USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 881 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 53 LYS NZ :NH3+ -126:sc= -0.107 (180deg=-0.631) USER MOD Set 1.2: A 102 ASN : amide:sc= -0.497 X(o=-0.6,f=-0.63) USER MOD Set 2.1: A 36 GLN : amide:sc= -0.536 X(o=-0.75,f=-0.39) USER MOD Set 2.2: A 39 GLN : amide:sc= -0.216 X(o=-0.75,f=-0.46) USER MOD Single : A 18 LYS NZ :NH3+ -133:sc= -2.05 (180deg=-4.72!) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0694) USER MOD Single : A 25 GLN : amide:sc= -0.676 K(o=-0.68,f=-1.4) USER MOD Single : A 28 SER OG : rot 76:sc= 0.0266 USER MOD Single : A 29 GLN : amide:sc= -0.44 X(o=-0.44,f=-0.07) USER MOD Single : A 34 SER OG : rot 180:sc= -0.416 USER MOD Single : A 38 MET CE :methyl 140:sc= -1.16 (180deg=-1.91) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.0944 USER MOD Single : A 46 GLN : amide:sc= -0.113 X(o=-0.11,f=-0.11) USER MOD Single : A 47 GLN : amide:sc= -0.3 K(o=-0.3,f=-1.2) USER MOD Single : A 51 THR OG1 : rot -160:sc= -0.0465 USER MOD Single : A 56 GLN : amide:sc= -0.0718 K(o=-0.072,f=-1.2!) USER MOD Single : A 60 GLN : amide:sc= -0.78 K(o=-0.78,f=-0.052) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot -160:sc= -2.81! USER MOD Single : A 64 SER OG : rot -37:sc= 0.138! USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= -5.09! C(o=-5.1!,f=-9.8!) USER MOD Single : A 72 HIS : no HE2:sc= -1.12 K(o=-1.1,f=-12!) USER MOD Single : A 73 GLN : amide:sc= -0.319 X(o=-0.32,f=-0.39) USER MOD Single : A 74 GLN : amide:sc= -0.724 K(o=-0.72,f=-1.3) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -2.45! C(o=-2.5!,f=-2.5!) USER MOD Single : A 100 GLN : amide:sc= -2.96 X(o=-3,f=-3.4!) USER MOD Single : A 103 ASN : amide:sc= -2.05 K(o=-2.1,f=-9.7!) USER MOD Single : A 105 GLN : amide:sc= -0.0116 K(o=-0.012,f=-1.8!) USER MOD Single : A 106 GLN : amide:sc= -0.0678 X(o=-0.068,f=-0.068) USER MOD Single : A 107 GLN : amide:sc= -4.2! C(o=-4.2!,f=-6!) USER MOD Single : A 113 TYR OH : rot -137:sc= 0.471 USER MOD Single : A 114 GLN : amide:sc= -1.61 K(o=-1.6,f=-1.1) USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0.38) USER MOD Single : A 127 SER OG : rot 52:sc= 0.911 USER MOD Single : A 129 LYS NZ :NH3+ -111:sc= -0.638 (180deg=-3.4!) USER MOD ----------------------------------------------------------------- ATOM 270 N LYS A 18 -1.058 16.714 -3.169 1.00 0.00 N ATOM 271 CA LYS A 18 -2.233 16.480 -4.050 1.00 0.00 C ATOM 272 C LYS A 18 -2.245 14.998 -4.418 1.00 0.00 C ATOM 273 O LYS A 18 -3.189 14.482 -4.983 1.00 0.00 O ATOM 274 CB LYS A 18 -2.106 17.331 -5.316 1.00 0.00 C ATOM 275 CG LYS A 18 -0.670 17.257 -5.840 1.00 0.00 C ATOM 276 CD LYS A 18 -0.613 17.815 -7.266 1.00 0.00 C ATOM 277 CE LYS A 18 -0.965 19.308 -7.261 1.00 0.00 C ATOM 278 NZ LYS A 18 -2.446 19.469 -7.214 1.00 0.00 N ATOM 0 HA LYS A 18 -3.157 16.755 -3.542 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.801 16.975 -6.077 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -2.372 18.366 -5.100 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -0.005 17.825 -5.190 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -0.321 16.224 -5.829 1.00 0.00 H new ATOM 0 HD2 LYS A 18 0.384 17.670 -7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -1.308 17.271 -7.906 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -0.508 19.797 -6.401 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.564 19.790 -8.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.742 20.168 -7.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.901 18.556 -7.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -2.730 19.796 -6.268 1.00 0.00 H new ATOM 292 N ASP A 19 -1.187 14.316 -4.075 1.00 0.00 N ATOM 293 CA ASP A 19 -1.079 12.863 -4.357 1.00 0.00 C ATOM 294 C ASP A 19 -2.247 12.121 -3.706 1.00 0.00 C ATOM 295 O ASP A 19 -3.178 11.668 -4.355 1.00 0.00 O ATOM 296 CB ASP A 19 0.222 12.351 -3.733 1.00 0.00 C ATOM 297 CG ASP A 19 0.375 10.857 -4.024 1.00 0.00 C ATOM 298 OD1 ASP A 19 0.544 10.514 -5.183 1.00 0.00 O ATOM 299 OD2 ASP A 19 0.320 10.082 -3.084 1.00 0.00 O ATOM 0 H ASP A 19 -0.378 14.717 -3.601 1.00 0.00 H new ATOM 0 HA ASP A 19 -1.093 12.695 -5.434 1.00 0.00 H new ATOM 0 HB2 ASP A 19 1.072 12.900 -4.138 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.214 12.524 -2.657 1.00 0.00 H new ATOM 304 N LEU A 20 -2.189 11.989 -2.409 1.00 0.00 N ATOM 305 CA LEU A 20 -3.260 11.271 -1.682 1.00 0.00 C ATOM 306 C LEU A 20 -4.563 12.076 -1.733 1.00 0.00 C ATOM 307 O LEU A 20 -5.632 11.522 -1.863 1.00 0.00 O ATOM 308 CB LEU A 20 -2.810 11.026 -0.231 1.00 0.00 C ATOM 309 CG LEU A 20 -2.818 12.344 0.595 1.00 0.00 C ATOM 310 CD1 LEU A 20 -4.114 12.469 1.411 1.00 0.00 C ATOM 311 CD2 LEU A 20 -1.632 12.354 1.570 1.00 0.00 C ATOM 0 H LEU A 20 -1.438 12.352 -1.822 1.00 0.00 H new ATOM 0 HA LEU A 20 -3.448 10.307 -2.156 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -3.470 10.297 0.238 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -1.808 10.598 -0.227 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.746 13.178 -0.103 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -4.097 13.398 1.981 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -4.970 12.473 0.736 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -4.196 11.625 2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.642 13.279 2.146 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -1.711 11.504 2.248 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -0.700 12.286 1.010 1.00 0.00 H new ATOM 323 N GLN A 21 -4.503 13.376 -1.630 1.00 0.00 N ATOM 324 CA GLN A 21 -5.764 14.172 -1.682 1.00 0.00 C ATOM 325 C GLN A 21 -6.591 13.709 -2.885 1.00 0.00 C ATOM 326 O GLN A 21 -7.781 13.489 -2.788 1.00 0.00 O ATOM 327 CB GLN A 21 -5.431 15.662 -1.825 1.00 0.00 C ATOM 328 CG GLN A 21 -6.640 16.504 -1.407 1.00 0.00 C ATOM 329 CD GLN A 21 -6.308 17.989 -1.569 1.00 0.00 C ATOM 330 OE1 GLN A 21 -6.292 18.729 -0.605 1.00 0.00 O ATOM 331 NE2 GLN A 21 -6.039 18.459 -2.756 1.00 0.00 N ATOM 0 H GLN A 21 -3.646 13.917 -1.513 1.00 0.00 H new ATOM 0 HA GLN A 21 -6.332 14.024 -0.764 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -4.570 15.913 -1.206 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -5.159 15.886 -2.856 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -7.505 16.245 -2.017 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -6.905 16.290 -0.371 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -6.052 17.838 -3.565 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -5.815 19.447 -2.875 1.00 0.00 H new ATOM 340 N ALA A 22 -5.959 13.547 -4.016 1.00 0.00 N ATOM 341 CA ALA A 22 -6.710 13.086 -5.215 1.00 0.00 C ATOM 342 C ALA A 22 -7.294 11.701 -4.925 1.00 0.00 C ATOM 343 O ALA A 22 -8.403 11.391 -5.329 1.00 0.00 O ATOM 344 CB ALA A 22 -5.791 13.038 -6.438 1.00 0.00 C ATOM 0 H ALA A 22 -4.963 13.713 -4.160 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.517 13.785 -5.434 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.357 12.699 -7.305 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.391 14.033 -6.632 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.969 12.348 -6.249 1.00 0.00 H new ATOM 350 N ILE A 23 -6.607 10.876 -4.178 1.00 0.00 N ATOM 351 CA ILE A 23 -7.219 9.559 -3.849 1.00 0.00 C ATOM 352 C ILE A 23 -8.490 9.861 -3.045 1.00 0.00 C ATOM 353 O ILE A 23 -9.590 9.724 -3.542 1.00 0.00 O ATOM 354 CB ILE A 23 -6.245 8.690 -3.028 1.00 0.00 C ATOM 355 CG1 ILE A 23 -5.234 8.008 -3.973 1.00 0.00 C ATOM 356 CG2 ILE A 23 -7.014 7.617 -2.238 1.00 0.00 C ATOM 357 CD1 ILE A 23 -4.001 7.541 -3.182 1.00 0.00 C ATOM 0 H ILE A 23 -5.679 11.050 -3.793 1.00 0.00 H new ATOM 0 HA ILE A 23 -7.451 8.998 -4.754 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.714 9.332 -2.325 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.703 7.156 -4.466 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -4.931 8.703 -4.756 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.311 7.013 -1.665 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -7.716 8.099 -1.558 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.561 6.977 -2.931 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.294 7.061 -3.859 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -3.525 8.400 -2.710 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.309 6.830 -2.415 1.00 0.00 H new ATOM 369 N LYS A 24 -8.333 10.299 -1.814 1.00 0.00 N ATOM 370 CA LYS A 24 -9.503 10.655 -0.946 1.00 0.00 C ATOM 371 C LYS A 24 -10.638 11.264 -1.772 1.00 0.00 C ATOM 372 O LYS A 24 -11.776 10.874 -1.643 1.00 0.00 O ATOM 373 CB LYS A 24 -9.034 11.672 0.106 1.00 0.00 C ATOM 374 CG LYS A 24 -9.999 11.682 1.297 1.00 0.00 C ATOM 375 CD LYS A 24 -9.648 12.846 2.226 1.00 0.00 C ATOM 376 CE LYS A 24 -10.459 12.734 3.518 1.00 0.00 C ATOM 377 NZ LYS A 24 -11.893 13.022 3.231 1.00 0.00 N ATOM 0 H LYS A 24 -7.425 10.426 -1.368 1.00 0.00 H new ATOM 0 HA LYS A 24 -9.881 9.751 -0.469 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.029 11.419 0.444 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -8.981 12.667 -0.337 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -11.026 11.780 0.946 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.935 10.738 1.839 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -8.582 12.835 2.452 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -9.860 13.795 1.733 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.355 11.734 3.940 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -10.078 13.435 4.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -12.421 13.080 4.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.971 13.927 2.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.289 12.261 2.644 1.00 0.00 H new ATOM 391 N GLN A 25 -10.358 12.234 -2.591 1.00 0.00 N ATOM 392 CA GLN A 25 -11.452 12.868 -3.386 1.00 0.00 C ATOM 393 C GLN A 25 -12.399 11.785 -3.939 1.00 0.00 C ATOM 394 O GLN A 25 -13.623 11.887 -3.903 1.00 0.00 O ATOM 395 CB GLN A 25 -10.828 13.623 -4.573 1.00 0.00 C ATOM 396 CG GLN A 25 -10.264 14.968 -4.100 1.00 0.00 C ATOM 397 CD GLN A 25 -9.402 15.579 -5.206 1.00 0.00 C ATOM 398 OE1 GLN A 25 -9.588 15.284 -6.370 1.00 0.00 O ATOM 399 NE2 GLN A 25 -8.459 16.424 -4.890 1.00 0.00 N ATOM 0 H GLN A 25 -9.426 12.617 -2.747 1.00 0.00 H new ATOM 0 HA GLN A 25 -12.012 13.549 -2.746 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -10.035 13.023 -5.020 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -11.579 13.786 -5.346 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -11.078 15.645 -3.843 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -9.670 14.828 -3.197 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -8.303 16.672 -3.913 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -7.878 16.837 -5.620 1.00 0.00 H new ATOM 408 N GLU A 26 -11.811 10.738 -4.474 1.00 0.00 N ATOM 409 CA GLU A 26 -12.624 9.640 -5.079 1.00 0.00 C ATOM 410 C GLU A 26 -12.891 8.489 -4.085 1.00 0.00 C ATOM 411 O GLU A 26 -13.778 7.673 -4.325 1.00 0.00 O ATOM 412 CB GLU A 26 -11.886 9.108 -6.335 1.00 0.00 C ATOM 413 CG GLU A 26 -12.769 9.245 -7.585 1.00 0.00 C ATOM 414 CD GLU A 26 -12.038 8.658 -8.794 1.00 0.00 C ATOM 415 OE1 GLU A 26 -10.990 9.179 -9.138 1.00 0.00 O ATOM 416 OE2 GLU A 26 -12.538 7.697 -9.355 1.00 0.00 O ATOM 0 H GLU A 26 -10.801 10.600 -4.516 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.597 10.046 -5.353 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.957 9.660 -6.478 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.616 8.062 -6.188 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -13.716 8.727 -7.433 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -13.005 10.294 -7.763 1.00 0.00 H new ATOM 423 N VAL A 27 -12.219 8.405 -2.953 1.00 0.00 N ATOM 424 CA VAL A 27 -12.586 7.286 -2.044 1.00 0.00 C ATOM 425 C VAL A 27 -14.001 7.610 -1.595 1.00 0.00 C ATOM 426 O VAL A 27 -14.850 6.767 -1.388 1.00 0.00 O ATOM 427 CB VAL A 27 -11.650 7.170 -0.818 1.00 0.00 C ATOM 428 CG1 VAL A 27 -10.187 7.284 -1.262 1.00 0.00 C ATOM 429 CG2 VAL A 27 -11.973 8.234 0.244 1.00 0.00 C ATOM 0 H VAL A 27 -11.475 9.029 -2.639 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.501 6.328 -2.557 1.00 0.00 H new ATOM 0 HB VAL A 27 -11.812 6.193 -0.363 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.535 7.201 -0.392 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.957 6.484 -1.965 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.027 8.248 -1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.295 8.121 1.090 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -11.852 9.227 -0.188 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -13.001 8.109 0.584 1.00 0.00 H new ATOM 439 N SER A 28 -14.223 8.908 -1.498 1.00 0.00 N ATOM 440 CA SER A 28 -15.555 9.431 -1.121 1.00 0.00 C ATOM 441 C SER A 28 -16.488 8.926 -2.196 1.00 0.00 C ATOM 442 O SER A 28 -17.220 8.001 -1.967 1.00 0.00 O ATOM 443 CB SER A 28 -15.540 10.961 -1.100 1.00 0.00 C ATOM 444 OG SER A 28 -14.620 11.409 -0.113 1.00 0.00 O ATOM 0 H SER A 28 -13.518 9.625 -1.670 1.00 0.00 H new ATOM 0 HA SER A 28 -15.860 9.105 -0.127 1.00 0.00 H new ATOM 0 HB2 SER A 28 -15.257 11.347 -2.079 1.00 0.00 H new ATOM 0 HB3 SER A 28 -16.538 11.343 -0.884 1.00 0.00 H new ATOM 0 HG SER A 28 -13.705 11.302 -0.446 1.00 0.00 H new ATOM 450 N GLN A 29 -16.436 9.546 -3.369 1.00 0.00 N