USER MOD reduce.3.24.130724 H: found=0, std=0, add=894, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 893 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 131 ASN : amide:sc= -0.142 X(o=-6.8,f=-6.6) USER MOD Set 1.2: A 133 GLN : amide:sc= -6.63! K(o=-6.8!,f=-4.3) USER MOD Set 2.1: A 73 ASN : amide:sc= -3.82! C(o=-5.9!,f=-9.2!) USER MOD Set 2.2: A 113 THR OG1 : rot -107:sc= -2.08! USER MOD Set 3.1: A 79 HIS : no HE2:sc= -6.45! C(o=-9.1!,f=-13!) USER MOD Set 3.2: A 83 MET CE :methyl -121:sc= -1.8! (180deg=-1.68) USER MOD Set 3.3: A 85 THR OG1 : rot 120:sc= -0.261 USER MOD Set 3.4: A 125 MET CE :methyl 133:sc= -1.82 (180deg=-2.71) USER MOD Set 3.5: A 145 TYR OH : rot -109:sc= 1.2 USER MOD Set 4.1: A 45 THR OG1 : rot 93:sc= 1.04 USER MOD Set 4.2: A 110 THR OG1 : rot 132:sc= 0.113 USER MOD Set 5.1: A 34 HIS : no HE2:sc= -3.57 K(o=-6.1,f=-8.7!) USER MOD Set 5.2: A 122 HIS : no HE2:sc= -2.56 K(o=-6.1,f=-9.5!) USER MOD Set 6.1: A 21 THR OG1 : rot 180:sc= 0.241 USER MOD Set 6.2: A 23 ASN : amide:sc= -0.624 K(o=-0.38,f=-1) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.092 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= -0.761 USER MOD Single : A 52 ASN : amide:sc= -4! K(o=-4!,f=-1.6) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0569 USER MOD Single : A 56 LYS NZ :NH3+ -170:sc= -0.568 (180deg=-0.722) USER MOD Single : A 60 ASN : amide:sc= -3.77! K(o=-3.8!,f=-0.32) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 HIS : no HD1:sc= -5.06! C(o=-5.1!,f=-7!) USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.15) USER MOD Single : A 84 HIS : no HD1:sc= -1.14 X(o=-1.1,f=-1.2) USER MOD Single : A 87 TYR OH : rot 180:sc= 0.00497 USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 91 SER OG : rot -31:sc= 0.0853 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot -47:sc= 0.00121 USER MOD Single : A 96 SER OG : rot 180:sc=-0.00407 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0107 USER MOD Single : A 99 SER OG : rot -140:sc= -0.211 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0194 USER MOD Single : A 102 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00347) USER MOD Single : A 103 GLN : amide:sc= -8.11! K(o=-8.1!,f=-1.5) USER MOD Single : A 105 GLN : amide:sc= -1.53 K(o=-1.5,f=-0.035) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HE2:sc= 0.145 K(o=0.15,f=-0.61) USER MOD Single : A 129 ASN : amide:sc= -0.275 X(o=-0.27,f=-0.0085) USER MOD Single : A 134 ASN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.377 USER MOD ----------------------------------------------------------------- ATOM 271 N PRO A 18 2.974 -11.485 -1.470 1.00 0.00 N ATOM 272 CA PRO A 18 4.192 -11.476 -0.622 1.00 0.00 C ATOM 273 C PRO A 18 3.922 -11.920 0.822 1.00 0.00 C ATOM 274 O PRO A 18 4.832 -12.379 1.519 1.00 0.00 O ATOM 275 CB PRO A 18 4.632 -10.006 -0.624 1.00 0.00 C ATOM 276 CG PRO A 18 3.915 -9.369 -1.764 1.00 0.00 C ATOM 277 CD PRO A 18 2.628 -10.123 -1.925 1.00 0.00 C ATOM 0 HA PRO A 18 4.937 -12.171 -1.008 1.00 0.00 H new ATOM 0 HB2 PRO A 18 4.378 -9.520 0.318 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.712 -9.921 -0.745 1.00 0.00 H new ATOM 0 HG2 PRO A 18 3.726 -8.314 -1.564 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.511 -9.418 -2.675 1.00 0.00 H new ATOM 0 HD2 PRO A 18 1.829 -9.689 -1.324 1.00 0.00 H new ATOM 0 HD3 PRO A 18 2.286 -10.119 -2.960 1.00 0.00 H new ATOM 285 N LEU A 19 2.660 -11.786 1.245 1.00 0.00 N ATOM 286 CA LEU A 19 2.229 -12.149 2.580 1.00 0.00 C ATOM 287 C LEU A 19 0.912 -12.881 2.524 1.00 0.00 C ATOM 288 O LEU A 19 0.395 -13.237 1.460 1.00 0.00 O ATOM 289 CB LEU A 19 2.037 -10.902 3.465 1.00 0.00 C ATOM 290 CG LEU A 19 2.864 -10.768 4.762 1.00 0.00 C ATOM 291 CD1 LEU A 19 2.382 -11.747 5.833 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.354 -10.957 4.510 1.00 0.00 C ATOM 0 H LEU A 19 1.911 -11.419 0.658 1.00 0.00 H new ATOM 0 HA LEU A 19 3.005 -12.785 3.006 1.00 0.00 H new ATOM 0 HB2 LEU A 19 2.246 -10.027 2.850 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.983 -10.853 3.740 1.00 0.00 H new ATOM 0 HG LEU A 19 2.712 -9.752 5.126 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.985 -11.627 6.733 1.00 0.00 H new ATOM 0 HD12 LEU A 19 1.337 -11.545 6.067 1.00 0.00 H new ATOM 0 HD13 LEU A 19 2.481 -12.768 5.464 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.898 -10.855 5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.530 -11.950 4.095 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.702 -10.202 3.805 1.00 0.00 H new ATOM 304 N ASP A 20 0.407 -13.078 3.707 1.00 0.00 N ATOM 305 CA ASP A 20 -0.864 -13.699 3.951 1.00 0.00 C ATOM 306 C ASP A 20 -1.684 -12.796 4.848 1.00 0.00 C ATOM 307 O ASP A 20 -2.917 -12.832 4.841 1.00 0.00 O ATOM 308 CB ASP A 20 -0.690 -15.044 4.623 1.00 0.00 C ATOM 309 CG ASP A 20 -1.191 -16.193 3.773 1.00 0.00 C ATOM 310 OD1 ASP A 20 -2.423 -16.374 3.687 1.00 0.00 O ATOM 311 OD2 ASP A 20 -0.351 -16.912 3.192 1.00 0.00 O ATOM 0 H ASP A 20 0.888 -12.800 4.562 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.369 -13.853 2.997 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.365 -15.198 4.849 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.223 -15.042 5.574 1.00 0.00 H new ATOM 316 N THR A 21 -0.957 -11.974 5.617 1.00 0.00 N ATOM 317 CA THR A 21 -1.541 -11.053 6.570 1.00 0.00 C ATOM 318 C THR A 21 -0.496 -10.047 7.106 1.00 0.00 C ATOM 319 O THR A 21 0.591 -9.898 6.560 1.00 0.00 O ATOM 320 CB THR A 21 -2.252 -11.831 7.723 1.00 0.00 C ATOM 321 OG1 THR A 21 -3.094 -10.950 8.475 1.00 0.00 O ATOM 322 CG2 THR A 21 -1.269 -12.530 8.667 1.00 0.00 C ATOM 0 H THR A 21 0.062 -11.938 5.586 1.00 0.00 H new ATOM 0 HA THR A 21 -2.299 -10.466 6.052 1.00 0.00 H new ATOM 0 HB THR A 21 -2.853 -12.606 7.247 1.00 0.00 H new ATOM 0 HG1 THR A 21 -3.534 -11.452 9.193 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.823 -13.053 9.447 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.671 -13.246 8.104 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.613 -11.789 9.123 1.00 0.00 H new ATOM 330 N GLY A 22 -0.897 -9.333 8.141 1.00 0.00 N ATOM 331 CA GLY A 22 -0.052 -8.367 8.827 1.00 0.00 C ATOM 332 C GLY A 22 -0.801 -7.660 9.940 1.00 0.00 C ATOM 333 O GLY A 22 -1.695 -6.858 9.673 1.00 0.00 O ATOM 0 H GLY A 22 -1.834 -9.407 8.537 1.00 0.00 H new ATOM 0 HA2 GLY A 22 0.820 -8.874 9.240 1.00 0.00 H new ATOM 0 HA3 GLY A 22 0.316 -7.632 8.111 1.00 0.00 H new ATOM 337 N ASN A 23 -0.415 -7.936 11.196 1.00 0.00 N ATOM 338 CA ASN A 23 -1.072 -7.346 12.366 1.00 0.00 C ATOM 339 C ASN A 23 -0.143 -7.212 13.545 1.00 0.00 C ATOM 340 O ASN A 23 0.451 -8.187 14.014 1.00 0.00 O ATOM 341 CB ASN A 23 -2.328 -8.154 12.757 1.00 0.00 C ATOM 342 CG ASN A 23 -2.092 -9.659 12.753 1.00 0.00 C ATOM 343 OD1 ASN A 23 -1.924 -10.278 13.804 1.00 0.00 O ATOM 344 ND2 ASN A 23 -2.062 -10.243 11.559 1.00 0.00 N ATOM 0 H ASN A 23 0.353 -8.567 11.424 1.00 0.00 H new ATOM 0 HA ASN A 23 -1.374 -6.338 12.080 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -2.657 -7.846 13.749 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -3.136 -7.917 12.065 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -1.894 -11.246 11.486 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -2.207 -9.688 10.716 1.00 0.00 H new ATOM 351 N ILE A 24 -0.066 -5.975 14.026 1.00 0.00 N ATOM 352 CA ILE A 24 0.764 -5.633 15.170 1.00 0.00 C ATOM 353 C ILE A 24 -0.118 -5.475 16.399 1.00 0.00 C ATOM 354 O ILE A 24 -0.140 -4.440 17.078 1.00 0.00 O ATOM 355 CB ILE A 24 1.572 -4.339 14.950 1.00 0.00 C ATOM 356 CG1 ILE A 24 1.740 -4.015 13.458 1.00 0.00 C ATOM 357 CG2 ILE A 24 2.928 -4.415 15.639 1.00 0.00 C ATOM 358 CD1 ILE A 24 0.541 -3.301 12.876 1.00 0.00 C ATOM 0 H ILE A 24 -0.577 -5.185 13.633 1.00 0.00 H new ATOM 0 HA ILE A 24 1.480 -6.443 15.309 1.00 0.00 H new ATOM 0 HB ILE A 24 1.002 -3.526 15.401 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.627 -3.396 13.323 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.910 -4.940 12.907 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.476 -3.489 15.467 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.784 -4.558 16.710 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.495 -5.253 15.234 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.716 -3.098 11.820 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.344 -3.929 12.983 1.00 0.00 H new ATOM 0 HD13 ILE A 24 0.385 -2.361 13.405 1.00 0.00 H new ATOM 370 N THR A 25 -0.804 -6.549 16.669 1.00 0.00 N ATOM 371 CA THR A 25 -1.709 -6.663 17.814 1.00 0.00 C ATOM 372 C THR A 25 -1.105 -7.556 18.902 1.00 0.00 C ATOM 373 O THR A 25 -1.393 -7.387 20.090 1.00 0.00 O ATOM 374 CB THR A 25 -3.100 -7.204 17.373 1.00 0.00 C ATOM 375 OG1 THR A 25 -3.972 -7.330 18.503 1.00 0.00 O ATOM 376 CG2 THR A 25 -3.004 -8.550 16.646 1.00 0.00 C ATOM 0 H THR A 25 -0.760 -7.394 16.099 1.00 0.00 H new ATOM 0 HA THR A 25 -1.848 -5.665 18.230 1.00 0.00 H new ATOM 0 HB THR A 25 -3.509 -6.477 16.671 1.00 0.00 H new ATOM 0 HG1 THR A 25 -4.843 -7.670 18.208 1.00 0.00 H new ATOM 0 HG21 THR A 25 -4.002 -8.881 16.361 1.00 0.00 H new ATOM 0 HG22 THR A 25 -2.390 -8.438 15.753 1.00 0.00 H new ATOM 0 HG23 THR A 25 -2.552 -9.289 17.307 1.00 0.00 H new ATOM 384 N THR A 26 -0.257 -8.487 18.468 1.00 0.00 N ATOM 385 CA THR A 26 0.401 -9.430 19.374 1.00 0.00 C ATOM 386 C THR A 26 1.914 -9.200 19.396 1.00 0.00 C ATOM 387 O THR A 26 2.474 -8.768 20.408 1.00 0.00 O ATOM 388 CB THR A 26 0.077 -10.902 18.985 1.00 0.00 C ATOM 389 OG1 THR A 26 -1.286 -11.009 18.552 1.00 0.00 O ATOM 390 CG2 THR A 26 0.300 -11.852 20.157 1.00 0.00 C ATOM 0 H THR A 26 -0.007 -8.610 17.487 1.00 0.00 H new ATOM 0 HA THR A 26 0.013 -9.253 20.377 1.00 0.00 H new ATOM 0 HB THR A 26 0.751 -11.182 18.175 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.480 -11.938 18.308 1.00 0.00 H new ATOM 0 HG21 THR A 26 0.064 -12.871 19.850 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.342 -11.801 20.474 1.00 0.00 H new ATOM 0 HG23 THR A 26 -0.346 -11.565 20.986 1.00 0.00 H new ATOM 398 N GLY A 27 2.544 -9.488 18.269 1.00 0.00 N ATOM 399 CA GLY A 27 3.987 -9.328 18.127 1.00 0.00 C ATOM 400 C GLY A 27 4.441 -9.463 16.688 1.00 0.00 C ATOM 401 O GLY A 27 4.210 -10.498 16.058 1.00 0.00 O ATOM 0 H GLY A 27 2.077 -9.837 17.432 1.00 0.00 H new ATOM 0 HA2 GLY A 27 4.281 -8.350 18.508 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.495 -10.074 18.738 1.00 0.00 H new ATOM 405 N PHE A 28 5.107 -8.418 16.177 1.00 0.00 N ATOM 406 CA PHE A 28 5.591 -8.390 14.800 1.00 0.00 C ATOM 407 C PHE A 28 6.862 -9.189 14.589 1.00 0.00 C ATOM 408 O PHE A 28 7.592 -9.494 15.535 1.00 0.00 O ATOM 409 CB PHE A 28 5.734 -6.958 14.279 1.00 0.00 C ATOM 410 CG PHE A 28 5.064 -6.775 12.940 1.00 0.00 C ATOM 411 CD1 PHE A 28 5.818 -6.663 11.786 1.00 0.00 C ATOM 412 CD2 PHE A 28 3.677 -6.750 12.830 1.00 0.00 C ATOM 413 CE1 PHE A 28 5.214 -6.528 10.554 1.00 0.00 C ATOM 414 CE2 PHE A 28 3.069 -6.612 11.597 1.00 0.00 C ATOM 415 CZ PHE A 28 3.839 -6.503 10.460 1.00 0.00 C ATOM 0 H PHE A 28 5.322 -7.574 16.708 1.00 0.00 H new ATOM 0 HA PHE A 28 4.824 -8.888 14.207 1.00 0.00 H new ATOM 0 HB2 PHE A 28 5.300 -6.265 15.000 1.00 0.00 H new ATOM 0 HB3 PHE A 28 6.791 -6.707 14.193 1.00 0.00 H new ATOM 0 HD1 PHE A 28 6.896 -6.682 11.851 1.00 0.00 H new ATOM 0 HD2 PHE A 28 3.069 -6.839 13.718 1.00 0.00 H new ATOM 0 HE1 PHE A 28 5.818 -6.442 9.663 1.00 0.00 H new ATOM 0 HE2 PHE A 28 1.992 -6.590 11.525 1.00 0.00 H new ATOM 0 HZ PHE A 28 3.365 -6.398 9.495 1.00 0.00 H new ATOM 425 N ASN A 29 7.055 -9.570 13.316 1.00 0.00 N ATOM 426 CA ASN A 29 8.165 -10.384 12.834 1.00 0.00 C ATOM 427 C ASN A 29 9.572 -9.832 13.122 1.00 0.00 C ATOM 428 O ASN A 29 10.515 -10.055 12.349 1.00 0.00 O ATOM 429 CB ASN A 29 7.975 -10.586 11.337 1.00 0.00 C ATOM 430 CG ASN A 29 6.844 -11.527 11.003 1.00 0.00 C ATOM 431 OD1 ASN A 29 6.989 -12.748 11.053 1.00 0.00 O ATOM 432 ND2 ASN A 29 5.711 -10.949 10.648 1.00 0.00 N ATOM 0 H ASN A 29 6.412 -9.305 12.570 1.00 0.00 H new ATOM 0 HA ASN A 29 8.131 -11.321 13.390 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.786 -9.620 10.868 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.900 -10.973 10.909 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.903 -11.520 10.399 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.643 -9.932 10.623 1.00 0.00 H new ATOM 439 N GLY A 30 9.704 -9.139 14.236 1.00 0.00 N ATOM 440 CA GLY A 30 10.982 -8.572 14.625 1.00 0.00 C ATOM 441 C GLY A 30 11.027 -7.092 14.353 1.00 0.00 C ATOM 442 O GLY A 30 12.050 -6.442 14.576 1.00 0.00 O ATOM 0 H GLY A 30 8.942 -8.954 14.889 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.156 -8.755 15.685 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.784 -9.069 14.080 1.00 0.00 H new ATOM 446 N TYR A 31 9.904 -6.581 13.844 1.00 0.00 N ATOM 447 CA TYR A 31 9.754 -5.150 13.552 1.00 0.00 C ATOM 448 C TYR A 31 8.915 -4.501 14.676 1.00 0.00 C ATOM 449 O TYR A 31 7.689 -4.380 14.544 1.00 0.00 O ATOM 450 CB TYR A 31 9.085 -4.917 12.177 1.00 0.00 C ATOM 451 CG TYR A 31 9.636 -5.750 11.023 1.00 0.00 C ATOM 452 CD1 TYR A 31 9.416 -7.126 10.946 1.00 0.00 C ATOM 453 CD2 TYR A 31 10.362 -5.152 10.000 1.00 0.00 C ATOM 454 CE1 TYR A 31 9.903 -7.872 9.892 1.00 0.00 C ATOM 455 CE2 TYR A 31 10.854 -5.894 8.943 1.00 0.00 C ATOM 456 CZ TYR A 31 10.622 -7.252 8.894 1.00 0.00 C ATOM 457 OH TYR A 31 11.108 -7.993 7.841 1.00 0.00 O ATOM 0 H TYR A 31 9.079 -7.139 13.624 1.00 0.00 H new ATOM 0 HA TYR A 31 10.742 -4.693 13.510 1.00 0.00 H new ATOM 0 HB2 TYR A 31 8.019 -5.123 12.273 1.00 0.00 H new ATOM 0 HB3 TYR A 31 9.184 -3.863 11.919 1.00 0.00 H new ATOM 0 HD1 TYR A 31 8.854 -7.617 11.727 1.00 0.00 H new ATOM 0 HD2 TYR A 31 10.545 -4.088 