USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1000 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 101 SER OG : rot -92:sc= 1.3 USER MOD Set 1.2: A 103 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 86 SER OG : rot 104:sc= -0.153 USER MOD Set 3.1: A 28 THR OG1 : rot 81:sc= -0.941 USER MOD Set 3.2: A 47 THR OG1 : rot 180:sc= 0.431 USER MOD Set 4.1: A 30 LYS NZ :NH3+ 172:sc=-0.00578 (180deg=-0.13) USER MOD Set 4.2: A 44 GLN : amide:sc= -2.01! X(o=-2!,f=-2.3) USER MOD Set 5.1: A 40 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 63 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.479) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 ASN : amide:sc= -5.85! C(o=-5.8!,f=-3.5!) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 45:sc= 0.35 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.0293 USER MOD Single : A 24 LYS NZ :NH3+ 172:sc= -0.0077 (180deg=-0.102) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.0554 USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.0123 USER MOD Single : A 31 TYR OH : rot 180:sc= -0.292 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 62:sc= 0.685 USER MOD Single : A 41 HIS : no HD1:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 42 SER OG : rot -34:sc= 0.506 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -13.7! C(o=-14!,f=-12!) USER MOD Single : A 50 SER OG : rot -57:sc= 0.475 USER MOD Single : A 56 TYR OH : rot 180:sc= -0.978 USER MOD Single : A 57 ASN : amide:sc= -1.11 K(o=-1.1,f=-2.8!) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 180:sc= -0.0628 USER MOD Single : A 67 HIS : no HD1:sc= -3.72! C(o=-3.7!,f=-5.4!) USER MOD Single : A 73 ASN : amide:sc=-0.00498 K(o=-0.005,f=-0.65) USER MOD Single : A 75 GLN : amide:sc= -3.98! K(o=-4!,f=-0.34) USER MOD Single : A 79 LYS NZ :NH3+ 137:sc= 0 (180deg=-0.899) USER MOD Single : A 83 SER OG : rot 75:sc= 0.783 USER MOD Single : A 87 GLN : amide:sc= -5.53! C(o=-5.5!,f=-7.6!) USER MOD Single : A 91 SER OG : rot -16:sc= 0.798 USER MOD Single : A 93 SER OG : rot 180:sc=-0.00639 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -104:sc= 1.37 USER MOD Single : A 109 GLN : amide:sc= -0.824 K(o=-0.82,f=-4!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 127 HIS : no HD1:sc= -0.0188 X(o=-0.019,f=0) USER MOD Single : A 128 HIS : no HD1:sc= -0.079 X(o=-0.079,f=0) USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=-0.001) USER MOD Single : A 130 HIS : no HD1:sc= -0.0407 X(o=-0.041,f=0) USER MOD Single : A 131 HIS : no HD1:sc= -0.0386 X(o=-0.039,f=-0.039) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 34.379 -4.091 0.868 1.00 0.00 N ATOM 2 CA MET A 0 34.599 -2.818 1.602 1.00 0.00 C ATOM 3 C MET A 0 33.433 -1.859 1.389 1.00 0.00 C ATOM 4 O MET A 0 32.635 -1.626 2.299 1.00 0.00 O ATOM 5 CB MET A 0 35.904 -2.162 1.140 1.00 0.00 C ATOM 6 CG MET A 0 36.233 -0.873 1.876 1.00 0.00 C ATOM 7 SD MET A 0 36.368 -1.106 3.658 1.00 0.00 S ATOM 8 CE MET A 0 36.810 0.549 4.181 1.00 0.00 C ATOM 0 H1 MET A 0 35.186 -4.728 1.028 1.00 0.00 H new ATOM 0 H2 MET A 0 33.507 -4.543 1.211 1.00 0.00 H new ATOM 0 H3 MET A 0 34.290 -3.894 -0.149 1.00 0.00 H new ATOM 0 HA MET A 0 34.668 -3.046 2.666 1.00 0.00 H new ATOM 0 HB2 MET A 0 36.723 -2.868 1.277 1.00 0.00 H new ATOM 0 HB3 MET A 0 35.838 -1.954 0.072 1.00 0.00 H new ATOM 0 HG2 MET A 0 37.171 -0.470 1.494 1.00 0.00 H new ATOM 0 HG3 MET A 0 35.460 -0.133 1.668 1.00 0.00 H new ATOM 0 HE1 MET A 0 36.930 0.568 5.264 1.00 0.00 H new ATOM 0 HE2 MET A 0 37.747 0.842 3.707 1.00 0.00 H new ATOM 0 HE3 MET A 0 36.023 1.245 3.890 1.00 0.00 H new ATOM 20 N ASN A 1 33.338 -1.306 0.184 1.00 0.00 N ATOM 21 CA ASN A 1 32.269 -0.373 -0.148 1.00 0.00 C ATOM 22 C ASN A 1 31.538 -0.799 -1.417 1.00 0.00 C ATOM 23 O ASN A 1 32.129 -1.398 -2.316 1.00 0.00 O ATOM 24 CB ASN A 1 32.832 1.038 -0.315 1.00 0.00 C ATOM 25 CG ASN A 1 32.849 1.804 0.990 1.00 0.00 C ATOM 26 OD1 ASN A 1 33.850 1.819 1.706 1.00 0.00 O ATOM 27 ND2 ASN A 1 31.728 2.437 1.307 1.00 0.00 N ATOM 0 H ASN A 1 33.990 -1.489 -0.579 1.00 0.00 H new ATOM 0 HA ASN A 1 31.552 -0.377 0.673 1.00 0.00 H new ATOM 0 HB2 ASN A 1 33.845 0.979 -0.713 1.00 0.00 H new ATOM 0 HB3 ASN A 1 32.234 1.582 -1.046 1.00 0.00 H new ATOM 0 HD21 ASN A 1 31.670 2.966 2.177 1.00 0.00 H new ATOM 0 HD22 ASN A 1 30.924 2.395 0.681 1.00 0.00 H new ATOM 34 N CYS A 2 30.248 -0.484 -1.479 1.00 0.00 N ATOM 35 CA CYS A 2 29.427 -0.830 -2.634 1.00 0.00 C ATOM 36 C CYS A 2 29.281 0.359 -3.578 1.00 0.00 C ATOM 37 O CYS A 2 29.702 1.471 -3.260 1.00 0.00 O ATOM 38 CB CYS A 2 28.044 -1.305 -2.183 1.00 0.00 C ATOM 39 SG CYS A 2 28.054 -2.887 -1.282 1.00 0.00 S ATOM 0 H CYS A 2 29.748 0.011 -0.741 1.00 0.00 H new ATOM 0 HA CYS A 2 29.926 -1.638 -3.169 1.00 0.00 H new ATOM 0 HB2 CYS A 2 27.600 -0.540 -1.546 1.00 0.00 H new ATOM 0 HB3 CYS A 2 27.403 -1.403 -3.059 1.00 0.00 H new ATOM 44 N GLY A 3 28.680 0.115 -4.736 1.00 0.00 N ATOM 45 CA GLY A 3 28.466 1.183 -5.695 1.00 0.00 C ATOM 46 C GLY A 3 27.372 2.133 -5.243 1.00 0.00 C ATOM 47 O GLY A 3 26.566 1.774 -4.386 1.00 0.00 O ATOM 0 H GLY A 3 28.338 -0.800 -5.028 1.00 0.00 H new ATOM 0 HA2 GLY A 3 29.394 1.737 -5.835 1.00 0.00 H new ATOM 0 HA3 GLY A 3 28.200 0.756 -6.662 1.00 0.00 H new ATOM 51 N PRO A 4 27.320 3.358 -5.796 1.00 0.00 N ATOM 52 CA PRO A 4 26.300 4.346 -5.425 1.00 0.00 C ATOM 53 C PRO A 4 24.893 3.750 -5.414 1.00 0.00 C ATOM 54 O PRO A 4 24.546 2.948 -6.280 1.00 0.00 O ATOM 55 CB PRO A 4 26.436 5.408 -6.514 1.00 0.00 C ATOM 56 CG PRO A 4 27.868 5.337 -6.914 1.00 0.00 C ATOM 57 CD PRO A 4 28.245 3.882 -6.821 1.00 0.00 C ATOM 0 HA PRO A 4 26.444 4.733 -4.416 1.00 0.00 H new ATOM 0 HB2 PRO A 4 25.776 5.202 -7.357 1.00 0.00 H new ATOM 0 HB3 PRO A 4 26.175 6.398 -6.140 1.00 0.00 H new ATOM 0 HG2 PRO A 4 28.011 5.715 -7.926 1.00 0.00 H new ATOM 0 HG3 PRO A 4 28.489 5.945 -6.256 1.00 0.00 H new ATOM 0 HD2 PRO A 4 28.119 3.372 -7.776 1.00 0.00 H new ATOM 0 HD3 PRO A 4 29.287 3.754 -6.526 1.00 0.00 H new ATOM 65 N PRO A 5 24.067 4.138 -4.425 1.00 0.00 N ATOM 66 CA PRO A 5 22.697 3.631 -4.288 1.00 0.00 C ATOM 67 C PRO A 5 21.863 3.801 -5.557 1.00 0.00 C ATOM 68 O PRO A 5 21.498 4.919 -5.922 1.00 0.00 O ATOM 69 CB PRO A 5 22.111 4.476 -3.155 1.00 0.00 C ATOM 70 CG PRO A 5 23.291 4.926 -2.368 1.00 0.00 C ATOM 71 CD PRO A 5 24.404 5.105 -3.362 1.00 0.00 C ATOM 0 HA PRO A 5 22.692 2.559 -4.093 1.00 0.00 H new ATOM 0 HB2 PRO A 5 21.548 5.324 -3.544 1.00 0.00 H new ATOM 0 HB3 PRO A 5 21.425 3.893 -2.541 1.00 0.00 H new ATOM 0 HG2 PRO A 5 23.080 5.859 -1.846 1.00 0.00 H new ATOM 0 HG3 PRO A 5 23.559 4.190 -1.610 1.00 0.00 H new ATOM 0 HD2 PRO A 5 24.443 6.125 -3.744 1.00 0.00 H new ATOM 0 HD3 PRO A 5 25.377 4.893 -2.919 1.00 0.00 H new ATOM 79 N PRO A 6 21.556 2.687 -6.250 1.00 0.00 N ATOM 80 CA PRO A 6 20.742 2.711 -7.470 1.00 0.00 C ATOM 81 C PRO A 6 19.360 3.291 -7.201 1.00 0.00 C ATOM 82 O PRO A 6 19.043 3.731 -6.096 1.00 0.00 O ATOM 83 CB PRO A 6 20.616 1.231 -7.859 1.00 0.00 C ATOM 84 CG PRO A 6 21.003 0.463 -6.640 1.00 0.00 C ATOM 85 CD PRO A 6 21.984 1.323 -5.902 1.00 0.00 C ATOM 0 HA PRO A 6 21.190 3.329 -8.248 1.00 0.00 H new ATOM 0 HB2 PRO A 6 19.598 0.992 -8.167 1.00 0.00 H new ATOM 0 HB3 PRO A 6 21.268 0.989 -8.698 1.00 0.00 H new ATOM 0 HG2 PRO A 6 20.131 0.247 -6.022 1.00 0.00 H new ATOM 0 HG3 PRO A 6 21.449 -0.495 -6.908 1.00 0.00 H new ATOM 0 HD2 PRO A 6 21.944 1.149 -4.827 1.00 0.00 H new ATOM 0 HD3 PRO A 6 23.009 1.129 -6.218 1.00 0.00 H new ATOM 93 N THR A 7 18.549 3.273 -8.256 1.00 0.00 N ATOM 94 CA THR A 7 17.181 3.762 -8.193 1.00 0.00 C ATOM 95 C THR A 7 16.241 2.587 -7.970 1.00 0.00 C ATOM 96 O THR A 7 16.312 1.586 -8.685 1.00 0.00 O ATOM 97 CB THR A 7 16.780 4.508 -9.481 1.00 0.00 C ATOM 98 OG1 THR A 7 17.645 5.631 -9.686 1.00 0.00 O ATOM 99 CG2 THR A 7 15.335 4.982 -9.405 1.00 0.00 C ATOM 0 H THR A 7 18.823 2.920 -9.173 1.00 0.00 H new ATOM 0 HA THR A 7 17.110 4.468 -7.366 1.00 0.00 H new ATOM 0 HB THR A 7 16.876 3.818 -10.319 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.385 6.099 -10.507 1.00 0.00 H new ATOM 0 HG21 THR A 7 15.075 5.506 -10.325 1.00 0.00 H new ATOM 0 HG22 THR A 7 14.676 4.123 -9.278 1.00 0.00 H new ATOM 0 HG23 THR A 7 15.218 5.657 -8.558 1.00 0.00 H new ATOM 107 N LEU A 8 15.362 2.701 -6.987 1.00 0.00 N ATOM 108 CA LEU A 8 14.421 1.630 -6.697 1.00 0.00 C ATOM 109 C LEU A 8 13.007 2.016 -7.106 1.00 0.00 C ATOM 110 O LEU A 8 12.417 2.932 -6.545 1.00 0.00 O ATOM 111 CB LEU A 8 14.452 1.283 -5.209 1.00 0.00 C ATOM 112 CG LEU A 8 15.847 1.064 -4.623 1.00 0.00 C ATOM 113 CD1 LEU A 8 15.751 0.558 -3.193 1.00 0.00 C ATOM 114 CD2 LEU A 8 16.644 0.094 -5.481 1.00 0.00 C ATOM 0 H LEU A 8 15.280 3.517 -6.381 1.00 0.00 H new ATOM 0 HA LEU A 8 14.721 0.757 -7.276 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.964 2.085 -4.655 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.862 0.380 -5.050 1.00 0.00 H new ATOM 0 HG LEU A 8 16.369 2.021 -4.615 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.753 0.408 -2.792 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.222 1.290 -2.583 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.209 -0.387 -3.177 1.00 0.00 H new ATOM 0 HD21 LEU A 8 17.633 -0.048 -5.046 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.126 -0.864 -5.524 1.00 0.00 H new ATOM 0 HD23 LEU A 8 16.745 0.498 -6.489 1.00 0.00 H new ATOM 126 N SER A 9 12.471 1.335 -8.104 1.00 0.00 N ATOM 127 CA SER A 9 11.116 1.618 -8.541 1.00 0.00 C ATOM 128 C SER A 9 10.124 1.111 -7.500 1.00 0.00 C ATOM 129 O SER A 9 8.940 1.443 -7.539 1.00 0.00 O ATOM 130 CB SER A 9 10.838 0.971 -9.899 1.00 0.00 C ATOM 131 OG SER A 9 11.012 -0.435 -9.839 1.00 0.00 O ATOM 0 H SER A 9 12.945 0.593 -8.620 1.00 0.00 H new ATOM 0 HA SER A 9 11.001 2.696 -8.650 1.00 0.00 H new ATOM 0 HB2 SER A 9 9.820 1.202 -10.214 1.00 0.00 H new ATOM 0 HB3 SER A 9 11.507 1.392 -10.650 1.00 0.00 H new ATOM 0 HG SER A 9 10.827 -0.825 -10.719 1.00 0.00 H new ATOM 137 N PHE A 10 10.629 0.306 -6.566 1.00 0.00 N ATOM 138 CA PHE A 10 9.804 -0.251 -5.501 1.00 0.00 C ATOM 139 C PHE A 10 10.033 0.490 -4.187 1.00 0.00 C ATOM 140 O PHE A 10 9.356 0.234 -3.194 1.00 0.00 O ATOM 141 CB PHE A 10 10.095 -1.742 -5.324 1.00 0.00 C ATOM 142 CG PHE A 10 11.558 -2.078 -5.340 1.00 0.00 C ATOM 143 CD1 PHE A 10 12.324 -1.956 -4.194 1.00 0.00 C ATOM 144 CD2 PHE A 10 12.164 -2.521 -6.504 1.00 0.00 C ATOM 145 CE1 PHE A 10 13.668 -2.267 -4.208 1.00 0.00 C ATOM 146 CE2 PHE A 10 13.508 -2.836 -6.525 1.00 0.00 C ATOM 147 CZ PHE A 10 14.262 -2.709 -5.375 1.00 0.00 C ATOM 0 H PHE A 10 11.609 0.026 -6.528 1.00 0.00 H new ATOM 0 HA PHE A 10 8.759 -0.127 -5.785 1.00 0.00 H new ATOM 0 HB2 PHE A 10 9.665 -2.077 -4.380 1.00 0.00 H new ATOM 0 HB3 PHE A 10 9.595 -2.297 -6.118 1.00 0.00 H new ATOM 0 HD1 PHE A 10 11.865 -1.614 -3.279 1.00 0.00 H new ATOM 0 HD2 PHE A 10 11.578 -2.621 -7.406 1.00 0.00 H new ATOM 0 HE1 PHE A 10 14.256 -2.165 -3.308 1.00 0.00 H new ATOM 0 HE2 PHE A 10 13.969 -3.181 -7.439 1.00 0.00 H new ATOM 0 HZ PHE A 10 15.314 -2.955 -5.388 1.00 0.00 H new ATOM 157 N ALA A 11 10.992 1.409 -4.193 1.00 0.00 N ATOM 158 CA ALA A 11 11.298 2.203 -3.006 1.00 0.00 C ATOM 159 C ALA A 11 11.923 3.532 -3.403 1.00 0.00 C ATOM 160 O ALA A 11 12.568 3.658 -4.437 1.00 0.00 O ATOM 161 CB ALA A 11 12.233 1.434 -2.084 1.00 0.00 C ATOM 0 H ALA A 11 11.571 1.623 -5.005 1.00 0.00 H new ATOM 0 HA ALA A 11 10.368 2.403 -2.473 1.00 0.00 H new ATOM 0 HB1 ALA A 11 12.453 2.037 -1.203 1.00 0.00 H new ATOM 0 HB2 ALA A 11 11.756 0.503 -1.776 1.00 0.00 H new ATOM 0 HB3 ALA A 11 13.160 1.210 -2.611 1.00 0.00 H new ATOM 167 N ALA A 12 11.743 4.512 -2.535 1.00 0.00 N ATOM 168 CA ALA A 12 12.320 5.828 -2.762 1.00 0.00 C ATOM 169 C ALA A 12 13.050 6.310 -1.512 1.00 0.00 C ATOM 170 O ALA A 12 12.640 5.996 -0.395 1.00 0.00 O ATOM 171 CB ALA A 12 11.242 6.820 -3.168 1.00 0.00 C ATOM 0 H ALA A 12 11.206 4.424 -1.672 1.00 0.00 H new ATOM 0 HA ALA A 12 13.041 5.755 -3.576 1.00 0.00 H new ATOM 0 HB1 ALA A 12 11.692 7.799 -3.334 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.763 6.481 -4.086 1.00 0.00 H new ATOM 0 HB3 ALA A 12 10.497 6.893 -2.375 1.00 0.00 H new ATOM 177 N PRO A 13 14.140 7.082 -1.677 1.00 0.00 N ATOM 178 CA PRO A 13 14.920 7.595 -0.547 1.00 0.00 C ATOM 179 C PRO A 13 14.033 8.154 0.561 1.00 0.00 C ATOM 180 O PRO A 13 12.973 8.724 0.304 1.00 0.00 O ATOM 181 CB PRO A 13 15.754 8.707 -1.180 1.00 0.00 C ATOM 182 CG PRO A 13 15.939 8.277 -2.595 1.00 0.00 C ATOM 183 CD PRO A 13 14.691 7.523 -2.975 1.00 0.00 C ATOM 0 HA PRO A 13 15.513 6.817 -0.067 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.244 9.668 -1.121 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.711 8.823 -0.672 1.00 0.00 H new ATOM 0 HG2 PRO A 13 16.087 9.138 -3.247 1.00 0.00 H new ATOM 0 HG3 PRO A 13 16.821 7.645 -2.697 1.00 0.00 H new ATOM 0 HD2 PRO A 13 13.988 8.158 -3.514 1.00 0.00 H new ATOM 0 HD3 PRO A 13 14.916 6.676 -3.623 1.00 0.00 H new ATOM 191 N MET A 14 14.490 7.978 1.801 1.00 0.00 N ATOM 192 CA MET A 14 13.747 8.454 2.961 1.00 0.00 C ATOM 193 C MET A 14 14.685 8.759 4.125 1.00 0.00 C ATOM 194 O MET A 14 14.287 9.393 5.102 1.00 0.00 O ATOM 195 CB MET A 14 12.710 7.409 3.382 1.00 0.00 C ATOM 196 CG MET A 14 11.696 7.922 4.390 1.00 0.00 C ATOM 197 SD MET A 14 10.495 6.665 4.867 1.00 0.00 S ATOM 198 CE MET A 14 9.452 7.599 5.982 1.00 0.00 C ATOM 0 H MET A 14 15.369 7.511 2.024 1.00 0.00 H new ATOM 0 HA MET A 