ATOM 451 CA GLN A 29 -17.287 9.124 -4.550 1.00 0.00 C ATOM 452 C GLN A 29 -18.037 7.809 -4.294 1.00 0.00 C ATOM 453 O GLN A 29 -19.232 7.705 -4.484 1.00 0.00 O ATOM 454 CB GLN A 29 -16.349 8.874 -5.734 1.00 0.00 C ATOM 455 CG GLN A 29 -17.161 8.662 -7.020 1.00 0.00 C ATOM 456 CD GLN A 29 -17.801 9.985 -7.446 1.00 0.00 C ATOM 457 OE1 GLN A 29 -17.214 10.746 -8.190 1.00 0.00 O ATOM 458 NE2 GLN A 29 -18.989 10.294 -7.002 1.00 0.00 N ATOM 0 H GLN A 29 -15.827 10.342 -3.559 1.00 0.00 H new ATOM 0 HA GLN A 29 -18.017 9.913 -4.734 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -15.674 9.721 -5.857 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -15.730 7.999 -5.538 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -16.514 8.287 -7.813 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -17.932 7.910 -6.855 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -19.482 9.656 -6.378 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -19.424 11.174 -7.279 1.00 0.00 H new ATOM 467 N ALA A 30 -17.310 6.798 -3.867 1.00 0.00 N ATOM 468 CA ALA A 30 -17.936 5.461 -3.596 1.00 0.00 C ATOM 469 C ALA A 30 -18.411 5.338 -2.145 1.00 0.00 C ATOM 470 O ALA A 30 -18.640 6.301 -1.445 1.00 0.00 O ATOM 471 CB ALA A 30 -16.896 4.366 -3.849 1.00 0.00 C ATOM 0 H ALA A 30 -16.306 6.843 -3.694 1.00 0.00 H new ATOM 0 HA ALA A 30 -18.798 5.356 -4.255 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -17.341 3.390 -3.655 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -16.563 4.413 -4.886 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.043 4.514 -3.187 1.00 0.00 H new ATOM 477 N ALA A 31 -18.553 4.123 -1.708 1.00 0.00 N ATOM 478 CA ALA A 31 -18.996 3.845 -0.313 1.00 0.00 C ATOM 479 C ALA A 31 -17.790 4.097 0.619 1.00 0.00 C ATOM 480 O ALA A 31 -16.732 4.441 0.133 1.00 0.00 O ATOM 481 CB ALA A 31 -19.467 2.375 -0.267 1.00 0.00 C ATOM 0 H ALA A 31 -18.377 3.290 -2.270 1.00 0.00 H new ATOM 0 HA ALA A 31 -19.817 4.485 0.009 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -19.801 2.131 0.742 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -20.292 2.235 -0.966 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -18.641 1.720 -0.544 1.00 0.00 H new ATOM 487 N PRO A 32 -17.960 3.941 1.922 1.00 0.00 N ATOM 488 CA PRO A 32 -16.846 4.174 2.867 1.00 0.00 C ATOM 489 C PRO A 32 -15.742 3.131 2.620 1.00 0.00 C ATOM 490 O PRO A 32 -15.256 2.483 3.526 1.00 0.00 O ATOM 491 CB PRO A 32 -17.481 4.032 4.274 1.00 0.00 C ATOM 492 CG PRO A 32 -18.963 3.599 4.076 1.00 0.00 C ATOM 493 CD PRO A 32 -19.236 3.539 2.555 1.00 0.00 C ATOM 0 HA PRO A 32 -16.377 5.151 2.753 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -16.941 3.293 4.866 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -17.426 4.976 4.816 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -19.142 2.627 4.535 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -19.636 4.308 4.558 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -19.531 2.536 2.246 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -20.046 4.211 2.272 1.00 0.00 H new ATOM 501 N GLY A 33 -15.355 2.964 1.383 1.00 0.00 N ATOM 502 CA GLY A 33 -14.300 1.967 1.033 1.00 0.00 C ATOM 503 C GLY A 33 -14.731 1.245 -0.241 1.00 0.00 C ATOM 504 O GLY A 33 -14.614 1.763 -1.333 1.00 0.00 O ATOM 0 H GLY A 33 -15.730 3.483 0.589 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.342 2.464 0.883 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.165 1.255 1.847 1.00 0.00 H new ATOM 508 N SER A 34 -15.264 0.064 -0.102 1.00 0.00 N ATOM 509 CA SER A 34 -15.747 -0.686 -1.289 1.00 0.00 C ATOM 510 C SER A 34 -14.581 -0.898 -2.279 1.00 0.00 C ATOM 511 O SER A 34 -13.529 -0.318 -2.097 1.00 0.00 O ATOM 512 CB SER A 34 -16.862 0.157 -1.937 1.00 0.00 C ATOM 513 OG SER A 34 -16.473 0.563 -3.245 1.00 0.00 O ATOM 0 H SER A 34 -15.386 -0.415 0.790 1.00 0.00 H new ATOM 0 HA SER A 34 -16.129 -1.667 -1.008 1.00 0.00 H new ATOM 0 HB2 SER A 34 -17.784 -0.423 -1.987 1.00 0.00 H new ATOM 0 HB3 SER A 34 -17.069 1.033 -1.323 1.00 0.00 H new ATOM 0 HG SER A 34 -17.189 1.097 -3.648 1.00 0.00 H new ATOM 519 N PRO A 35 -14.794 -1.682 -3.316 1.00 0.00 N ATOM 520 CA PRO A 35 -13.748 -1.907 -4.338 1.00 0.00 C ATOM 521 C PRO A 35 -13.300 -0.566 -4.938 1.00 0.00 C ATOM 522 O PRO A 35 -12.129 -0.302 -5.064 1.00 0.00 O ATOM 523 CB PRO A 35 -14.423 -2.793 -5.412 1.00 0.00 C ATOM 524 CG PRO A 35 -15.825 -3.194 -4.869 1.00 0.00 C ATOM 525 CD PRO A 35 -16.063 -2.405 -3.561 1.00 0.00 C ATOM 0 HA PRO A 35 -12.857 -2.381 -3.926 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -14.516 -2.251 -6.353 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -13.821 -3.679 -5.612 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.599 -2.964 -5.601 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -15.871 -4.267 -4.683 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -16.899 -1.713 -3.664 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.303 -3.074 -2.734 1.00 0.00 H new ATOM 533 N GLN A 36 -14.224 0.270 -5.316 1.00 0.00 N ATOM 534 CA GLN A 36 -13.857 1.589 -5.923 1.00 0.00 C ATOM 535 C GLN A 36 -12.634 2.201 -5.221 1.00 0.00 C ATOM 536 O GLN A 36 -11.831 2.884 -5.836 1.00 0.00 O ATOM 537 CB GLN A 36 -15.038 2.535 -5.773 1.00 0.00 C ATOM 538 CG GLN A 36 -16.163 2.110 -6.716 1.00 0.00 C ATOM 539 CD GLN A 36 -15.786 2.465 -8.155 1.00 0.00 C ATOM 540 OE1 GLN A 36 -16.027 3.567 -8.605 1.00 0.00 O ATOM 541 NE2 GLN A 36 -15.200 1.570 -8.902 1.00 0.00 N ATOM 0 H GLN A 36 -15.226 0.100 -5.232 1.00 0.00 H new ATOM 0 HA GLN A 36 -13.610 1.436 -6.974 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -15.393 2.528 -4.742 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -14.729 3.556 -5.997 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -16.339 1.038 -6.629 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -17.092 2.609 -6.439 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -14.997 0.644 -8.525 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -14.945 1.796 -9.863 1.00 0.00 H new ATOM 550 N PHE A 37 -12.483 1.972 -3.941 1.00 0.00 N ATOM 551 CA PHE A 37 -11.318 2.550 -3.216 1.00 0.00 C ATOM 552 C PHE A 37 -10.058 2.230 -4.031 1.00 0.00 C ATOM 553 O PHE A 37 -9.297 3.078 -4.454 1.00 0.00 O ATOM 554 CB PHE A 37 -11.222 1.844 -1.861 1.00 0.00 C ATOM 555 CG PHE A 37 -10.326 2.591 -0.871 1.00 0.00 C ATOM 556 CD1 PHE A 37 -9.473 3.649 -1.267 1.00 0.00 C ATOM 557 CD2 PHE A 37 -10.351 2.199 0.475 1.00 0.00 C ATOM 558 CE1 PHE A 37 -8.669 4.290 -0.317 1.00 0.00 C ATOM 559 CE2 PHE A 37 -9.544 2.846 1.417 1.00 0.00 C ATOM 560 CZ PHE A 37 -8.704 3.890 1.021 1.00 0.00 C ATOM 0 H PHE A 37 -13.116 1.411 -3.371 1.00 0.00 H new ATOM 0 HA PHE A 37 -11.421 3.627 -3.081 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -12.221 1.743 -1.437 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -10.834 0.836 -2.007 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -9.443 3.961 -2.300 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -10.998 1.392 0.787 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -8.019 5.097 -0.620 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -9.570 2.538 2.452 1.00 0.00 H new ATOM 0 HZ PHE A 37 -8.082 4.388 1.750 1.00 0.00 H new ATOM 570 N MET A 38 -9.903 0.941 -4.245 1.00 0.00 N ATOM 571 CA MET A 38 -8.770 0.379 -5.030 1.00 0.00 C ATOM 572 C MET A 38 -8.619 1.168 -6.318 1.00 0.00 C ATOM 573 O MET A 38 -7.532 1.514 -6.705 1.00 0.00 O ATOM 574 CB MET A 38 -9.068 -1.119 -5.319 1.00 0.00 C ATOM 575 CG MET A 38 -8.411 -1.632 -6.622 1.00 0.00 C ATOM 576 SD MET A 38 -6.616 -1.691 -6.437 1.00 0.00 S ATOM 577 CE MET A 38 -6.320 -2.919 -7.735 1.00 0.00 C ATOM 0 H MET A 38 -10.547 0.234 -3.889 1.00 0.00 H new ATOM 0 HA MET A 38 -7.835 0.452 -4.474 1.00 0.00 H new ATOM 0 HB2 MET A 38 -8.716 -1.721 -4.481 1.00 0.00 H new ATOM 0 HB3 MET A 38 -10.147 -1.262 -5.383 1.00 0.00 H new ATOM 0 HG2 MET A 38 -8.791 -2.625 -6.863 1.00 0.00 H new ATOM 0 HG3 MET A 38 -8.677 -0.979 -7.453 1.00 0.00 H new ATOM 0 HE1 MET A 38 -5.426 -2.647 -8.296 1.00 0.00 H new ATOM 0 HE2 MET A 38 -6.180 -3.901 -7.282 1.00 0.00 H new ATOM 0 HE3 MET A 38 -7.176 -2.949 -8.409 1.00 0.00 H new ATOM 587 N GLN A 39 -9.698 1.459 -6.978 1.00 0.00 N ATOM 588 CA GLN A 39 -9.619 2.225 -8.250 1.00 0.00 C ATOM 589 C GLN A 39 -8.630 3.382 -8.093 1.00 0.00 C ATOM 590 O GLN A 39 -7.757 3.597 -8.912 1.00 0.00 O ATOM 591 CB GLN A 39 -11.019 2.767 -8.563 1.00 0.00 C ATOM 592 CG GLN A 39 -11.113 3.125 -10.046 1.00 0.00 C ATOM 593 CD GLN A 39 -11.164 1.842 -10.878 1.00 0.00 C ATOM 594 OE1 GLN A 39 -10.182 1.456 -11.480 1.00 0.00 O ATOM 595 NE2 GLN A 39 -12.275 1.161 -10.937 1.00 0.00 N ATOM 0 H GLN A 39 -10.641 1.198 -6.690 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.275 1.585 -9.062 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.773 2.021 -8.310 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.224 3.647 -7.953 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.003 3.726 -10.230 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.254 3.728 -10.341 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -13.099 1.485 -10.431 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -12.319 0.304 -11.489 1.00 0.00 H new ATOM 604 N THR A 40 -8.770 4.118 -7.030 1.00 0.00 N ATOM 605 CA THR A 40 -7.861 5.264 -6.768 1.00 0.00 C ATOM 606 C THR A 40 -6.521 4.755 -6.202 1.00 0.00 C ATOM 607 O THR A 40 -5.481 5.260 -6.579 1.00 0.00 O ATOM 608 CB THR A 40 -8.563 6.221 -5.792 1.00 0.00 C ATOM 609 OG1 THR A 40 -9.757 5.605 -5.331 1.00 0.00 O ATOM 610 CG2 THR A 40 -8.920 7.541 -6.472 1.00 0.00 C ATOM 0 H THR A 40 -9.488 3.972 -6.320 1.00 0.00 H new ATOM 0 HA THR A 40 -7.639 5.799 -7.691 1.00 0.00 H new ATOM 0 HB THR A 40 -7.886 6.432 -4.964 1.00 0.00 H new ATOM 0 HG1 THR A 40 -10.214 6.205 -4.705 1.00 0.00 H new ATOM 0 HG21 THR A 40 -9.415 8.197 -5.756 1.00 0.00 H new ATOM 0 HG22 THR A 40 -8.011 8.021 -6.835 1.00 0.00 H new ATOM 0 HG23 THR A 40 -9.589 7.349 -7.311 1.00 0.00 H new ATOM 618 N ILE A 41 -6.486 3.762 -5.364 1.00 0.00 N ATOM 619 CA ILE A 41 -5.146 3.284 -4.901 1.00 0.00 C ATOM 620 C ILE A 41 -4.537 2.473 -6.047 1.00 0.00 C ATOM 621 O ILE A 41 -3.392 2.073 -6.007 1.00 0.00 O ATOM 622 CB ILE A 41 -5.272 2.419 -3.641 1.00 0.00 C ATOM 623 CG1 ILE A 41 -6.004 3.207 -2.531 1.00 0.00 C ATOM 624 CG2 ILE A 41 -3.878 1.993 -3.169 1.00 0.00 C ATOM 625 CD1 ILE A 41 -5.028 4.122 -1.766 1.00 0.00 C ATOM 0 H ILE A 41 -7.295 3.270 -4.986 1.00 0.00 H new ATOM 0 HA ILE A 41 -4.511 4.132 -4.642 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.854 1.526 -3.871 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -6.801 3.807 -2.971 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.475 2.511 -1.837 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.969 1.378 -2.273 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.387 1.419 -3.955 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.284 2.879 -2.942 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.570 4.665 -0.991 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.246 3.517 -1.307 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.577 4.833 -2.459 1.00 0.00 H new ATOM 637 N ARG A 42 -5.306 2.245 -7.080 1.00 0.00 N ATOM 638 CA ARG A 42 -4.801 1.478 -8.255 1.00 0.00 C ATOM 639 C ARG A 42 -4.124 2.432 -9.231 1.00 0.00 C ATOM 640 O ARG A 42 -3.221 2.063 -9.950 1.00 0.00 O ATOM 641 CB ARG A 42 -5.971 0.820 -8.983 1.00 0.00 C ATOM 642 CG ARG A 42 -5.461 -0.109 -10.121 1.00 0.00 C ATOM 643 CD ARG A 42 -5.731 0.516 -11.496 1.00 0.00 C ATOM 644 NE ARG A 42 -5.070 -0.304 -12.550 1.00 0.00 N ATOM 645 CZ ARG A 42 -5.422 -0.170 -13.799 1.00 0.00 C ATOM 646 NH1 ARG A 42 -6.363 0.673 -14.125 1.00 0.00 N ATOM 647 NH2 ARG A 42 -4.835 -0.882 -14.721 1.00 0.00 N ATOM 0 H ARG A 42 -6.272 2.561 -7.159 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.098 0.723 -7.904 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -6.567 0.243 -8.276 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -6.624 1.587 -9.399 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -4.392 -0.286 -10.001 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -5.954 -1.079 -10.054 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.804 0.568 -11.680 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -5.353 1.538 -11.524 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.342 -0.971 -12.295 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -6.824 1.227 -13.403 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -6.638 0.778 -15.102 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -4.101 -1.543 -14.465 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.110 -0.778 -15.698 1.00 0.00 H new ATOM 661 N LEU A 43 -4.553 3.664 -9.258 1.00 0.00 N ATOM 662 CA LEU A 43 -3.940 4.657 -10.185 1.00 0.00 C ATOM 663 C LEU A 43 -2.823 5.383 -9.439 1.00 0.00 C ATOM 664 O LEU A 43 -1.940 5.959 -10.029 1.00 0.00 O ATOM 665 CB LEU A 43 -5.034 5.665 -10.633 1.00 0.00 C ATOM 666 CG LEU A 43 -5.286 5.566 -12.146 1.00 0.00 C ATOM 667 CD1 LEU A 43 -6.615 6.242 -12.491 1.00 0.00 C ATOM 668 CD2 LEU A 43 -4.153 6.265 -12.903 1.00 0.00 C ATOM 0 H LEU A 43 -5.306 4.027 -8.674 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.528 4.166 -11.067 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.960 5.467 -10.093 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.726 6.679 -10.377 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.325 4.516 -12.435 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.792 6.171 -13.564 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.425 5.746 -11.956 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.576 7.291 -12.199 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.334 6.194 -13.976 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.113 7.314 -12.611 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.204 5.785 -12.662 1.00 0.00 H new ATOM 680 N ALA A 44 -2.843 5.344 -8.142 1.00 0.00 N ATOM 681 CA ALA A 44 -1.765 6.035 -7.368 1.00 0.00 C ATOM 682 C ALA A 44 -0.623 5.061 -7.077 1.00 0.00 C ATOM 683 O ALA A 44 0.534 5.434 -7.129 1.00 0.00 O ATOM 684 CB ALA A 44 -2.332 6.580 -6.056 1.00 0.00 C ATOM 0 H ALA A 44 -3.550 4.869 -7.581 1.00 0.00 H new ATOM 0 HA ALA A 44 -1.380 6.865 -7.961 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.541 7.082 -5.498 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.130 7.290 -6.272 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -2.729 5.757 -5.462 1.00 0.00 H new ATOM 690 N VAL A 45 -0.909 3.827 -6.777 1.00 0.00 N ATOM 691 CA VAL A 45 0.200 2.873 -6.486 1.00 0.00 C ATOM 692 C VAL A 45 0.723 2.235 -7.775 1.00 0.00 C ATOM 693 O VAL A 45 1.887 1.901 -7.876 1.00 0.00 O ATOM 694 CB VAL A 45 -0.303 1.776 -5.544 1.00 0.00 C ATOM 695 CG1 VAL A 45 0.790 0.721 -5.349 1.00 0.00 C ATOM 696 CG2 VAL A 45 -0.651 2.396 -4.190 1.00 0.00 C ATOM 0 H VAL A 45 -1.850 3.438 -6.720 1.00 0.00 H new ATOM 0 HA VAL A 45 1.014 3.424 -6.015 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.187 1.306 -5.975 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.428 -0.058 -4.678 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.046 0.280 -6.312 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.675 1.189 -4.918 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.010 1.619 -3.515 1.00 0.00 H new ATOM 0 HG22 VAL A 45 0.237 2.864 -3.765 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -1.429 3.148 -4.323 1.00 0.00 H new ATOM 706 N GLN A 46 -0.099 2.072 -8.775 1.00 0.00 N ATOM 707 CA GLN A 46 0.396 1.445 -10.036 1.00 0.00 C ATOM 708 C GLN A 46 0.974 2.502 -10.969 1.00 0.00 C ATOM 709 O GLN A 46 1.819 2.213 -11.793 1.00 0.00 O ATOM 710 CB GLN A 46 -0.768 0.753 -10.751 1.00 0.00 C ATOM 711 CG GLN A 46 -0.221 -0.219 -11.797 1.00 0.00 C ATOM 712 CD GLN A 46 0.347 -1.456 -11.100 1.00 0.00 C ATOM 713 OE1 GLN A 46 1.544 -1.669 -11.094 1.00 0.00 O ATOM 714 NE2 GLN A 46 -0.465 -2.289 -10.509 1.00 0.00 N ATOM 0 H GLN A 46 -1.083 2.342 -8.776 1.00 0.00 H new ATOM 0 HA GLN A 46 1.172 0.724 -9.780 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -1.385 0.217 -10.029 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -1.408 1.495 -11.229 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -1.013 -0.510 -12.487 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.555 0.266 -12.388 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -1.469 -2.112 -10.513 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -0.095 -3.117 -10.043 1.00 0.00 H new ATOM 723 N GLN A 47 0.505 3.717 -10.887 1.00 0.00 N ATOM 724 CA GLN A 47 1.016 4.758 -11.815 1.00 0.00 C ATOM 725 C GLN A 47 2.263 5.435 -11.246 1.00 0.00 C ATOM 726 O GLN A 47 3.287 5.525 -11.894 1.00 0.00 O ATOM 727 CB GLN A 47 -0.098 5.794 -12.026 1.00 0.00 C ATOM 728 CG GLN A 47 0.050 6.476 -13.388 1.00 0.00 C ATOM 729 CD GLN A 47 -0.291 5.483 -14.501 1.00 0.00 C ATOM 730 OE1 GLN A 47 -1.447 5.214 -14.758 1.00 0.00 O ATOM 731 NE2 GLN A 47 0.675 4.923 -15.178 1.00 0.00 N ATOM 0 H GLN A 47 -0.203 4.030 -10.223 1.00 0.00 H new ATOM 0 HA GLN A 47 1.296 4.299 -12.763 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -1.071 5.307 -11.961 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -0.062 6.541 -11.233 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -0.609 7.342 -13.445 1.00 0.00 H new ATOM 0 HG3 GLN A 47 1.069 6.842 -13.514 1.00 0.00 H new ATOM 0 HE21 GLN A 47 1.646 5.149 -14.963 1.00 0.00 H new ATOM 0 HE22 GLN A 47 0.458 4.260 -15.922 1.00 0.00 H new ATOM 740 N PHE A 48 2.168 5.947 -10.044 1.00 0.00 N ATOM 741 CA PHE A 48 3.330 6.659 -9.435 1.00 0.00 C ATOM 742 C PHE A 48 4.147 5.723 -8.542 1.00 0.00 C ATOM 743 O PHE A 48 5.119 6.155 -7.959 1.00 0.00 O ATOM 744 CB PHE A 48 2.812 7.822 -8.586 1.00 0.00 C ATOM 745 CG PHE A 48 2.157 8.850 -9.477 1.00 0.00 C ATOM 746 CD1 PHE A 48 0.794 8.748 -9.779 1.00 0.00 C ATOM 747 CD2 PHE A 48 2.913 9.906 -9.999 1.00 0.00 C ATOM 748 CE1 PHE A 48 0.187 9.703 -10.604 1.00 0.00 C ATOM 749 CE2 PHE A 48 2.306 10.861 -10.824 1.00 0.00 C ATOM 750 CZ PHE A 48 0.942 10.759 -11.126 1.00 0.00 C ATOM 0 H PHE A 48 1.334 5.902 -9.459 1.00 0.00 H new ATOM 0 HA PHE A 48 3.971 7.021 -10.239 1.00 0.00 H new ATOM 0 HB2 PHE A 48 2.097 7.457 -7.849 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.635 8.276 -8.034 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.211 7.933 -9.376 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.965 9.984 -9.766 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.865 9.624 -10.837 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.889 11.676 -11.227 1.00 0.00 H new ATOM 0 HZ PHE A 48 0.473 11.495 -11.762 1.00 0.00 H new ATOM 760 N ASP A 49 3.777 4.454 -8.444 1.00 0.00 N ATOM 761 CA ASP A 49 4.552 3.476 -7.583 1.00 0.00 C ATOM 762 C ASP A 49 5.435 4.194 -6.541 1.00 0.00 C ATOM 763 O ASP A 49 6.639 4.244 -6.701 1.00 0.00 O ATOM 764 CB ASP A 49 5.457 2.622 -8.482 1.00 0.00 C ATOM 765 CG ASP A 49 5.976 3.478 -9.639 1.00 0.00 C ATOM 766 OD1 ASP A 49 6.979 4.147 -9.451 1.00 0.00 O ATOM 767 OD2 ASP A 49 5.363 3.449 -10.693 1.00 0.00 O ATOM 0 H ASP A 49 2.971 4.053 -8.924 1.00 0.00 H new ATOM 0 HA ASP A 49 3.828 2.859 -7.051 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.292 2.226 -7.905 1.00 0.00 H new ATOM 0 HB3 ASP A 49 4.902 1.767 -8.868 1.00 0.00 H new ATOM 772 N PRO A 50 4.831 4.732 -5.513 1.00 0.00 N ATOM 773 CA PRO A 50 5.587 5.441 -4.472 1.00 0.00 C ATOM 774 C PRO A 50 6.462 4.432 -3.718 1.00 0.00 C ATOM 775 O PRO A 50 6.201 3.245 -3.726 1.00 0.00 O ATOM 776 CB PRO A 50 4.509 6.065 -3.554 1.00 0.00 C ATOM 777 CG PRO A 50 3.120 5.616 -4.098 1.00 0.00 C ATOM 778 CD PRO A 50 3.374 4.681 -5.300 1.00 0.00 C ATOM 0 HA PRO A 50 6.254 6.209 -4.864 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.643 5.734 -2.524 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.588 7.152 -3.553 1.00 0.00 H new ATOM 0 HG2 PRO A 50 2.553 5.100 -3.323 1.00 0.00 H new ATOM 0 HG3 PRO A 50 2.530 6.480 -4.402 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.040 3.665 -5.089 1.00 0.00 H new ATOM 0 HD3 PRO A 50 2.833 5.017 -6.184 1.00 0.00 H new ATOM 786 N THR A 51 7.489 4.890 -3.063 1.00 0.00 N ATOM 787 CA THR A 51 8.361 3.947 -2.310 1.00 0.00 C ATOM 788 C THR A 51 7.586 3.428 -1.098 1.00 0.00 C ATOM 789 O THR A 51 6.514 3.910 -0.788 1.00 0.00 O ATOM 790 CB THR A 51 9.632 4.666 -1.849 1.00 0.00 C ATOM 791 OG1 THR A 51 9.280 5.839 -1.129 1.00 0.00 O ATOM 792 CG2 THR A 51 10.476 5.044 -3.067 1.00 0.00 C ATOM 0 H THR A 51 7.763 5.871 -3.016 1.00 0.00 H new ATOM 0 HA THR A 51 8.647 3.114 -2.952 1.00 0.00 H new ATOM 0 HB THR A 51 10.208 4.005 -1.202 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.044 6.452 -1.109 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.381 5.556 -2.738 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.748 4.142 -3.615 1.00 0.00 H new ATOM 0 HG23 THR A 51 9.902 5.704 -3.717 1.00 0.00 H new ATOM 800 N ALA A 52 8.105 2.449 -0.411 1.00 0.00 N ATOM 801 CA ALA A 52 7.371 1.916 0.769 1.00 0.00 C ATOM 802 C ALA A 52 7.123 3.058 1.758 1.00 0.00 C ATOM 803 O ALA A 52 6.281 2.979 2.627 1.00 0.00 O ATOM 804 CB ALA A 52 8.205 0.826 1.440 1.00 0.00 C ATOM 0 H ALA A 52 8.998 1.999 -0.613 1.00 0.00 H new ATOM 0 HA ALA A 52 6.418 1.492 0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 52 7.667 0.436 2.304 1.00 0.00 H new ATOM 0 HB2 ALA A 52 8.386 0.018 0.731 1.00 0.00 H new ATOM 0 HB3 ALA A 52 9.158 1.245 1.765 1.00 0.00 H new ATOM 810 N LYS A 53 7.862 4.122 1.618 1.00 0.00 N ATOM 811 CA LYS A 53 7.704 5.294 2.525 1.00 0.00 C ATOM 812 C LYS A 53 6.235 5.714 2.575 1.00 0.00 C ATOM 813 O LYS A 53 5.587 5.634 3.604 1.00 0.00 O ATOM 814 CB LYS A 53 8.529 6.455 1.978 1.00 0.00 C ATOM 815 CG LYS A 53 10.005 6.044 1.814 1.00 0.00 C ATOM 816 CD LYS A 53 10.757 6.230 3.138 1.00 0.00 C ATOM 817 CE LYS A 53 12.146 5.599 3.028 1.00 0.00 C ATOM 818 NZ LYS A 53 12.012 4.119 2.913 1.00 0.00 N ATOM 0 H LYS A 53 8.580 4.231 0.902 1.00 0.00 H new ATOM 0 HA LYS A 53 8.041 5.027 3.527 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.126 6.773 1.017 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.457 7.309 2.652 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.067 5.004 1.495 1.00 0.00 H new ATOM 0 HG3 LYS A 53 10.473 6.645 1.034 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.845 7.291 3.373 1.00 0.00 H new ATOM 0 HD3 LYS A 53 10.200 5.769 3.953 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.670 5.996 2.158 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.743 5.854 3.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 12.587 3.660 3.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.015 3.850 3.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.340 3.813 1.975 1.00 0.00 H new ATOM 832 N ASP A 54 5.693 6.141 1.463 1.00 0.00 N ATOM 833 CA ASP A 54 4.258 6.539 1.422 1.00 0.00 C ATOM 834 C ASP A 54 3.420 5.504 2.170 1.00 0.00 C ATOM 835 O ASP A 54 2.642 5.841 3.041 1.00 0.00 O ATOM 836 CB ASP A 54 3.798 6.586 -0.039 1.00 0.00 C ATOM 837 CG ASP A 54 2.457 7.320 -0.136 1.00 0.00 C ATOM 838 OD1 ASP A 54 2.285 8.295 0.577 1.00 0.00 O ATOM 839 OD2 ASP A 54 1.626 6.894 -0.921 1.00 0.00 O ATOM 0 H ASP A 54 6.189 6.231 0.576 1.00 0.00 H new ATOM 0 HA ASP A 54 4.136 7.517 1.888 1.00 0.00 H new ATOM 0 HB2 ASP A 54 4.546 7.093 -0.649 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.699 5.574 -0.432 1.00 0.00 H new ATOM 844 N LEU A 55 3.554 4.256 1.833 1.00 0.00 N ATOM 845 CA LEU A 55 2.737 3.214 2.526 1.00 0.00 C ATOM 846 C LEU A 55 2.806 3.428 4.044 1.00 0.00 C ATOM 847 O LEU A 55 1.901 3.063 4.768 1.00 0.00 O ATOM 848 CB LEU A 55 3.255 1.813 2.168 1.00 0.00 C ATOM 849 CG LEU A 55 2.730 1.403 0.788 1.00 0.00 C ATOM 850 CD1 LEU A 55 3.178 2.425 -0.259 1.00 0.00 C ATOM 851 CD2 LEU A 55 3.283 0.024 0.424 1.00 0.00 C ATOM 0 H LEU A 55 4.188 3.908 1.113 1.00 0.00 H new ATOM 0 HA LEU A 55 1.700 3.298 2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 55 4.345 1.807 2.169 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.931 1.093 2.919 1.00 0.00 H new ATOM 0 HG LEU A 55 1.641 1.366 0.812 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.803 2.130 -1.239 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.784 3.408 -0.000 1.00 0.00 H new ATOM 0 HD13 LEU A 55 4.267 2.466 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.911 -0.270 -0.557 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.372 0.063 0.402 1.00 0.00 H new ATOM 0 HD23 LEU A 55 2.961 -0.705 1.167 1.00 0.00 H new ATOM 863 N GLN A 56 3.864 4.020 4.535 1.00 0.00 N ATOM 864 CA GLN A 56 3.964 4.251 6.006 1.00 0.00 C ATOM 865 C GLN A 56 2.976 5.341 6.427 1.00 0.00 C ATOM 866 O GLN A 56 2.154 5.145 7.300 1.00 0.00 O ATOM 867 CB GLN A 56 5.382 4.696 6.376 1.00 0.00 C ATOM 868 CG GLN A 56 6.397 3.684 5.845 1.00 0.00 C ATOM 869 CD GLN A 56 7.754 3.923 6.509 1.00 0.00 C ATOM 870 OE1 GLN A 56 8.517 4.761 6.072 1.00 0.00 O ATOM 871 NE2 GLN A 56 8.090 3.216 7.553 1.00 0.00 N ATOM 0 H GLN A 56 4.657 4.351 3.986 1.00 0.00 H new ATOM 0 HA GLN A 56 3.730 3.319 6.521 1.00 0.00 H new ATOM 0 HB2 GLN A 56 5.585 5.682 5.957 1.00 0.00 H new ATOM 0 HB3 GLN A 56 5.475 4.784 7.458 1.00 0.00 H new ATOM 0 HG2 GLN A 56 6.055 2.669 6.048 1.00 0.00 H new ATOM 0 HG3 GLN A 56 6.488 3.779 4.763 1.00 0.00 H new ATOM 0 HE21 GLN A 56 7.449 2.512 7.920 1.00 0.00 H new ATOM 0 HE22 GLN A 56 8.993 3.367 8.002 1.00 0.00 H new ATOM 880 N ASP A 57 3.061 6.497 5.824 1.00 0.00 N ATOM 881 CA ASP A 57 2.138 7.612 6.203 1.00 0.00 C ATOM 882 C ASP A 57 0.844 7.552 5.388 1.00 0.00 C ATOM 883 O ASP A 57 -0.090 8.275 5.663 1.00 0.00 O ATOM 884 CB ASP A 57 2.829 8.951 5.961 1.00 0.00 C ATOM 885 CG ASP A 57 3.869 9.193 7.059 1.00 0.00 C ATOM 886 OD1 ASP A 57 4.474 8.229 7.497 1.00 0.00 O ATOM 887 OD2 ASP A 57 4.042 10.339 7.441 1.00 0.00 O ATOM 0 H ASP A 57 3.729 6.719 5.086 1.00 0.00 H new ATOM 0 HA ASP A 57 1.887 7.508 7.259 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.310 8.953 4.983 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.094 9.756 5.957 1.00 0.00 H new ATOM 892 N LEU A 58 0.751 6.689 4.417 1.00 0.00 N ATOM 893 CA LEU A 58 -0.522 6.593 3.636 1.00 0.00 C ATOM 894 C LEU A 58 -1.414 5.563 4.327 1.00 0.00 C ATOM 895 O LEU A 58 -2.625 5.624 4.253 1.00 0.00 O ATOM 896 CB LEU A 58 -0.223 6.168 2.189 1.00 0.00 C ATOM 897 CG LEU A 58 -1.525 6.157 1.339 1.00 0.00 C ATOM 898 CD1 LEU A 58 -1.226 6.637 -0.087 1.00 0.00 C ATOM 899 CD2 LEU A 58 -2.106 4.736 1.261 1.00 0.00 C ATOM 0 H LEU A 58 1.491 6.049 4.129 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.025 7.559 3.600 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.501 6.852 1.746 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.230 5.177 2.182 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.245 