10.032 1.00 0.00 H new ATOM 0 HE1 TYR A 31 9.721 -8.936 9.850 1.00 0.00 H new ATOM 0 HE2 TYR A 31 11.418 -5.412 8.158 1.00 0.00 H new ATOM 0 HH TYR A 31 11.591 -7.406 7.223 1.00 0.00 H new ATOM 467 N PRO A 32 9.551 -4.080 15.817 1.00 0.00 N ATOM 468 CA PRO A 32 8.834 -3.478 16.955 1.00 0.00 C ATOM 469 C PRO A 32 8.447 -2.017 16.720 1.00 0.00 C ATOM 470 O PRO A 32 9.228 -1.246 16.154 1.00 0.00 O ATOM 471 CB PRO A 32 9.837 -3.569 18.120 1.00 0.00 C ATOM 472 CG PRO A 32 11.026 -4.309 17.592 1.00 0.00 C ATOM 473 CD PRO A 32 10.998 -4.148 16.102 1.00 0.00 C ATOM 0 HA PRO A 32 7.892 -3.997 17.135 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.120 -2.576 18.468 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.399 -4.092 18.970 1.00 0.00 H new ATOM 0 HG2 PRO A 32 11.950 -3.907 18.009 1.00 0.00 H new ATOM 0 HG3 PRO A 32 10.983 -5.362 17.870 1.00 0.00 H new ATOM 0 HD2 PRO A 32 11.518 -3.245 15.781 1.00 0.00 H new ATOM 0 HD3 PRO A 32 11.473 -4.987 15.594 1.00 0.00 H new ATOM 481 N GLY A 33 7.234 -1.653 17.157 1.00 0.00 N ATOM 482 CA GLY A 33 6.749 -0.281 16.999 1.00 0.00 C ATOM 483 C GLY A 33 6.061 -0.044 15.662 1.00 0.00 C ATOM 484 O GLY A 33 5.651 1.080 15.357 1.00 0.00 O ATOM 0 H GLY A 33 6.579 -2.284 17.618 1.00 0.00 H new ATOM 0 HA2 GLY A 33 6.052 -0.053 17.805 1.00 0.00 H new ATOM 0 HA3 GLY A 33 7.587 0.409 17.097 1.00 0.00 H new ATOM 488 N HIS A 34 5.918 -1.123 14.883 1.00 0.00 N ATOM 489 CA HIS A 34 5.306 -1.101 13.569 1.00 0.00 C ATOM 490 C HIS A 34 3.790 -0.899 13.670 1.00 0.00 C ATOM 491 O HIS A 34 3.115 -1.571 14.453 1.00 0.00 O ATOM 492 CB HIS A 34 5.638 -2.421 12.853 1.00 0.00 C ATOM 493 CG HIS A 34 5.633 -2.345 11.354 1.00 0.00 C ATOM 494 ND1 HIS A 34 4.939 -3.218 10.553 1.00 0.00 N ATOM 495 CD2 HIS A 34 6.236 -1.467 10.509 1.00 0.00 C ATOM 496 CE1 HIS A 34 5.135 -2.848 9.283 1.00 0.00 C ATOM 497 NE2 HIS A 34 5.909 -1.790 9.208 1.00 0.00 N ATOM 0 H HIS A 34 6.235 -2.051 15.164 1.00 0.00 H new ATOM 0 HA HIS A 34 5.703 -0.263 12.996 1.00 0.00 H new ATOM 0 HB2 HIS A 34 6.621 -2.759 13.182 1.00 0.00 H new ATOM 0 HB3 HIS A 34 4.919 -3.178 13.166 1.00 0.00 H new ATOM 0 HD1 HIS A 34 4.375 -4.007 10.870 1.00 0.00 H new ATOM 0 HD2 HIS A 34 6.871 -0.646 10.809 1.00 0.00 H new ATOM 0 HE1 HIS A 34 4.711 -3.354 8.429 1.00 0.00 H new ATOM 505 N VAL A 35 3.290 0.061 12.898 1.00 0.00 N ATOM 506 CA VAL A 35 1.863 0.398 12.862 1.00 0.00 C ATOM 507 C VAL A 35 1.200 -0.113 11.574 1.00 0.00 C ATOM 508 O VAL A 35 0.028 0.176 11.316 1.00 0.00 O ATOM 509 CB VAL A 35 1.618 1.932 12.972 1.00 0.00 C ATOM 510 CG1 VAL A 35 1.158 2.332 14.375 1.00 0.00 C ATOM 511 CG2 VAL A 35 2.848 2.743 12.564 1.00 0.00 C ATOM 0 H VAL A 35 3.862 0.632 12.276 1.00 0.00 H new ATOM 0 HA VAL A 35 1.416 -0.093 13.726 1.00 0.00 H new ATOM 0 HB VAL A 35 0.817 2.166 12.270 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.998 3.409 14.412 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.227 1.818 14.613 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.922 2.054 15.101 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.630 3.807 12.657 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.685 2.486 13.213 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.108 2.515 11.530 1.00 0.00 H new ATOM 521 N GLY A 36 1.953 -0.871 10.770 1.00 0.00 N ATOM 522 CA GLY A 36 1.434 -1.405 9.527 1.00 0.00 C ATOM 523 C GLY A 36 1.990 -2.777 9.223 1.00 0.00 C ATOM 524 O GLY A 36 2.304 -3.546 10.136 1.00 0.00 O ATOM 0 H GLY A 36 2.922 -1.123 10.966 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.347 -1.459 9.582 1.00 0.00 H new ATOM 0 HA3 GLY A 36 1.679 -0.726 8.711 1.00 0.00 H new ATOM 528 N VAL A 37 2.099 -3.074 7.934 1.00 0.00 N ATOM 529 CA VAL A 37 2.629 -4.353 7.457 1.00 0.00 C ATOM 530 C VAL A 37 3.685 -4.116 6.356 1.00 0.00 C ATOM 531 O VAL A 37 3.597 -3.138 5.608 1.00 0.00 O ATOM 532 CB VAL A 37 1.480 -5.300 6.973 1.00 0.00 C ATOM 533 CG1 VAL A 37 0.684 -4.687 5.827 1.00 0.00 C ATOM 534 CG2 VAL A 37 2.008 -6.684 6.587 1.00 0.00 C ATOM 0 H VAL A 37 1.823 -2.437 7.187 1.00 0.00 H new ATOM 0 HA VAL A 37 3.121 -4.857 8.289 1.00 0.00 H new ATOM 0 HB VAL A 37 0.803 -5.425 7.818 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.103 -5.376 5.521 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.237 -3.749 6.155 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.348 -4.497 4.984 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.179 -7.310 6.257 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.732 -6.585 5.779 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.489 -7.144 7.450 1.00 0.00 H new ATOM 544 N ASP A 38 4.659 -5.030 6.261 1.00 0.00 N ATOM 545 CA ASP A 38 5.737 -4.917 5.275 1.00 0.00 C ATOM 546 C ASP A 38 5.863 -6.171 4.423 1.00 0.00 C ATOM 547 O ASP A 38 5.831 -7.295 4.931 1.00 0.00 O ATOM 548 CB ASP A 38 7.060 -4.571 5.979 1.00 0.00 C ATOM 549 CG ASP A 38 7.027 -3.189 6.598 1.00 0.00 C ATOM 550 OD1 ASP A 38 6.299 -2.321 6.067 1.00 0.00 O ATOM 551 OD2 ASP A 38 7.636 -3.015 7.672 1.00 0.00 O ATOM 0 H ASP A 38 4.721 -5.856 6.856 1.00 0.00 H new ATOM 0 HA ASP A 38 5.488 -4.106 4.591 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.263 -5.311 6.753 1.00 0.00 H new ATOM 0 HB3 ASP A 38 7.879 -4.628 5.261 1.00 0.00 H new ATOM 556 N TYR A 39 6.014 -5.940 3.114 1.00 0.00 N ATOM 557 CA TYR A 39 6.125 -7.012 2.122 1.00 0.00 C ATOM 558 C TYR A 39 7.383 -6.829 1.273 1.00 0.00 C ATOM 559 O TYR A 39 7.453 -5.924 0.431 1.00 0.00 O ATOM 560 CB TYR A 39 4.910 -7.035 1.177 1.00 0.00 C ATOM 561 CG TYR A 39 3.546 -6.851 1.817 1.00 0.00 C ATOM 562 CD1 TYR A 39 3.117 -5.592 2.194 1.00 0.00 C ATOM 563 CD2 TYR A 39 2.672 -7.920 1.996 1.00 0.00 C ATOM 564 CE1 TYR A 39 1.866 -5.393 2.729 1.00 0.00 C ATOM 565 CE2 TYR A 39 1.415 -7.725 2.541 1.00 0.00 C ATOM 566 CZ TYR A 39 1.018 -6.462 2.901 1.00 0.00 C ATOM 567 OH TYR A 39 -0.238 -6.268 3.428 1.00 0.00 O ATOM 0 H TYR A 39 6.063 -5.003 2.714 1.00 0.00 H new ATOM 0 HA TYR A 39 6.172 -7.951 2.674 1.00 0.00 H new ATOM 0 HB2 TYR A 39 5.044 -6.252 0.431 1.00 0.00 H new ATOM 0 HB3 TYR A 39 4.911 -7.986 0.645 1.00 0.00 H new ATOM 0 HD1 TYR A 39 3.778 -4.748 2.066 1.00 0.00 H new ATOM 0 HD2 TYR A 39 2.979 -8.914 1.706 1.00 0.00 H new ATOM 0 HE1 TYR A 39 1.550 -4.400 3.013 1.00 0.00 H new ATOM 0 HE2 TYR A 39 0.749 -8.564 2.682 1.00 0.00 H new ATOM 0 HH TYR A 39 -0.707 -7.127 3.481 1.00 0.00 H new ATOM 577 N ALA A 40 8.371 -7.695 1.502 1.00 0.00 N ATOM 578 CA ALA A 40 9.640 -7.674 0.762 1.00 0.00 C ATOM 579 C ALA A 40 9.434 -7.842 -0.753 1.00 0.00 C ATOM 580 O ALA A 40 9.143 -8.942 -1.241 1.00 0.00 O ATOM 581 CB ALA A 40 10.582 -8.743 1.304 1.00 0.00 C ATOM 0 H ALA A 40 8.317 -8.432 2.205 1.00 0.00 H new ATOM 0 HA ALA A 40 10.092 -6.693 0.911 1.00 0.00 H new ATOM 0 HB1 ALA A 40 11.519 -8.718 0.748 1.00 0.00 H new ATOM 0 HB2 ALA A 40 10.781 -8.552 2.359 1.00 0.00 H new ATOM 0 HB3 ALA A 40 10.121 -9.724 1.194 1.00 0.00 H new ATOM 587 N VAL A 41 9.576 -6.725 -1.478 1.00 0.00 N ATOM 588 CA VAL A 41 9.408 -6.693 -2.926 1.00 0.00 C ATOM 589 C VAL A 41 10.354 -5.631 -3.544 1.00 0.00 C ATOM 590 O VAL A 41 10.349 -4.477 -3.104 1.00 0.00 O ATOM 591 CB VAL A 41 7.911 -6.453 -3.334 1.00 0.00 C ATOM 592 CG1 VAL A 41 7.408 -5.059 -2.953 1.00 0.00 C ATOM 593 CG2 VAL A 41 7.693 -6.720 -4.822 1.00 0.00 C ATOM 0 H VAL A 41 9.811 -5.820 -1.071 1.00 0.00 H new ATOM 0 HA VAL A 41 9.681 -7.669 -3.327 1.00 0.00 H new ATOM 0 HB VAL A 41 7.320 -7.169 -2.763 1.00 0.00 H new ATOM 0 HG11 VAL A 41 6.368 -4.951 -3.260 1.00 0.00 H new ATOM 0 HG12 VAL A 41 7.484 -4.927 -1.874 1.00 0.00 H new ATOM 0 HG13 VAL A 41 8.014 -4.304 -3.454 1.00 0.00 H new ATOM 0 HG21 VAL A 41 6.647 -6.545 -5.074 1.00 0.00 H new ATOM 0 HG22 VAL A 41 8.324 -6.051 -5.408 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.953 -7.754 -5.048 1.00 0.00 H new ATOM 603 N PRO A 42 11.175 -6.008 -4.572 1.00 0.00 N ATOM 604 CA PRO A 42 12.125 -5.084 -5.239 1.00 0.00 C ATOM 605 C PRO A 42 11.538 -3.754 -5.681 1.00 0.00 C ATOM 606 O PRO A 42 10.404 -3.650 -6.152 1.00 0.00 O ATOM 607 CB PRO A 42 12.601 -5.877 -6.457 1.00 0.00 C ATOM 608 CG PRO A 42 12.464 -7.303 -6.061 1.00 0.00 C ATOM 609 CD PRO A 42 11.273 -7.374 -5.143 1.00 0.00 C ATOM 0 HA PRO A 42 12.909 -4.792 -4.540 1.00 0.00 H new ATOM 0 HB2 PRO A 42 11.998 -5.651 -7.336 1.00 0.00 H new ATOM 0 HB3 PRO A 42 13.633 -5.634 -6.708 1.00 0.00 H new ATOM 0 HG2 PRO A 42 12.319 -7.937 -6.936 1.00 0.00 H new ATOM 0 HG3 PRO A 42 13.364 -7.655 -5.558 1.00 0.00 H new ATOM 0 HD2 PRO A 42 10.367 -7.645 -5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 42 11.414 -8.123 -4.364 1.00 0.00 H new ATOM 617 N VAL A 43 12.387 -2.755 -5.499 1.00 0.00 N ATOM 618 CA VAL A 43 12.139 -1.356 -5.813 1.00 0.00 C ATOM 619 C VAL A 43 11.890 -1.101 -7.307 1.00 0.00 C ATOM 620 O VAL A 43 12.539 -1.707 -8.166 1.00 0.00 O ATOM 621 CB VAL A 43 13.356 -0.519 -5.305 1.00 0.00 C ATOM 622 CG1 VAL A 43 14.693 -1.101 -5.772 1.00 0.00 C ATOM 623 CG2 VAL A 43 13.262 0.960 -5.693 1.00 0.00 C ATOM 0 H VAL A 43 13.317 -2.906 -5.108 1.00 0.00 H new ATOM 0 HA VAL A 43 11.221 -1.053 -5.310 1.00 0.00 H new ATOM 0 HB VAL A 43 13.316 -0.580 -4.217 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.509 -0.486 -5.394 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.800 -2.117 -5.393 1.00 0.00 H new ATOM 0 HG13 VAL A 43 14.723 -1.115 -6.861 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.134 1.492 -5.313 1.00 0.00 H new ATOM 0 HG22 VAL A 43 13.226 1.050 -6.779 1.00 0.00 H new ATOM 0 HG23 VAL A 43 12.358 1.392 -5.263 1.00 0.00 H new ATOM 633 N GLY A 44 10.942 -0.202 -7.589 1.00 0.00 N ATOM 634 CA GLY A 44 10.648 0.157 -8.954 1.00 0.00 C ATOM 635 C GLY A 44 9.407 -0.508 -9.515 1.00 0.00 C ATOM 636 O GLY A 44 9.082 -0.316 -10.691 1.00 0.00 O ATOM 0 H GLY A 44 10.377 0.279 -6.889 1.00 0.00 H new ATOM 0 HA2 GLY A 44 10.527 1.239 -9.016 1.00 0.00 H new ATOM 0 HA3 GLY A 44 11.502 -0.105 -9.579 1.00 0.00 H new ATOM 640 N THR A 45 8.714 -1.290 -8.679 1.00 0.00 N ATOM 641 CA THR A 45 7.498 -1.968 -9.081 1.00 0.00 C ATOM 642 C THR A 45 6.294 -1.028 -8.894 1.00 0.00 C ATOM 643 O THR A 45 6.107 -0.504 -7.793 1.00 0.00 O ATOM 644 CB THR A 45 7.285 -3.276 -8.281 1.00 0.00 C ATOM 645 OG1 THR A 45 8.542 -3.934 -8.075 1.00 0.00 O ATOM 646 CG2 THR A 45 6.340 -4.230 -9.008 1.00 0.00 C ATOM 0 H THR A 45 8.987 -1.464 -7.712 1.00 0.00 H new ATOM 0 HA THR A 45 7.591 -2.237 -10.133 1.00 0.00 H new ATOM 0 HB THR A 45 6.839 -3.007 -7.324 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.923 -3.650 -7.218 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.214 -5.137 -8.417 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.372 -3.749 -9.145 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.759 -4.486 -9.981 1.00 0.00 H new ATOM 654 N PRO A 46 5.453 -0.795 -9.953 1.00 0.00 N ATOM 655 CA PRO A 46 4.290 0.110 -9.851 1.00 0.00 C ATOM 656 C PRO A 46 3.311 -0.291 -8.746 1.00 0.00 C ATOM 657 O PRO A 46 2.855 -1.438 -8.685 1.00 0.00 O ATOM 658 CB PRO A 46 3.611 0.008 -11.224 1.00 0.00 C ATOM 659 CG PRO A 46 4.664 -0.497 -12.145 1.00 0.00 C ATOM 660 CD PRO A 46 5.557 -1.378 -11.317 1.00 0.00 C ATOM 0 HA PRO A 46 4.607 1.120 -9.592 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.758 -0.670 -11.192 1.00 0.00 H new ATOM 0 HB3 PRO A 46 3.235 0.978 -11.550 1.00 0.00 H new ATOM 0 HG2 PRO A 46 4.224 -1.055 -12.971 1.00 0.00 H new ATOM 0 HG3 PRO A 46 5.227 0.328 -12.582 1.00 0.00 H new ATOM 0 HD2 PRO A 46 5.226 -2.416 -11.336 1.00 0.00 H new ATOM 0 HD3 PRO A 46 6.584 -1.365 -11.682 1.00 0.00 H new ATOM 668 N VAL A 47 3.012 0.675 -7.877 1.00 0.00 N ATOM 669 CA VAL A 47 2.104 0.494 -6.775 1.00 0.00 C ATOM 670 C VAL A 47 0.775 1.089 -7.139 1.00 0.00 C ATOM 671 O VAL A 47 0.664 2.272 -7.477 1.00 0.00 O ATOM 672 CB VAL A 47 2.625 1.110 -5.442 1.00 0.00 C ATOM 673 CG1 VAL A 47 1.797 0.637 -4.247 1.00 0.00 C ATOM 674 CG2 VAL A 47 4.098 0.780 -5.212 1.00 0.00 C ATOM 0 H VAL A 47 3.406 1.614 -7.931 1.00 0.00 H new ATOM 0 HA VAL A 47 2.011 -0.577 -6.597 1.00 0.00 H new ATOM 0 HB VAL A 47 2.521 2.191 -5.532 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.187 1.086 -3.333 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.758 0.937 -4.383 1.00 0.00 H new ATOM 0 HG13 VAL A 47 1.855 -0.449 -4.171 1.00 0.00 H new ATOM 0 HG21 VAL A 47 4.428 1.225 -4.274 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.226 -0.302 -5.165 1.00 0.00 H new ATOM 0 HG23 VAL A 47 4.693 1.180 -6.033 1.00 0.00 H new ATOM 684 N ARG A 48 -0.208 0.225 -7.077 1.00 0.00 N ATOM 685 CA ARG A 48 -1.563 0.574 -7.393 1.00 0.00 C ATOM 686 C ARG A 48 -2.393 0.782 -6.153 1.00 0.00 C ATOM 687 O ARG A 48 -2.124 0.200 -5.097 1.00 0.00 O ATOM 688 CB ARG A 48 -2.216 -0.490 -8.287 1.00 0.00 C ATOM 689 CG ARG A 48 -1.671 -0.540 -9.705 1.00 0.00 C ATOM 690 CD ARG A 48 -1.614 -1.966 -10.222 1.00 0.00 C ATOM 691 NE ARG A 48 -1.227 -2.025 -11.634 1.00 0.00 N ATOM 692 CZ ARG A 48 -1.184 -3.146 -12.366 1.00 0.00 C ATOM 693 NH1 ARG A 48 -1.501 -4.326 -11.835 1.00 0.00 N ATOM 694 NH2 ARG A 48 -0.820 -3.084 -13.640 1.00 0.00 N ATOM 0 H ARG A 48 -0.084 -0.750 -6.802 1.00 0.00 H new ATOM 0 HA ARG A 48 -1.526 1.517 -7.938 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -2.081 -1.468 -7.825 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.289 -0.302 -8.330 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.300 0.062 -10.360 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -0.673 -0.101 -9.730 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -0.902 -2.539 -9.627 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -2.589 -2.437 -10.094 1.00 0.00 H new ATOM 0 HE ARG A 48 -0.972 -1.150 -12.092 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -1.782 -4.386 -10.856 