00 53.02 H new ATOM 0 HB ILE A 93 -1.212 -4.506 9.705 1.00 1.14 H new ATOM 0 HG12 ILE A 93 -2.481 -3.126 7.315 1.00 35.10 H new ATOM 0 HG13 ILE A 93 -2.195 -2.455 8.908 1.00 35.10 H new ATOM 0 HG21 ILE A 93 0.109 -5.053 7.716 1.00 25.13 H new ATOM 0 HG22 ILE A 93 -0.854 -6.448 8.258 1.00 25.13 H new ATOM 0 HG23 ILE A 93 -1.378 -5.500 6.846 1.00 25.13 H new ATOM 0 HD11 ILE A 93 -0.622 -1.545 7.279 1.00 30.13 H new ATOM 0 HD12 ILE A 93 0.238 -2.504 8.507 1.00 30.13 H new ATOM 0 HD13 ILE A 93 -0.052 -3.186 6.889 1.00 30.13 H new ATOM 1507 N GLY A 94 -3.293 -6.684 10.716 1.00 3.43 N ATOM 1508 CA GLY A 94 -3.396 -8.005 11.317 1.00 73.21 C ATOM 1509 C GLY A 94 -4.698 -8.694 10.941 1.00 73.33 C ATOM 1510 O GLY A 94 -4.817 -9.918 11.024 1.00 2.01 O ATOM 0 H GLY A 94 -3.335 -5.912 11.381 1.00 3.43 H new ATOM 0 HA2 GLY A 94 -2.554 -8.618 10.995 1.00 73.21 H new ATOM 0 HA3 GLY A 94 -3.331 -7.917 12.402 1.00 73.21 H new ATOM 1514 N GLU A 95 -5.648 -7.897 10.498 1.00 22.45 N ATOM 1515 CA GLU A 95 -6.970 -8.349 10.104 1.00 54.35 C ATOM 1516 C GLU A 95 -6.890 -9.056 8.718 1.00 32.41 C ATOM 1517 O GLU A 95 -7.781 -9.807 8.339 1.00 11.42 O ATOM 1518 CB GLU A 95 -7.877 -7.109 10.047 1.00 64.55 C ATOM 1519 CG GLU A 95 -9.368 -7.340 9.894 1.00 1.53 C ATOM 1520 CD GLU A 95 -9.991 -8.063 11.079 1.00 52.11 C ATOM 1521 OE1 GLU A 95 -9.915 -7.542 12.214 1.00 34.44 O ATOM 1522 OE2 GLU A 95 -10.588 -9.150 10.890 1.00 5.23 O ATOM 0 H GLU A 95 -5.521 -6.890 10.399 1.00 22.45 H new ATOM 0 HA GLU A 95 -7.374 -9.070 10.815 1.00 54.35 H new ATOM 0 HB2 GLU A 95 -7.717 -6.533 10.959 1.00 64.55 H new ATOM 0 HB3 GLU A 95 -7.546 -6.487 9.215 1.00 64.55 H new ATOM 0 HG2 GLU A 95 -9.865 -6.379 9.761 1.00 1.53 H new ATOM 0 HG3 GLU A 95 -9.548 -7.920 8.989 1.00 1.53 H new ATOM 1529 N VAL A 96 -5.799 -8.797 7.978 1.00 62.12 N ATOM 1530 CA VAL A 96 -5.576 -9.426 6.660 1.00 75.53 C ATOM 1531 C VAL A 96 -4.402 -10.402 6.674 1.00 62.53 C ATOM 1532 O VAL A 96 -4.528 -11.535 6.195 1.00 12.43 O ATOM 1533 CB VAL A 96 -5.340 -8.361 5.533 1.00 41.02 C ATOM 1534 CG1 VAL A 96 -4.797 -9.002 4.263 1.00 4.32 C ATOM 1535 CG2 VAL A 96 -6.624 -7.675 5.181 1.00 14.22 C ATOM 0 H VAL A 96 -5.058 -8.158 8.267 1.00 62.12 H new ATOM 0 HA VAL A 96 -6.490 -9.979 6.443 1.00 75.53 H new ATOM 0 HB VAL A 96 -4.615 -7.646 5.923 1.00 41.02 H new ATOM 0 HG11 VAL A 96 -4.646 -8.234 3.504 1.00 4.32 H new ATOM 0 HG12 VAL A 96 -3.847 -9.491 4.480 1.00 4.32 H new ATOM 0 HG13 VAL A 96 -5.509 -9.741 3.895 1.00 4.32 H new ATOM 0 HG21 VAL A 96 -6.441 -6.940 4.398 1.00 14.22 H new ATOM 0 HG22 VAL A 96 -7.345 -8.412 4.826 1.00 14.22 H new ATOM 0 HG23 VAL A 96 -7.022 -7.174 6.063 1.00 14.22 H new ATOM 1545 N SER A 97 -3.275 -9.961 7.233 1.00 61.30 N ATOM 1546 CA SER A 97 -2.034 -10.734 7.240 1.00 30.13 C ATOM 1547 C SER A 97 -2.231 -12.156 7.792 1.00 55.31 C ATOM 1548 O SER A 97 -2.109 -13.146 7.058 1.00 12.15 O ATOM 1549 CB SER A 97 -0.967 -9.963 8.022 1.00 4.13 C ATOM 1550 OG SER A 97 -1.470 -9.570 9.296 1.00 41.23 O ATOM 0 H SER A 97 -3.197 -9.055 7.695 1.00 61.30 H new ATOM 0 HA SER A 97 -1.701 -10.862 6.210 1.00 30.13 H new ATOM 0 HB2 SER A 97 -0.081 -10.585 8.150 1.00 4.13 H new ATOM 0 HB3 SER A 97 -0.660 -9.082 7.458 1.00 4.13 H new ATOM 0 HG SER A 97 -1.991 -8.745 9.202 1.00 41.23 H new ATOM 1556 N SER A 98 -2.534 -12.241 9.062 1.00 33.23 N ATOM 1557 CA SER A 98 -2.830 -13.492 9.738 1.00 61.40 C ATOM 1558 C SER A 98 -3.588 -13.175 11.026 1.00 32.21 C ATOM 1559 O SER A 98 -4.787 -13.436 11.139 1.00 23.21 O ATOM 1560 CB SER A 98 -1.536 -14.290 10.047 1.00 0.52 C ATOM 1561 OG SER A 98 -0.837 -14.663 8.857 1.00 44.14 O ATOM 0 H SER A 98 -2.585 -11.427 9.675 1.00 33.23 H new ATOM 0 HA SER A 98 -3.441 -14.117 9.087 1.00 61.40 H new ATOM 0 HB2 SER A 98 -0.882 -13.688 10.678 1.00 0.52 H new ATOM 0 HB3 SER A 98 -1.790 -15.186 10.614 1.00 0.52 H new ATOM 0 HG SER A 98 -1.376 -14.426 8.073 1.00 44.14 H new ATOM 1567 N GLY A 99 -2.891 -12.579 11.965 1.00 44.33 N ATOM 1568 CA GLY A 99 -3.494 -12.165 13.205 1.00 14.43 C ATOM 1569 