6.822 1.816 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -2.144 6.626 -0.675 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.829 7.652 -0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.492 5.975 -0.547 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -3.017 4.748 0.662 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.377 4.070 0.800 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.337 4.382 2.266 1.00 0.00 H new ATOM 911 N LEU A 59 -0.820 4.647 5.036 1.00 0.00 N ATOM 912 CA LEU A 59 -1.610 3.623 5.778 1.00 0.00 C ATOM 913 C LEU A 59 -1.876 4.142 7.196 1.00 0.00 C ATOM 914 O LEU A 59 -2.783 3.698 7.866 1.00 0.00 O ATOM 915 CB LEU A 59 -0.801 2.319 5.830 1.00 0.00 C ATOM 916 CG LEU A 59 -1.567 1.225 6.589 1.00 0.00 C ATOM 917 CD1 LEU A 59 -2.859 0.860 5.840 1.00 0.00 C ATOM 918 CD2 LEU A 59 -0.670 -0.014 6.702 1.00 0.00 C ATOM 0 H LEU A 59 0.192 4.562 5.135 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.562 3.433 5.281 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.585 1.980 4.817 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.157 2.501 6.316 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.833 1.589 7.581 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.391 0.084 6.390 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.492 1.743 5.755 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.611 0.494 4.844 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.201 -0.800 7.239 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.411 -0.368 5.704 1.00 0.00 H new ATOM 0 HD23 LEU A 59 0.240 0.244 7.243 1.00 0.00 H new ATOM 930 N GLN A 60 -1.087 5.066 7.669 1.00 0.00 N ATOM 931 CA GLN A 60 -1.299 5.591 9.054 1.00 0.00 C ATOM 932 C GLN A 60 -2.191 6.841 9.043 1.00 0.00 C ATOM 933 O GLN A 60 -2.784 7.182 10.048 1.00 0.00 O ATOM 934 CB GLN A 60 0.056 5.964 9.651 1.00 0.00 C ATOM 935 CG GLN A 60 0.866 4.694 9.917 1.00 0.00 C ATOM 936 CD GLN A 60 2.288 5.073 10.334 1.00 0.00 C ATOM 937 OE1 GLN A 60 3.217 4.319 10.122 1.00 0.00 O ATOM 938 NE2 GLN A 60 2.500 6.219 10.923 1.00 0.00 N ATOM 0 H GLN A 60 -0.306 5.481 7.161 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.789 4.818 9.646 1.00 0.00 H new ATOM 0 HB2 GLN A 60 0.599 6.617 8.968 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -0.084 6.519 10.579 1.00 0.00 H new ATOM 0 HG2 GLN A 60 0.391 4.105 10.701 1.00 0.00 H new ATOM 0 HG3 GLN A 60 0.892 4.072 9.022 1.00 0.00 H new ATOM 0 HE21 GLN A 60 1.721 6.853 11.101 1.00 0.00 H new ATOM 0 HE22 GLN A 60 3.445 6.481 11.205 1.00 0.00 H new ATOM 947 N TYR A 61 -2.288 7.535 7.930 1.00 0.00 N ATOM 948 CA TYR A 61 -3.141 8.775 7.876 1.00 0.00 C ATOM 949 C TYR A 61 -4.381 8.539 7.014 1.00 0.00 C ATOM 950 O TYR A 61 -5.487 8.843 7.415 1.00 0.00 O ATOM 951 CB TYR A 61 -2.334 9.930 7.278 1.00 0.00 C ATOM 952 CG TYR A 61 -1.286 10.378 8.270 1.00 0.00 C ATOM 953 CD1 TYR A 61 -0.167 9.574 8.515 1.00 0.00 C ATOM 954 CD2 TYR A 61 -1.432 11.597 8.947 1.00 0.00 C ATOM 955 CE1 TYR A 61 0.805 9.986 9.434 1.00 0.00 C ATOM 956 CE2 TYR A 61 -0.460 12.008 9.867 1.00 0.00 C ATOM 957 CZ TYR A 61 0.659 11.203 10.110 1.00 0.00 C ATOM 958 OH TYR A 61 1.617 11.608 11.017 1.00 0.00 O ATOM 0 H TYR A 61 -1.815 7.299 7.058 1.00 0.00 H new ATOM 0 HA TYR A 61 -3.453 9.022 8.891 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -1.859 9.614 6.349 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -2.995 10.761 7.031 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.053 8.635 7.994 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -2.295 12.219 8.759 1.00 0.00 H new ATOM 0 HE1 TYR A 61 1.668 9.365 9.622 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -0.574 12.946 10.389 1.00 0.00 H new ATOM 0 HH TYR A 61 1.363 12.475 11.396 1.00 0.00 H new ATOM 968 N LEU A 62 -4.219 8.016 5.828 1.00 0.00 N ATOM 969 CA LEU A 62 -5.414 7.791 4.963 1.00 0.00 C ATOM 970 C LEU A 62 -6.268 6.680 5.570 1.00 0.00 C ATOM 971 O LEU A 62 -7.476 6.683 5.439 1.00 0.00 O ATOM 972 CB LEU A 62 -4.977 7.414 3.540 1.00 0.00 C ATOM 973 CG LEU A 62 -6.122 7.689 2.541 1.00 0.00 C ATOM 974 CD1 LEU A 62 -6.094 9.156 2.093 1.00 0.00 C ATOM 975 CD2 LEU A 62 -5.960 6.791 1.308 1.00 0.00 C ATOM 0 H LEU A 62 -3.324 7.738 5.425 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.001 8.708 4.907 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.094 7.987 3.259 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.698 6.361 3.504 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.071 7.478 3.033 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.906 9.337 1.389 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.215 9.804 2.961 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.141 9.371 1.610 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.770 6.988 0.605 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.004 7.001 0.828 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.991 5.745 1.613 1.00 0.00 H new ATOM 987 N CYS A 63 -5.658 5.748 6.256 1.00 0.00 N ATOM 988 CA CYS A 63 -6.438 4.650 6.906 1.00 0.00 C ATOM 989 C CYS A 63 -6.417 4.898 8.416 1.00 0.00 C ATOM 990 O CYS A 63 -6.455 6.028 8.861 1.00 0.00 O ATOM 991 CB CYS A 63 -5.775 3.308 6.584 1.00 0.00 C ATOM 992 SG CYS A 63 -5.215 3.321 4.862 1.00 0.00 S ATOM 0 H CYS A 63 -4.649 5.699 6.395 1.00 0.00 H new ATOM 0 HA CYS A 63 -7.466 4.629 6.543 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -4.931 3.136 7.252 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -6.480 2.492 6.744 1.00 0.00 H new ATOM 0 HG CYS A 63 -5.045 2.099 4.452 1.00 0.00 H new ATOM 998 N SER A 64 -6.326 3.869 9.212 1.00 0.00 N ATOM 999 CA SER A 64 -6.267 4.087 10.686 1.00 0.00 C ATOM 1000 C SER A 64 -5.678 2.852 11.373 1.00 0.00 C ATOM 1001 O SER A 64 -5.486 1.820 10.761 1.00 0.00 O ATOM 1002 CB SER A 64 -7.665 4.370 11.230 1.00 0.00 C ATOM 1003 OG SER A 64 -8.349 5.240 10.339 1.00 0.00 O ATOM 0 H SER A 64 -6.290 2.895 8.910 1.00 0.00 H new ATOM 0 HA SER A 64 -5.628 4.946 10.891 1.00 0.00 H new ATOM 0 HB2 SER A 64 -8.219 3.438 11.343 1.00 0.00 H new ATOM 0 HB3 SER A 64 -7.598 4.823 12.219 1.00 0.00 H new ATOM 0 HG SER A 64 -7.718 5.894 9.971 1.00 0.00 H new ATOM 1009 N SER A 65 -5.371 2.971 12.639 1.00 0.00 N ATOM 1010 CA SER A 65 -4.768 1.834 13.401 1.00 0.00 C ATOM 1011 C SER A 65 -5.395 0.499 12.990 1.00 0.00 C ATOM 1012 O SER A 65 -4.734 -0.360 12.435 1.00 0.00 O ATOM 1013 CB SER A 65 -4.993 2.056 14.896 1.00 0.00 C ATOM 1014 OG SER A 65 -4.431 0.969 15.621 1.00 0.00 O ATOM 0 H SER A 65 -5.514 3.820 13.186 1.00 0.00 H new ATOM 0 HA SER A 65 -3.702 1.797 13.178 1.00 0.00 H new ATOM 0 HB2 SER A 65 -4.534 2.994 15.210 1.00 0.00 H new ATOM 0 HB3 SER A 65 -6.059 2.137 15.107 1.00 0.00 H new ATOM 0 HG SER A 65 -4.572 1.108 16.581 1.00 0.00 H new ATOM 1020 N LEU A 66 -6.655 0.298 13.270 1.00 0.00 N ATOM 1021 CA LEU A 66 -7.301 -0.995 12.908 1.00 0.00 C ATOM 1022 C LEU A 66 -6.944 -1.378 11.470 1.00 0.00 C ATOM 1023 O LEU A 66 -6.223 -2.320 11.243 1.00 0.00 O ATOM 1024 CB LEU A 66 -8.828 -0.857 13.038 1.00 0.00 C ATOM 1025 CG LEU A 66 -9.263 -1.001 14.508 1.00 0.00 C ATOM 1026 CD1 LEU A 66 -9.054 -2.447 15.005 1.00 0.00 C ATOM 1027 CD2 LEU A 66 -8.460 -0.029 15.381 1.00 0.00 C ATOM 0 H LEU A 66 -7.263 0.973 13.733 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.943 -1.773 13.582 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.145 0.112 12.653 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.320 -1.617 12.432 1.00 0.00 H new ATOM 0 HG LEU A 66 -10.325 -0.765 14.579 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -9.369 -2.523 16.046 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.646 -3.130 14.396 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.999 -2.711 14.925 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -8.770 -0.133 16.421 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -7.397 -0.255 15.295 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.641 0.993 15.049 1.00 0.00 H new ATOM 1039 N VAL A 67 -7.506 -0.693 10.507 1.00 0.00 N ATOM 1040 CA VAL A 67 -7.267 -1.041 9.067 1.00 0.00 C ATOM 1041 C VAL A 67 -5.857 -1.624 8.855 1.00 0.00 C ATOM 1042 O VAL A 67 -5.688 -2.630 8.194 1.00 0.00 O ATOM 1043 CB VAL A 67 -7.431 0.208 8.206 1.00 0.00 C ATOM 1044 CG1 VAL A 67 -7.556 -0.195 6.734 1.00 0.00 C ATOM 1045 CG2 VAL A 67 -8.690 0.964 8.636 1.00 0.00 C ATOM 0 H VAL A 67 -8.128 0.102 10.655 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.997 -1.797 8.777 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.560 0.851 8.333 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -7.673 0.699 6.121 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -6.658 -0.731 6.426 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.426 -0.839 6.606 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -8.807 1.856 8.021 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.561 0.321 8.511 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -8.600 1.254 9.683 1.00 0.00 H new ATOM 1055 N ALA A 68 -4.843 -1.003 9.415 1.00 0.00 N ATOM 1056 CA ALA A 68 -3.455 -1.534 9.243 1.00 0.00 C ATOM 1057 C ALA A 68 -3.431 -2.993 9.695 1.00 0.00 C ATOM 1058 O ALA A 68 -2.841 -3.845 9.060 1.00 0.00 O ATOM 1059 CB ALA A 68 -2.477 -0.713 10.085 1.00 0.00 C ATOM 0 H ALA A 68 -4.918 -0.157 9.980 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.158 -1.465 8.196 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.468 -1.104 9.956 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.506 0.328 9.764 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -2.759 -0.777 11.136 1.00 0.00 H new ATOM 1065 N SER A 69 -4.130 -3.293 10.751 1.00 0.00 N ATOM 1066 CA SER A 69 -4.232 -4.698 11.223 1.00 0.00 C ATOM 1067 C SER A 69 -4.893 -5.517 10.118 1.00 0.00 C ATOM 1068 O SER A 69 -4.262 -6.257 9.390 1.00 0.00 O ATOM 1069 CB SER A 69 -5.149 -4.721 12.458 1.00 0.00 C ATOM 1070 OG SER A 69 -5.184 -6.041 12.986 1.00 0.00 O ATOM 0 H SER A 69 -4.642 -2.614 11.315 1.00 0.00 H new ATOM 0 HA SER A 69 -3.249 -5.101 11.468 1.00 0.00 H new ATOM 0 HB2 SER A 69 -4.783 -4.024 13.212 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.154 -4.398 12.186 1.00 0.00 H new ATOM 0 HG SER A 69 -5.766 -6.063 13.774 1.00 0.00 H new ATOM 1076 N LEU A 70 -6.185 -5.364 10.009 1.00 0.00 N ATOM 1077 CA LEU A 70 -7.008 -6.067 8.997 1.00 0.00 C ATOM 1078 C LEU A 70 -6.293 -6.274 7.656 1.00 0.00 C ATOM 1079 O LEU A 70 -6.043 -7.383 7.228 1.00 0.00 O ATOM 1080 CB LEU A 70 -8.246 -5.183 8.731 1.00 0.00 C ATOM 1081 CG LEU A 70 -8.811 -4.636 10.051 1.00 0.00 C ATOM 1082 CD1 LEU A 70 -10.186 -4.016 9.790 1.00 0.00 C ATOM 1083 CD2 LEU A 70 -8.956 -5.771 11.071 1.00 0.00 C ATOM 0 H LEU A 70 -6.725 -4.746 10.615 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.246 -7.055 9.391 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.975 -4.356 8.074 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -9.010 -5.763 8.214 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.130 -3.883 10.448 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.592 -3.626 10.723 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -10.088 -3.204 9.069 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -10.858 -4.776 9.391 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.357 -5.373 12.003 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -9.634 -6.529 10.678 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.980 -6.219 11.258 1.00 0.00 H new ATOM 1095 N HIS A 71 -6.092 -5.207 6.925 1.00 0.00 N ATOM 1096 CA HIS A 71 -5.542 -5.356 5.554 1.00 0.00 C ATOM 1097 C HIS A 71 -4.203 -6.108 5.577 1.00 0.00 C ATOM 1098 O HIS A 71 -4.005 -7.067 4.845 1.00 0.00 O ATOM 1099 CB HIS A 71 -5.414 -3.960 4.894 1.00 0.00 C ATOM 1100 CG HIS A 71 -4.220 -3.892 3.969 1.00 0.00 C ATOM 1101 ND1 HIS A 71 -2.921 -4.053 4.427 1.00 0.00 N ATOM 1102 CD2 HIS A 71 -4.115 -3.680 2.618 1.00 0.00 C ATOM 1103 CE1 HIS A 71 -2.100 -3.936 3.368 1.00 0.00 C ATOM 1104 NE2 HIS A 71 -2.777 -3.708 2.240 1.00 0.00 N ATOM 0 H HIS A 71 -6.284 -4.249 7.219 1.00 0.00 H new ATOM 0 HA HIS A 71 -6.226 -5.956 4.954 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -6.322 -3.736 4.334 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.320 -3.198 5.668 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -4.946 -3.516 1.948 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -1.024 -4.017 3.423 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -2.395 -3.582 1.303 1.00 0.00 H new ATOM 1112 N HIS A 72 -3.253 -5.662 6.371 1.00 0.00 N ATOM 1113 CA HIS A 72 -1.940 -6.361 6.351 1.00 0.00 C ATOM 1114 C HIS A 72 -2.166 -7.782 6.858 1.00 0.00 C ATOM 1115 O HIS A 72 -1.393 -8.679 6.593 1.00 0.00 O ATOM 1116 CB HIS A 72 -0.885 -5.582 7.168 1.00 0.00 C ATOM 1117 CG HIS A 72 -0.747 -6.148 8.562 1.00 0.00 C ATOM 1118 ND1 HIS A 72 -1.838 -6.328 9.397 1.00 0.00 N ATOM 1119 CD2 HIS A 72 0.345 -6.576 9.275 1.00 0.00 C ATOM 1120 CE1 HIS A 72 -1.383 -6.845 10.553 1.00 0.00 C ATOM 1121 NE2 HIS A 72 -0.059 -7.015 10.532 1.00 0.00 N ATOM 0 H HIS A 72 -3.331 -4.870 7.009 1.00 0.00 H new ATOM 0 HA HIS A 72 -1.537 -6.410 5.339 1.00 0.00 H new ATOM 0 HB2 HIS A 72 0.078 -5.625 6.658 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -1.169 -4.531 7.226 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -2.809 -6.109 9.176 1.00 0.00 H new ATOM 0 HD2 HIS A 72 1.363 -6.573 