USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 957 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 88 LYS NZ :NH3+ 158:sc= 1.28 (180deg=0) USER MOD Set 1.2: A 108 ASN : amide:sc= -0.797! K(o=0.48!,f=-4.7) USER MOD Set 2.1: A 77 HIS : no HE2:sc= 0.675 K(o=0.13,f=-3.3) USER MOD Set 2.2: A 84 SER OG : rot -176:sc= -0.542 USER MOD Set 3.1: A 76 HIS : no HE2:sc= -1.61! C(o=-1.6!,f=-3.5!) USER MOD Set 3.2: A 129 MET CE :methyl -179:sc= 0 (180deg=-0.00204) USER MOD Set 4.1: A 73 MET CE :methyl -153:sc= -0.616 (180deg=-0.912) USER MOD Set 4.2: A 164 MET CE :methyl -142:sc= -2.53 (180deg=-4.03!) USER MOD Set 5.1: A 63 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.0282 USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.00218 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 76:sc= -1 USER MOD Single : A 66 LYS NZ :NH3+ 166:sc= -0.0709 (180deg=-0.337) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.0815 X(o=-0.082,f=-0.35) USER MOD Single : A 70 LYS NZ :NH3+ 133:sc= 1.28 (180deg=0.258) USER MOD Single : A 81 CYS SG : rot 16:sc= -1.53! USER MOD Single : A 83 HIS : no HD1:sc= -0.0107 X(o=-0.011,f=-0.35) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -3.41! K(o=-3.4!,f=-0.43) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 GLN : amide:sc= -0.602 K(o=-0.6,f=-1.8!) USER MOD Single : A 99 LYS NZ :NH3+ 170:sc= -0.0156 (180deg=-0.158) USER MOD Single : A 103 GLN : amide:sc= 0.428 X(o=0.43,f=0) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot -40:sc= 0.651 USER MOD Single : A 114 THR OG1 : rot 41:sc= -1.39! USER MOD Single : A 116 LYS NZ :NH3+ 165:sc= -0.0367 (180deg=-0.291) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 95:sc= 1.29 USER MOD Single : A 136 THR OG1 : rot 180:sc= -0.164 USER MOD Single : A 142 THR OG1 : rot 180:sc= 0.0605 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot -35:sc= 0.346 USER MOD Single : A 147 ASN : amide:sc= 0.205 K(o=0.2,f=-4.9!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot -170:sc= 0 USER MOD Single : A 163 ASN : amide:sc= -0.254 K(o=-0.25,f=-2) USER MOD Single : A 165 LYS NZ :NH3+ -167:sc= 0.57 (180deg=-0.0628!) USER MOD Single : A 166 LYS NZ :NH3+ 171:sc= 1.26 (180deg=0.821) USER MOD Single : A 169 LYS NZ :NH3+ -172:sc= -0.0009 (180deg=-0.0935) USER MOD ----------------------------------------------------------------- ATOM 286 N TRP A 54 -15.924 5.179 2.383 1.00 0.00 N ATOM 287 CA TRP A 54 -15.599 6.583 2.500 1.00 0.00 C ATOM 288 C TRP A 54 -14.601 6.781 3.624 1.00 0.00 C ATOM 289 O TRP A 54 -14.758 6.196 4.702 1.00 0.00 O ATOM 290 CB TRP A 54 -16.856 7.425 2.734 1.00 0.00 C ATOM 291 CG TRP A 54 -17.802 7.411 1.572 1.00 0.00 C ATOM 292 CD1 TRP A 54 -18.982 6.731 1.479 1.00 0.00 C ATOM 293 CD2 TRP A 54 -17.640 8.105 0.328 1.00 0.00 C ATOM 294 NE1 TRP A 54 -19.564 6.964 0.257 1.00 0.00 N ATOM 295 CE2 TRP A 54 -18.761 7.803 -0.467 1.00 0.00 C ATOM 296 CE3 TRP A 54 -16.655 8.954 -0.189 1.00 0.00 C ATOM 297 CZ2 TRP A 54 -18.925 8.320 -1.751 1.00 0.00 C ATOM 298 CZ3 TRP A 54 -16.820 9.464 -1.463 1.00 0.00 C ATOM 299 CH2 TRP A 54 -17.946 9.146 -2.230 1.00 0.00 C ATOM 0 HA TRP A 54 -15.153 6.917 1.563 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -17.373 7.055 3.619 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -16.562 8.454 2.943 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -19.397 6.102 2.253 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -20.452 6.574 -0.060 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -15.783 9.206 0.396 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -19.793 8.077 -2.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -16.066 10.120 -1.874 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -18.044 9.562 -3.222 1.00 0.00 H new ATOM 310 N THR A 55 -13.578 7.585 3.356 1.00 0.00 N ATOM 311 CA THR A 55 -12.493 7.845 4.296 1.00 0.00 C ATOM 312 C THR A 55 -13.009 8.100 5.720 1.00 0.00 C ATOM 313 O THR A 55 -13.679 9.104 5.986 1.00 0.00 O ATOM 314 CB THR A 55 -11.658 9.049 3.822 1.00 0.00 C ATOM 315 OG1 THR A 55 -11.350 8.894 2.423 1.00 0.00 O ATOM 316 CG2 THR A 55 -10.359 9.155 4.615 1.00 0.00 C ATOM 0 H THR A 55 -13.477 8.080 2.470 1.00 0.00 H new ATOM 0 HA THR A 55 -11.869 6.952 4.325 1.00 0.00 H new ATOM 0 HB THR A 55 -12.238 9.958 3.981 1.00 0.00 H new ATOM 0 HG1 THR A 55 -10.820 9.660 2.118 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.786 10.013 4.262 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.588 9.282 5.673 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.773 8.246 4.477 1.00 0.00 H new ATOM 324 N GLN A 56 -12.716 7.165 6.612 1.00 0.00 N ATOM 325 CA GLN A 56 -13.122 7.269 8.000 1.00 0.00 C ATOM 326 C GLN A 56 -12.038 7.938 8.825 1.00 0.00 C ATOM 327 O GLN A 56 -11.012 8.365 8.291 1.00 0.00 O ATOM 328 CB GLN A 56 -13.420 5.886 8.585 1.00 0.00 C ATOM 329 CG GLN A 56 -14.646 5.211 8.003 1.00 0.00 C ATOM 330 CD GLN A 56 -15.044 3.981 8.789 1.00 0.00 C ATOM 331 OE1 GLN A 56 -14.627 2.865 8.483 1.00 0.00 O ATOM 332 NE2 GLN A 56 -15.832 4.186 9.827 1.00 0.00 N ATOM 0 H GLN A 56 -12.192 6.318 6.392 1.00 0.00 H new ATOM 0 HA GLN A 56 -14.028 7.874 8.036 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -12.555 5.243 8.424 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -13.550 5.981 9.663 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -15.476 5.917 7.990 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -14.449 4.932 6.968 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -16.154 5.129 10.044 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -16.119 3.401 10.412 1.00 0.00 H new ATOM 341 N THR A 57 -12.264 8.024 10.118 1.00 0.00 N ATOM 342 CA THR A 57 -11.300 8.607 11.012 1.00 0.00 C ATOM 343 C THR A 57 -10.246 7.578 11.403 1.00 0.00 C ATOM 344 O THR A 57 -10.438 6.369 11.200 1.00 0.00 O ATOM 345 CB THR A 57 -11.981 9.162 12.277 1.00 0.00 C ATOM 346 OG1 THR A 57 -12.801 8.148 12.873 1.00 0.00 O ATOM 347 CG2 THR A 57 -12.836 10.373 11.938 1.00 0.00 C ATOM 0 H THR A 57 -13.116 7.693 10.572 1.00 0.00 H new ATOM 0 HA THR A 57 -10.818 9.433 10.489 1.00 0.00 H new ATOM 0 HB THR A 57 -11.206 9.466 12.981 1.00 0.00 H new ATOM 0 HG1 THR A 57 -13.230 8.506 13.678 1.00 0.00 H new ATOM 0 HG21 THR A 57 -13.308 10.750 12.845 1.00 0.00 H new ATOM 0 HG22 THR A 57 -12.208 11.152 11.505 1.00 0.00 H new ATOM 0 HG23 THR A 57 -13.605 10.086 11.221 1.00 0.00 H new ATOM 355 N TYR A 58 -9.143 8.054 11.963 1.00 0.00 N ATOM 356 CA TYR A 58 -8.038 7.193 12.362 1.00 0.00 C ATOM 357 C TYR A 58 -8.512 6.100 13.318 1.00 0.00 C ATOM 358 O TYR A 58 -8.264 4.918 13.091 1.00 0.00 O ATOM 359 CB TYR A 58 -6.935 8.039 13.015 1.00 0.00 C ATOM 360 CG TYR A 58 -5.686 7.269 13.406 1.00 0.00 C ATOM 361 CD1 TYR A 58 -4.805 6.797 12.441 1.00 0.00 C ATOM 362 CD2 TYR A 58 -5.381 7.031 14.742 1.00 0.00 C ATOM 363 CE1 TYR A 58 -3.657 6.112 12.795 1.00 0.00 C ATOM 364 CE2 TYR A 58 -4.239 6.344 15.105 1.00 0.00 C ATOM 365 CZ TYR A 58 -3.379 5.888 14.128 1.00 0.00 C ATOM 366 OH TYR A 58 -2.233 5.208 14.485 1.00 0.00 O ATOM 0 H TYR A 58 -8.989 9.044 12.153 1.00 0.00 H new ATOM 0 HA TYR A 58 -7.637 6.705 11.473 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -6.653 8.835 12.327 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -7.343 8.517 13.905 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -5.020 6.968 11.397 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -6.050 7.390 15.510 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -2.981 5.754 12.032 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -4.021 6.165 16.147 1.00 0.00 H new ATOM 0 HH TYR A 58 -2.186 5.136 15.461 1.00 0.00 H new ATOM 376 N GLU A 59 -9.223 6.502 14.359 1.00 0.00 N ATOM 377 CA GLU A 59 -9.691 5.569 15.376 1.00 0.00 C ATOM 378 C GLU A 59 -10.727 4.581 14.831 1.00 0.00 C ATOM 379 O GLU A 59 -10.763 3.426 15.255 1.00 0.00 O ATOM 380 CB GLU A 59 -10.271 6.312 16.588 1.00 0.00 C ATOM 381 CG GLU A 59 -9.275 7.188 17.346 1.00 0.00 C ATOM 382 CD GLU A 59 -8.854 8.414 16.568 1.00 0.00 C ATOM 383 OE1 GLU A 59 -9.746 9.112 16.028 1.00 0.00 O ATOM 384 OE2 GLU A 59 -7.643 8.677 16.477 1.00 0.00 O ATOM 0 H GLU A 59 -9.491 7.472 14.524 1.00 0.00 H new ATOM 0 HA GLU A 59 -8.818 4.998 15.691 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.098 6.937 16.250 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.687 5.579 17.279 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -9.720 7.499 18.291 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.392 6.597 17.589 1.00 0.00 H new ATOM 391 N ALA A 60 -11.573 5.020 13.899 1.00 0.00 N ATOM 392 CA ALA A 60 -12.611 4.148 13.354 1.00 0.00 C ATOM 393 C ALA A 60 -12.023 3.077 12.446 1.00 0.00 C ATOM 394 O ALA A 60 -12.427 1.912 12.497 1.00 0.00 O ATOM 395 CB ALA A 60 -13.651 4.966 12.607 1.00 0.00 C ATOM 0 H ALA A 60 -11.560 5.963 13.510 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.093 3.643 14.191 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -14.417 4.302 12.207 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -14.110 5.681 13.290 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.172 5.503 11.788 1.00 0.00 H new ATOM 401 N ALA A 61 -11.064 3.467 11.616 1.00 0.00 N ATOM 402 CA ALA A 61 -10.419 2.527 10.712 1.00 0.00 C ATOM 403 C ALA A 61 -9.637 1.485 11.501 1.00 0.00 C ATOM 404 O ALA A 61 -9.547 0.320 11.099 1.00 0.00 O ATOM 405 CB ALA A 61 -9.515 3.257 9.743 1.00 0.00 C ATOM 0 H ALA A 61 -10.718 4.424 11.551 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.189 2.014 10.136 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -9.041 2.538 9.075 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.104 3.963 9.157 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -8.748 3.797 10.298 1.00 0.00 H new ATOM 411 N LEU A 62 -9.068 1.918 12.624 1.00 0.00 N ATOM 412 CA LEU A 62 -8.356 1.014 13.520 1.00 0.00 C ATOM 413 C LEU A 62 -9.274 -0.119 13.972 1.00 0.00 C ATOM 414 O LEU A 62 -8.854 -1.274 14.073 1.00 0.00 O ATOM 415 CB LEU A 62 -7.811 1.759 14.742 1.00 0.00 C ATOM 416 CG LEU A 62 -6.712 2.796 14.481 1.00 0.00 C ATOM 417 CD1 LEU A 62 -6.190 3.353 15.795 1.00 0.00 C ATOM 418 CD2 LEU A 62 -5.574 2.194 13.675 1.00 0.00 C ATOM 0 H LEU A 62 -9.087 2.890 12.934 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.514 0.596 12.969 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.644 2.262 15.234 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.424 1.022 15.445 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.145 3.610 13.900 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.410 4.088 15.595 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.006 3.829 16.338 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.778 2.542 16.396 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -4.809 2.951 13.504 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.141 1.358 14.225 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.954 1.840 12.717 1.00 0.00 H new ATOM 430 N TYR A 63 -10.536 0.219 14.226 1.00 0.00 N ATOM 431 CA TYR A 63 -11.525 -0.768 14.629 1.00 0.00 C ATOM 432 C TYR A 63 -11.793 -1.749 13.496 1.00 0.00 C ATOM 433 O TYR A 63 -11.824 -2.960 13.710 1.00 0.00 O ATOM 434 CB TYR A 63 -12.831 -0.089 15.064 1.00 0.00 C ATOM 435 CG TYR A 63 -13.974 -1.060 15.291 1.00 0.00 C ATOM 436 CD1 TYR A 63 -14.044 -1.829 16.446 1.00 0.00 C ATOM 437 CD2 TYR A 63 -14.977 -1.214 14.340 1.00 0.00 C ATOM 438 CE1 TYR A 63 -15.080 -2.723 16.645 1.00 0.00 C ATOM 439 CE2 TYR A 63 -16.015 -2.103 14.534 1.00 0.00 C ATOM 440 CZ TYR A 63 -16.061 -2.855 15.686 1.00 0.00 C ATOM 441 OH TYR A 63 -17.091 -3.748 15.878 1.00 0.00 O ATOM 0 H TYR A 63 -10.895 1.171 14.159 1.00 0.00 H new ATOM 0 HA TYR A 63 -11.125 -1.318 15.481 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -12.652 0.469 15.983 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -13.125 0.634 14.304 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -13.278 -1.727 17.200 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -14.943 -0.628 13.434 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -15.120 -3.315 17.547 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -16.787 -2.208 13.786 1.00 0.00 H new ATOM 0 HH TYR A 63 -17.698 -3.718 15.109 1.00 0.00 H new ATOM 451 N LYS A 64 -11.986 -1.215 12.287 1.00 0.00 N ATOM 452 CA LYS A 64 -12.243 -2.045 11.107 1.00 0.00 C ATOM 453 C LYS A 64 -11.130 -3.061 10.920 1.00 0.00 C ATOM 454 O LYS A 64 -11.379 -4.245 10.700 1.00 0.00 O ATOM 455 CB LYS A 64 -12.361 -1.177 9.847 1.00 0.00 C ATOM 456 CG LYS A 64 -13.510 -0.184 9.876 1.00 0.00 C ATOM 457 CD LYS A 64 -14.848 -0.884 10.054 1.00 0.00 C ATOM 458 CE LYS A 64 -16.000 0.098 9.966 1.00 0.00 C ATOM 459 NZ LYS A 64 -17.306 -0.557 10.218 1.00 0.00 N ATOM 0 H LYS A 64 -11.969 -0.213 12.100 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.185 -2.570 11.264 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.428 -0.631 9.708 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.481 -1.828 8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -13.358 0.525 10.689 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.519 0.390 8.950 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -14.963 -1.652 9.290 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -14.871 -1.389 11.020 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -15.850 0.899 10.690 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.010 0.559 8.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -18.067 0.148 10.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -17.461 -1.305 9.