14 13.237 9.377 2.685 1.00 0.00 H new ATOM 0 HB2 MET A 14 12.181 7.058 2.496 1.00 0.00 H new ATOM 0 HB3 MET A 14 13.227 6.548 3.807 1.00 0.00 H new ATOM 0 HG2 MET A 14 12.219 8.275 5.279 1.00 0.00 H new ATOM 0 HG3 MET A 14 11.171 8.779 3.968 1.00 0.00 H new ATOM 0 HE1 MET A 14 8.658 6.956 6.362 1.00 0.00 H new ATOM 0 HE2 MET A 14 10.050 7.969 6.815 1.00 0.00 H new ATOM 0 HE3 MET A 14 9.012 8.442 5.449 1.00 0.00 H new ATOM 208 N ASP A 15 15.932 8.309 4.019 1.00 0.00 N ATOM 209 CA ASP A 15 16.911 8.536 5.077 1.00 0.00 C ATOM 210 C ASP A 15 18.326 8.245 4.588 1.00 0.00 C ATOM 211 O ASP A 15 18.858 7.157 4.810 1.00 0.00 O ATOM 212 CB ASP A 15 16.588 7.662 6.288 1.00 0.00 C ATOM 213 CG ASP A 15 17.389 8.049 7.516 1.00 0.00 C ATOM 214 OD1 ASP A 15 18.510 7.524 7.684 1.00 0.00 O ATOM 215 OD2 ASP A 15 16.894 8.876 8.310 1.00 0.00 O ATOM 0 H ASP A 15 16.287 7.788 3.217 1.00 0.00 H new ATOM 0 HA ASP A 15 16.859 9.586 5.366 1.00 0.00 H new ATOM 0 HB2 ASP A 15 15.524 7.739 6.513 1.00 0.00 H new ATOM 0 HB3 ASP A 15 16.787 6.619 6.042 1.00 0.00 H new ATOM 220 N ILE A 16 18.926 9.225 3.920 1.00 0.00 N ATOM 221 CA ILE A 16 20.273 9.087 3.397 1.00 0.00 C ATOM 222 C ILE A 16 20.715 10.348 2.674 1.00 0.00 C ATOM 223 O ILE A 16 20.337 10.578 1.527 1.00 0.00 O ATOM 224 CB ILE A 16 20.380 7.901 2.424 1.00 0.00 C ATOM 225 CG1 ILE A 16 21.740 7.902 1.719 1.00 0.00 C ATOM 226 CG2 ILE A 16 19.246 7.933 1.409 1.00 0.00 C ATOM 227 CD1 ILE A 16 21.955 6.714 0.807 1.00 0.00 C ATOM 0 H ILE A 16 18.493 10.129 3.729 1.00 0.00 H new ATOM 0 HA ILE A 16 20.923 8.911 4.254 1.00 0.00 H new ATOM 0 HB ILE A 16 20.295 6.979 2.999 1.00 0.00 H new ATOM 0 HG12 ILE A 16 21.836 8.818 1.136 1.00 0.00 H new ATOM 0 HG13 ILE A 16 22.529 7.919 2.471 1.00 0.00 H new ATOM 0 HG21 ILE A 16 19.341 7.085 0.730 1.00 0.00 H new ATOM 0 HG22 ILE A 16 18.290 7.876 1.930 1.00 0.00 H new ATOM 0 HG23 ILE A 16 19.294 8.861 0.839 1.00 0.00 H new ATOM 0 HD11 ILE A 16 22.939 6.784 0.344 1.00 0.00 H new ATOM 0 HD12 ILE A 16 21.892 5.794 1.388 1.00 0.00 H new ATOM 0 HD13 ILE A 16 21.189 6.707 0.032 1.00 0.00 H new ATOM 239 N THR A 17 21.493 11.178 3.349 1.00 0.00 N ATOM 240 CA THR A 17 21.997 12.386 2.721 1.00 0.00 C ATOM 241 C THR A 17 22.752 12.013 1.459 1.00 0.00 C ATOM 242 O THR A 17 23.787 11.350 1.519 1.00 0.00 O ATOM 243 CB THR A 17 22.929 13.182 3.647 1.00 0.00 C ATOM 244 OG1 THR A 17 23.927 12.317 4.202 1.00 0.00 O ATOM 245 CG2 THR A 17 22.145 13.850 4.767 1.00 0.00 C ATOM 0 H THR A 17 21.785 11.041 4.317 1.00 0.00 H new ATOM 0 HA THR A 17 21.140 13.019 2.491 1.00 0.00 H new ATOM 0 HB THR A 17 23.413 13.959 3.055 1.00 0.00 H new ATOM 0 HG1 THR A 17 24.292 11.743 3.496 1.00 0.00 H new ATOM 0 HG21 THR A 17 22.829 14.407 5.408 1.00 0.00 H new ATOM 0 HG22 THR A 17 21.411 14.533 4.340 1.00 0.00 H new ATOM 0 HG23 THR A 17 21.633 13.089 5.357 1.00 0.00 H new ATOM 253 N LEU A 18 22.227 12.431 0.318 1.00 0.00 N ATOM 254 CA LEU A 18 22.841 12.113 -0.954 1.00 0.00 C ATOM 255 C LEU A 18 24.062 12.985 -1.219 1.00 0.00 C ATOM 256 O LEU A 18 24.333 13.367 -2.358 1.00 0.00 O ATOM 257 CB LEU A 18 21.822 12.274 -2.078 1.00 0.00 C ATOM 258 CG LEU A 18 21.093 10.989 -2.473 1.00 0.00 C ATOM 259 CD1 LEU A 18 22.092 9.915 -2.873 1.00 0.00 C ATOM 260 CD2 LEU A 18 20.216 10.501 -1.332 1.00 0.00 C ATOM 0 H LEU A 18 21.377 12.991 0.250 1.00 0.00 H new ATOM 0 HA LEU A 18 23.177 11.077 -0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 18 21.083 13.016 -1.776 1.00 0.00 H new ATOM 0 HB3 LEU A 18 22.331 12.671 -2.956 1.00 0.00 H new ATOM 0 HG LEU A 18 20.454 11.204 -3.329 1.00 0.00 H new ATOM 0 HD11 LEU A 18 21.558 9.007 -3.151 1.00 0.00 H new ATOM 0 HD12 LEU A 18 22.681 10.264 -3.721 1.00 0.00 H new ATOM 0 HD13 LEU A 18 22.754 9.703 -2.034 1.00 0.00 H new ATOM 0 HD21 LEU A 18 19.705 9.586 -1.631 1.00 0.00 H new ATOM 0 HD22 LEU A 18 20.835 10.302 -0.457 1.00 0.00 H new ATOM 0 HD23 LEU A 18 19.478 11.265 -1.088 1.00 0.00 H new ATOM 272 N THR A 19 24.798 13.288 -0.160 1.00 0.00 N ATOM 273 CA THR A 19 25.994 14.108 -0.267 1.00 0.00 C ATOM 274 C THR A 19 27.231 13.230 -0.405 1.00 0.00 C ATOM 275 O THR A 19 28.346 13.724 -0.577 1.00 0.00 O ATOM 276 CB THR A 19 26.151 15.025 0.960 1.00 0.00 C ATOM 277 OG1 THR A 19 26.477 14.246 2.117 1.00 0.00 O ATOM 278 CG2 THR A 19 24.868 15.803 1.213 1.00 0.00 C ATOM 0 H THR A 19 24.586 12.976 0.788 1.00 0.00 H new ATOM 0 HA THR A 19 25.890 14.729 -1.156 1.00 0.00 H new ATOM 0 HB THR A 19 26.957 15.731 0.761 1.00 0.00 H new ATOM 0 HG1 THR A 19 26.577 14.837 2.892 1.00 0.00 H new ATOM 0 HG21 THR A 19 24.998 16.446 2.084 1.00 0.00 H new ATOM 0 HG22 THR A 19 24.636 16.415 0.342 1.00 0.00 H new ATOM 0 HG23 THR A 19 24.050 15.106 1.395 1.00 0.00 H new ATOM 286 N GLU A 20 27.018 11.920 -0.327 1.00 0.00 N ATOM 287 CA GLU A 20 28.101 10.951 -0.448 1.00 0.00 C ATOM 288 C GLU A 20 27.926 10.113 -1.710 1.00 0.00 C ATOM 289 O GLU A 20 27.082 10.417 -2.555 1.00 0.00 O ATOM 290 CB GLU A 20 28.136 10.041 0.782 1.00 0.00 C ATOM 291 CG GLU A 20 28.259 10.794 2.096 1.00 0.00 C ATOM 292 CD GLU A 20 29.559 11.567 2.207 1.00 0.00 C ATOM 293 OE1 GLU A 20 29.608 12.719 1.727 1.00 0.00 O ATOM 294 OE2 GLU A 20 30.527 11.020 2.775 1.00 0.00 O ATOM 0 H GLU A 20 26.099 11.503 -0.180 1.00 0.00 H new ATOM 0 HA GLU A 20 29.044 11.493 -0.515 1.00 0.00 H new ATOM 0 HB2 GLU A 20 27.228 9.438 0.803 1.00 0.00 H new ATOM 0 HB3 GLU A 20 28.975 9.351 0.689 1.00 0.00 H new ATOM 0 HG2 GLU A 20 27.421 11.484 2.195 1.00 0.00 H new ATOM 0 HG3 GLU A 20 28.189 10.087 2.923 1.00 0.00 H new ATOM 301 N THR A 21 28.724 9.060 -1.835 1.00 0.00 N ATOM 302 CA THR A 21 28.650 8.179 -2.994 1.00 0.00 C ATOM 303 C THR A 21 29.008 6.747 -2.617 1.00 0.00 C ATOM 304 O THR A 21 28.697 5.805 -3.345 1.00 0.00 O ATOM 305 CB THR A 21 29.590 8.647 -4.120 1.00 0.00 C ATOM 306 OG1 THR A 21 30.039 9.983 -3.862 1.00 0.00 O ATOM 307 CG2 THR A 21 28.888 8.598 -5.469 1.00 0.00 C ATOM 0 H THR A 21 29.430 8.795 -1.148 1.00 0.00 H new ATOM 0 HA THR A 21 27.621 8.215 -3.351 1.00 0.00 H new ATOM 0 HB THR A 21 30.447 7.974 -4.148 1.00 0.00 H new ATOM 0 HG1 THR A 21 30.637 10.272 -4.582 1.00 0.00 H new ATOM 0 HG21 THR A 21 29.573 8.933 -6.248 1.00 0.00 H new ATOM 0 HG22 THR A 21 28.573 7.576 -5.678 1.00 0.00 H new ATOM 0 HG23 THR A 21 28.015 9.250 -5.449 1.00 0.00 H new ATOM 315 N ARG A 22 29.669 6.592 -1.475 1.00 0.00 N ATOM 316 CA ARG A 22 30.077 5.277 -0.998 1.00 0.00 C ATOM 317 C ARG A 22 29.492 5.000 0.382 1.00 0.00 C ATOM 318 O ARG A 22 29.267 5.922 1.165 1.00 0.00 O ATOM 319 CB ARG A 22 31.596 5.182 -0.933 1.00 0.00 C ATOM 320 CG ARG A 22 32.289 5.493 -2.248 1.00 0.00 C ATOM 321 CD ARG A 22 33.799 5.509 -2.089 1.00 0.00 C ATOM 322 NE ARG A 22 34.234 6.494 -1.103 1.00 0.00 N ATOM 323 CZ ARG A 22 35.481 6.582 -0.648 1.00 0.00 C ATOM 324 NH1 ARG A 22 36.413 5.749 -1.092 1.00 0.00 N ATOM 325 NH2 ARG A 22 35.797 7.505 0.250 1.00 0.00 N ATOM 0 H ARG A 22 29.934 7.363 -0.862 1.00 0.00 H new ATOM 0 HA ARG A 22 29.700 4.533 -1.700 1.00 0.00 H new ATOM 0 HB2 ARG A 22 31.961 5.869 -0.170 1.00 0.00 H new ATOM 0 HB3 ARG A 22 31.874 4.177 -0.616 1.00 0.00 H new ATOM 0 HG2 ARG A 22 32.008 4.749 -2.994 1.00 0.00 H new ATOM 0 HG3 ARG A 22 31.951 6.460 -2.619 1.00 0.00 H new ATOM 0 HD2 ARG A 22 34.143 4.519 -1.789 1.00 0.00 H new ATOM 0 HD3 ARG A 22 34.263 5.729 -3.051 1.00 0.00 H new ATOM 0 HE ARG A 22 33.543 7.152 -0.743 1.00 0.00 H new ATOM 0 HH11 ARG A 22 36.174 5.039 -1.784 1.00 0.00 H new ATOM 0 HH12 ARG A 22 37.368 5.819 -0.741 1.00 0.00 H new ATOM 0 HH21 ARG A 22 35.084 8.148 0.593 1.00 0.00 H new ATOM 0 HH22 ARG A 22 36.753 7.571 0.598 1.00 0.00 H new ATOM 339 N PHE A 23 29.256 3.724 0.677 1.00 0.00 N ATOM 340 CA PHE A 23 28.684 3.305 1.954 1.00 0.00 C ATOM 341 C PHE A 23 29.185 1.901 2.292 1.00 0.00 C ATOM 342 O PHE A 23 28.829 0.931 1.622 1.00 0.00 O ATOM 343 CB PHE A 23 27.153 3.316 1.884 1.00 0.00 C ATOM 344 CG PHE A 23 26.564 4.604 1.373 1.00 0.00 C ATOM 345 CD1 PHE A 23 26.581 4.895 0.019 1.00 0.00 C ATOM 346 CD2 PHE A 23 26.003 5.525 2.244 1.00 0.00 C ATOM 347 CE1 PHE A 23 26.055 6.077 -0.458 1.00 0.00 C ATOM 348 CE2 PHE A 23 25.471 6.710 1.772 1.00 0.00 C ATOM 349 CZ PHE A 23 25.498 6.987 0.419 1.00 0.00 C ATOM 0 H PHE A 23 29.455 2.953 0.039 1.00 0.00 H new ATOM 0 HA PHE A 23 28.996 4.001 2.733 1.00 0.00 H new ATOM 0 HB2 PHE A 23 26.825 2.500 1.240 1.00 0.00 H new ATOM 0 HB3 PHE A 23 26.754 3.118 2.879 1.00 0.00 H new ATOM 0 HD1 PHE A 23 27.012 4.186 -0.673 1.00 0.00 H new ATOM 0 HD2 PHE A 23 25.981 5.314 3.303 1.00 0.00 H new ATOM 0 HE1 PHE A 23 26.079 6.291 -1.516 1.00 0.00 H new ATOM 0 HE2 PHE A 23 25.035 7.419 2.460 1.00 0.00 H new ATOM 0 HZ PHE A 23 25.084 7.913 0.048 1.00 0.00 H new ATOM 359 N LYS A 24 30.019 1.802 3.325 1.00 0.00 N ATOM 360 CA LYS A 24 30.601 0.523 3.734 1.00 0.00 C ATOM 361 C LYS A 24 29.566 -0.584 3.868 1.00 0.00 C ATOM 362 O LYS A 24 28.362 -0.332 3.893 1.00 0.00 O ATOM 363 CB LYS A 24 31.350 0.669 5.056 1.00 0.00 C ATOM 364 CG LYS A 24 30.615 1.511 6.086 1.00 0.00 C ATOM 365 CD LYS A 24 31.408 1.630 7.377 1.00 0.00 C ATOM 366 CE LYS A 24 30.722 2.555 8.368 1.00 0.00 C ATOM 367 NZ LYS A 24 29.393 2.035 8.790 1.00 0.00 N ATOM 0 H LYS A 24 30.309 2.595 3.897 1.00 0.00 H new ATOM 0 HA LYS A 24 31.292 0.238 2.940 1.00 0.00 H new ATOM 0 HB2 LYS A 24 31.531 -0.322 5.472 1.00 0.00 H new ATOM 0 HB3 LYS A 24 32.325 1.116 4.863 1.00 0.00 H new ATOM 0 HG2 LYS A 24 30.429 2.505 5.679 1.00 0.00 H new ATOM 0 HG3 LYS A 24 29.643 1.065 6.295 1.00 0.00 H new ATOM 0 HD2 LYS A 24 31.530 0.643 7.823 1.00 0.00 H new ATOM 0 HD3 LYS A 24 32.407 2.006 7.158 1.00 0.00 H new ATOM 0 HE2 LYS A 24 31.357 2.681 9.245 1.00 0.00 H new ATOM 0 HE3 LYS A 24 30.599 3.541 7.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 29.020 2.622 9.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 28.736 2.066 7.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 29.493 1.053 9.118 1.00 0.00 H new ATOM 381 N THR A 25 30.055 -1.817 3.969 1.00 0.00 N ATOM 382 CA THR A 25 29.192 -2.980 4.087 1.00 0.00 C ATOM 383 C THR A 25 28.438 -3.004 5.410 1.00 0.00 C ATOM 384 O THR A 25 27.653 -3.917 5.668 1.00 0.00 O ATOM 385 CB THR A 25 29.985 -4.285 3.962 1.00 0.00 C ATOM 386 OG1 THR A 25 31.270 -4.141 4.577 1.00 0.00 O ATOM 387 CG2 THR A 25 30.147 -4.710 2.503 1.00 0.00 C ATOM 0 H THR A 25 31.052 -2.033 3.971 1.00 0.00 H new ATOM 0 HA THR A 25 28.477 -2.902 3.268 1.00 0.00 H new ATOM 0 HB THR A 25 29.423 -5.065 4.475 1.00 0.00 H new ATOM 0 HG1 THR A 25 31.769 -4.981 4.494 1.00 0.00 H new ATOM 0 HG21 THR A 25 30.715 -5.639 2.456 1.00 0.00 H new ATOM 0 HG22 THR A 25 29.164 -4.862 2.057 1.00 0.00 H new ATOM 0 HG23 THR A 25 30.678 -3.932 1.954 1.00 0.00 H new ATOM 395 N GLY A 26 28.675 -2.002 6.243 1.00 0.00 N ATOM 396 CA GLY A 26 28.009 -1.941 7.529 1.00 0.00 C ATOM 397 C GLY A 26 26.862 -0.956 7.528 1.00 0.00 C ATOM 398 O GLY A 26 26.043 -0.937 8.447 1.00 0.00 O ATOM 0 H GLY A 26 29.315 -1.231 6.053 1.00 0.00 H new ATOM 0 HA2 GLY A 26 27.636 -2.931 7.791 1.00 0.00 H new ATOM 0 HA3 GLY A 26 28.729 -1.658 8.297 1.00 0.00 H new ATOM 402 N THR A 27 26.808 -0.136 6.487 1.00 0.00 N ATOM 403 CA THR A 27 25.764 0.875 6.347 1.00 0.00 C ATOM 404 C THR A 27 24.401 0.232 6.104 1.00 0.00 C ATOM 405 O THR A 27 24.292 -0.987 5.993 1.00 0.00 O ATOM 406 CB THR A 27 26.070 1.836 5.187 1.00 0.00 C ATOM 407 OG1 THR A 27 25.296 3.034 5.324 1.00 0.00 O ATOM 408 CG2 THR A 27 25.760 1.182 3.852 1.00 0.00 C ATOM 0 H THR A 27 27.480 -0.151 5.720 1.00 0.00 H new ATOM 0 HA THR A 27 25.740 1.434 7.283 1.00 0.00 H new ATOM 0 HB THR A 27 27.131 2.083 5.219 1.00 0.00 H new ATOM 0 HG1 THR A 27 25.499 3.641 4.582 1.00 0.00 H new ATOM 0 HG21 THR A 27 25.984 1.879 3.045 1.00 0.00 H new ATOM 0 HG22 THR A 27 26.369 0.285 3.736 1.00 0.00 H new ATOM 0 HG23 THR A 27 24.705 0.911 3.816 1.00 0.00 H new ATOM 416 N THR A 28 23.362 1.060 6.025 1.00 0.00 N ATOM 417 CA THR A 28 22.011 0.571 5.776 1.00 0.00 C ATOM 418 C THR A 28 21.050 1.726 5.489 1.00 0.00 C ATOM 419 O THR A 28 20.989 2.699 6.240 1.00 0.00 O ATOM 420 CB THR A 28 21.482 -0.265 6.961 1.00 0.00 C ATOM 421 OG1 THR A 28 20.370 -1.062 6.537 1.00 0.00 O ATOM 422 CG2 THR A 28 21.055 0.617 8.124 1.00 0.00 C ATOM 0 H THR A 28 23.431 2.072 6.130 1.00 0.00 H new ATOM 0 HA THR A 28 22.063 -0.072 4.897 1.00 0.00 H new ATOM 0 HB THR A 28 22.294 -0.907 7.301 1.00 0.00 H new ATOM 0 HG1 THR A 28 20.698 -1.869 6.088 1.00 0.00 H new ATOM 0 HG21 THR A 28 20.689 -0.007 8.939 1.00 0.00 H new ATOM 0 HG22 THR A 28 21.908 1.201 8.470 1.00 0.00 H new ATOM 0 HG23 THR A 28 20.262 1.290 7.798 1.00 0.00 H new ATOM 430 N LEU A 29 20.318 1.622 4.384 1.00 0.00 N ATOM 431 CA LEU A 29 19.393 2.679 3.988 1.00 0.00 C ATOM 432 C LEU A 29 18.001 2.459 4.566 1.00 0.00 C ATOM 433 O LEU A 29 17.754 1.489 5.282 1.00 0.00 O ATOM 434 CB LEU A 29 19.299 2.768 2.461 1.00 0.00 C ATOM 435 CG LEU A 29 20.632 2.726 1.711 1.00 0.00 C ATOM 436 CD1 LEU A 29 20.448 3.186 0.272 1.00 0.00 C ATOM 437 CD2 LEU A 29 21.675 3.573 2.413 1.00 0.00 C ATOM 0 H LEU A 29 20.346 0.823 3.751 1.00 0.00 H new ATOM 0 HA LEU A 29 19.787 3.614 4.387 1.00 0.00 H new ATOM 0 HB2 LEU A 29 18.677 1.947 2.105 1.00 0.00 H new ATOM 0 HB3 LEU A 29 18.785 3.693 2.200 1.00 0.00 H new ATOM 0 HG LEU A 29 20.985 1.695 1.702 1.00 0.00 H new ATOM 0 HD11 LEU A 29 21.406 3.150 -0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 29 19.738 2.530 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 29 20.068 4.208 0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 29 22.613 3.527 1.860 1.00 0.00 H new ATOM 0 HD22 LEU A 29 21.332 4.607 2.460 1.00 0.00 H new ATOM 0 HD23 LEU A 29 21.830 3.196 3.424 1.00 0.00 H new ATOM 449 N LYS A 30 17.096 3.380 4.246 1.00 0.00 N ATOM 450 CA LYS A 30 15.715 3.302 4.702 1.00 0.00 C ATOM 451 C LYS A 30 14.798 3.029 3.517 1.00 0.00 C ATOM 452 O LYS A 30 14.382 1.894 3.290 1.00 0.00 O ATOM 453 CB LYS A 30 15.299 4.604 5.391 1.00 0.00 C ATOM 454 CG LYS A 30 14.078 4.459 6.287 1.00 0.00 C ATOM 455 CD LYS A 30 14.365 3.564 7.481 1.00 0.00 C ATOM 456 CE LYS A 30 13.183 3.508 8.436 1.00 0.00 C ATOM 457 NZ LYS A 30 11.955 2.990 7.773 1.00 0.00 N ATOM 0 H LYS A 30 17.299 4.195 3.667 1.00 0.00 H new ATOM 0 HA LYS A 30 15.631 2.488 5.422 1.00 0.00 H new ATOM 0 HB2 LYS A 30 16.134 4.972 5.987 1.00 0.00 H new ATOM 0 HB3 LYS A 30 15.093 5.357 4.631 1.00 0.00 H new ATOM 0 HG2 LYS A 30 13.763 5.442 6.636 1.00 0.00 H new ATOM 0 HG3 LYS A 30 13.250 4.045 5.711 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.601 2.558 7.134 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.244 3.933 8.010 1.00 0.00 H new ATOM 0 HE2 LYS A 30 13.433 2.872 9.285 1.00 0.00 H new ATOM 0 HE3 LYS A 30 12.989 4.505 8.