C GLY A 99 -2.833 -10.914 13.702 1.00 21.14 C ATOM 1570 O GLY A 99 -3.484 -9.935 14.042 1.00 3.21 O ATOM 0 H GLY A 99 -1.896 -12.369 11.890 1.00 44.33 H new ATOM 0 HA2 GLY A 99 -4.560 -11.990 13.060 1.00 14.43 H new ATOM 0 HA3 GLY A 99 -3.399 -12.957 13.948 1.00 14.43 H new ATOM 1574 N SER A 100 -1.533 -10.942 13.745 1.00 33.00 N ATOM 1575 CA SER A 100 -0.760 -9.795 14.111 1.00 45.10 C ATOM 1576 C SER A 100 0.343 -9.598 13.079 1.00 14.24 C ATOM 1577 O SER A 100 1.406 -10.214 13.165 1.00 61.11 O ATOM 1578 CB SER A 100 -0.173 -9.975 15.512 1.00 2.52 C ATOM 1579 OG SER A 100 -1.204 -10.269 16.452 1.00 51.22 O ATOM 0 H SER A 100 -0.977 -11.768 13.525 1.00 33.00 H new ATOM 0 HA SER A 100 -1.396 -8.910 14.130 1.00 45.10 H new ATOM 0 HB2 SER A 100 0.561 -10.781 15.504 1.00 2.52 H new ATOM 0 HB3 SER A 100 0.353 -9.068 15.812 1.00 2.52 H new ATOM 0 HG SER A 100 -0.812 -10.383 17.343 1.00 51.22 H new ATOM 1585 N GLY A 101 0.061 -8.814 12.073 1.00 33.15 N ATOM 1586 CA GLY A 101 1.015 -8.567 11.043 1.00 12.21 C ATOM 1587 C GLY A 101 1.118 -7.114 10.764 1.00 22.13 C ATOM 1588 O GLY A 101 0.135 -6.387 10.901 1.00 44.25 O ATOM 0 H GLY A 101 -0.831 -8.335 11.951 1.00 33.15 H new ATOM 0 HA2 GLY A 101 1.989 -8.955 11.341 1.00 12.21 H new ATOM 0 HA3 GLY A 101 0.724 -9.097 10.136 1.00 12.21 H new ATOM 1592 N GLU A 102 2.285 -6.686 10.388 1.00 20.43 N ATOM 1593 CA GLU A 102 2.538 -5.296 10.123 1.00 10.30 C ATOM 1594 C GLU A 102 2.625 -5.044 8.637 1.00 63.21 C ATOM 1595 O GLU A 102 2.716 -3.919 8.215 1.00 64.23 O ATOM 1596 CB GLU A 102 3.836 -4.875 10.791 1.00 43.31 C ATOM 1597 CG GLU A 102 3.834 -5.076 12.290 1.00 52.31 C ATOM 1598 CD GLU A 102 5.155 -4.758 12.911 1.00 24.51 C ATOM 1599 OE1 GLU A 102 6.079 -5.583 12.796 1.00 24.25 O ATOM 1600 OE2 GLU A 102 5.282 -3.703 13.553 1.00 11.14 O ATOM 0 H GLU A 102 3.095 -7.292 10.255 1.00 20.43 H new ATOM 0 HA GLU A 102 1.713 -4.710 10.527 1.00 10.30 H new ATOM 0 HB2 GLU A 102 4.660 -5.442 10.357 1.00 43.31 H new ATOM 0 HB3 GLU A 102 4.023 -3.824 10.573 1.00 43.31 H new ATOM 0 HG2 GLU A 102 3.065 -4.446 12.737 1.00 52.31 H new ATOM 0 HG3 GLU A 102 3.570 -6.109 12.515 1.00 52.31 H new ATOM 1607 N THR A 103 2.609 -6.104 7.853 1.00 13.03 N ATOM 1608 CA THR A 103 2.711 -5.999 6.418 1.00 51.44 C ATOM 1609 C THR A 103 1.506 -6.607 5.689 1.00 13.01 C ATOM 1610 O THR A 103 0.886 -7.568 6.159 1.00 33.34 O ATOM 1611 CB THR A 103 4.008 -6.677 5.906 1.00 60.31 C ATOM 1612 OG1 THR A 103 4.130 -7.998 6.469 1.00 24.12 O ATOM 1613 CG2 THR A 103 5.245 -5.856 6.240 1.00 23.54 C ATOM 0 H THR A 103 2.525 -7.061 8.197 1.00 13.03 H new ATOM 0 HA THR A 103 2.734 -4.932 6.195 1.00 51.44 H new ATOM 0 HB THR A 103 3.938 -6.746 4.820 1.00 60.31 H new ATOM 0 HG1 THR A 103 4.951 -8.420 6.139 1.00 24.12 H new ATOM 0 HG21 THR A 103 6.132 -6.366 5.864 1.00 23.54 H new ATOM 0 HG22 THR A 103 5.166 -4.874 5.775 1.00 23.54 H new ATOM 0 HG23 THR A 103 5.324 -5.740 7.321 1.00 23.54 H new ATOM 1621 N PHE A 104 1.194 -6.034 4.549 1.00 72.41 N ATOM 1622 CA PHE A 104 0.176 -6.542 3.655 1.00 43.52 C ATOM 1623 C PHE A 104 0.829 -7.154 2.483 1.00 53.43 C ATOM 1624 O PHE A 104 2.019 -6.967 2.251 1.00 2.10 O ATOM 1625 CB PHE A 104 -0.696 -5.428 3.055 1.00 14.15 C ATOM 1626 CG PHE A 104 -1.803 -4.895 3.874 1.00 71.01 C ATOM 1627 CD1 PHE A 104 -2.920 -5.663 4.084 1.00 3.13 C ATOM 1628 CD2 PHE A 104 -1.767 -3.616 4.377 1.00 42.44 C ATOM 1629 CE1 PHE A 104 -3.980 -5.180 4.790 1.00 15.24 C ATOM 1630 CE2 PHE A 104 -2.828 -3.121 5.092 1.00 13.22 C ATOM 1631 CZ PHE A 104 -3.937 -3.904 5.299 1.00 23.22 C ATOM 0 H PHE A 104 1.648 -5.186 4.210 1.00 72.41 H new ATOM 0 HA PHE A 104 -0.427 -7.231 4.246 1.00 43.52 H new ATOM 0 HB2 PHE A 104 -0.042 -4.595 2.796 1.00 14.15 H new ATOM 0 HB3 PHE A 104 -1.120 -5.802 2.123 1.00 14.15 H new ATOM 0 HD1 PHE A 104 -2.960 -6.665 3.684 1.00 3.13 H new ATOM 0 HD2 PHE A 104 -0.898 -2.997 4.208 1.00 42.44 H new ATOM 0 HE1 PHE A 104 -4.851 -5.798 4.949 1.00 15.24 H new ATOM 0 HE2 PHE A 104 -2.791 -2.118 5.491 1.00 13.22 H new ATOM 0 HZ PHE A 