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -17.307 -0.975 11.170 1.00 0.00 H new ATOM 473 N SER A 65 -9.909 -2.586 11.035 1.00 0.00 N ATOM 474 CA SER A 65 -8.733 -3.417 10.881 1.00 0.00 C ATOM 475 C SER A 65 -8.734 -4.589 11.873 1.00 0.00 C ATOM 476 O SER A 65 -8.364 -5.706 11.524 1.00 0.00 O ATOM 477 CB SER A 65 -7.482 -2.564 11.065 1.00 0.00 C ATOM 478 OG SER A 65 -7.537 -1.414 10.232 1.00 0.00 O ATOM 0 H SER A 65 -9.702 -1.608 11.239 1.00 0.00 H new ATOM 0 HA SER A 65 -8.742 -3.842 9.877 1.00 0.00 H new ATOM 0 HB2 SER A 65 -7.392 -2.261 12.108 1.00 0.00 H new ATOM 0 HB3 SER A 65 -6.596 -3.152 10.826 1.00 0.00 H new ATOM 0 HG SER A 65 -8.156 -0.760 10.618 1.00 0.00 H new ATOM 484 N LYS A 66 -9.171 -4.338 13.101 1.00 0.00 N ATOM 485 CA LYS A 66 -9.180 -5.372 14.122 1.00 0.00 C ATOM 486 C LYS A 66 -10.394 -6.297 13.997 1.00 0.00 C ATOM 487 O LYS A 66 -10.277 -7.507 14.190 1.00 0.00 O ATOM 488 CB LYS A 66 -9.147 -4.747 15.518 1.00 0.00 C ATOM 489 CG LYS A 66 -9.091 -5.767 16.647 1.00 0.00 C ATOM 490 CD LYS A 66 -9.086 -5.097 18.012 1.00 0.00 C ATOM 491 CE LYS A 66 -8.997 -6.123 19.133 1.00 0.00 C ATOM 492 NZ LYS A 66 -7.766 -6.947 19.037 1.00 0.00 N ATOM 0 H LYS A 66 -9.522 -3.432 13.411 1.00 0.00 H new ATOM 0 HA LYS A 66 -8.285 -5.976 13.972 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -8.280 -4.090 15.591 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -10.032 -4.124 15.648 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -9.947 -6.438 16.574 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -8.196 -6.380 16.539 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -8.243 -4.409 18.078 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -9.992 -4.503 18.131 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -9.016 -5.611 20.095 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -9.872 -6.773 19.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -7.621 -7.461 19.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -7.864 -7.628 18.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -6.948 -6.330 18.856 1.00 0.00 H new ATOM 506 N THR A 67 -11.545 -5.745 13.644 1.00 0.00 N ATOM 507 CA THR A 67 -12.766 -6.535 13.599 1.00 0.00 C ATOM 508 C THR A 67 -12.840 -7.381 12.325 1.00 0.00 C ATOM 509 O THR A 67 -13.396 -8.483 12.329 1.00 0.00 O ATOM 510 CB THR A 67 -14.036 -5.649 13.739 1.00 0.00 C ATOM 511 OG1 THR A 67 -15.192 -6.469 13.908 1.00 0.00 O ATOM 512 CG2 THR A 67 -14.226 -4.767 12.524 1.00 0.00 C ATOM 0 H THR A 67 -11.659 -4.764 13.387 1.00 0.00 H new ATOM 0 HA THR A 67 -12.735 -7.209 14.455 1.00 0.00 H new ATOM 0 HB THR A 67 -13.902 -5.014 14.615 1.00 0.00 H new ATOM 0 HG1 THR A 67 -15.986 -5.901 13.997 1.00 0.00 H new ATOM 0 HG21 THR A 67 -15.122 -4.160 12.652 1.00 0.00 H new ATOM 0 HG22 THR A 67 -13.360 -4.116 12.408 1.00 0.00 H new ATOM 0 HG23 THR A 67 -14.333 -5.390 11.636 1.00 0.00 H new ATOM 520 N SER A 68 -12.267 -6.876 11.247 1.00 0.00 N ATOM 521 CA SER A 68 -12.257 -7.592 9.989 1.00 0.00 C ATOM 522 C SER A 68 -10.906 -8.277 9.782 1.00 0.00 C ATOM 523 O SER A 68 -10.671 -8.917 8.755 1.00 0.00 O ATOM 524 CB SER A 68 -12.558 -6.629 8.841 1.00 0.00 C ATOM 525 OG SER A 68 -13.754 -5.904 9.090 1.00 0.00 O ATOM 0 H SER A 68 -11.801 -5.969 11.220 1.00 0.00 H new ATOM 0 HA SER A 68 -13.029 -8.361 10.009 1.00 0.00 H new ATOM 0 HB2 SER A 68 -11.727 -5.935 8.715 1.00 0.00 H new ATOM 0 HB3 SER A 68 -12.653 -7.186 7.909 1.00 0.00 H new ATOM 0 HG SER A 68 -13.927 -5.292 8.344 1.00 0.00 H new ATOM 531 N ASN A 69 -10.032 -8.140 10.794 1.00 0.00 N ATOM 532 CA ASN A 69 -8.668 -8.720 10.774 1.00 0.00 C ATOM 533 C ASN A 69 -7.890 -8.243 9.527 1.00 0.00 C ATOM 534 O ASN A 69 -6.910 -8.856 9.105 1.00 0.00 O ATOM 535 CB ASN A 69 -8.753 -10.262 10.810 1.00 0.00 C ATOM 536 CG ASN A 69 -7.445 -10.935 11.215 1.00 0.00 C ATOM 537 OD1 ASN A 69 -6.627 -11.305 10.372 1.00 0.00 O ATOM 538 ND2 ASN A 69 -7.248 -11.102 12.506 1.00 0.00 N ATOM 0 H ASN A 69 -10.246 -7.626 11.649 1.00 0.00 H new ATOM 0 HA ASN A 69 -8.127 -8.378 11.657 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -9.536 -10.558 11.508 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -9.049 -10.625 9.826 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -6.394 -11.551 12.838 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -7.949 -10.782 13.174 1.00 0.00 H new ATOM 545 N LYS A 70 -8.328 -7.126 8.973 1.00 0.00 N ATOM 546 CA LYS A 70 -7.733 -6.560 7.776 1.00 0.00 C ATOM 547 C LYS A 70 -6.544 -5.700 8.139 1.00 0.00 C ATOM 548 O LYS A 70 -6.691 -4.725 8.869 1.00 0.00 O ATOM 549 CB LYS A 70 -8.765 -5.698 7.034 1.00 0.00 C ATOM 550 CG LYS A 70 -9.972 -6.467 6.516 1.00 0.00 C ATOM 551 CD LYS A 70 -9.722 -7.068 5.140 1.00 0.00 C ATOM 552 CE LYS A 70 -9.656 -5.988 4.060 1.00 0.00 C ATOM 553 NZ LYS A 70 -9.601 -6.565 2.692 1.00 0.00 N ATOM 0 H LYS A 70 -9.109 -6.584 9.342 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.407 -7.378 7.133 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.111 -4.911 7.704 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -8.274 -5.208 6.193 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -10.223 -7.262 7.218 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -10.833 -5.800 6.469 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.788 -7.630 5.152 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.516 -7.775 4.901 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.528 -5.339 4.144 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -8.777 -5.365 4.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -10.283 -6.073 2.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -8.643 -6.450 2.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -9.839 -7.577 2.732 1.00 0.00 H new ATOM 567 N PRO A 71 -5.341 -6.054 7.662 1.00 0.00 N ATOM 568 CA PRO A 71 -4.154 -5.246 7.898 1.00 0.00 C ATOM 569 C PRO A 71 -4.337 -3.855 7.319 1.00 0.00 C ATOM 570 O PRO A 71 -4.632 -3.695 6.127 1.00 0.00 O ATOM 571 CB PRO A 71 -3.044 -6.005 7.159 1.00 0.00 C ATOM 572 CG PRO A 71 -3.561 -7.398 7.049 1.00 0.00 C ATOM 573 CD PRO A 71 -5.043 -7.267 6.883 1.00 0.00 C ATOM 0 HA PRO A 71 -3.934 -5.108 8.957 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.853 -5.573 6.177 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -2.104 -5.972 7.710 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.116 -7.915 6.199 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.316 -7.978 7.939 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -5.327 -7.158 5.836 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -5.574 -8.138 7.268 1.00 0.00 H new ATOM 581 N LEU A 72 -4.176 -2.861 8.158 1.00 0.00 N ATOM 582 CA LEU A 72 -4.377 -1.490 7.763 1.00 0.00 C ATOM 583 C LEU A 72 -3.142 -0.979 7.051 1.00 0.00 C ATOM 584 O LEU A 72 -2.027 -1.148 7.535 1.00 0.00 O ATOM 585 CB LEU A 72 -4.689 -0.645 9.014 1.00 0.00 C ATOM 586 CG LEU A 72 -5.138 0.811 8.797 1.00 0.00 C ATOM 587 CD1 LEU A 72 -5.820 1.334 10.049 1.00 0.00 C ATOM 588 CD2 LEU A 72 -3.957 1.703 8.455 1.00 0.00 C ATOM 0 H LEU A 72 -3.902 -2.980 9.133 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.219 -1.416 7.075 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.469 -1.156 9.579 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -3.798 -0.632 9.641 1.00 0.00 H new ATOM 0 HG LEU A 72 -5.838 0.827 7.962 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.135 2.365 9.888 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -6.692 0.719 10.272 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.123 1.294 10.886 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -4.304 2.726 8.307 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.235 1.679 9.271 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.483 1.345 7.541 1.00 0.00 H new ATOM 600 N MET A 73 -3.339 -0.349 5.914 1.00 0.00 N ATOM 601 CA MET A 73 -2.257 0.198 5.140 1.00 0.00 C ATOM 602 C MET A 73 -2.499 1.696 4.982 1.00 0.00 C ATOM 603 O MET A 73 -3.328 2.131 4.179 1.00 0.00 O ATOM 604 CB MET A 73 -2.200 -0.511 3.775 1.00 0.00 C ATOM 605 CG MET A 73 -1.258 0.104 2.755 1.00 0.00 C ATOM 606 SD MET A 73 -1.333 -0.762 1.170 1.00 0.00 S ATOM 607 CE MET A 73 -0.335 0.300 0.143 1.00 0.00 C ATOM 0 H MET A 73 -4.261 -0.203 5.502 1.00 0.00 H new ATOM 0 HA MET A 73 -1.299 0.043 5.636 1.00 0.00 H new ATOM 0 HB2 MET A 73 -1.905 -1.548 3.936 1.00 0.00 H new ATOM 0 HB3 MET A 73 -3.204 -0.527 3.352 1.00 0.00 H new ATOM 0 HG2 MET A 73 -1.514 1.153 2.609 1.00 0.00 H new ATOM 0 HG3 MET A 73 -0.238 0.075 3.138 1.00 0.00 H new ATOM 0 HE1 MET A 73 -0.653 0.205 -0.895 1.00 0.00 H new ATOM 0 HE2 MET A 73 -0.454 1.334 0.466 1.00 0.00 H new ATOM 0 HE3 MET A 73 0.712 0.011 0.230 1.00 0.00 H new ATOM 617 N ILE A 74 -1.808 2.481 5.770 1.00 0.00 N ATOM 618 CA ILE A 74 -2.027 3.907 5.764 1.00 0.00 C ATOM 619 C ILE A 74 -1.134 4.609 4.791 1.00 0.00 C ATOM 620 O ILE A 74 0.098 4.514 4.854 1.00 0.00 O ATOM 621 CB ILE A 74 -1.906 4.560 7.171 1.00 0.00 C ATOM 622 CG1 ILE A 74 -1.979 6.101 7.063 1.00 0.00 C ATOM 623 CG2 ILE A 74 -0.638 4.112 7.895 1.00 0.00 C ATOM 624 CD1 ILE A 74 -2.004 6.827 8.399 1.00 0.00 C ATOM 0 H ILE A 74 -1.092 2.160 6.421 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.061 4.031 5.441 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.751 4.220 7.770 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -1.122 6.453 6.489 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.873 6.371 6.500 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -0.590 4.590 8.874 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -0.654 3.029 8.020 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.236 4.397 7.309 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -2.056 7.902 8.228 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -2.876 6.508 8.970 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.098 6.592 8.958 1.00 0.00 H new ATOM 636 N ILE A 75 -1.756 5.281 3.869 1.00 0.00 N ATOM 637 CA ILE A 75 -1.051 6.088 2.915 1.00 0.00 C ATOM 638 C ILE A 75 -0.571 7.382 3.587 1.00 0.00 C ATOM 639 O ILE A 75 -1.381 8.242 3.979 1.00 0.00 O ATOM 640 CB ILE A 75 -1.946 6.435 1.709 1.00 0.00 C ATOM 641 CG1 ILE A 75 -2.527 5.156 1.065 1.00 0.00 C ATOM 642 CG2 ILE A 75 -1.174 7.252 0.696 1.00 0.00 C ATOM 643 CD1 ILE A 75 -1.476 4.147 0.619 1.00 0.00 C ATOM 0 H ILE A 75 -2.770 5.286 3.756 1.00 0.00 H new ATOM 0 HA ILE A 75 -0.195 5.518 2.554 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.783 7.036 2.065 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.196 4.675 1.779 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -3.131 5.439 0.203 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.820 7.489 -0.149 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.830 8.177 1.160 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.314 6.680 0.346 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.968 3.280 0.178 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -0.821 4.607 -0.121 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.886 3.831 1.480 1.00 0.00 H new ATOM 655 N HIS A 76 0.734 7.511 3.712 1.00 0.00 N ATOM 656 CA HIS A 76 1.351 8.644 4.383 1.00 0.00 C ATOM 657 C HIS A 76 1.539 9.791 3.388 1.00 0.00 C ATOM 658 O HIS A 76 2.172 9.614 2.353 1.00 0.00 O ATOM 659 CB HIS A 76 2.709 8.197 4.956 1.00 0.00 C ATOM 660 CG HIS A 76 3.290 9.103 6.000 1.00 0.00 C ATOM 661 ND1 HIS A 76 4.610 9.512 5.998 1.00 0.00 N ATOM 662 CD2 HIS A 76 2.740 9.635 7.118 1.00 0.00 C ATOM 663 CE1 HIS A 76 4.841 10.249 7.067 1.00 0.00 C ATOM 664 NE2 HIS A 76 3.724 10.341 7.763 1.00 0.00 N ATOM 0 H HIS A 76 1.403 6.831 3.350 1.00 0.00 H new ATOM 0 HA HIS A 76 0.714 8.995 5.195 1.00 0.00 H new ATOM 0 HB2 HIS A 76 2.595 7.201 5.385 1.00 0.00 H new ATOM 0 HB3 HIS A 76 3.421 8.111 4.135 1.00 0.00 H new ATOM 0 HD1 HIS A 76 5.298 9.280 5.282 1.00 0.00 H new ATOM 0 HD2 HIS A 76 1.716 9.524 7.442 1.00 0.00 H new ATOM 0 HE1 HIS A 76 5.786 10.701 7.329 1.00 0.00 H new ATOM 673 N HIS A 77 0.975 10.964 3.687 1.00 0.00 N ATOM 674 CA HIS A 77 1.094 12.101 2.770 1.00 0.00 C ATOM 675 C HIS A 77 0.917 13.447 3.484 1.00 0.00 C ATOM 676 O HIS A 77 0.378 13.509 4.588 1.00 0.00 O ATOM 677 CB HIS A 77 0.080 11.979 1.620 1.00 0.00 C ATOM 678 CG HIS A 77 -1.357 12.179 2.027 1.00 0.00 C ATOM 679 ND1 HIS A 77 -2.021 13.379 1.882 1.00 0.00 N ATOM 680 CD2 HIS A 77 -2.250 11.324 2.566 1.00 0.00 C ATOM 681 CE1 HIS A 77 -3.254 13.255 2.314 1.00 0.00 C ATOM 682 NE2 HIS A 77 -3.426 12.018 2.736 1.00 0.00 N ATOM 0 H HIS A 77 0.443 11.150 4.537 1.00 0.00 H new ATOM 0 HA HIS A 77 2.105 12.075 2.364 1.00 0.00 H new ATOM 0 HB2 HIS A 77 0.332 12.711 0.852 1.00 0.00 H new ATOM 0 HB3 HIS A 77 0.182 10.993 1.167 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -1.616 14.232 1.498 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -2.075 10.288 2.817 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -4.001 14.035 2.322 1.00 0.00 H new ATOM 691 N LEU A 78 1.387 14.507 2.825 1.00 0.00 N ATOM 692 CA LEU A 78 1.282 15.885 3.312 1.00 0.00 C ATOM 693 C LEU A 78 1.531 16.823 2.127 1.00 0.00 C ATOM 694 O LEU A 78 1.932 16.362 1.056 1.00 0.00 O ATOM 695 CB LEU A 78 2.298 16.152 4.440 1.00 0.00 C ATOM 696 CG LEU A 78 2.165 17.486 5.185 1.00 0.00 C ATOM 697 CD1 LEU A 78 0.902 17.507 6.025 1.00 0.00 C ATOM 698 CD2 LEU A 78 3.387 17.746 6.054 1.00 0.00 C ATOM 0 H LEU A 78 1.859 14.432 1.924 1.00 0.00 H new ATOM 0 HA LEU A 78 0.289 16.057 3.728 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.217 15.346 5.169 1.00 0.00 H new ATOM 0 HB3 LEU A 78 3.300 16.098 4.015 1.00 0.00 H new ATOM 0 HG LEU A 78 2.099 18.282 4.443 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.827 18.462 6.545 1.00 0.00 H new ATOM 0 HD12 LEU A 78 0.034 17.376 5.380 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.937 16.698 6.755 1.00 0.00 H new ATOM 0 HD21 LEU A 78 3.269 18.698 6.572 1.00 0.00 H new ATOM 0 HD22 LEU A 78 3.490 16.945 6.786 1.00 0.00 H new ATOM 0 HD23 LEU A 78 4.278 17.782 5.427 1.00 0.00 H new ATOM 710 N ASP A 79 1.302 18.113 2.304 1.00 0.00 N ATOM 711 CA ASP A 79 1.469 19.070 1.202 1.00 0.00 C ATOM 712 C ASP A 79 2.923 19.558 1.088 1.00 0.00 C ATOM 713 O ASP A 79 3.310 20.139 0.080 1.00 0.00 O ATOM 714 CB ASP A 79 0.523 20.261 1.384 1.00 0.00 C ATOM 715 CG ASP A 79 0.106 20.890 0.065 1.00 0.00 C ATOM 716 OD1 ASP A 79 -0.900 20.433 -0.515 1.00 0.00 O ATOM 717 OD2 ASP A 79 0.768 21.839 -0.396 1.00 0.00 O ATOM 0 H ASP A 79 1.003 18.527 3.187 1.00 0.00 H new ATOM 0 HA ASP A 79 1.219 18.553 0.275 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -0.367 19.933 1.922 1.00 0.00 H new ATOM 0 HB3 ASP A 79 1.010 21.015 2.003 1.00 0.00 H new ATOM 