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -1.463 -5.170 -12.407 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -0.575 -2.186 -14.057 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -0.785 -3.934 -14.202 1.00 0.00 H new ATOM 708 N ALA A 49 -3.437 1.599 -6.314 1.00 0.00 N ATOM 709 CA ALA A 49 -4.338 1.925 -5.230 1.00 0.00 C ATOM 710 C ALA A 49 -5.238 0.739 -4.907 1.00 0.00 C ATOM 711 O ALA A 49 -5.962 0.241 -5.770 1.00 0.00 O ATOM 712 CB ALA A 49 -5.166 3.158 -5.567 1.00 0.00 C ATOM 0 H ALA A 49 -3.672 2.046 -7.200 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.742 2.151 -4.346 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.836 3.384 -4.738 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.503 4.006 -5.739 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.753 2.968 -6.466 1.00 0.00 H new ATOM 718 N VAL A 50 -5.142 0.258 -3.673 1.00 0.00 N ATOM 719 CA VAL A 50 -5.938 -0.892 -3.216 1.00 0.00 C ATOM 720 C VAL A 50 -7.456 -0.596 -3.165 1.00 0.00 C ATOM 721 O VAL A 50 -8.269 -1.523 -3.113 1.00 0.00 O ATOM 722 CB VAL A 50 -5.430 -1.419 -1.851 1.00 0.00 C ATOM 723 CG1 VAL A 50 -6.106 -2.724 -1.443 1.00 0.00 C ATOM 724 CG2 VAL A 50 -3.920 -1.615 -1.868 1.00 0.00 C ATOM 0 H VAL A 50 -4.520 0.644 -2.963 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.800 -1.674 -3.962 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.690 -0.659 -1.114 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.715 -3.051 -0.480 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -7.182 -2.567 -1.364 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.905 -3.488 -2.194 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.590 -1.986 -0.897 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.655 -2.337 -2.641 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.432 -0.663 -2.078 1.00 0.00 H new ATOM 734 N ALA A 51 -7.824 0.692 -3.206 1.00 0.00 N ATOM 735 CA ALA A 51 -9.215 1.131 -3.186 1.00 0.00 C ATOM 736 C ALA A 51 -9.303 2.620 -3.454 1.00 0.00 C ATOM 737 O ALA A 51 -8.431 3.391 -3.045 1.00 0.00 O ATOM 738 CB ALA A 51 -9.889 0.800 -1.865 1.00 0.00 C ATOM 0 H ALA A 51 -7.155 1.460 -3.254 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.740 0.592 -3.975 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.924 1.142 -1.889 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.867 -0.278 -1.705 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.360 1.298 -1.052 1.00 0.00 H new ATOM 744 N ASN A 52 -10.356 3.003 -4.176 1.00 0.00 N ATOM 745 CA ASN A 52 -10.631 4.384 -4.531 1.00 0.00 C ATOM 746 C ASN A 52 -10.835 5.272 -3.299 1.00 0.00 C ATOM 747 O ASN A 52 -11.210 4.784 -2.229 1.00 0.00 O ATOM 748 CB ASN A 52 -11.870 4.451 -5.440 1.00 0.00 C ATOM 749 CG ASN A 52 -13.030 3.553 -5.026 1.00 0.00 C ATOM 750 OD1 ASN A 52 -13.716 2.974 -5.869 1.00 0.00 O ATOM 751 ND2 ASN A 52 -13.255 3.448 -3.733 1.00 0.00 N ATOM 0 H ASN A 52 -11.050 2.347 -4.534 1.00 0.00 H new ATOM 0 HA ASN A 52 -9.760 4.765 -5.063 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -12.223 5.482 -5.470 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -11.571 4.186 -6.454 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -14.023 2.869 -3.394 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -12.661 3.946 -3.070 1.00 0.00 H new ATOM 758 N GLY A 53 -10.593 6.569 -3.476 1.00 0.00 N ATOM 759 CA GLY A 53 -10.751 7.517 -2.384 1.00 0.00 C ATOM 760 C GLY A 53 -10.158 8.883 -2.670 1.00 0.00 C ATOM 761 O GLY A 53 -10.456 9.493 -3.701 1.00 0.00 O ATOM 0 H GLY A 53 -10.290 6.982 -4.358 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.813 7.631 -2.164 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.282 7.108 -1.489 1.00 0.00 H new ATOM 765 N THR A 54 -9.302 9.350 -1.749 1.00 0.00 N ATOM 766 CA THR A 54 -8.674 10.641 -1.829 1.00 0.00 C ATOM 767 C THR A 54 -7.296 10.588 -1.180 1.00 0.00 C ATOM 768 O THR A 54 -7.120 9.958 -0.139 1.00 0.00 O ATOM 769 CB THR A 54 -9.534 11.693 -1.117 1.00 0.00 C ATOM 770 OG1 THR A 54 -10.899 11.589 -1.542 1.00 0.00 O ATOM 771 CG2 THR A 54 -9.039 13.120 -1.358 1.00 0.00 C ATOM 0 H THR A 54 -9.034 8.818 -0.921 1.00 0.00 H new ATOM 0 HA THR A 54 -8.570 10.915 -2.879 1.00 0.00 H new ATOM 0 HB THR A 54 -9.455 11.490 -0.049 1.00 0.00 H new ATOM 0 HG1 THR A 54 -11.438 12.264 -1.080 1.00 0.00 H new ATOM 0 HG21 THR A 54 -9.684 13.823 -0.831 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.018 13.218 -0.989 1.00 0.00 H new ATOM 0 HG23 THR A 54 -9.061 13.337 -2.426 1.00 0.00 H new ATOM 779 N VAL A 55 -6.345 11.282 -1.798 1.00 0.00 N ATOM 780 CA VAL A 55 -4.975 11.361 -1.334 1.00 0.00 C ATOM 781 C VAL A 55 -4.869 12.464 -0.274 1.00 0.00 C ATOM 782 O VAL A 55 -5.055 13.645 -0.562 1.00 0.00 O ATOM 783 CB VAL A 55 -3.992 11.667 -2.502 1.00 0.00 C ATOM 784 CG1 VAL A 55 -2.536 11.472 -2.093 1.00 0.00 C ATOM 785 CG2 VAL A 55 -4.294 10.823 -3.739 1.00 0.00 C ATOM 0 H VAL A 55 -6.515 11.814 -2.652 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.700 10.396 -0.909 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.143 12.717 -2.752 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.887 11.697 -2.939 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.298 12.140 -1.266 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.381 10.439 -1.781 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.585 11.069 -4.529 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.206 9.766 -3.488 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.307 11.031 -4.083 1.00 0.00 H new ATOM 795 N LYS A 56 -4.607 12.038 0.940 1.00 0.00 N ATOM 796 CA LYS A 56 -4.461 12.935 2.093 1.00 0.00 C ATOM 797 C LYS A 56 -2.996 13.273 2.329 1.00 0.00 C ATOM 798 O LYS A 56 -2.666 14.201 3.074 1.00 0.00 O ATOM 799 CB LYS A 56 -5.052 12.335 3.395 1.00 0.00 C ATOM 800 CG LYS A 56 -6.128 11.254 3.219 1.00 0.00 C ATOM 801 CD LYS A 56 -7.259 11.686 2.288 1.00 0.00 C ATOM 802 CE LYS A 56 -8.368 12.431 3.022 1.00 0.00 C ATOM 803 NZ LYS A 56 -9.537 12.693 2.139 1.00 0.00 N ATOM 0 H LYS A 56 -4.486 11.052 1.171 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.022 13.837 1.849 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.234 11.912 3.979 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -5.477 13.148 3.984 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.665 10.349 2.825 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -6.544 11.001 4.194 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.855 12.325 1.503 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -7.678 10.807 1.799 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -8.688 11.847 3.885 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -7.981 13.376 3.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -10.194 13.343 2.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -9.211 13.122 1.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -10.024 11.798 1.933 1.00 0.00 H new ATOM 817 N PHE A 57 -2.129 12.485 1.694 1.00 0.00 N ATOM 818 CA PHE A 57 -0.691 12.648 1.774 1.00 0.00 C ATOM 819 C PHE A 57 -0.035 12.039 0.544 1.00 0.00 C ATOM 820 O PHE A 57 -0.430 10.969 0.074 1.00 0.00 O ATOM 821 CB PHE A 57 -0.106 12.002 3.041 1.00 0.00 C ATOM 822 CG PHE A 57 1.212 12.591 3.465 1.00 0.00 C ATOM 823 CD1 PHE A 57 1.268 13.584 4.430 1.00 0.00 C ATOM 824 CD2 PHE A 57 2.394 12.160 2.881 1.00 0.00 C ATOM 825 CE1 PHE A 57 2.478 14.136 4.804 1.00 0.00 C ATOM 826 CE2 PHE A 57 3.605 12.706 3.253 1.00 0.00 C ATOM 827 CZ PHE A 57 3.648 13.696 4.215 1.00 0.00 C ATOM 0 H PHE A 57 -2.418 11.706 1.102 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.484 13.717 1.820 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.821 12.109 3.856 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.022 10.934 2.868 1.00 0.00 H new ATOM 0 HD1 PHE A 57 0.356 13.930 4.894 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.366 11.388 2.126 1.00 0.00 H new ATOM 0 HE1 PHE A 57 2.509 14.911 5.556 1.00 0.00 H new ATOM 0 HE2 PHE A 57 4.518 12.360 2.792 1.00 0.00 H new ATOM 0 HZ PHE A 57 4.595 14.126 4.507 1.00 0.00 H new ATOM 837 N ALA A 58 0.972 12.744 0.049 1.00 0.00 N ATOM 838 CA ALA A 58 1.738 12.348 -1.114 1.00 0.00 C ATOM 839 C ALA A 58 3.167 12.851 -0.968 1.00 0.00 C ATOM 840 O ALA A 58 3.497 13.990 -1.327 1.00 0.00 O ATOM 841 CB ALA A 58 1.104 12.865 -2.406 1.00 0.00 C ATOM 0 H ALA A 58 1.283 13.626 0.457 1.00 0.00 H new ATOM 0 HA ALA A 58 1.743 11.260 -1.177 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.706 12.549 -3.258 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.096 12.461 -2.504 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.058 13.954 -2.378 1.00 0.00 H new ATOM 847 N GLY A 59 3.996 11.982 -0.408 1.00 0.00 N ATOM 848 CA GLY A 59 5.401 12.277 -0.199 1.00 0.00 C ATOM 849 C GLY A 59 6.255 11.816 -1.359 1.00 0.00 C ATOM 850 O GLY A 59 6.727 10.669 -1.372 1.00 0.00 O ATOM 0 H GLY A 59 3.712 11.056 -0.088 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.529 13.350 -0.058 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.741 11.793 0.716 1.00 0.00 H new ATOM 854 N ASN A 60 6.432 12.730 -2.329 1.00 0.00 N ATOM 855 CA ASN A 60 7.207 12.490 -3.550 1.00 0.00 C ATOM 856 C ASN A 60 8.701 12.406 -3.292 1.00 0.00 C ATOM 857 O ASN A 60 9.328 13.342 -2.793 1.00 0.00 O ATOM 858 CB ASN A 60 6.920 13.584 -4.586 1.00 0.00 C ATOM 859 CG ASN A 60 5.522 13.494 -5.152 1.00 0.00 C ATOM 860 OD1 ASN A 60 5.315 13.615 -6.360 1.00 0.00 O ATOM 861 ND2 ASN A 60 4.552 13.298 -4.275 1.00 0.00 N ATOM 0 H ASN A 60 6.034 13.668 -2.282 1.00 0.00 H new ATOM 0 HA ASN A 60 6.891 11.521 -3.936 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.059 14.562 -4.125 1.00 0.00 H new ATOM 0 HB3 ASN A 60 7.643 13.509 -5.398 1.00 0.00 H new ATOM 0 HD21 ASN A 60 3.584 13.241 -4.590 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.772 13.204 -3.284 1.00 0.00 H new ATOM 868 N GLY A 61 9.232 11.255 -3.664 1.00 0.00 N ATOM 869 CA GLY A 61 10.652 10.946 -3.512 1.00 0.00 C ATOM 870 C GLY A 61 11.522 11.544 -4.606 1.00 0.00 C ATOM 871 O GLY A 61 12.743 11.372 -4.599 1.00 0.00 O ATOM 0 H GLY A 61 8.690 10.500 -4.084 1.00 0.00 H new ATOM 0 HA2 GLY A 61 10.994 11.313 -2.545 1.00 0.00 H new ATOM 0 HA3 GLY A 61 10.782 9.864 -3.506 1.00 0.00 H new ATOM 875 N ALA A 62 10.885 12.244 -5.550 1.00 0.00 N ATOM 876 CA ALA A 62 11.579 12.863 -6.670 1.00 0.00 C ATOM 877 C ALA A 62 12.306 14.143 -6.280 1.00 0.00 C ATOM 878 O ALA A 62 13.367 14.455 -6.829 1.00 0.00 O ATOM 879 CB ALA A 62 10.596 13.148 -7.794 1.00 0.00 C ATOM 0 H ALA A 62 9.876 12.394 -5.554 1.00 0.00 H new ATOM 0 HA ALA A 62 12.337 12.156 -7.006 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.122 13.611 -8.629 1.00 0.00 H new ATOM 0 HB2 ALA A 62 10.141 12.214 -8.125 1.00 0.00 H new ATOM 0 HB3 ALA A 62 9.819 13.823 -7.435 1.00 0.00 H new ATOM 885 N ASN A 63 11.730 14.871 -5.326 1.00 0.00 N ATOM 886 CA ASN A 63 12.286 16.133 -4.875 1.00 0.00 C ATOM 887 C ASN A 63 12.211 16.288 -3.354 1.00 0.00 C ATOM 888 O ASN A 63 12.246 17.412 -2.835 1.00 0.00 O ATOM 889 CB ASN A 63 11.564 17.288 -5.550 1.00 0.00 C ATOM 890 CG ASN A 63 12.501 18.223 -6.268 1.00 0.00 C ATOM 891 OD1 ASN A 63 13.150 19.075 -5.660 1.00 0.00 O ATOM 892 ND2 ASN A 63 12.557 18.073 -7.579 1.00 0.00 N ATOM 0 H ASN A 63 10.870 14.600 -4.850 1.00 0.00 H new ATOM 0 HA ASN A 63 13.340 16.143 -5.152 1.00 0.00 H new ATOM 0 HB2 ASN A 63 10.839 16.891 -6.261 1.00 0.00 H new ATOM 0 HB3 ASN A 63 11.003 17.847 -4.801 1.00 0.00 H new ATOM 0 HD21 ASN A 63 13.159 18.679 -8.136 1.00 0.00 H new ATOM 0 HD22 ASN A 63 11.998 17.351 -8.034 1.00 0.00 H new ATOM 899 N HIS A 64 12.110 15.164 -2.635 1.00 0.00 N ATOM 900 CA HIS A 64 11.998 15.192 -1.205 1.00 0.00 C ATOM 901 C HIS A 64 13.348 15.432 -0.489 1.00 0.00 C ATOM 902 O HIS A 64 14.264 14.612 -0.603 1.00 0.00 O ATOM 903 CB HIS A 64 11.330 13.907 -0.689 1.00 0.00 C ATOM 904 CG HIS A 64 12.068 12.614 -0.952 1.00 0.00 C ATOM 905 ND1 HIS A 64 13.125 12.497 -1.834 1.00 0.00 N ATOM 906 CD2 HIS A 64 11.900 11.383 -0.411 1.00 0.00 C ATOM 907 CE1 HIS A 64 13.573 11.254 -1.821 1.00 0.00 C ATOM 908 NE2 HIS A 64 12.847 10.560 -0.967 1.00 0.00 N ATOM 0 H HIS A 64 12.105 14.228 -3.040 1.00 0.00 H new ATOM 0 HA HIS A 64 11.367 16.047 -0.963 1.00 0.00 H new ATOM 0 HB2 HIS A 64 11.186 14.005 0.387 1.00 0.00 H new ATOM 0 HB3 HIS A 64 10.340 13.833 -1.138 1.00 0.00 H new ATOM 0 HD2 HIS A 64 11.158 11.102 0.322 1.00 0.00 H new ATOM 0 HE1 HIS A 64 14.394 10.872 -2.410 1.00 0.00 H new ATOM 0 HE2 HIS A 64 12.970 9.570 -0.754 1.00 0.00 H new ATOM 917 N PRO A 65 13.496 16.573 0.251 1.00 0.00 N ATOM 918 CA PRO A 65 14.701 16.889 1.019 1.00 0.00 C ATOM 919 C PRO A 65 14.876 15.946 2.177 1.00 0.00 C ATOM 920 O PRO A 65 13.979 15.198 2.508 1.00 0.00 O ATOM 921 CB PRO A 65 14.441 18.308 1.555 1.00 0.00 C ATOM 922 CG PRO A 65 13.387 18.843 0.684 1.00 0.00 C ATOM 923 CD PRO A 65 12.524 17.668 0.401 1.00 0.00 C ATOM 0 HA PRO A 65 15.601 16.808 0.409 1.00 0.00 H new ATOM 0 HB2 PRO A 65 14.122 18.286 2.597 1.00 0.00 H new ATOM 0 HB3 PRO A 65 15.342 18.920 1.510 1.00 0.00 H new ATOM 0 HG2 PRO A 65 12.828 19.639 1.176 1.00 0.00 H new ATOM 0 HG3 PRO A 65 13.802 19.264 -0.232 1.00 0.00 H new ATOM 0 HD2 PRO A 65 11.823 17.477 1.213 1.00 0.00 H new ATOM 0 HD3 PRO A 65 11.933 17.810 -0.504 1.00 0.00 H new ATOM 931 N TRP A 66 16.063 15.908 2.711 1.00 0.00 N ATOM 932 CA TRP A 66 16.325 15.103 3.882 1.00 0.00 C ATOM 933 C TRP A 66 16.251 16.011 5.102 1.00 0.00 C ATOM 934 O TRP A 66 16.603 15.620 6.222 1.00 0.00 O ATOM 935 CB TRP A 66 17.678 14.416 3.827 1.00 0.00 C ATOM 936 CG TRP A 66 17.830 13.441 2.692 1.00 0.00 C ATOM 937 CD1 TRP A 66 18.007 13.744 1.371 1.00 0.00 C ATOM 938 CD2 TRP A 66 17.811 12.007 2.775 1.00 0.00 C ATOM 939 