104 -4.774 -3.518 5.861 1.00 23.22 H new ATOM 1641 N SER A 105 0.071 -7.880 1.750 1.00 52.50 N ATOM 1642 CA SER A 105 0.503 -8.383 0.511 1.00 1.44 C ATOM 1643 C SER A 105 -0.647 -8.197 -0.461 1.00 42.43 C ATOM 1644 O SER A 105 -1.822 -8.344 -0.064 1.00 22.41 O ATOM 1645 CB SER A 105 0.922 -9.838 0.650 1.00 14.12 C ATOM 1646 OG SER A 105 1.961 -9.960 1.631 1.00 15.32 O ATOM 0 H SER A 105 -0.882 -8.143 2.002 1.00 52.50 H new ATOM 0 HA SER A 105 1.381 -7.853 0.141 1.00 1.44 H new ATOM 0 HB2 SER A 105 0.065 -10.445 0.940 1.00 14.12 H new ATOM 0 HB3 SER A 105 1.271 -10.217 -0.310 1.00 14.12 H new ATOM 0 HG SER A 105 2.223 -10.901 1.715 1.00 15.32 H new ATOM 1652 N TYR A 106 -0.328 -7.853 -1.695 1.00 62.42 N ATOM 1653 CA TYR A 106 -1.328 -7.525 -2.713 1.00 54.31 C ATOM 1654 C TYR A 106 -2.396 -8.643 -2.882 1.00 1.34 C ATOM 1655 O TYR A 106 -3.595 -8.348 -2.837 1.00 24.25 O ATOM 1656 CB TYR A 106 -0.637 -7.165 -4.041 1.00 13.13 C ATOM 1657 CG TYR A 106 -1.518 -6.488 -5.069 1.00 33.44 C ATOM 1658 CD1 TYR A 106 -1.759 -5.147 -4.986 1.00 70.44 C ATOM 1659 CD2 TYR A 106 -2.068 -7.174 -6.126 1.00 4.22 C ATOM 1660 CE1 TYR A 106 -2.522 -4.487 -5.911 1.00 4.50 C ATOM 1661 CE2 TYR A 106 -2.839 -6.526 -7.074 1.00 40.42 C ATOM 1662 CZ TYR A 106 -3.054 -5.179 -6.956 1.00 45.11 C ATOM 1663 OH TYR A 106 -3.806 -4.528 -7.875 1.00 60.04 O ATOM 0 H TYR A 106 0.634 -7.791 -2.028 1.00 62.42 H new ATOM 0 HA TYR A 106 -1.878 -6.648 -2.372 1.00 54.31 H new ATOM 0 HB2 TYR A 106 0.209 -6.512 -3.826 1.00 13.13 H new ATOM 0 HB3 TYR A 106 -0.232 -8.077 -4.479 1.00 13.13 H new ATOM 0 HD1 TYR A 106 -1.334 -4.589 -4.165 1.00 70.44 H new ATOM 0 HD2 TYR A 106 -1.895 -8.236 -6.218 1.00 4.22 H new ATOM 0 HE1 TYR A 106 -2.701 -3.426 -5.813 1.00 4.50 H new ATOM 0 HE2 TYR A 106 -3.267 -7.077 -7.899 1.00 40.42 H new ATOM 0 HH TYR A 106 -4.008 -5.132 -8.620 1.00 60.04 H new ATOM 1673 N PRO A 107 -1.999 -9.948 -3.057 1.00 62.14 N ATOM 1674 CA PRO A 107 -2.975 -11.032 -3.163 1.00 2.30 C ATOM 1675 C PRO A 107 -3.826 -11.170 -1.895 1.00 71.34 C ATOM 1676 O PRO A 107 -5.017 -11.402 -1.984 1.00 31.20 O ATOM 1677 CB PRO A 107 -2.118 -12.291 -3.373 1.00 15.23 C ATOM 1678 CG PRO A 107 -0.821 -11.782 -3.885 1.00 42.21 C ATOM 1679 CD PRO A 107 -0.613 -10.468 -3.200 1.00 10.21 C ATOM 0 HA PRO A 107 -3.685 -10.854 -3.971 1.00 2.30 H new ATOM 0 HB2 PRO A 107 -1.988 -12.841 -2.441 1.00 15.23 H new ATOM 0 HB3 PRO A 107 -2.584 -12.973 -4.084 1.00 15.23 H new ATOM 0 HG2 PRO A 107 -0.010 -12.475 -3.660 1.00 42.21 H new ATOM 0 HG3 PRO A 107 -0.846 -11.661 -4.968 1.00 42.21 H new ATOM 0 HD2 PRO A 107 -0.125 -10.589 -2.233 1.00 10.21 H new ATOM 0 HD3 PRO A 107 0.011 -9.798 -3.791 1.00 10.21 H new ATOM 1687 N ASP A 108 -3.210 -10.989 -0.718 1.00 63.32 N ATOM 1688 CA ASP A 108 -3.927 -11.140 0.571 1.00 30.11 C ATOM 1689 C ASP A 108 -5.049 -10.168 0.745 1.00 50.13 C ATOM 1690 O ASP A 108 -6.132 -10.546 1.191 1.00 51.20 O ATOM 1691 CB ASP A 108 -2.998 -11.145 1.790 1.00 23.10 C ATOM 1692 CG ASP A 108 -2.145 -12.388 1.866 1.00 55.30 C ATOM 1693 OD1 ASP A 108 -2.645 -13.442 2.292 1.00 62.31 O ATOM 1694 OD2 ASP A 108 -0.967 -12.333 1.500 1.00 3.11 O ATOM 0 H ASP A 108 -2.225 -10.740 -0.624 1.00 63.32 H new ATOM 0 HA ASP A 108 -4.376 -12.132 0.515 1.00 30.11 H new ATOM 0 HB2 ASP A 108 -2.352 -10.268 1.753 1.00 23.10 H new ATOM 0 HB3 ASP A 108 -3.596 -11.063 2.698 1.00 23.10 H new ATOM 1699 N PHE A 109 -4.818 -8.926 0.389 1.00 4.32 N ATOM 1700 CA PHE A 109 -5.853 -7.925 0.479 1.00 73.33 C ATOM 1701 C PHE A 109 -7.023 -8.314 -0.469 1.00 14.43 C ATOM 1702 O PHE A 109 -8.188 -8.110 -0.144 1.00 12.01 O ATOM 1703 CB PHE A 109 -5.287 -6.551 0.118 1.00 64.11 C ATOM 1704 CG PHE A 109 -6.123 -5.377 0.578 1.00 22.15 C ATOM 1705 CD1 PHE A 109 -7.364 -5.102 0.020 1.00 4.32 C ATOM 1706 CD2 PHE A 109 -5.643 -4.532 1.562 1.00 35.02 C ATOM 1707 CE1 PHE A 109 -8.102 -4.016 0.437 1.00 23.31 C ATOM 1708 CE2 PHE A 109 -6.379 -3.446 1.984 1.00 3.15 C ATOM 1709 CZ PHE A 109 -7.608 -3.189 1.419 1.00 3.12 C ATOM 0 H PHE A 109 -3.924 -8.586 0.035 1.00 4.32 H new ATOM 0 HA PHE A 109 -6.230 -7.874 1.500 1.00 73.33 H new ATOM 0 HB2 PHE A 109 -4.290 -6.460 0.550 1.00 64.11 H new ATOM 0 HB3 PHE A 109 -5.172 -6.495 -0.964 1.00 64.11 H new ATOM 0 HD1 PHE A 109 -7.756 -5.748 -0.751 1.00 4.32 H new ATOM 0 HD2 PHE A 109 -4.678 -4.726 2.006 1.00 35.02 H new ATOM 0 HE1 PHE A 109 -9.066 -3.814 -0.006 1.00 23.31 H new ATOM 0 HE2 PHE A 109 -5.992 -2.798 2.756 1.00 3.15 H new ATOM 0 HZ PHE A 109 -8.185 -2.337 1.747 1.00 3.12 H new ATOM 1719 N LEU A 110 -6.694 -8.907 -1.624 1.00 2.42 N ATOM 1720 CA LEU A 110 -7.684 -9.352 -2.573 1.00 11.45 C ATOM 1721 C LEU A 110 -8.407 -10.586 -2.089 1.00 35.20 C ATOM 1722 O LEU A 110 -9.599 -10.705 -2.282 1.00 71.42 O ATOM 1723 CB LEU A 110 -7.065 -9.547 -3.955 1.00 11.24 C ATOM 1724 CG LEU A 110 -6.669 -8.252 -4.654 1.00 32.44 C ATOM 1725 CD1 LEU A 110 -5.913 -8.525 -5.946 1.00 74.01 C ATOM 1726 CD2 LEU A 110 -7.921 -7.431 -4.939 1.00 64.35 C ATOM 0 H LEU A 110 -5.732 -9.085 -1.913 1.00 2.42 H new ATOM 0 HA LEU A 110 -8.438 -8.570 -2.663 1.00 11.45 H new ATOM 0 HB2 LEU A 110 -6.182 -10.179 -3.859 1.00 11.24 H new ATOM 0 HB3 LEU A 110 -7.774 -10.084 -4.585 1.00 11.24 H new ATOM 0 HG LEU A 110 -6.003 -7.693 -3.996 1.00 32.44 H new ATOM 0 HD11 LEU A 110 -5.646 -7.580 -6.418 1.00 74.01 H new ATOM 0 HD12 LEU A 110 -5.007 -9.089 -5.725 1.00 74.01 H new ATOM 0 HD13 LEU A 110 -6.544 -9.103 -6.622 1.00 74.01 H new ATOM 0 HD21 LEU A 110 -7.642 -6.504 -5.439 1.00 64.35 H new ATOM 0 HD22 LEU A 110 -8.592 -8.002 -5.581 1.00 64.35 H new ATOM 0 HD23 LEU A 110 -8.426 -7.200 -4.001 1.00 64.35 H new ATOM 1738 N ARG A 111 -7.687 -11.489 -1.439 1.00 14.11 N ATOM 1739 CA ARG A 111 -8.295 -12.681 -0.834 1.00 52.34 C ATOM 1740 C ARG A 111 -9.375 -12.234 0.147 1.00 23.42 C ATOM 1741 O ARG A 111 -10.460 -12.811 0.214 1.00 43.04 O ATOM 1742 CB ARG A 111 -7.226 -13.513 -0.095 1.00 63.20 C ATOM 1743 CG ARG A 111 -6.106 -14.029 -0.991 1.00 22.22 C ATOM 1744 CD ARG A 111 -5.012 -14.727 -0.190 1.00 1.34 C ATOM 1745 NE ARG A 111 -5.483 -15.937 0.473 1.00 45.11 N ATOM 1746 CZ ARG A 111 -4.971 -16.437 1.603 1.00 52.55 C ATOM 1747 NH1 ARG A 111 -4.037 -15.762 2.288 1.00 21.55 N ATOM 1748 NH2 ARG A 111 -5.414 -17.606 2.063 1.00 71.23 N ATOM 0 H ARG A 111 -6.677 -11.425 -1.313 1.00 14.11 H new ATOM 0 HA ARG A 111 -8.734 -13.303 -1.614 1.00 52.34 H new ATOM 0 HB2 ARG A 111 -6.791 -12.903 0.697 1.00 63.20 H new ATOM 0 HB3 ARG A 111 -7.711 -14.362 0.386 1.00 63.20 H new ATOM 0 HG2 ARG A 111 -6.518 -14.723 -1.724 1.00 22.22 H new ATOM 0 HG3 ARG A 111 -5.674 -13.197 -1.547 1.00 22.22 H new ATOM 0 HD2 ARG A 111 -4.186 -14.980 -0.855 1.00 1.34 H new ATOM 0 HD3 ARG A 111 -4.619 -14.038 0.558 1.00 1.34 H new ATOM 0 HE ARG A 111 -6.260 -16.439 0.044 1.00 45.11 H new ATOM 0 HH11 ARG A 111 -3.710 -14.857 1.949 1.00 21.55 H new ATOM 0 HH12 ARG A 111 -3.654 -16.153 3.149 1.00 21.55 H new ATOM 0 HH21 ARG A 111 -6.138 -18.113 1.554 1.00 71.23 H new ATOM 0 HH22 ARG A 111 -5.029 -17.994 2.924 1.00 71.23 H new ATOM 1762 N MET A 112 -9.062 -11.168 0.859 1.00 43.50 N ATOM 1763 CA MET A 112 -9.956 -10.550 1.816 1.00 23.45 C ATOM 1764 C MET A 112 -11.124 -9.850 1.097 1.00 31.03 C ATOM 1765 O MET A 112 -12.281 -10.118 1.385 1.00 52.12 O ATOM 1766 CB MET A 112 -9.136 -9.558 2.682 1.00 42.32 C ATOM 1767 CG MET A 112 -9.889 -8.833 3.799 1.00 23.24 C ATOM 1768 SD MET A 112 -11.114 -7.614 3.241 1.00 60.14 S ATOM 1769 CE MET A 112 -10.057 -6.437 2.390 1.00 43.42 C ATOM 0 H MET A 112 -8.159 -10.699 0.786 1.00 43.50 H new ATOM 0 HA MET A 112 -10.396 -11.308 2.463 1.00 23.45 H new ATOM 0 HB2 MET A 112 -8.306 -10.104 3.130 1.00 42.32 H new ATOM 0 HB3 MET A 112 -8.703 -8.807 2.021 1.00 42.32 H new ATOM 0 HG2 MET A 112 -10.394 -9.576 4.416 1.00 23.24 H new ATOM 0 HG3 MET A 112 -9.163 -8.329 4.437 1.00 23.24 H new ATOM 0 HE1 MET A 112 -10.265 -5.431 2.755 1.00 43.42 H new ATOM 0 HE2 MET A 112 -9.012 -6.683 2.580 1.00 43.42 H new ATOM 0 HE3 MET A 112 -10.251 -6.482 1.318 1.00 43.42 H new ATOM 1779 N MET A 113 -10.794 -8.968 