722 N GLU A 80 3.730 19.287 2.115 1.00 0.00 N ATOM 723 CA GLU A 80 5.142 19.735 2.150 1.00 0.00 C ATOM 724 C GLU A 80 6.043 18.845 1.252 1.00 0.00 C ATOM 725 O GLU A 80 7.268 18.813 1.400 1.00 0.00 O ATOM 726 CB GLU A 80 5.649 19.718 3.600 1.00 0.00 C ATOM 727 CG GLU A 80 6.950 20.480 3.820 1.00 0.00 C ATOM 728 CD GLU A 80 7.446 20.380 5.243 1.00 0.00 C ATOM 729 OE1 GLU A 80 7.068 21.240 6.066 1.00 0.00 O ATOM 730 OE2 GLU A 80 8.214 19.447 5.549 1.00 0.00 O ATOM 0 H GLU A 80 3.439 18.760 2.938 1.00 0.00 H new ATOM 0 HA GLU A 80 5.191 20.751 1.758 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.880 20.142 4.246 1.00 0.00 H new ATOM 0 HB3 GLU A 80 5.791 18.683 3.910 1.00 0.00 H new ATOM 0 HG2 GLU A 80 7.713 20.092 3.145 1.00 0.00 H new ATOM 0 HG3 GLU A 80 6.801 21.529 3.564 1.00 0.00 H new ATOM 737 N CYS A 81 5.421 18.147 0.330 1.00 0.00 N ATOM 738 CA CYS A 81 6.102 17.252 -0.595 1.00 0.00 C ATOM 739 C CYS A 81 5.295 17.195 -1.883 1.00 0.00 C ATOM 740 O CYS A 81 4.205 17.786 -1.930 1.00 0.00 O ATOM 741 CB CYS A 81 6.238 15.854 0.024 1.00 0.00 C ATOM 742 SG CYS A 81 7.469 15.762 1.344 1.00 0.00 S ATOM 0 H CYS A 81 4.411 18.181 0.194 1.00 0.00 H new ATOM 0 HA CYS A 81 7.106 17.620 -0.807 1.00 0.00 H new ATOM 0 HB2 CYS A 81 5.270 15.545 0.419 1.00 0.00 H new ATOM 0 HB3 CYS A 81 6.504 15.144 -0.759 1.00 0.00 H new ATOM 0 HG CYS A 81 7.770 16.963 1.741 1.00 0.00 H new ATOM 748 N PRO A 82 5.809 16.534 -2.966 1.00 0.00 N ATOM 749 CA PRO A 82 5.027 16.292 -4.177 1.00 0.00 C ATOM 750 C PRO A 82 3.641 15.850 -3.812 1.00 0.00 C ATOM 751 O PRO A 82 3.467 14.909 -3.030 1.00 0.00 O ATOM 752 CB PRO A 82 5.796 15.157 -4.893 1.00 0.00 C ATOM 753 CG PRO A 82 6.969 14.832 -4.005 1.00 0.00 C ATOM 754 CD PRO A 82 7.169 16.023 -3.111 1.00 0.00 C ATOM 0 HA PRO A 82 4.916 17.178 -4.802 1.00 0.00 H new ATOM 0 HB2 PRO A 82 5.160 14.283 -5.036 1.00 0.00 H new ATOM 0 HB3 PRO A 82 6.130 15.474 -5.881 1.00 0.00 H new ATOM 0 HG2 PRO A 82 6.774 13.934 -3.418 1.00 0.00 H new ATOM 0 HG3 PRO A 82 7.863 14.637 -4.598 1.00 0.00 H new ATOM 0 HD2 PRO A 82 7.603 15.743 -2.151 1.00 0.00 H new ATOM 0 HD3 PRO A 82 7.835 16.760 -3.559 1.00 0.00 H new ATOM 762 N HIS A 83 2.655 16.558 -4.347 1.00 0.00 N ATOM 763 CA HIS A 83 1.275 16.314 -4.017 1.00 0.00 C ATOM 764 C HIS A 83 0.921 14.850 -4.106 1.00 0.00 C ATOM 765 O HIS A 83 1.370 14.129 -5.013 1.00 0.00 O ATOM 766 CB HIS A 83 0.337 17.159 -4.874 1.00 0.00 C ATOM 767 CG HIS A 83 0.248 18.586 -4.430 1.00 0.00 C ATOM 768 ND1 HIS A 83 0.450 19.660 -5.269 1.00 0.00 N ATOM 769 CD2 HIS A 83 -0.044 19.110 -3.218 1.00 0.00 C ATOM 770 CE1 HIS A 83 0.288 20.781 -4.588 1.00 0.00 C ATOM 771 NE2 HIS A 83 -0.012 20.470 -3.343 1.00 0.00 N ATOM 0 H HIS A 83 2.798 17.313 -5.018 1.00 0.00 H new ATOM 0 HA HIS A 83 1.142 16.616 -2.978 1.00 0.00 H new ATOM 0 HB2 HIS A 83 0.677 17.129 -5.909 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -0.659 16.717 -4.853 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -0.262 18.556 -2.317 1.00 0.00 H new ATOM 0 HE1 HIS A 83 0.385 21.781 -4.984 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -0.192 21.138 -2.593 1.00 0.00 H new ATOM 780 N SER A 84 0.110 14.419 -3.154 1.00 0.00 N ATOM 781 CA SER A 84 -0.327 13.038 -3.032 1.00 0.00 C ATOM 782 C SER A 84 -0.932 12.518 -4.341 1.00 0.00 C ATOM 783 O SER A 84 -1.040 11.317 -4.545 1.00 0.00 O ATOM 784 CB SER A 84 -1.357 12.935 -1.915 1.00 0.00 C ATOM 785 OG SER A 84 -0.897 13.595 -0.748 1.00 0.00 O ATOM 0 H SER A 84 -0.270 15.030 -2.431 1.00 0.00 H new ATOM 0 HA SER A 84 0.544 12.424 -2.801 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.299 13.376 -2.241 1.00 0.00 H new ATOM 0 HB3 SER A 84 -1.555 11.887 -1.692 1.00 0.00 H new ATOM 0 HG SER A 84 -1.541 13.462 -0.021 1.00 0.00 H new ATOM 791 N GLN A 85 -1.301 13.438 -5.221 1.00 0.00 N ATOM 792 CA GLN A 85 -1.895 13.080 -6.501 1.00 0.00 C ATOM 793 C GLN A 85 -0.879 12.365 -7.378 1.00 0.00 C ATOM 794 O GLN A 85 -1.208 11.396 -8.060 1.00 0.00 O ATOM 795 CB GLN A 85 -2.458 14.311 -7.223 1.00 0.00 C ATOM 796 CG GLN A 85 -1.471 15.457 -7.371 1.00 0.00 C ATOM 797 CD GLN A 85 -2.013 16.574 -8.222 1.00 0.00 C ATOM 798 OE1 GLN A 85 -1.806 16.607 -9.428 1.00 0.00 O ATOM 799 NE2 GLN A 85 -2.723 17.490 -7.603 1.00 0.00 N ATOM 0 H GLN A 85 -1.199 14.442 -5.071 1.00 0.00 H new ATOM 0 HA GLN A 85 -2.726 12.403 -6.304 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -2.800 14.011 -8.214 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -3.332 14.668 -6.679 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -1.218 15.845 -6.384 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -0.547 15.083 -7.812 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -2.872 17.426 -6.596 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -3.125 18.266 -8.129 1.00 0.00 H new ATOM 808 N ALA A 86 0.359 12.841 -7.343 1.00 0.00 N ATOM 809 CA ALA A 86 1.435 12.245 -8.108 1.00 0.00 C ATOM 810 C ALA A 86 1.680 10.817 -7.669 1.00 0.00 C ATOM 811 O ALA A 86 1.812 9.913 -8.494 1.00 0.00 O ATOM 812 CB ALA A 86 2.705 13.066 -7.960 1.00 0.00 C ATOM 0 H ALA A 86 0.640 13.647 -6.785 1.00 0.00 H new ATOM 0 HA ALA A 86 1.143 12.235 -9.158 1.00 0.00 H new ATOM 0 HB1 ALA A 86 3.505 12.606 -8.540 1.00 0.00 H new ATOM 0 HB2 ALA A 86 2.528 14.078 -8.324 1.00 0.00 H new ATOM 0 HB3 ALA A 86 2.994 13.103 -6.910 1.00 0.00 H new ATOM 818 N LEU A 87 1.724 10.609 -6.366 1.00 0.00 N ATOM 819 CA LEU A 87 1.947 9.280 -5.831 1.00 0.00 C ATOM 820 C LEU A 87 0.712 8.405 -6.032 1.00 0.00 C ATOM 821 O LEU A 87 0.819 7.200 -6.255 1.00 0.00 O ATOM 822 CB LEU A 87 2.311 9.344 -4.350 1.00 0.00 C ATOM 823 CG LEU A 87 2.644 8.000 -3.697 1.00 0.00 C ATOM 824 CD1 LEU A 87 3.888 7.389 -4.327 1.00 0.00 C ATOM 825 CD2 LEU A 87 2.828 8.164 -2.204 1.00 0.00 C ATOM 0 H LEU A 87 1.609 11.339 -5.663 1.00 0.00 H new ATOM 0 HA LEU A 87 2.782 8.836 -6.372 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.167 10.008 -4.232 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.480 9.796 -3.808 1.00 0.00 H new ATOM 0 HG LEU A 87 1.808 7.322 -3.867 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.107 6.435 -3.848 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.716 7.230 -5.392 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.733 8.064 -4.193 1.00 0.00 H new ATOM 0 HD21 LEU A 87 3.064 7.198 -1.758 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.644 8.861 -2.012 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.909 8.552 -1.765 1.00 0.00 H new ATOM 837 N LYS A 88 -0.459 9.026 -5.971 1.00 0.00 N ATOM 838 CA LYS A 88 -1.712 8.309 -6.137 1.00 0.00 C ATOM 839 C LYS A 88 -1.875 7.844 -7.582 1.00 0.00 C ATOM 840 O LYS A 88 -2.591 6.882 -7.860 1.00 0.00 O ATOM 841 CB LYS A 88 -2.895 9.175 -5.697 1.00 0.00 C ATOM 842 CG LYS A 88 -4.131 8.378 -5.317 1.00 0.00 C ATOM 843 CD LYS A 88 -5.079 9.209 -4.469 1.00 0.00 C ATOM 844 CE LYS A 88 -6.191 8.354 -3.887 1.00 0.00 C ATOM 845 NZ LYS A 88 -6.990 9.095 -2.882 1.00 0.00 N ATOM 0 H LYS A 88 -0.565 10.027 -5.807 1.00 0.00 H new ATOM 0 HA LYS A 88 -1.692 7.425 -5.499 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -2.591 9.784 -4.845 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -3.151 9.861 -6.504 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -4.643 8.044 -6.219 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.836 7.484 -4.768 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -4.524 9.687 -3.662 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -5.509 10.006 -5.075 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -6.844 8.012 -4.690 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -5.762 7.465 -3.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -7.924 8.649 -2.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -6.499 9.076 -1.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -7.108 10.081 -3.191 1.00 0.00 H new ATOM 859 N LYS A 89 -1.204 8.537 -8.497 1.00 0.00 N ATOM 860 CA LYS A 89 -1.200 8.153 -9.897 1.00 0.00 C ATOM 861 C LYS A 89 -0.517 6.796 -10.024 1.00 0.00 C ATOM 862 O LYS A 89 -1.089 5.841 -10.552 1.00 0.00 O ATOM 863 CB LYS A 89 -0.437 9.199 -10.722 1.00 0.00 C ATOM 864 CG LYS A 89 -0.545 9.016 -12.231 1.00 0.00 C ATOM 865 CD LYS A 89 -1.965 9.256 -12.724 1.00 0.00 C ATOM 866 CE LYS A 89 -2.421 10.680 -12.442 1.00 0.00 C ATOM 867 NZ LYS A 89 -3.806 10.924 -12.905 1.00 0.00 N ATOM 0 H LYS A 89 -0.655 9.371 -8.288 1.00 0.00 H new ATOM 0 HA LYS A 89 -2.222 8.093 -10.270 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -0.809 10.190 -10.462 1.00 0.00 H new ATOM 0 HB3 LYS A 89 0.615 9.169 -10.440 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.136 9.705 -12.731 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -0.232 8.007 -12.499 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -2.017 9.062 -13.795 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -2.643 8.553 -12.240 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.358 10.875 -11.371 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -1.746 11.380 -12.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -4.075 11.906 -12.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -3.862 10.764 -13.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -4.455 10.274 -12.417 1.00 0.00 H new ATOM 881 N VAL A 90 0.714 6.736 -9.523 1.00 0.00 N ATOM 882 CA VAL A 90 1.483 5.494 -9.467 1.00 0.00 C ATOM 883 C VAL A 90 0.670 4.405 -8.765 1.00 0.00 C ATOM 884 O VAL A 90 0.611 3.266 -9.219 1.00 0.00 O ATOM 885 CB VAL A 90 2.819 5.688 -8.712 1.00 0.00 C ATOM 886 CG1 VAL A 90 3.615 4.397 -8.692 1.00 0.00 C ATOM 887 CG2 VAL A 90 3.640 6.807 -9.333 1.00 0.00 C ATOM 0 H VAL A 90 1.207 7.545 -9.145 1.00 0.00 H new ATOM 0 HA VAL A 90 1.702 5.197 -10.493 1.00 0.00 H new ATOM 0 HB VAL A 90 2.585 5.968 -7.685 1.00 0.00 H new ATOM 0 HG11 VAL A 90 4.551 4.555 -8.156 1.00 0.00 H new ATOM 0 HG12 VAL A 90 3.037 3.621 -8.191 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.830 4.086 -9.714 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.574 6.922 -8.783 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.859 6.564 -10.373 1.00 0.00 H new ATOM 0 HG23 VAL A 90 3.076 7.739 -9.290 1.00 0.00 H new ATOM 897 N PHE A 91 0.037 4.791 -7.672 1.00 0.00 N ATOM 898 CA PHE A 91 -0.806 3.904 -6.877 1.00 0.00 C ATOM 899 C PHE A 91 -1.875 3.207 -7.731 1.00 0.00 C ATOM 900 O PHE A 91 -2.159 2.022 -7.546 1.00 0.00 O ATOM 901 CB PHE A 91 -1.462 4.721 -5.748 1.00 0.00 C ATOM 902 CG PHE A 91 -2.646 4.075 -5.081 1.00 0.00 C ATOM 903 CD1 PHE A 91 -2.477 3.212 -4.016 1.00 0.00 C ATOM 904 CD2 PHE A 91 -3.935 4.347 -5.521 1.00 0.00 C ATOM 905 CE1 PHE A 91 -3.567 2.630 -3.403 1.00 0.00 C ATOM 906 CE2 PHE A 91 -5.026 3.769 -4.914 1.00 0.00 C ATOM 907 CZ PHE A 91 -4.844 2.910 -3.854 1.00 0.00 C ATOM 0 H PHE A 91 0.092 5.740 -7.303 1.00 0.00 H new ATOM 0 HA PHE A 91 -0.181 3.118 -6.454 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -0.708 4.928 -4.988 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -1.777 5.682 -6.155 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -1.482 2.991 -3.660 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -4.083 5.022 -6.351 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.423 1.956 -2.571 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -6.022 3.989 -5.268 1.00 0.00 H new ATOM 0 HZ PHE A 91 -5.698 2.455 -3.375 1.00 0.00 H new ATOM 917 N ALA A 92 -2.448 3.941 -8.663 1.00 0.00 N ATOM 918 CA ALA A 92 -3.520 3.417 -9.487 1.00 0.00 C ATOM 919 C ALA A 92 -3.007 2.648 -10.702 1.00 0.00 C ATOM 920 O ALA A 92 -3.574 1.622 -11.075 1.00 0.00 O ATOM 921 CB ALA A 92 -4.440 4.545 -9.927 1.00 0.00 C ATOM 0 H ALA A 92 -2.189 4.906 -8.870 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.077 2.707 -8.875 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.241 4.141 -10.545 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -4.868 5.029 -9.049 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -3.871 5.275 -10.503 1.00 0.00 H new ATOM 927 N GLU A 93 -1.934 3.126 -11.314 1.00 0.00 N ATOM 928 CA GLU A 93 -1.443 2.507 -12.545 1.00 0.00 C ATOM 929 C GLU A 93 -0.440 1.379 -12.312 1.00 0.00 C ATOM 930 O GLU A 93 -0.250 0.532 -13.190 1.00 0.00 O ATOM 931 CB GLU A 93 -0.872 3.551 -13.508 1.00 0.00 C ATOM 932 CG GLU A 93 0.291 4.358 -12.954 1.00 0.00 C ATOM 933 CD GLU A 93 0.770 5.396 -13.935 1.00 0.00 C ATOM 934 OE1 GLU A 93 -0.064 6.191 -14.411 1.00 0.00 O ATOM 935 OE2 GLU A 93 1.984 5.426 -14.240 1.00 0.00 O ATOM 0 H GLU A 93 -1.392 3.926 -10.989 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.317 2.045 -13.005 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -0.546 3.046 -14.417 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.670 4.237 -13.793 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -0.014 4.846 -12.028 1.00 0.00 H new ATOM 0 HG3 GLU A 93 1.113 3.687 -12.705 1.00 0.00 H new ATOM 942 N ASN A 94 0.216 1.358 -11.162 1.00 0.00 N ATOM 943 CA ASN A 94 1.179 0.296 -10.893 1.00 0.00 C ATOM 944 C ASN A 94 0.468 -0.983 -10.466 1.00 0.00 C ATOM 945 O ASN A 94 -0.140 -1.042 -9.395 1.00 0.00 O ATOM 946 CB ASN A 94 2.231 0.718 -9.857 1.00 0.00 C ATOM 947 CG ASN A 94 3.369 -0.290 -9.748 1.00 0.00 C ATOM 948 OD1 ASN A 94 4.309 -0.274 -10.541 1.00 0.00 O ATOM 949 ND2 ASN A 94 3.305 -1.156 -8.757 1.00 0.00 N ATOM 0 H ASN A 94 0.106 2.044 -10.416 1.00 0.00 H new ATOM 0 HA ASN A 94 1.712 0.098 -11.823 1.00 0.00 H new ATOM 0 HB2 ASN A 94 2.636 1.693 -10.129 1.00 0.00 H new ATOM 0 HB3 ASN A 94 1.754 0.832 -8.883 1.00 0.00 H new ATOM 0 HD21 ASN A 94 4.050 -1.841 -8.629 1.00 0.00 H new ATOM 0 HD22 ASN A 94 2.511 -1.141 -8.117 1.00 0.00 H new ATOM 956 N LYS A 95 0.575 -1.998 -11.321 1.00 0.00 N ATOM 957 CA LYS A 95 -0.086 -3.308 -11.171 1.00 0.00 C ATOM 958 C LYS A 95 -0.057 -3.863 -9.740 1.00 0.00 C ATOM 959 O LYS A 95 -1.051 -4.395 -9.254 1.00 0.00 O ATOM 960 CB LYS A 95 0.585 -4.307 -12.116 1.00 0.00 C ATOM 961 CG LYS A 95 -0.013 -5.707 -12.096 1.00 0.00 C ATOM 962 CD LYS A 95 0.875 -6.691 -12.848 1.00 0.00 C ATOM 963 CE LYS A 95 1.062 -6.282 -14.300 1.00 0.00 C ATOM 964 NZ LYS A 95 2.060 -7.131 -14.992 1.00 0.00 N ATOM 0 H LYS A 95 1.141 -1.937 -12.167 1.00 0.00 H new ATOM 0 HA LYS A 95 -1.137 -3.161 -11.418 1.00 0.00 H new ATOM 0 HB2 LYS A 95 0.529 -3.918 -13.133 1.00 0.00 H new ATOM 0 HB3 LYS A 95 1.642 -4.375 -11.859 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -0.137 -6.038 -11.065 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -1.005 -5.689 -12.547 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.847 -6.751 -12.359 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.434 -7.687 -12.804 1.00 0.00 H new ATOM 0 HE2 LYS A 95 0.107 -6.348 -14.821 1.00 0.00 H new ATOM 0 HE3 LYS A 95 1.379 -5.240 -14.