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 11.213 2.840 8.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 11.624 3.679 7.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 12.169 2.088 7.301 1.00 0.00 H new ATOM 471 N TYR A 31 14.502 4.083 2.759 1.00 0.00 N ATOM 472 CA TYR A 31 13.648 3.972 1.581 1.00 0.00 C ATOM 473 C TYR A 31 12.243 3.495 1.943 1.00 0.00 C ATOM 474 O TYR A 31 12.056 2.706 2.870 1.00 0.00 O ATOM 475 CB TYR A 31 14.286 3.024 0.561 1.00 0.00 C ATOM 476 CG TYR A 31 15.265 3.700 -0.373 1.00 0.00 C ATOM 477 CD1 TYR A 31 16.390 4.351 0.120 1.00 0.00 C ATOM 478 CD2 TYR A 31 15.064 3.689 -1.748 1.00 0.00 C ATOM 479 CE1 TYR A 31 17.285 4.971 -0.730 1.00 0.00 C ATOM 480 CE2 TYR A 31 15.956 4.304 -2.605 1.00 0.00 C ATOM 481 CZ TYR A 31 17.065 4.944 -2.091 1.00 0.00 C ATOM 482 OH TYR A 31 17.955 5.560 -2.941 1.00 0.00 O ATOM 0 H TYR A 31 14.843 5.027 2.942 1.00 0.00 H new ATOM 0 HA TYR A 31 13.553 4.965 1.142 1.00 0.00 H new ATOM 0 HB2 TYR A 31 14.800 2.224 1.094 1.00 0.00 H new ATOM 0 HB3 TYR A 31 13.498 2.557 -0.030 1.00 0.00 H new ATOM 0 HD1 TYR A 31 16.567 4.372 1.185 1.00 0.00 H new ATOM 0 HD2 TYR A 31 14.196 3.191 -2.154 1.00 0.00 H new ATOM 0 HE1 TYR A 31 18.153 5.475 -0.331 1.00 0.00 H new ATOM 0 HE2 TYR A 31 15.786 4.284 -3.671 1.00 0.00 H new ATOM 0 HH TYR A 31 17.654 5.447 -3.867 1.00 0.00 H new ATOM 492 N THR A 32 11.257 3.987 1.202 1.00 0.00 N ATOM 493 CA THR A 32 9.863 3.616 1.426 1.00 0.00 C ATOM 494 C THR A 32 9.192 3.205 0.117 1.00 0.00 C ATOM 495 O THR A 32 9.300 3.903 -0.891 1.00 0.00 O ATOM 496 CB THR A 32 9.071 4.773 2.067 1.00 0.00 C ATOM 497 OG1 THR A 32 7.671 4.611 1.816 1.00 0.00 O ATOM 498 CG2 THR A 32 9.541 6.117 1.529 1.00 0.00 C ATOM 0 H THR A 32 11.397 4.647 0.437 1.00 0.00 H new ATOM 0 HA THR A 32 9.861 2.768 2.111 1.00 0.00 H new ATOM 0 HB THR A 32 9.248 4.751 3.142 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.177 5.350 2.229 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.967 6.917 1.997 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.599 6.250 1.755 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.394 6.148 0.449 1.00 0.00 H new ATOM 506 N CYS A 33 8.501 2.067 0.138 1.00 0.00 N ATOM 507 CA CYS A 33 7.830 1.557 -1.055 1.00 0.00 C ATOM 508 C CYS A 33 6.572 2.373 -1.389 1.00 0.00 C ATOM 509 O CYS A 33 5.609 2.440 -0.625 1.00 0.00 O ATOM 510 CB CYS A 33 7.464 0.077 -0.873 1.00 0.00 C ATOM 511 SG CYS A 33 8.624 -0.886 0.159 1.00 0.00 S ATOM 0 H CYS A 33 8.391 1.482 0.966 1.00 0.00 H new ATOM 0 HA CYS A 33 8.525 1.654 -1.889 1.00 0.00 H new ATOM 0 HB2 CYS A 33 6.470 0.016 -0.429 1.00 0.00 H new ATOM 0 HB3 CYS A 33 7.403 -0.390 -1.856 1.00 0.00 H new ATOM 516 N LEU A 34 6.643 2.990 -2.571 1.00 0.00 N ATOM 517 CA LEU A 34 5.599 3.872 -3.105 1.00 0.00 C ATOM 518 C LEU A 34 4.440 3.099 -3.761 1.00 0.00 C ATOM 519 O LEU A 34 4.428 1.873 -3.746 1.00 0.00 O ATOM 520 CB LEU A 34 6.252 4.808 -4.128 1.00 0.00 C ATOM 521 CG LEU A 34 7.615 5.370 -3.715 1.00 0.00 C ATOM 522 CD1 LEU A 34 8.316 5.991 -4.913 1.00 0.00 C ATOM 523 CD2 LEU A 34 7.456 6.392 -2.599 1.00 0.00 C ATOM 0 H LEU A 34 7.442 2.889 -3.197 1.00 0.00 H new ATOM 0 HA LEU A 34 5.162 4.431 -2.277 1.00 0.00 H new ATOM 0 HB2 LEU A 34 6.368 4.269 -5.068 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.575 5.641 -4.319 1.00 0.00 H new ATOM 0 HG LEU A 34 8.229 4.550 -3.342 1.00 0.00 H new ATOM 0 HD11 LEU A 34 9.284 6.386 -4.604 1.00 0.00 H new ATOM 0 HD12 LEU A 34 8.463 5.233 -5.682 1.00 0.00 H new ATOM 0 HD13 LEU A 34 7.705 6.800 -5.313 1.00 0.00 H new ATOM 0 HD21 LEU A 34 8.435 6.780 -2.319 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.826 7.212 -2.943 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.993 5.917 -1.734 1.00 0.00 H new ATOM 535 N PRO A 35 3.427 3.822 -4.321 1.00 0.00 N ATOM 536 CA PRO A 35 2.274 3.213 -4.997 1.00 0.00 C ATOM 537 C PRO A 35 2.610 1.924 -5.741 1.00 0.00 C ATOM 538 O PRO A 35 3.304 1.933 -6.759 1.00 0.00 O ATOM 539 CB PRO A 35 1.858 4.305 -5.973 1.00 0.00 C ATOM 540 CG PRO A 35 2.154 5.579 -5.255 1.00 0.00 C ATOM 541 CD PRO A 35 3.295 5.295 -4.305 1.00 0.00 C ATOM 0 HA PRO A 35 1.501 2.910 -4.291 1.00 0.00 H new ATOM 0 HB2 PRO A 35 2.416 4.237 -6.907 1.00 0.00 H new ATOM 0 HB3 PRO A 35 0.801 4.229 -6.227 1.00 0.00 H new ATOM 0 HG2 PRO A 35 2.425 6.365 -5.960 1.00 0.00 H new ATOM 0 HG3 PRO A 35 1.276 5.928 -4.711 1.00 0.00 H new ATOM 0 HD2 PRO A 35 4.215 5.780 -4.632 1.00 0.00 H new ATOM 0 HD3 PRO A 35 3.079 5.664 -3.302 1.00 0.00 H new ATOM 549 N GLY A 36 2.105 0.821 -5.208 1.00 0.00 N ATOM 550 CA GLY A 36 2.352 -0.477 -5.805 1.00 0.00 C ATOM 551 C GLY A 36 3.014 -1.435 -4.838 1.00 0.00 C ATOM 552 O GLY A 36 2.875 -2.651 -4.965 1.00 0.00 O ATOM 0 H GLY A 36 1.526 0.801 -4.369 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.409 -0.903 -6.147 1.00 0.00 H new ATOM 0 HA3 GLY A 36 2.985 -0.356 -6.684 1.00 0.00 H new ATOM 556 N TYR A 37 3.779 -0.882 -3.901 1.00 0.00 N ATOM 557 CA TYR A 37 4.470 -1.684 -2.899 1.00 0.00 C ATOM 558 C TYR A 37 4.249 -1.132 -1.467 1.00 0.00 C ATOM 559 O TYR A 37 4.648 -0.011 -1.159 1.00 0.00 O ATOM 560 CB TYR A 37 5.954 -1.712 -3.235 1.00 0.00 C ATOM 561 CG TYR A 37 6.259 -1.343 -4.674 1.00 0.00 C ATOM 562 CD1 TYR A 37 6.044 -0.049 -5.145 1.00 0.00 C ATOM 563 CD2 TYR A 37 6.755 -2.290 -5.561 1.00 0.00 C ATOM 564 CE1 TYR A 37 6.318 0.285 -6.457 1.00 0.00 C ATOM 565 CE2 TYR A 37 7.032 -1.961 -6.873 1.00 0.00 C ATOM 566 CZ TYR A 37 6.813 -0.673 -7.317 1.00 0.00 C ATOM 567 OH TYR A 37 7.087 -0.344 -8.624 1.00 0.00 O ATOM 0 H TYR A 37 3.936 0.122 -3.816 1.00 0.00 H new ATOM 0 HA TYR A 37 4.062 -2.695 -2.916 1.00 0.00 H new ATOM 0 HB2 TYR A 37 6.481 -1.024 -2.573 1.00 0.00 H new ATOM 0 HB3 TYR A 37 6.344 -2.710 -3.034 1.00 0.00 H new ATOM 0 HD1 TYR A 37 5.657 0.704 -4.474 1.00 0.00 H new ATOM 0 HD2 TYR A 37 6.927 -3.300 -5.219 1.00 0.00 H new ATOM 0 HE1 TYR A 37 6.145 1.292 -6.808 1.00 0.00 H new ATOM 0 HE2 TYR A 37 7.419 -2.709 -7.549 1.00 0.00 H new ATOM 0 HH TYR A 37 7.782 0.347 -8.649 1.00 0.00 H new ATOM 577 N VAL A 38 3.583 -1.929 -0.611 1.00 0.00 N ATOM 578 CA VAL A 38 3.328 -1.531 0.785 1.00 0.00 C ATOM 579 C VAL A 38 4.352 -2.204 1.684 1.00 0.00 C ATOM 580 O VAL A 38 5.475 -2.495 1.268 1.00 0.00 O ATOM 581 CB VAL A 38 1.897 -1.864 1.303 1.00 0.00 C ATOM 582 CG1 VAL A 38 0.837 -1.080 0.548 1.00 0.00 C ATOM 583 CG2 VAL A 38 1.604 -3.351 1.251 1.00 0.00 C ATOM 0 H VAL A 38 3.214 -2.847 -0.860 1.00 0.00 H new ATOM 0 HA VAL A 38 3.412 -0.445 0.812 1.00 0.00 H new ATOM 0 HB VAL A 38 1.863 -1.560 2.349 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.149 -1.336 0.935 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.012 -0.012 0.679 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.887 -1.328 -0.512 1.00 0.00 H new ATOM 0 HG21 VAL A 38 0.596 -3.536 1.621 1.00 0.00 H new ATOM 0 HG22 VAL A 38 1.683 -3.702 0.222 1.00 0.00 H new ATOM 0 HG23 VAL A 38 2.323 -3.885 1.872 1.00 0.00 H new ATOM 593 N ARG A 39 3.944 -2.445 2.926 1.00 0.00 N ATOM 594 CA ARG A 39 4.801 -3.090 3.909 1.00 0.00 C ATOM 595 C ARG A 39 4.273 -4.468 4.298 1.00 0.00 C ATOM 596 O ARG A 39 3.635 -4.627 5.339 1.00 0.00 O ATOM 597 CB ARG A 39 4.928 -2.211 5.154 1.00 0.00 C ATOM 598 CG ARG A 39 5.380 -0.790 4.854 1.00 0.00 C ATOM 599 CD ARG A 39 6.893 -0.690 4.763 1.00 0.00 C ATOM 600 NE ARG A 39 7.525 -0.768 6.077 1.00 0.00 N ATOM 601 CZ ARG A 39 7.893 0.298 6.781 1.00 0.00 C ATOM 602 NH1 ARG A 39 7.684 1.518 6.301 1.00 0.00 N ATOM 603 NH2 ARG A 39 8.465 0.148 7.967 1.00 0.00 N ATOM 0 H ARG A 39 3.017 -2.200 3.275 1.00 0.00 H new ATOM 0 HA ARG A 39 5.783 -3.223 3.456 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.965 -2.177 5.664 1.00 0.00 H new ATOM 0 HB3 ARG A 39 5.637 -2.671 5.842 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.936 -0.457 3.916 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.017 -0.120 5.634 1.00 0.00 H new ATOM 0 HD2 ARG A 39 7.272 -1.492 4.130 1.00 0.00 H new ATOM 0 HD3 ARG A 39 7.166 0.250 4.284 1.00 0.00 H new ATOM 0 HE ARG A 39 7.693 -1.691 6.477 1.00 0.00 H new ATOM 0 HH11 ARG A 39 7.240 1.639 5.391 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.967 2.335 6.843 1.00 0.00 H new ATOM 0 HH21 ARG A 39 8.624 -0.787 8.342 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.746 0.968 8.505 1.00 0.00 H new ATOM 617 N SER A 40 4.532 -5.460 3.450 1.00 0.00 N ATOM 618 CA SER A 40 4.107 -6.826 3.726 1.00 0.00 C ATOM 619 C SER A 40 5.007 -7.431 4.795 1.00 0.00 C ATOM 620 O SER A 40 4.550 -8.158 5.677 1.00 0.00 O ATOM 621 CB SER A 40 4.156 -7.672 2.454 1.00 0.00 C ATOM 622 OG SER A 40 3.729 -9.000 2.708 1.00 0.00 O ATOM 0 H SER A 40 5.033 -5.342 2.569 1.00 0.00 H new ATOM 0 HA SER A 40 3.078 -6.811 4.086 1.00 0.00 H new ATOM 0 HB2 SER A 40 3.522 -7.223 1.690 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.172 -7.682 2.059 1.00 0.00 H new ATOM 0 HG SER A 40 3.768 -9.520 1.879 1.00 0.00 H new ATOM 628 N HIS A 41 6.296 -7.118 4.699 1.00 0.00 N ATOM 629 CA HIS A 41 7.279 -7.595 5.659 1.00 0.00 C ATOM 630 C HIS A 41 7.669 -6.461 6.598 1.00 0.00 C ATOM 631 O HIS A 41 8.325 -6.676 7.617 1.00 0.00 O ATOM 632 CB HIS A 41 8.517 -8.132 4.936 1.00 0.00 C ATOM 633 CG HIS A 41 8.214 -9.235 3.971 1.00 0.00 C ATOM 634 ND1 HIS A 41 8.246 -9.069 2.601 1.00 0.00 N ATOM 635 CD2 HIS A 41 7.871 -10.529 4.181 1.00 0.00 C ATOM 636 CE1 HIS A 41 7.936 -10.211 2.013 1.00 0.00 C ATOM 637 NE2 HIS A 41 7.705 -11.112 2.950 1.00 0.00 N ATOM 0 H HIS A 41 6.683 -6.532 3.960 1.00 0.00 H new ATOM 0 HA HIS A 41 6.841 -8.407 6.239 1.00 0.00 H new ATOM 0 HB2 HIS A 41 8.999 -7.314 4.401 1.00 0.00 H new ATOM 0 HB3 HIS A 41 9.232 -8.493 5.676 1.00 0.00 H new ATOM 0 HD2 HIS A 41 7.751 -11.012 5.139 1.00 0.00 H new ATOM 0 HE1 HIS A 41 7.881 -10.379 0.948 1.00 0.00 H new ATOM 0 HE2 HIS A 41 7.445 -12.084 2.785 1.00 0.00 H new ATOM 646 N SER A 42 7.258 -5.247 6.227 1.00 0.00 N ATOM 647 CA SER A 42 7.527 -4.046 7.015 1.00 0.00 C ATOM 648 C SER A 42 9.004 -3.663 6.990 1.00 0.00 C ATOM 649 O SER A 42 9.381 -2.593 7.464 1.00 0.00 O ATOM 650 CB SER A 42 7.062 -4.246 8.456 1.00 0.00 C ATOM 651 OG SER A 42 7.324 -3.098 9.244 1.00 0.00 O ATOM 0 H SER A 42 6.730 -5.070 5.372 1.00 0.00 H new ATOM 0 HA SER A 42 6.968 -3.227 6.562 1.00 0.00 H new ATOM 0 HB2 SER A 42 5.994 -4.463 8.469 1.00 0.00 H new ATOM 0 HB3 SER A 42 7.568 -5.110 8.888 1.00 0.00 H new ATOM 0 HG SER A 42 8.151 -2.672 8.937 1.00 0.00 H new ATOM 657 N THR A 43 9.834 -4.535 6.434 1.00 0.00 N ATOM 658 CA THR A 43 11.267 -4.274 6.350 1.00 0.00 C ATOM 659 C THR A 43 11.603 -3.467 5.100 1.00 0.00 C ATOM 660 O THR A 43 10.911 -3.559 4.087 1.00 0.00 O ATOM 661 CB THR A 43 12.080 -5.579 6.330 1.00 0.00 C ATOM 662 OG1 THR A 43 11.414 -6.587 7.100 1.00 0.00 O ATOM 663 CG2 THR A 43 13.476 -5.352 6.889 1.00 0.00 C ATOM 0 H THR A 43 9.542 -5.427 6.035 1.00 0.00 H new ATOM 0 HA THR A 43 11.534 -3.702 7.239 1.00 0.00 H new ATOM 0 HB THR A 43 12.165 -5.911 5.295 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.939 -7.414 7.079 1.00 0.00 H new ATOM 0 HG21 THR A 43 14.034 -6.288 6.866 1.00 0.00 H new ATOM 0 HG22 THR A 43 13.993 -4.606 6.285 1.00 0.00 H new ATOM 0 HG23 THR A 43 13.403 -4.999 7.918 1.00 0.00 H new ATOM 671 N GLN A 44 12.670 -2.677 5.183 1.00 0.00 N ATOM 672 CA GLN A 44 13.107 -1.854 4.059 1.00 0.00 C ATOM 673 C GLN A 44 14.426 -1.158 4.380 1.00 0.00 C ATOM 674 O GLN A 44 14.442 -0.063 4.941 1.00 0.00 O ATOM 675 CB GLN A 44 12.034 -0.821 3.702 1.00 0.00 C ATOM 676 CG GLN A 44 11.516 -0.038 4.899 1.00 0.00 C ATOM 677 CD GLN A 44 10.375 0.897 4.541 1.00 0.00 C ATOM 678 OE1 GLN A 44 10.208 1.953 5.152 1.00 0.00 O ATOM 679 NE2 GLN A 44 9.578 0.510 3.550 1.00 0.00 N ATOM 0 H GLN A 44 13.249 -2.589 6.018 1.00 0.00 H new ATOM 0 HA GLN A 44 13.263 -2.506 3.200 1.00 0.00 H new ATOM 0 HB2 GLN A 44 12.443 -0.123 2.972 1.00 0.00 H new ATOM 0 HB3 GLN A 44 11.198 -1.330 3.222 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.181 -0.736 5.666 1.00 0.00 H new ATOM 0 HG3 GLN A 44 12.333 0.541 5.330 1.00 0.00 H new ATOM 0 HE21 GLN A 44 9.753 -0.373 3.070 1.00 0.00 H new ATOM 0 HE22 GLN A 44 8.792 1.096 3.269 1.00 0.00 H new ATOM 688 N THR A 