0.155 1.00 53.25 N ATOM 1780 CA MET A 113 -11.788 -8.174 -0.600 1.00 41.23 C ATOM 1781 C MET A 113 -12.780 -9.068 -1.327 1.00 34.41 C ATOM 1782 O MET A 113 -13.996 -8.936 -1.177 1.00 11.01 O ATOM 1783 CB MET A 113 -11.062 -7.295 -1.629 1.00 75.25 C ATOM 1784 CG MET A 113 -11.976 -6.414 -2.486 1.00 43.22 C ATOM 1785 SD MET A 113 -12.875 -5.172 -1.533 1.00 24.32 S ATOM 1786 CE MET A 113 -11.516 -4.188 -0.899 1.00 32.40 C ATOM 0 H MET A 113 -9.829 -8.776 -0.114 1.00 53.25 H new ATOM 0 HA MET A 113 -12.337 -7.558 0.112 1.00 41.23 H new ATOM 0 HB2 MET A 113 -10.354 -6.655 -1.103 1.00 75.25 H new ATOM 0 HB3 MET A 113 -10.480 -7.939 -2.289 1.00 75.25 H new ATOM 0 HG2 MET A 113 -11.377 -5.914 -3.247 1.00 43.22 H new ATOM 0 HG3 MET A 113 -12.692 -7.048 -3.010 1.00 43.22 H new ATOM 0 HE1 MET A 113 -11.908 -3.289 -0.423 1.00 32.40 H new ATOM 0 HE2 MET A 113 -10.955 -4.770 -0.168 1.00 32.40 H new ATOM 0 HE3 MET A 113 -10.857 -3.906 -1.720 1.00 32.40 H new ATOM 1796 N LEU A 114 -12.239 -9.979 -2.091 1.00 45.14 N ATOM 1797 CA LEU A 114 -12.994 -10.902 -2.916 1.00 34.14 C ATOM 1798 C LEU A 114 -13.742 -11.913 -2.059 1.00 70.44 C ATOM 1799 O LEU A 114 -14.842 -12.344 -2.407 1.00 61.41 O ATOM 1800 CB LEU A 114 -12.024 -11.636 -3.875 1.00 15.24 C ATOM 1801 CG LEU A 114 -11.474 -10.885 -5.130 1.00 33.14 C ATOM 1802 CD1 LEU A 114 -11.011 -9.468 -4.822 1.00 12.21 C ATOM 1803 CD2 LEU A 114 -10.295 -11.667 -5.680 1.00 60.11 C ATOM 0 H LEU A 114 -11.230 -10.108 -2.163 1.00 45.14 H new ATOM 0 HA LEU A 114 -13.729 -10.339 -3.491 1.00 34.14 H new ATOM 0 HB2 LEU A 114 -11.166 -11.962 -3.287 1.00 15.24 H new ATOM 0 HB3 LEU A 114 -12.530 -12.535 -4.227 1.00 15.24 H new ATOM 0 HG LEU A 114 -12.289 -10.812 -5.850 1.00 33.14 H new ATOM 0 HD11 LEU A 114 -10.640 -9.000 -5.734 1.00 12.21 H new ATOM 0 HD12 LEU A 114 -11.848 -8.889 -4.431 1.00 12.21 H new ATOM 0 HD13 LEU A 114 -10.213 -9.499 -4.080 1.00 12.21 H new ATOM 0 HD21 LEU A 114 -9.898 -11.157 -6.558 1.00 60.11 H new ATOM 0 HD22 LEU A 114 -9.518 -11.738 -4.919 1.00 60.11 H new ATOM 0 HD23 LEU A 114 -10.621 -12.669 -5.959 1.00 60.11 H new ATOM 1815 N GLY A 115 -13.157 -12.260 -0.931 1.00 11.43 N ATOM 1816 CA GLY A 115 -13.748 -13.254 -0.063 1.00 31.00 C ATOM 1817 C GLY A 115 -14.769 -12.680 0.890 1.00 70.21 C ATOM 1818 O GLY A 115 -15.587 -13.427 1.454 1.00 5.33 O ATOM 0 H GLY A 115 -12.276 -11.870 -0.596 1.00 11.43 H new ATOM 0 HA2 GLY A 115 -14.222 -14.024 -0.672 1.00 31.00 H new ATOM 0 HA3 GLY A 115 -12.959 -13.742 0.510 1.00 31.00 H new ATOM 1822 N LYS A 116 -14.719 -11.354 1.068 1.00 12.31 N ATOM 1823 CA LYS A 116 -15.599 -10.623 1.973 1.00 71.32 C ATOM 1824 C LYS A 116 -15.299 -10.997 3.431 1.00 33.42 C ATOM 1825 O LYS A 116 -15.739 -12.029 3.934 1.00 62.14 O ATOM 1826 CB LYS A 116 -17.080 -10.821 1.590 1.00 1.52 C ATOM 1827 CG LYS A 116 -18.080 -10.171 2.526 1.00 13.30 C ATOM 1828 CD LYS A 116 -19.511 -10.334 2.013 1.00 11.04 C ATOM 1829 CE LYS A 116 -19.907 -11.802 1.797 1.00 21.52 C ATOM 1830 NZ LYS A 116 -19.818 -12.608 3.032 1.00 4.22 N ATOM 0 H LYS A 116 -14.055 -10.755 0.578 1.00 12.31 H new ATOM 0 HA LYS A 116 -15.402 -9.556 1.874 1.00 71.32 H new ATOM 0 HB2 LYS A 116 -17.235 -10.425 0.586 1.00 1.52 H new ATOM 0 HB3 LYS A 116 -17.288 -11.890 1.547 1.00 1.52 H new ATOM 0 HG2 LYS A 116 -17.994 -10.615 3.518 1.00 13.30 H new ATOM 0 HG3 LYS A 116 -17.848 -9.111 2.630 1.00 13.30 H new ATOM 0 HD2 LYS A 116 -20.200 -9.878 2.724 1.00 11.04 H new ATOM 0 HD3 LYS A 116 -19.618 -9.792 1.073 1.00 11.04 H new ATOM 0 HE2 LYS A 116 -20.926 -11.846 1.413 1.00 21.52 H new ATOM 0 HE3 LYS A 116 -19.261 -12.239 1.036 1.00 21.52 H new ATOM 0 HZ1 LYS A 116 -20.129 -13.581 2.835 1.00 4.22 H new ATOM 0 HZ2 LYS A 116 -18.834 -12.620 3.368 1.00 4.22 H new ATOM 0 HZ3 LYS A 116 -20.429 -12.191 3.763 1.00 4.22 H new ATOM 1844 N ARG A 117 -14.515 -10.174 4.078 1.00 14.41 N ATOM 1845 CA ARG A 117 -14.057 -10.440 5.425 1.00 73.41 C ATOM 1846 C ARG A 117 -14.181 -9.163 6.271 1.00 44.21 C ATOM 1847 O ARG A 117 -14.344 -8.073 5.721 1.00 