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 2.157 -6.818 -15.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 2.978 -7.049 -14.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 1.746 -8.122 -14.972 1.00 0.00 H new ATOM 978 N GLU A 96 1.063 -3.716 -9.068 1.00 0.00 N ATOM 979 CA GLU A 96 1.213 -4.316 -7.752 1.00 0.00 C ATOM 980 C GLU A 96 0.612 -3.462 -6.653 1.00 0.00 C ATOM 981 O GLU A 96 0.087 -3.987 -5.682 1.00 0.00 O ATOM 982 CB GLU A 96 2.656 -4.624 -7.452 1.00 0.00 C ATOM 983 CG GLU A 96 3.268 -5.597 -8.425 1.00 0.00 C ATOM 984 CD GLU A 96 4.059 -6.676 -7.729 1.00 0.00 C ATOM 985 OE1 GLU A 96 5.208 -6.417 -7.340 1.00 0.00 O ATOM 986 OE2 GLU A 96 3.527 -7.786 -7.547 1.00 0.00 O ATOM 0 H GLU A 96 1.875 -3.195 -9.400 1.00 0.00 H new ATOM 0 HA GLU A 96 0.656 -5.253 -7.775 1.00 0.00 H new ATOM 0 HB2 GLU A 96 3.229 -3.697 -7.465 1.00 0.00 H new ATOM 0 HB3 GLU A 96 2.732 -5.031 -6.444 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.480 -6.055 -9.023 1.00 0.00 H new ATOM 0 HG3 GLU A 96 3.919 -5.059 -9.114 1.00 0.00 H new ATOM 993 N ILE A 97 0.673 -2.153 -6.808 1.00 0.00 N ATOM 994 CA ILE A 97 0.124 -1.266 -5.798 1.00 0.00 C ATOM 995 C ILE A 97 -1.395 -1.252 -5.916 1.00 0.00 C ATOM 996 O ILE A 97 -2.108 -1.196 -4.917 1.00 0.00 O ATOM 997 CB ILE A 97 0.682 0.187 -5.906 1.00 0.00 C ATOM 998 CG1 ILE A 97 2.217 0.194 -5.858 1.00 0.00 C ATOM 999 CG2 ILE A 97 0.132 1.041 -4.780 1.00 0.00 C ATOM 1000 CD1 ILE A 97 2.823 1.569 -6.085 1.00 0.00 C ATOM 0 H ILE A 97 1.091 -1.684 -7.612 1.00 0.00 H new ATOM 0 HA ILE A 97 0.426 -1.648 -4.823 1.00 0.00 H new ATOM 0 HB ILE A 97 0.365 0.600 -6.864 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.544 -0.183 -4.889 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.600 -0.492 -6.613 1.00 0.00 H new ATOM 0 HG21 ILE A 97 0.528 2.053 -4.864 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.956 1.070 -4.843 1.00 0.00 H new ATOM 0 HG23 ILE A 97 0.428 0.614 -3.822 1.00 0.00 H new ATOM 0 HD11 ILE A 97 3.910 1.500 -6.038 1.00 0.00 H new ATOM 0 HD12 ILE A 97 2.525 1.940 -7.066 1.00 0.00 H new ATOM 0 HD13 ILE A 97 2.469 2.254 -5.315 1.00 0.00 H new ATOM 1012 N GLN A 98 -1.875 -1.338 -7.148 1.00 0.00 N ATOM 1013 CA GLN A 98 -3.300 -1.369 -7.417 1.00 0.00 C ATOM 1014 C GLN A 98 -3.913 -2.665 -6.882 1.00 0.00 C ATOM 1015 O GLN A 98 -4.972 -2.645 -6.245 1.00 0.00 O ATOM 1016 CB GLN A 98 -3.554 -1.208 -8.931 1.00 0.00 C ATOM 1017 CG GLN A 98 -5.030 -1.111 -9.330 1.00 0.00 C ATOM 1018 CD GLN A 98 -5.694 -2.466 -9.506 1.00 0.00 C ATOM 1019 OE1 GLN A 98 -5.054 -3.440 -9.897 1.00 0.00 O ATOM 1020 NE2 GLN A 98 -6.979 -2.533 -9.219 1.00 0.00 N ATOM 0 H GLN A 98 -1.290 -1.388 -7.982 1.00 0.00 H new ATOM 0 HA GLN A 98 -3.781 -0.537 -6.903 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -3.039 -0.312 -9.278 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.107 -2.055 -9.452 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -5.569 -0.546 -8.569 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -5.112 -0.550 -10.261 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -7.474 -1.701 -8.897 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -7.478 -3.417 -9.319 1.00 0.00 H new ATOM 1029 N LYS A 99 -3.229 -3.790 -7.119 1.00 0.00 N ATOM 1030 CA LYS A 99 -3.726 -5.085 -6.657 1.00 0.00 C ATOM 1031 C LYS A 99 -3.646 -5.195 -5.140 1.00 0.00 C ATOM 1032 O LYS A 99 -4.553 -5.717 -4.495 1.00 0.00 O ATOM 1033 CB LYS A 99 -2.961 -6.246 -7.305 1.00 0.00 C ATOM 1034 CG LYS A 99 -3.387 -7.613 -6.775 1.00 0.00 C ATOM 1035 CD LYS A 99 -2.619 -8.748 -7.428 1.00 0.00 C ATOM 1036 CE LYS A 99 -2.957 -10.084 -6.774 1.00 0.00 C ATOM 1037 NZ LYS A 99 -4.407 -10.398 -6.856 1.00 0.00 N ATOM 0 H LYS A 99 -2.342 -3.828 -7.621 1.00 0.00 H new ATOM 0 HA LYS A 99 -4.771 -5.151 -6.959 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.114 -6.217 -8.384 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -1.893 -6.112 -7.131 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.233 -7.646 -5.696 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.454 -7.752 -6.949 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.857 -8.789 -8.491 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -1.548 -8.561 -7.348 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -2.387 -10.878 -7.257 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.650 -10.063 -5.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -4.567 -11.381 -6.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -4.937 -9.755 -6.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.733 -10.279 -7.836 1.00 0.00 H new ATOM 1051 N LEU A 100 -2.567 -4.686 -4.572 1.00 0.00 N ATOM 1052 CA LEU A 100 -2.380 -4.740 -3.132 1.00 0.00 C ATOM 1053 C LEU A 100 -3.398 -3.884 -2.424 1.00 0.00 C ATOM 1054 O LEU A 100 -3.810 -4.196 -1.313 1.00 0.00 O ATOM 1055 CB LEU A 100 -0.960 -4.330 -2.744 1.00 0.00 C ATOM 1056 CG LEU A 100 0.010 -5.477 -2.391 1.00 0.00 C ATOM 1057 CD1 LEU A 100 -0.204 -5.938 -0.965 1.00 0.00 C ATOM 1058 CD2 LEU A 100 -0.152 -6.650 -3.343 1.00 0.00 C ATOM 0 H LEU A 100 -1.810 -4.232 -5.083 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.528 -5.773 -2.816 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.531 -3.761 -3.568 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.020 -3.657 -1.889 1.00 0.00 H new ATOM 0 HG LEU A 100 1.025 -5.091 -2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.490 -6.747 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -0.028 -5.106 -0.283 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.228 -6.294 -0.847 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.545 -7.441 -3.067 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.172 -7.029 -3.284 1.00 0.00 H new ATOM 0 HD23 LEU A 100 0.055 -6.323 -4.362 1.00 0.00 H new ATOM 1070 N ALA A 101 -3.846 -2.827 -3.076 1.00 0.00 N ATOM 1071 CA ALA A 101 -4.838 -1.951 -2.500 1.00 0.00 C ATOM 1072 C ALA A 101 -6.216 -2.600 -2.572 1.00 0.00 C ATOM 1073 O ALA A 101 -7.136 -2.226 -1.854 1.00 0.00 O ATOM 1074 CB ALA A 101 -4.837 -0.637 -3.263 1.00 0.00 C ATOM 0 H ALA A 101 -3.534 -2.557 -4.009 1.00 0.00 H new ATOM 0 HA ALA A 101 -4.600 -1.766 -1.453 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -5.583 0.032 -2.836 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.852 -0.175 -3.191 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -5.075 -0.824 -4.310 1.00 0.00 H new ATOM 1080 N GLU A 102 -6.344 -3.575 -3.443 1.00 0.00 N ATOM 1081 CA GLU A 102 -7.601 -4.273 -3.634 1.00 0.00 C ATOM 1082 C GLU A 102 -7.850 -5.242 -2.471 1.00 0.00 C ATOM 1083 O GLU A 102 -8.990 -5.478 -2.074 1.00 0.00 O ATOM 1084 CB GLU A 102 -7.564 -5.032 -4.971 1.00 0.00 C ATOM 1085 CG GLU A 102 -8.814 -4.878 -5.826 1.00 0.00 C ATOM 1086 CD GLU A 102 -10.031 -5.528 -5.217 1.00 0.00 C ATOM 1087 OE1 GLU A 102 -10.121 -6.773 -5.242 1.00 0.00 O ATOM 1088 OE2 GLU A 102 -10.916 -4.799 -4.725 1.00 0.00 O ATOM 0 H GLU A 102 -5.585 -3.908 -4.038 1.00 0.00 H new ATOM 0 HA GLU A 102 -8.417 -3.551 -3.657 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.704 -4.688 -5.545 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.408 -6.091 -4.767 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.014 -3.817 -5.979 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.631 -5.313 -6.809 1.00 0.00 H new ATOM 1095 N GLN A 103 -6.774 -5.764 -1.906 1.00 0.00 N ATOM 1096 CA GLN A 103 -6.876 -6.740 -0.827 1.00 0.00 C ATOM 1097 C GLN A 103 -6.673 -6.084 0.550 1.00 0.00 C ATOM 1098 O GLN A 103 -7.038 -6.652 1.582 1.00 0.00 O ATOM 1099 CB GLN A 103 -5.840 -7.855 -1.037 1.00 0.00 C ATOM 1100 CG GLN A 103 -6.000 -9.045 -0.099 1.00 0.00 C ATOM 1101 CD GLN A 103 -4.894 -10.073 -0.264 1.00 0.00 C ATOM 1102 OE1 GLN A 103 -4.999 -10.994 -1.073 1.00 0.00 O ATOM 1103 NE2 GLN A 103 -3.836 -9.924 0.506 1.00 0.00 N ATOM 0 H GLN A 103 -5.818 -5.530 -2.175 1.00 0.00 H new ATOM 0 HA GLN A 103 -7.880 -7.164 -0.848 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -5.906 -8.207 -2.066 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -4.842 -7.437 -0.907 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -6.011 -8.691 0.932 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -6.963 -9.521 -0.283 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -3.789 -9.146 1.164 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -3.063 -10.587 0.445 1.00 0.00 H new ATOM 1112 N PHE A 104 -6.116 -4.885 0.561 1.00 0.00 N ATOM 1113 CA PHE A 104 -5.798 -4.201 1.812 1.00 0.00 C ATOM 1114 C PHE A 104 -6.601 -2.898 1.986 1.00 0.00 C ATOM 1115 O PHE A 104 -7.464 -2.580 1.165 1.00 0.00 O ATOM 1116 CB PHE A 104 -4.282 -3.961 1.883 1.00 0.00 C ATOM 1117 CG PHE A 104 -3.509 -5.227 2.129 1.00 0.00 C ATOM 1118 CD1 PHE A 104 -3.106 -6.029 1.077 1.00 0.00 C ATOM 1119 CD2 PHE A 104 -3.198 -5.621 3.417 1.00 0.00 C ATOM 1120 CE1 PHE A 104 -2.409 -7.198 1.304 1.00 0.00 C ATOM 1121 CE2 PHE A 104 -2.499 -6.788 3.650 1.00 0.00 C ATOM 1122 CZ PHE A 104 -2.104 -7.577 2.591 1.00 0.00 C ATOM 0 H PHE A 104 -5.873 -4.361 -0.280 1.00 0.00 H new ATOM 0 HA PHE A 104 -6.094 -4.839 2.645 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -3.945 -3.509 0.950 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -4.067 -3.248 2.679 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.340 -5.736 0.064 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.506 -5.008 4.251 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -2.103 -7.815 0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -2.262 -7.083 4.661 1.00 0.00 H new ATOM 0 HZ PHE A 104 -1.556 -8.490 2.771 1.00 0.00 H new ATOM 1132 N VAL A 105 -6.332 -2.166 3.078 1.00 0.00 N ATOM 1133 CA VAL A 105 -7.046 -0.915 3.381 1.00 0.00 C ATOM 1134 C VAL A 105 -6.227 0.269 2.923 1.00 0.00 C ATOM 1135 O VAL A 105 -5.020 0.264 3.063 1.00 0.00 O ATOM 1136 CB VAL A 105 -7.279 -0.736 4.902 1.00 0.00 C ATOM 1137 CG1 VAL A 105 -8.324 0.342 5.167 1.00 0.00 C ATOM 1138 CG2 VAL A 105 -7.671 -2.052 5.564 1.00 0.00 C ATOM 0 H VAL A 105 -5.624 -2.419 3.767 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.004 -0.969 2.864 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.337 -0.413 5.346 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -8.471 0.450 6.242 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -7.983 1.290 4.750 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -9.266 0.058 4.699 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.827 -1.890 6.631 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -8.592 -2.425 5.115 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -6.875 -2.783 5.420 1.00 0.00 H new ATOM 1148 N LEU A 106 -6.877 1.278 2.377 1.00 0.00 N ATOM 1149 CA LEU A 106 -6.173 2.474 1.953 1.00 0.00 C ATOM 1150 C LEU A 106 -6.686 3.665 2.723 1.00 0.00 C ATOM 1151 O LEU A 106 -7.851 4.036 2.600 1.00 0.00 O ATOM 1152 CB LEU A 106 -6.350 2.729 0.445 1.00 0.00 C ATOM 1153 CG LEU A 106 -5.938 1.597 -0.500 1.00 0.00 C ATOM 1154 CD1 LEU A 106 -4.558 1.057 -0.140 1.00 0.00 C ATOM 1155 CD2 LEU A 106 -6.986 0.491 -0.506 1.00 0.00 C ATOM 0 H LEU A 106 -7.884 1.295 2.217 1.00 0.00 H new ATOM 0 HA LEU A 106 -5.112 2.326 2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -7.399 2.961 0.261 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -5.776 3.617 0.181 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.876 2.002 -1.510 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.291 0.254 -0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.823 1.858 -0.215 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -4.573 0.672 0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -6.673 -0.303 -1.184 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -7.094 0.087 0.501 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -7.941 0.897 -0.839 1.00 0.00 H new ATOM 1167 N LEU A 107 -5.832 4.260 3.516 1.00 0.00 N ATOM 1168 CA LEU A 107 -6.221 5.421 4.283 1.00 0.00 C ATOM 1169 C LEU A 107 -5.416 6.629 3.889 1.00 0.00 C ATOM 1170 O LEU A 107 -4.219 6.694 4.143 1.00 0.00 O ATOM 1171 CB LEU A 107 -6.066 5.181 5.782 1.00 0.00 C ATOM 1172 CG LEU A 107 -6.965 4.117 6.397 1.00 0.00 C ATOM 1173 CD1 LEU A 107 -6.772 4.091 7.897 1.00 0.00 C ATOM 1174 CD2 LEU A 107 -8.427 4.374 6.053 1.00 0.00 C ATOM 0 H LEU A 107 -4.865 3.963 3.649 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.273 5.604 4.063 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.029 4.907 5.978 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -6.250 6.123 6.299 1.00 0.00 H new ATOM 0 HG LEU A 107 -6.689 3.147 5.984 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.417 3.328 8.334 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.731 3.861 8.126 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.028 5.065 8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.048 3.600 6.504 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -8.725 5.349 6.438 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -8.555 4.357 4.971 1.00 0.00 H new ATOM 1186 N ASN A 108 -6.063 7.572 3.247 1.00 0.00 N ATOM 1187 CA ASN A 108 -5.423 8.825 2.917 1.00 0.00 C ATOM 1188 C ASN A 108 -5.634 9.777 4.070 1.00 0.00 C ATOM 1189 O ASN A 108 -6.721 10.319 4.247 1.00 0.00 O ATOM 1190 CB ASN A 108 -5.982 9.422 1.613 1.00 0.00 C ATOM 1191 CG ASN A 108 -5.512 8.690 0.356 1.00 0.00 C ATOM 1192 OD1 ASN A 108 -5.350 9.295 -0.703 1.00 0.00 O ATOM 1193 ND2 ASN A 108 -5.294 7.391 0.463 1.00 0.00 N ATOM 0 H ASN A 108 -7.033 7.496 2.942 