45 15.535 -1.804 4.021 1.00 0.00 N ATOM 689 CA THR A 45 16.862 -1.253 4.278 1.00 0.00 C ATOM 690 C THR A 45 17.869 -1.739 3.240 1.00 0.00 C ATOM 691 O THR A 45 17.870 -2.909 2.861 1.00 0.00 O ATOM 692 CB THR A 45 17.377 -1.643 5.679 1.00 0.00 C ATOM 693 OG1 THR A 45 17.597 -3.057 5.743 1.00 0.00 O ATOM 694 CG2 THR A 45 16.389 -1.235 6.761 1.00 0.00 C ATOM 0 H THR A 45 15.539 -2.709 3.551 1.00 0.00 H new ATOM 0 HA THR A 45 16.765 -0.169 4.219 1.00 0.00 H new ATOM 0 HB THR A 45 18.315 -1.116 5.851 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.925 -3.297 6.635 1.00 0.00 H new ATOM 0 HG21 THR A 45 16.779 -1.523 7.737 1.00 0.00 H new ATOM 0 HG22 THR A 45 16.243 -0.155 6.732 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.435 -1.734 6.590 1.00 0.00 H new ATOM 702 N LEU A 46 18.728 -0.831 2.788 1.00 0.00 N ATOM 703 CA LEU A 46 19.750 -1.165 1.801 1.00 0.00 C ATOM 704 C LEU A 46 21.121 -1.195 2.465 1.00 0.00 C ATOM 705 O LEU A 46 21.681 -0.154 2.807 1.00 0.00 O ATOM 706 CB LEU A 46 19.733 -0.166 0.640 1.00 0.00 C ATOM 707 CG LEU A 46 18.857 -0.565 -0.554 1.00 0.00 C ATOM 708 CD1 LEU A 46 17.430 -0.848 -0.105 1.00 0.00 C ATOM 709 CD2 LEU A 46 18.880 0.519 -1.624 1.00 0.00 C ATOM 0 H LEU A 46 18.737 0.143 3.090 1.00 0.00 H new ATOM 0 HA LEU A 46 19.534 -2.153 1.395 1.00 0.00 H new ATOM 0 HB2 LEU A 46 19.389 0.797 1.016 1.00 0.00 H new ATOM 0 HB3 LEU A 46 20.755 -0.025 0.289 1.00 0.00 H new ATOM 0 HG LEU A 46 19.265 -1.479 -0.985 1.00 0.00 H new ATOM 0 HD11 LEU A 46 16.826 -1.129 -0.968 1.00 0.00 H new ATOM 0 HD12 LEU A 46 17.431 -1.663 0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 46 17.010 0.046 0.356 1.00 0.00 H new ATOM 0 HD21 LEU A 46 18.252 0.216 -2.462 1.00 0.00 H new ATOM 0 HD22 LEU A 46 18.501 1.452 -1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 46 19.903 0.666 -1.971 1.00 0.00 H new ATOM 721 N THR A 47 21.657 -2.399 2.642 1.00 0.00 N ATOM 722 CA THR A 47 22.965 -2.576 3.260 1.00 0.00 C ATOM 723 C THR A 47 23.987 -3.000 2.218 1.00 0.00 C ATOM 724 O THR A 47 23.653 -3.707 1.267 1.00 0.00 O ATOM 725 CB THR A 47 22.921 -3.643 4.373 1.00 0.00 C ATOM 726 OG1 THR A 47 21.933 -3.295 5.349 1.00 0.00 O ATOM 727 CG2 THR A 47 24.277 -3.786 5.048 1.00 0.00 C ATOM 0 H THR A 47 21.203 -3.269 2.365 1.00 0.00 H new ATOM 0 HA THR A 47 23.251 -1.619 3.697 1.00 0.00 H new ATOM 0 HB THR A 47 22.660 -4.597 3.915 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.911 -3.979 6.051 1.00 0.00 H new ATOM 0 HG21 THR A 47 24.217 -4.545 5.828 1.00 0.00 H new ATOM 0 HG22 THR A 47 25.022 -4.083 4.309 1.00 0.00 H new ATOM 0 HG23 THR A 47 24.566 -2.833 5.491 1.00 0.00 H new ATOM 735 N CYS A 48 25.233 -2.572 2.390 1.00 0.00 N ATOM 736 CA CYS A 48 26.273 -2.942 1.449 1.00 0.00 C ATOM 737 C CYS A 48 26.692 -4.377 1.729 1.00 0.00 C ATOM 738 O CYS A 48 27.204 -4.688 2.803 1.00 0.00 O ATOM 739 CB CYS A 48 27.462 -1.982 1.555 1.00 0.00 C ATOM 740 SG CYS A 48 28.889 -2.420 0.508 1.00 0.00 S ATOM 0 H CYS A 48 25.540 -1.978 3.160 1.00 0.00 H new ATOM 0 HA CYS A 48 25.895 -2.872 0.429 1.00 0.00 H new ATOM 0 HB2 CYS A 48 27.127 -0.979 1.289 1.00 0.00 H new ATOM 0 HB3 CYS A 48 27.789 -1.943 2.594 1.00 0.00 H new ATOM 745 N ASN A 49 26.449 -5.252 0.766 1.00 0.00 N ATOM 746 CA ASN A 49 26.817 -6.653 0.908 1.00 0.00 C ATOM 747 C ASN A 49 28.207 -6.897 0.335 1.00 0.00 C ATOM 748 O ASN A 49 28.899 -5.957 -0.056 1.00 0.00 O ATOM 749 CB ASN A 49 25.801 -7.544 0.197 1.00 0.00 C ATOM 750 CG ASN A 49 25.563 -7.106 -1.231 1.00 0.00 C ATOM 751 OD1 ASN A 49 26.338 -7.428 -2.127 1.00 0.00 O ATOM 752 ND2 ASN A 49 24.486 -6.368 -1.449 1.00 0.00 N ATOM 0 H ASN A 49 26.000 -5.019 -0.120 1.00 0.00 H new ATOM 0 HA ASN A 49 26.823 -6.900 1.970 1.00 0.00 H new ATOM 0 HB2 ASN A 49 26.155 -8.575 0.206 1.00 0.00 H new ATOM 0 HB3 ASN A 49 24.858 -7.526 0.744 1.00 0.00 H new ATOM 0 HD21 ASN A 49 24.273 -6.043 -2.392 1.00 0.00 H new ATOM 0 HD22 ASN A 49 23.869 -6.124 -0.674 1.00 0.00 H new ATOM 759 N SER A 50 28.610 -8.161 0.284 1.00 0.00 N ATOM 760 CA SER A 50 29.914 -8.517 -0.255 1.00 0.00 C ATOM 761 C SER A 50 29.760 -9.143 -1.646 1.00 0.00 C ATOM 762 O SER A 50 30.273 -10.230 -1.915 1.00 0.00 O ATOM 763 CB SER A 50 30.630 -9.491 0.683 1.00 0.00 C ATOM 764 OG SER A 50 31.926 -9.804 0.203 1.00 0.00 O ATOM 0 H SER A 50 28.054 -8.953 0.608 1.00 0.00 H new ATOM 0 HA SER A 50 30.513 -7.610 -0.341 1.00 0.00 H new ATOM 0 HB2 SER A 50 30.704 -9.054 1.679 1.00 0.00 H new ATOM 0 HB3 SER A 50 30.044 -10.405 0.779 1.00 0.00 H new ATOM 0 HG SER A 50 31.859 -10.172 -0.703 1.00 0.00 H new ATOM 770 N ASP A 51 29.047 -8.436 -2.522 1.00 0.00 N ATOM 771 CA ASP A 51 28.810 -8.879 -3.898 1.00 0.00 C ATOM 772 C ASP A 51 29.224 -7.782 -4.874 1.00 0.00 C ATOM 773 O ASP A 51 29.791 -8.058 -5.931 1.00 0.00 O ATOM 774 CB ASP A 51 27.331 -9.213 -4.102 1.00 0.00 C ATOM 775 CG ASP A 51 26.875 -10.372 -3.239 1.00 0.00 C ATOM 776 OD1 ASP A 51 26.498 -10.133 -2.073 1.00 0.00 O ATOM 777 OD2 ASP A 51 26.896 -11.521 -3.729 1.00 0.00 O ATOM 0 H ASP A 51 28.616 -7.539 -2.299 1.00 0.00 H new ATOM 0 HA ASP A 51 29.404 -9.774 -4.083 1.00 0.00 H new ATOM 0 HB2 ASP A 51 26.728 -8.334 -3.873 1.00 0.00 H new ATOM 0 HB3 ASP A 51 27.157 -9.454 -5.151 1.00 0.00 H new ATOM 782 N GLY A 52 28.935 -6.538 -4.509 1.00 0.00 N ATOM 783 CA GLY A 52 29.285 -5.416 -5.359 1.00 0.00 C ATOM 784 C GLY A 52 28.187 -4.370 -5.388 1.00 0.00 C ATOM 785 O GLY A 52 28.302 -3.342 -6.057 1.00 0.00 O ATOM 0 H GLY A 52 28.465 -6.287 -3.640 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.210 -4.963 -5.001 1.00 0.00 H new ATOM 0 HA3 GLY A 52 29.475 -5.772 -6.372 1.00 0.00 H new ATOM 789 N GLU A 53 27.119 -4.653 -4.648 1.00 0.00 N ATOM 790 CA GLU A 53 25.985 -3.737 -4.593 1.00 0.00 C ATOM 791 C GLU A 53 25.191 -3.852 -3.296 1.00 0.00 C ATOM 792 O GLU A 53 25.703 -4.280 -2.264 1.00 0.00 O ATOM 793 CB GLU A 53 25.060 -3.993 -5.785 1.00 0.00 C ATOM 794 CG GLU A 53 24.255 -5.275 -5.659 1.00 0.00 C ATOM 795 CD GLU A 53 23.393 -5.551 -6.875 1.00 0.00 C ATOM 796 OE1 GLU A 53 22.268 -5.014 -6.941 1.00 0.00 O ATOM 797 OE2 GLU A 53 23.844 -6.308 -7.762 1.00 0.00 O ATOM 0 H GLU A 53 27.015 -5.497 -4.085 1.00 0.00 H new ATOM 0 HA GLU A 53 26.389 -2.725 -4.632 1.00 0.00 H new ATOM 0 HB2 GLU A 53 24.375 -3.152 -5.891 1.00 0.00 H new ATOM 0 HB3 GLU A 53 25.657 -4.035 -6.696 1.00 0.00 H new ATOM 0 HG2 GLU A 53 24.936 -6.112 -5.505 1.00 0.00 H new ATOM 0 HG3 GLU A 53 23.620 -5.214 -4.775 1.00 0.00 H new ATOM 804 N TRP A 54 23.928 -3.447 -3.384 1.00 0.00 N ATOM 805 CA TRP A 54 23.011 -3.448 -2.260 1.00 0.00 C ATOM 806 C TRP A 54 22.059 -4.635 -2.283 1.00 0.00 C ATOM 807 O TRP A 54 21.306 -4.834 -3.237 1.00 0.00 O ATOM 808 CB TRP A 54 22.207 -2.159 -2.306 1.00 0.00 C ATOM 809 CG TRP A 54 23.067 -0.936 -2.314 1.00 0.00 C ATOM 810 CD1 TRP A 54 23.548 -0.270 -3.403 1.00 0.00 C ATOM 811 CD2 TRP A 54 23.556 -0.245 -1.172 1.00 0.00 C ATOM 812 NE1 TRP A 54 24.306 0.804 -2.999 1.00 0.00 N ATOM 813 CE2 TRP A 54 24.325 0.839 -1.630 1.00 0.00 C ATOM 814 CE3 TRP A 54 23.412 -0.441 0.196 1.00 0.00 C ATOM 815 CZ2 TRP A 54 24.949 1.727 -0.758 1.00 0.00 C ATOM 816 CZ3 TRP A 54 24.028 0.437 1.062 1.00 0.00 C ATOM 817 CH2 TRP A 54 24.788 1.509 0.582 1.00 0.00 C ATOM 0 H TRP A 54 23.512 -3.106 -4.250 1.00 0.00 H new ATOM 0 HA TRP A 54 23.595 -3.525 -1.343 1.00 0.00 H new ATOM 0 HB2 TRP A 54 21.578 -2.161 -3.196 1.00 0.00 H new ATOM 0 HB3 TRP A 54 21.540 -2.122 -1.445 1.00 0.00 H new ATOM 0 HD1 TRP A 54 23.361 -0.545 -4.430 1.00 0.00 H new ATOM 0 HE1 TRP A 54 24.776 1.465 -3.617 1.00 0.00 H new ATOM 0 HE3 TRP A 54 22.828 -1.267 0.574 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 25.537 2.555 -1.126 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 23.922 0.295 2.127 1.00 0.00 H new ATOM 0 HH2 TRP A 54 25.258 2.180 1.286 1.00 0.00 H new ATOM 828 N VAL A 55 22.109 -5.415 -1.213 1.00 0.00 N ATOM 829 CA VAL A 55 21.258 -6.579 -1.046 1.00 0.00 C ATOM 830 C VAL A 55 20.128 -6.204 -0.092 1.00 0.00 C ATOM 831 O VAL A 55 20.328 -5.351 0.772 1.00 0.00 O ATOM 832 CB VAL A 55 22.057 -7.778 -0.490 1.00 0.00 C ATOM 833 CG1 VAL A 55 21.235 -8.573 0.508 1.00 0.00 C ATOM 834 CG2 VAL A 55 22.532 -8.672 -1.626 1.00 0.00 C ATOM 0 H VAL A 55 22.746 -5.255 -0.433 1.00 0.00 H new ATOM 0 HA VAL A 55 20.855 -6.880 -2.013 1.00 0.00 H new ATOM 0 HB VAL A 55 22.929 -7.387 0.034 1.00 0.00 H new ATOM 0 HG11 VAL A 55 21.825 -9.410 0.881 1.00 0.00 H new ATOM 0 HG12 VAL A 55 20.952 -7.929 1.341 1.00 0.00 H new ATOM 0 HG13 VAL A 55 20.337 -8.951 0.020 1.00 0.00 H new ATOM 0 HG21 VAL A 55 23.093 -9.512 -1.217 1.00 0.00 H new ATOM 0 HG22 VAL A 55 21.671 -9.046 -2.179 1.00 0.00 H new ATOM 0 HG23 VAL A 55 23.173 -8.099 -2.296 1.00 0.00 H new ATOM 844 N TYR A 56 18.959 -6.837 -0.215 1.00 0.00 N ATOM 845 CA TYR A 56 17.857 -6.516 0.696 1.00 0.00 C ATOM 846 C TYR A 56 16.547 -7.197 0.315 1.00 0.00 C ATOM 847 O TYR A 56 15.501 -6.904 0.890 1.00 0.00 O ATOM 848 CB TYR A 56 17.631 -5.000 0.733 1.00 0.00 C ATOM 849 CG TYR A 56 17.511 -4.377 -0.644 1.00 0.00 C ATOM 850 CD1 TYR A 56 16.290 -4.331 -1.303 1.00 0.00 C ATOM 851 CD2 TYR A 56 18.621 -3.842 -1.287 1.00 0.00 C ATOM 852 CE1 TYR A 56 16.179 -3.770 -2.561 1.00 0.00 C ATOM 853 CE2 TYR A 56 18.518 -3.279 -2.542 1.00 0.00 C ATOM 854 CZ TYR A 56 17.295 -3.246 -3.176 1.00 0.00 C ATOM 855 OH TYR A 56 17.189 -2.688 -4.429 1.00 0.00 O ATOM 0 H TYR A 56 18.753 -7.552 -0.912 1.00 0.00 H new ATOM 0 HA TYR A 56 18.152 -6.890 1.677 1.00 0.00 H new ATOM 0 HB2 TYR A 56 16.724 -4.789 1.300 1.00 0.00 H new ATOM 0 HB3 TYR A 56 18.457 -4.530 1.266 1.00 0.00 H new ATOM 0 HD1 TYR A 56 15.412 -4.740 -0.825 1.00 0.00 H new ATOM 0 HD2 TYR A 56 19.582 -3.868 -0.795 1.00 0.00 H new ATOM 0 HE1 TYR A 56 15.222 -3.742 -3.060 1.00 0.00 H new ATOM 0 HE2 TYR A 56 19.391 -2.866 -3.025 1.00 0.00 H new ATOM 0 HH TYR A 56 18.068 -2.364 -4.718 1.00 0.00 H new ATOM 865 N ASN A 57 16.616 -8.119 -0.637 1.00 0.00 N ATOM 866 CA ASN A 57 15.435 -8.842 -1.106 1.00 0.00 C ATOM 867 C ASN A 57 14.332 -7.868 -1.513 1.00 0.00 C ATOM 868 O ASN A 57 14.470 -6.655 -1.365 1.00 0.00 O ATOM 869 CB ASN A 57 14.913 -9.784 -0.019 1.00 0.00 C ATOM 870 CG ASN A 57 14.031 -10.885 -0.579 1.00 0.00 C ATOM 871 OD1 ASN A 57 14.206 -11.317 -1.719 1.00 0.00 O ATOM 872 ND2 ASN A 57 13.076 -11.343 0.222 1.00 0.00 N ATOM 0 H ASN A 57 17.483 -8.387 -1.104 1.00 0.00 H new ATOM 0 HA ASN A 57 15.726 -9.430 -1.976 1.00 0.00 H new ATOM 0 HB2 ASN A 57 15.757 -10.231 0.506 1.00 0.00 H new ATOM 0 HB3 ASN A 57 14.349 -9.209 0.715 1.00 0.00 H new ATOM 0 HD21 ASN A 57 12.451 -12.082 -0.100 1.00 0.00 H new ATOM 0 HD22 ASN A 57 12.967 -10.956 1.159 1.00 0.00 H new ATOM 879 N THR A 58 13.241 -8.403 -2.042 1.00 0.00 N ATOM 880 CA THR A 58 12.119 -7.570 -2.450 1.00 0.00 C ATOM 881 C THR A 58 11.102 -7.470 -1.318 1.00 0.00 C ATOM 882 O THR A 58 10.170 -8.270 -1.229 1.00 0.00 O ATOM 883 CB THR A 58 11.431 -8.124 -3.709 1.00 0.00 C ATOM 884 OG1 THR A 58 12.416 -8.491 -4.684 1.00 0.00 O ATOM 885 CG2 THR A 58 10.488 -7.089 -4.305 1.00 0.00 C ATOM 0 H THR A 58 13.109 -9.402 -2.198 1.00 0.00 H new ATOM 0 HA THR A 58 12.511 -6.580 -2.683 1.00 0.00 H new ATOM 0 HB THR A 58 10.854 -9.004 -3.425 1.00 0.00 H new ATOM 0 HG1 THR A 58 11.970 -8.844 -5.482 1.00 0.00 H new ATOM 0 HG21 THR A 58 10.011 -7.501 -5.195 1.00 0.00 H new ATOM 0 HG22 THR A 58 9.724 -6.828 -3.572 1.00 0.00 H new ATOM 0 HG23 THR A 58 11.052 -6.196 -4.576 1.00 0.00 H new ATOM 893 N PHE A 59 11.300 -6.484 -0.452 1.00 0.00 N ATOM 894 CA PHE A 59 10.427 -6.275 0.698 1.00 0.00 C ATOM 895 C PHE A 59 9.310 -5.277 0.391 1.00 0.00 C ATOM 896 O PHE A 59 8.658 -4.768 1.303 1.00 0.00 O ATOM 897 CB PHE A 59 11.260 -5.787 1.886 1.00 0.00 C ATOM 898 CG PHE A 59 12.233 -4.698 1.529 1.00 0.00 C ATOM 899 CD1 PHE A 59 11.804 -3.537 0.906 1.00 0.00 C ATOM 900 CD2 PHE A 59 13.581 -4.843 1.810 1.00 0.00 C ATOM 901 CE1 PHE A 59 12.702 -2.544 0.567 1.00 0.00 C ATOM 902 CE2 PHE A 59 14.483 -3.852 1.476 1.00 0.00 C ATOM 903 CZ PHE A 59 14.043 -2.701 0.853 1.00 0.00 C ATOM 0 H PHE A 59 12.063 -5.811 -0.525 1.00 0.00 H new ATOM 0 HA PHE A 59 9.954 -7.226 0.943 1.00 0.00 H new ATOM 0 HB2 PHE A 59 10.590 -5.423 2.665 1.00 0.00 H new ATOM 0 HB3 PHE A 59 11.809 -6.630 2.306 1.00 0.00 H new ATOM 0 HD1 PHE A 59 10.755 -3.407 0.683 1.00 0.00 H new ATOM 0 HD2 PHE A 59 13.931 -5.742 2.296 1.00 0.00 H new ATOM 0 HE1 PHE A 59 12.355 -1.645 0.079 1.00 0.00 H new ATOM 0 HE2 PHE A 59 15.532 -3.977 1.702 1.00 0.00 H new ATOM 0 HZ PHE A 59 14.747 -1.925 0.590 1.00 0.00 H new ATOM 913 N CYS A 60 9.089 -5.002 -0.891 1.00 0.00 N ATOM 914 CA CYS A 60 8.051 -4.059 -1.300 1.00 0.00 C ATOM 915 C CYS A 60 6.948 -4.760 -2.108 1.00 0.00 C ATOM 916 O CYS A 60 7.222 -5.436 -3.100 1.00 0.00 O ATOM 917 CB CYS A 60 8.666 -2.915 -2.114 1.00 0.00 C ATOM 918 SG CYS A 60 9.813 -1.838 -1.185 1.00 0.00 S ATOM 0 H CYS A 60 9.612 -5.416 -1.662 1.00 0.00 H new ATOM 0 HA CYS A 60 7.595 -3.647 -0.400 1.00 0.00 H new ATOM 0 HB2 CYS A 60 9.199 -3.340 -2.965 1.00 0.00 H new ATOM 0 HB3 CYS A 60 7.860 -2.301 -2.516 1.00 0.00 H new ATOM 923 N ILE A 61 5.703 -4.584 -1.663 1.00 0.00 N ATOM 924 CA ILE A 61 4.527 -5.182 -2.312 1.00 0.00 C ATOM 925 C ILE A 61 3.259 -4.558 -1.734 1.00 0.00 C ATOM 926 O ILE A 61 2.988 -4.718 -0.551 1.00 0.00 O ATOM 927 CB ILE A 61 4.489 -6.713 -2.104 1.00 0.00 C ATOM 928 CG1 ILE A 61 3.053 -7.240 -2.209 1.00 0.00 C ATOM 929 CG2 ILE A 61 5.099 -7.080 -0.757 1.00 0.00 C ATOM 