8.915 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -2.012 -7.092 11.395 1.00 0.00 H new ATOM 1129 N GLN A 73 -3.265 -8.002 7.538 1.00 0.00 N ATOM 1130 CA GLN A 73 -3.577 -9.381 7.998 1.00 0.00 C ATOM 1131 C GLN A 73 -3.476 -10.253 6.749 1.00 0.00 C ATOM 1132 O GLN A 73 -2.693 -11.177 6.685 1.00 0.00 O ATOM 1133 CB GLN A 73 -4.994 -9.435 8.601 1.00 0.00 C ATOM 1134 CG GLN A 73 -5.090 -10.568 9.628 1.00 0.00 C ATOM 1135 CD GLN A 73 -4.246 -10.221 10.856 1.00 0.00 C ATOM 1136 OE1 GLN A 73 -3.209 -10.813 11.082 1.00 0.00 O ATOM 1137 NE2 GLN A 73 -4.649 -9.279 11.664 1.00 0.00 N ATOM 0 H GLN A 73 -3.951 -7.290 7.790 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.895 -9.721 8.778 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.231 -8.483 9.076 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.728 -9.588 7.810 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -6.129 -10.721 9.920 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -4.742 -11.502 9.187 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -5.519 -8.782 11.474 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -4.094 -9.039 12.485 1.00 0.00 H new ATOM 1146 N GLN A 74 -4.256 -9.940 5.736 1.00 0.00 N ATOM 1147 CA GLN A 74 -4.177 -10.729 4.470 1.00 0.00 C ATOM 1148 C GLN A 74 -2.690 -10.862 4.132 1.00 0.00 C ATOM 1149 O GLN A 74 -2.086 -11.899 4.319 1.00 0.00 O ATOM 1150 CB GLN A 74 -4.894 -9.964 3.354 1.00 0.00 C ATOM 1151 CG GLN A 74 -6.402 -9.981 3.619 1.00 0.00 C ATOM 1152 CD GLN A 74 -7.138 -9.314 2.455 1.00 0.00 C ATOM 1153 OE1 GLN A 74 -7.341 -8.117 2.456 1.00 0.00 O ATOM 1154 NE2 GLN A 74 -7.551 -10.045 1.456 1.00 0.00 N ATOM 0 H GLN A 74 -4.936 -9.179 5.735 1.00 0.00 H new ATOM 0 HA GLN A 74 -4.645 -11.708 4.576 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -4.532 -8.937 3.311 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -4.678 -10.419 2.388 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -6.748 -11.007 3.740 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.623 -9.458 4.549 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -7.380 -11.051 1.455 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.044 -9.611 0.676 1.00 0.00 H new ATOM 1163 N LEU A 75 -2.091 -9.757 3.696 1.00 0.00 N ATOM 1164 CA LEU A 75 -0.617 -9.700 3.404 1.00 0.00 C ATOM 1165 C LEU A 75 0.141 -10.638 4.346 1.00 0.00 C ATOM 1166 O LEU A 75 0.770 -11.575 3.900 1.00 0.00 O ATOM 1167 CB LEU A 75 -0.153 -8.244 3.638 1.00 0.00 C ATOM 1168 CG LEU A 75 1.043 -7.899 2.736 1.00 0.00 C ATOM 1169 CD1 LEU A 75 1.504 -6.471 3.033 1.00 0.00 C ATOM 1170 CD2 LEU A 75 2.193 -8.867 3.015 1.00 0.00 C ATOM 0 H LEU A 75 -2.582 -8.878 3.530 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.420 -10.011 2.378 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.976 -7.559 3.436 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.124 -8.110 4.684 1.00 0.00 H new ATOM 0 HG LEU A 75 0.744 -7.981 1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.352 -6.222 2.395 1.00 0.00 H new ATOM 0 HD12 LEU A 75 0.687 -5.777 2.837 1.00 0.00 H new ATOM 0 HD13 LEU A 75 1.802 -6.395 4.079 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.040 -8.620 2.374 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.492 -8.785 4.060 1.00 0.00 H new ATOM 0 HD23 LEU A 75 1.868 -9.887 2.810 1.00 0.00 H new ATOM 1182 N ASP A 76 0.073 -10.386 5.636 1.00 0.00 N ATOM 1183 CA ASP A 76 0.763 -11.251 6.654 1.00 0.00 C ATOM 1184 C ASP A 76 0.968 -12.670 6.101 1.00 0.00 C ATOM 1185 O ASP A 76 2.062 -13.093 5.753 1.00 0.00 O ATOM 1186 CB ASP A 76 -0.156 -11.328 7.901 1.00 0.00 C ATOM 1187 CG ASP A 76 0.678 -11.648 9.148 1.00 0.00 C ATOM 1188 OD1 ASP A 76 1.480 -12.565 9.081 1.00 0.00 O ATOM 1189 OD2 ASP A 76 0.498 -10.971 10.147 1.00 0.00 O ATOM 0 H ASP A 76 -0.442 -9.601 6.034 1.00 0.00 H new ATOM 0 HA ASP A 76 1.737 -10.829 6.901 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -0.679 -10.381 8.036 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.917 -12.095 7.756 1.00 0.00 H new ATOM 1194 N SER A 77 -0.109 -13.395 6.005 1.00 0.00 N ATOM 1195 CA SER A 77 -0.051 -14.771 5.479 1.00 0.00 C ATOM 1196 C SER A 77 0.022 -14.750 3.959 1.00 0.00 C ATOM 1197 O SER A 77 0.547 -15.665 3.356 1.00 0.00 O ATOM 1198 CB SER A 77 -1.318 -15.504 5.886 1.00 0.00 C ATOM 1199 OG SER A 77 -1.318 -15.708 7.293 1.00 0.00 O ATOM 0 H SER A 77 -1.041 -13.080 6.276 1.00 0.00 H new ATOM 0 HA SER A 77 0.832 -15.268 5.879 1.00 0.00 H new ATOM 0 HB2 SER A 77 -2.195 -14.927 5.592 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.378 -16.462 5.369 1.00 0.00 H new ATOM 0 HG SER A 77 -2.136 -16.179 7.555 1.00 0.00 H new ATOM 1205 N LEU A 78 -0.518 -13.739 3.311 1.00 0.00 N ATOM 1206 CA LEU A 78 -0.468 -13.741 1.829 1.00 0.00 C ATOM 1207 C LEU A 78 0.974 -13.985 1.421 1.00 0.00 C ATOM 1208 O LEU A 78 1.276 -14.933 0.728 1.00 0.00 O ATOM 1209 CB LEU A 78 -0.990 -12.402 1.266 1.00 0.00 C ATOM 1210 CG LEU A 78 -1.872 -12.655 0.043 1.00 0.00 C ATOM 1211 CD1 LEU A 78 -2.655 -11.385 -0.304 1.00 0.00 C ATOM 1212 CD2 LEU A 78 -0.995 -13.051 -1.146 1.00 0.00 C ATOM 0 H LEU A 78 -0.978 -12.936 3.741 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.108 -14.525 1.424 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.559 -11.874 2.031 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.151 -11.762 0.993 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.572 -13.460 0.266 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.282 -11.571 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.283 -11.103 0.541 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.958 -10.576 -0.524 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.624 -13.231 -2.018 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.294 -12.246 -1.365 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.442 -13.958 -0.904 1.00 0.00 H new ATOM 1224 N ILE A 79 1.886 -13.171 1.900 1.00 0.00 N ATOM 1225 CA ILE A 79 3.314 -13.396 1.603 1.00 0.00 C ATOM 1226 C ILE A 79 3.607 -14.862 1.913 1.00 0.00 C ATOM 1227 O ILE A 79 4.064 -15.596 1.062 1.00 0.00 O ATOM 1228 CB ILE A 79 4.141 -12.439 2.515 1.00 0.00 C ATOM 1229 CG1 ILE A 79 4.569 -11.180 1.730 1.00 0.00 C ATOM 1230 CG2 ILE A 79 5.392 -13.127 3.086 1.00 0.00 C ATOM 1231 CD1 ILE A 79 5.435 -11.543 0.513 1.00 0.00 C ATOM 0 H ILE A 79 1.689 -12.360 2.486 1.00 0.00 H new ATOM 0 HA ILE A 79 3.572 -13.192 0.564 1.00 0.00 H new ATOM 0 HB ILE A 79 3.496 -12.156 3.346 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.683 -10.638 1.399 1.00 0.00 H new ATOM 0 HG13 ILE A 79 5.125 -10.512 2.387 1.00 0.00 H new ATOM 0 HG21 ILE A 79 5.938 -12.424 3.715 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.093 -13.990 3.681 1.00 0.00 H new ATOM 0 HG23 ILE A 79 6.033 -13.455 2.267 1.00 0.00 H new ATOM 0 HD11 ILE A 79 5.718 -10.633 -0.016 1.00 0.00 H new ATOM 0 HD12 ILE A 79 6.333 -12.063 0.847 1.00 0.00 H new ATOM 0 HD13 ILE A 79 4.869 -12.191 -0.156 1.00 0.00 H new ATOM 1243 N SER A 80 3.347 -15.295 3.128 1.00 0.00 N ATOM 1244 CA SER A 80 3.617 -16.723 3.470 1.00 0.00 C ATOM 1245 C SER A 80 3.101 -17.618 2.337 1.00 0.00 C ATOM 1246 O SER A 80 3.817 -18.458 1.805 1.00 0.00 O ATOM 1247 CB SER A 80 2.899 -17.082 4.772 1.00 0.00 C ATOM 1248 OG SER A 80 3.450 -18.283 5.295 1.00 0.00 O ATOM 0 H SER A 80 2.965 -14.727 3.884 1.00 0.00 H new ATOM 0 HA SER A 80 4.689 -16.873 3.597 1.00 0.00 H new ATOM 0 HB2 SER A 80 3.007 -16.274 5.495 1.00 0.00 H new ATOM 0 HB3 SER A 80 1.832 -17.207 4.590 1.00 0.00 H new ATOM 0 HG SER A 80 2.994 -18.516 6.130 1.00 0.00 H new ATOM 1254 N GLU A 81 1.867 -17.442 1.951 1.00 0.00 N ATOM 1255 CA GLU A 81 1.324 -18.280 0.863 1.00 0.00 C ATOM 1256 C GLU A 81 1.885 -17.817 -0.483 1.00 0.00 C ATOM 1257 O GLU A 81 1.804 -18.527 -1.470 1.00 0.00 O ATOM 1258 CB GLU A 81 -0.201 -18.156 0.843 1.00 0.00 C ATOM 1259 CG GLU A 81 -0.777 -18.721 2.143 1.00 0.00 C ATOM 1260 CD GLU A 81 -2.298 -18.561 2.139 1.00 0.00 C ATOM 1261 OE1 GLU A 81 -2.889 -18.726 1.085 1.00 0.00 O ATOM 1262 OE2 GLU A 81 -2.846 -18.277 3.192 1.00 0.00 O ATOM 0 H GLU A 81 1.221 -16.757 2.343 1.00 0.00 H new ATOM 0 HA GLU A 81 1.610 -19.318 1.033 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -0.490 -17.111 0.729 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -0.609 -18.695 -0.012 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -0.512 -19.773 2.244 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -0.348 -18.201 3.000 1.00 0.00 H new ATOM 1269 N ALA A 82 2.378 -16.603 -0.584 1.00 0.00 N ATOM 1270 CA ALA A 82 2.833 -16.149 -1.930 1.00 0.00 C ATOM 1271 C ALA A 82 4.164 -16.805 -2.281 1.00 0.00 C ATOM 1272 O ALA A 82 4.524 -16.930 -3.433 1.00 0.00 O ATOM 1273 CB ALA A 82 3.013 -14.631 -1.955 1.00 0.00 C ATOM 0 H ALA A 82 2.481 -15.933 0.178 1.00 0.00 H new ATOM 0 HA ALA A 82 2.073 -16.435 -2.657 1.00 0.00 H new ATOM 0 HB1 ALA A 82 3.345 -14.320 -2.946 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.064 -14.148 -1.723 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.759 -14.341 -1.215 1.00 0.00 H new ATOM 1279 N GLU A 83 4.951 -17.156 -1.277 1.00 0.00 N ATOM 1280 CA GLU A 83 6.299 -17.731 -1.567 1.00 0.00 C ATOM 1281 C GLU A 83 6.179 -19.223 -1.851 1.00 0.00 C ATOM 1282 O GLU A 83 6.846 -19.741 -2.725 1.00 0.00 O ATOM 1283 CB GLU A 83 7.253 -17.487 -0.392 1.00 0.00 C ATOM 1284 CG GLU A 83 6.563 -17.878 0.916 1.00 0.00 C ATOM 1285 CD GLU A 83 7.567 -17.798 2.067 1.00 0.00 C ATOM 1286 OE1 GLU A 83 8.099 -16.723 2.290 1.00 0.00 O ATOM 1287 OE2 GLU A 83 7.787 -18.814 2.707 1.00 0.00 O ATOM 0 H GLU A 83 4.715 -17.068 -0.289 1.00 0.00 H new ATOM 0 HA GLU A 83 6.707 -17.236 -2.448 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.165 -18.070 -0.523 1.00 0.00 H new ATOM 0 HB3 GLU A 83 7.547 -16.438 -0.361 1.00 0.00 H new ATOM 0 HG2 GLU A 83 5.720 -17.214 1.108 1.00 0.00 H new ATOM 0 HG3 GLU A 83 6.161 -18.888 0.840 1.00 0.00 H new ATOM 1294 N THR A 84 5.307 -19.928 -1.173 1.00 0.00 N ATOM 1295 CA THR A 84 5.158 -21.377 -1.504 1.00 0.00 C ATOM 1296 C THR A 84 4.854 -21.456 -2.998 1.00 0.00 C ATOM 1297 O THR A 84 5.478 -22.179 -3.749 1.00 0.00 O ATOM 1298 CB THR A 84 4.001 -22.004 -0.710 1.00 0.00 C ATOM 1299 OG1 THR A 84 3.671 -23.265 -1.272 1.00 0.00 O ATOM 1300 CG2 THR A 84 2.773 -21.106 -0.731 1.00 0.00 C ATOM 0 H THR A 84 4.708 -19.576 -0.426 1.00 0.00 H new ATOM 0 HA THR A 84 6.067 -21.921 -1.248 1.00 0.00 H new ATOM 0 HB THR A 84 4.321 -22.127 0.325 1.00 0.00 H new ATOM 0 HG1 THR A 84 2.934 -23.666 -0.765 1.00 0.00 H new ATOM 0 HG21 THR A 84 1.970 -21.574 -0.162 1.00 0.00 H new ATOM 0 HG22 THR A 84 3.019 -20.142 -0.286 1.00 0.00 H new ATOM 0 HG23 THR A 84 2.449 -20.957 -1.761 1.00 0.00 H new ATOM 1308 N ARG A 85 3.880 -20.681 -3.408 1.00 0.00 N ATOM 1309 CA ARG A 85 3.454 -20.619 -4.842 1.00 0.00 C ATOM 1310 C ARG A 85 4.665 -20.766 -5.767 1.00 0.00 C ATOM 1311 O ARG A 85 4.576 -21.323 -6.843 1.00 0.00 O ATOM 1312 CB ARG A 85 2.777 -19.243 -5.066 1.00 0.00 C ATOM 1313 CG ARG A 85 2.926 -18.750 -6.525 1.00 0.00 C ATOM 1314 CD ARG A 85 4.284 -18.025 -6.756 1.00 0.00 C ATOM 1315 NE ARG A 85 4.935 -18.605 -7.967 1.00 0.00 N ATOM 1316 CZ ARG A 85 5.854 -17.935 -8.609 1.00 0.00 C ATOM 1317 NH1 ARG A 85 6.160 -16.724 -8.242 1.00 0.00 N ATOM 1318 NH2 ARG A 85 6.453 -18.474 -9.636 1.00 0.00 N ATOM 0 H ARG A 85 3.347 -20.070 -2.789 1.00 0.00 H new ATOM 0 HA ARG A 85 2.763 -21.431 -5.068 1.00 0.00 H new ATOM 0 HB2 ARG A 85 1.719 -19.315 -4.815 1.00 0.00 H new ATOM 0 HB3 ARG A 85 3.216 -18.509 -4.390 1.00 0.00 H new ATOM 0 HG2 ARG A 85 2.847 -19.598 -7.205 1.00 0.00 H new ATOM 0 HG3 ARG A 85 2.107 -18.072 -6.765 1.00 0.00 H new ATOM 0 HD2 ARG A 85 4.124 -16.955 -6.889 1.00 0.00 H new ATOM 0 HD3 ARG A 85 4.929 -18.145 -5.886 1.00 0.00 H new ATOM 0 HE ARG A 85 4.660 -19.531 -8.296 1.00 0.00 H new ATOM 0 HH11 ARG A 85 5.681 -16.295 -7.450 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.878 -16.204 -8.746 1.00 0.00 H new ATOM 0 HH21 ARG A 85 6.203 -19.416 -9.935 1.00 0.00 H new ATOM 0 HH22 ARG A 85 7.171 -17.953 -10.139 1.00 0.00 H new ATOM 1332 N GLY A 86 5.786 -20.251 -5.363 1.00 0.00 N ATOM 1333 CA GLY A 86 6.997 -20.332 -6.218 1.00 0.00 C ATOM 1334 C GLY A 86 8.111 -19.544 -5.540 1.00 0.00 C ATOM 1335 O GLY A 86 9.012 -20.125 -4.981 1.00 0.00 O ATOM 0 H GLY A 86 5.917 -19.774 -4.471 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.296 -21.371 -6.356 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.791 -19.925 -7.208 1.00 0.00 H new ATOM 1339 N ILE A 87 8.064 -18.224 -5.599 1.00 0.00 N ATOM 1340 CA ILE A 87 9.131 -17.396 -4.960 1.00 0.00 C ATOM 1341 C ILE A 87 9.474 -17.978 -3.579 1.00 0.00 C ATOM 1342 O ILE A 87 8.943 -17.536 -2.591 1.00 0.00 O ATOM 1343 CB ILE A 87 8.651 -15.934 -4.761 1.00 0.00 C ATOM 1344 CG1 ILE A 87 7.845 -15.447 -5.968 1.00 0.00 C ATOM 1345 CG2 ILE A 87 9.849 -15.011 -4.571 1.00 0.00 C ATOM 1346 CD1 ILE A 87 7.330 -14.030 -5.702 1.00 0.00 C ATOM 0 H ILE A 87 7.328 -17.692 -6.065 1.00 0.00 H new ATOM 0 HA ILE A 87 10.004 -17.406 -5.613 1.00 0.00 H new ATOM 0 HB ILE A 87 8.015 -15.913 -3.876 1.00 0.00 H new ATOM 0 HG12 ILE A 87 8.468 -15.457 -6.862 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.008 -16.120 -6.155 1.00 0.00 H new ATOM 0 HG21 ILE A 87 9.501 -13.987 -4.432 1.00 0.00 H new ATOM 0 HG22 ILE A 87 10.414 -15.324 -3.693 1.00 0.00 H new ATOM 0 HG23 ILE A 87 10.490 -15.060 -5.452 1.00 0.00 H new ATOM 0 HD11 ILE A 87 6.756 -13.684 -6.562 1.00 0.00 H new ATOM 0 HD12 ILE A 87 6.692 -14.035 -4.818 1.00 0.00 H new ATOM 0 HD13 ILE A 87 8.175 -13.361 -5.536 1.00 0.00 H new ATOM 1358 N THR A 88 10.320 -18.976 -3.495 1.00 0.00 N ATOM 1359 CA THR A 88 10.644 -19.554 -2.158 1.00 0.00 C ATOM 1360 C THR A 88 11.310 -18.468 -1.322 1.00 0.00 C ATOM 1361 O THR A 88 12.421 -18.618 -0.854 1.00 0.00 O ATOM 1362 CB THR A 88 11.600 -20.738 -2.322 1.00 0.00 C ATOM 1363 OG1 THR A 88 11.116 -21.596 -3.347 1.00 0.00 O ATOM 1364 CG2 THR A 88 11.688 -21.511 -1.006 1.00 0.00 C ATOM 0 H THR A 88 10.795 -19.410 -4.287 1.00 0.00 H new ATOM 0 HA THR A 88 9.735 -19.905 -1.669 1.00 0.00 H new ATOM 0 HB THR A 88 12.591 -20.372 -2.592 1.00 0.00 H new ATOM 0 HG1 THR A 88 11.728 -22.354 -3.455 1.00 0.00 H new ATOM 0 HG21 THR A 88 12.369 -22.354 -1.124 1.00 0.00 H new ATOM 0 HG22 THR A 88 12.059 -20.852 -0.221 1.00 0.00 H new ATOM 0 HG23 THR A 88 10.699 -21.879 -0.733 1.00 0.00 H new ATOM 1372 N SER A 89 10.650 -17.353 -1.174 1.00 0.00 N ATOM 1373 CA SER A 89 11.247 -16.226 -0.420 1.00 0.00 C ATOM 1374 C SER A 89 12.455 -15.739 -1.213 1.00 0.00 C ATOM 1375 O SER A 89 13.114 -14.797 -0.833 1.00 0.00 O ATOM 1376 CB SER A 89 11.660 -16.674 0.987 1.00 0.00 C ATOM 1377 OG SER A 89 11.692 -15.542 1.847 1.00 0.00 O ATOM 0 H SER A 89 9.717 -17.177 -1.547 1.00 0.00 H new ATOM 0 HA SER A 89 10.523 -15.420 -0.298 1.00 0.00 H new ATOM 0 HB2 SER A 89 10.956 -17.415 1.367 1.00 0.00 H new ATOM 0 HB3 SER A 89 12.640 -17.151 0.957 1.00 0.00 H new ATOM 0 HG SER A 89 11.954 -15.823 2.748 1.00 0.00 H new ATOM 1383 N TYR A 90 12.717 -16.367 -2.337 1.00 0.00 N ATOM 1384 CA TYR A 90 13.850 -15.960 -3.219 1.00 0.00 C ATOM 1385 C TYR A 90 15.075 -15.580 -2.383 1.00 0.00 C ATOM 1386 O TYR A 90 15.923 -16.401 -2.093 1.00 0.00 O ATOM 1387 CB TYR A 90 13.401 -14.774 -4.052 1.00 0.00 C ATOM 1388 CG TYR A 90 14.515 -14.208 -4.936 1.00 0.00 C ATOM 1389 CD1 TYR A 90 15.704 -14.926 -5.213 1.00 0.00 C ATOM 1390 CD2 TYR A 90 14.339 -12.935 -5.498 1.00 0.00 C ATOM 1391 CE1 TYR A 90 16.685 -14.361 -6.038 1.00 0.00 C ATOM 1392 CE2 TYR A 90 15.327 -12.379 -6.319 1.00 0.00 C ATOM 1393 CZ TYR A 90 16.497 -13.091 -6.589 1.00 0.00 C ATOM 1394 OH TYR A 90 17.468 -12.541 -7.400 1.00 0.00 O ATOM 0 H TYR A 90 12.179 -17.161 -2.683 1.00 0.00 H new ATOM 0 HA TYR A 90 14.130 -16.792 -3.865 1.00 0.00 H new ATOM 0 HB2 TYR A 90 12.563 -15.075 -4.681 1.00 0.00 H new ATOM 0 HB3 TYR A 90 13.036 -13.989 -3.390 1.00 0.00 H new ATOM 0 HD1 TYR A 90 15.854 -15.908 -4.789 1.00 0.00 H new ATOM 0 HD2 TYR A 90 13.435 -12.380 -5.296 1.00 0.00 H new ATOM 0 HE1 TYR A 90 17.591 -14.910 -6.249 1.00 0.00 H new ATOM 0 HE2 TYR A 90 15.184 -11.397 -6.745 1.00 0.00 H new ATOM 0 HH TYR A 90 17.179 -11.654 -7.701 1.00 0.00 H new ATOM 1404 N ASN A 91 15.126 -14.361 -1.925 1.00 0.00 N ATOM 1405 CA ASN A 91 16.244 -13.953 -1.025 1.00 0.00 C ATOM 1406 C ASN A 91 16.178 -12.438 -0.677 1.00 0.00 C ATOM 1407 O ASN A 91 16.509 -12.074 0.426 1.00 0.00 O ATOM 1408 CB ASN A 91 17.614 -14.356 -1.616 1.00 0.00 C ATOM 1409 CG ASN A 91 18.172 -15.589 -0.892 1.00 0.00 C ATOM 1410 OD1 ASN A 91 18.175 -16.678 -1.433 1.00 0.00 O ATOM 1411 ND2 ASN A 91 18.650 -15.460 0.316 1.00 0.00 N ATOM 0 H ASN A 91 14.445 -13.630 -2.133 1.00 0.00 H new ATOM 0 HA ASN A 91 16.127 -14.495 -0.086 1.00 0.00 H new ATOM 0 HB2 ASN A 91 17.509 -14.569 -2.680 1.00 0.00 H new ATOM 0 HB3 ASN A 91 18.314 -13.526 -1.524 1.00 0.00 H new ATOM 0 HD21 ASN A 91 19.026 -16.272 0.805 1.00 0.00 H new ATOM 0 HD22 ASN A 91 18.648 -14.547 0.770 1.00 0.00 H new ATOM 1418 N PRO A 92 15.752 -11.587 -1.582 1.00 0.00 N ATOM 1419 CA PRO A 92 15.638 -10.148 -1.268 1.00 0.00 C ATOM 1420 C PRO A 92 14.510 -9.934 -0.254 1.00 0.00 C ATOM 1421 O PRO A 92 14.716 -9.350 0.791 1.00 0.00 O ATOM 1422 CB PRO A 92 15.334 -9.477 -2.627 1.00 0.00 C ATOM 1423 CG PRO A 92 15.446 -10.590 -3.708 1.00 0.00 C ATOM 1424 CD PRO A 92 15.400 -11.936 -2.960 1.00 0.00 C ATOM 0 HA PRO A 92 16.537 -9.728 -0.817 1.00 0.00 H new ATOM 0 HB2 PRO A 92 14.337 -9.036 -2.627 1.00 0.00 H new ATOM 0 HB3 PRO A 92 16.039 -8.670 -2.827 1.00 0.00 H new ATOM 0 HG2 PRO A 92 14.628 -10.517 -4.425 1.00 0.00 H new ATOM 0 HG3 PRO A 92 16.374 -10.491 -4.271 1.00 0.00 H new ATOM 0 HD2 PRO A 92 14.411 -12.391 -3.017 1.00 0.00 H new ATOM 0 HD3 PRO A 92 16.105 -12.652 -3.383 1.00 0.00 H new ATOM 1432 N LEU A 93 13.323 -10.442 -0.540 1.00 0.00 N ATOM 1433 CA LEU A 93 12.199 -10.308 0.443 1.00 0.00 C ATOM 1434 C LEU A 93 12.758 -10.691 1.792 1.00 0.00 C ATOM 1435 O LEU A 93 12.738 -9.907 2.705 1.00 0.00 O ATOM 1436 CB LEU A 93 11.034 -11.257 0.097 1.00 0.00 C ATOM 1437 CG LEU A 93 10.766 -11.259 -1.425 1.00 0.00 C ATOM 1438 CD1 LEU A 93 11.509 -12.426 -2.083 1.00 0.00 C ATOM 1439 CD2 LEU A 93 9.260 -11.409 -1.694 1.00 0.00 C ATOM 0 H LEU A 93 13.092 -10.936 -1.402 1.00 0.00 H new ATOM 0 HA LEU A 93 11.812 -9.289 0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.270 -12.267 0.431 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.135 -10.947 0.629 1.00 0.00 H new ATOM 0 HG LEU A 93 11.119 -10.316 -1.843 1.00 0.00 H new ATOM 0 HD11 LEU A 93 11.316 -12.422 -3.156 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.580 -12.322 -1.907 1.00 0.00 H new ATOM 0 HD13 LEU A 93 11.161 -13.366 -1.655 1.00 0.00 H new ATOM 0 HD21 LEU A 93 9.081 -11.409 -2.769 1.00 0.00 H new ATOM 0 HD22 LEU A 93 8.906 -12.347 -1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 93 8.724 -10.577 -1.237 1.00 0.00 H new ATOM 1451 N ALA A 94 13.238 -11.916 1.853 1.00 0.00 N ATOM 1452 CA ALA A 94 13.865 -12.522 3.081 1.00 0.00 C ATOM 1453 C ALA A 94 13.925 -11.506 4.221 1.00 0.00 C ATOM 1454 O ALA A 94 13.472 -11.741 5.324 1.00 0.00 O ATOM 1455 CB ALA A 94 15.272 -12.933 2.683 1.00 0.00 C ATOM 0 H ALA A 94 13.219 -12.553 1.057 1.00 0.00 H new ATOM 0 HA ALA A 94 13.280 -13.371 3.434 1.00 0.00 H new ATOM 0 HB1 ALA A 94 15.776 -13.381 3.539 1.00 0.00 H new ATOM 0 HB2 ALA A 94 15.223 -13.658 1.871 1.00 0.00 H new ATOM 0 HB3 ALA A 94 15.828 -12.055 2.353 1.00 0.00 H new ATOM 1461 N GLY A 95 14.415 -10.339 3.904 1.00 0.00 N ATOM 1462 CA GLY A 95 14.443 -9.228 4.891 1.00 0.00 C ATOM 1463 C GLY A 95 12.977 -8.856 5.179 1.00 0.00 C ATOM 1464 O GLY A 95 12.096 -9.648 4.908 1.00 0.00 O ATOM 0 H GLY A 95 14.802 -10.107 2.989 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.951 -9.535 5.805 1.00 0.00 H new ATOM 0 HA3 GLY A 95 14.989 -8.372 4.495 1.00 0.00 H new ATOM 1468 N PRO A 96 12.726 -7.685 5.716 1.00 0.00 N ATOM 1469 CA PRO A 96 11.336 -7.281 6.004 1.00 0.00 C ATOM 1470 C PRO A 96 10.599 -7.011 4.676 1.00 0.00 C ATOM 1471 O PRO A 96 11.191 -7.104 3.619 1.00 0.00 O ATOM 1472 CB PRO A 96 11.470 -6.002 6.854 1.00 0.00 C ATOM 1473 CG PRO A 96 12.987 -5.626 6.886 1.00 0.00 C ATOM 1474 CD PRO A 96 13.758 -6.718 6.105 1.00 0.00 C ATOM 0 HA PRO A 96 10.761 -8.043 6.530 1.00 0.00 H new ATOM 0 HB2 PRO A 96 10.882 -5.191 6.425 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.094 -6.169 7.863 1.00 0.00 H new ATOM 0 HG2 PRO A 96 13.148 -4.647 6.435 1.00 0.00 H new ATOM 0 HG3 PRO A 96 13.345 -5.566 7.914 1.00 0.00 H new ATOM 0 HD2 PRO A 96 14.262 -6.302 5.233 1.00 0.00 H new ATOM 0 HD3 PRO A 96 14.525 -7.183 6.724 1.00 0.00 H new ATOM 1482 N LEU A 97 9.332 -6.659 4.695 1.00 0.00 N ATOM 1483 CA LEU A 97 8.641 -6.375 3.397 1.00 0.00 C ATOM 1484 C LEU A 97 9.114 -4.999 2.913 1.00 0.00 C ATOM 1485 O LEU A 97 9.538 -4.838 1.782 1.00 0.00 O ATOM 1486 CB LEU A 97 7.116 -6.393 3.583 1.00 0.00 C ATOM 1487 CG LEU A 97 6.725 -7.455 4.617 1.00 0.00 C ATOM 1488 CD1 LEU A 97 5.203 -7.484 4.764 1.00 0.00 C ATOM 1489 CD2 LEU A 97 7.215 -8.830 4.156 1.00 0.00 C ATOM 0 H LEU A 97 8.759 -6.558 5.533 1.00 0.00 H new ATOM 0 HA LEU A 97 8.886 -7.139 2.659 1.00 0.00 H new ATOM 0 HB2 LEU A 97 6.770 -5.412 3.909 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.628 -6.604 2.631 1.00 0.00 H new ATOM 0 HG LEU A 97 7.183 -7.210 5.576 1.00 0.00 H new ATOM 0 HD11 LEU A 97 4.923 -8.239 5.499 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.851 -6.507 5.095 1.00 0.00 H new ATOM 0 HD13 LEU A 97 4.749 -7.727 3.803 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.935 -9.582 4.894 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.760 -9.076 3.197 1.00 0.00 H new ATOM 0 HD23 LEU A 97 8.300 -8.813 4.049 1.00 0.00 H new ATOM 1501 N ARG A 98 9.000 -3.997 3.750 1.00 0.00 N ATOM 1502 CA ARG A 98 9.428 -2.614 3.367 1.00 0.00 C ATOM 1503 C ARG A 98 10.734 -2.695 2.549 1.00 0.00 C ATOM 1504 O ARG A 98 11.064 -1.822 1.781 1.00 0.00 O ATOM 1505 CB ARG A 98 9.670 -1.812 4.672 1.00 0.00 C ATOM 1506 CG ARG A 98 9.000 -0.437 4.589 1.00 0.00 C ATOM 1507 CD ARG A 98 9.189 0.309 5.911 1.00 0.00 C ATOM 1508 NE ARG A 98 8.632 -0.508 7.026 1.00 0.00 N ATOM 1509 CZ ARG A 98 8.937 -0.218 8.261 1.00 0.00 C ATOM 1510 NH1 ARG A 98 9.728 0.787 8.519 1.00 0.00 N ATOM 1511 NH2 ARG A 98 8.450 -0.933 9.238 1.00 0.00 N ATOM 0 H ARG A 98 8.624 -4.079 4.695 1.00 0.00 H new ATOM 0 HA ARG A 98 8.664 -2.125 2.762 1.00 0.00 H new ATOM 0 HB2 ARG A 98 9.275 -2.365 5.524 1.00 0.00 H new ATOM 0 HB3 ARG A 98 10.740 -1.692 4.839 1.00 0.00 H new ATOM 0 HG2 ARG A 98 9.431 0.139 3.770 1.00 0.00 H new ATOM 0 HG3 ARG A 98 7.938 -0.552 4.374 1.00 0.00 H new ATOM 0 HD2 ARG A 98 10.248 0.504 6.083 1.00 0.00 H new ATOM 0 HD3 ARG A 98 8.689 1.277 5.870 1.00 0.00 H new ATOM 0 HE ARG A 98 8.013 -1.293 6.824 1.00 0.00 H new ATOM 0 HH11 ARG A 98 10.108 1.346 7.755 1.00 0.00 H new ATOM 0 HH12 ARG A 98 9.966 1.014 9.485 1.00 0.00 H new ATOM 0 HH21 ARG A 98 7.831 -1.718 9.036 1.00 0.00 H new ATOM 0 HH22 ARG A 98 8.688 -0.707 10.204 1.00 0.00 H new ATOM 1525 N VAL A 99 11.443 -3.783 2.713 1.00 0.00 N ATOM 1526 CA VAL A 99 12.710 -3.994 1.954 1.00 0.00 C ATOM 1527 C VAL A 99 12.335 -4.487 0.550 1.00 0.00 C ATOM 1528 O VAL A 99 12.917 -4.084 -0.437 1.00 0.00 O ATOM 1529 CB VAL A 99 13.608 -5.026 2.706 1.00 0.00 C ATOM 1530 CG1 VAL A 99 14.315 -5.974 1.718 1.00 0.00 C ATOM 1531 CG2 VAL A 99 14.683 -4.293 3.536 1.00 0.00 C ATOM 0 H VAL A 99 11.194 -4.542 3.348 1.00 0.00 H new ATOM 0 HA VAL A 99 13.280 -3.069 1.871 1.00 0.00 H new ATOM 0 HB VAL A 99 12.959 -5.608 3.360 1.00 0.00 H new ATOM 0 HG11 VAL A 99 14.933 -6.681 2.271 1.00 0.00 H new ATOM 0 HG12 VAL A 99 13.569 -6.519 1.140 1.00 0.00 H new ATOM 0 HG13 VAL A 99 14.944 -5.393 1.043 1.00 0.00 H new ATOM 0 HG21 VAL A 99 15.303 -5.024 4.056 1.00 0.00 H new ATOM 0 HG22 VAL A 99 15.307 -3.693 2.874 1.00 0.00 H new ATOM 0 HG23 VAL A 99 14.199 -3.644 4.266 1.00 0.00 H new ATOM 1541 N GLN A 100 11.358 -5.349 0.464 1.00 0.00 N ATOM 1542 CA GLN A 100 10.919 -5.868 -0.865 1.00 0.00 C ATOM 1543 C GLN A 100 10.839 -4.724 -1.871 1.00 0.00 C ATOM 1544 O GLN A 100 11.458 -4.761 -2.916 1.00 0.00 O ATOM 1545 CB GLN A 100 9.521 -6.494 -0.753 1.00 0.00 C ATOM 1546 CG GLN A 100 9.600 -7.824 -0.011 1.00 0.00 C ATOM 1547 CD GLN A 100 8.202 -8.245 0.443 1.00 0.00 C ATOM 1548 OE1 GLN A 100 7.232 -7.562 0.178 1.00 0.00 O ATOM 1549 NE2 GLN A 100 8.056 -9.351 1.119 1.00 0.00 N ATOM 0 H GLN A 100 10.841 -5.719 1.262 1.00 0.00 H new ATOM 0 HA GLN A 100 11.642 -6.614 -1.194 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.851 -5.814 -0.227 1.00 0.00 H new ATOM 0 HB3 GLN A 100 9.102 -6.648 -1.748 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.028 -8.588 -0.660 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.260 -7.732 0.851 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.870 -9.924 1.341 1.00 0.00 H new ATOM 0 HE22 GLN A 100 7.128 -9.643 1.425 1.00 0.00 H new ATOM 1558 N ALA A 101 10.044 -3.722 -1.585 1.00 0.00 N ATOM 1559 CA ALA A 101 9.891 -2.594 -2.568 1.00 0.00 C ATOM 1560 C ALA A 101 10.921 -1.487 -2.318 1.00 0.00 C ATOM 1561 O ALA A 101 11.340 -0.824 -3.245 1.00 0.00 O ATOM 1562 CB ALA A 101 8.476 -2.022 -2.489 1.00 0.00 C ATOM 0 H ALA A 101 9.500 -3.632 -0.727 1.00 0.00 H new ATOM 0 HA ALA A 101 10.066 -2.993 -3.567 1.00 0.00 H new ATOM 0 HB1 ALA A 101 8.373 -1.206 -3.204 1.00 0.00 H new ATOM 0 HB2 ALA A 101 7.754 -2.804 -2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 101 8.290 -1.648 -1.482 1.00 0.00 H new ATOM 1568 N ASN A 102 11.361 -1.277 -1.115 1.00 0.00 N ATOM 1569 CA ASN A 102 12.383 -0.211 -0.911 1.00 0.00 C ATOM 1570 C ASN A 102 13.712 -0.710 -1.479 1.00 0.00 C ATOM 1571 O ASN A 102 14.760 -0.512 -0.897 1.00 0.00 O ATOM 1572 CB ASN A 102 12.548 0.099 0.578 1.00 0.00 C ATOM 1573 CG ASN A 102 13.459 1.316 0.747 1.00 0.00 C ATOM 1574 OD1 ASN A 102 13.167 2.383 0.243 1.00 0.00 O ATOM 1575 ND2 ASN A 102 14.559 1.201 1.440 1.00 0.00 N ATOM 0 H ASN A 102 11.069 -1.782 -0.278 1.00 0.00 H new ATOM 0 HA ASN A 102 12.066 0.701 -1.417 1.00 0.00 H new ATOM 0 HB2 ASN A 102 11.575 0.294 1.030 1.00 0.00 H new ATOM 0 HB3 ASN A 102 12.973 -0.761 1.095 1.00 0.00 H new ATOM 0 HD21 ASN A 102 15.174 2.006 1.559 1.00 0.00 H new ATOM 0 HD22 ASN A 102 14.804 0.306 1.863 1.00 0.00 H new ATOM 1582 N ASN A 103 13.672 -1.364 -2.618 1.00 0.00 N ATOM 1583 CA ASN A 103 14.922 -1.895 -3.245 1.00 0.00 C ATOM 1584 C ASN A 103 14.928 -1.535 -4.742 1.00 0.00 C ATOM 1585 O ASN A 103 14.574 -2.361 -5.561 1.00 0.00 O ATOM 1586 CB ASN A 103 14.936 -3.419 -3.106 1.00 0.00 C ATOM 1587 CG ASN A 103 16.273 -3.963 -3.613 1.00 0.00 C ATOM 1588 OD1 ASN A 103 17.033 -3.253 -4.241 1.00 0.00 O ATOM 1589 ND2 ASN A 103 16.595 -5.204 -3.366 1.00 0.00 N ATOM 0 H ASN A 103 12.818 -1.553 -3.143 1.00 0.00 H new ATOM 0 HA ASN A 103 15.795 -1.463 -2.755 1.00 0.00 H new ATOM 0 HB2 ASN A 103 14.788 -3.702 -2.064 1.00 0.00 H new ATOM 0 HB3 ASN A 103 14.114 -3.855 -3.675 1.00 0.00 H new ATOM 0 HD21 ASN A 103 17.484 -5.576 -3.700 1.00 0.00 H new ATOM 0 HD22 ASN A 103 15.958 -5.801 -2.839 1.00 0.00 H new ATOM 1596 N PRO A 104 15.316 -0.318 -5.073 1.00 0.00 N ATOM 1597 CA PRO A 104 15.345 0.122 -6.483 1.00 0.00 C ATOM 1598 C PRO A 104 16.180 -0.847 -7.332 1.00 0.00 C ATOM 1599 O PRO A 104 15.975 -0.966 -8.524 1.00 0.00 O ATOM 1600 CB PRO A 104 15.966 1.539 -6.443 1.00 0.00 C ATOM 1601 CG PRO A 104 16.042 1.963 -4.949 1.00 0.00 C ATOM 1602 CD PRO A 104 15.757 0.706 -4.098 1.00 0.00 C ATOM 0 HA PRO A 104 14.355 0.136 -6.940 1.00 0.00 H new ATOM 0 HB2 PRO A 104 16.958 1.537 -6.894 1.00 0.00 H new ATOM 0 HB3 PRO A 104 15.358 2.242 -7.012 1.00 0.00 H new ATOM 0 HG2 PRO A 104 17.026 2.370 -4.715 1.00 0.00 H new ATOM 0 HG3 PRO A 104 15.314 2.745 -4.734 1.00 0.00 H new ATOM 0 HD2 PRO A 104 16.648 0.382 -3.560 1.00 0.00 H new ATOM 0 HD3 PRO A 104 14.986 0.900 -3.352 1.00 0.00 H new ATOM 1610 N GLN A 105 17.111 -1.541 -6.742 1.00 0.00 N ATOM 1611 CA GLN A 105 17.934 -2.493 -7.540 1.00 0.00 C ATOM 1612 C GLN A 105 17.082 -3.707 -7.925 1.00 0.00 C ATOM 1613 O GLN A 105 17.177 -4.216 -9.024 1.00 0.00 O ATOM 1614 CB GLN A 105 19.135 -2.952 -6.711 1.00 0.00 C ATOM 1615 CG GLN A 105 19.932 -1.731 -6.249 1.00 0.00 C ATOM 1616 CD GLN A 105 21.227 -2.191 -5.577 1.00 0.00 C ATOM 1617 OE1 GLN A 105 21.649 -3.317 -5.751 1.00 0.00 O ATOM 1618 NE2 GLN A 105 21.881 -1.361 -4.812 1.00 0.00 N ATOM 0 H GLN A 105 17.338 -1.492 -5.749 1.00 0.00 H new ATOM 0 HA GLN A 105 18.288 -1.997 -8.444 1.00 0.00 H new ATOM 0 HB2 GLN A 105 18.797 -3.527 -5.849 1.00 0.00 H new ATOM 0 HB3 GLN A 105 19.769 -3.611 -7.304 1.00 0.00 H new ATOM 0 HG2 GLN A 105 20.160 -1.089 -7.100 1.00 0.00 H new ATOM 0 HG3 GLN A 105 19.339 -1.139 -5.552 1.00 0.00 H new ATOM 0 HE21 GLN A 105 21.527 -0.416 -4.666 1.00 0.00 H new ATOM 0 HE22 GLN A 105 22.746 -1.657 -4.360 1.00 0.00 H new ATOM 1627 N GLN A 106 16.250 -4.173 -7.025 1.00 0.00 N ATOM 1628 CA GLN A 106 15.381 -5.359 -7.321 1.00 0.00 C ATOM 1629 C GLN A 106 13.924 -4.907 -7.454 1.00 0.00 C ATOM 1630 O GLN A 106 13.015 -5.581 -7.011 1.00 0.00 O ATOM 1631 CB GLN A 106 15.490 -6.362 -6.170 1.00 0.00 C ATOM 1632 CG GLN A 106 16.958 -6.728 -5.947 1.00 0.00 C ATOM 1633 CD GLN A 106 17.475 -7.522 -7.148 1.00 0.00 C ATOM 1634 OE1 GLN A 106 17.060 -8.641 -7.375 1.00 0.00 O ATOM 1635 NE2 GLN A 106 18.370 -6.986 -7.932 1.00 0.00 N ATOM 0 H GLN A 106 16.134 -3.781 -6.091 1.00 0.00 H new ATOM 0 HA GLN A 106 15.706 -5.824 -8.252 1.00 0.00 H new ATOM 0 HB2 GLN A 106 15.069 -5.934 -5.260 1.00 0.00 H new ATOM 0 HB3 GLN A 106 14.912 -7.257 -6.398 1.00 0.00 H new ATOM 0 HG2 GLN A 106 17.552 -5.824 -5.812 1.00 0.00 H new ATOM 0 HG3 GLN A 106 17.062 -7.317 -5.036 1.00 0.00 H new ATOM 0 HE21 GLN A 106 18.718 -6.046 -7.741 1.00 0.00 H new ATOM 0 HE22 GLN A 106 18.721 -7.507 -8.736 1.00 0.00 H new ATOM 1644 N GLN A 107 13.696 -3.762 -8.039 1.00 0.00 N ATOM 1645 CA GLN A 107 12.301 -3.249 -8.184 1.00 0.00 C ATOM 1646 C GLN A 107 11.348 -4.362 -8.644 1.00 0.00 C ATOM 1647 O GLN A 107 10.145 -4.219 -8.565 1.00 0.00 O ATOM 1648 CB GLN A 107 12.278 -2.106 -9.206 1.00 0.00 C ATOM 1649 CG GLN A 107 12.896 -2.568 -10.532 1.00 0.00 C ATOM 1650 CD GLN A 107 11.890 -3.428 -11.301 1.00 0.00 C ATOM 1651 OE1 GLN A 107 12.107 -4.608 -11.497 1.00 0.00 O ATOM 1652 NE2 GLN A 107 10.792 -2.884 -11.748 1.00 0.00 N ATOM 0 H GLN A 107 14.420 -3.156 -8.425 1.00 0.00 H new ATOM 0 HA GLN A 107 11.967 -2.888 -7.211 1.00 0.00 H new ATOM 0 HB2 GLN A 107 11.252 -1.776 -9.370 1.00 0.00 H new ATOM 0 HB3 GLN A 107 12.830 -1.250 -8.818 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.182 -1.704 -11.131 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.805 -3.138 -10.341 1.00 0.00 H new ATOM 0 HE21 GLN A 107 10.610 -1.894 -11.584 1.00 0.00 H new ATOM 0 HE22 GLN A 107 10.116 -3.449 -12.262 1.00 0.00 H new ATOM 1661 N GLY A 108 11.852 -5.473 -9.111 1.00 0.00 N ATOM 1662 CA GLY A 108 10.928 -6.567 -9.544 1.00 0.00 C ATOM 1663 C GLY A 108 9.948 -6.843 -8.401 1.00 0.00 C ATOM 1664 O GLY A 108 8.768 -7.047 -8.598 1.00 0.00 O ATOM 0 H GLY A 108 12.847 -5.671 -9.211 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.389 -6.275 -10.445 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.492 -7.467 -9.787 1.00 0.00 H new ATOM 1668 N LEU A 109 10.454 -6.838 -7.206 1.00 0.00 N ATOM 1669 CA LEU A 109 9.598 -7.082 -6.013 1.00 0.00 C ATOM 1670 C LEU A 109 8.832 -5.806 -5.656 1.00 0.00 C ATOM 1671 O LEU A 109 8.079 -5.778 -4.705 1.00 0.00 O ATOM 1672 CB LEU A 109 10.473 -7.511 -4.840 1.00 0.00 C ATOM 1673 CG LEU A 109 11.048 -8.912 -5.112 1.00 0.00 C ATOM 1674 CD1 LEU A 109 12.231 -9.167 -4.168 1.00 0.00 C ATOM 1675 CD2 LEU A 109 9.963 -9.996 -4.909 1.00 0.00 C ATOM 0 H LEU A 109 11.439 -6.673 -6.999 1.00 0.00 H new ATOM 0 HA LEU A 109 8.882 -7.873 -6.235 1.00 0.00 H new ATOM 0 HB2 LEU A 109 11.283 -6.796 -4.696 1.00 0.00 H new ATOM 0 HB3 LEU A 109 9.888 -7.519 -3.920 1.00 0.00 H new ATOM 0 HG LEU A 109 11.389 -8.961 -6.146 1.00 0.00 H new ATOM 0 HD11 LEU A 109 12.641 -10.159 -4.358 1.00 0.00 H new ATOM 0 HD12 LEU A 109 13.002 -8.416 -4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 109 11.891 -9.107 -3.134 1.00 0.00 H new ATOM 0 HD21 LEU A 109 10.390 -10.979 -5.106 1.00 0.00 H new ATOM 0 HD22 LEU A 109 9.598 -9.958 -3.883 1.00 0.00 H new ATOM 0 HD23 LEU A 109 9.135 -9.815 -5.595 1.00 0.00 H new ATOM 1687 N ARG A 110 8.983 -4.761 -6.428 1.00 0.00 N ATOM 1688 CA ARG A 110 8.222 -3.502 -6.149 1.00 0.00 C ATOM 1689 C ARG A 110 6.977 -3.494 -7.036 1.00 0.00 C ATOM 1690 O ARG A 110 5.933 -3.005 -6.646 1.00 0.00 O ATOM 1691 CB ARG A 110 9.084 -2.270 -6.442 1.00 0.00 C ATOM 1692 CG ARG A 110 8.255 -1.002 -6.220 1.00 0.00 C ATOM 1693 CD ARG A 110 9.174 0.221 -6.248 1.00 0.00 C ATOM 1694 NE ARG A 110 9.858 0.297 -7.570 1.00 0.00 N ATOM 1695 CZ ARG A 110 10.454 1.400 -7.935 1.00 0.00 C ATOM 1696 NH1 ARG A 110 10.452 2.435 -7.141 1.00 0.00 N ATOM 1697 NH2 ARG A 110 11.051 1.466 -9.093 1.00 0.00 N ATOM 0 H ARG A 110 9.600 -4.723 -7.240 1.00 0.00 H new ATOM 0 HA ARG A 110 7.940 -3.468 -5.097 1.00 0.00 H new ATOM 0 HB2 ARG A 110 9.960 -2.263 -5.793 1.00 0.00 H new ATOM 0 HB3 ARG A 110 9.448 -2.304 -7.469 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.492 -0.914 -6.993 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.735 -1.058 -5.264 1.00 0.00 H new ATOM 0 HD2 ARG A 110 8.596 1.128 -6.073 1.00 0.00 H new ATOM 0 HD3 ARG A 110 9.911 0.154 -5.448 1.00 0.00 H new ATOM 0 HE ARG A 110 9.861 -0.513 -8.190 1.00 0.00 H new ATOM 0 HH11 ARG A 110 9.985 2.382 -6.236 1.00 0.00 H new ATOM 0 HH12 ARG A 110 10.917 3.297 -7.425 1.00 0.00 H new ATOM 0 HH21 ARG A 110 11.052 0.656 -9.713 1.00 0.00 H new ATOM 0 HH22 ARG A 110 11.517 2.327 -9.378 1.00 0.00 H new ATOM 1711 N ARG A 111 7.051 -4.079 -8.201 1.00 0.00 N ATOM 1712 CA ARG A 111 5.841 -4.146 -9.073 1.00 0.00 C ATOM 1713 C ARG A 111 5.064 -5.405 -8.684 1.00 0.00 C ATOM 1714 O ARG A 111 3.851 -5.446 -8.754 1.00 0.00 O ATOM 1715 CB ARG A 111 6.238 -4.179 -10.560 1.00 0.00 C ATOM 1716 CG ARG A 111 7.234 -5.327 -10.836 1.00 0.00 C ATOM 1717 CD ARG A 111 6.510 -6.690 -11.021 1.00 0.00 C ATOM 1718 NE ARG A 111 6.910 -7.321 -12.326 1.00 0.00 N ATOM 1719 CZ ARG A 111 6.809 -6.679 -13.462 1.00 0.00 C ATOM 1720 NH1 ARG A 111 6.283 -5.486 -13.502 1.00 0.00 N ATOM 1721 NH2 ARG A 111 7.217 -7.245 -14.565 1.00 0.00 N ATOM 0 H ARG A 111 7.891 -4.511 -8.586 1.00 0.00 H new ATOM 0 HA ARG A 111 5.221 -3.261 -8.932 1.00 0.00 H new ATOM 0 HB2 ARG A 111 5.348 -4.308 -11.176 1.00 0.00 H new ATOM 0 HB3 ARG A 111 6.686 -3.227 -10.843 1.00 0.00 H new ATOM 0 HG2 ARG A 111 7.812 -5.099 -11.731 1.00 0.00 H new ATOM 0 HG3 ARG A 111 7.941 -5.401 -10.010 1.00 0.00 H new ATOM 0 HD2 ARG A 111 6.759 -7.357 -10.195 1.00 0.00 H new ATOM 0 HD3 ARG A 111 5.430 -6.542 -10.997 1.00 0.00 H new ATOM 0 HE ARG A 111 7.270 -8.275 -12.326 1.00 0.00 H new ATOM 0 HH11 ARG A 111 5.947 -5.048 -12.644 1.00 0.00 H new ATOM 0 HH12 ARG A 111 6.207 -4.991 -14.391 1.00 0.00 H new ATOM 0 HH21 ARG A 111 7.613 -8.185 -14.540 1.00 0.00 H new ATOM 0 HH22 ARG A 111 7.140 -6.748 -15.452 1.00 0.00 H new ATOM 1735 N GLU A 112 5.753 -6.419 -8.229 1.00 0.00 N ATOM 1736 CA GLU A 112 5.047 -7.654 -7.790 1.00 0.00 C ATOM 1737 C GLU A 112 4.352 -7.344 -6.469 1.00 0.00 C ATOM 1738 O GLU A 112 3.168 -7.551 -6.312 1.00 0.00 O ATOM 1739 CB GLU A 112 6.057 -8.791 -7.586 1.00 0.00 C ATOM 1740 CG GLU A 112 5.319 -10.104 -7.290 1.00 0.00 C ATOM 1741 CD GLU A 112 4.724 -10.659 -8.586 1.00 0.00 C ATOM 1742 OE1 GLU A 112 5.402 -10.599 -9.599 1.00 0.00 O ATOM 1743 OE2 GLU A 112 3.602 -11.135 -8.544 1.00 0.00 O ATOM 0 H GLU A 112 6.769 -6.444 -8.144 1.00 0.00 H new ATOM 0 HA GLU A 112 4.324 -7.966 -8.543 1.00 0.00 H new ATOM 0 HB2 GLU A 112 6.674 -8.904 -8.477 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.728 -8.548 -6.762 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.006 -10.829 -6.853 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.529 -9.933 -6.559 1.00 0.00 H new ATOM 1750 N TYR A 113 5.088 -6.831 -5.520 1.00 0.00 N ATOM 1751 CA TYR A 113 4.475 -6.484 -4.205 1.00 0.00 C ATOM 1752 C TYR A 113 3.162 -5.739 -4.458 1.00 0.00 C ATOM 1753 O TYR A 113 2.097 -6.209 -4.110 1.00 0.00 O ATOM 1754 CB TYR A 113 5.431 -5.593 -3.408 1.00 0.00 C ATOM 1755 CG TYR A 113 4.778 -5.179 -2.110 1.00 0.00 C ATOM 1756 CD1 TYR A 113 4.822 -6.035 -1.003 1.00 0.00 C ATOM 1757 CD2 TYR A 113 4.134 -3.940 -2.013 1.00 0.00 C ATOM 1758 CE1 TYR A 113 4.222 -5.651 0.203 1.00 0.00 C ATOM 1759 CE2 TYR A 113 3.533 -3.557 -0.807 1.00 0.00 C ATOM 1760 CZ TYR A 113 3.578 -4.412 0.300 1.00 0.00 C ATOM 1761 OH TYR A 113 2.988 -4.033 1.489 1.00 0.00 O ATOM 0 H TYR A 113 6.086 -6.637 -5.598 1.00 0.00 H new ATOM 0 HA TYR A 113 4.282 -7.392 -3.634 1.00 0.00 H new ATOM 0 HB2 TYR A 113 6.359 -6.128 -3.205 1.00 0.00 H new ATOM 0 HB3 TYR A 113 5.693 -4.711 -3.992 1.00 0.00 H new ATOM 0 HD1 TYR A 113 5.318 -6.991 -1.079 1.00 0.00 H new ATOM 0 HD2 TYR A 113 4.100 -3.280 -2.867 1.00 0.00 H new ATOM 0 HE1 TYR A 113 4.256 -6.311 1.058 1.00 0.00 H new ATOM 0 HE2 TYR A 113 3.035 -2.602 -0.731 1.00 0.00 H new ATOM 0 HH TYR A 113 2.113 -3.632 1.307 1.00 0.00 H new ATOM 1771 N GLN A 114 3.234 -4.576 -5.053 1.00 0.00 N ATOM 1772 CA GLN A 114 1.998 -3.783 -5.327 1.00 0.00 C ATOM 1773 C GLN A 114 0.857 -4.689 -5.814 1.00 0.00 C ATOM 1774 O GLN A 114 -0.283 -4.517 -5.435 1.00 0.00 O ATOM 1775 CB GLN A 114 2.302 -2.740 -6.404 1.00 0.00 C ATOM 1776 CG GLN A 114 3.259 -1.688 -5.840 1.00 0.00 C ATOM 1777 CD GLN A 114 3.758 -0.791 -6.974 1.00 0.00 C ATOM 1778 OE1 GLN A 114 4.894 -0.360 -6.968 1.00 0.00 O ATOM 1779 NE2 GLN A 114 2.952 -0.488 -7.954 1.00 0.00 N ATOM 0 H GLN A 114 4.102 -4.139 -5.363 1.00 0.00 H new ATOM 0 HA GLN A 114 1.685 -3.298 -4.402 1.00 0.00 H new ATOM 0 HB2 GLN A 114 2.746 -3.221 -7.276 1.00 0.00 H new ATOM 0 HB3 GLN A 114 1.379 -2.266 -6.737 1.00 0.00 H new ATOM 0 HG2 GLN A 114 2.752 -1.088 -5.084 1.00 0.00 H new ATOM 0 HG3 GLN A 114 4.102 -2.174 -5.349 1.00 0.00 H new ATOM 0 HE21 GLN A 114 1.998 -0.849 -7.960 1.00 0.00 H new ATOM 0 HE22 GLN A 114 3.276 0.110 -8.714 1.00 0.00 H new ATOM 1788 N GLN A 115 1.146 -5.640 -6.659 1.00 0.00 N ATOM 1789 CA GLN A 115 0.059 -6.530 -7.171 1.00 0.00 C ATOM 1790 C GLN A 115 -0.529 -7.361 -6.026 1.00 0.00 C ATOM 1791 O GLN A 115 -1.728 -7.556 -5.944 1.00 0.00 O ATOM 1792 CB GLN A 115 0.613 -7.466 -8.250 1.00 0.00 C ATOM 1793 CG GLN A 115 0.941 -6.657 -9.507 1.00 0.00 C ATOM 1794 CD GLN A 115 1.664 -7.551 -10.515 1.00 0.00 C ATOM 1795 OE1 GLN A 115 2.873 -7.503 -10.630 1.00 0.00 O ATOM 1796 NE2 GLN A 115 0.971 -8.372 -11.257 1.00 0.00 N ATOM 0 H GLN A 115 2.080 -5.841 -7.017 1.00 0.00 H new ATOM 0 HA GLN A 115 -0.726 -5.908 -7.601 1.00 0.00 H new ATOM 0 HB2 GLN A 115 1.508 -7.970 -7.885 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -0.117 -8.241 -8.484 1.00 0.00 H new ATOM 0 HG2 GLN A 115 0.026 -6.261 -9.947 1.00 0.00 H new ATOM 0 HG3 GLN A 115 1.566 -5.802 -9.249 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -0.044 -8.413 -11.161 1.00 0.00 H new ATOM 0 HE22 GLN A 115 1.444 -8.972 -11.932 1.00 0.00 H new ATOM 1805 N LEU A 116 0.291 -7.834 -5.128 1.00 0.00 N ATOM 1806 CA LEU A 116 -0.238 -8.631 -3.987 1.00 0.00 C ATOM 1807 C LEU A 116 -0.743 -7.665 -2.911 1.00 0.00 C ATOM 1808 O LEU A 116 -1.536 -8.019 -2.057 1.00 0.00 O ATOM 1809 CB LEU A 116 0.882 -9.508 -3.412 1.00 0.00 C ATOM 1810 CG LEU A 116 1.086 -10.743 -4.298 1.00 0.00 C ATOM 1811 CD1 LEU A 116 1.659 -10.327 -5.655 1.00 0.00 C ATOM 1812 CD2 LEU A 116 2.062 -11.703 -3.612 1.00 0.00 C ATOM 0 H LEU A 116 1.303 -7.703 -5.135 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.053 -9.272 -4.322 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.808 -8.936 -3.351 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.630 -9.816 -2.397 1.00 0.00 H new ATOM 0 HG LEU A 116 0.125 -11.235 -4.450 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.800 -11.211 -6.277 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.968 -9.643 -6.148 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.618 -9.830 -5.508 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.209 -12.582 -4.239 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.018 -11.202 -3.459 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.655 -12.009 -2.648 1.00 0.00 H new ATOM 1824 N TRP A 117 -0.292 -6.442 -2.960 1.00 0.00 N ATOM 1825 CA TRP A 117 -0.733 -5.432 -1.960 1.00 0.00 C ATOM 1826 C TRP A 117 -2.088 -4.851 -2.376 1.00 0.00 C ATOM 1827 O TRP A 117 -2.957 -4.627 -1.552 1.00 0.00 O ATOM 1828 CB TRP A 117 0.304 -4.307 -1.894 1.00 0.00 C ATOM 1829 CG TRP A 117 0.124 -3.528 -0.629 1.00 0.00 C ATOM 1830 CD1 TRP A 117 0.466 -3.963 0.604 1.00 0.00 C ATOM 1831 CD2 TRP A 117 -0.435 -2.194 -0.452 1.00 0.00 C ATOM 1832 NE1 TRP A 117 0.155 -2.981 1.527 1.00 0.00 N ATOM 1833 CE2 TRP A 117 -0.403 -1.871 0.925 1.00 0.00 C ATOM 1834 CE3 TRP A 117 -0.960 -1.242 -1.344 1.00 0.00 C ATOM 1835 CZ2 TRP A 117 -0.876 -0.648 1.401 1.00 0.00 C ATOM 1836 CZ3 TRP A 117 -1.438 -0.010 -0.869 1.00 0.00 C ATOM 1837 CH2 TRP A 117 -1.396 0.286 0.501 1.00 0.00 C ATOM 0 H TRP A 117 0.369 -6.097 -3.656 1.00 0.00 H new ATOM 0 HA TRP A 117 -0.830 -5.904 -0.982 1.00 0.00 H new ATOM 0 HB2 TRP A 117 1.310 -4.724 -1.935 1.00 0.00 H new ATOM 0 HB3 TRP A 117 0.196 -3.649 -2.756 1.00 0.00 H new ATOM 0 HD1 TRP A 117 0.910 -4.921 0.831 1.00 0.00 H new ATOM 0 HE1 TRP A 117 0.318 -3.067 2.530 1.00 0.00 H new ATOM 0 HE3 TRP A 117 -0.996 -1.460 -2.401 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -0.841 -0.425 2.