1.00 0.00 H new ATOM 0 HA ASN A 108 -4.359 8.655 2.754 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -7.071 9.400 1.651 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -5.686 10.469 1.546 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -4.981 6.858 -0.348 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -5.439 6.922 1.357 1.00 0.00 H new ATOM 1200 N LEU A 109 -4.596 9.990 4.854 1.00 0.00 N ATOM 1201 CA LEU A 109 -4.733 10.784 6.060 1.00 0.00 C ATOM 1202 C LEU A 109 -3.551 11.718 6.237 1.00 0.00 C ATOM 1203 O LEU A 109 -2.472 11.482 5.691 1.00 0.00 O ATOM 1204 CB LEU A 109 -4.874 9.860 7.282 1.00 0.00 C ATOM 1205 CG LEU A 109 -5.193 10.548 8.617 1.00 0.00 C ATOM 1206 CD1 LEU A 109 -6.556 11.227 8.562 1.00 0.00 C ATOM 1207 CD2 LEU A 109 -5.138 9.545 9.759 1.00 0.00 C ATOM 0 H LEU A 109 -3.658 9.629 4.681 1.00 0.00 H new ATOM 0 HA LEU A 109 -5.631 11.395 5.969 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -5.660 9.134 7.074 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -3.946 9.301 7.398 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.439 11.315 8.796 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.762 11.708 9.518 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.557 11.977 7.771 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -7.325 10.482 8.357 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.367 10.050 10.698 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -5.868 8.755 9.585 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -4.140 9.111 9.814 1.00 0.00 H new ATOM 1219 N VAL A 110 -3.771 12.782 6.978 1.00 0.00 N ATOM 1220 CA VAL A 110 -2.737 13.744 7.274 1.00 0.00 C ATOM 1221 C VAL A 110 -2.164 13.438 8.653 1.00 0.00 C ATOM 1222 O VAL A 110 -2.883 12.959 9.533 1.00 0.00 O ATOM 1223 CB VAL A 110 -3.294 15.193 7.246 1.00 0.00 C ATOM 1224 CG1 VAL A 110 -2.180 16.213 7.423 1.00 0.00 C ATOM 1225 CG2 VAL A 110 -4.053 15.451 5.951 1.00 0.00 C ATOM 0 H VAL A 110 -4.676 13.003 7.393 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.958 13.671 6.515 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.986 15.302 8.081 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.600 17.218 7.399 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.685 16.049 8.380 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.455 16.104 6.617 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.435 16.472 5.951 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.382 15.315 5.103 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.885 14.752 5.872 1.00 0.00 H new ATOM 1235 N TYR A 111 -0.893 13.707 8.846 1.00 0.00 N ATOM 1236 CA TYR A 111 -0.258 13.398 10.107 1.00 0.00 C ATOM 1237 C TYR A 111 0.004 14.666 10.900 1.00 0.00 C ATOM 1238 O TYR A 111 0.280 15.729 10.328 1.00 0.00 O ATOM 1239 CB TYR A 111 1.052 12.619 9.890 1.00 0.00 C ATOM 1240 CG TYR A 111 2.214 13.465 9.417 1.00 0.00 C ATOM 1241 CD1 TYR A 111 2.350 13.813 8.085 1.00 0.00 C ATOM 1242 CD2 TYR A 111 3.177 13.919 10.315 1.00 0.00 C ATOM 1243 CE1 TYR A 111 3.405 14.587 7.659 1.00 0.00 C ATOM 1244 CE2 TYR A 111 4.233 14.696 9.893 1.00 0.00 C ATOM 1245 CZ TYR A 111 4.342 15.026 8.563 1.00 0.00 C ATOM 1246 OH TYR A 111 5.387 15.799 8.133 1.00 0.00 O ATOM 0 H TYR A 111 -0.282 14.136 8.151 1.00 0.00 H new ATOM 0 HA TYR A 111 -0.938 12.766 10.679 1.00 0.00 H new ATOM 0 HB2 TYR A 111 1.330 12.133 10.825 1.00 0.00 H new ATOM 0 HB3 TYR A 111 0.874 11.829 9.161 1.00 0.00 H new ATOM 0 HD1 TYR A 111 1.617 13.472 7.369 1.00 0.00 H new ATOM 0 HD2 TYR A 111 3.094 13.657 11.360 1.00 0.00 H new ATOM 0 HE1 TYR A 111 3.496 14.849 6.615 1.00 0.00 H new ATOM 0 HE2 TYR A 111 4.970 15.043 10.602 1.00 0.00 H new ATOM 0 HH TYR A 111 5.960 16.028 8.895 1.00 0.00 H new ATOM 1256 N GLU A 112 -0.105 14.560 12.205 1.00 0.00 N ATOM 1257 CA GLU A 112 0.163 15.675 13.086 1.00 0.00 C ATOM 1258 C GLU A 112 0.502 15.172 14.477 1.00 0.00 C ATOM 1259 O GLU A 112 1.548 15.501 15.030 1.00 0.00 O ATOM 1260 CB GLU A 112 -1.037 16.627 13.142 1.00 0.00 C ATOM 1261 CG GLU A 112 -0.765 17.903 13.920 1.00 0.00 C ATOM 1262 CD GLU A 112 0.394 18.689 13.345 1.00 0.00 C ATOM 1263 OE1 GLU A 112 0.160 19.533 12.458 1.00 0.00 O ATOM 1264 OE2 GLU A 112 1.545 18.465 13.775 1.00 0.00 O ATOM 0 H GLU A 112 -0.381 13.703 12.684 1.00 0.00 H new ATOM 0 HA GLU A 112 1.016 16.227 12.692 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.332 16.887 12.125 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -1.881 16.108 13.596 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -1.660 18.525 13.918 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -0.552 17.654 14.960 1.00 0.00 H new ATOM 1271 N THR A 113 -0.371 14.346 15.026 1.00 0.00 N ATOM 1272 CA THR A 113 -0.176 13.817 16.360 1.00 0.00 C ATOM 1273 C THR A 113 0.459 12.420 16.314 1.00 0.00 C ATOM 1274 O THR A 113 0.507 11.707 17.318 1.00 0.00 O ATOM 1275 CB THR A 113 -1.519 13.778 17.142 1.00 0.00 C ATOM 1276 OG1 THR A 113 -1.288 13.421 18.509 1.00 0.00 O ATOM 1277 CG2 THR A 113 -2.495 12.788 16.515 1.00 0.00 C ATOM 0 H THR A 113 -1.224 14.028 14.565 1.00 0.00 H new ATOM 0 HA THR A 113 0.509 14.484 16.884 1.00 0.00 H new ATOM 0 HB THR A 113 -1.959 14.774 17.096 1.00 0.00 H new ATOM 0 HG1 THR A 113 -0.604 12.721 18.553 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.425 12.783 17.084 1.00 0.00 H new ATOM 0 HG22 THR A 113 -2.701 13.082 15.486 1.00 0.00 H new ATOM 0 HG23 THR A 113 -2.058 11.790 16.526 1.00 0.00 H new ATOM 1285 N THR A 114 0.955 12.044 15.149 1.00 0.00 N ATOM 1286 CA THR A 114 1.591 10.758 14.974 1.00 0.00 C ATOM 1287 C THR A 114 3.071 10.848 15.311 1.00 0.00 C ATOM 1288 O THR A 114 3.843 11.469 14.576 1.00 0.00 O ATOM 1289 CB THR A 114 1.436 10.259 13.527 1.00 0.00 C ATOM 1290 OG1 THR A 114 1.909 11.266 12.622 1.00 0.00 O ATOM 1291 CG2 THR A 114 -0.018 9.932 13.218 1.00 0.00 C ATOM 0 H THR A 114 0.927 12.618 14.306 1.00 0.00 H new ATOM 0 HA THR A 114 1.103 10.054 15.648 1.00 0.00 H new ATOM 0 HB THR A 114 2.024 9.349 13.408 1.00 0.00 H new ATOM 0 HG1 THR A 114 2.724 11.674 12.983 1.00 0.00 H new ATOM 0 HG21 THR A 114 -0.101 9.581 12.189 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.368 9.154 13.896 1.00 0.00 H new ATOM 0 HG23 THR A 114 -0.627 10.826 13.347 1.00 0.00 H new ATOM 1299 N ASP A 115 3.455 10.248 16.421 1.00 0.00 N ATOM 1300 CA ASP A 115 4.846 10.259 16.853 1.00 0.00 C ATOM 1301 C ASP A 115 5.726 9.484 15.896 1.00 0.00 C ATOM 1302 O ASP A 115 5.299 8.489 15.310 1.00 0.00 O ATOM 1303 CB ASP A 115 4.984 9.688 18.262 1.00 0.00 C ATOM 1304 CG ASP A 115 4.532 10.658 19.322 1.00 0.00 C ATOM 1305 OD1 ASP A 115 5.347 11.504 19.739 1.00 0.00 O ATOM 1306 OD2 ASP A 115 3.353 10.594 19.737 1.00 0.00 O ATOM 0 H ASP A 115 2.824 9.744 17.044 1.00 0.00 H new ATOM 0 HA ASP A 115 5.175 11.298 16.860 1.00 0.00 H new ATOM 0 HB2 ASP A 115 4.399 8.772 18.339 1.00 0.00 H new ATOM 0 HB3 ASP A 115 6.025 9.417 18.441 1.00 0.00 H new ATOM 1311 N LYS A 116 6.967 9.933 15.754 1.00 0.00 N ATOM 1312 CA LYS A 116 7.924 9.289 14.857 1.00 0.00 C ATOM 1313 C LYS A 116 8.388 7.946 15.420 1.00 0.00 C ATOM 1314 O LYS A 116 9.192 7.253 14.810 1.00 0.00 O ATOM 1315 CB LYS A 116 9.130 10.200 14.610 1.00 0.00 C ATOM 1316 CG LYS A 116 9.959 10.480 15.855 1.00 0.00 C ATOM 1317 CD LYS A 116 11.146 11.384 15.550 1.00 0.00 C ATOM 1318 CE LYS A 116 10.697 12.768 15.119 1.00 0.00 C ATOM 1319 NZ LYS A 116 9.909 13.456 16.178 1.00 0.00 N ATOM 0 H LYS A 116 7.337 10.744 16.250 1.00 0.00 H new ATOM 0 HA LYS A 116 7.420 9.108 13.908 1.00 0.00 H new ATOM 0 HB2 LYS A 116 9.770 9.742 13.855 1.00 0.00 H new ATOM 0 HB3 LYS A 116 8.779 11.147 14.199 1.00 0.00 H new ATOM 0 HG2 LYS A 116 9.331 10.948 16.613 1.00 0.00 H new ATOM 0 HG3 LYS A 116 10.316 9.539 16.273 1.00 0.00 H new ATOM 0 HD2 LYS A 116 11.779 11.465 16.434 1.00 0.00 H new ATOM 0 HD3 LYS A 116 11.753 10.936 14.763 1.00 0.00 H new ATOM 0 HE2 LYS A 116 11.570 13.370 14.869 1.00 0.00 H new ATOM 0 HE3 LYS A 116 10.095 12.688 14.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 9.840 14.470 15.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 8.954 13.045 16.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 10.381 13.334 17.097 1.00 0.00 H new ATOM 1333 N HIS A 117 7.871 7.590 16.587 1.00 0.00 N ATOM 1334 CA HIS A 117 8.199 6.324 17.228 1.00 0.00 C ATOM 1335 C HIS A 117 7.755 5.142 16.362 1.00 0.00 C ATOM 1336 O HIS A 117 8.342 4.061 16.428 1.00 0.00 O ATOM 1337 CB HIS A 117 7.542 6.242 18.613 1.00 0.00 C ATOM 1338 CG HIS A 117 7.742 4.925 19.308 1.00 0.00 C ATOM 1339 ND1 HIS A 117 6.760 3.962 19.391 1.00 0.00 N ATOM 1340 CD2 HIS A 117 8.819 4.414 19.940 1.00 0.00 C ATOM 1341 CE1 HIS A 117 7.224 2.920 20.043 1.00 0.00 C ATOM 1342 NE2 HIS A 117 8.473 3.166 20.390 1.00 0.00 N ATOM 0 H HIS A 117 7.216 8.167 17.114 1.00 0.00 H new ATOM 0 HA HIS A 117 9.281 6.274 17.347 1.00 0.00 H new ATOM 0 HB2 HIS A 117 7.943 7.037 19.241 1.00 0.00 H new ATOM 0 HB3 HIS A 117 6.473 6.427 18.508 1.00 0.00 H new ATOM 0 HD2 HIS A 117 9.776 4.898 20.068 1.00 0.00 H new ATOM 0 HE1 HIS A 117 6.676 2.015 20.259 1.00 0.00 H new ATOM 0 HE2 HIS A 117 9.081 2.532 20.908 1.00 0.00 H new ATOM 1351 N LEU A 118 6.721 5.355 15.555 1.00 0.00 N ATOM 1352 CA LEU A 118 6.209 4.306 14.687 1.00 0.00 C ATOM 1353 C LEU A 118 7.223 3.941 13.602 1.00 0.00 C ATOM 1354 O LEU A 118 7.307 2.789 13.180 1.00 0.00 O ATOM 1355 CB LEU A 118 4.835 4.701 14.093 1.00 0.00 C ATOM 1356 CG LEU A 118 4.731 6.069 13.392 1.00 0.00 C ATOM 1357 CD1 LEU A 118 5.245 6.003 11.961 1.00 0.00 C ATOM 1358 CD2 LEU A 118 3.296 6.571 13.420 1.00 0.00 C ATOM 0 H LEU A 118 6.224 6.243 15.485 1.00 0.00 H new ATOM 0 HA LEU A 118 6.054 3.411 15.289 1.00 0.00 H new ATOM 0 HB2 LEU A 118 4.545 3.933 13.376 1.00 0.00 H new ATOM 0 HB3 LEU A 118 4.101 4.679 14.899 1.00 0.00 H new ATOM 0 HG LEU A 118 5.361 6.772 13.938 1.00 0.00 H new ATOM 0 HD11 LEU A 118 5.157 6.985 11.497 1.00 0.00 H new ATOM 0 HD12 LEU A 118 6.291 5.696 11.964 1.00 0.00 H new ATOM 0 HD13 LEU A 118 4.656 5.281 11.396 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.239 7.538 12.921 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.651 5.859 12.905 1.00 0.00 H new ATOM 0 HD23 LEU A 118 2.967 6.676 14.454 1.00 0.00 H new ATOM 1370 N SER A 119 7.985 4.927 13.162 1.00 0.00 N ATOM 1371 CA SER A 119 9.033 4.723 12.185 1.00 0.00 C ATOM 1372 C SER A 119 10.041 5.866 12.287 1.00 0.00 C ATOM 1373 O SER A 119 9.777 6.981 11.817 1.00 0.00 O ATOM 1374 CB SER A 119 8.450 4.650 10.768 1.00 0.00 C ATOM 1375 OG SER A 119 9.460 4.346 9.817 1.00 0.00 O ATOM 0 H SER A 119 7.892 5.893 13.475 1.00 0.00 H new ATOM 0 HA SER A 119 9.533 3.776 12.390 1.00 0.00 H new ATOM 0 HB2 SER A 119 7.670 3.890 10.731 1.00 0.00 H new ATOM 0 HB3 SER A 119 7.981 5.601 10.514 1.00 0.00 H new ATOM 0 HG SER A 119 9.064 4.303 8.922 1.00 0.00 H new ATOM 1381 N PRO A 120 11.204 5.614 12.934 1.00 0.00 N ATOM 1382 CA PRO A 120 12.250 6.633 13.135 1.00 0.00 C ATOM 1383 C PRO A 120 12.675 7.324 11.842 1.00 0.00 C ATOM 1384 O PRO A 120 13.026 8.501 11.847 1.00 0.00 O ATOM 1385 CB PRO A 120 13.418 5.830 13.710 1.00 0.00 C ATOM 1386 CG PRO A 120 12.778 4.664 14.377 1.00 0.00 C ATOM 1387 CD PRO A 120 11.584 4.318 13.535 1.00 0.00 C ATOM 0 HA PRO A 120 11.898 7.440 13.777 1.00 0.00 H new ATOM 0 HB2 PRO A 120 14.104 5.511 12.926 1.00 0.00 H new ATOM 0 HB3 PRO A 120 13.997 6.423 14.418 1.00 0.00 H new ATOM 0 HG2 PRO A 120 13.468 3.823 14.442 1.00 0.00 H new ATOM 0 HG3 PRO A 120 12.480 4.911 15.396 1.00 0.00 H new ATOM 0 HD2 PRO A 120 11.830 3.578 12.773 1.00 0.00 H new ATOM 0 HD3 PRO A 120 10.776 3.901 14.136 1.00 0.00 H new ATOM 1395 N ASP A 121 12.628 6.601 10.739 1.00 0.00 N ATOM 1396 CA ASP A 121 13.038 7.149 9.455 1.00 0.00 C ATOM 1397 C ASP A 121 11.851 7.264 8.519 1.00 0.00 C ATOM 1398 O ASP A 121 11.994 7.168 7.303 1.00 0.00 O ATOM 1399 CB ASP A 121 14.124 6.280 8.820 1.00 0.00 C ATOM 1400 CG ASP A 121 15.404 6.286 9.623 1.00 0.00 C ATOM 1401 OD1 ASP A 121 16.196 7.241 9.482 1.00 0.00 O ATOM 1402 OD2 ASP A 121 15.628 5.336 10.405 1.00 0.00 O ATOM 0 H ASP A 121 12.310 5.632 10.704 1.00 0.00 H new ATOM 0 HA ASP A 121 13.444 8.146 9.627 1.00 0.00 H new ATOM 0 HB2 ASP A 121 13.760 5.257 8.728 1.00 0.00 H new ATOM 0 HB3 ASP A 121 14.329 6.638 7.811 1.00 0.00 H new ATOM 1407 N GLY A 122 10.684 7.515 9.083 1.00 0.00 N ATOM 1408 CA GLY A 122 9.488 7.619 8.281 1.00 0.00 C ATOM 1409 C GLY A 122 8.964 9.035 8.245 1.00 0.00 C ATOM 1410 O GLY A 122 7.773 9.262 8.027 1.00 0.00 O ATOM 0 H GLY A 122 10.543 7.649 10.084 1.00 0.00 H new ATOM 0 HA2 GLY A 122 9.700 7.283 7.266 1.00 0.00 H new ATOM 0 HA3 GLY A 122 8.721 6.957 8.683 1.00 0.00 H new ATOM 1414 N GLN A 123 9.860 9.994 8.471 1.00 0.00 N ATOM 1415 CA GLN A 123 9.497 11.412 8.462 1.00 0.00 C ATOM 1416 C GLN A 123 9.055 11.857 7.071 1.00 0.00 C ATOM 1417 O GLN A 123 8.270 12.797 6.927 1.00 0.00 O ATOM 1418 CB GLN A 123 10.664 12.278 8.957 1.00 0.00 C ATOM 1419 CG GLN A 123 11.971 12.065 8.203 1.00 0.00 C ATOM 1420 CD GLN A 123 13.046 13.058 8.607 1.00 0.00 C ATOM 1421 OE1 GLN A 123 12.750 14.199 8.972 1.00 0.00 O ATOM 1422 NE2 GLN A 123 14.296 12.634 8.554 1.00 0.00 N ATOM 0 H GLN A 123 10.846 9.815 8.663 1.00 0.00 H new ATOM 0 HA GLN A 123 8.657 11.544 9.144 1.00 0.00 H new ATOM 0 HB2 GLN A 123 10.380 13.328 8.878 1.00 0.00 H new ATOM 0 HB3 GLN A 123 10.831 12.071 10.014 1.00 0.00 H new ATOM 0 HG2 GLN A 123 12.330 11.052 8.385 1.00 0.00 H new ATOM 0 HG3 GLN A 123 11.787 12.150 7.132 1.00 0.00 H new ATOM 0 HE21 GLN A 123 14.499 11.683 8.247 1.00 0.00 H new ATOM 0 HE22 GLN A 123 15.058 13.258 8.820 1.00 0.00 H new ATOM 1431 N TYR A 124 9.555 11.175 6.053 1.00 0.00 N ATOM 1432 CA TYR A 124 9.195 11.478 4.684 1.00 0.00 C ATOM 1433 C TYR A 124 7.768 11.031 4.428 1.00 0.00 C ATOM 1434 O TYR A 124 7.346 9.967 4.894 1.00 0.00 O ATOM 1435 CB TYR A 124 10.173 10.810 3.720 1.00 0.00 C ATOM 1436 CG TYR A 124 11.605 11.247 3.950 1.00 0.00 C ATOM 1437 CD1 TYR A 124 12.074 12.452 3.443 1.00 0.00 C ATOM 1438 CD2 TYR A 124 12.482 10.464 4.694 1.00 0.00 C ATOM 1439 CE1 TYR A 124 13.371 12.864 3.663 1.00 0.00 C ATOM 1440 