NE1 TRP A 66 18.093 12.591 0.630 1.00 0.00 N ATOM 940 CE2 TRP A 66 17.979 11.513 1.467 1.00 0.00 C ATOM 941 CE3 TRP A 66 17.669 11.090 3.826 1.00 0.00 C ATOM 942 CZ2 TRP A 66 18.007 10.150 1.183 1.00 0.00 C ATOM 943 CZ3 TRP A 66 17.698 9.738 3.540 1.00 0.00 C ATOM 944 CH2 TRP A 66 17.866 9.280 2.228 1.00 0.00 C ATOM 0 H TRP A 66 16.869 16.424 2.358 1.00 0.00 H new ATOM 0 HA TRP A 66 15.578 14.311 3.933 1.00 0.00 H new ATOM 0 HB2 TRP A 66 18.455 15.176 3.745 1.00 0.00 H new ATOM 0 HB3 TRP A 66 17.844 13.890 4.767 1.00 0.00 H new ATOM 0 HD1 TRP A 66 18.070 14.744 0.969 1.00 0.00 H new ATOM 0 HE1 TRP A 66 18.221 12.545 -0.381 1.00 0.00 H new ATOM 0 HE3 TRP A 66 17.539 11.434 4.841 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 18.136 9.793 0.172 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 17.589 9.023 4.342 1.00 0.00 H new ATOM 0 HH2 TRP A 66 17.885 8.217 2.037 1.00 0.00 H new ATOM 955 N MET A 67 15.753 17.237 4.857 1.00 0.00 N ATOM 956 CA MET A 67 15.612 18.241 5.891 1.00 0.00 C ATOM 957 C MET A 67 14.410 17.935 6.755 1.00 0.00 C ATOM 958 O MET A 67 14.487 17.998 7.987 1.00 0.00 O ATOM 959 CB MET A 67 15.498 19.637 5.278 1.00 0.00 C ATOM 960 CG MET A 67 16.563 20.605 5.764 1.00 0.00 C ATOM 961 SD MET A 67 16.389 22.245 5.037 1.00 0.00 S ATOM 962 CE MET A 67 17.782 23.090 5.776 1.00 0.00 C ATOM 0 H MET A 67 15.442 17.544 3.935 1.00 0.00 H new ATOM 0 HA MET A 67 16.503 18.221 6.518 1.00 0.00 H new ATOM 0 HB2 MET A 67 15.562 19.554 4.193 1.00 0.00 H new ATOM 0 HB3 MET A 67 14.515 20.047 5.509 1.00 0.00 H new ATOM 0 HG2 MET A 67 16.509 20.685 6.850 1.00 0.00 H new ATOM 0 HG3 MET A 67 17.549 20.207 5.523 1.00 0.00 H new ATOM 0 HE1 MET A 67 17.811 24.121 5.423 1.00 0.00 H new ATOM 0 HE2 MET A 67 17.679 23.081 6.861 1.00 0.00 H new ATOM 0 HE3 MET A 67 18.706 22.584 5.495 1.00 0.00 H new ATOM 972 N LEU A 68 13.307 17.592 6.100 1.00 0.00 N ATOM 973 CA LEU A 68 12.110 17.226 6.815 1.00 0.00 C ATOM 974 C LEU A 68 11.704 15.797 6.445 1.00 0.00 C ATOM 975 O LEU A 68 10.597 15.358 6.782 1.00 0.00 O ATOM 976 CB LEU A 68 10.974 18.259 6.589 1.00 0.00 C ATOM 977 CG LEU A 68 10.417 18.409 5.171 1.00 0.00 C ATOM 978 CD1 LEU A 68 9.174 17.538 4.993 1.00 0.00 C ATOM 979 CD2 LEU A 68 10.088 19.867 4.883 1.00 0.00 C ATOM 0 H LEU A 68 13.225 17.562 5.084 1.00 0.00 H new ATOM 0 HA LEU A 68 12.312 17.243 7.886 1.00 0.00 H new ATOM 0 HB2 LEU A 68 10.146 17.996 7.248 1.00 0.00 H new ATOM 0 HB3 LEU A 68 11.340 19.234 6.910 1.00 0.00 H new ATOM 0 HG LEU A 68 11.177 18.078 4.463 1.00 0.00 H new ATOM 0 HD11 LEU A 68 8.789 17.655 3.980 1.00 0.00 H new ATOM 0 HD12 LEU A 68 9.434 16.493 5.164 1.00 0.00 H new ATOM 0 HD13 LEU A 68 8.410 17.843 5.708 1.00 0.00 H new ATOM 0 HD21 LEU A 68 9.693 19.958 3.871 1.00 0.00 H new ATOM 0 HD22 LEU A 68 9.343 20.220 5.596 1.00 0.00 H new ATOM 0 HD23 LEU A 68 10.992 20.469 4.975 1.00 0.00 H new ATOM 991 N TRP A 69 12.612 15.062 5.747 1.00 0.00 N ATOM 992 CA TRP A 69 12.301 13.696 5.336 1.00 0.00 C ATOM 993 C TRP A 69 13.402 12.728 5.750 1.00 0.00 C ATOM 994 O TRP A 69 14.586 13.077 5.748 1.00 0.00 O ATOM 995 CB TRP A 69 12.049 13.604 3.814 1.00 0.00 C ATOM 996 CG TRP A 69 11.296 14.781 3.224 1.00 0.00 C ATOM 997 CD1 TRP A 69 11.687 16.090 3.248 1.00 0.00 C ATOM 998 CD2 TRP A 69 10.054 14.758 2.511 1.00 0.00 C ATOM 999 NE1 TRP A 69 10.759 16.876 2.640 1.00 0.00 N ATOM 1000 CE2 TRP A 69 9.750 16.089 2.165 1.00 0.00 C ATOM 1001 CE3 TRP A 69 9.163 13.752 2.139 1.00 0.00 C ATOM 1002 CZ2 TRP A 69 8.601 16.438 1.470 1.00 0.00 C ATOM 1003 CZ3 TRP A 69 8.024 14.102 1.446 1.00 0.00 C ATOM 1004 CH2 TRP A 69 7.751 15.435 1.117 1.00 0.00 C ATOM 0 H TRP A 69 13.536 15.395 5.471 1.00 0.00 H new ATOM 0 HA TRP A 69 11.383 13.410 5.849 1.00 0.00 H new ATOM 0 HB2 TRP A 69 13.009 13.512 3.305 1.00 0.00 H new ATOM 0 HB3 TRP A 69 11.490 12.692 3.607 1.00 0.00 H new ATOM 0 HD1 TRP A 69 12.605 16.450 3.688 1.00 0.00 H new ATOM 0 HE1 TRP A 69 10.809 17.891 2.553 1.00 0.00 H new ATOM 0 HE3 TRP A 69 9.361 12.720 2.389 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 8.389 17.467 1.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 7.327 13.331 1.151 1.00 0.00 H new ATOM 0 HH2 TRP A 69 6.849 15.672 0.573 1.00 0.00 H new ATOM 1015 N MET A 70 12.983 11.528 6.167 1.00 0.00 N ATOM 1016 CA MET A 70 13.904 10.470 6.593 1.00 0.00 C ATOM 1017 C MET A 70 13.385 9.090 6.190 1.00 0.00 C ATOM 1018 O MET A 70 14.175 8.173 5.951 1.00 0.00 O ATOM 1019 CB MET A 70 14.128 10.518 8.108 1.00 0.00 C ATOM 1020 CG MET A 70 15.260 11.443 8.525 1.00 0.00 C ATOM 1021 SD MET A 70 16.868 10.873 7.939 1.00 0.00 S ATOM 1022 CE MET A 70 17.964 11.993 8.805 1.00 0.00 C ATOM 0 H MET A 70 11.999 11.264 6.218 1.00 0.00 H new ATOM 0 HA MET A 70 14.855 10.643 6.090 1.00 0.00 H new ATOM 0 HB2 MET A 70 13.207 10.842 8.593 1.00 0.00 H new ATOM 0 HB3 MET A 70 14.341 9.511 8.468 1.00 0.00 H new ATOM 0 HG2 MET A 70 15.069 12.444 8.137 1.00 0.00 H new ATOM 0 HG3 MET A 70 15.280 11.521 9.612 1.00 0.00 H new ATOM 0 HE1 MET A 70 18.997 11.765 8.544 1.00 0.00 H new ATOM 0 HE2 MET A 70 17.736 13.020 8.519 1.00 0.00 H new ATOM 0 HE3 MET A 70 17.827 11.877 9.880 1.00 0.00 H new ATOM 1032 N ALA A 71 12.052 8.962 6.090 1.00 0.00 N ATOM 1033 CA ALA A 71 11.407 7.694 5.722 1.00 0.00 C ATOM 1034 C ALA A 71 11.317 7.514 4.208 1.00 0.00 C ATOM 1035 O ALA A 71 11.247 6.385 3.713 1.00 0.00 O ATOM 1036 CB ALA A 71 10.024 7.609 6.349 1.00 0.00 C ATOM 0 H ALA A 71 11.398 9.726 6.260 1.00 0.00 H new ATOM 0 HA ALA A 71 12.028 6.885 6.108 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.555 6.665 6.070 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.112 7.663 7.434 1.00 0.00 H new ATOM 0 HB3 ALA A 71 9.412 8.438 5.993 1.00 0.00 H new ATOM 1042 N GLY A 72 11.328 8.635 3.491 1.00 0.00 N ATOM 1043 CA GLY A 72 11.269 8.609 2.038 1.00 0.00 C ATOM 1044 C GLY A 72 9.891 8.893 1.469 1.00 0.00 C ATOM 1045 O GLY A 72 9.257 9.892 1.821 1.00 0.00 O ATOM 0 H GLY A 72 11.377 9.570 3.895 1.00 0.00 H new ATOM 0 HA2 GLY A 72 11.972 9.343 1.643 1.00 0.00 H new ATOM 0 HA3 GLY A 72 11.600 7.631 1.689 1.00 0.00 H new ATOM 1049 N ASN A 73 9.438 7.993 0.582 1.00 0.00 N ATOM 1050 CA ASN A 73 8.149 8.111 -0.089 1.00 0.00 C ATOM 1051 C ASN A 73 7.014 7.544 0.750 1.00 0.00 C ATOM 1052 O ASN A 73 7.133 6.455 1.321 1.00 0.00 O ATOM 1053 CB ASN A 73 8.178 7.379 -1.429 1.00 0.00 C ATOM 1054 CG ASN A 73 9.071 8.039 -2.457 1.00 0.00 C ATOM 1055 OD1 ASN A 73 8.592 8.706 -3.371 1.00 0.00 O ATOM 1056 ND2 ASN A 73 10.375 7.846 -2.314 1.00 0.00 N ATOM 0 H ASN A 73 9.964 7.161 0.314 1.00 0.00 H new ATOM 0 HA ASN A 73 7.970 9.175 -0.242 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.517 6.356 -1.268 1.00 0.00 H new ATOM 0 HB3 ASN A 73 7.164 7.320 -1.824 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.028 8.260 -2.980 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.725 7.284 -1.538 1.00 0.00 H new ATOM 1063 N ALA A 74 5.899 8.279 0.785 1.00 0.00 N ATOM 1064 CA ALA A 74 4.726 7.866 1.546 1.00 0.00 C ATOM 1065 C ALA A 74 3.448 8.384 0.908 1.00 0.00 C ATOM 1066 O ALA A 74 3.432 9.470 0.330 1.00 0.00 O ATOM 1067 CB ALA A 74 4.823 8.325 2.998 1.00 0.00 C ATOM 0 H ALA A 74 5.788 9.165 0.292 1.00 0.00 H new ATOM 0 HA ALA A 74 4.694 6.777 1.535 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.935 8.003 3.541 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.709 7.888 3.459 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.895 9.412 3.032 1.00 0.00 H new ATOM 1073 N VAL A 75 2.372 7.600 1.031 1.00 0.00 N ATOM 1074 CA VAL A 75 1.078 7.964 0.457 1.00 0.00 C ATOM 1075 C VAL A 75 -0.048 7.598 1.410 1.00 0.00 C ATOM 1076 O VAL A 75 -0.228 6.432 1.753 1.00 0.00 O ATOM 1077 CB VAL A 75 0.779 7.274 -0.913 1.00 0.00 C ATOM 1078 CG1 VAL A 75 -0.126 8.154 -1.766 1.00 0.00 C ATOM 1079 CG2 VAL A 75 2.045 6.927 -1.686 1.00 0.00 C ATOM 0 H VAL A 75 2.375 6.707 1.525 1.00 0.00 H new ATOM 0 HA VAL A 75 1.132 9.040 0.292 1.00 0.00 H new ATOM 0 HB VAL A 75 0.271 6.336 -0.687 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.324 7.659 -2.716 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.067 8.324 -1.242 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.365 9.110 -1.950 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.777 6.450 -2.629 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.609 7.838 -1.888 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.656 6.245 -1.096 1.00 0.00 H new ATOM 1089 N LEU A 76 -0.811 8.602 1.808 1.00 0.00 N ATOM 1090 CA LEU A 76 -1.946 8.402 2.676 1.00 0.00 C ATOM 1091 C LEU A 76 -3.164 8.817 1.924 1.00 0.00 C ATOM 1092 O LEU A 76 -3.240 9.907 1.361 1.00 0.00 O ATOM 1093 CB LEU A 76 -1.823 9.171 3.982 1.00 0.00 C ATOM 1094 CG LEU A 76 -2.180 8.397 5.258 1.00 0.00 C ATOM 1095 CD1 LEU A 76 -1.147 8.659 6.343 1.00 0.00 C ATOM 1096 CD2 LEU A 76 -3.569 8.775 5.752 1.00 0.00 C ATOM 0 H LEU A 76 -0.657 9.573 1.537 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.003 7.351 2.958 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -0.798 9.529 4.074 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.464 10.051 3.924 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.179 7.333 5.021 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -1.414 8.103 7.242 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.165 8.337 5.996 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -1.120 9.725 6.570 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.799 8.213 6.657 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -3.600 9.843 5.970 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.305 8.541 4.983 1.00 0.00 H new ATOM 1108 N ILE A 77 -4.092 7.906 1.928 1.00 0.00 N ATOM 1109 CA ILE A 77 -5.332 8.019 1.215 1.00 0.00 C ATOM 1110 C ILE A 77 -6.486 7.497 2.064 1.00 0.00 C ATOM 1111 O ILE A 77 -6.318 6.632 2.926 1.00 0.00 O ATOM 1112 CB ILE A 77 -5.239 7.239 -0.137 1.00 0.00 C ATOM 1113 CG1 ILE A 77 -4.326 7.975 -1.124 1.00 0.00 C ATOM 1114 CG2 ILE A 77 -6.609 6.983 -0.786 1.00 0.00 C ATOM 1115 CD1 ILE A 77 -3.489 7.058 -1.999 1.00 0.00 C ATOM 0 H ILE A 77 -4.004 7.032 2.446 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.523 9.070 0.999 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.813 6.265 0.104 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.938 8.610 -1.764 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.660 8.633 -0.565 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.473 6.438 -1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -7.228 6.394 -0.109 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.099 7.935 -0.989 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.872 7.657 -2.668 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.848 6.440 -1.370 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.146 6.417 -2.588 1.00 0.00 H new ATOM 1127 N GLN A 78 -7.641 8.075 1.807 1.00 0.00 N ATOM 1128 CA GLN A 78 -8.876 7.722 2.446 1.00 0.00 C ATOM 1129 C GLN A 78 -9.659 6.811 1.507 1.00 0.00 C ATOM 1130 O GLN A 78 -10.055 7.209 0.411 1.00 0.00 O ATOM 1131 CB GLN A 78 -9.682 8.973 2.795 1.00 0.00 C ATOM 1132 CG GLN A 78 -11.035 8.677 3.429 1.00 0.00 C ATOM 1133 CD GLN A 78 -12.129 9.532 2.863 1.00 0.00 C ATOM 1134 OE1 GLN A 78 -12.454 10.601 3.380 1.00 0.00 O ATOM 1135 NE2 GLN A 78 -12.689 9.047 1.778 1.00 0.00 N ATOM 0 H GLN A 78 -7.741 8.827 1.125 1.00 0.00 H new ATOM 0 HA GLN A 78 -8.674 7.198 3.380 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.099 9.591 3.478 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.836 9.559 1.889 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -11.283 7.626 3.277 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -10.972 8.837 4.505 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -12.375 8.154 1.397 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -13.438 9.563 1.316 1.00 0.00 H new ATOM 1144 N HIS A 79 -9.863 5.595 1.969 1.00 0.00 N ATOM 1145 CA HIS A 79 -10.566 4.557 1.219 1.00 0.00 C ATOM 1146 C HIS A 79 -12.050 4.824 1.026 1.00 0.00 C ATOM 1147 O HIS A 79 -12.572 5.871 1.417 1.00 0.00 O ATOM 1148 CB HIS A 79 -10.358 3.193 1.873 1.00 0.00 C ATOM 1149 CG HIS A 79 -9.109 2.497 1.428 1.00 0.00 C ATOM 1150 ND1 HIS A 79 -8.532 2.712 0.196 1.00 0.00 N ATOM 1151 CD2 HIS A 79 -8.323 1.592 2.056 1.00 0.00 C ATOM 1152 CE1 HIS A 79 -7.443 1.973 0.084 1.00 0.00 C ATOM 1153 NE2 HIS A 79 -7.295 1.284 1.198 1.00 0.00 N ATOM 0 H HIS A 79 -9.544 5.289 2.888 1.00 0.00 H new ATOM 0 HA HIS A 79 -10.127 4.566 0.221 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -10.327 3.320 2.955 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -11.216 2.559 1.651 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -8.890 3.344 -0.520 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -8.475 1.188 3.046 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -6.787 1.939 -0.773 1.00 0.00 H new ATOM 1162 N ALA A 80 -12.706 3.835 0.412 1.00 0.00 N ATOM 1163 CA ALA A 80 -14.117 3.901 0.078 1.00 0.00 C ATOM 1164 C ALA A 80 -15.054 3.935 1.291 1.00 0.00 C ATOM 1165 O ALA A 80 -16.219 4.325 1.163 1.00 0.00 O ATOM 1166 CB ALA A 80 -14.496 2.751 -0.843 1.00 0.00 C ATOM 0 H ALA A 80 -12.261 2.961 0.133 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.254 4.855 -0.431 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -15.557 2.813 -1.085 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.910 2.811 -1.760 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -14.293 1.803 -0.344 1.00 0.00 H new ATOM 1172 N ASP A 81 -14.540 3.540 2.454 1.00 0.00 N ATOM 1173 CA ASP A 81 -15.322 3.516 3.681 1.00 0.00 C ATOM 1174 C ASP A 81 -15.002 4.720 4.558 1.00 0.00 C ATOM 1175 O ASP A 81 -15.682 4.975 5.558 1.00 0.00 O ATOM 1176 CB ASP A 81 -15.091 