930 CD1 ILE A 61 2.931 -8.729 -1.963 1.00 0.00 C ATOM 0 H ILE A 61 5.477 -4.023 -0.842 1.00 0.00 H new ATOM 0 HA ILE A 61 4.589 -4.986 -3.382 1.00 0.00 H new ATOM 0 HB ILE A 61 5.080 -7.182 -2.891 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.428 -6.710 -1.491 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.663 -7.012 -3.201 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.065 -8.161 -0.625 1.00 0.00 H new ATOM 0 HG22 ILE A 61 6.135 -6.742 -0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.534 -6.599 0.041 1.00 0.00 H new ATOM 0 HD11 ILE A 61 1.887 -9.028 -2.054 1.00 0.00 H new ATOM 0 HD12 ILE A 61 3.529 -9.269 -2.697 1.00 0.00 H new ATOM 0 HD13 ILE A 61 3.289 -8.963 -0.960 1.00 0.00 H new ATOM 942 N TYR A 62 2.480 -3.863 -2.573 1.00 0.00 N ATOM 943 CA TYR A 62 1.274 -3.159 -2.109 1.00 0.00 C ATOM 944 C TYR A 62 0.211 -4.074 -1.530 1.00 0.00 C ATOM 945 O TYR A 62 0.501 -5.132 -0.973 1.00 0.00 O ATOM 946 CB TYR A 62 0.638 -2.336 -3.232 1.00 0.00 C ATOM 947 CG TYR A 62 0.554 -0.855 -2.911 1.00 0.00 C ATOM 948 CD1 TYR A 62 1.666 -0.183 -2.453 1.00 0.00 C ATOM 949 CD2 TYR A 62 -0.612 -0.130 -3.084 1.00 0.00 C ATOM 950 CE1 TYR A 62 1.647 1.157 -2.176 1.00 0.00 C ATOM 951 CE2 TYR A 62 -0.647 1.232 -2.817 1.00 0.00 C ATOM 952 CZ TYR A 62 0.494 1.865 -2.362 1.00 0.00 C ATOM 953 OH TYR A 62 0.499 3.211 -2.113 1.00 0.00 O ATOM 0 H TYR A 62 2.661 -3.772 -3.573 1.00 0.00 H new ATOM 0 HA TYR A 62 1.629 -2.508 -1.310 1.00 0.00 H new ATOM 0 HB2 TYR A 62 1.217 -2.471 -4.146 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -0.364 -2.716 -3.430 1.00 0.00 H new ATOM 0 HD1 TYR A 62 2.584 -0.733 -2.308 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.505 -0.629 -3.431 1.00 0.00 H new ATOM 0 HE1 TYR A 62 2.536 1.651 -1.813 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -1.559 1.792 -2.964 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.391 3.580 -2.291 1.00 0.00 H new ATOM 963 N LYS A 63 -1.026 -3.623 -1.745 1.00 0.00 N ATOM 964 CA LYS A 63 -2.235 -4.290 -1.281 1.00 0.00 C ATOM 965 C LYS A 63 -3.264 -3.266 -0.815 1.00 0.00 C ATOM 966 O LYS A 63 -3.290 -2.886 0.348 1.00 0.00 O ATOM 967 CB LYS A 63 -1.955 -5.300 -0.161 1.00 0.00 C ATOM 968 CG LYS A 63 -1.424 -4.695 1.128 1.00 0.00 C ATOM 969 CD LYS A 63 -1.058 -5.784 2.119 1.00 0.00 C ATOM 970 CE LYS A 63 0.402 -6.189 2.004 1.00 0.00 C ATOM 971 NZ LYS A 63 0.680 -7.475 2.704 1.00 0.00 N ATOM 0 H LYS A 63 -1.215 -2.763 -2.259 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.634 -4.847 -2.129 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -2.876 -5.840 0.060 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.235 -6.033 -0.525 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.549 -4.081 0.914 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.176 -4.037 1.564 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -1.259 -5.435 3.132 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -1.691 -6.655 1.950 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.671 -6.283 0.952 1.00 0.00 H new ATOM 0 HE3 LYS A 63 1.031 -5.404 2.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.482 -7.953 2.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 0.913 -7.285 3.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -0.161 -8.085 2.656 1.00 0.00 H new ATOM 985 N ARG A 64 -4.071 -2.784 -1.752 1.00 0.00 N ATOM 986 CA ARG A 64 -5.123 -1.823 -1.440 1.00 0.00 C ATOM 987 C ARG A 64 -6.490 -2.429 -1.734 1.00 0.00 C ATOM 988 O ARG A 64 -6.661 -3.645 -1.673 1.00 0.00 O ATOM 989 CB ARG A 64 -4.933 -0.543 -2.249 1.00 0.00 C ATOM 990 CG ARG A 64 -4.204 -0.766 -3.562 1.00 0.00 C ATOM 991 CD ARG A 64 -3.559 0.511 -4.056 1.00 0.00 C ATOM 992 NE ARG A 64 -4.546 1.489 -4.508 1.00 0.00 N ATOM 993 CZ ARG A 64 -4.232 2.635 -5.107 1.00 0.00 C ATOM 994 NH1 ARG A 64 -2.962 2.948 -5.321 1.00 0.00 N ATOM 995 NH2 ARG A 64 -5.190 3.467 -5.491 1.00 0.00 N ATOM 0 H ARG A 64 -4.017 -3.043 -2.737 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.065 -1.577 -0.380 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -5.909 -0.102 -2.453 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.377 0.178 -1.650 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -3.442 -1.534 -3.431 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -4.904 -1.136 -4.311 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.959 0.946 -3.257 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -2.878 0.279 -4.875 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.533 1.281 -4.356 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -2.223 2.310 -5.026 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -2.724 3.827 -5.780 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.168 3.229 -5.327 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -4.949 4.345 -5.950 1.00 0.00 H new ATOM 1009 N CYS A 65 -7.460 -1.583 -2.061 1.00 0.00 N ATOM 1010 CA CYS A 65 -8.799 -2.056 -2.365 1.00 0.00 C ATOM 1011 C CYS A 65 -9.359 -1.332 -3.572 1.00 0.00 C ATOM 1012 O CYS A 65 -9.457 -0.105 -3.574 1.00 0.00 O ATOM 1013 CB CYS A 65 -9.735 -1.839 -1.178 1.00 0.00 C ATOM 1014 SG CYS A 65 -8.967 -2.119 0.447 1.00 0.00 S ATOM 0 H CYS A 65 -7.342 -0.572 -2.121 1.00 0.00 H new ATOM 0 HA CYS A 65 -8.731 -3.123 -2.579 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -10.117 -0.819 -1.214 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -10.592 -2.505 -1.281 1.00 0.00 H new ATOM 1019 N ARG A 66 -9.720 -2.083 -4.602 1.00 0.00 N ATOM 1020 CA ARG A 66 -10.289 -1.467 -5.790 1.00 0.00 C ATOM 1021 C ARG A 66 -11.547 -0.725 -5.373 1.00 0.00 C ATOM 1022 O ARG A 66 -12.300 -1.208 -4.531 1.00 0.00 O ATOM 1023 CB ARG A 66 -10.599 -2.514 -6.863 1.00 0.00 C ATOM 1024 CG ARG A 66 -11.128 -1.922 -8.158 1.00 0.00 C ATOM 1025 CD ARG A 66 -10.058 -1.113 -8.870 1.00 0.00 C ATOM 1026 NE ARG A 66 -8.926 -1.941 -9.280 1.00 0.00 N ATOM 1027 CZ ARG A 66 -7.916 -1.498 -10.023 1.00 0.00 C ATOM 1028 NH1 ARG A 66 -7.905 -0.243 -10.453 1.00 0.00 N ATOM 1029 NH2 ARG A 66 -6.919 -2.311 -10.341 1.00 0.00 N ATOM 0 H ARG A 66 -9.632 -3.098 -4.640 1.00 0.00 H new ATOM 0 HA ARG A 66 -9.572 -0.773 -6.228 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -9.693 -3.082 -7.077 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -11.332 -3.219 -6.470 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -11.477 -2.722 -8.811 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -11.987 -1.286 -7.946 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -10.491 -0.632 -9.747 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -9.706 -0.319 -8.212 1.00 0.00 H new ATOM 0 HE ARG A 66 -8.910 -2.915 -8.979 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -8.673 0.385 -10.214 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -7.129 0.094 -11.023 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -6.926 -3.278 -10.016 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -6.145 -1.970 -10.911 1.00 0.00 H new ATOM 1043 N HIS A 67 -11.781 0.439 -5.959 1.00 0.00 N ATOM 1044 CA HIS A 67 -12.951 1.237 -5.617 1.00 0.00 C ATOM 1045 C HIS A 67 -14.223 0.387 -5.651 1.00 0.00 C ATOM 1046 O HIS A 67 -14.461 -0.349 -6.609 1.00 0.00 O ATOM 1047 CB HIS A 67 -13.080 2.421 -6.577 1.00 0.00 C ATOM 1048 CG HIS A 67 -14.229 3.326 -6.263 1.00 0.00 C ATOM 1049 ND1 HIS A 67 -14.352 4.002 -5.067 1.00 0.00 N ATOM 1050 CD2 HIS A 67 -15.314 3.665 -6.998 1.00 0.00 C ATOM 1051 CE1 HIS A 67 -15.463 4.716 -5.080 1.00 0.00 C ATOM 1052 NE2 HIS A 67 -16.064 4.530 -6.240 1.00 0.00 N ATOM 0 H HIS A 67 -11.179 0.852 -6.671 1.00 0.00 H new ATOM 0 HA HIS A 67 -12.822 1.615 -4.603 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -12.156 2.999 -6.553 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.193 2.043 -7.593 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -15.546 3.320 -7.995 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -15.819 5.345 -4.278 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -16.944 4.959 -6.527 1.00 0.00 H new ATOM 1061 N PRO A 68 -15.055 0.479 -4.596 1.00 0.00 N ATOM 1062 CA PRO A 68 -16.312 -0.275 -4.499 1.00 0.00 C ATOM 1063 C PRO A 68 -17.214 -0.026 -5.698 1.00 0.00 C ATOM 1064 O PRO A 68 -17.881 -0.936 -6.193 1.00 0.00 O ATOM 1065 CB PRO A 68 -16.969 0.275 -3.224 1.00 0.00 C ATOM 1066 CG PRO A 68 -16.258 1.551 -2.935 1.00 0.00 C ATOM 1067 CD PRO A 68 -14.856 1.348 -3.426 1.00 0.00 C ATOM 0 HA PRO A 68 -16.140 -1.351 -4.474 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -18.036 0.444 -3.373 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -16.870 -0.427 -2.396 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -16.734 2.389 -3.443 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -16.272 1.775 -1.868 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -14.379 2.290 -3.696 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.226 0.877 -2.672 1.00 0.00 H new ATOM 1075 N GLY A 69 -17.226 1.217 -6.155 1.00 0.00 N ATOM 1076 CA GLY A 69 -18.068 1.589 -7.271 1.00 0.00 C ATOM 1077 C GLY A 69 -19.191 2.503 -6.834 1.00 0.00 C ATOM 1078 O GLY A 69 -19.284 2.894 -5.671 1.00 0.00 O ATOM 0 H GLY A 69 -16.665 1.977 -5.771 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.467 2.087 -8.032 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.484 0.692 -7.730 1.00 0.00 H new ATOM 1082 N GLU A 70 -20.036 2.843 -7.795 1.00 0.00 N ATOM 1083 CA GLU A 70 -21.175 3.707 -7.543 1.00 0.00 C ATOM 1084 C GLU A 70 -22.333 2.914 -6.962 1.00 0.00 C ATOM 1085 O GLU A 70 -22.763 1.906 -7.523 1.00 0.00 O ATOM 1086 CB GLU A 70 -21.599 4.440 -8.816 1.00 0.00 C ATOM 1087 CG GLU A 70 -22.778 5.380 -8.618 1.00 0.00 C ATOM 1088 CD GLU A 70 -23.114 6.166 -9.870 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -23.881 5.647 -10.708 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -22.612 7.301 -10.011 1.00 0.00 O ATOM 0 H GLU A 70 -19.952 2.530 -8.762 1.00 0.00 H new ATOM 0 HA GLU A 70 -20.875 4.456 -6.810 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -20.751 5.010 -9.195 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -21.856 3.705 -9.579 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -23.650 4.803 -8.311 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -22.553 6.073 -7.808 1.00 0.00 H new ATOM 1097 N LEU A 71 -22.841 3.402 -5.842 1.00 0.00 N ATOM 1098 CA LEU A 71 -23.975 2.788 -5.175 1.00 0.00 C ATOM 1099 C LEU A 71 -25.238 3.528 -5.597 1.00 0.00 C ATOM 1100 O LEU A 71 -25.548 4.597 -5.072 1.00 0.00 O ATOM 1101 CB LEU A 71 -23.779 2.840 -3.656 1.00 0.00 C ATOM 1102 CG LEU A 71 -25.036 2.593 -2.825 1.00 0.00 C ATOM 1103 CD1 LEU A 71 -25.593 1.201 -3.087 1.00 0.00 C ATOM 1104 CD2 LEU A 71 -24.752 2.790 -1.345 1.00 0.00 C ATOM 0 H LEU A 71 -22.480 4.232 -5.372 1.00 0.00 H new ATOM 0 HA LEU A 71 -24.064 1.739 -5.458 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -23.029 2.100 -3.378 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -23.376 3.818 -3.392 1.00 0.00 H new ATOM 0 HG LEU A 71 -25.789 3.321 -3.126 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -26.488 1.048 -2.484 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -25.846 1.103 -4.143 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -24.845 0.454 -2.822 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -25.662 2.609 -0.773 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -23.978 2.092 -1.027 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -24.412 3.811 -1.172 1.00 0.00 H new ATOM 1116 N ARG A 72 -25.959 2.955 -6.558 1.00 0.00 N ATOM 1117 CA ARG A 72 -27.182 3.582 -7.044 1.00 0.00 C ATOM 1118 C ARG A 72 -28.219 3.619 -5.932 1.00 0.00 C ATOM 1119 O ARG A 72 -28.478 2.620 -5.260 1.00 0.00 O ATOM 1120 CB ARG A 72 -27.723 2.881 -8.290 1.00 0.00 C ATOM 1121 CG ARG A 72 -29.010 3.491 -8.822 1.00 0.00 C ATOM 1122 CD ARG A 72 -29.443 2.831 -10.122 1.00 0.00 C ATOM 1123 NE ARG A 72 -30.615 3.482 -10.703 1.00 0.00 N ATOM 1124 CZ ARG A 72 -31.260 3.023 -11.771 1.00 0.00 C ATOM 1125 NH1 ARG A 72 -30.856 1.910 -12.368 1.00 0.00 N ATOM 1126 NH2 ARG A 72 -32.313 3.678 -12.243 1.00 0.00 N ATOM 0 H ARG A 72 -25.721 2.071 -7.009 1.00 0.00 H new ATOM 0 HA ARG A 72 -26.949 4.605 -7.339 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -26.965 2.913 -9.073 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -27.898 1.830 -8.058 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -29.799 3.384 -8.078 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -28.868 4.559 -8.985 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -28.620 2.862 -10.836 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -29.666 1.780 -9.938 1.00 0.00 H new ATOM 0 HE ARG A 72 -30.958 4.337 -10.264 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -30.048 1.403 -12.008 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -31.354 1.561 -13.187 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -32.628 4.534 -11.786 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -32.808 3.325 -13.062 1.00 0.00 H new ATOM 1140 N ASN A 73 -28.790 4.808 -5.752 1.00 0.00 N ATOM 1141 CA ASN A 73 -29.770 5.066 -4.706 1.00 0.00 C ATOM 1142 C ASN A 73 -29.050 5.114 -3.367 1.00 0.00 C ATOM 1143 O ASN A 73 -29.686 5.064 -2.313 1.00 0.00 O ATOM 1144 CB ASN A 73 -30.878 4.010 -4.702 1.00 0.00 C ATOM 1145 CG ASN A 73 -31.655 3.986 -6.003 1.00 0.00 C ATOM 1146 OD1 ASN A 73 -31.870 5.024 -6.630 1.00 0.00 O ATOM 1147 ND2 ASN A 73 -32.075 2.798 -6.421 