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 -1.840 0.714 -1.563 1.00 0.00 H new ATOM 0 HH2 TRP A 117 -1.765 1.235 0.860 1.00 0.00 H new ATOM 1848 N LEU A 118 -2.307 -4.645 -3.648 1.00 0.00 N ATOM 1849 CA LEU A 118 -3.624 -4.118 -4.089 1.00 0.00 C ATOM 1850 C LEU A 118 -4.672 -5.198 -3.846 1.00 0.00 C ATOM 1851 O LEU A 118 -5.784 -4.899 -3.461 1.00 0.00 O ATOM 1852 CB LEU A 118 -3.570 -3.714 -5.564 1.00 0.00 C ATOM 1853 CG LEU A 118 -2.678 -2.465 -5.725 1.00 0.00 C ATOM 1854 CD1 LEU A 118 -2.507 -2.142 -7.217 1.00 0.00 C ATOM 1855 CD2 LEU A 118 -3.307 -1.252 -4.997 1.00 0.00 C ATOM 0 H LEU A 118 -1.633 -4.819 -4.394 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.886 -3.225 -3.522 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.175 -4.535 -6.162 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.575 -3.506 -5.932 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.704 -2.671 -5.282 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.877 -1.260 -7.328 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.040 -2.988 -7.721 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.483 -1.949 -7.662 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.665 -0.380 -5.121 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.289 -1.042 -5.421 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.411 -1.478 -3.936 1.00 0.00 H new ATOM 1867 N ALA A 119 -4.330 -6.454 -3.970 1.00 0.00 N ATOM 1868 CA ALA A 119 -5.337 -7.495 -3.625 1.00 0.00 C ATOM 1869 C ALA A 119 -5.728 -7.222 -2.173 1.00 0.00 C ATOM 1870 O ALA A 119 -6.815 -6.744 -1.918 1.00 0.00 O ATOM 1871 CB ALA A 119 -4.747 -8.899 -3.775 1.00 0.00 C ATOM 0 H ALA A 119 -3.423 -6.796 -4.286 1.00 0.00 H new ATOM 0 HA ALA A 119 -6.200 -7.453 -4.289 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -5.503 -9.641 -3.517 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -4.427 -9.051 -4.806 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.891 -9.007 -3.109 1.00 0.00 H new ATOM 1877 N ALA A 120 -4.890 -7.509 -1.215 1.00 0.00 N ATOM 1878 CA ALA A 120 -5.275 -7.230 0.200 1.00 0.00 C ATOM 1879 C ALA A 120 -5.852 -5.810 0.349 1.00 0.00 C ATOM 1880 O ALA A 120 -6.296 -5.457 1.416 1.00 0.00 O ATOM 1881 CB ALA A 120 -4.052 -7.355 1.107 1.00 0.00 C ATOM 0 H ALA A 120 -3.966 -7.920 -1.346 1.00 0.00 H new ATOM 0 HA ALA A 120 -6.035 -7.957 0.486 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -4.341 -7.150 2.138 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.649 -8.365 1.037 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -3.292 -6.639 0.794 1.00 0.00 H new ATOM 1887 N PHE A 121 -5.861 -4.996 -0.696 1.00 0.00 N ATOM 1888 CA PHE A 121 -6.446 -3.609 -0.585 1.00 0.00 C ATOM 1889 C PHE A 121 -7.750 -3.519 -1.407 1.00 0.00 C ATOM 1890 O PHE A 121 -8.621 -2.728 -1.106 1.00 0.00 O ATOM 1891 CB PHE A 121 -5.431 -2.565 -1.093 1.00 0.00 C ATOM 1892 CG PHE A 121 -5.614 -1.256 -0.350 1.00 0.00 C ATOM 1893 CD1 PHE A 121 -6.709 -0.434 -0.640 1.00 0.00 C ATOM 1894 CD2 PHE A 121 -4.691 -0.872 0.632 1.00 0.00 C ATOM 1895 CE1 PHE A 121 -6.881 0.772 0.050 1.00 0.00 C ATOM 1896 CE2 PHE A 121 -4.864 0.333 1.322 1.00 0.00 C ATOM 1897 CZ PHE A 121 -5.959 1.155 1.031 1.00 0.00 C ATOM 0 H PHE A 121 -5.490 -5.233 -1.616 1.00 0.00 H new ATOM 0 HA PHE A 121 -6.671 -3.404 0.462 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -4.415 -2.934 -0.950 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -5.565 -2.407 -2.163 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -7.421 -0.730 -1.396 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -3.846 -1.506 0.856 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -7.725 1.407 -0.175 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -4.153 0.629 2.079 1.00 0.00 H new ATOM 0 HZ PHE A 121 -6.092 2.085 1.564 1.00 0.00 H new ATOM 1907 N ALA A 122 -7.899 -4.323 -2.432 1.00 0.00 N ATOM 1908 CA ALA A 122 -9.158 -4.281 -3.257 1.00 0.00 C ATOM 1909 C ALA A 122 -10.099 -5.397 -2.817 1.00 0.00 C ATOM 1910 O ALA A 122 -11.302 -5.259 -2.915 1.00 0.00 O ATOM 1911 CB ALA A 122 -8.841 -4.426 -4.744 1.00 0.00 C ATOM 0 H ALA A 122 -7.207 -5.007 -2.736 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.640 -3.316 -3.102 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -9.767 -4.393 -5.318 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -8.189 -3.611 -5.058 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.340 -5.378 -4.918 1.00 0.00 H new ATOM 1917 N ALA A 123 -9.603 -6.461 -2.276 1.00 0.00 N ATOM 1918 CA ALA A 123 -10.528 -7.514 -1.774 1.00 0.00 C ATOM 1919 C ALA A 123 -10.835 -7.147 -0.326 1.00 0.00 C ATOM 1920 O ALA A 123 -11.204 -7.973 0.480 1.00 0.00 O ATOM 1921 CB ALA A 123 -9.847 -8.884 -1.833 1.00 0.00 C ATOM 0 H ALA A 123 -8.608 -6.653 -2.157 1.00 0.00 H new ATOM 0 HA ALA A 123 -11.435 -7.570 -2.376 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -10.532 -9.647 -1.464 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -9.573 -9.110 -2.864 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -8.950 -8.871 -1.214 1.00 0.00 H new ATOM 1927 N LEU A 124 -10.606 -5.901 0.014 1.00 0.00 N ATOM 1928 CA LEU A 124 -10.794 -5.457 1.418 1.00 0.00 C ATOM 1929 C LEU A 124 -12.263 -5.597 1.901 1.00 0.00 C ATOM 1930 O LEU A 124 -12.497 -6.107 2.979 1.00 0.00 O ATOM 1931 CB LEU A 124 -10.342 -3.980 1.548 1.00 0.00 C ATOM 1932 CG LEU A 124 -8.971 -3.895 2.239 1.00 0.00 C ATOM 1933 CD1 LEU A 124 -8.437 -2.458 2.158 1.00 0.00 C ATOM 1934 CD2 LEU A 124 -9.068 -4.344 3.719 1.00 0.00 C ATOM 0 H LEU A 124 -10.295 -5.173 -0.630 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.187 -6.105 2.051 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -10.287 -3.522 0.560 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -11.080 -3.417 2.120 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.283 -4.566 1.725 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.465 -2.403 2.649 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -8.332 -2.167 1.113 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.133 -1.782 2.655 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -8.085 -4.275 4.185 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -9.768 -3.699 4.250 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -9.419 -5.375 3.764 1.00 0.00 H new ATOM 1946 N PRO A 125 -13.221 -5.083 1.114 1.00 0.00 N ATOM 1947 CA PRO A 125 -14.646 -5.097 1.505 1.00 0.00 C ATOM 1948 C PRO A 125 -14.985 -6.407 2.173 1.00 0.00 C ATOM 1949 O PRO A 125 -15.343 -6.449 3.333 1.00 0.00 O ATOM 1950 CB PRO A 125 -15.416 -4.880 0.189 1.00 0.00 C ATOM 1951 CG PRO A 125 -14.396 -4.302 -0.829 1.00 0.00 C ATOM 1952 CD PRO A 125 -12.985 -4.491 -0.225 1.00 0.00 C ATOM 0 HA PRO A 125 -14.903 -4.326 2.231 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -15.837 -5.818 -0.173 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -16.249 -4.193 0.336 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -14.476 -4.816 -1.787 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.596 -3.247 -1.016 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -12.374 -5.147 -0.845 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.457 -3.541 -0.150 1.00 0.00 H new ATOM 1960 N GLY A 126 -14.869 -7.476 1.458 1.00 0.00 N ATOM 1961 CA GLY A 126 -15.180 -8.796 2.055 1.00 0.00 C ATOM 1962 C GLY A 126 -13.890 -9.465 2.525 1.00 0.00 C ATOM 1963 O GLY A 126 -13.509 -10.498 2.014 1.00 0.00 O ATOM 0 H GLY A 126 -14.572 -7.497 0.483 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -15.865 -8.674 2.894 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -15.683 -9.428 1.323 1.00 0.00 H new ATOM 1967 N SER A 127 -13.278 -8.940 3.573 1.00 0.00 N ATOM 1968 CA SER A 127 -12.072 -9.640 4.144 1.00 0.00 C ATOM 1969 C SER A 127 -11.222 -8.789 5.120 1.00 0.00 C ATOM 1970 O SER A 127 -10.359 -9.346 5.770 1.00 0.00 O ATOM 1971 CB SER A 127 -11.177 -10.189 3.017 1.00 0.00 C ATOM 1972 OG SER A 127 -11.533 -11.540 2.756 1.00 0.00 O ATOM 0 H SER A 127 -13.554 -8.079 4.046 1.00 0.00 H new ATOM 0 HA SER A 127 -12.481 -10.456 4.740 1.00 0.00 H new ATOM 0 HB2 SER A 127 -11.296 -9.588 2.116 1.00 0.00 H new ATOM 0 HB3 SER A 127 -10.128 -10.126 3.306 1.00 0.00 H new ATOM 0 HG SER A 127 -12.500 -11.601 2.608 1.00 0.00 H new ATOM 1978 N ALA A 128 -11.408 -7.493 5.277 1.00 0.00 N ATOM 1979 CA ALA A 128 -10.512 -6.792 6.269 1.00 0.00 C ATOM 1980 C ALA A 128 -10.743 -5.261 6.339 1.00 0.00 C ATOM 1981 O ALA A 128 -9.807 -4.500 6.491 1.00 0.00 O ATOM 1982 CB ALA A 128 -9.042 -7.101 5.894 1.00 0.00 C ATOM 0 H ALA A 128 -12.098 -6.917 4.794 1.00 0.00 H new ATOM 0 HA ALA A 128 -10.753 -7.169 7.263 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -8.375 -6.604 6.598 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.875 -8.177 5.934 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -8.840 -6.739 4.886 1.00 0.00 H new ATOM 1988 N LYS A 129 -11.960 -4.794 6.235 1.00 0.00 N ATOM 1989 CA LYS A 129 -12.193 -3.298 6.313 1.00 0.00 C ATOM 1990 C LYS A 129 -13.504 -2.939 7.027 1.00 0.00 C ATOM 1991 O LYS A 129 -13.630 -1.893 7.629 1.00 0.00 O ATOM 1992 CB LYS A 129 -12.228 -2.725 4.897 1.00 0.00 C ATOM 1993 CG LYS A 129 -13.437 -3.247 4.105 1.00 0.00 C ATOM 1994 CD LYS A 129 -14.547 -2.189 4.061 1.00 0.00 C ATOM 1995 CE LYS A 129 -14.127 -0.988 3.191 1.00 0.00 C ATOM 1996 NZ LYS A 129 -14.235 0.259 4.000 1.00 0.00 N ATOM 0 H LYS A 129 -12.797 -5.362 6.102 1.00 0.00 H new ATOM 0 HA LYS A 129 -11.375 -2.871 6.893 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -12.266 -1.637 4.945 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -11.309 -2.989 4.374 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -13.131 -3.504 3.091 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -13.814 -4.160 4.566 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -15.460 -2.631 3.662 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -14.772 -1.850 5.072 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -13.105 -1.119 2.836 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -14.764 -0.921 2.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -15.017 0.841 3.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -14.418 0.013 4.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -13.346 0.794 3.934 1.00 0.00 H new ATOM 2010 N ASP A 130 -14.478 -3.807 6.930 1.00 0.00 N ATOM 2011 CA ASP A 130 -15.807 -3.541 7.573 1.00 0.00 C ATOM 2012 C ASP A 130 -16.517 -2.371 6.852 1.00 0.00 C ATOM 2013 O ASP A 130 -16.512 -1.259 7.343 1.00 0.00 O ATOM 2014 CB ASP A 130 -15.573 -3.171 9.050 1.00 0.00 C ATOM 2015 CG ASP A 130 -14.412 -4.000 9.602 1.00 0.00 C ATOM 2016 OD1 ASP A 130 -14.610 -5.182 9.828 1.00 0.00 O ATOM 2017 OD2 ASP A 130 -13.346 -3.438 9.790 1.00 0.00 O ATOM 0 H ASP A 130 -14.413 -4.694 6.431 1.00 0.00 H new ATOM 0 HA ASP A 130 -16.435 -4.429 7.504 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -15.350 -2.108 9.139 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -16.476 -3.357 9.631 1.00 0.00 H new ATOM 2022 N PRO A 131 -17.109 -2.644 5.700 1.00 0.00 N ATOM 2023 CA PRO A 131 -17.815 -1.605 4.918 1.00 0.00 C ATOM 2024 C PRO A 131 -19.179 -1.325 5.557 1.00 0.00 C ATOM 2025 O PRO A 131 -19.599 -0.193 5.680 1.00 0.00 O ATOM 2026 CB PRO A 131 -18.018 -2.231 3.521 1.00 0.00 C ATOM 2027 CG PRO A 131 -17.749 -3.760 3.673 1.00 0.00 C ATOM 2028 CD PRO A 131 -17.129 -3.988 5.079 1.00 0.00 C ATOM 0 HA PRO A 131 -17.262 -0.666 4.876 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -19.030 -2.050 3.159 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -17.336 -1.788 2.795 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -18.675 -4.325 3.566 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -17.071 -4.109 2.894 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -17.724 -4.687 5.666 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -16.125 -4.406 5.007 1.00 0.00 H new