2.223 4.443 1.00 0.00 C ATOM 1177 CG ASP A 81 -16.327 1.348 4.483 1.00 0.00 C ATOM 1178 OD1 ASP A 81 -16.551 0.592 3.514 1.00 0.00 O ATOM 1179 OD2 ASP A 81 -17.073 1.420 5.482 1.00 0.00 O ATOM 0 H ASP A 81 -13.575 3.230 2.569 1.00 0.00 H new ATOM 0 HA ASP A 81 -16.376 3.568 3.407 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -14.274 1.672 3.978 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.780 2.455 5.462 1.00 0.00 H new ATOM 1184 N GLY A 82 -13.962 5.456 4.160 1.00 0.00 N ATOM 1185 CA GLY A 82 -13.545 6.642 4.877 1.00 0.00 C ATOM 1186 C GLY A 82 -12.296 6.403 5.690 1.00 0.00 C ATOM 1187 O GLY A 82 -11.732 7.341 6.260 1.00 0.00 O ATOM 0 H GLY A 82 -13.396 5.242 3.339 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.366 7.450 4.168 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.349 6.968 5.536 1.00 0.00 H new ATOM 1191 N MET A 83 -11.864 5.136 5.734 1.00 0.00 N ATOM 1192 CA MET A 83 -10.681 4.725 6.443 1.00 0.00 C ATOM 1193 C MET A 83 -9.418 5.283 5.789 1.00 0.00 C ATOM 1194 O MET A 83 -9.480 5.800 4.671 1.00 0.00 O ATOM 1195 CB MET A 83 -10.639 3.195 6.528 1.00 0.00 C ATOM 1196 CG MET A 83 -11.020 2.449 5.250 1.00 0.00 C ATOM 1197 SD MET A 83 -11.991 0.964 5.566 1.00 0.00 S ATOM 1198 CE MET A 83 -12.098 0.284 3.912 1.00 0.00 C ATOM 0 H MET A 83 -12.345 4.368 5.266 1.00 0.00 H new ATOM 0 HA MET A 83 -10.718 5.131 7.454 1.00 0.00 H new ATOM 0 HB2 MET A 83 -9.632 2.893 6.816 1.00 0.00 H new ATOM 0 HB3 MET A 83 -11.309 2.875 7.327 1.00 0.00 H new ATOM 0 HG2 MET A 83 -11.587 3.116 4.601 1.00 0.00 H new ATOM 0 HG3 MET A 83 -10.113 2.176 4.711 1.00 0.00 H new ATOM 0 HE1 MET A 83 -13.145 0.195 3.622 1.00 0.00 H new ATOM 0 HE2 MET A 83 -11.583 0.944 3.213 1.00 0.00 H new ATOM 0 HE3 MET A 83 -11.631 -0.701 3.893 1.00 0.00 H new ATOM 1208 N HIS A 84 -8.283 5.169 6.476 1.00 0.00 N ATOM 1209 CA HIS A 84 -7.049 5.691 5.948 1.00 0.00 C ATOM 1210 C HIS A 84 -6.073 4.570 5.630 1.00 0.00 C ATOM 1211 O HIS A 84 -6.037 3.558 6.333 1.00 0.00 O ATOM 1212 CB HIS A 84 -6.412 6.681 6.923 1.00 0.00 C ATOM 1213 CG HIS A 84 -7.140 7.986 7.035 1.00 0.00 C ATOM 1214 ND1 HIS A 84 -6.731 9.135 6.390 1.00 0.00 N ATOM 1215 CD2 HIS A 84 -8.248 8.324 7.736 1.00 0.00 C ATOM 1216 CE1 HIS A 84 -7.556 10.123 6.690 1.00 0.00 C ATOM 1217 NE2 HIS A 84 -8.484 9.657 7.504 1.00 0.00 N ATOM 0 H HIS A 84 -8.204 4.722 7.390 1.00 0.00 H new ATOM 0 HA HIS A 84 -7.284 6.217 5.023 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -6.361 6.220 7.910 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -5.387 6.875 6.608 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -8.836 7.668 8.361 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -7.483 11.139 6.330 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -9.253 10.199 7.898 1.00 0.00 H new ATOM 1226 N THR A 85 -5.284 4.754 4.566 1.00 0.00 N ATOM 1227 CA THR A 85 -4.314 3.779 4.156 1.00 0.00 C ATOM 1228 C THR A 85 -3.047 4.463 3.690 1.00 0.00 C ATOM 1229 O THR A 85 -3.085 5.367 2.849 1.00 0.00 O ATOM 1230 CB THR A 85 -4.847 2.903 3.017 1.00 0.00 C ATOM 1231 OG1 THR A 85 -6.024 3.485 2.439 1.00 0.00 O ATOM 1232 CG2 THR A 85 -5.153 1.502 3.516 1.00 0.00 C ATOM 0 H THR A 85 -5.313 5.587 3.978 1.00 0.00 H new ATOM 0 HA THR A 85 -4.104 3.148 5.019 1.00 0.00 H new ATOM 0 HB THR A 85 -4.075 2.840 2.251 1.00 0.00 H new ATOM 0 HG1 THR A 85 -5.866 3.668 1.489 1.00 0.00 H new ATOM 0 HG21 THR A 85 -5.530 0.897 2.692 1.00 0.00 H new ATOM 0 HG22 THR A 85 -4.244 1.050 3.912 1.00 0.00 H new ATOM 0 HG23 THR A 85 -5.905 1.552 4.303 1.00 0.00 H new ATOM 1240 N GLY A 86 -1.938 4.039 4.266 1.00 0.00 N ATOM 1241 CA GLY A 86 -0.651 4.574 3.898 1.00 0.00 C ATOM 1242 C GLY A 86 0.141 3.592 3.067 1.00 0.00 C ATOM 1243 O GLY A 86 -0.074 2.376 3.156 1.00 0.00 O ATOM 0 H GLY A 86 -1.908 3.323 4.992 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -0.787 5.499 3.338 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.090 4.826 4.798 1.00 0.00 H new ATOM 1247 N TYR A 87 1.059 4.132 2.266 1.00 0.00 N ATOM 1248 CA TYR A 87 1.918 3.369 1.401 1.00 0.00 C ATOM 1249 C TYR A 87 3.314 3.954 1.599 1.00 0.00 C ATOM 1250 O TYR A 87 3.636 5.025 1.066 1.00 0.00 O ATOM 1251 CB TYR A 87 1.454 3.471 -0.079 1.00 0.00 C ATOM 1252 CG TYR A 87 -0.008 3.085 -0.354 1.00 0.00 C ATOM 1253 CD1 TYR A 87 -0.318 1.961 -1.120 1.00 0.00 C ATOM 1254 CD2 TYR A 87 -1.076 3.845 0.138 1.00 0.00 C ATOM 1255 CE1 TYR A 87 -1.637 1.611 -1.382 1.00 0.00 C ATOM 1256 CE2 TYR A 87 -2.387 3.492 -0.120 1.00 0.00 C ATOM 1257 CZ TYR A 87 -2.661 2.378 -0.878 1.00 0.00 C ATOM 1258 OH TYR A 87 -3.967 2.030 -1.135 1.00 0.00 O ATOM 0 H TYR A 87 1.219 5.138 2.209 1.00 0.00 H new ATOM 0 HA TYR A 87 1.898 2.306 1.641 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.609 4.495 -0.418 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.098 2.834 -0.686 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.481 1.352 -1.516 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -0.871 4.724 0.731 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.857 0.739 -1.980 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -3.195 4.090 0.273 1.00 0.00 H new ATOM 0 HH TYR A 87 -4.568 2.675 -0.706 1.00 0.00 H new ATOM 1268 N ALA A 88 4.119 3.285 2.421 1.00 0.00 N ATOM 1269 CA ALA A 88 5.455 3.782 2.731 1.00 0.00 C ATOM 1270 C ALA A 88 6.558 2.895 2.171 1.00 0.00 C ATOM 1271 O ALA A 88 6.319 1.752 1.767 1.00 0.00 O ATOM 1272 CB ALA A 88 5.608 3.974 4.240 1.00 0.00 C ATOM 0 H ALA A 88 3.873 2.408 2.879 1.00 0.00 H new ATOM 0 HA ALA A 88 5.565 4.748 2.239 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.609 4.345 4.460 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.869 4.693 4.592 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.456 3.020 4.745 1.00 0.00 H new ATOM 1278 N HIS A 89 7.788 3.450 2.186 1.00 0.00 N ATOM 1279 CA HIS A 89 9.010 2.790 1.679 1.00 0.00 C ATOM 1280 C HIS A 89 8.950 2.571 0.156 1.00 0.00 C ATOM 1281 O HIS A 89 9.337 1.521 -0.359 1.00 0.00 O ATOM 1282 CB HIS A 89 9.291 1.470 2.430 1.00 0.00 C ATOM 1283 CG HIS A 89 9.654 1.674 3.870 1.00 0.00 C ATOM 1284 ND1 HIS A 89 8.727 1.984 4.843 1.00 0.00 N ATOM 1285 CD2 HIS A 89 10.853 1.626 4.498 1.00 0.00 C ATOM 1286 CE1 HIS A 89 9.339 2.120 6.005 1.00 0.00 C ATOM 1287 NE2 HIS A 89 10.629 1.907 5.823 1.00 0.00 N ATOM 0 H HIS A 89 7.963 4.384 2.557 1.00 0.00 H new ATOM 0 HA HIS A 89 9.845 3.463 1.874 1.00 0.00 H new ATOM 0 HB2 HIS A 89 8.409 0.832 2.371 1.00 0.00 H new ATOM 0 HB3 HIS A 89 10.102 0.940 1.929 1.00 0.00 H new ATOM 0 HD2 HIS A 89 11.807 1.407 4.042 1.00 0.00 H new ATOM 0 HE1 HIS A 89 8.865 2.364 6.944 1.00 0.00 H new ATOM 0 HE2 HIS A 89 11.344 1.945 6.550 1.00 0.00 H new ATOM 1296 N LEU A 90 8.442 3.589 -0.543 1.00 0.00 N ATOM 1297 CA LEU A 90 8.341 3.595 -1.994 1.00 0.00 C ATOM 1298 C LEU A 90 9.471 4.434 -2.596 1.00 0.00 C ATOM 1299 O LEU A 90 10.159 5.160 -1.872 1.00 0.00 O ATOM 1300 CB LEU A 90 6.963 4.130 -2.430 1.00 0.00 C ATOM 1301 CG LEU A 90 5.754 3.625 -1.621 1.00 0.00 C ATOM 1302 CD1 LEU A 90 4.547 4.505 -1.882 1.00 0.00 C ATOM 1303 CD2 LEU A 90 5.442 2.173 -1.951 1.00 0.00 C ATOM 0 H LEU A 90 8.087 4.440 -0.107 1.00 0.00 H new ATOM 0 HA LEU A 90 8.440 2.574 -2.362 1.00 0.00 H new ATOM 0 HB2 LEU A 90 6.984 5.218 -2.373 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.809 3.869 -3.477 1.00 0.00 H new ATOM 0 HG LEU A 90 6.004 3.678 -0.561 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.698 4.139 -1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.773 5.529 -1.585 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.302 4.480 -2.944 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.584 1.843 -1.365 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.213 2.082 -3.013 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.305 1.552 -1.712 1.00 0.00 H new ATOM 1315 N SER A 91 9.678 4.309 -3.909 1.00 0.00 N ATOM 1316 CA SER A 91 10.719 5.050 -4.597 1.00 0.00 C ATOM 1317 C SER A 91 10.163 6.261 -5.342 1.00 0.00 C ATOM 1318 O SER A 91 10.926 7.152 -5.730 1.00 0.00 O ATOM 1319 CB SER A 91 11.477 4.144 -5.573 1.00 0.00 C ATOM 1320 OG SER A 91 12.646 4.779 -6.063 1.00 0.00 O ATOM 0 H SER A 91 9.131 3.696 -4.513 1.00 0.00 H new ATOM 0 HA SER A 91 11.407 5.412 -3.833 1.00 0.00 H new ATOM 0 HB2 SER A 91 11.748 3.214 -5.073 1.00 0.00 H new ATOM 0 HB3 SER A 91 10.827 3.880 -6.407 1.00 0.00 H new ATOM 0 HG SER A 91 12.498 5.747 -6.108 1.00 0.00 H new ATOM 1326 N LYS A 92 8.833 6.304 -5.526 1.00 0.00 N ATOM 1327 CA LYS A 92 8.188 7.388 -6.250 1.00 0.00 C ATOM 1328 C LYS A 92 6.682 7.364 -6.080 1.00 0.00 C ATOM 1329 O LYS A 92 6.086 6.346 -5.718 1.00 0.00 O ATOM 1330 CB LYS A 92 8.510 7.328 -7.749 1.00 0.00 C ATOM 1331 CG LYS A 92 9.315 8.506 -8.248 1.00 0.00 C ATOM 1332 CD LYS A 92 10.166 8.104 -9.437 1.00 0.00 C ATOM 1333 CE LYS A 92 10.782 9.312 -10.123 1.00 0.00 C ATOM 1334 NZ LYS A 92 11.745 8.916 -11.188 1.00 0.00 N ATOM 0 H LYS A 92 8.190 5.593 -5.178 1.00 0.00 H new ATOM 0 HA LYS A 92 8.581 8.312 -5.826 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.060 6.410 -7.956 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.577 7.274 -8.310 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.645 9.318 -8.531 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.952 8.883 -7.448 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.957 7.431 -9.107 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.555 7.552 -10.151 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.992 9.924 -10.558 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.293 9.928 -9.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.143 9.769 -11.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.513 8.353 -10.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 11.253 8.349 -11.908 1.00 0.00 H new ATOM 1348 N ILE A 93 6.100 8.516 -6.358 1.00 0.00 N ATOM 1349 CA ILE A 93 4.673 8.731 -6.293 1.00 0.00 C ATOM 1350 C ILE A 93 4.151 9.299 -7.610 1.00 0.00 C ATOM 1351 O ILE A 93 4.855 10.024 -8.320 1.00 0.00 O ATOM 1352 CB ILE A 93 4.311 9.676 -5.108 1.00 0.00 C ATOM 1353 CG1 ILE A 93 3.867 8.892 -3.877 1.00 0.00 C ATOM 1354 CG2 ILE A 93 3.263 10.713 -5.458 1.00 0.00 C ATOM 1355 CD1 ILE A 93 5.005 8.538 -2.938 1.00 0.00 C ATOM 0 H ILE A 93 6.622 9.345 -6.642 1.00 0.00 H new ATOM 0 HA ILE A 93 4.193 7.768 -6.122 1.00 0.00 H new ATOM 0 HB ILE A 93 5.233 10.212 -4.881 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.126 9.477 -3.332 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.374 7.975 -4.199 1.00 0.00 H new ATOM 0 HG21 ILE A 93 3.061 11.335 -4.586 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.628 11.338 -6.273 1.00 0.00 H new ATOM 0 HG23 ILE A 93 2.345 10.213 -5.767 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.614 7.982 -2.086 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.736 7.926 -3.467 1.00 0.00 H new ATOM 0 HD13 ILE A 93 5.484 9.452 -2.586 1.00 0.00 H new ATOM 1367 N SER A 94 2.914 8.941 -7.910 1.00 0.00 N ATOM 1368 CA SER A 94 2.219 9.402 -9.088 1.00 0.00 C ATOM 1369 C SER A 94 1.065 10.313 -8.691 1.00 0.00 C ATOM 1370 O SER A 94 0.397 10.906 -9.548 1.00 0.00 O ATOM 1371 CB SER A 94 1.648 8.219 -9.837 1.00 0.00 C ATOM 1372 OG SER A 94 1.447 8.520 -11.207 1.00 0.00 O ATOM 0 H SER A 94 2.360 8.312 -7.329 1.00 0.00 H new ATOM 0 HA SER A 94 2.925 9.946 -9.716 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.324 7.369 -9.746 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.701 7.924 -9.385 1.00 0.00 H new ATOM 0 HG SER A 94 0.998 9.387 -11.289 1.00 0.00 H new ATOM 1378 N VAL A 95 0.841 10.408 -7.381 1.00 0.00 N ATOM 1379 CA VAL A 95 -0.229 11.164 -6.835 1.00 0.00 C ATOM 1380 C VAL A 95 0.239 12.486 -6.227 1.00 0.00 C ATOM 1381 O VAL A 95 1.414 12.853 -6.311 1.00 0.00 O ATOM 1382 CB VAL A 95 -1.032 10.350 -5.792 1.00 0.00 C ATOM 1383 CG1 VAL A 95 -2.238 9.702 -6.447 1.00 0.00 C ATOM 1384 CG2 VAL A 95 -0.175 9.302 -5.084 1.00 0.00 C ATOM 0 H VAL A 95 1.419 9.947 -6.679 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.888 11.400 -7.671 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.372 11.049 -5.028 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.794 9.132 -5.702 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.882 10.474 -6.869 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.905 9.033 -7.241 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.786 8.759 -4.363 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.226 8.604 -5.818 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.647 9.795 -4.565 1.00 0.00 H new ATOM 1394 N SER A 96 -0.712 13.187 -5.613 1.00 0.00 N ATOM 1395 CA SER A 96 -0.495 14.476 -4.993 1.00 0.00 C ATOM 1396 C SER A 96 -1.542 14.690 -3.921 1.00 0.00 C ATOM 1397 O SER A 96 -2.696 14.287 -4.077 1.00 0.00 O ATOM 1398 CB SER A 96 -0.552 15.616 -6.021 1.00 0.00 C ATOM 1399 OG SER A 96 0.447 15.458 -7.014 1.00 0.00 O ATOM 0 H SER A 96 -1.675 12.860 -5.535 1.00 0.00 H new ATOM 0 HA SER A 96 0.501 14.484 -4.551 1.00 0.00 H new ATOM 0 HB2 SER A 96 -1.536 15.638 -6.490 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.419 16.573 -5.516 1.00 0.00 H new ATOM 0 HG SER A 96 0.389 16.195 -7.657 1.00 0.00 H new ATOM 1405 N THR A 97 -1.126 15.338 -2.841 1.00 0.00 N ATOM 1406 CA THR A 97 -1.991 15.624 -1.699 1.00 0.00 C ATOM 1407 C THR A 97 -3.260 16.384 -2.125 1.00 0.00 C ATOM 1408 O THR A 97 -3.175 17.381 -2.847 1.00 0.00 O ATOM 1409 CB THR A 97 -1.231 16.449 -0.633 1.00 0.00 C ATOM 1410 OG1 THR A 97 0.100 15.939 -0.472 1.00 0.00 O ATOM 1411 CG2 THR A 97 -1.941 16.422 0.721 1.00 0.00 C ATOM 0 H THR A 97 -0.173 15.683 -2.730 1.00 0.00 H new ATOM 0 HA THR A 97 -2.289 14.666 -1.273 1.00 0.00 H new ATOM 0 HB THR A 97 -1.200 17.480 -0.984 