1.00 0.00 N ATOM 0 H ASN A 73 -28.583 5.621 -6.332 1.00 0.00 H new ATOM 0 HA ASN A 73 -30.254 6.024 -4.895 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -30.440 3.028 -4.525 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -31.562 4.207 -3.877 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -32.598 2.720 -7.293 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -31.875 1.963 -5.870 1.00 0.00 H new ATOM 1154 N GLY A 74 -27.723 5.214 -3.405 1.00 0.00 N ATOM 1155 CA GLY A 74 -26.986 5.273 -2.160 1.00 0.00 C ATOM 1156 C GLY A 74 -25.766 6.175 -2.206 1.00 0.00 C ATOM 1157 O GLY A 74 -25.541 6.892 -3.181 1.00 0.00 O ATOM 0 H GLY A 74 -27.159 5.254 -4.254 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -27.653 5.621 -1.371 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -26.670 4.266 -1.889 1.00 0.00 H new ATOM 1161 N GLN A 75 -24.980 6.124 -1.133 1.00 0.00 N ATOM 1162 CA GLN A 75 -23.774 6.941 -1.020 1.00 0.00 C ATOM 1163 C GLN A 75 -22.584 6.103 -0.557 1.00 0.00 C ATOM 1164 O GLN A 75 -22.710 5.267 0.336 1.00 0.00 O ATOM 1165 CB GLN A 75 -24.007 8.103 -0.049 1.00 0.00 C ATOM 1166 CG GLN A 75 -22.802 9.020 0.111 1.00 0.00 C ATOM 1167 CD GLN A 75 -22.672 10.037 -1.010 1.00 0.00 C ATOM 1168 OE1 GLN A 75 -22.166 11.140 -0.802 1.00 0.00 O ATOM 1169 NE2 GLN A 75 -23.126 9.676 -2.206 1.00 0.00 N ATOM 0 H GLN A 75 -25.157 5.524 -0.327 1.00 0.00 H new ATOM 0 HA GLN A 75 -23.546 7.342 -2.007 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -24.856 8.691 -0.398 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -24.278 7.700 0.927 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -22.877 9.546 1.063 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -21.896 8.415 0.151 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -23.539 8.753 -2.337 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -23.062 10.322 -2.992 1.00 0.00 H new ATOM 1178 N VAL A 76 -21.429 6.337 -1.175 1.00 0.00 N ATOM 1179 CA VAL A 76 -20.220 5.597 -0.824 1.00 0.00 C ATOM 1180 C VAL A 76 -19.230 6.480 -0.068 1.00 0.00 C ATOM 1181 O VAL A 76 -18.588 7.349 -0.659 1.00 0.00 O ATOM 1182 CB VAL A 76 -19.521 5.015 -2.064 1.00 0.00 C ATOM 1183 CG1 VAL A 76 -18.436 4.037 -1.638 1.00 0.00 C ATOM 1184 CG2 VAL A 76 -20.529 4.337 -2.979 1.00 0.00 C ATOM 0 H VAL A 76 -21.305 7.027 -1.915 1.00 0.00 H new ATOM 0 HA VAL A 76 -20.540 4.776 -0.183 1.00 0.00 H new ATOM 0 HB VAL A 76 -19.057 5.830 -2.620 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -17.946 3.629 -2.522 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.701 4.555 -1.022 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -18.883 3.225 -1.064 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -20.014 3.932 -3.850 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -21.023 3.528 -2.440 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -21.273 5.064 -3.303 1.00 0.00 H new ATOM 1194 N GLU A 77 -19.110 6.259 1.235 1.00 0.00 N ATOM 1195 CA GLU A 77 -18.178 7.034 2.051 1.00 0.00 C ATOM 1196 C GLU A 77 -16.732 6.716 1.671 1.00 0.00 C ATOM 1197 O GLU A 77 -16.172 5.717 2.121 1.00 0.00 O ATOM 1198 CB GLU A 77 -18.402 6.748 3.537 1.00 0.00 C ATOM 1199 CG GLU A 77 -17.303 7.297 4.434 1.00 0.00 C ATOM 1200 CD GLU A 77 -17.606 7.116 5.909 1.00 0.00 C ATOM 1201 OE1 GLU A 77 -18.380 7.927 6.459 1.00 0.00 O ATOM 1202 OE2 GLU A 77 -17.068 6.164 6.513 1.00 0.00 O ATOM 0 H GLU A 77 -19.641 5.555 1.748 1.00 0.00 H new ATOM 0 HA GLU A 77 -18.363 8.092 1.863 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -19.357 7.177 3.841 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -18.476 5.671 3.684 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.363 6.799 4.197 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.164 8.357 4.223 1.00 0.00 H new ATOM 1209 N ILE A 78 -16.132 7.569 0.843 1.00 0.00 N ATOM 1210 CA ILE A 78 -14.751 7.369 0.405 1.00 0.00 C ATOM 1211 C ILE A 78 -13.888 8.585 0.727 1.00 0.00 C ATOM 1212 O ILE A 78 -14.388 9.708 0.804 1.00 0.00 O ATOM 1213 CB ILE A 78 -14.684 7.084 -1.110 1.00 0.00 C ATOM 1214 CG1 ILE A 78 -15.573 5.890 -1.467 1.00 0.00 C ATOM 1215 CG2 ILE A 78 -13.247 6.828 -1.547 1.00 0.00 C ATOM 1216 CD1 ILE A 78 -15.319 4.662 -0.617 1.00 0.00 C ATOM 0 H ILE A 78 -16.579 8.403 0.462 1.00 0.00 H new ATOM 0 HA ILE A 78 -14.365 6.506 0.948 1.00 0.00 H new ATOM 0 HB ILE A 78 -15.051 7.962 -1.641 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -16.618 6.183 -1.362 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -15.417 5.634 -2.515 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -13.222 6.629 -2.618 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.638 7.705 -1.327 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -12.851 5.967 -1.009 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -15.986 3.859 -0.929 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -14.284 4.342 -0.740 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -15.503 4.900 0.431 1.00 0.00 H new ATOM 1228 N LYS A 79 -12.587 8.357 0.911 1.00 0.00 N ATOM 1229 CA LYS A 79 -11.662 9.438 1.233 1.00 0.00 C ATOM 1230 C LYS A 79 -10.216 8.956 1.254 1.00 0.00 C ATOM 1231 O LYS A 79 -9.307 9.665 0.820 1.00 0.00 O ATOM 1232 CB LYS A 79 -12.005 10.038 2.601 1.00 0.00 C ATOM 1233 CG LYS A 79 -11.830 9.073 3.768 1.00 0.00 C ATOM 1234 CD LYS A 79 -12.882 7.972 3.761 1.00 0.00 C ATOM 1235 CE LYS A 79 -12.747 7.064 4.972 1.00 0.00 C ATOM 1236 NZ LYS A 79 -13.812 6.025 5.009 1.00 0.00 N ATOM 0 H LYS A 79 -12.154 7.436 0.842 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.765 10.194 0.455 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -11.376 10.912 2.770 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -13.038 10.386 2.584 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -10.837 8.626 3.723 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -11.889 9.625 4.706 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.877 8.418 3.749 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -12.786 7.382 2.850 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -11.770 6.582 4.957 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -12.793 7.663 5.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.395 5.110 5.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -14.533 6.292 5.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -14.253 5.946 4.070 1.00 0.00 H new ATOM 1250 N THR A 80 -10.016 7.750 1.758 1.00 0.00 N ATOM 1251 CA THR A 80 -8.681 7.182 1.879 1.00 0.00 C ATOM 1252 C THR A 80 -8.159 6.616 0.563 1.00 0.00 C ATOM 1253 O THR A 80 -7.262 5.771 0.564 1.00 0.00 O ATOM 1254 CB THR A 80 -8.662 6.082 2.950 1.00 0.00 C ATOM 1255 OG1 THR A 80 -9.390 4.936 2.491 1.00 0.00 O ATOM 1256 CG2 THR A 80 -9.279 6.598 4.241 1.00 0.00 C ATOM 0 H THR A 80 -10.764 7.142 2.092 1.00 0.00 H new ATOM 0 HA THR A 80 -8.022 8.000 2.171 1.00 0.00 H new ATOM 0 HB THR A 80 -7.627 5.796 3.139 1.00 0.00 H new ATOM 0 HG1 THR A 80 -9.371 4.239 3.180 1.00 0.00 H new ATOM 0 HG21 THR A 80 -9.260 5.810 4.994 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.709 7.455 4.599 1.00 0.00 H new ATOM 0 HG23 THR A 80 -10.310 6.899 4.056 1.00 0.00 H new ATOM 1264 N ASP A 81 -8.713 7.078 -0.558 1.00 0.00 N ATOM 1265 CA ASP A 81 -8.264 6.609 -1.871 1.00 0.00 C ATOM 1266 C ASP A 81 -8.453 5.104 -2.013 1.00 0.00 C ATOM 1267 O ASP A 81 -7.996 4.493 -2.980 1.00 0.00 O ATOM 1268 CB ASP A 81 -6.789 6.936 -2.048 1.00 0.00 C ATOM 1269 CG ASP A 81 -6.525 8.427 -2.141 1.00 0.00 C ATOM 1270 OD1 ASP A 81 -6.391 9.073 -1.080 1.00 0.00 O ATOM 1271 OD2 ASP A 81 -6.450 8.948 -3.273 1.00 0.00 O ATOM 0 H ASP A 81 -9.464 7.768 -0.586 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.861 7.111 -2.632 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.227 6.524 -1.210 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -6.419 6.449 -2.950 1.00 0.00 H new ATOM 1276 N LEU A 82 -9.123 4.525 -1.030 1.00 0.00 N ATOM 1277 CA LEU A 82 -9.377 3.092 -0.992 1.00 0.00 C ATOM 1278 C LEU A 82 -8.074 2.335 -0.754 1.00 0.00 C ATOM 1279 O LEU A 82 -7.687 1.477 -1.548 1.00 0.00 O ATOM 1280 CB LEU A 82 -10.041 2.629 -2.289 1.00 0.00 C ATOM 1281 CG LEU A 82 -11.424 3.230 -2.581 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -12.143 3.598 -1.290 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -11.297 4.448 -3.482 1.00 0.00 C ATOM 0 H LEU A 82 -9.507 5.035 -0.234 1.00 0.00 H new ATOM 0 HA LEU A 82 -10.058 2.880 -0.168 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -9.378 2.869 -3.120 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.136 1.544 -2.260 1.00 0.00 H new ATOM 0 HG LEU A 82 -12.017 2.475 -3.097 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -13.120 4.021 -1.525 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -12.272 2.705 -0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -11.552 4.331 -0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -12.287 4.860 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.681 5.201 -2.991 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.832 4.157 -4.424 1.00 0.00 H new ATOM 1295 N SER A 83 -7.405 2.658 0.344 1.00 0.00 N ATOM 1296 CA SER A 83 -6.186 1.968 0.733 1.00 0.00 C ATOM 1297 C SER A 83 -6.550 0.860 1.718 1.00 0.00 C ATOM 1298 O SER A 83 -7.251 1.104 2.700 1.00 0.00 O ATOM 1299 CB SER A 83 -5.189 2.941 1.368 1.00 0.00 C ATOM 1300 OG SER A 83 -4.939 4.045 0.517 1.00 0.00 O ATOM 0 H SER A 83 -7.690 3.399 0.984 1.00 0.00 H new ATOM 0 HA SER A 83 -5.712 1.540 -0.150 1.00 0.00 H new ATOM 0 HB2 SER A 83 -5.579 3.295 2.322 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.254 2.422 1.579 1.00 0.00 H new ATOM 0 HG SER A 83 -5.710 4.650 0.531 1.00 0.00 H new ATOM 1306 N PHE A 84 -6.082 -0.353 1.443 1.00 0.00 N ATOM 1307 CA PHE A 84 -6.376 -1.517 2.284 1.00 0.00 C ATOM 1308 C PHE A 84 -6.401 -1.176 3.772 1.00 0.00 C ATOM 1309 O PHE A 84 -5.639 -0.335 4.249 1.00 0.00 O ATOM 1310 CB PHE A 84 -5.363 -2.624 1.996 1.00 0.00 C ATOM 1311 CG PHE A 84 -4.961 -3.448 3.184 1.00 0.00 C ATOM 1312 CD1 PHE A 84 -5.771 -4.474 3.646 1.00 0.00 C ATOM 1313 CD2 PHE A 84 -3.759 -3.206 3.827 1.00 0.00 C ATOM 1314 CE1 PHE A 84 -5.389 -5.239 4.731 1.00 0.00 C ATOM 1315 CE2 PHE A 84 -3.372 -3.964 4.911 1.00 0.00 C ATOM 1316 CZ PHE A 84 -4.187 -4.984 5.366 1.00 0.00 C ATOM 0 H PHE A 84 -5.492 -0.560 0.637 1.00 0.00 H new ATOM 0 HA PHE A 84 -7.378 -1.864 2.033 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -5.780 -3.287 1.238 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.468 -2.173 1.567 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -6.710 -4.677 3.153 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -3.116 -2.413 3.475 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -6.028 -6.035 5.083 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.433 -3.761 5.405 1.00 0.00 H new ATOM 0 HZ PHE A 84 -3.886 -5.580 6.215 1.00 0.00 H new ATOM 1326 N GLY A 85 -7.294 -1.852 4.493 1.00 0.00 N ATOM 1327 CA GLY A 85 -7.433 -1.631 5.919 1.00 0.00 C ATOM 1328 C GLY A 85 -8.312 -0.441 6.247 1.00 0.00 C ATOM 1329 O GLY A 85 -7.889 0.464 6.969 1.00 0.00 O ATOM 0 H GLY A 85 -7.927 -2.553 4.109 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.852 -2.525 6.381 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.446 -1.479 6.356 1.00 0.00 H new ATOM 1333 N SER A 86 -9.538 -0.433 5.723 1.00 0.00 N ATOM 1334 CA SER A 86 -10.461 0.668 5.985 1.00 0.00 C ATOM 1335 C SER A 86 -11.917 0.251 5.821 1.00 0.00 C ATOM 1336 O SER A 86 -12.237 -0.705 5.115 1.00 0.00 O ATOM 1337 CB SER A 86 -10.164 1.854 5.067 1.00 0.00 C ATOM 1338 OG SER A 86 -8.840 2.325 5.248 1.00 0.00 O ATOM 0 H SER A 86 -9.911 -1.168 5.122 1.00 0.00 H new ATOM 0 HA SER A 86 -10.309 0.963 7.023 1.00 0.00 H new ATOM 0 HB2 SER A 86 -10.308 1.558 4.028 1.00 0.00 H new ATOM 0 HB3 SER A 86 -10.870 2.659 5.270 1.00 0.00 H new ATOM 0 HG SER A 86 -8.282 2.028 4.499 1.00 0.00 H new ATOM 1344 N GLN A 87 -12.787 0.996 6.491 1.00 0.00 N ATOM 1345 CA GLN A 87 -14.220 0.745 6.443 1.00 0.00 C ATOM 1346 C GLN A 87 -14.941 1.911 5.766 1.00 0.00 C ATOM 1347 O GLN A 87 -14.669 3.075 6.058 1.00 0.00 O ATOM 1348 CB GLN A 87 -14.767 0.513 7.858 1.00 0.00 C ATOM 1349 CG GLN A 87 -16.285 0.558 7.951 1.00 0.00 C ATOM 1350 CD GLN A 87 -16.802 1.916 8.388 1.00 0.00 C ATOM 1351 OE1 GLN A 87 -17.904 2.031 8.924 1.00 0.00 O ATOM 1352 NE2 GLN A 87 -15.994 2.949 8.182 1.00 0.00 N ATOM 0 H GLN A 87 -12.521 1.786 7.079 1.00 0.00 H new ATOM 0 HA GLN A 87 -14.400 -0.155 5.855 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -14.420 -0.456 8.216 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -14.350 1.267 8.526 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -16.713 0.305 6.981 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -16.625 -0.200 8.656 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -15.089 2.807 7.734 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -16.278 3.885 8.472 1.00 0.00 H new ATOM 1361 N ILE A 88 -15.829 1.594 4.829 1.00 0.00 N ATOM 1362 CA ILE A 88 -16.583 2.622 4.119 1.00 0.00 C ATOM 1363 C ILE A 88 -18.084 2.402 4.274 1.00 0.00 C ATOM 1364 O ILE A 88 -18.645 1.444 3.741 1.00 0.00 O ATOM 1365 CB ILE A 88 -16.214 2.672 2.625 1.00 0.00 C ATOM 1366 CG1 ILE A 88 -16.375 1.295 1.981 1.00 0.00 C ATOM 1367 CG2 ILE A 88 -14.787 3.172 2.465 1.00 0.00 C ATOM 1368 CD1 ILE A 88 -16.291 1.318 0.472 1.00 0.00 C ATOM 0 H ILE A 88 -16.044 0.638 4.544 1.00 0.00 