34.14 O ATOM 1848 CB ARG A 117 -12.604 -10.941 5.332 1.00 2.23 C ATOM 1849 CG ARG A 117 -11.911 -11.352 6.630 1.00 70.44 C ATOM 1850 CD ARG A 117 -10.530 -11.914 6.315 1.00 43.03 C ATOM 1851 NE ARG A 117 -9.783 -12.339 7.500 1.00 74.13 N ATOM 1852 CZ ARG A 117 -8.582 -12.946 7.456 1.00 74.21 C ATOM 1853 NH1 ARG A 117 -8.019 -13.232 6.287 1.00 64.25 N ATOM 1854 NH2 ARG A 117 -7.962 -13.286 8.578 1.00 55.40 N ATOM 0 H ARG A 117 -14.173 -9.296 3.688 1.00 14.41 H new ATOM 0 HA ARG A 117 -14.662 -11.204 5.913 1.00 73.41 H new ATOM 0 HB2 ARG A 117 -12.587 -11.797 4.657 1.00 2.23 H new ATOM 0 HB3 ARG A 117 -12.007 -10.156 4.867 1.00 2.23 H new ATOM 0 HG2 ARG A 117 -11.822 -10.493 7.295 1.00 70.44 H new ATOM 0 HG3 ARG A 117 -12.508 -12.099 7.153 1.00 70.44 H new ATOM 0 HD2 ARG A 117 -10.638 -12.764 5.641 1.00 43.03 H new ATOM 0 HD3 ARG A 117 -9.952 -11.157 5.784 1.00 43.03 H new ATOM 0 HE ARG A 117 -10.198 -12.165 8.415 1.00 74.13 H new ATOM 0 HH11 ARG A 117 -8.497 -12.992 5.418 1.00 64.25 H new ATOM 0 HH12 ARG A 117 -7.109 -13.692 6.258 1.00 64.25 H new ATOM 0 HH21 ARG A 117 -8.395 -13.088 9.480 1.00 55.40 H new ATOM 0 HH22 ARG A 117 -7.052 -13.746 8.539 1.00 55.40 H new ATOM 1868 N SER A 118 -14.080 -9.313 7.591 1.00 71.34 N ATOM 1869 CA SER A 118 -14.249 -8.237 8.581 1.00 21.33 C ATOM 1870 C SER A 118 -13.128 -7.169 8.575 1.00 10.13 C ATOM 1871 O SER A 118 -12.944 -6.446 9.556 1.00 23.10 O ATOM 1872 CB SER A 118 -14.354 -8.894 9.955 1.00 15.30 C ATOM 1873 OG SER A 118 -13.284 -9.834 10.152 1.00 62.02 O ATOM 0 H SER A 118 -13.872 -10.214 8.020 1.00 71.34 H new ATOM 0 HA SER A 118 -15.151 -7.684 8.319 1.00 21.33 H new ATOM 0 HB2 SER A 118 -14.322 -8.130 10.732 1.00 15.30 H new ATOM 0 HB3 SER A 118 -15.313 -9.403 10.048 1.00 15.30 H new ATOM 0 HG SER A 118 -12.466 -9.352 10.396 1.00 62.02 H new ATOM 1879 N ALA A 119 -12.430 -7.037 7.478 1.00 1.22 N ATOM 1880 CA ALA A 119 -11.377 -6.074 7.381 1.00 72.14 C ATOM 1881 C ALA A 119 -11.944 -4.718 7.115 1.00 13.51 C ATOM 1882 O ALA A 119 -12.592 -4.481 6.090 1.00 32.51 O ATOM 1883 CB ALA A 119 -10.383 -6.469 6.316 1.00 21.23 C ATOM 0 H ALA A 119 -12.577 -7.592 6.635 1.00 1.22 H new ATOM 0 HA ALA A 119 -10.844 -6.042 8.331 1.00 72.14 H new ATOM 0 HB1 ALA A 119 -9.592 -5.721 6.261 1.00 21.23 H new ATOM 0 HB2 ALA A 119 -9.950 -7.438 6.564 1.00 21.23 H new ATOM 0 HB3 ALA A 119 -10.889 -6.534 5.352 1.00 21.23 H new ATOM 1889 N ILE A 120 -11.703 -3.826 8.050 1.00 21.24 N ATOM 1890 CA ILE A 120 -12.145 -2.441 7.970 1.00 61.40 C ATOM 1891 C ILE A 120 -11.489 -1.762 6.763 1.00 25.44 C ATOM 1892 O ILE A 120 -11.991 -0.786 6.227 1.00 32.22 O ATOM 1893 CB ILE A 120 -11.786 -1.699 9.283 1.00 53.15 C ATOM 1894 CG1 ILE A 120 -12.404 -2.456 10.471 1.00 52.23 C ATOM 1895 CG2 ILE A 120 -12.289 -0.253 9.251 1.00 65.04 C ATOM 1896 CD1 ILE A 120 -12.067 -1.885 11.822 1.00 54.51 C ATOM 0 H ILE A 120 -11.187 -4.040 8.903 1.00 21.24 H new ATOM 0 HA ILE A 120 -13.227 -2.408 7.842 1.00 61.40 H new ATOM 0 HB ILE A 120 -10.702 -1.669 9.391 1.00 53.15 H new ATOM 0 HG12 ILE A 120 -13.488 -2.465 10.355 1.00 52.23 H new ATOM 0 HG13 ILE A 120 -12.071 -3.493 10.436 1.00 52.23 H new ATOM 0 HG21 ILE A 120 -12.024 0.245 10.184 1.00 65.04 H new ATOM 0 HG22 ILE A 120 -11.829 0.274 8.415 1.00 65.04 H new ATOM 0 HG23 ILE A 120 -13.372 -0.247 9.131 1.00 65.04 H new ATOM 0 HD11 ILE A 120 -12.545 -2.482 12.599 1.00 54.51 H new ATOM 0 HD12 ILE A 120 -10.987 -1.902 11.965 1.00 54.51 H new ATOM 0 HD13 ILE A 120 -12.425 -0.857 11.882 1.00 54.51 H new ATOM 1908 N LEU A 121 -10.383 -2.348 6.323 1.00 40.21 N ATOM 1909 CA LEU A 121 -9.649 -1.907 5.147 1.00 62.11 C ATOM 1910 C LEU A 121 -10.559 -1.912 3.944 1.00 23.32 C ATOM 1911 O LEU A 121 -10.450 -1.066 3.088 1.00 50.31 O ATOM 1912 CB LEU A 121 -8.463 -2.830 4.824 1.00 51.22 C ATOM 1913 CG LEU A 121 -7.352 -2.996 5.854 1.00 72.41 C ATOM 1914 CD1 LEU A 121 -6.813 -1.667 6.326 1.00 43.34 C ATOM 1915 CD2 LEU A 121 -7.757 -3.885 7.006 1.00 62.31 C ATOM 0 H LEU A 121 -9.965 -3.157 6.782 1.00 40.21 H new ATOM 