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.574 16.468 0.203 1.00 0.00 H new ATOM 0 HG21 THR A 97 -1.375 17.013 1.441 1.00 0.00 H new ATOM 0 HG22 THR A 97 -2.942 16.840 0.615 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.013 15.393 1.073 1.00 0.00 H new ATOM 1419 N ASP A 98 -4.426 15.864 -1.688 1.00 0.00 N ATOM 1420 CA ASP A 98 -5.763 16.441 -1.967 1.00 0.00 C ATOM 1421 C ASP A 98 -6.335 15.947 -3.298 1.00 0.00 C ATOM 1422 O ASP A 98 -7.491 16.243 -3.624 1.00 0.00 O ATOM 1423 CB ASP A 98 -5.776 17.984 -1.916 1.00 0.00 C ATOM 1424 CG ASP A 98 -6.263 18.513 -0.582 1.00 0.00 C ATOM 1425 OD1 ASP A 98 -7.477 18.778 -0.457 1.00 0.00 O ATOM 1426 OD2 ASP A 98 -5.431 18.661 0.339 1.00 0.00 O ATOM 0 H ASP A 98 -4.468 15.017 -1.121 1.00 0.00 H new ATOM 0 HA ASP A 98 -6.407 16.085 -1.163 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -4.771 18.360 -2.108 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -6.416 18.366 -2.711 1.00 0.00 H new ATOM 1431 N SER A 99 -5.537 15.177 -4.057 1.00 0.00 N ATOM 1432 CA SER A 99 -5.976 14.629 -5.325 1.00 0.00 C ATOM 1433 C SER A 99 -6.807 13.375 -5.101 1.00 0.00 C ATOM 1434 O SER A 99 -6.599 12.655 -4.124 1.00 0.00 O ATOM 1435 CB SER A 99 -4.777 14.285 -6.201 1.00 0.00 C ATOM 1436 OG SER A 99 -3.939 15.411 -6.390 1.00 0.00 O ATOM 0 H SER A 99 -4.582 14.926 -3.801 1.00 0.00 H new ATOM 0 HA SER A 99 -6.584 15.382 -5.826 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.207 13.478 -5.741 1.00 0.00 H new ATOM 0 HB3 SER A 99 -5.123 13.920 -7.168 1.00 0.00 H new ATOM 0 HG SER A 99 -3.620 15.430 -7.316 1.00 0.00 H new ATOM 1442 N THR A 100 -7.762 13.135 -5.992 1.00 0.00 N ATOM 1443 CA THR A 100 -8.607 11.962 -5.915 1.00 0.00 C ATOM 1444 C THR A 100 -7.948 10.761 -6.565 1.00 0.00 C ATOM 1445 O THR A 100 -7.224 10.897 -7.557 1.00 0.00 O ATOM 1446 CB THR A 100 -9.978 12.180 -6.559 1.00 0.00 C ATOM 1447 OG1 THR A 100 -9.850 12.908 -7.787 1.00 0.00 O ATOM 1448 CG2 THR A 100 -10.894 12.917 -5.604 1.00 0.00 C ATOM 0 H THR A 100 -7.967 13.747 -6.781 1.00 0.00 H new ATOM 0 HA THR A 100 -8.751 11.773 -4.851 1.00 0.00 H new ATOM 0 HB THR A 100 -10.413 11.206 -6.781 1.00 0.00 H new ATOM 0 HG1 THR A 100 -10.736 13.036 -8.185 1.00 0.00 H new ATOM 0 HG21 THR A 100 -11.866 13.066 -6.074 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.017 12.331 -4.693 1.00 0.00 H new ATOM 0 HG23 THR A 100 -10.459 13.885 -5.357 1.00 0.00 H new ATOM 1456 N VAL A 101 -8.207 9.594 -5.994 1.00 0.00 N ATOM 1457 CA VAL A 101 -7.646 8.367 -6.480 1.00 0.00 C ATOM 1458 C VAL A 101 -8.710 7.323 -6.779 1.00 0.00 C ATOM 1459 O VAL A 101 -9.872 7.456 -6.382 1.00 0.00 O ATOM 1460 CB VAL A 101 -6.630 7.758 -5.495 1.00 0.00 C ATOM 1461 CG1 VAL A 101 -5.215 8.071 -5.933 1.00 0.00 C ATOM 1462 CG2 VAL A 101 -6.868 8.204 -4.056 1.00 0.00 C ATOM 0 H VAL A 101 -8.813 9.483 -5.181 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.135 8.635 -7.405 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.774 6.678 -5.513 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.510 7.633 -5.226 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.040 7.654 -6.925 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.074 9.151 -5.964 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.124 7.745 -3.405 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.786 9.289 -3.993 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.865 7.897 -3.740 1.00 0.00 H new ATOM 1472 N LYS A 102 -8.270 6.270 -7.469 1.00 0.00 N ATOM 1473 CA LYS A 102 -9.089 5.167 -7.857 1.00 0.00 C ATOM 1474 C LYS A 102 -8.317 3.876 -7.703 1.00 0.00 C ATOM 1475 O LYS A 102 -7.103 3.824 -7.899 1.00 0.00 O ATOM 1476 CB LYS A 102 -9.568 5.357 -9.281 1.00 0.00 C ATOM 1477 CG LYS A 102 -10.760 4.489 -9.658 1.00 0.00 C ATOM 1478 CD LYS A 102 -11.024 4.509 -11.155 1.00 0.00 C ATOM 1479 CE LYS A 102 -12.222 3.645 -11.524 1.00 0.00 C ATOM 1480 NZ LYS A 102 -11.917 2.188 -11.427 1.00 0.00 N ATOM 0 H LYS A 102 -7.301 6.177 -7.773 1.00 0.00 H new ATOM 0 HA LYS A 102 -9.965 5.116 -7.211 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -9.834 6.404 -9.426 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -8.745 5.140 -9.962 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -10.579 3.464 -9.335 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -11.646 4.839 -9.128 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.200 5.534 -11.480 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -10.141 4.153 -11.686 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -13.057 3.884 -10.866 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -12.539 3.881 -12.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -12.750 1.639 -11.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -11.115 1.959 -12.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -11.672 1.949 -10.445 1.00 0.00 H new ATOM 1494 N GLN A 103 -9.060 2.837 -7.368 1.00 0.00 N ATOM 1495 CA GLN A 103 -8.531 1.502 -7.156 1.00 0.00 C ATOM 1496 C GLN A 103 -7.787 0.990 -8.394 1.00 0.00 C ATOM 1497 O GLN A 103 -8.230 1.175 -9.531 1.00 0.00 O ATOM 1498 CB GLN A 103 -9.674 0.554 -6.776 1.00 0.00 C ATOM 1499 CG GLN A 103 -9.243 -0.731 -6.059 1.00 0.00 C ATOM 1500 CD GLN A 103 -9.028 -1.885 -7.007 1.00 0.00 C ATOM 1501 OE1 GLN A 103 -9.129 -3.051 -6.626 1.00 0.00 O ATOM 1502 NE2 GLN A 103 -8.747 -1.561 -8.251 1.00 0.00 N ATOM 0 H GLN A 103 -10.069 2.899 -7.233 1.00 0.00 H new ATOM 0 HA GLN A 103 -7.809 1.540 -6.340 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -10.373 1.092 -6.136 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -10.216 0.282 -7.682 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -8.322 -0.543 -5.508 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -10.002 -1.005 -5.326 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -8.674 -0.579 -8.518 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -8.602 -2.291 -8.948 1.00 0.00 H new ATOM 1511 N GLY A 104 -6.652 0.356 -8.128 1.00 0.00 N ATOM 1512 CA GLY A 104 -5.797 -0.208 -9.160 1.00 0.00 C ATOM 1513 C GLY A 104 -4.964 0.819 -9.903 1.00 0.00 C ATOM 1514 O GLY A 104 -4.153 0.462 -10.758 1.00 0.00 O ATOM 0 H GLY A 104 -6.298 0.219 -7.181 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.130 -0.940 -8.704 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.417 -0.745 -9.878 1.00 0.00 H new ATOM 1518 N GLN A 105 -5.183 2.097 -9.588 1.00 0.00 N ATOM 1519 CA GLN A 105 -4.458 3.194 -10.208 1.00 0.00 C ATOM 1520 C GLN A 105 -3.054 3.256 -9.665 1.00 0.00 C ATOM 1521 O GLN A 105 -2.823 3.060 -8.473 1.00 0.00 O ATOM 1522 CB GLN A 105 -5.214 4.504 -9.970 1.00 0.00 C ATOM 1523 CG GLN A 105 -4.664 5.740 -10.670 1.00 0.00 C ATOM 1524 CD GLN A 105 -5.618 6.906 -10.538 1.00 0.00 C ATOM 1525 OE1 GLN A 105 -6.366 7.222 -11.463 1.00 0.00 O ATOM 1526 NE2 GLN A 105 -5.620 7.531 -9.366 1.00 0.00 N ATOM 0 H GLN A 105 -5.870 2.395 -8.895 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.389 3.032 -11.284 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -6.248 4.364 -10.286 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.232 4.698 -8.898 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -3.698 6.006 -10.241 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -4.495 5.521 -11.724 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.981 7.234 -8.628 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -6.260 8.308 -9.204 1.00 0.00 H new ATOM 1535 N ILE A 106 -2.123 3.509 -10.568 1.00 0.00 N ATOM 1536 CA ILE A 106 -0.732 3.590 -10.218 1.00 0.00 C ATOM 1537 C ILE A 106 -0.481 4.864 -9.423 1.00 0.00 C ATOM 1538 O ILE A 106 -0.413 5.970 -9.970 1.00 0.00 O ATOM 1539 CB ILE A 106 0.193 3.475 -11.448 1.00 0.00 C ATOM 1540 CG1 ILE A 106 0.020 2.090 -12.107 1.00 0.00 C ATOM 1541 CG2 ILE A 106 1.665 3.716 -11.074 1.00 0.00 C ATOM 1542 CD1 ILE A 106 0.440 2.025 -13.565 1.00 0.00 C ATOM 0 H ILE A 106 -2.317 3.662 -11.558 1.00 0.00 H new ATOM 0 HA ILE A 106 -0.485 2.734 -9.590 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.093 4.249 -12.161 1.00 0.00 H new ATOM 0 HG12 ILE A 106 0.600 1.359 -11.543 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.026 1.794 -12.031 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.286 3.627 -11.965 1.00 0.00 H new ATOM 0 HG22 ILE A 106 1.775 4.716 -10.654 1.00 0.00 H new ATOM 0 HG23 ILE A 106 1.979 2.976 -10.337 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.283 1.015 -13.944 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.156 2.728 -14.147 1.00 0.00 H new ATOM 0 HD13 ILE A 106 1.495 2.286 -13.652 1.00 0.00 H new ATOM 1554 N ILE A 107 -0.379 4.664 -8.124 1.00 0.00 N ATOM 1555 CA ILE A 107 -0.164 5.728 -7.175 1.00 0.00 C ATOM 1556 C ILE A 107 1.323 5.956 -6.848 1.00 0.00 C ATOM 1557 O ILE A 107 1.660 6.891 -6.115 1.00 0.00 O ATOM 1558 CB ILE A 107 -0.943 5.452 -5.865 1.00 0.00 C ATOM 1559 CG1 ILE A 107 -0.908 3.960 -5.472 1.00 0.00 C ATOM 1560 CG2 ILE A 107 -2.384 5.932 -5.990 1.00 0.00 C ATOM 1561 CD1 ILE A 107 -0.713 3.723 -3.989 1.00 0.00 C ATOM 0 H ILE A 107 -0.445 3.741 -7.695 1.00 0.00 H new ATOM 0 HA ILE A 107 -0.535 6.637 -7.648 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.448 6.011 -5.071 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.839 3.489 -5.786 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.103 3.469 -6.018 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -2.917 5.730 -5.061 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -2.395 7.004 -6.189 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.873 5.406 -6.810 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -0.699 2.651 -3.791 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.232 4.163 -3.671 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.532 4.184 -3.436 1.00 0.00 H new ATOM 1573 N GLY A 108 2.197 5.099 -7.391 1.00 0.00 N ATOM 1574 CA GLY A 108 3.620 5.231 -7.182 1.00 0.00 C ATOM 1575 C GLY A 108 4.381 3.996 -7.614 1.00 0.00 C ATOM 1576 O GLY A 108 3.884 3.181 -8.393 1.00 0.00 O ATOM 0 H GLY A 108 1.929 4.309 -7.978 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.988 6.094 -7.737 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.814 5.424 -6.127 1.00 0.00 H new ATOM 1580 N TYR A 109 5.593 3.891 -7.096 1.00 0.00 N ATOM 1581 CA TYR A 109 6.502 2.795 -7.354 1.00 0.00 C ATOM 1582 C TYR A 109 7.194 2.432 -6.052 1.00 0.00 C ATOM 1583 O TYR A 109 7.591 3.317 -5.289 1.00 0.00 O ATOM 1584 CB TYR A 109 7.561 3.156 -8.413 1.00 0.00 C ATOM 1585 CG TYR A 109 7.004 3.737 -9.696 1.00 0.00 C ATOM 1586 CD1 TYR A 109 6.823 2.951 -10.826 1.00 0.00 C ATOM 1587 CD2 TYR A 109 6.667 5.079 -9.770 1.00 0.00 C ATOM 1588 CE1 TYR A 109 6.319 3.489 -11.995 1.00 0.00 C ATOM 1589 CE2 TYR A 109 6.161 5.627 -10.933 1.00 0.00 C ATOM 1590 CZ TYR A 109 5.989 4.829 -12.043 1.00 0.00 C ATOM 1591 OH TYR A 109 5.486 5.371 -13.204 1.00 0.00 O ATOM 0 H TYR A 109 5.981 4.591 -6.464 1.00 0.00 H new ATOM 0 HA TYR A 109 5.927 1.955 -7.743 1.00 0.00 H new ATOM 0 HB2 TYR A 109 8.259 3.872 -7.979 1.00 0.00 H new ATOM 0 HB3 TYR A 109 8.133 2.260 -8.655 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.080 1.903 -10.791 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.802 5.708 -8.903 1.00 0.00 H new ATOM 0 HE1 TYR A 109 6.184 2.865 -12.866 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.902 6.675 -10.972 1.00 0.00 H new ATOM 0 HH TYR A 109 5.305 6.325 -13.068 1.00 0.00 H new ATOM 1601 N THR A 110 7.349 1.131 -5.821 1.00 0.00 N ATOM 1602 CA THR A 110 7.977 0.594 -4.610 1.00 0.00 C ATOM 1603 C THR A 110 9.423 1.067 -4.453 1.00 0.00 C ATOM 1604 O THR A 110 10.082 1.373 -5.453 1.00 0.00 O ATOM 1605 CB THR A 110 7.954 -0.944 -4.619 1.00 0.00 C ATOM 1606 OG1 THR A 110 8.006 -1.441 -5.962 1.00 0.00 O ATOM 1607 CG2 THR A 110 6.713 -1.477 -3.919 1.00 0.00 C ATOM 0 H THR A 110 7.040 0.410 -6.473 1.00 0.00 H new ATOM 0 HA THR A 110 7.397 0.969 -3.767 1.00 0.00 H new ATOM 0 HB THR A 110 8.833 -1.292 -4.077 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.690 -2.139 -6.026 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.723 -2.567 -3.940 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.704 -1.134 -2.884 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.822 -1.112 -4.430 1.00 0.00 H new ATOM 1615 N GLY A 111 9.912 1.142 -3.202 1.00 0.00 N ATOM 1616 CA GLY A 111 11.274 1.586 -2.990 1.00 0.00 C ATOM 1617 C GLY A 111 11.862 1.147 -1.678 1.00 0.00 C ATOM 1618 O GLY A 111 11.363 0.222 -1.030 1.00 0.00 O ATOM 0 H GLY A 111 9.393 0.906 -2.356 1.00 0.00 H new ATOM 0 HA2 GLY A 111 11.898 1.210 -3.800 1.00 0.00 H new ATOM 0 HA3 GLY A 111 11.303 2.674 -3.044 1.00 0.00 H new ATOM 1622 N ALA A 112 12.952 1.814 -1.308 1.00 0.00 N ATOM 1623 CA ALA A 112 13.648 1.559 -0.067 1.00 0.00 C ATOM 1624 C ALA A 112 14.316 2.856 0.409 1.00 0.00 C ATOM 1625 O ALA A 112 15.501 2.878 0.772 1.00 0.00 O ATOM 1626 CB ALA A 112 14.674 0.430 -0.232 1.00 0.00 C ATOM 0 H ALA A 112 13.374 2.552 -1.872 1.00 0.00 H new ATOM 0 HA ALA A 112 12.933 1.230 0.687 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.183 0.259 0.717 1.00 0.00 H new ATOM 0 HB2 ALA A 112 14.164 -0.483 -0.540 1.00 0.00 H new ATOM 0 HB3 ALA A 112 15.405 0.711 -0.990 1.00 0.00 H new ATOM 1632 N THR A 113 13.530 3.940 0.401 1.00 0.00 N ATOM 1633 CA THR A 113 14.013 5.275 0.777 1.00 0.00 C ATOM 1634 C THR A 113 14.121 5.481 2.299 1.00 0.00 C ATOM 1635 O THR A 113 14.480 6.574 2.756 1.00 0.00 O ATOM 1636 CB THR A 113 13.114 6.375 0.174 1.00 0.00 C ATOM 1637 OG1 THR A 113 11.743 6.117 0.500 1.00 0.00 O ATOM 1638 CG2 THR A 113 13.271 6.448 -1.340 1.00 0.00 C ATOM 0 H THR A 113 12.546 3.917 0.135 1.00 0.00 H new ATOM 0 HA THR A 113 15.020 5.350 0.368 1.00 0.00 H new ATOM 0 HB THR A 113 13.421 7.331 0.599 1.00 0.00 H new ATOM 0 