CE2 TYR A 124 13.781 10.874 4.923 1.00 0.00 C ATOM 1441 CZ TYR A 124 14.220 12.074 4.405 1.00 0.00 C ATOM 1442 OH TYR A 124 15.509 12.485 4.632 1.00 0.00 O ATOM 0 H TYR A 124 10.215 10.404 6.154 1.00 0.00 H new ATOM 0 HA TYR A 124 9.254 12.554 4.518 1.00 0.00 H new ATOM 0 HB2 TYR A 124 10.105 9.728 3.830 1.00 0.00 H new ATOM 0 HB3 TYR A 124 9.885 11.045 2.695 1.00 0.00 H new ATOM 0 HD1 TYR A 124 11.410 13.078 2.865 1.00 0.00 H new ATOM 0 HD2 TYR A 124 12.142 9.522 5.098 1.00 0.00 H new ATOM 0 HE1 TYR A 124 13.719 13.802 3.255 1.00 0.00 H new ATOM 0 HE2 TYR A 124 14.450 10.257 5.505 1.00 0.00 H new ATOM 0 HH TYR A 124 15.976 11.814 5.173 1.00 0.00 H new ATOM 1452 N VAL A 125 7.022 11.830 3.698 1.00 0.00 N ATOM 1453 CA VAL A 125 5.613 11.539 3.525 1.00 0.00 C ATOM 1454 C VAL A 125 5.269 10.564 2.393 1.00 0.00 C ATOM 1455 O VAL A 125 4.964 9.416 2.694 1.00 0.00 O ATOM 1456 CB VAL A 125 4.670 12.775 3.525 1.00 0.00 C ATOM 1457 CG1 VAL A 125 3.951 12.849 4.850 1.00 0.00 C ATOM 1458 CG2 VAL A 125 5.417 14.081 3.275 1.00 0.00 C ATOM 0 H VAL A 125 7.356 12.669 3.223 1.00 0.00 H new ATOM 0 HA VAL A 125 5.402 11.002 4.449 1.00 0.00 H new ATOM 0 HB VAL A 125 3.960 12.649 2.708 1.00 0.00 H new ATOM 0 HG11 VAL A 125 3.288 13.714 4.856 1.00 0.00 H new ATOM 0 HG12 VAL A 125 3.365 11.942 4.997 1.00 0.00 H new ATOM 0 HG13 VAL A 125 4.680 12.945 5.655 1.00 0.00 H new ATOM 0 HG21 VAL A 125 4.711 14.912 3.285 1.00 0.00 H new ATOM 0 HG22 VAL A 125 6.163 14.229 4.056 1.00 0.00 H new ATOM 0 HG23 VAL A 125 5.912 14.037 2.305 1.00 0.00 H new ATOM 1468 N PRO A 126 5.309 10.988 1.081 1.00 0.00 N ATOM 1469 CA PRO A 126 4.882 10.136 -0.046 1.00 0.00 C ATOM 1470 C PRO A 126 5.450 8.718 -0.023 1.00 0.00 C ATOM 1471 O PRO A 126 6.558 8.463 -0.502 1.00 0.00 O ATOM 1472 CB PRO A 126 5.363 10.888 -1.279 1.00 0.00 C ATOM 1473 CG PRO A 126 5.398 12.308 -0.858 1.00 0.00 C ATOM 1474 CD PRO A 126 5.769 12.304 0.600 1.00 0.00 C ATOM 0 HA PRO A 126 3.804 9.978 -0.011 1.00 0.00 H new ATOM 0 HB2 PRO A 126 6.348 10.543 -1.595 1.00 0.00 H new ATOM 0 HB3 PRO A 126 4.688 10.741 -2.122 1.00 0.00 H new ATOM 0 HG2 PRO A 126 6.126 12.870 -1.443 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.429 12.784 -1.012 1.00 0.00 H new ATOM 0 HD2 PRO A 126 6.843 12.427 0.739 1.00 0.00 H new ATOM 0 HD3 PRO A 126 5.283 13.118 1.138 1.00 0.00 H new ATOM 1482 N ARG A 127 4.668 7.821 0.571 1.00 0.00 N ATOM 1483 CA ARG A 127 4.941 6.399 0.639 1.00 0.00 C ATOM 1484 C ARG A 127 3.902 5.731 1.506 1.00 0.00 C ATOM 1485 O ARG A 127 2.971 6.386 1.987 1.00 0.00 O ATOM 1486 CB ARG A 127 6.365 6.068 1.126 1.00 0.00 C ATOM 1487 CG ARG A 127 6.764 6.654 2.471 1.00 0.00 C ATOM 1488 CD ARG A 127 8.205 6.274 2.798 1.00 0.00 C ATOM 1489 NE ARG A 127 9.105 6.587 1.679 1.00 0.00 N ATOM 1490 CZ ARG A 127 9.675 5.676 0.869 1.00 0.00 C ATOM 1491 NH1 ARG A 127 9.538 4.373 1.108 1.00 0.00 N ATOM 1492 NH2 ARG A 127 10.387 6.079 -0.165 1.00 0.00 N ATOM 0 H ARG A 127 3.796 8.080 1.033 1.00 0.00 H new ATOM 0 HA ARG A 127 4.884 6.009 -0.377 1.00 0.00 H new ATOM 0 HB2 ARG A 127 6.466 4.984 1.180 1.00 0.00 H new ATOM 0 HB3 ARG A 127 7.074 6.417 0.375 1.00 0.00 H new ATOM 0 HG2 ARG A 127 6.661 7.739 2.449 1.00 0.00 H new ATOM 0 HG3 ARG A 127 6.096 6.286 3.250 1.00 0.00 H new ATOM 0 HD2 ARG A 127 8.531 6.808 3.690 1.00 0.00 H new ATOM 0 HD3 ARG A 127 8.260 5.209 3.026 1.00 0.00 H new ATOM 0 HE ARG A 127 9.313 7.570 1.503 1.00 0.00 H new ATOM 0 HH11 ARG A 127 8.996 4.056 1.912 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.975 3.692 0.487 1.00 0.00 H new ATOM 0 HH21 ARG A 127 10.503 7.076 -0.347 1.00 0.00 H new ATOM 0 HH22 ARG A 127 10.822 5.394 -0.783 1.00 0.00 H new ATOM 1506 N ILE A 128 4.046 4.448 1.715 1.00 0.00 N ATOM 1507 CA ILE A 128 3.055 3.703 2.451 1.00 0.00 C ATOM 1508 C ILE A 128 3.567 3.246 3.808 1.00 0.00 C ATOM 1509 O ILE A 128 4.770 3.052 4.008 1.00 0.00 O ATOM 1510 CB ILE A 128 2.588 2.471 1.652 1.00 0.00 C ATOM 1511 CG1 ILE A 128 3.756 1.498 1.451 1.00 0.00 C ATOM 1512 CG2 ILE A 128 2.018 2.907 0.306 1.00 0.00 C ATOM 1513 CD1 ILE A 128 3.355 0.181 0.821 1.00 0.00 C ATOM 0 H ILE A 128 4.839 3.897 1.387 1.00 0.00 H new ATOM 0 HA ILE A 128 2.217 4.381 2.610 1.00 0.00 H new ATOM 0 HB ILE A 128 1.805 1.960 2.213 1.00 0.00 H new ATOM 0 HG12 ILE A 128 4.510 1.975 0.824 1.00 0.00 H new ATOM 0 HG13 ILE A 128 4.222 1.301 2.416 1.00 0.00 H new ATOM 0 HG21 ILE A 128 1.691 2.030 -0.252 1.00 0.00 H new ATOM 0 HG22 ILE A 128 1.169 3.571 0.468 1.00 0.00 H new ATOM 0 HG23 ILE A 128 2.786 3.432 -0.262 1.00 0.00 H new ATOM 0 HD11 ILE A 128 4.235 -0.453 0.712 1.00 0.00 H new ATOM 0 HD12 ILE A 128 2.624 -0.319 1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 128 2.916 0.365 -0.160 1.00 0.00 H new ATOM 1525 N MET A 129 2.642 3.100 4.729 1.00 0.00 N ATOM 1526 CA MET A 129 2.910 2.582 6.055 1.00 0.00 C ATOM 1527 C MET A 129 1.795 1.620 6.403 1.00 0.00 C ATOM 1528 O MET A 129 0.843 1.485 5.634 1.00 0.00 O ATOM 1529 CB MET A 129 2.982 3.715 7.087 1.00 0.00 C ATOM 1530 CG MET A 129 4.237 4.564 6.989 1.00 0.00 C ATOM 1531 SD MET A 129 4.234 5.946 8.148 1.00 0.00 S ATOM 1532 CE MET A 129 5.879 6.598 7.888 1.00 0.00 C ATOM 0 H MET A 129 1.663 3.342 4.576 1.00 0.00 H new ATOM 0 HA MET A 129 3.875 2.075 6.069 1.00 0.00 H new ATOM 0 HB2 MET A 129 2.111 4.358 6.966 1.00 0.00 H new ATOM 0 HB3 MET A 129 2.924 3.285 8.087 1.00 0.00 H new ATOM 0 HG2 MET A 129 5.110 3.939 7.178 1.00 0.00 H new ATOM 0 HG3 MET A 129 4.333 4.947 5.973 1.00 0.00 H new ATOM 0 HE1 MET A 129 6.041 7.450 8.548 1.00 0.00 H new ATOM 0 HE2 MET A 129 6.616 5.825 8.107 1.00 0.00 H new ATOM 0 HE3 MET A 129 5.984 6.917 6.851 1.00 0.00 H new ATOM 1542 N PHE A 130 1.881 0.954 7.531 1.00 0.00 N ATOM 1543 CA PHE A 130 0.842 0.009 7.878 1.00 0.00 C ATOM 1544 C PHE A 130 0.640 -0.087 9.380 1.00 0.00 C ATOM 1545 O PHE A 130 1.588 0.019 10.161 1.00 0.00 O ATOM 1546 CB PHE A 130 1.145 -1.387 7.290 1.00 0.00 C ATOM 1547 CG PHE A 130 2.164 -2.185 8.066 1.00 0.00 C ATOM 1548 CD1 PHE A 130 3.511 -1.887 7.986 1.00 0.00 C ATOM 1549 CD2 PHE A 130 1.761 -3.236 8.877 1.00 0.00 C ATOM 1550 CE1 PHE A 130 4.441 -2.620 8.701 1.00 0.00 C ATOM 1551 CE2 PHE A 130 2.684 -3.971 9.591 1.00 0.00 C ATOM 1552 CZ PHE A 130 4.025 -3.662 9.504 1.00 0.00 C ATOM 0 H PHE A 130 2.638 1.043 8.209 1.00 0.00 H new ATOM 0 HA PHE A 130 -0.085 0.381 7.441 1.00 0.00 H new ATOM 0 HB2 PHE A 130 0.217 -1.956 7.242 1.00 0.00 H new ATOM 0 HB3 PHE A 130 1.499 -1.267 6.266 1.00 0.00 H new ATOM 0 HD1 PHE A 130 3.841 -1.073 7.358 1.00 0.00 H new ATOM 0 HD2 PHE A 130 0.712 -3.482 8.950 1.00 0.00 H new ATOM 0 HE1 PHE A 130 5.491 -2.377 8.631 1.00 0.00 H new ATOM 0 HE2 PHE A 130 2.357 -4.788 10.218 1.00 0.00 H new ATOM 0 HZ PHE A 130 4.749 -4.235 10.064 1.00 0.00 H new ATOM 1562 N VAL A 131 -0.602 -0.255 9.766 1.00 0.00 N ATOM 1563 CA VAL A 131 -0.960 -0.463 11.144 1.00 0.00 C ATOM 1564 C VAL A 131 -1.476 -1.884 11.305 1.00 0.00 C ATOM 1565 O VAL A 131 -2.427 -2.290 10.630 1.00 0.00 O ATOM 1566 CB VAL A 131 -2.036 0.543 11.624 1.00 0.00 C ATOM 1567 CG1 VAL A 131 -2.343 0.334 13.104 1.00 0.00 C ATOM 1568 CG2 VAL A 131 -1.583 1.979 11.370 1.00 0.00 C ATOM 0 H VAL A 131 -1.397 -0.251 9.126 1.00 0.00 H new ATOM 0 HA VAL A 131 -0.073 -0.304 11.757 1.00 0.00 H new ATOM 0 HB VAL A 131 -2.948 0.365 11.054 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -3.101 1.050 13.423 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -2.713 -0.680 13.259 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -1.435 0.482 13.688 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -2.353 2.670 11.714 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -0.656 2.169 11.911 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -1.416 2.124 10.303 1.00 0.00 H new ATOM 1578 N ASP A 132 -0.844 -2.636 12.173 1.00 0.00 N ATOM 1579 CA ASP A 132 -1.206 -4.028 12.386 1.00 0.00 C ATOM 1580 C ASP A 132 -2.557 -4.123 13.100 1.00 0.00 C ATOM 1581 O ASP A 132 -2.859 -3.295 13.969 1.00 0.00 O ATOM 1582 CB ASP A 132 -0.117 -4.727 13.214 1.00 0.00 C ATOM 1583 CG ASP A 132 -0.303 -6.227 13.286 1.00 0.00 C ATOM 1584 OD1 ASP A 132 -1.112 -6.696 14.113 1.00 0.00 O ATOM 1585 OD2 ASP A 132 0.357 -6.949 12.512 1.00 0.00 O ATOM 0 H ASP A 132 -0.069 -2.310 12.751 1.00 0.00 H new ATOM 0 HA ASP A 132 -1.291 -4.524 11.419 1.00 0.00 H new ATOM 0 HB2 ASP A 132 0.859 -4.507 12.781 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -0.117 -4.317 14.224 1.00 0.00 H new ATOM 1590 N PRO A 133 -3.405 -5.128 12.728 1.00 0.00 N ATOM 1591 CA PRO A 133 -4.726 -5.357 13.362 1.00 0.00 C ATOM 1592 C PRO A 133 -4.655 -5.469 14.894 1.00 0.00 C ATOM 1593 O PRO A 133 -5.675 -5.386 15.575 1.00 0.00 O ATOM 1594 CB PRO A 133 -5.178 -6.688 12.759 1.00 0.00 C ATOM 1595 CG PRO A 133 -4.495 -6.750 11.440 1.00 0.00 C ATOM 1596 CD PRO A 133 -3.157 -6.094 11.635 1.00 0.00 C ATOM 0 HA PRO A 133 -5.404 -4.524 13.178 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -4.894 -7.528 13.393 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -6.262 -6.725 12.647 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -4.379 -7.782 11.109 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -5.075 -6.233 10.676 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -2.390 -6.819 11.906 1.00 0.00 H new ATOM 0 HD3 PRO A 133 -2.818 -5.595 10.727 1.00 0.00 H new ATOM 1604 N SER A 134 -3.451 -5.657 15.428 1.00 0.00 N ATOM 1605 CA SER A 134 -3.253 -5.739 16.869 1.00 0.00 C ATOM 1606 C SER A 134 -3.280 -4.339 17.510 1.00 0.00 C ATOM 1607 O SER A 134 -3.044 -4.193 18.714 1.00 0.00 O ATOM 1608 CB SER A 134 -1.921 -6.423 17.172 1.00 0.00 C ATOM 1609 OG SER A 134 -1.787 -7.619 16.415 1.00 0.00 O ATOM 0 H SER A 134 -2.596 -5.756 14.881 1.00 0.00 H new ATOM 0 HA SER A 134 -4.067 -6.326 17.294 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.098 -5.746 16.941 1.00 0.00 H new ATOM 0 HB3 SER A 134 -1.857 -6.651 18.236 1.00 0.00 H new ATOM 0 HG SER A 134 -1.291 -7.431 15.591 1.00 0.00 H new ATOM 1615 N LEU A 135 -3.572 -3.319 16.686 1.00 0.00 N ATOM 1616 CA LEU A 135 -3.648 -1.923 17.134 1.00 0.00 C ATOM 1617 C LEU A 135 -2.268 -1.378 17.482 1.00 0.00 C ATOM 1618 O LEU A 135 -1.969 -1.105 18.648 1.00 0.00 O ATOM 1619 CB LEU A 135 -4.611 -1.765 18.331 1.00 0.00 C ATOM 1620 CG LEU A 135 -6.093 -1.526 18.003 1.00 0.00 C ATOM 1621 CD1 LEU A 135 -6.293 -0.128 17.466 1.00 0.00 C ATOM 1622 CD2 LEU A 135 -6.618 -2.557 17.008 1.00 0.00 C ATOM 0 H LEU A 135 -3.762 -3.441 15.691 1.00 0.00 H new ATOM 0 HA LEU A 135 -4.045 -1.339 16.304 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -4.540 -2.663 18.945 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -4.260 -0.933 18.941 1.00 0.00 H new ATOM 0 HG LEU A 135 -6.661 -1.636 18.927 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -7.348 0.027 17.238 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -5.973 0.598 18.213 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.703 0.001 16.559 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -7.669 -2.358 16.799 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -6.045 -2.494 16.083 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -6.515 -3.556 17.431 1.00 0.00 H new ATOM 1634 N THR A 136 -1.426 -1.237 16.467 1.00 0.00 N ATOM 1635 CA THR A 136 -0.077 -0.721 16.647 1.00 0.00 C ATOM 1636 C THR A 136 0.652 -0.661 15.314 1.00 0.00 C ATOM 1637 O THR A 136 0.230 -1.280 14.335 1.00 0.00 O ATOM 1638 CB THR A 136 0.737 -1.594 17.633 1.00 0.00 C ATOM 1639 OG1 THR A 136 2.049 -1.047 17.825 1.00 0.00 O ATOM 1640 CG2 THR A 136 0.844 -3.027 17.130 1.00 0.00 C ATOM 0 H THR A 136 -1.657 -1.475 15.503 1.00 0.00 H new ATOM 0 HA THR A 136 -0.167 0.283 17.062 1.00 0.00 H new ATOM 0 HB THR A 136 0.211 -1.599 18.588 1.00 0.00 H new ATOM 0 HG1 THR A 136 2.550 -1.610 18.452 1.00 0.00 H new ATOM 0 HG21 THR A 136 1.420 -3.620 17.840 1.00 0.00 H new ATOM 0 HG22 THR A 136 -0.154 -3.452 17.028 1.00 0.00 H new ATOM 0 HG23 THR A 136 1.343 -3.036 16.161 1.00 0.00 H new ATOM 1648 N VAL A 137 1.734 0.084 15.279 1.00 0.00 N ATOM 1649 CA VAL A 137 2.536 0.203 14.090 1.00 0.00 C ATOM 1650 C VAL A 137 3.833 -0.575 14.286 1.00 0.00 C ATOM 1651 O VAL A 137 4.322 -0.695 15.409 1.00 0.00 O ATOM 1652 CB VAL A 137 2.855 1.678 13.766 1.00 0.00 C ATOM 1653 CG1 VAL A 137 3.449 1.793 12.380 1.00 0.00 C ATOM 1654 CG2 VAL A 137 1.608 2.543 13.891 1.00 0.00 C ATOM 0 H VAL A 137 2.079 0.622 16.074 1.00 0.00 H new ATOM 0 HA VAL A 137 1.973 -0.206 13.251 1.00 0.00 H new ATOM 0 HB VAL A 137 3.587 2.038 14.489 1.00 0.00 H new ATOM 0 HG11 VAL A 137 3.669 2.838 12.164 1.00 0.00 H new ATOM 0 HG12 VAL A 137 4.369 1.210 12.329 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.738 1.413 11.647 1.00 0.00 H new ATOM 0 HG21 VAL A 137 1.858 3.578 13.658 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.848 2.188 13.195 1.00 0.00 H new ATOM 0 HG23 VAL A 137 1.224 2.483 14.909 1.00 0.00 H new ATOM 1664 N ARG A 138 4.379 -1.106 13.211 1.00 0.00 N ATOM 1665 CA ARG A 138 5.575 -1.915 13.310 1.00 0.00 C ATOM 1666 C ARG A 138 6.637 -1.484 12.307 1.00 0.00 C ATOM 1667 O ARG A 138 6.422 -1.536 11.098 1.00 0.00 O ATOM 1668 CB ARG A 138 5.226 -3.393 13.142 1.00 0.00 C ATOM 1669 CG ARG A 138 6.396 -4.336 13.353 1.00 0.00 C ATOM 1670 CD ARG A 138 5.907 -5.735 13.671 1.00 0.00 C ATOM 1671 NE ARG A 138 5.086 -5.739 14.884 1.00 0.00 N ATOM 1672 CZ ARG A 138 4.158 -6.648 15.170 1.00 0.00 C ATOM 1673 NH1 ARG A 138 3.951 -7.670 14.354 1.00 0.00 N ATOM 1674 NH2 ARG A 138 3.440 -6.533 16.283 1.00 0.00 N ATOM 0 H ARG A 138 4.016 -0.993 12.265 1.00 0.00 H new ATOM 0 HA ARG A 138 5.999 -1.766 14.303 1.00 0.00 H new ATOM 0 HB2 ARG A 138 4.435 -3.650 13.846 1.00 0.00 H new ATOM 0 HB3 ARG A 138 4.824 -3.548 12.141 1.00 0.00 H new ATOM 0 HG2 ARG A 138 7.018 -4.358 12.458 1.00 0.00 H new ATOM 0 HG3 ARG A 138 7.022 -3.970 14.167 1.00 0.00 H new ATOM 0 HD2 ARG A 138 5.327 -6.121 12.833 1.00 0.00 H new ATOM 0 HD3 ARG A 138 6.760 -6.401 13.802 1.00 0.00 H new ATOM 0 HE ARG A 138 5.237 -4.989 15.559 1.00 0.00 H new ATOM 0 HH11 ARG A 138 4.504 -7.763 13.502 1.00 0.00 H new ATOM 0 HH12 ARG A 138 3.238 -8.365 14.577 1.00 0.00 H new ATOM 0 HH21 ARG A 138 3.601 -5.749 16.915 1.00 0.00 H new ATOM 0 HH22 ARG A 138 2.728 -7.229 16.505 1.00 0.00 H new ATOM 1688 N ALA A 139 7.783 -1.061 12.819 1.00 0.00 N ATOM 1689 CA ALA A 139 8.900 -0.650 11.980 1.00 0.00 C ATOM 1690 C ALA A 139 9.803 -1.845 11.684 1.00 0.00 C ATOM 1691 O ALA A 139 10.997 -1.837 11.985 1.00 0.00 O ATOM 1692 CB ALA A 139 9.690 0.466 12.655 1.00 0.00 C ATOM 0 H ALA A 139 7.965 -0.993 13.820 1.00 0.00 H new ATOM 0 HA ALA A 139 8.508 -0.269 11.037 1.00 0.00 H new ATOM 0 HB1 ALA A 139 10.521 0.762 12.015 1.00 0.00 H new ATOM 0 HB2 ALA A 139 9.038 1.323 12.822 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.076 0.112 13.611 1.00 0.00 H new ATOM 1698 N ASP A 140 9.213 -2.877 11.109 1.00 0.00 N ATOM 1699 CA ASP A 140 9.937 -4.102 10.780 1.00 0.00 C ATOM 1700 C ASP A 140 10.070 -4.236 9.264 1.00 0.00 C ATOM 1701 O ASP A 140 10.226 -5.327 8.724 1.00 0.00 O ATOM 1702 CB ASP A 140 9.192 -5.314 11.373 1.00 0.00 C ATOM 1703 CG ASP A 140 9.992 -6.604 11.314 1.00 0.00 C ATOM 1704 OD1 ASP A 140 11.015 -6.705 12.015 1.00 0.00 O ATOM 1705 OD2 ASP A 140 9.580 -7.532 10.588 1.00 0.00 O ATOM 0 H ASP A 140 8.225 -2.895 10.856 1.00 0.00 H new ATOM 0 HA ASP A 140 10.938 -4.062 11.209 1.00 0.00 H new ATOM 0 HB2 ASP A 140 8.936 -5.101 12.411 1.00 0.00 H new ATOM 0 HB3 ASP A 140 8.254 -5.452 10.836 1.00 0.00 H new ATOM 1710 N ILE A 141 10.020 -3.113 8.580 1.00 0.00 N ATOM 1711 CA ILE A 141 10.120 -3.110 7.138 1.00 0.00 C ATOM 1712 C ILE A 141 11.555 -2.889 6.689 1.00 0.00 C ATOM 1713 O ILE A 141 12.085 -1.774 6.776 1.00 0.00 O ATOM 1714 CB ILE A 141 9.217 -2.034 6.496 1.00 0.00 C ATOM 1715 CG1 ILE A 141 7.755 -2.277 6.883 1.00 0.00 C ATOM 1716 CG2 ILE A 141 9.386 -2.046 4.976 1.00 0.00 C ATOM 1717 CD1 ILE A 141 6.797 -1.231 6.356 1.00 0.00 C ATOM 0 H ILE A 141 9.911 -2.190 9.000 1.00 0.00 H new ATOM 0 HA ILE A 141 9.781 -4.091 6.804 1.00 0.00 H new ATOM 0 HB ILE A 141 9.512 -1.052 6.866 1.00 0.00 H new ATOM 0 HG12 ILE A 141 7.449 -3.255 6.511 1.00 0.00 H new ATOM 0 HG13 ILE A 141 7.678 -2.311 7.970 1.00 0.00 H new ATOM 0 HG21 ILE A 141 8.745 -1.284 4.533 1.00 0.00 H new ATOM 0 HG22 ILE A 141 10.426 -1.837 4.724 1.00 0.00 H new ATOM 0 HG23 ILE A 141 9.108 -3.025 4.587 1.00 0.00 H new ATOM 0 HD11 ILE A 141 5.783 -1.474 6.673 1.00 0.00 H new ATOM 0 HD12 ILE A 141 7.075 -0.253 6.748 1.00 0.00 H new ATOM 0 HD13 ILE A 141 6.842 -1.212 5.267 1.00 0.00 H new ATOM 1729 N THR A 142 12.186 -3.951 6.244 1.00 0.00 N ATOM 1730 CA THR A 142 13.518 -3.883 5.712 1.00 0.00 C ATOM 1731 C THR A 142 13.468 -3.590 4.213 1.00 0.00 C ATOM 1732 O THR A 142 12.659 -4.174 3.484 1.00 0.00 O ATOM 1733 CB THR A 142 14.273 -5.200 5.969 1.00 0.00 C ATOM 1734 OG1 THR A 142 13.382 -6.312 5.767 1.00 0.00 O ATOM 1735 CG2 THR A 142 14.819 -5.238 7.390 1.00 0.00 C ATOM 0 H THR A 142 11.784 -4.888 6.243 1.00 0.00 H new ATOM 0 HA THR A 142 14.051 -3.076 6.215 1.00 0.00 H new ATOM 0 HB THR A 142 15.109 -5.264 5.272 1.00 0.00 H new ATOM 0 HG1 THR A 142 13.863 -7.150 5.929 1.00 0.00 H new ATOM 0 HG21 THR A 142 15.349 -6.177 7.551 1.00 0.00 H new ATOM 0 HG22 THR A 142 15.505 -4.404 7.539 1.00 0.00 H new ATOM 0 HG23 THR A 142 13.995 -5.161 8.099 1.00 0.00 H new ATOM 1743 N GLY A 143 14.320 -2.690 3.762 1.00 0.00 N ATOM 1744 CA GLY A 143 14.332 -2.318 2.364 1.00 0.00 C ATOM 1745 C GLY A 143 15.559 -2.847 1.663 1.00 0.00 C ATOM 1746 O GLY A 143 16.680 -2.664 2.145 1.00 0.00 O ATOM 0 H GLY A 143 15.008 -2.207 4.340 1.00 0.00 H new ATOM 0 HA2 GLY A 143 13.437 -2.704 1.876 1.00 0.00 H new ATOM 0 HA3 GLY A 143 14.300 -1.232 2.275 1.00 0.00 H new ATOM 1750 N ARG A 144 15.361 -3.516 0.539 1.00 0.00 N ATOM 1751 CA ARG A 144 16.477 -4.072 -0.217 1.00 0.00 C ATOM 1752 C ARG A 144 17.296 -2.991 -0.904 1.00 0.00 C ATOM 1753 O ARG A 144 18.518 -3.094 -0.994 1.00 0.00 O ATOM 1754 CB ARG A 144 15.995 -5.092 -1.243 1.00 0.00 C ATOM 1755 CG ARG A 144 15.614 -6.429 -0.635 1.00 0.00 C ATOM 1756 CD ARG A 144 15.204 -7.426 -1.704 1.00 0.00 C ATOM 1757 NE ARG A 144 13.964 -7.034 -2.372 1.00 0.00 N ATOM 1758 CZ ARG A 144 13.583 -7.450 -3.578 1.00 0.00 C ATOM 1759 NH1 ARG A 144 14.349 -8.279 -4.277 1.00 0.00 N ATOM 1760 NH2 ARG A 144 12.425 -7.038 -4.076 1.00 0.00 N ATOM 0 H ARG A 144 14.443 -3.688 0.129 1.00 0.00 H new ATOM 0 HA ARG A 144 17.122 -4.575 0.503 1.00 0.00 H new ATOM 0 HB2 ARG A 144 15.134 -4.684 -1.772 1.00 0.00 H new ATOM 0 HB3 ARG A 144 16.779 -5.249 -1.984 1.00 0.00 H new ATOM 0 HG2 ARG A 144 16.456 -6.826 -0.069 1.00 0.00 H new ATOM 0 HG3 ARG A 144 14.794 -6.290 0.069 1.00 0.00 H new ATOM 0 HD2 ARG A 144 16.001 -7.514 -2.442 1.00 0.00 H new ATOM 0 HD3 ARG A 144 15.077 -8.410 -1.253 1.00 0.00 H new ATOM 0 HE ARG A 144 13.344 -6.393 -1.877 1.00 0.00 H new ATOM 0 HH11 ARG A 144 15.236 -8.602 -3.891 1.00 0.00 H new ATOM 0 HH12 ARG A 144 14.050 -8.593 -5.200 1.00 0.00 H new ATOM 0 HH21 ARG A 144 11.833 -6.407 -3.536 1.00 0.00 H new ATOM 0 HH22 ARG A 144 12.126 -7.352 -4.999 1.00 0.00 H new ATOM 1774 N TYR A 145 16.634 -1.961 -1.395 1.00 0.00 N ATOM 1775 CA TYR A 145 17.329 -0.895 -2.080 1.00 0.00 C ATOM 1776 C TYR A 145 17.829 0.160 -1.112 1.00 0.00 C ATOM 1777 O TYR A 145 17.116 1.095 -0.770 1.00 0.00 O ATOM 1778 CB TYR A 145 16.443 -0.261 -3.152 1.00 0.00 C ATOM 1779 CG TYR A 145 16.122 -1.195 -4.293 1.00 0.00 C ATOM 1780 CD1 TYR A 145 17.095 -1.537 -5.222 1.00 0.00 C ATOM 1781 CD2 TYR A 145 14.853 -1.741 -4.439 1.00 0.00 C ATOM 1782 CE1 TYR A 145 16.815 -2.394 -6.264 1.00 0.00 C ATOM 1783 CE2 TYR A 145 14.565 -2.601 -5.479 1.00 0.00 C ATOM 1784 CZ TYR A 145 15.550 -2.924 -6.389 1.00 0.00 C ATOM 1785 OH TYR A 145 15.271 -3.786 -7.428 1.00 0.00 O ATOM 0 H TYR A 145 15.623 -1.842 -1.332 1.00 0.00 H new ATOM 0 HA TYR A 145 18.197 -1.338 -2.568 1.00 0.00 H new ATOM 0 HB2 TYR A 145 15.513 0.073 -2.693 1.00 0.00 H new ATOM 0 HB3 TYR A 145 16.940 0.625 -3.546 1.00 0.00 H new ATOM 0 HD1 TYR A 145 18.088 -1.124 -5.126 1.00 0.00 H new ATOM 0 HD2 TYR A 145 14.080 -1.489 -3.728 1.00 0.00 H new ATOM 0 HE1 TYR A 145 17.583 -2.649 -6.979 1.00 0.00 H new ATOM 0 HE2 TYR A 145 13.574 -3.019 -5.580 1.00 0.00 H new ATOM 0 HH TYR A 145 14.335 -4.072 -7.374 1.00 0.00 H new ATOM 1795 N SER A 146 19.054 -0.010 -0.659 1.00 0.00 N ATOM 1796 CA SER A 146 19.673 0.955 0.220 1.00 0.00 C ATOM 1797 C SER A 146 20.403 2.004 -0.615 1.00 0.00 C ATOM 1798 O SER A 146 20.985 2.948 -0.075 1.00 0.00 O ATOM 1799 CB SER A 146 20.638 0.259 1.194 1.00 0.00 C ATOM 1800 OG SER A 146 21.141 1.173 2.161 1.00 0.00 O ATOM 0 H SER A 146 19.641 -0.812 -0.888 1.00 0.00 H new ATOM 0 HA SER A 146 18.903 1.448 0.813 1.00 0.00 H new ATOM 0 HB2 SER A 146 20.123 -0.560 1.697 1.00 0.00 H new ATOM 0 HB3 SER A 146 21.467 -0.179 0.638 1.00 0.00 H new ATOM 0 HG SER A 146 21.257 2.054 1.749 1.00 0.00 H new ATOM 1806 N ASN A 147 20.390 1.782 -1.947 1.00 0.00 N ATOM 1807 CA ASN A 147 20.974 2.694 -2.938 1.00 0.00 C ATOM 1808 C ASN A 147 20.684 4.117 -2.552 1.00 0.00 C ATOM 1809 O ASN A 147 21.590 4.950 -2.474 1.00 0.00 O ATOM 1810 CB ASN A 147 20.425 2.407 -4.344 1.00 0.00 C ATOM 1811 CG ASN A 147 20.730 0.997 -4.827 1.00 0.00 C ATOM 1812 OD1 ASN A 147 20.771 0.046 -4.043 1.00 0.00 O ATOM 1813 ND2 ASN A 147 20.952 0.853 -6.117 1.00 0.00 N ATOM 0 H ASN A 147 19.967 0.952 -2.363 1.00 0.00 H new ATOM 0 HA ASN A 147 22.052 2.536 -2.957 1.00 0.00 H new ATOM 0 HB2 ASN A 147 19.346 2.559 -4.344 1.00 0.00 H new ATOM 0 HB3 ASN A 147 20.848 3.125 -5.046 1.00 0.00 H new ATOM 0 HD21 ASN A 147 21.166 -0.069 -6.498 1.00 0.00 H new ATOM 0 HD22 ASN A 147 20.909 1.663 -6.735 1.00 0.00 H new ATOM 1820 N ARG A 148 19.422 4.402 -2.312 1.00 0.00 N ATOM 1821 CA ARG A 148 18.987 5.655 -1.776 1.00 0.00 C ATOM 1822 C ARG A 148 17.738 5.349 -0.955 1.00 0.00 C ATOM 1823 O ARG A 148 16.612 5.382 -1.450 1.00 0.00 O ATOM 1824 CB ARG A 148 18.728 6.714 -2.870 1.00 0.00 C ATOM 1825 CG ARG A 148 17.753 6.307 -3.980 1.00 0.00 C ATOM 1826 CD ARG A 148 18.396 5.374 -4.995 1.00 0.00 C ATOM 1827 NE ARG A 148 19.517 6.008 -5.698 1.00 0.00 N ATOM 1828 CZ ARG A 148 20.050 5.553 -6.834 1.00 0.00 C ATOM 1829 NH1 ARG A 148 19.561 4.456 -7.416 1.00 0.00 N ATOM 1830 NH2 ARG A 148 21.067 6.198 -7.391 1.00 0.00 N ATOM 0 H ARG A 148 18.660 3.748 -2.491 1.00 0.00 H new ATOM 0 HA ARG A 148 19.764 6.100 -1.155 1.00 0.00 H new ATOM 0 HB2 ARG A 148 18.347 7.616 -2.392 1.00 0.00 H new ATOM 0 HB3 ARG A 148 19.682 6.975 -3.329 1.00 0.00 H new ATOM 0 HG2 ARG A 148 16.885 5.818 -3.538 1.00 0.00 H new ATOM 0 HG3 ARG A 148 17.390 7.200 -4.489 1.00 0.00 H new ATOM 0 HD2 ARG A 148 18.749 4.476 -4.488 1.00 0.00 H new ATOM 0 HD3 ARG A 148 17.647 5.057 -5.721 1.00 0.00 H new ATOM 0 HE ARG A 148 19.916 6.854 -5.291 1.00 0.00 H new ATOM 0 HH11 ARG A 148 18.776 3.961 -6.993 1.00 0.00 H new ATOM 0 HH12 ARG A 148 19.972 4.113 -8.284 1.00 0.00 H new ATOM 0 HH21 ARG A 148 21.440 7.039 -6.951 1.00 0.00 H new ATOM 0 HH22 ARG A 148 21.476 5.852 -8.259 1.00 0.00 H new ATOM 1844 N LEU A 149 17.970 4.999 0.291 1.00 0.00 N ATOM 1845 CA LEU A 149 16.949 4.440 1.160 1.00 0.00 C ATOM 1846 C LEU A 149 15.905 5.431 1.672 1.00 0.00 C ATOM 1847 O LEU A 149 14.921 5.019 2.294 1.00 0.00 O ATOM 1848 CB LEU A 149 17.570 3.638 2.311 1.00 0.00 C ATOM 1849 CG LEU A 149 16.585 2.774 3.121 1.00 0.00 C ATOM 1850 CD1 LEU A 149 15.670 1.970 2.192 1.00 0.00 C ATOM 1851 CD2 LEU A 149 17.340 1.846 4.058 1.00 0.00 C ATOM 0 H LEU A 149 18.882 5.094 0.738 1.00 0.00 H new ATOM 0 HA LEU A 149 16.387 3.764 0.515 1.00 0.00 H new ATOM 0 HB2 LEU A 149 18.345 2.989 1.903 1.00 0.00 H new ATOM 0 HB3 LEU A 149 18.062 4.333 2.992 1.00 0.00 H new ATOM 0 HG LEU A 149 15.961 3.439 3.718 1.00 0.00 H new ATOM 0 HD11 LEU A 149 14.984 1.368 2.788 1.00 0.00 H new ATOM 0 HD12 LEU A 149 15.100 2.653 1.562 1.00 0.00 H new ATOM 0 HD13 LEU A 149 16.274 1.316 1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 149 16.629 1.243 4.623 1.00 0.00 H new ATOM 0 HD22 LEU A 149 17.990 1.192 3.477 1.00 0.00 H new ATOM 0 HD23 LEU A 149 17.943 2.437 4.747 1.00 0.00 H new ATOM 1863 N TYR A 150 16.052 6.713 1.423 1.00 0.00 N ATOM 1864 CA TYR A 150 15.090 7.631 1.971 1.00 0.00 C ATOM 1865 C TYR A 150 14.602 8.502 0.837 1.00 0.00 C ATOM 1866 O TYR A 150 15.344 9.337 0.309 1.00 0.00 O ATOM 1867 CB TYR A 150 15.682 8.475 3.118 1.00 0.00 C ATOM 1868 CG TYR A 150 17.196 8.575 3.116 1.00 0.00 C ATOM 1869 CD1 TYR A 150 17.857 9.521 2.342 1.00 0.00 C ATOM 1870 CD2 TYR A 150 17.962 7.723 3.901 1.00 0.00 C ATOM 1871 CE1 TYR A 150 19.235 9.612 2.353 1.00 0.00 C ATOM 1872 CE2 TYR A 150 19.336 7.808 3.916 1.00 0.00 C ATOM 1873 CZ TYR A 150 19.969 8.751 3.142 1.00 0.00 C ATOM 1874 OH TYR A 150 21.345 8.836 3.159 1.00 0.00 O ATOM 0 H TYR A 150 16.799 7.128 0.866 1.00 0.00 H new ATOM 0 HA TYR A 150 14.260 7.079 2.412 1.00 0.00 H new ATOM 0 HB2 TYR A 150 15.265 9.481 3.063 1.00 0.00 H new ATOM 0 HB3 TYR A 150 15.361 8.048 4.068 1.00 0.00 H new ATOM 0 HD1 TYR A 150 17.284 10.195 1.722 1.00 0.00 H new ATOM 0 HD2 TYR A 150 17.470 6.980 4.511 1.00 0.00 H new ATOM 0 HE1 TYR A 150 19.735 10.353 1.747 1.00 0.00 H new ATOM 0 HE2 TYR A 150 19.914 7.136 4.533 1.00 0.00 H new ATOM 0 HH TYR A 150 21.707 8.158 3.767 1.00 0.00 H new ATOM 1884 N ALA A 151 13.364 8.297 0.455 1.00 0.00 N ATOM 1885 CA ALA A 151 12.816 8.977 -0.694 1.00 0.00 C ATOM 1886 C ALA A 151 11.320 9.186 -0.574 1.00 0.00 C ATOM 1887 O ALA A 151 10.688 8.715 0.376 1.00 0.00 O ATOM 1888 CB ALA A 151 13.140 8.165 -1.939 1.00 0.00 C ATOM 0 H ALA A 151 12.716 7.664 0.924 1.00 0.00 H new ATOM 0 HA ALA A 151 13.267 9.967 -0.759 1.00 0.00 H new ATOM 0 HB1 ALA A 151 12.732 8.666 -2.817 1.00 0.00 H new ATOM 0 HB2 ALA A 151 14.221 8.074 -2.043 1.00 0.00 H new ATOM 0 HB3 ALA A 151 12.699 7.172 -1.851 1.00 0.00 H new ATOM 1894 N TYR A 152 10.760 9.904 -1.538 1.00 0.00 N ATOM 1895 CA TYR A 152 9.325 10.157 -1.579 1.00 0.00 C ATOM 1896 C TYR A 152 8.850 10.468 -2.999 1.00 0.00 C ATOM 1897 O TYR A 152 7.722 10.900 -3.205 1.00 0.00 O ATOM 1898 CB TYR A 152 8.958 11.307 -0.637 1.00 0.00 C ATOM 1899 CG TYR A 152 9.809 12.556 -0.801 1.00 0.00 C ATOM 1900 CD1 TYR A 152 9.860 13.242 -2.012 1.00 0.00 C ATOM 1901 CD2 TYR A 152 10.546 13.054 0.260 1.00 0.00 C ATOM 1902 CE1 TYR A 152 10.626 14.381 -2.155 1.00 0.00 C ATOM 1903 CE2 TYR A 152 11.316 14.192 0.126 1.00 0.00 C ATOM 1904 CZ TYR A 152 11.352 14.852 -1.082 1.00 0.00 C ATOM 1905 OH TYR A 152 12.116 15.991 -1.217 1.00 0.00 O ATOM 0 H TYR A 152 11.281 10.324 -2.307 1.00 0.00 H new ATOM 0 HA TYR A 152 8.820 9.249 -1.248 1.00 0.00 H new ATOM 0 HB2 TYR A 152 7.913 11.572 -0.798 1.00 0.00 H new ATOM 0 HB3 TYR A 152 9.043 10.958 0.392 1.00 0.00 H new ATOM 0 HD1 TYR A 152 9.290 12.876 -2.854 1.00 0.00 H new ATOM 0 HD2 TYR A 152 10.518 12.542 1.211 1.00 0.00 H new ATOM 0 HE1 TYR A 152 10.656 14.900 -3.102 1.00 0.00 H new ATOM 0 HE2 TYR A 152 11.887 14.563 0.964 1.00 0.00 H new ATOM 0 HH TYR A 152 12.563 16.187 -0.367 1.00 0.00 H new ATOM 1915 N GLU A 153 9.712 10.260 -3.972 1.00 0.00 N ATOM 1916 CA GLU A 153 9.362 10.539 -5.354 1.00 0.00 C ATOM 1917 C GLU A 153 8.533 9.411 -5.942 1.00 0.00 C ATOM 1918 O GLU A 153 8.668 8.264 -5.527 1.00 0.00 O ATOM 1919 CB GLU A 153 10.615 10.727 -6.204 1.00 0.00 C ATOM 1920 CG GLU A 153 11.404 11.978 -5.890 1.00 0.00 C ATOM 1921 CD GLU A 153 12.520 12.198 -6.881 1.00 0.00 C ATOM 1922 OE1 GLU A 153 13.630 11.674 -6.658 1.00 0.00 O ATOM 1923 OE2 GLU A 153 12.286 12.885 -7.902 1.00 0.00 O ATOM 0 H GLU A 153 10.657 9.900 -3.836 1.00 0.00 H new ATOM 0 HA GLU A 153 8.777 11.459 -5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 153 11.263 9.861 -6.070 1.00 0.00 H new ATOM 0 HB3 GLU A 153 10.326 10.749 -7.255 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.737 12.840 -5.896 1.00 0.00 H new ATOM 0 HG3 GLU A 153 11.819 11.904 -4.885 1.00 0.00 H new ATOM 1930 N PRO A 154 7.665 9.721 -6.931 1.00 0.00 N ATOM 1931 CA PRO A 154 6.865 8.703 -7.629 1.00 0.00 C ATOM 1932 C PRO A 154 7.757 7.643 -8.281 1.00 0.00 C ATOM 1933 O PRO A 154 7.324 6.521 -8.543 1.00 0.00 O ATOM 1934 CB PRO A 154 6.126 9.507 -8.708 1.00 0.00 C ATOM 1935 CG PRO A 154 6.102 10.905 -8.193 1.00 