0 HA LEU A 121 -9.278 -0.906 5.367 1.00 62.11 H new ATOM 0 HB2 LEU A 121 -8.866 -3.821 4.612 1.00 51.22 H new ATOM 0 HB3 LEU A 121 -8.006 -2.468 3.903 1.00 51.22 H new ATOM 0 HG LEU A 121 -6.535 -3.507 5.344 1.00 72.41 H new ATOM 0 HD11 LEU A 121 -6.024 -1.834 7.059 1.00 43.34 H new ATOM 0 HD12 LEU A 121 -6.409 -1.116 5.477 1.00 43.34 H new ATOM 0 HD13 LEU A 121 -7.617 -1.090 6.784 1.00 43.34 H new ATOM 0 HD21 LEU A 121 -6.929 -3.969 7.710 1.00 62.31 H new ATOM 0 HD22 LEU A 121 -8.621 -3.454 7.512 1.00 62.31 H new ATOM 0 HD23 LEU A 121 -8.014 -4.875 6.629 1.00 62.31 H new ATOM 1927 N LYS A 122 -11.469 -2.873 3.907 1.00 30.42 N ATOM 1928 CA LYS A 122 -12.392 -3.018 2.808 1.00 64.34 C ATOM 1929 C LYS A 122 -13.306 -1.790 2.770 1.00 52.11 C ATOM 1930 O LYS A 122 -13.615 -1.277 1.710 1.00 34.20 O ATOM 1931 CB LYS A 122 -13.173 -4.363 2.966 1.00 52.43 C ATOM 1932 CG LYS A 122 -14.054 -4.810 1.781 1.00 52.22 C ATOM 1933 CD LYS A 122 -15.338 -4.004 1.612 1.00 61.20 C ATOM 1934 CE LYS A 122 -16.288 -4.219 2.774 1.00 4.34 C ATOM 1935 NZ LYS A 122 -17.554 -3.489 2.584 1.00 35.24 N ATOM 0 H LYS A 122 -11.583 -3.571 4.642 1.00 30.42 H new ATOM 0 HA LYS A 122 -11.871 -3.066 1.852 1.00 64.34 H new ATOM 0 HB2 LYS A 122 -12.449 -5.153 3.165 1.00 52.43 H new ATOM 0 HB3 LYS A 122 -13.808 -4.283 3.848 1.00 52.43 H new ATOM 0 HG2 LYS A 122 -13.471 -4.738 0.863 1.00 52.22 H new ATOM 0 HG3 LYS A 122 -14.313 -5.860 1.913 1.00 52.22 H new ATOM 0 HD2 LYS A 122 -15.095 -2.944 1.531 1.00 61.20 H new ATOM 0 HD3 LYS A 122 -15.829 -4.291 0.682 1.00 61.20 H new ATOM 0 HE2 LYS A 122 -16.494 -5.284 2.883 1.00 4.34 H new ATOM 0 HE3 LYS A 122 -15.813 -3.890 3.698 1.00 4.34 H new ATOM 0 HZ1 LYS A 122 -17.710 -2.850 3.389 1.00 35.24 H new ATOM 0 HZ2 LYS A 122 -17.506 -2.934 1.706 1.00 35.24 H new ATOM 0 HZ3 LYS A 122 -18.340 -4.167 2.523 1.00 35.24 H new ATOM 1949 N MET A 123 -13.674 -1.298 3.946 1.00 51.13 N ATOM 1950 CA MET A 123 -14.520 -0.116 4.047 1.00 34.43 C ATOM 1951 C MET A 123 -13.724 1.113 3.645 1.00 72.22 C ATOM 1952 O MET A 123 -14.201 1.961 2.904 1.00 75.20 O ATOM 1953 CB MET A 123 -15.046 0.093 5.483 1.00 2.54 C ATOM 1954 CG MET A 123 -15.817 -1.077 6.071 1.00 54.42 C ATOM 1955 SD MET A 123 -17.209 -1.606 5.035 1.00 61.23 S ATOM 1956 CE MET A 123 -18.213 -0.117 4.988 1.00 13.11 C ATOM 0 H MET A 123 -13.400 -1.699 4.843 1.00 51.13 H new ATOM 0 HA MET A 123 -15.371 -0.265 3.383 1.00 34.43 H new ATOM 0 HB2 MET A 123 -14.199 0.312 6.134 1.00 2.54 H new ATOM 0 HB3 MET A 123 -15.690 0.972 5.491 1.00 2.54 H new ATOM 0 HG2 MET A 123 -15.138 -1.917 6.213 1.00 54.42 H new ATOM 0 HG3 MET A 123 -16.191 -0.799 7.057 1.00 54.42 H new ATOM 0 HE1 MET A 123 -19.193 -0.352 4.572 1.00 13.11 H new ATOM 0 HE2 MET A 123 -18.332 0.274 5.999 1.00 13.11 H new ATOM 0 HE3 MET A 123 -17.724 0.632 4.365 1.00 13.11 H new ATOM 1966 N ILE A 124 -12.495 1.179 4.122 1.00 11.55 N ATOM 1967 CA ILE A 124 -11.638 2.331 3.884 1.00 62.14 C ATOM 1968 C ILE A 124 -11.241 2.435 2.406 1.00 23.13 C ATOM 1969 O ILE A 124 -11.460 3.462 1.769 1.00 22.01 O ATOM 1970 CB ILE A 124 -10.327 2.253 4.730 1.00 1.24 C ATOM 1971 CG1 ILE A 124 -10.622 2.041 6.231 1.00 1.21 C ATOM 1972 CG2 ILE A 124 -9.474 3.505 4.526 1.00 72.21 C ATOM 1973 CD1 ILE A 124 -11.465 3.116 6.881 1.00 60.34 C ATOM 0 H ILE A 124 -12.063 0.443 4.681 1.00 11.55 H new ATOM 0 HA ILE A 124 -12.215 3.208 4.177 1.00 62.14 H new ATOM 0 HB ILE A 124 -9.768 1.386 4.378 1.00 1.24 H new ATOM 0 HG12 ILE A 124 -11.127 1.083 6.354 1.00 1.21 H new ATOM 0 HG13 ILE A 124 -9.674 1.973 6.765 1.00 1.21 H new ATOM 0 HG21 ILE A 124 -8.566 3.428 5.125 1.00 72.21 H new ATOM 0 HG22 ILE A 124 -9.207 3.596 3.473 1.00 72.21 H new ATOM 0 HG23 ILE A 124 -10.039 4.385 4.835 1.00 72.21 H new ATOM 0 HD11 ILE A 124 -11.615 2.874 7.933 1.00 60.34 H new ATOM 0 HD12 ILE A 124 -10.957 4.077 6.798 1.00 60.34 H new ATOM 0 HD13 ILE A 124 -12.432 3.173 6.381 1.00 60.34 H new ATOM 1985 N LEU A 125 -10.713 1.345 1.873 1.00 62.42 N ATOM 1986 CA LEU A 125 -10.130 1.308 0.532 1.00 22.52 C