HG1 THR A 113 11.268 5.810 -0.301 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.625 7.232 -1.735 1.00 0.00 H new ATOM 0 HG22 THR A 113 14.308 6.673 -1.588 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.992 5.491 -1.781 1.00 0.00 H new ATOM 1700 N GLY A 118 16.934 -3.555 2.313 1.00 0.00 N ATOM 1701 CA GLY A 118 16.218 -4.233 1.248 1.00 0.00 C ATOM 1702 C GLY A 118 14.913 -3.519 0.897 1.00 0.00 C ATOM 1703 O GLY A 118 14.254 -3.004 1.804 1.00 0.00 O ATOM 0 HA2 GLY A 118 16.851 -4.289 0.363 1.00 0.00 H new ATOM 0 HA3 GLY A 118 16.002 -5.258 1.550 1.00 0.00 H new ATOM 1707 N PRO A 119 14.495 -3.457 -0.410 1.00 0.00 N ATOM 1708 CA PRO A 119 13.238 -2.789 -0.814 1.00 0.00 C ATOM 1709 C PRO A 119 12.005 -3.579 -0.386 1.00 0.00 C ATOM 1710 O PRO A 119 12.048 -4.812 -0.348 1.00 0.00 O ATOM 1711 CB PRO A 119 13.320 -2.734 -2.350 1.00 0.00 C ATOM 1712 CG PRO A 119 14.713 -3.135 -2.703 1.00 0.00 C ATOM 1713 CD PRO A 119 15.191 -4.016 -1.589 1.00 0.00 C ATOM 0 HA PRO A 119 13.139 -1.809 -0.347 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.593 -3.408 -2.804 1.00 0.00 H new ATOM 0 HB3 PRO A 119 13.098 -1.732 -2.717 1.00 0.00 H new ATOM 0 HG2 PRO A 119 14.736 -3.665 -3.655 1.00 0.00 H new ATOM 0 HG3 PRO A 119 15.354 -2.260 -2.810 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.927 -5.060 -1.757 1.00 0.00 H new ATOM 0 HD3 PRO A 119 16.274 -3.975 -1.477 1.00 0.00 H new ATOM 1721 N HIS A 120 10.921 -2.869 -0.011 1.00 0.00 N ATOM 1722 CA HIS A 120 9.688 -3.510 0.405 1.00 0.00 C ATOM 1723 C HIS A 120 8.499 -2.552 0.323 1.00 0.00 C ATOM 1724 O HIS A 120 8.603 -1.437 -0.198 1.00 0.00 O ATOM 1725 CB HIS A 120 9.832 -4.136 1.821 1.00 0.00 C ATOM 1726 CG HIS A 120 10.126 -3.154 2.919 1.00 0.00 C ATOM 1727 ND1 HIS A 120 11.386 -2.650 3.160 1.00 0.00 N ATOM 1728 CD2 HIS A 120 9.311 -2.588 3.839 1.00 0.00 C ATOM 1729 CE1 HIS A 120 11.335 -1.817 4.184 1.00 0.00 C ATOM 1730 NE2 HIS A 120 10.088 -1.761 4.613 1.00 0.00 N ATOM 0 H HIS A 120 10.890 -1.850 0.007 1.00 0.00 H new ATOM 0 HA HIS A 120 9.486 -4.324 -0.292 1.00 0.00 H new ATOM 0 HB2 HIS A 120 8.911 -4.665 2.064 1.00 0.00 H new ATOM 0 HB3 HIS A 120 10.629 -4.879 1.795 1.00 0.00 H new ATOM 0 HD1 HIS A 120 12.226 -2.884 2.631 1.00 0.00 H new ATOM 0 HD2 HIS A 120 8.249 -2.755 3.945 1.00 0.00 H new ATOM 0 HE1 HIS A 120 12.171 -1.274 4.599 1.00 0.00 H new ATOM 1739 N LEU A 121 7.376 -3.037 0.828 1.00 0.00 N ATOM 1740 CA LEU A 121 6.130 -2.336 0.832 1.00 0.00 C ATOM 1741 C LEU A 121 5.566 -2.250 2.236 1.00 0.00 C ATOM 1742 O LEU A 121 5.583 -3.217 3.002 1.00 0.00 O ATOM 1743 CB LEU A 121 5.137 -3.022 -0.132 1.00 0.00 C ATOM 1744 CG LEU A 121 3.630 -2.760 0.077 1.00 0.00 C ATOM 1745 CD1 LEU A 121 3.246 -1.340 -0.331 1.00 0.00 C ATOM 1746 CD2 LEU A 121 2.806 -3.774 -0.703 1.00 0.00 C ATOM 0 H LEU A 121 7.319 -3.961 1.257 1.00 0.00 H new ATOM 0 HA LEU A 121 6.297 -1.317 0.484 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.392 -2.717 -1.147 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.301 -4.098 -0.071 1.00 0.00 H new ATOM 0 HG LEU A 121 3.417 -2.869 1.140 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.178 -1.191 -0.170 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.807 -0.624 0.271 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.479 -1.189 -1.385 1.00 0.00 H new ATOM 0 HD21 LEU A 121 1.745 -3.578 -0.547 1.00 0.00 H new ATOM 0 HD22 LEU A 121 3.038 -3.692 -1.765 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.044 -4.780 -0.357 1.00 0.00 H new ATOM 1758 N HIS A 122 5.086 -1.069 2.544 1.00 0.00 N ATOM 1759 CA HIS A 122 4.467 -0.780 3.800 1.00 0.00 C ATOM 1760 C HIS A 122 3.013 -0.418 3.547 1.00 0.00 C ATOM 1761 O HIS A 122 2.719 0.491 2.772 1.00 0.00 O ATOM 1762 CB HIS A 122 5.203 0.356 4.542 1.00 0.00 C ATOM 1763 CG HIS A 122 4.513 0.840 5.799 1.00 0.00 C ATOM 1764 ND1 HIS A 122 4.895 0.404 7.045 1.00 0.00 N ATOM 1765 CD2 HIS A 122 3.451 1.682 5.937 1.00 0.00 C ATOM 1766 CE1 HIS A 122 4.059 0.977 7.901 1.00 0.00 C ATOM 1767 NE2 HIS A 122 3.177 1.759 7.273 1.00 0.00 N ATOM 0 H HIS A 122 5.119 -0.271 1.910 1.00 0.00 H new ATOM 0 HA HIS A 122 4.521 -1.659 4.442 1.00 0.00 H new ATOM 0 HB2 HIS A 122 6.204 0.013 4.802 1.00 0.00 H new ATOM 0 HB3 HIS A 122 5.322 1.199 3.861 1.00 0.00 H new ATOM 0 HD1 HIS A 122 5.663 -0.230 7.266 1.00 0.00 H new ATOM 0 HD2 HIS A 122 2.926 2.191 5.142 1.00 0.00 H new ATOM 0 HE1 HIS A 122 4.088 0.830 8.971 1.00 0.00 H new ATOM 1775 N PHE A 123 2.126 -1.158 4.184 1.00 0.00 N ATOM 1776 CA PHE A 123 0.695 -0.924 4.067 1.00 0.00 C ATOM 1777 C PHE A 123 0.064 -0.788 5.457 1.00 0.00 C ATOM 1778 O PHE A 123 -0.061 -1.768 6.201 1.00 0.00 O ATOM 1779 CB PHE A 123 0.038 -2.068 3.274 1.00 0.00 C ATOM 1780 CG PHE A 123 -1.395 -1.820 2.875 1.00 0.00 C ATOM 1781 CD1 PHE A 123 -1.694 -1.139 1.707 1.00 0.00 C ATOM 1782 CD2 PHE A 123 -2.438 -2.275 3.668 1.00 0.00 C ATOM 1783 CE1 PHE A 123 -3.005 -0.917 1.337 1.00 0.00 C ATOM 1784 CE2 PHE A 123 -3.751 -2.053 3.302 1.00 0.00 C ATOM 1785 CZ PHE A 123 -4.034 -1.375 2.135 1.00 0.00 C ATOM 0 H PHE A 123 2.373 -1.936 4.796 1.00 0.00 H new ATOM 0 HA PHE A 123 0.529 0.008 3.527 1.00 0.00 H new ATOM 0 HB2 PHE A 123 0.625 -2.251 2.374 1.00 0.00 H new ATOM 0 HB3 PHE A 123 0.081 -2.978 3.873 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -0.893 -0.778 1.079 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -2.221 -2.809 4.582 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -3.226 -0.385 0.423 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.555 -2.410 3.929 1.00 0.00 H new ATOM 0 HZ PHE A 123 -5.060 -1.202 1.846 1.00 0.00 H new ATOM 1795 N GLU A 124 -0.309 0.442 5.796 1.00 0.00 N ATOM 1796 CA GLU A 124 -0.938 0.750 7.044 1.00 0.00 C ATOM 1797 C GLU A 124 -2.358 1.247 6.791 1.00 0.00 C ATOM 1798 O GLU A 124 -2.587 2.160 6.005 1.00 0.00 O ATOM 1799 CB GLU A 124 -0.079 1.771 7.821 1.00 0.00 C ATOM 1800 CG GLU A 124 -0.020 3.175 7.221 1.00 0.00 C ATOM 1801 CD GLU A 124 0.877 4.109 8.009 1.00 0.00 C ATOM 1802 OE1 GLU A 124 2.041 4.302 7.597 1.00 0.00 O ATOM 1803 OE2 GLU A 124 0.417 4.648 9.037 1.00 0.00 O ATOM 0 H GLU A 124 -0.174 1.253 5.193 1.00 0.00 H new ATOM 0 HA GLU A 124 -1.013 -0.144 7.663 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.466 1.845 8.837 1.00 0.00 H new ATOM 0 HB3 GLU A 124 0.937 1.383 7.894 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.340 3.112 6.194 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -1.026 3.592 7.181 1.00 0.00 H new ATOM 1810 N MET A 125 -3.285 0.617 7.470 1.00 0.00 N ATOM 1811 CA MET A 125 -4.683 0.913 7.379 1.00 0.00 C ATOM 1812 C MET A 125 -5.187 1.293 8.747 1.00 0.00 C ATOM 1813 O MET A 125 -4.875 0.652 9.755 1.00 0.00 O ATOM 1814 CB MET A 125 -5.409 -0.295 6.796 1.00 0.00 C ATOM 1815 CG MET A 125 -6.826 -0.552 7.301 1.00 0.00 C ATOM 1816 SD MET A 125 -7.971 0.788 6.937 1.00 0.00 S ATOM 1817 CE MET A 125 -9.420 0.194 7.805 1.00 0.00 C ATOM 0 H MET A 125 -3.074 -0.140 8.121 1.00 0.00 H new ATOM 0 HA MET A 125 -4.870 1.756 6.714 1.00 0.00 H new ATOM 0 HB2 MET A 125 -5.450 -0.178 5.713 1.00 0.00 H new ATOM 0 HB3 MET A 125 -4.809 -1.183 6.998 1.00 0.00 H new ATOM 0 HG2 MET A 125 -7.202 -1.472 6.853 1.00 0.00 H new ATOM 0 HG3 MET A 125 -6.796 -0.711 8.379 1.00 0.00 H new ATOM 0 HE1 MET A 125 -9.845 1.003 8.399 1.00 0.00 H new ATOM 0 HE2 MET A 125 -10.159 -0.153 7.083 1.00 0.00 H new ATOM 0 HE3 MET A 125 -9.139 -0.630 8.461 1.00 0.00 H new ATOM 1827 N LEU A 126 -5.985 2.328 8.737 1.00 0.00 N ATOM 1828 CA LEU A 126 -6.555 2.896 9.931 1.00 0.00 C ATOM 1829 C LEU A 126 -8.000 3.355 9.669 1.00 0.00 C ATOM 1830 O LEU A 126 -8.408 3.435 8.512 1.00 0.00 O ATOM 1831 CB LEU A 126 -5.712 4.109 10.374 1.00 0.00 C ATOM 1832 CG LEU A 126 -4.548 3.811 11.318 1.00 0.00 C ATOM 1833 CD1 LEU A 126 -3.261 3.580 10.539 1.00 0.00 C ATOM 1834 CD2 LEU A 126 -4.379 4.946 12.314 1.00 0.00 C ATOM 0 H LEU A 126 -6.263 2.810 7.882 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.559 2.137 10.714 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.315 4.595 9.483 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.373 4.827 10.860 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.774 2.897 11.867 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.448 3.370 11.234 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.391 2.733 9.865 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.022 4.471 9.959 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.547 4.723 12.982 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.176 5.873 11.778 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.293 5.057 12.898 1.00 0.00 H new ATOM 1846 N PRO A 127 -8.814 3.632 10.731 1.00 0.00 N ATOM 1847 CA PRO A 127 -10.190 4.135 10.577 1.00 0.00 C ATOM 1848 C PRO A 127 -10.251 5.506 9.929 1.00 0.00 C ATOM 1849 O PRO A 127 -9.220 6.091 9.581 1.00 0.00 O ATOM 1850 CB PRO A 127 -10.696 4.292 12.014 1.00 0.00 C ATOM 1851 CG PRO A 127 -9.483 4.274 12.870 1.00 0.00 C ATOM 1852 CD PRO A 127 -8.497 3.416 12.154 1.00 0.00 C ATOM 0 HA PRO A 127 -10.766 3.456 9.948 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -11.247 5.224 12.135 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -11.376 3.483 12.281 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -9.092 5.281 13.016 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -9.707 3.872 13.858 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -7.472 3.706 12.384 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -8.602 2.367 12.433 1.00 0.00 H new ATOM 1860 N ALA A 128 -11.476 6.016 9.799 1.00 0.00 N ATOM 1861 CA ALA A 128 -11.696 7.341 9.278 1.00 0.00 C ATOM 1862 C ALA A 128 -11.256 8.367 10.324 1.00 0.00 C ATOM 1863 O ALA A 128 -10.847 9.485 9.999 1.00 0.00 O ATOM 1864 CB ALA A 128 -13.159 7.537 8.932 1.00 0.00 C ATOM 0 H ALA A 128 -12.329 5.517 10.053 1.00 0.00 H new ATOM 0 HA ALA A 128 -11.112 7.474 8.368 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.309 8.543 8.540 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.456 6.806 8.180 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -13.766 7.403 9.827 1.00 0.00 H new ATOM 1870 N ASN A 129 -11.332 7.925 11.593 1.00 0.00 N ATOM 1871 CA ASN A 129 -10.965 8.722 12.760 1.00 0.00 C ATOM 1872 C ASN A 129 -10.641 7.795 13.900 1.00 0.00 C ATOM 1873 O ASN A 129 -11.533 7.235 14.550 1.00 0.00 O ATOM 1874 CB ASN A 129 -12.047 9.749 13.142 1.00 0.00 C ATOM 1875 CG ASN A 129 -11.669 11.164 12.744 1.00 0.00 C ATOM 1876 OD1 ASN A 129 -11.116 11.920 13.544 1.00 0.00 O ATOM 1877 ND2 ASN A 129 -11.961 11.529 11.501 1.00 0.00 N ATOM 0 H ASN A 129 -11.656 6.988 11.831 1.00 0.00 H new ATOM 0 HA ASN A 129 -10.083 9.313 12.513 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -12.987 9.478 12.661 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -12.217 9.710 14.218 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -11.727 12.467 11.177 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -12.420 10.871 10.871 1.00 0.00 H new ATOM 1884 N PRO A 130 -9.329 7.622 14.153 1.00 0.00 N ATOM 1885 CA PRO A 130 -8.843 6.711 15.164 1.00 0.00 C ATOM 1886 C PRO A 130 -9.043 7.119 16.608 1.00 0.00 C ATOM 1887 O PRO A 130 -9.310 8.278 16.937 1.00 0.00 O ATOM 1888 CB PRO A 130 -7.344 6.571 14.906 1.00 0.00 C ATOM 1889 CG PRO A 130 -7.082 7.323 13.640 1.00 0.00 C ATOM 1890 CD PRO A 130 -8.217 8.273 13.446 1.00 0.00 C ATOM 0 HA PRO A 130 -9.425 5.794 15.067 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -6.764 6.981 15.733 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -7.060 5.524 14.806 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -6.136 7.861 13.701 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -7.005 6.639 12.795 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -7.995 9.255 13.864 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -8.443 8.419 12.390 1.00 0.00 H new ATOM 1898 N ASN A 131 -8.902 6.099 17.441 1.00 0.00 N ATOM 1899 CA ASN A 131 -8.992 6.193 18.860 1.00 0.00 C ATOM 1900 C ASN A 131 -7.646 5.783 19.428 1.00 0.00 C ATOM 1901 O ASN A 131 -7.497 4.728 20.058 1.00 0.00 O ATOM 1902 CB ASN A 131 -10.091 5.287 19.351 1.00 0.00 C ATOM 1903 CG ASN A 131 -10.898 5.895 20.462 1.00 0.00 C ATOM 1904 OD1 ASN A 131 -10.572 5.762 21.642 1.00 0.00 O ATOM 1905 ND2 ASN A 131 -11.966 6.570 20.078 1.00 0.00 N ATOM 0 H ASN A 131 -8.714 5.150 17.116 1.00 0.00 H new ATOM 0 HA ASN A 131 -9.231 7.207 19.180 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -10.753 5.043 18.520 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -9.655 4.350 19.697 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -12.567 7.012 20.773 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -12.190 6.649 19.086 1.00 0.00 H new ATOM 1912 N TRP A 132 -6.666 6.666 19.212 1.00 0.00 N ATOM 1913 CA TRP A 132 -5.275 6.461 19.646 1.00 0.00 C ATOM 1914 C TRP A 132 -5.145 6.366 21.179 1.00 0.00 C ATOM 1915 O TRP A 132 -4.041 6.425 21.735 1.00 0.00 O ATOM 1916 CB TRP A 132 -4.373 7.603 19.144 1.00 0.00 C ATOM 1917 CG TRP A 132 -4.648 8.041 17.738 1.00 0.00 C ATOM 1918 CD1 TRP A 132 -4.255 7.409 16.599 1.00 0.00 C ATOM 1919 CD2 TRP A 132 -5.384 9.199 17.321 1.00 0.00 C ATOM 1920 NE1 TRP A 132 -4.686 8.106 15.501 1.00 0.00 N ATOM 1921 CE2 TRP A 132 -5.382 9.202 15.918 1.00 0.00 C ATOM 1922 CE3 TRP A 132 -6.044 10.235 17.994 1.00 0.00 C ATOM 1923 CZ2 TRP A 132 -6.006 10.187 15.173 1.00 0.00 C ATOM 1924 CZ3 TRP A 132 -6.667 11.219 17.249 1.00 0.00 C ATOM 1925 CH2 TRP A 132 -6.645 11.188 15.849 1.00 0.00 C ATOM 0 H TRP A 132 -6.814 7.551 18.727 1.00 0.00 H new ATOM 0 HA TRP A 132 -4.957 5.512 19.214 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -4.490 8.460 19.807 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -3.333 