0.00 C ATOM 1936 CD PRO A 154 7.379 11.082 -7.427 1.00 0.00 C ATOM 0 HA PRO A 154 6.200 8.163 -6.955 1.00 0.00 H new ATOM 0 HB2 PRO A 154 6.641 9.448 -9.667 1.00 0.00 H new ATOM 0 HB3 PRO A 154 5.117 9.126 -8.864 1.00 0.00 H new ATOM 0 HG2 PRO A 154 6.035 11.622 -9.011 1.00 0.00 H new ATOM 0 HG3 PRO A 154 5.236 11.071 -7.552 1.00 0.00 H new ATOM 0 HD2 PRO A 154 8.182 11.456 -8.063 1.00 0.00 H new ATOM 0 HD3 PRO A 154 7.263 11.793 -6.609 1.00 0.00 H new ATOM 1944 N ALA A 155 9.007 8.021 -8.546 1.00 0.00 N ATOM 1945 CA ALA A 155 9.985 7.124 -9.135 1.00 0.00 C ATOM 1946 C ALA A 155 10.437 6.063 -8.138 1.00 0.00 C ATOM 1947 O ALA A 155 10.850 4.974 -8.529 1.00 0.00 O ATOM 1948 CB ALA A 155 11.180 7.911 -9.639 1.00 0.00 C ATOM 0 H ALA A 155 9.364 8.957 -8.357 1.00 0.00 H new ATOM 0 HA ALA A 155 9.511 6.615 -9.975 1.00 0.00 H new ATOM 0 HB1 ALA A 155 11.907 7.228 -10.079 1.00 0.00 H new ATOM 0 HB2 ALA A 155 10.853 8.627 -10.393 1.00 0.00 H new ATOM 0 HB3 ALA A 155 11.641 8.445 -8.808 1.00 0.00 H new ATOM 1954 N ASP A 156 10.318 6.369 -6.842 1.00 0.00 N ATOM 1955 CA ASP A 156 10.731 5.442 -5.766 1.00 0.00 C ATOM 1956 C ASP A 156 9.695 4.328 -5.594 1.00 0.00 C ATOM 1957 O ASP A 156 9.616 3.673 -4.557 1.00 0.00 O ATOM 1958 CB ASP A 156 10.931 6.195 -4.445 1.00 0.00 C ATOM 1959 CG ASP A 156 11.696 5.368 -3.424 1.00 0.00 C ATOM 1960 OD1 ASP A 156 12.894 5.122 -3.650 1.00 0.00 O ATOM 1961 OD2 ASP A 156 11.105 4.980 -2.392 1.00 0.00 O ATOM 0 H ASP A 156 9.938 7.254 -6.505 1.00 0.00 H new ATOM 0 HA ASP A 156 11.683 4.992 -6.050 1.00 0.00 H new ATOM 0 HB2 ASP A 156 11.470 7.123 -4.636 1.00 0.00 H new ATOM 0 HB3 ASP A 156 9.959 6.469 -4.034 1.00 0.00 H new ATOM 1966 N THR A 157 8.943 4.089 -6.646 1.00 0.00 N ATOM 1967 CA THR A 157 7.850 3.155 -6.611 1.00 0.00 C ATOM 1968 C THR A 157 8.339 1.717 -6.441 1.00 0.00 C ATOM 1969 O THR A 157 7.566 0.846 -6.059 1.00 0.00 O ATOM 1970 CB THR A 157 6.933 3.273 -7.856 1.00 0.00 C ATOM 1971 OG1 THR A 157 5.923 2.254 -7.827 1.00 0.00 O ATOM 1972 CG2 THR A 157 7.724 3.169 -9.152 1.00 0.00 C ATOM 0 H THR A 157 9.077 4.541 -7.551 1.00 0.00 H new ATOM 0 HA THR A 157 7.254 3.418 -5.737 1.00 0.00 H new ATOM 0 HB THR A 157 6.464 4.257 -7.823 1.00 0.00 H new ATOM 0 HG1 THR A 157 5.452 2.236 -8.686 1.00 0.00 H new ATOM 0 HG21 THR A 157 7.045 3.256 -10.000 1.00 0.00 H new ATOM 0 HG22 THR A 157 8.462 3.970 -9.193 1.00 0.00 H new ATOM 0 HG23 THR A 157 8.232 2.206 -9.192 1.00 0.00 H new ATOM 1980 N ALA A 158 9.628 1.462 -6.711 1.00 0.00 N ATOM 1981 CA ALA A 158 10.166 0.116 -6.587 1.00 0.00 C ATOM 1982 C ALA A 158 10.488 -0.182 -5.127 1.00 0.00 C ATOM 1983 O ALA A 158 10.099 -1.215 -4.602 1.00 0.00 O ATOM 1984 CB ALA A 158 11.406 -0.041 -7.452 1.00 0.00 C ATOM 0 H ALA A 158 10.303 2.165 -7.012 1.00 0.00 H new ATOM 0 HA ALA A 158 9.418 -0.597 -6.932 1.00 0.00 H new ATOM 0 HB1 ALA A 158 11.796 -1.053 -7.348 1.00 0.00 H new ATOM 0 HB2 ALA A 158 11.148 0.143 -8.495 1.00 0.00 H new ATOM 0 HB3 ALA A 158 12.164 0.675 -7.134 1.00 0.00 H new ATOM 1990 N LEU A 159 11.223 0.725 -4.489 1.00 0.00 N ATOM 1991 CA LEU A 159 11.534 0.615 -3.069 1.00 0.00 C ATOM 1992 C LEU A 159 10.230 0.597 -2.277 1.00 0.00 C ATOM 1993 O LEU A 159 10.030 -0.246 -1.413 1.00 0.00 O ATOM 1994 CB LEU A 159 12.432 1.797 -2.650 1.00 0.00 C ATOM 1995 CG LEU A 159 13.103 1.708 -1.270 1.00 0.00 C ATOM 1996 CD1 LEU A 159 14.271 2.670 -1.201 1.00 0.00 C ATOM 1997 CD2 LEU A 159 12.117 2.026 -0.161 1.00 0.00 C ATOM 0 H LEU A 159 11.617 1.551 -4.939 1.00 0.00 H new ATOM 0 HA LEU A 159 12.075 -0.309 -2.865 1.00 0.00 H new ATOM 0 HB2 LEU A 159 13.214 1.911 -3.400 1.00 0.00 H new ATOM 0 HB3 LEU A 159 11.830 2.706 -2.676 1.00 0.00 H new ATOM 0 HG LEU A 159 13.459 0.687 -1.133 1.00 0.00 H new ATOM 0 HD11 LEU A 159 14.741 2.601 -0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 159 14.999 2.415 -1.971 1.00 0.00 H new ATOM 0 HD13 LEU A 159 13.914 3.687 -1.362 1.00 0.00 H new ATOM 0 HD21 LEU A 159 12.619 1.955 0.804 1.00 0.00 H new ATOM 0 HD22 LEU A 159 11.731 3.036 -0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 159 11.291 1.315 -0.193 1.00 0.00 H new ATOM 2009 N LEU A 160 9.358 1.548 -2.593 1.00 0.00 N ATOM 2010 CA LEU A 160 8.020 1.599 -2.002 1.00 0.00 C ATOM 2011 C LEU A 160 7.349 0.231 -2.129 1.00 0.00 C ATOM 2012 O LEU A 160 6.724 -0.263 -1.186 1.00 0.00 O ATOM 2013 CB LEU A 160 7.166 2.681 -2.693 1.00 0.00 C ATOM 2014 CG LEU A 160 5.755 2.929 -2.105 1.00 0.00 C ATOM 2015 CD1 LEU A 160 5.249 4.279 -2.539 1.00 0.00 C ATOM 2016 CD2 LEU A 160 4.763 1.859 -2.554 1.00 0.00 C ATOM 0 H LEU A 160 9.552 2.298 -3.257 1.00 0.00 H new ATOM 0 HA LEU A 160 8.109 1.856 -0.946 1.00 0.00 H new ATOM 0 HB2 LEU A 160 7.717 3.621 -2.664 1.00 0.00 H new ATOM 0 HB3 LEU A 160 7.055 2.409 -3.743 1.00 0.00 H new ATOM 0 HG LEU A 160 5.839 2.889 -1.019 1.00 0.00 H new ATOM 0 HD11 LEU A 160 4.256 4.447 -2.122 1.00 0.00 H new ATOM 0 HD12 LEU A 160 5.928 5.054 -2.183 1.00 0.00 H new ATOM 0 HD13 LEU A 160 5.196 4.315 -3.627 1.00 0.00 H new ATOM 0 HD21 LEU A 160 3.784 2.066 -2.122 1.00 0.00 H new ATOM 0 HD22 LEU A 160 4.688 1.865 -3.641 1.00 0.00 H new ATOM 0 HD23 LEU A 160 5.107 0.880 -2.220 1.00 0.00 H new ATOM 2028 N LEU A 161 7.499 -0.370 -3.297 1.00 0.00 N ATOM 2029 CA LEU A 161 6.923 -1.666 -3.579 1.00 0.00 C ATOM 2030 C LEU A 161 7.570 -2.758 -2.727 1.00 0.00 C ATOM 2031 O LEU A 161 6.878 -3.628 -2.205 1.00 0.00 O ATOM 2032 CB LEU A 161 7.063 -1.991 -5.064 1.00 0.00 C ATOM 2033 CG LEU A 161 6.364 -3.263 -5.533 1.00 0.00 C ATOM 2034 CD1 LEU A 161 4.877 -3.210 -5.204 1.00 0.00 C ATOM 2035 CD2 LEU A 161 6.574 -3.458 -7.027 1.00 0.00 C ATOM 0 H LEU A 161 8.024 0.030 -4.074 1.00 0.00 H new ATOM 0 HA LEU A 161 5.864 -1.630 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 161 6.673 -1.151 -5.639 1.00 0.00 H new ATOM 0 HB3 LEU A 161 8.124 -2.073 -5.300 1.00 0.00 H new ATOM 0 HG LEU A 161 6.799 -4.113 -5.007 1.00 0.00 H new ATOM 0 HD11 LEU A 161 4.396 -4.126 -5.546 1.00 0.00 H new ATOM 0 HD12 LEU A 161 4.746 -3.112 -4.126 1.00 0.00 H new ATOM 0 HD13 LEU A 161 4.424 -2.354 -5.704 1.00 0.00 H new ATOM 0 HD21 LEU A 161 6.070 -4.369 -7.349 1.00 0.00 H new ATOM 0 HD22 LEU A 161 6.162 -2.605 -7.567 1.00 0.00 H new ATOM 0 HD23 LEU A 161 7.640 -3.539 -7.237 1.00 0.00 H new ATOM 2047 N ASP A 162 8.896 -2.716 -2.597 1.00 0.00 N ATOM 2048 CA ASP A 162 9.625 -3.683 -1.771 1.00 0.00 C ATOM 2049 C ASP A 162 9.183 -3.565 -0.316 1.00 0.00 C ATOM 2050 O ASP A 162 9.008 -4.570 0.381 1.00 0.00 O ATOM 2051 CB ASP A 162 11.136 -3.445 -1.894 1.00 0.00 C ATOM 2052 CG ASP A 162 11.958 -4.537 -1.244 1.00 0.00 C ATOM 2053 OD1 ASP A 162 11.781 -5.717 -1.613 1.00 0.00 O ATOM 2054 OD2 ASP A 162 12.813 -4.224 -0.386 1.00 0.00 O ATOM 0 H ASP A 162 9.489 -2.023 -3.053 1.00 0.00 H new ATOM 0 HA ASP A 162 9.402 -4.691 -2.122 1.00 0.00 H new ATOM 0 HB2 ASP A 162 11.403 -3.375 -2.948 1.00 0.00 H new ATOM 0 HB3 ASP A 162 11.386 -2.488 -1.437 1.00 0.00 H new ATOM 2059 N ASN A 163 8.990 -2.327 0.128 1.00 0.00 N ATOM 2060 CA ASN A 163 8.478 -2.051 1.467 1.00 0.00 C ATOM 2061 C ASN A 163 7.116 -2.687 1.633 1.00 0.00 C ATOM 2062 O ASN A 163 6.817 -3.283 2.660 1.00 0.00 O ATOM 2063 CB ASN A 163 8.359 -0.544 1.699 1.00 0.00 C ATOM 2064 CG ASN A 163 9.689 0.141 1.919 1.00 0.00 C ATOM 2065 OD1 ASN A 163 10.728 -0.326 1.471 1.00 0.00 O ATOM 2066 ND2 ASN A 163 9.657 1.263 2.610 1.00 0.00 N ATOM 0 H ASN A 163 9.182 -1.492 -0.425 1.00 0.00 H new ATOM 0 HA ASN A 163 9.174 -2.468 2.195 1.00 0.00 H new ATOM 0 HB2 ASN A 163 7.864 -0.091 0.840 1.00 0.00 H new ATOM 0 HB3 ASN A 163 7.721 -0.367 2.565 1.00 0.00 H new ATOM 0 HD21 ASN A 163 10.520 1.777 2.789 1.00 0.00 H new ATOM 0 HD22 ASN A 163 8.769 1.618 2.966 1.00 0.00 H new ATOM 2073 N MET A 164 6.297 -2.548 0.599 1.00 0.00 N ATOM 2074 CA MET A 164 4.957 -3.122 0.567 1.00 0.00 C ATOM 2075 C MET A 164 5.010 -4.633 0.753 1.00 0.00 C ATOM 2076 O MET A 164 4.136 -5.224 1.395 1.00 0.00 O ATOM 2077 CB MET A 164 4.285 -2.783 -0.765 1.00 0.00 C ATOM 2078 CG MET A 164 2.975 -3.502 -1.013 1.00 0.00 C ATOM 2079 SD MET A 164 2.298 -3.129 -2.639 1.00 0.00 S ATOM 2080 CE MET A 164 2.022 -1.369 -2.478 1.00 0.00 C ATOM 0 H MET A 164 6.544 -2.032 -0.245 1.00 0.00 H new ATOM 0 HA MET A 164 4.377 -2.697 1.386 1.00 0.00 H new ATOM 0 HB2 MET A 164 4.107 -1.708 -0.804 1.00 0.00 H new ATOM 0 HB3 MET A 164 4.974 -3.021 -1.575 1.00 0.00 H new ATOM 0 HG2 MET A 164 3.129 -4.577 -0.922 1.00 0.00 H new ATOM 0 HG3 MET A 164 2.254 -3.217 -0.246 1.00 0.00 H new ATOM 0 HE1 MET A 164 1.096 -1.098 -2.985 1.00 0.00 H new ATOM 0 HE2 MET A 164 1.948 -1.107 -1.422 1.00 0.00 H new ATOM 0 HE3 MET A 164 2.854 -0.828 -2.929 1.00 0.00 H new ATOM 2090 N LYS A 165 6.045 -5.249 0.206 1.00 0.00 N ATOM 2091 CA LYS A 165 6.216 -6.684 0.310 1.00 0.00 C ATOM 2092 C LYS A 165 6.472 -7.066 1.757 1.00 0.00 C ATOM 2093 O LYS A 165 5.803 -7.919 2.304 1.00 0.00 O ATOM 2094 CB LYS A 165 7.394 -7.161 -0.555 1.00 0.00 C ATOM 2095 CG LYS A 165 7.331 -6.738 -2.015 1.00 0.00 C ATOM 2096 CD LYS A 165 6.215 -7.441 -2.768 1.00 0.00 C ATOM 2097 CE LYS A 165 6.215 -7.037 -4.235 1.00 0.00 C ATOM 2098 NZ LYS A 165 5.222 -7.800 -5.023 1.00 0.00 N ATOM 0 H LYS A 165 6.781 -4.773 -0.316 1.00 0.00 H new ATOM 0 HA LYS A 165 5.304 -7.163 -0.046 1.00 0.00 H new ATOM 0 HB2 LYS A 165 8.320 -6.782 -0.122 1.00 0.00 H new ATOM 0 HB3 LYS A 165 7.442 -8.249 -0.509 1.00 0.00 H new ATOM 0 HG2 LYS A 165 7.183 -5.660 -2.073 1.00 0.00 H new ATOM 0 HG3 LYS A 165 8.285 -6.955 -2.496 1.00 0.00 H new ATOM 0 HD2 LYS A 165 6.337 -8.521 -2.684 1.00 0.00 H new ATOM 0 HD3 LYS A 165 5.254 -7.193 -2.318 1.00 0.00 H new ATOM 0 HE2 LYS A 165 6.001 -5.971 -4.317 1.00 0.00 H new ATOM 0 HE3 LYS A 165 7.209 -7.195 -4.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 5.402 -7.659 -6.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 5.301 -8.812 -4.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 4.265 -7.466 -4.791 1.00 0.00 H new ATOM 2112 N LYS A 166 7.428 -6.406 2.373 1.00 0.00 N ATOM 2113 CA LYS A 166 7.792 -6.715 3.743 1.00 0.00 C ATOM 2114 C LYS A 166 6.715 -6.262 4.740 1.00 0.00 C ATOM 2115 O LYS A 166 6.583 -6.835 5.823 1.00 0.00 O ATOM 2116 CB LYS A 166 9.148 -6.081 4.095 1.00 0.00 C ATOM 2117 CG LYS A 166 9.613 -6.372 5.515 1.00 0.00 C ATOM 2118 CD LYS A 166 9.737 -7.871 5.769 1.00 0.00 C ATOM 2119 CE LYS A 166 9.984 -8.163 7.240 1.00 0.00 C ATOM 2120 NZ LYS A 166 8.849 -7.726 8.095 1.00 0.00 N ATOM 0 H LYS A 166 7.969 -5.652 1.949 1.00 0.00 H new ATOM 0 HA LYS A 166 7.875 -7.799 3.821 1.00 0.00 H new ATOM 0 HB2 LYS A 166 9.901 -6.444 3.395 1.00 0.00 H new ATOM 0 HB3 LYS A 166 9.080 -5.002 3.959 1.00 0.00 H new ATOM 0 HG2 LYS A 166 10.576 -5.892 5.689 1.00 0.00 H new ATOM 0 HG3 LYS A 166 8.908 -5.939 6.225 1.00 0.00 H new ATOM 0 HD2 LYS A 166 8.826 -8.374 5.444 1.00 0.00 H new ATOM 0 HD3 LYS A 166 10.555 -8.277 5.173 1.00 0.00 H new ATOM 0 HE2 LYS A 166 10.148 -9.232 7.374 1.00 0.00 H new ATOM 0 HE3 LYS A 166 10.895 -7.658 7.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 8.988 -8.078 9.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 8.804 -6.687 8.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 7.960 -8.107 7.713 1.00 0.00 H new ATOM 2134 N ALA A 167 5.950 -5.251 4.373 1.00 0.00 N ATOM 2135 CA ALA A 167 4.932 -4.697 5.255 1.00 0.00 C ATOM 2136 C ALA A 167 3.718 -5.594 5.380 1.00 0.00 C ATOM 2137 O ALA A 167 3.196 -5.801 6.478 1.00 0.00 O ATOM 2138 CB ALA A 167 4.489 -3.339 4.742 1.00 0.00 C ATOM 0 H ALA A 167 6.013 -4.792 3.464 1.00 0.00 H new ATOM 0 HA ALA A 167 5.384 -4.608 6.243 1.00 0.00 H new ATOM 0 HB1 ALA A 167 3.728 -2.930 5.406 1.00 0.00 H new ATOM 0 HB2 ALA A 167 5.345 -2.664 4.712 1.00 0.00 H new ATOM 0 HB3 ALA A 167 4.076 -3.446 3.739 1.00 0.00 H new ATOM 2144 N LEU A 168 3.277 -6.133 4.265 1.00 0.00 N ATOM 2145 CA LEU A 168 2.025 -6.878 4.249 1.00 0.00 C ATOM 2146 C LEU A 168 2.209 -8.345 3.851 1.00 0.00 C ATOM 2147 O LEU A 168 1.473 -9.217 4.314 1.00 0.00 O ATOM 2148 CB LEU A 168 1.057 -6.198 3.280 1.00 0.00 C ATOM 2149 CG LEU A 168 0.863 -4.690 3.494 1.00 0.00 C ATOM 2150 CD1 LEU A 168 -0.002 -4.095 2.399 1.00 0.00 C ATOM 2151 CD2 LEU A 168 0.258 -4.417 4.861 1.00 0.00 C ATOM 0 H LEU A 168 3.755 -6.074 3.366 1.00 0.00 H new ATOM 0 HA LEU A 168 1.627 -6.876 5.264 1.00 0.00 H new ATOM 0 HB2 LEU A 168 1.413 -6.361 2.263 1.00 0.00 H new ATOM 0 HB3 LEU A 168 0.086 -6.687 3.360 1.00 0.00 H new ATOM 0 HG LEU A 168 1.842 -4.213 3.449 1.00 0.00 H new ATOM 0 HD11 LEU A 168 -0.125 -3.026 2.573 1.00 0.00 H new ATOM 0 HD12 LEU A 168 0.475 -4.253 1.432 1.00 0.00 H new ATOM 0 HD13 LEU A 168 -0.979 -4.578 2.404 1.00 0.00 H new ATOM 0 HD21 LEU A 168 0.128 -3.343 4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 168 -0.711 -4.911 4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 168 0.922 -4.801 5.636 1.00 0.00 H new ATOM 2163 N LYS A 169 3.179 -8.616 3.005 1.00 0.00 N ATOM 2164 CA LYS A 169 3.400 -9.978 2.537 1.00 0.00 C ATOM 2165 C LYS A 169 4.292 -10.782 3.471 1.00 0.00 C ATOM 2166 O LYS A 169 5.518 -10.657 3.449 1.00 0.00 O ATOM 2167 CB LYS A 169 3.962 -9.987 1.111 1.00 0.00 C ATOM 2168 CG LYS A 169 3.098 -9.241 0.095 1.00 0.00 C ATOM 2169 CD LYS A 169 1.661 -9.763 0.069 1.00 0.00 C ATOM 2170 CE LYS A 169 1.603 -11.243 -0.286 1.00 0.00 C ATOM 2171 NZ LYS A 169 2.135 -11.512 -1.645 1.00 0.00 N ATOM 0 H LYS A 169 3.825 -7.923 2.627 1.00 0.00 H new ATOM 0 HA LYS A 169 2.425 -10.465 2.531 1.00 0.00 H new ATOM 0 HB2 LYS A 169 4.957 -9.543 1.121 1.00 0.00 H new ATOM 0 HB3 LYS A 169 4.078 -11.020 0.784 1.00 0.00 H new ATOM 0 HG2 LYS A 169 3.093 -8.178 0.335 1.00 0.00 H new ATOM 0 HG3 LYS A 169 3.538 -9.341 -0.897 1.00 0.00 H new ATOM 0 HD2 LYS A 169 1.199 -9.605 1.044 1.00 0.00 H new ATOM 0 HD3 LYS A 169 1.080 -9.192 -0.656 1.00 0.00 H new ATOM 0 HE2 LYS A 169 2.174 -11.814 0.446 1.00 0.00 H new ATOM 0 HE3 LYS A 169 0.571 -11.590 -0.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 1.953 -12.504 -1.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 1.666 -10.888 -2.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 3.159 -11.333 -1.658 1.00 0.00 H new