ATOM 1987 C LEU A 125 -11.203 1.583 -0.526 1.00 12.22 C ATOM 1988 O LEU A 125 -11.004 2.398 -1.423 1.00 44.15 O ATOM 1989 CB LEU A 125 -9.465 -0.084 0.308 1.00 70.15 C ATOM 1990 CG LEU A 125 -8.382 -0.240 -0.801 1.00 12.04 C ATOM 1991 CD1 LEU A 125 -8.883 0.081 -2.195 1.00 75.13 C ATOM 1992 CD2 LEU A 125 -7.145 0.573 -0.463 1.00 24.24 C ATOM 0 H LEU A 125 -10.674 0.450 2.360 1.00 62.42 H new ATOM 0 HA LEU A 125 -9.371 2.085 0.439 1.00 22.52 H new ATOM 0 HB2 LEU A 125 -9.013 -0.387 1.252 1.00 70.15 H new ATOM 0 HB3 LEU A 125 -10.261 -0.797 0.092 1.00 70.15 H new ATOM 0 HG LEU A 125 -8.119 -1.298 -0.819 1.00 12.04 H new ATOM 0 HD11 LEU A 125 -8.073 -0.050 -2.912 1.00 75.13 H new ATOM 0 HD12 LEU A 125 -9.705 -0.588 -2.449 1.00 75.13 H new ATOM 0 HD13 LEU A 125 -9.232 1.113 -2.227 1.00 75.13 H new ATOM 0 HD21 LEU A 125 -6.402 0.449 -1.251 1.00 24.24 H new ATOM 0 HD22 LEU A 125 -7.413 1.626 -0.379 1.00 24.24 H new ATOM 0 HD23 LEU A 125 -6.730 0.228 0.484 1.00 24.24 H new ATOM 2004 N MET A 126 -12.351 0.934 -0.389 1.00 63.44 N ATOM 2005 CA MET A 126 -13.433 1.073 -1.375 1.00 51.21 C ATOM 2006 C MET A 126 -14.063 2.450 -1.323 1.00 4.50 C ATOM 2007 O MET A 126 -14.718 2.875 -2.271 1.00 4.23 O ATOM 2008 CB MET A 126 -14.519 0.013 -1.177 1.00 65.32 C ATOM 2009 CG MET A 126 -14.105 -1.455 -1.340 1.00 20.14 C ATOM 2010 SD MET A 126 -13.779 -2.028 -3.046 1.00 32.05 S ATOM 2011 CE MET A 126 -12.295 -1.155 -3.550 1.00 31.32 C ATOM 0 H MET A 126 -12.564 0.308 0.388 1.00 63.44 H new ATOM 0 HA MET A 126 -12.976 0.930 -2.354 1.00 51.21 H new ATOM 0 HB2 MET A 126 -14.934 0.138 -0.177 1.00 65.32 H new ATOM 0 HB3 MET A 126 -15.323 0.217 -1.884 1.00 65.32 H new ATOM 0 HG2 MET A 126 -13.207 -1.624 -0.746 1.00 20.14 H new ATOM 0 HG3 MET A 126 -14.890 -2.080 -0.915 1.00 20.14 H new ATOM 0 HE1 MET A 126 -11.620 -1.846 -4.055 1.00 31.32 H new ATOM 0 HE2 MET A 126 -12.562 -0.346 -4.230 1.00 31.32 H new ATOM 0 HE3 MET A 126 -11.800 -0.741 -2.671 1.00 31.32 H new ATOM 2021 N TYR A 127 -13.861 3.151 -0.237 1.00 12.03 N ATOM 2022 CA TYR A 127 -14.468 4.439 -0.084 1.00 51.13 C ATOM 2023 C TYR A 127 -13.495 5.551 -0.500 1.00 13.34 C ATOM 2024 O TYR A 127 -13.884 6.720 -0.616 1.00 50.52 O ATOM 2025 CB TYR A 127 -14.941 4.636 1.364 1.00 12.32 C ATOM 2026 CG TYR A 127 -15.850 5.825 1.543 1.00 63.02 C ATOM 2027 CD1 TYR A 127 -17.182 5.743 1.195 1.00 52.41 C ATOM 2028 CD2 TYR A 127 -15.380 7.025 2.044 1.00 34.43 C ATOM 2029 CE1 TYR A 127 -18.022 6.814 1.336 1.00 54.23 C ATOM 2030 CE2 TYR A 127 -16.217 8.109 2.193 1.00 11.01 C ATOM 2031 CZ TYR A 127 -17.538 7.996 1.835 1.00 61.34 C ATOM 2032 OH TYR A 127 -18.386 9.079 1.968 1.00 32.22 O ATOM 0 H TYR A 127 -13.283 2.850 0.548 1.00 12.03 H new ATOM 0 HA TYR A 127 -15.338 4.493 -0.739 1.00 51.13 H new ATOM 0 HB2 TYR A 127 -15.463 3.737 1.693 1.00 12.32 H new ATOM 0 HB3 TYR A 127 -14.071 4.754 2.009 1.00 12.32 H new ATOM 0 HD1 TYR A 127 -17.570 4.814 0.803 1.00 52.41 H new ATOM 0 HD2 TYR A 127 -14.340 7.114 2.323 1.00 34.43 H new ATOM 0 HE1 TYR A 127 -19.061 6.729 1.056 1.00 54.23 H new ATOM 0 HE2 TYR A 127 -15.838 9.040 2.588 1.00 11.01 H new ATOM 0 HH TYR A 127 -17.890 9.840 2.337 1.00 32.22 H new ATOM 2042 N GLU A 128 -12.244 5.195 -0.738 1.00 24.32 N ATOM 2043 CA GLU A 128 -11.249 6.185 -1.108 1.00 75.53 C ATOM 2044 C GLU A 128 -11.519 6.868 -2.432 1.00 54.34 C ATOM 2045 O GLU A 128 -11.963 6.243 -3.416 1.00 63.55 O ATOM 2046 CB GLU A 128 -9.818 5.687 -0.977 1.00 21.25 C ATOM 2047 CG GLU A 128 -9.381 5.544 0.470 1.00 61.23 C ATOM 2048 CD GLU A 128 -9.518 6.860 1.221 1.00 24.30 C ATOM 2049 OE1 GLU A 128 -8.613 7.713 1.122 1.00 12.12 O ATOM 2050 OE2 GLU A 128 -10.551 7.081 1.891 1.00 53.04 O ATOM 0 H GLU A 128 -11.896 4.238 -0.682 1.00 24.32 H new ATOM 0 HA GLU A 128 -11.357 6.969 -0.359 1.00 75.53 H new ATOM 0 HB2 GLU A 128 -9.725 4.723 -1.478 1.00 21.25 H new ATOM 0 HB3 GLU A 128 -9.148 6.378 -1.489 1.00 21.25 H new ATOM 0 HG2 GLU A 128 -9.983 4.779 0.960 1.00 61.23 H new ATOM 0 HG3 GLU A 128 -8.345 5.207 0.508 1.00 61.23 H new