7.285 19.215 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -3.686 6.492 16.565 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -4.514 7.847 14.529 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -6.066 10.265 19.073 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -5.989 10.165 14.093 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -7.179 12.024 17.755 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -7.142 11.969 15.294 1.00 0.00 H new ATOM 1936 N GLN A 133 -6.289 6.196 21.835 1.00 0.00 N ATOM 1937 CA GLN A 133 -6.396 6.114 23.273 1.00 0.00 C ATOM 1938 C GLN A 133 -6.073 4.718 23.813 1.00 0.00 C ATOM 1939 O GLN A 133 -6.647 4.248 24.805 1.00 0.00 O ATOM 1940 CB GLN A 133 -7.798 6.531 23.667 1.00 0.00 C ATOM 1941 CG GLN A 133 -8.119 8.006 23.408 1.00 0.00 C ATOM 1942 CD GLN A 133 -8.555 8.271 21.970 1.00 0.00 C ATOM 1943 OE1 GLN A 133 -9.746 8.388 21.683 1.00 0.00 O ATOM 1944 NE2 GLN A 133 -7.585 8.329 21.057 1.00 0.00 N ATOM 0 H GLN A 133 -7.188 6.110 21.360 1.00 0.00 H new ATOM 0 HA GLN A 133 -5.657 6.783 23.715 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -8.513 5.915 23.121 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -7.941 6.322 24.727 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -8.909 8.326 24.087 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -7.240 8.610 23.634 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -6.611 8.227 21.341 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -7.817 8.476 20.075 1.00 0.00 H new ATOM 1953 N ASN A 134 -5.140 4.077 23.119 1.00 0.00 N ATOM 1954 CA ASN A 134 -4.623 2.740 23.419 1.00 0.00 C ATOM 1955 C ASN A 134 -5.653 1.686 23.096 1.00 0.00 C ATOM 1956 O ASN A 134 -6.806 1.774 23.530 1.00 0.00 O ATOM 1957 CB ASN A 134 -4.142 2.619 24.873 1.00 0.00 C ATOM 1958 CG ASN A 134 -2.862 3.391 25.101 1.00 0.00 C ATOM 1959 OD1 ASN A 134 -1.774 2.817 25.149 1.00 0.00 O ATOM 1960 ND2 ASN A 134 -2.987 4.705 25.222 1.00 0.00 N ATOM 0 H ASN A 134 -4.702 4.490 22.295 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.753 2.577 22.784 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -4.916 2.990 25.545 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -3.983 1.569 25.118 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -2.160 5.285 25.362 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -3.910 5.136 25.176 1.00 0.00 H new ATOM 1967 N GLY A 135 -5.225 0.701 22.322 1.00 0.00 N ATOM 1968 CA GLY A 135 -6.116 -0.359 21.933 1.00 0.00 C ATOM 1969 C GLY A 135 -5.788 -0.941 20.575 1.00 0.00 C ATOM 1970 O GLY A 135 -5.735 -2.166 20.426 1.00 0.00 O ATOM 0 H GLY A 135 -4.275 0.621 21.959 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.077 -1.151 22.680 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -7.138 0.019 21.923 1.00 0.00 H new ATOM 1974 N PHE A 136 -5.593 -0.070 19.577 1.00 0.00 N ATOM 1975 CA PHE A 136 -5.255 -0.507 18.215 1.00 0.00 C ATOM 1976 C PHE A 136 -4.420 0.527 17.475 1.00 0.00 C ATOM 1977 O PHE A 136 -3.767 0.206 16.484 1.00 0.00 O ATOM 1978 CB PHE A 136 -6.522 -0.833 17.382 1.00 0.00 C ATOM 1979 CG PHE A 136 -7.767 0.007 17.657 1.00 0.00 C ATOM 1980 CD1 PHE A 136 -9.017 -0.588 17.590 1.00 0.00 C ATOM 1981 CD2 PHE A 136 -7.703 1.370 17.961 1.00 0.00 C ATOM 1982 CE1 PHE A 136 -10.167 0.142 17.815 1.00 0.00 C ATOM 1983 CE2 PHE A 136 -8.851 2.096 18.187 1.00 0.00 C ATOM 1984 CZ PHE A 136 -10.084 1.485 18.112 1.00 0.00 C ATOM 0 H PHE A 136 -5.663 0.942 19.686 1.00 0.00 H new ATOM 0 HA PHE A 136 -4.665 -1.416 18.330 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -6.270 -0.729 16.327 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -6.776 -1.880 17.548 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -9.093 -1.640 17.358 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -6.742 1.859 18.019 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -11.132 -0.340 17.758 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -8.785 3.148 18.424 1.00 0.00 H new ATOM 0 HZ PHE A 136 -10.983 2.057 18.286 1.00 0.00 H new ATOM 1994 N SER A 137 -4.462 1.778 17.959 1.00 0.00 N ATOM 1995 CA SER A 137 -3.750 2.928 17.365 1.00 0.00 C ATOM 1996 C SER A 137 -4.347 3.197 16.000 1.00 0.00 C ATOM 1997 O SER A 137 -3.783 3.894 15.148 1.00 0.00 O ATOM 1998 CB SER A 137 -2.227 2.697 17.291 1.00 0.00 C ATOM 1999 OG SER A 137 -1.637 2.761 18.578 1.00 0.00 O ATOM 0 H SER A 137 -5.000 2.027 18.789 1.00 0.00 H new ATOM 0 HA SER A 137 -3.880 3.802 18.003 1.00 0.00 H new ATOM 0 HB2 SER A 137 -2.025 1.724 16.843 1.00 0.00 H new ATOM 0 HB3 SER A 137 -1.774 3.447 16.642 1.00 0.00 H new ATOM 0 HG SER A 137 -0.672 2.610 18.503 1.00 0.00 H new ATOM 2005 N GLY A 138 -5.547 2.631 15.853 1.00 0.00 N ATOM 2006 CA GLY A 138 -6.316 2.732 14.647 1.00 0.00 C ATOM 2007 C GLY A 138 -5.825 1.791 13.567 1.00 0.00 C ATOM 2008 O GLY A 138 -6.499 1.593 12.559 1.00 0.00 O ATOM 0 H GLY A 138 -6.002 2.087 16.586 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.361 2.514 14.867 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.275 3.757 14.278 1.00 0.00 H new ATOM 2012 N ARG A 139 -4.646 1.195 13.773 1.00 0.00 N ATOM 2013 CA ARG A 139 -4.094 0.284 12.769 1.00 0.00 C ATOM 2014 C ARG A 139 -4.631 -1.137 12.927 1.00 0.00 C ATOM 2015 O ARG A 139 -4.534 -1.731 14.005 1.00 0.00 O ATOM 2016 CB ARG A 139 -2.550 0.284 12.743 1.00 0.00 C ATOM 2017 CG ARG A 139 -1.845 0.339 14.101 1.00 0.00 C ATOM 2018 CD ARG A 139 -1.721 -1.026 14.764 1.00 0.00 C ATOM 2019 NE ARG A 139 -0.749 -1.000 15.863 1.00 0.00 N ATOM 2020 CZ ARG A 139 -0.954 -1.513 17.085 1.00 0.00 C ATOM 2021 NH1 ARG A 139 -2.102 -2.110 17.400 1.00 0.00 N ATOM 2022 NH2 ARG A 139 0.001 -1.419 18.000 1.00 0.00 N ATOM 0 H ARG A 139 -4.069 1.323 14.604 1.00 0.00 H new ATOM 0 HA ARG A 139 -4.432 0.668 11.806 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.217 -0.614 12.222 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -2.219 1.137 12.151 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -0.850 0.765 13.970 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -2.394 1.009 14.762 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.694 -1.338 15.144 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -1.416 -1.766 14.024 1.00 0.00 H new ATOM 0 HE ARG A 139 0.152 -0.557 15.684 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -2.846 -2.184 16.706 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -2.237 -2.494 18.335 1.00 0.00 H new ATOM 0 HH21 ARG A 139 0.883 -0.959 17.772 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -0.146 -1.806 18.932 1.00 0.00 H new ATOM 2036 N ILE A 140 -5.216 -1.665 11.843 1.00 0.00 N ATOM 2037 CA ILE A 140 -5.769 -3.020 11.859 1.00 0.00 C ATOM 2038 C ILE A 140 -5.237 -3.896 10.707 1.00 0.00 C ATOM 2039 O ILE A 140 -4.361 -3.477 9.946 1.00 0.00 O ATOM 2040 CB ILE A 140 -7.321 -3.060 11.888 1.00 0.00 C ATOM 2041 CG1 ILE A 140 -7.940 -1.696 12.210 1.00 0.00 C ATOM 2042 CG2 ILE A 140 -7.797 -4.090 12.906 1.00 0.00 C ATOM 2043 CD1 ILE A 140 -8.469 -0.977 10.994 1.00 0.00 C ATOM 0 H ILE A 140 -5.317 -1.177 10.953 1.00 0.00 H new ATOM 0 HA ILE A 140 -5.417 -3.442 12.800 1.00 0.00 H new ATOM 0 HB ILE A 140 -7.651 -3.340 10.887 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -8.752 -1.833 12.924 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -7.191 -1.071 12.696 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -8.887 -4.111 12.920 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -7.418 -5.075 12.632 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -7.427 -3.822 13.895 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -8.893 -0.019 11.294 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -7.656 -0.809 10.288 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -9.241 -1.583 10.520 1.00 0.00 H new ATOM 2055 N ASP A 141 -5.821 -5.105 10.579 1.00 0.00 N ATOM 2056 CA ASP A 141 -5.410 -6.119 9.597 1.00 0.00 C ATOM 2057 C ASP A 141 -5.793 -5.789 8.135 1.00 0.00 C ATOM 2058 O ASP A 141 -6.937 -5.404 7.875 1.00 0.00 O ATOM 2059 CB ASP A 141 -6.026 -7.470 9.970 1.00 0.00 C ATOM 2060 CG ASP A 141 -5.346 -8.110 11.163 1.00 0.00 C ATOM 2061 OD1 ASP A 141 -5.543 -7.617 12.293 1.00 0.00 O ATOM 2062 OD2 ASP A 141 -4.616 -9.104 10.966 1.00 0.00 O ATOM 0 H ASP A 141 -6.601 -5.404 11.164 1.00 0.00 H new ATOM 0 HA ASP A 141 -4.321 -6.143 9.636 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -7.085 -7.334 10.190 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -5.961 -8.143 9.115 1.00 0.00 H new ATOM 2067 N PRO A 142 -4.828 -5.913 7.158 1.00 0.00 N ATOM 2068 CA PRO A 142 -5.091 -5.673 5.724 1.00 0.00 C ATOM 2069 C PRO A 142 -5.824 -6.837 5.031 1.00 0.00 C ATOM 2070 O PRO A 142 -6.161 -6.740 3.848 1.00 0.00 O ATOM 2071 CB PRO A 142 -3.696 -5.512 5.099 1.00 0.00 C ATOM 2072 CG PRO A 142 -2.709 -5.640 6.213 1.00 0.00 C ATOM 2073 CD PRO A 142 -3.418 -6.298 7.360 1.00 0.00 C ATOM 0 HA PRO A 142 -5.741 -4.806 5.603 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -3.522 -6.274 4.339 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -3.602 -4.544 4.608 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -1.850 -6.234 5.900 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -2.330 -4.661 6.506 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -3.291 -7.380 7.343 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -3.040 -5.948 8.320 1.00 0.00 H new ATOM 2081 N THR A 143 -6.097 -7.918 5.791 1.00 0.00 N ATOM 2082 CA THR A 143 -6.753 -9.136 5.296 1.00 0.00 C ATOM 2083 C THR A 143 -8.058 -8.881 4.544 1.00 0.00 C ATOM 2084 O THR A 143 -8.470 -9.692 3.708 1.00 0.00 O ATOM 2085 CB THR A 143 -7.021 -10.110 6.454 1.00 0.00 C ATOM 2086 OG1 THR A 143 -7.327 -9.392 7.658 1.00 0.00 O ATOM 2087 CG2 THR A 143 -5.824 -11.022 6.685 1.00 0.00 C ATOM 0 H THR A 143 -5.862 -7.965 6.782 1.00 0.00 H new ATOM 0 HA THR A 143 -6.056 -9.570 4.579 1.00 0.00 H new ATOM 0 HB THR A 143 -7.879 -10.724 6.182 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.496 -10.028 8.384 1.00 0.00 H new ATOM 0 HG21 THR A 143 -6.038 -11.702 7.510 1.00 0.00 H new ATOM 0 HG22 THR A 143 -5.626 -11.598 5.781 1.00 0.00 H new ATOM 0 HG23 THR A 143 -4.949 -10.419 6.930 1.00 0.00 H new ATOM 2095 N GLY A 144 -8.685 -7.748 4.844 1.00 0.00 N ATOM 2096 CA GLY A 144 -9.941 -7.372 4.198 1.00 0.00 C ATOM 2097 C GLY A 144 -9.730 -6.937 2.756 1.00 0.00 C ATOM 2098 O GLY A 144 -10.633 -7.053 1.924 1.00 0.00 O ATOM 0 H GLY A 144 -8.345 -7.074 5.530 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -10.630 -8.216 4.225 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -10.408 -6.561 4.757 1.00 0.00 H new ATOM 2102 N TYR A 145 -8.506 -6.478 2.475 1.00 0.00 N ATOM 2103 CA TYR A 145 -8.108 -6.009 1.156 1.00 0.00 C ATOM 2104 C TYR A 145 -7.245 -7.046 0.433 1.00 0.00 C ATOM 2105 O TYR A 145 -6.969 -6.910 -0.765 1.00 0.00 O ATOM 2106 CB TYR A 145 -7.312 -4.696 1.248 1.00 0.00 C ATOM 2107 CG TYR A 145 -7.868 -3.664 2.208 1.00 0.00 C ATOM 2108 CD1 TYR A 145 -8.554 -2.553 1.742 1.00 0.00 C ATOM 2109 CD2 TYR A 145 -7.695 -3.802 3.579 1.00 0.00 C ATOM 2110 CE1 TYR A 145 -9.054 -1.609 2.617 1.00 0.00 C ATOM 2111 CE2 TYR A 145 -8.192 -2.868 4.459 1.00 0.00 C ATOM 2112 CZ TYR A 145 -8.871 -1.772 3.976 1.00 0.00 C ATOM 2113 OH TYR A 145 -9.359 -0.833 4.855 1.00 0.00 O ATOM 0 H TYR A 145 -7.760 -6.424 3.169 1.00 0.00 H new ATOM 0 HA TYR A 145 -9.027 -5.843 0.594 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -6.290 -4.931 1.546 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -7.260 -4.252 0.254 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -8.699 -2.424 0.680 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -7.160 -4.659 3.962 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -9.585 -0.748 2.240 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -8.050 -2.994 5.522 1.00 0.00 H new ATOM 0 HH TYR A 145 -8.613 -0.333 5.247 1.00 0.00 H new ATOM 2123 N ILE A 146 -6.823 -8.077 1.171 1.00 0.00 N ATOM 2124 CA ILE A 146 -5.982 -9.128 0.626 1.00 0.00 C ATOM 2125 C ILE A 146 -6.825 -10.363 0.277 1.00 0.00 C ATOM 2126 O ILE A 146 -6.350 -11.285 -0.388 1.00 0.00 O ATOM 2127 CB ILE A 146 -4.823 -9.517 1.610 1.00 0.00 C ATOM 2128 CG1 ILE A 146 -4.118 -8.267 2.216 1.00 0.00 C ATOM 2129 CG2 ILE A 146 -3.792 -10.439 0.943 1.00 0.00 C ATOM 2130 CD1 ILE A 146 -3.517 -7.280 1.213 1.00 0.00 C ATOM 0 H ILE A 146 -7.057 -8.200 2.156 1.00 0.00 H new ATOM 0 HA ILE A 146 -5.524 -8.742 -0.285 1.00 0.00 H new ATOM 0 HB ILE A 146 -5.292 -10.064 2.428 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.840 -7.732 2.833 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -3.323 -8.609 2.879 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -3.007 -10.684 1.658 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -4.282 -11.355 0.614 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -3.354 -9.933 0.083 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -3.054 -6.452 1.750 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.764 -7.787 0.610 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -4.304 -6.896 0.564 1.00 0.00 H new ATOM 2142 N ALA A 147 -8.081 -10.357 0.727 1.00 0.00 N ATOM 2143 CA ALA A 147 -9.028 -11.434 0.448 1.00 0.00 C ATOM 2144 C ALA A 147 -9.525 -11.389 -0.995 1.00 0.00 C ATOM 2145 O ALA A 147 -9.924 -12.410 -1.561 1.00 0.00 O ATOM 2146 CB ALA A 147 -10.204 -11.348 1.393 1.00 0.00 C ATOM 0 H ALA A 147 -8.469 -9.604 1.295 1.00 0.00 H new ATOM 0 HA ALA A 147 -8.505 -12.379 0.596 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -10.904 -12.155 1.177 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -9.852 -11.438 2.421 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -10.705 -10.389 1.264 1.00 0.00 H new