H new ATOM 0 HA ILE A 88 -16.316 3.579 4.567 1.00 0.00 H new ATOM 0 HB ILE A 88 -16.890 3.361 2.119 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -15.604 0.629 2.369 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -17.337 0.875 2.276 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -14.530 3.206 1.406 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -14.702 4.172 2.891 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -14.105 2.497 2.983 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -16.414 0.306 0.085 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -17.079 1.957 0.073 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -15.319 1.707 0.168 1.00 0.00 H new ATOM 1380 N GLU A 89 -18.727 3.294 5.019 1.00 0.00 N ATOM 1381 CA GLU A 89 -20.158 3.202 5.257 1.00 0.00 C ATOM 1382 C GLU A 89 -20.955 3.686 4.053 1.00 0.00 C ATOM 1383 O GLU A 89 -20.601 4.678 3.415 1.00 0.00 O ATOM 1384 CB GLU A 89 -20.539 4.021 6.488 1.00 0.00 C ATOM 1385 CG GLU A 89 -20.521 3.226 7.782 1.00 0.00 C ATOM 1386 CD GLU A 89 -21.008 4.032 8.969 1.00 0.00 C ATOM 1387 OE1 GLU A 89 -22.236 4.084 9.188 1.00 0.00 O ATOM 1388 OE2 GLU A 89 -20.160 4.612 9.681 1.00 0.00 O ATOM 0 H GLU A 89 -18.276 4.091 5.469 1.00 0.00 H new ATOM 0 HA GLU A 89 -20.400 2.153 5.426 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -19.852 4.863 6.580 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -21.536 4.437 6.342 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -21.146 2.340 7.668 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -19.506 2.878 7.976 1.00 0.00 H new ATOM 1395 N PHE A 90 -22.032 2.977 3.753 1.00 0.00 N ATOM 1396 CA PHE A 90 -22.899 3.330 2.638 1.00 0.00 C ATOM 1397 C PHE A 90 -24.110 4.100 3.149 1.00 0.00 C ATOM 1398 O PHE A 90 -24.294 4.240 4.359 1.00 0.00 O ATOM 1399 CB PHE A 90 -23.331 2.066 1.898 1.00 0.00 C ATOM 1400 CG PHE A 90 -22.176 1.184 1.514 1.00 0.00 C ATOM 1401 CD1 PHE A 90 -21.501 1.380 0.316 1.00 0.00 C ATOM 1402 CD2 PHE A 90 -21.765 0.156 2.350 1.00 0.00 C ATOM 1403 CE1 PHE A 90 -20.442 0.567 -0.037 1.00 0.00 C ATOM 1404 CE2 PHE A 90 -20.707 -0.659 1.998 1.00 0.00 C ATOM 1405 CZ PHE A 90 -20.044 -0.454 0.804 1.00 0.00 C ATOM 0 H PHE A 90 -22.328 2.149 4.269 1.00 0.00 H new ATOM 0 HA PHE A 90 -22.354 3.968 1.942 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -24.019 1.501 2.527 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -23.880 2.348 0.999 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -21.807 2.176 -0.346 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -22.278 -0.009 3.286 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -19.925 0.730 -0.971 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -20.398 -1.457 2.657 1.00 0.00 H new ATOM 0 HZ PHE A 90 -19.216 -1.091 0.528 1.00 0.00 H new ATOM 1415 N SER A 91 -24.937 4.597 2.237 1.00 0.00 N ATOM 1416 CA SER A 91 -26.112 5.362 2.637 1.00 0.00 C ATOM 1417 C SER A 91 -27.185 5.368 1.559 1.00 0.00 C ATOM 1418 O SER A 91 -27.037 6.008 0.522 1.00 0.00 O ATOM 1419 CB SER A 91 -25.725 6.799 2.976 1.00 0.00 C ATOM 1420 OG SER A 91 -24.773 6.842 4.023 1.00 0.00 O ATOM 0 H SER A 91 -24.819 4.487 1.230 1.00 0.00 H new ATOM 0 HA SER A 91 -26.523 4.874 3.521 1.00 0.00 H new ATOM 0 HB2 SER A 91 -25.317 7.287 2.091 1.00 0.00 H new ATOM 0 HB3 SER A 91 -26.614 7.358 3.267 1.00 0.00 H new ATOM 0 HG SER A 91 -24.750 5.975 4.480 1.00 0.00 H new ATOM 1426 N CYS A 92 -28.278 4.672 1.836 1.00 0.00 N ATOM 1427 CA CYS A 92 -29.382 4.619 0.888 1.00 0.00 C ATOM 1428 C CYS A 92 -30.261 5.852 1.083 1.00 0.00 C ATOM 1429 O CYS A 92 -30.837 6.052 2.152 1.00 0.00 O ATOM 1430 CB CYS A 92 -30.193 3.330 1.051 1.00 0.00 C ATOM 1431 SG CYS A 92 -29.300 1.817 0.556 1.00 0.00 S ATOM 0 H CYS A 92 -28.424 4.143 2.696 1.00 0.00 H new ATOM 0 HA CYS A 92 -28.984 4.616 -0.127 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -30.497 3.235 2.093 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -31.105 3.410 0.459 1.00 0.00 H new ATOM 1436 N SER A 93 -30.347 6.679 0.042 1.00 0.00 N ATOM 1437 CA SER A 93 -31.118 7.923 0.097 1.00 0.00 C ATOM 1438 C SER A 93 -32.511 7.735 0.688 1.00 0.00 C ATOM 1439 O SER A 93 -32.993 6.615 0.851 1.00 0.00 O ATOM 1440 CB SER A 93 -31.250 8.533 -1.297 1.00 0.00 C ATOM 1441 OG SER A 93 -31.616 7.551 -2.251 1.00 0.00 O ATOM 0 H SER A 93 -29.890 6.510 -0.854 1.00 0.00 H new ATOM 0 HA SER A 93 -30.564 8.593 0.755 1.00 0.00 H new ATOM 0 HB2 SER A 93 -31.998 9.326 -1.281 1.00 0.00 H new ATOM 0 HB3 SER A 93 -30.305 8.992 -1.587 1.00 0.00 H new ATOM 0 HG SER A 93 -31.696 7.967 -3.135 1.00 0.00 H new ATOM 1447 N GLU A 94 -33.146 8.864 0.993 1.00 0.00 N ATOM 1448 CA GLU A 94 -34.491 8.884 1.556 1.00 0.00 C ATOM 1449 C GLU A 94 -35.406 7.919 0.810 1.00 0.00 C ATOM 1450 O GLU A 94 -35.237 7.679 -0.385 1.00 0.00 O ATOM 1451 CB GLU A 94 -35.050 10.306 1.483 1.00 0.00 C ATOM 1452 CG GLU A 94 -36.520 10.407 1.841 1.00 0.00 C ATOM 1453 CD GLU A 94 -36.787 10.132 3.309 1.00 0.00 C ATOM 1454 OE1 GLU A 94 -36.520 11.027 4.138 1.00 0.00 O ATOM 1455 OE2 GLU A 94 -37.263 9.023 3.629 1.00 0.00 O ATOM 0 H GLU A 94 -32.741 9.790 0.856 1.00 0.00 H new ATOM 0 HA GLU A 94 -34.442 8.565 2.597 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -34.478 10.946 2.155 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -34.904 10.692 0.474 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -36.883 11.404 1.591 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -37.087 9.700 1.235 1.00 0.00 H new ATOM 1462 N GLY A 95 -36.384 7.376 1.531 1.00 0.00 N ATOM 1463 CA GLY A 95 -37.325 6.445 0.936 1.00 0.00 C ATOM 1464 C GLY A 95 -36.730 5.068 0.727 1.00 0.00 C ATOM 1465 O GLY A 95 -37.427 4.064 0.867 1.00 0.00 O ATOM 0 H GLY A 95 -36.541 7.566 2.521 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -38.204 6.364 1.576 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -37.664 6.839 -0.022 1.00 0.00 H new ATOM 1469 N PHE A 96 -35.445 5.009 0.401 1.00 0.00 N ATOM 1470 CA PHE A 96 -34.790 3.730 0.156 1.00 0.00 C ATOM 1471 C PHE A 96 -33.810 3.433 1.283 1.00 0.00 C ATOM 1472 O PHE A 96 -32.870 4.191 1.512 1.00 0.00 O ATOM 1473 CB PHE A 96 -34.050 3.751 -1.185 1.00 0.00 C ATOM 1474 CG PHE A 96 -34.780 4.487 -2.274 1.00 0.00 C ATOM 1475 CD1 PHE A 96 -35.821 3.884 -2.961 1.00 0.00 C ATOM 1476 CD2 PHE A 96 -34.421 5.782 -2.611 1.00 0.00 C ATOM 1477 CE1 PHE A 96 -36.491 4.560 -3.964 1.00 0.00 C ATOM 1478 CE2 PHE A 96 -35.087 6.463 -3.613 1.00 0.00 C ATOM 1479 CZ PHE A 96 -36.122 5.850 -4.290 1.00 0.00 C ATOM 0 H PHE A 96 -34.840 5.824 0.301 1.00 0.00 H new ATOM 0 HA PHE A 96 -35.550 2.949 0.119 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -33.072 4.211 -1.042 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -33.875 2.725 -1.508 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -36.112 2.875 -2.710 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -33.611 6.265 -2.085 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -37.302 4.080 -4.492 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -34.798 7.473 -3.866 1.00 0.00 H new ATOM 0 HZ PHE A 96 -36.643 6.379 -5.074 1.00 0.00 H new ATOM 1489 N PHE A 97 -34.035 2.333 1.994 1.00 0.00 N ATOM 1490 CA PHE A 97 -33.160 1.957 3.097 1.00 0.00 C ATOM 1491 C PHE A 97 -32.033 1.058 2.616 1.00 0.00 C ATOM 1492 O PHE A 97 -32.017 0.602 1.473 1.00 0.00 O ATOM 1493 CB PHE A 97 -33.958 1.291 4.226 1.00 0.00 C ATOM 1494 CG PHE A 97 -34.569 -0.036 3.874 1.00 0.00 C ATOM 1495 CD1 PHE A 97 -35.587 -0.123 2.937 1.00 0.00 C ATOM 1496 CD2 PHE A 97 -34.138 -1.195 4.499 1.00 0.00 C ATOM 1497 CE1 PHE A 97 -36.161 -1.342 2.627 1.00 0.00 C ATOM 1498 CE2 PHE A 97 -34.711 -2.416 4.195 1.00 0.00 C ATOM 1499 CZ PHE A 97 -35.722 -2.490 3.258 1.00 0.00 C ATOM 0 H PHE A 97 -34.810 1.691 1.828 1.00 0.00 H new ATOM 0 HA PHE A 97 -32.711 2.866 3.497 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -33.300 1.155 5.084 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -34.753 1.969 4.538 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -35.936 0.772 2.443 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -33.346 -1.144 5.231 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -36.951 -1.397 1.893 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -34.368 -3.312 4.691 1.00 0.00 H new ATOM 0 HZ PHE A 97 -36.169 -3.444 3.019 1.00 0.00 H new ATOM 1509 N LEU A 98 -31.090 0.818 3.518 1.00 0.00 N ATOM 1510 CA LEU A 98 -29.928 0.003 3.205 1.00 0.00 C ATOM 1511 C LEU A 98 -30.131 -1.453 3.594 1.00 0.00 C ATOM 1512 O LEU A 98 -30.724 -1.765 4.627 1.00 0.00 O ATOM 1513 CB LEU A 98 -28.692 0.561 3.901 1.00 0.00 C ATOM 1514 CG LEU A 98 -27.371 -0.030 3.415 1.00 0.00 C ATOM 1515 CD1 LEU A 98 -26.251 0.982 3.579 1.00 0.00 C ATOM 1516 CD2 LEU A 98 -27.056 -1.313 4.166 1.00 0.00 C ATOM 0 H LEU A 98 -31.109 1.177 4.472 1.00 0.00 H new ATOM 0 HA LEU A 98 -29.786 0.039 2.125 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -28.667 1.641 3.758 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -28.783 0.383 4.973 1.00 0.00 H new ATOM 0 HG LEU A 98 -27.463 -0.271 2.356 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -25.314 0.548 3.229 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -26.478 1.874 2.995 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -26.155 1.251 4.631 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -26.111 -1.722 3.808 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -26.978 -1.101 5.232 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -27.852 -2.038 3.997 1.00 0.00 H new ATOM 1528 N ILE A 99 -29.623 -2.337 2.744 1.00 0.00 N ATOM 1529 CA ILE A 99 -29.700 -3.782 2.944 1.00 0.00 C ATOM 1530 C ILE A 99 -28.569 -4.452 2.185 1.00 0.00 C ATOM 1531 O ILE A 99 -28.548 -4.499 0.956 1.00 0.00 O ATOM 1532 CB ILE A 99 -31.019 -4.373 2.410 1.00 0.00 C ATOM 1533 CG1 ILE A 99 -32.127 -3.326 2.424 1.00 0.00 C ATOM 1534 CG2 ILE A 99 -31.423 -5.589 3.229 1.00 0.00 C ATOM 1535 CD1 ILE A 99 -33.151 -3.512 1.328 1.00 0.00 C ATOM 0 H ILE A 99 -29.140 -2.069 1.886 1.00 0.00 H new ATOM 0 HA ILE A 99 -29.636 -3.961 4.017 1.00 0.00 H new ATOM 0 HB ILE A 99 -30.862 -4.686 1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -32.632 -3.356 3.390 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -31.681 -2.336 2.328 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -32.357 -5.996 2.840 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -30.642 -6.347 3.165 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -31.560 -5.297 4.270 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -33.908 -2.731 1.401 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -32.660 -3.452 0.357 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -33.625 -4.488 1.435 1.00 0.00 H new ATOM 1547 N GLY A 100 -27.629 -4.971 2.965 1.00 0.00 N ATOM 1548 CA GLY A 100 -26.460 -5.629 2.422 1.00 0.00 C ATOM 1549 C GLY A 100 -25.346 -5.696 3.444 1.00 0.00 C ATOM 1550 O GLY A 100 -24.902 -6.775 3.835 1.00 0.00 O ATOM 0 H GLY A 100 -27.660 -4.945 3.984 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -26.723 -6.637 2.100 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -26.115 -5.092 1.538 1.00 0.00 H new ATOM 1554 N SER A 101 -24.919 -4.517 3.872 1.00 0.00 N ATOM 1555 CA SER A 101 -23.857 -4.355 4.855 1.00 0.00 C ATOM 1556 C SER A 101 -23.494 -2.882 4.926 1.00 0.00 C ATOM 1557 O SER A 101 -22.817 -2.363 4.037 1.00 0.00 O ATOM 1558 CB SER A 101 -22.625 -5.181 4.478 1.00 0.00 C ATOM 1559 OG SER A 101 -21.612 -5.064 5.460 1.00 0.00 O ATOM 0 H SER A 101 -25.306 -3.633 3.542 1.00 0.00 H new ATOM 0 HA SER A 101 -24.206 -4.709 5.825 1.00 0.00 H new ATOM 0 HB2 SER A 101 -22.906 -6.228 4.364 1.00 0.00 H new ATOM 0 HB3 SER A 101 -22.241 -4.848 3.514 1.00 0.00 H new ATOM 0 HG SER A 101 -21.012 -4.326 5.225 1.00 0.00 H new ATOM 1565 N THR A 102 -23.939 -2.201 5.976 1.00 0.00 N ATOM 1566 CA THR A 102 -23.683 -0.777 6.109 1.00 0.00 C ATOM 1567 C THR A 102 -22.199 -0.492 6.237 1.00 0.00 C ATOM 1568 O THR A 102 -21.778 0.665 6.252 1.00 0.00 O ATOM 1569 CB THR A 102 -24.419 -0.172 7.321 1.00 0.00 C ATOM 1570 OG1 THR A 102 -23.927 -0.753 8.534 1.00 0.00 O ATOM 1571 CG2 THR A 102 -25.919 -0.403 7.220 1.00 0.00 C ATOM 0 H THR A 102 -24.475 -2.611 6.741 1.00 0.00 H new ATOM 0 HA THR A 102 -24.062 -0.310 5.200 1.00 0.00 H new ATOM 0 HB THR A 102 -24.232 0.902 7.327 1.00 0.00 H new ATOM 0 HG1 THR A 102 -24.399 -0.362 9.299 1.00 0.00 H new ATOM 0 HG21 THR A 102 -26.414 0.034 8.088 1.00 0.00 H new ATOM 0 HG22 THR A 102 -26.299 0.065 6.312 1.00 0.00 H new ATOM 0 HG23 THR A 102 -26.121 -1.474 7.188 1.00 0.00 H new ATOM 1579 N THR A 103 -21.406 -1.545 6.331 1.00 0.00 N ATOM 1580 CA THR A 103 -19.974 -1.399 6.437 1.00 0.00 C ATOM 1581 C THR A 103 -19.290 -2.169 5.324 1.00 0.00 C ATOM 1582 O THR A 103 -19.860 -3.103 4.759 1.00 0.00 O ATOM 1583 CB THR A 103 -19.461 -1.874 7.796 1.00 0.00 C ATOM 1584 OG1 THR A 103 -19.901 -3.214 8.053 1.00 0.00 O ATOM 1585 CG2 THR A 103 -19.944 -0.949 8.900 1.00 0.00 C ATOM 0 H THR A 103 -21.735 -2.510 6.336 1.00 0.00 H new ATOM 0 HA THR A 103 -19.737 -0.339 6.343 1.00 0.00 H new ATOM 0 HB THR A 103 -18.371 -1.857 7.777 1.00 0.00 H new ATOM 0 HG1 THR A 103 -19.564 -3.507 8.925 1.00 0.00 H new ATOM 0 HG21 THR A 103 -19.569 -1.302 9.861 1.00 0.00 H new ATOM 0 HG22 THR A 103 -19.576 0.060 8.716 1.00 0.00 H new ATOM 0 HG23 THR A 103 -21.034 -0.940 8.917 1.00 0.00 H new ATOM 1593 N SER A 104 -18.067 -1.774 5.009 1.00 0.00 N ATOM 1594 CA SER A 104 -17.274 -2.450 4.000 1.00 0.00 C ATOM 1595 C SER A 104 -15.815 -2.417 4.434 1.00 0.00 C ATOM 1596 O SER A 104 -15.219 -1.347 4.544 1.00 0.00 O ATOM 1597 CB SER A 104 -17.445 -1.783 2.635 1.00 0.00 C ATOM 1598 OG SER A 104 -16.727 -2.481 1.633 1.00 0.00 O ATOM 0 H SER A 104 -17.599 -0.979 5.444 1.00 0.00 H new ATOM 0 HA SER A 104 -17.609 -3.483 3.902 1.00 0.00 H new ATOM 0 HB2 SER A 104 -18.502 -1.750 2.373 1.00 0.00 H new ATOM 0 HB3 SER A 104 -17.097 -0.751 2.685 1.00 0.00 H new ATOM 0 HG SER A 104 -15.911 -1.986 1.410 1.00 0.00 H new ATOM 1604 N ARG A 105 -15.236 -3.588 4.672 1.00 0.00 N ATOM 1605 CA ARG A 105 -13.851 -3.693 5.125 1.00 0.00 C ATOM 1606 C ARG A 105 -12.916 -4.082 3.989 1.00 0.00 C ATOM 1607 O ARG A 105 -13.313 -4.113 2.828 1.00 0.00 O ATOM 1608 CB ARG A 105 -13.747 -4.717 6.256 1.00 0.00 C ATOM 1609 CG ARG A 105 -14.673 -4.425 7.424 1.00 0.00 C ATOM 1610 CD ARG A 105 -14.533 -5.466 8.522 1.00 0.00 C ATOM 1611 NE ARG A 105 -13.172 -5.530 9.046 1.00 0.00 N ATOM 1612 CZ ARG A 105 -12.835 -6.210 10.138 1.00 0.00 C ATOM 1613 NH1 ARG A 105 -13.756 -6.880 10.817 1.00 0.00 N ATOM 1614 NH2 ARG A 105 -11.575 -6.220 10.551 1.00 0.00 N ATOM 0 H ARG A 105 -15.707 -4.485 4.558 1.00 0.00 H new ATOM 0 HA ARG A 105 -13.546 -2.712 5.489 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.974 -5.707 5.861 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -12.719 -4.746 6.616 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -14.450 -3.437 7.828 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -15.705 -4.401 7.074 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -15.223 -5.232 9.333 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -14.818 -6.444 8.133 1.00 0.00 H new ATOM 0 HE ARG A 105 -12.439 -5.025 8.547 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -14.726 -6.875 10.502 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -13.494 -7.401 11.654 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -10.864 -5.706 10.031 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -11.317 -6.742 11.389 1.00 0.00 H new ATOM 1628 N CYS A 106 -11.673 -4.395 4.340 1.00 0.00 N ATOM 1629 CA CYS A 106 -10.671 -4.766 3.354 1.00 0.00 C ATOM 1630 C CYS A 106 -9.767 -5.878 3.869 1.00 0.00 C ATOM 1631 O CYS A 106 -9.032 -5.702 4.841 1.00 0.00 O ATOM 1632 CB CYS A 106 -9.823 -3.550 2.980 1.00 0.00 C ATOM 1633 SG CYS A 106 -10.541 -2.512 1.667 1.00 0.00 S ATOM 0 H CYS A 106 -11.337 -4.398 5.303 1.00 0.00 H new ATOM 0 HA CYS A 106 -11.196 -5.132 2.472 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -9.673 -2.938 3.870 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -8.839 -3.892 2.659 1.00 0.00 H new ATOM 1638 N GLU A 107 -9.832 -7.023 3.206 1.00 0.00 N ATOM 1639 CA GLU A 107 -9.055 -8.187 3.591 1.00 0.00 C ATOM 1640 C GLU A 107 -8.019 -8.500 2.526 1.00 0.00 C ATOM 1641 O GLU A 107 -8.117 -8.016 1.404 1.00 0.00 O ATOM 1642 CB GLU A 107 -9.992 -9.380 3.789 1.00 0.00 C ATOM 1643 CG GLU A 107 -10.197 -9.765 5.244 1.00 0.00 C ATOM 1644 CD GLU A 107 -8.905 -10.157 5.933 1.00 0.00 C ATOM 1645 OE1 GLU A 107 -8.211 -9.258 6.453 1.00 0.00 O ATOM 1646 OE2 GLU A 107 -8.586 -11.365 5.953 1.00 0.00 O ATOM 0 H GLU A 107 -10.424 -7.169 2.388 1.00 0.00 H new ATOM 0 HA GLU A 107 -8.535 -7.981 4.527 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -10.960 -9.147 3.345 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -9.591 -10.238 3.249 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -10.649 -8.928 5.777 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -10.900 -10.596 5.300 1.00 0.00 H new ATOM 1653 N VAL A 108 -7.036 -9.317 2.866 1.00 0.00 N ATOM 1654 CA VAL A 108 -6.009 -9.650 1.896 1.00 0.00 C ATOM 1655 C VAL A 108 -5.867 -11.145 1.668 1.00 0.00 C ATOM 1656 O VAL A 108 -5.703 -11.931 2.601 1.00 0.00 O ATOM 1657 CB VAL A 108 -4.637 -9.066 2.262 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -3.647 -9.358 1.153 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.733 -7.572 2.475 1.00 0.00 C ATOM 0 H VAL A 108 -6.928 -9.752 3.782 1.00 0.00 H new ATOM 0 HA VAL A 108 -6.352 -9.191 0.969 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.298 -9.529 3.188 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.674 -8.942 1.415 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -3.557 -10.436 1.020 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -3.997 -8.906 0.225 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.750 -7.177 2.733 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.086 -7.096 1.560 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.432 -7.364 3.285 1.00 0.00 H new ATOM 1669 N GLN A 109 -5.935 -11.508 0.396 1.00 0.00 N ATOM 1670 CA GLN A 109 -5.802 -12.895 -0.015 1.00 0.00 C ATOM 1671 C GLN A 109 -4.831 -13.020 -1.182 1.00 0.00 C ATOM 1672 O GLN A 109 -5.135 -12.605 -2.300 1.00 0.00 O ATOM 1673 CB GLN A 109 -7.170 -13.462 -0.402 1.00 0.00 C ATOM 1674 CG GLN A 109 -8.230 -12.394 -0.635 1.00 0.00 C ATOM 1675 CD GLN A 109 -9.010 -12.063 0.622 1.00 0.00 C ATOM 1676 OE1 GLN A 109 -8.501 -12.189 1.736 1.00 0.00 O ATOM 1677 NE2 GLN A 109 -10.254 -11.634 0.450 1.00 0.00 N ATOM 0 H GLN A 109 -6.083 -10.855 -0.373 1.00 0.00 H new ATOM 0 HA GLN A 109 -5.406 -13.467 0.824 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -7.063 -14.059 -1.307 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -7.511 -14.134 0.385 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -7.752 -11.489 -1.011 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -8.920 -12.734 -1.407 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.637 -11.544 -0.491 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -10.827 -11.394 1.259 1.00 0.00 H new ATOM 1686 N ASP A 110 -3.661 -13.594 -0.912 1.00 0.00 N ATOM 1687 CA ASP A 110 -2.642 -13.766 -1.938 1.00 0.00 C ATOM 1688 C ASP A 110 -2.314 -12.425 -2.594 1.00 0.00 C ATOM 1689 O ASP A 110 -2.176 -11.411 -1.911 1.00 0.00 O ATOM 1690 CB ASP A 110 -3.123 -14.772 -2.982 1.00 0.00 C ATOM 1691 CG ASP A 110 -3.192 -16.184 -2.436 1.00 0.00 C ATOM 1692 OD1 ASP A 110 -2.158 -16.884 -2.467 1.00 0.00 O ATOM 1693 OD2 ASP A 110 -4.280 -16.591 -1.976 1.00 0.00 O ATOM 0 H ASP A 110 -3.398 -13.947 0.008 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.733 -14.149 -1.474 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -4.109 -14.476 -3.341 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.451 -14.750 -3.840 1.00 0.00 H new ATOM 1698 N ARG A 111 -2.188 -12.424 -3.918 1.00 0.00 N ATOM 1699 CA ARG A 111 -1.885 -11.212 -4.656 1.00 0.00 C ATOM 1700 C ARG A 111 -3.113 -10.310 -4.763 1.00 0.00 C ATOM 1701 O ARG A 111 -3.212 -9.492 -5.677 1.00 0.00 O ATOM 1702 CB ARG A 111 -1.384 -11.577 -6.051 1.00 0.00 C ATOM 1703 CG ARG A 111 -0.081 -12.360 -6.048 1.00 0.00 C ATOM 1704 CD ARG A 111 0.318 -12.777 -7.453 1.00 0.00 C ATOM 1705 NE ARG A 111 0.477 -11.628 -8.340 1.00 0.00 N ATOM 1706 CZ ARG A 111 0.684 -11.730 -9.649 1.00 0.00 C ATOM 1707 NH1 ARG A 111 0.754 -12.925 -10.222 1.00 0.00 N ATOM 1708 NH2 ARG A 111 0.821 -10.638 -10.388 1.00 0.00 N ATOM 0 H ARG A 111 -2.292 -13.255 -4.500 1.00 0.00 H new ATOM 0 HA ARG A 111 -1.111 -10.665 -4.118 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -2.149 -12.164 -6.560 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.247 -10.663 -6.629 1.00 0.00 H new ATOM 0 HG2 ARG A 111 0.710 -11.752 -5.609 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -0.188 -13.245 -5.421 1.00 0.00 H new ATOM 0 HD2 ARG A 111 1.253 -13.337 -7.413 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -0.438 -13.448 -7.861 1.00 0.00 H new ATOM 0 HE ARG A 111 0.426 -10.694 -7.932 1.00 0.00 H new ATOM 0 HH11 ARG A 111 0.649 -13.768 -9.658 1.00 0.00 H new ATOM 0 HH12 ARG A 111 0.913 -13.000 -11.227 1.00 0.00 H new ATOM 0 HH21 ARG A 111 0.768 -9.717 -9.952 1.00 0.00 H new ATOM 0 HH22 ARG A 111 0.980 -10.718 -11.392 1.00 0.00 H new ATOM 1722 N GLY A 112 -4.043 -10.457 -3.820 1.00 0.00 N ATOM 1723 CA GLY A 112 -5.247 -9.647 -3.840 1.00 0.00 C ATOM 1724 C GLY A 112 -5.620 -9.117 -2.481 1.00 0.00 C ATOM 1725 O GLY A 112 -5.113 -9.580 -1.460 1.00 0.00 O ATOM 0 H GLY A 112 -3.983 -11.120 -3.047 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -5.104 -8.810 -4.524 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -6.072 -10.242 -4.231 1.00 0.00 H new ATOM 1729 N VAL A 113 -6.518 -8.138 -2.473 1.00 0.00 N ATOM 1730 CA VAL A 113 -6.951 -7.511 -1.237 1.00 0.00 C ATOM 1731 C VAL A 113 -8.042 -6.483 -1.476 1.00 0.00 C ATOM 1732 O VAL A 113 -8.251 -6.008 -2.593 1.00 0.00 O ATOM 1733 CB VAL A 113 -5.767 -6.798 -0.540 1.00 0.00 C ATOM 1734 CG1 VAL A 113 -4.832 -6.199 -1.568 1.00 0.00 C ATOM 1735 CG2 VAL A 113 -6.242 -5.721 0.426 1.00 0.00 C ATOM 0 H VAL A 113 -6.959 -7.763 -3.313 1.00 0.00 H new ATOM 0 HA VAL A 113 -7.340 -8.309 -0.605 1.00 0.00 H new ATOM 0 HB VAL A 113 -5.230 -7.549 0.039 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.005 -5.701 -1.061 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.442 -6.989 -2.209 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -5.375 -5.474 -2.175 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -5.380 -5.246 0.894 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -6.818 -4.973 -0.118 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -6.869 -6.173 1.195 1.00 0.00 H new ATOM 1745 N GLY A 114 -8.726 -6.156 -0.398 1.00 0.00 N ATOM 1746 CA GLY A 114 -9.738 -5.142 -0.499 1.00 0.00 C ATOM 1747 C GLY A 114 -11.099 -5.553 0.017 1.00 0.00 C ATOM 1748 O GLY A 114 -11.223 -6.504 0.789 1.00 0.00 O ATOM 0 H GLY A 114 -8.601 -6.566 0.527 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.407 -4.261 0.051 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.835 -4.847 -1.544 1.00 0.00 H new ATOM 1752 N TRP A 115 -12.122 -4.831 -0.422 1.00 0.00 N ATOM 1753 CA TRP A 115 -13.495 -5.076 0.007 1.00 0.00 C ATOM 1754 C TRP A 115 -13.913 -6.523 -0.216 1.00 0.00 C ATOM 1755 O TRP A 115 -13.515 -7.156 -1.194 1.00 0.00 O ATOM 1756 CB TRP A 115 -14.462 -4.150 -0.732 1.00 0.00 C ATOM 1757 CG TRP A 115 -13.913 -2.779 -0.975 1.00 0.00 C ATOM 1758 CD1 TRP A 115 -13.562 -2.244 -2.178 1.00 0.00 C ATOM 1759 CD2 TRP A 115 -13.646 -1.771 0.007 1.00 0.00 C ATOM 1760 NE1 TRP A 115 -13.094 -0.964 -2.007 1.00 0.00 N ATOM 1761 CE2 TRP A 115 -13.136 -0.651 -0.675 1.00 0.00 C ATOM 1762 CE3 TRP A 115 -13.790 -1.705 1.394 1.00 0.00 C ATOM 1763 CZ2 TRP A 115 -12.768 0.517 -0.016 1.00 0.00 C ATOM 1764 CZ3 TRP A 115 -13.425 -0.543 2.047 1.00 0.00 C ATOM 1765 CH2 TRP A 115 -12.920 0.554 1.342 1.00 0.00 C ATOM 0 H TRP A 115 -12.025 -4.061 -1.084 1.00 0.00 H new ATOM 0 HA TRP A 115 -13.534 -4.871 1.077 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -14.724 -4.602 -1.689 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -15.383 -4.066 -0.156 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -13.640 -2.752 -3.128 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -12.768 -0.347 -2.751 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -14.180 -2.547 1.947 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -12.376 1.365 -0.558 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -13.532 -0.481 3.120 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -12.645 1.448 1.881 1.00 0.00 H new ATOM 1776 N SER A 116 -14.724 -7.035 0.703 1.00 0.00 N ATOM 1777 CA SER A 116 -15.225 -8.397 0.613 1.00 0.00 C ATOM 1778 C SER A 116 -16.624 -8.395 -0.001 1.00 0.00 C ATOM 1779 O SER A 116 -17.112 -9.423 -0.472 1.00 0.00 O ATOM 1780 CB SER A 116 -15.256 -9.047 1.997 1.00 0.00 C ATOM 1781 OG SER A 116 -15.814 -10.348 1.938 1.00 0.00 O ATOM 0 H SER A 116 -15.049 -6.522 1.523 1.00 0.00 H new ATOM 0 HA SER A 116 -14.557 -8.976 -0.025 1.00 0.00 H new ATOM 0 HB2 SER A 116 -14.245 -9.100 2.400 1.00 0.00 H new ATOM 0 HB3 SER A 116 -15.839 -8.429 2.679 1.00 0.00 H new ATOM 0 HG SER A 116 -15.821 -10.742 2.835 1.00 0.00 H new ATOM 1787 N HIS A 117 -17.259 -7.221 0.012 1.00 0.00 N ATOM 1788 CA HIS A 117 -18.603 -7.052 -0.540 1.00 0.00 C ATOM 1789 C HIS A 117 -19.048 -5.592 -0.432 1.00 0.00 C ATOM 1790 O HIS A 117 -19.569 -5.172 0.602 1.00 0.00 O ATOM 1791 CB HIS A 117 -19.601 -7.946 0.196 1.00 0.00 C ATOM 1792 CG HIS A 117 -20.982 -7.905 -0.381 1.00 0.00 C ATOM 1793 ND1 HIS A 117 -22.001 -7.148 0.159 1.00 0.00 N ATOM 1794 CD2 HIS A 117 -21.512 -8.534 -1.456 1.00 0.00 C ATOM 1795 CE1 HIS A 117 -23.097 -7.315 -0.558 1.00 0.00 C ATOM 1796 NE2 HIS A 117 -22.828 -8.150 -1.544 1.00 0.00 N ATOM 0 H HIS A 117 -16.859 -6.368 0.402 1.00 0.00 H new ATOM 0 HA HIS A 117 -18.575 -7.339 -1.591 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -19.238 -8.974 0.176 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -19.644 -7.643 1.242 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -20.996 -9.211 -2.121 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -24.052 -6.847 -0.370 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -23.490 -8.460 -2.256 1.00 0.00 H new ATOM 1805 N PRO A 118 -18.845 -4.798 -1.497 1.00 0.00 N ATOM 1806 CA PRO A 118 -19.216 -3.390 -1.518 1.00 0.00 C ATOM 1807 C PRO A 118 -20.615 -3.148 -2.078 1.00 0.00 C ATOM 1808 O PRO A 118 -21.413 -4.079 -2.193 1.00 0.00 O ATOM 1809 CB PRO A 118 -18.157 -2.796 -2.440 1.00 0.00 C ATOM 1810 CG PRO A 118 -17.847 -3.886 -3.420 1.00 0.00 C ATOM 1811 CD PRO A 118 -18.221 -5.199 -2.768 1.00 0.00 C ATOM 0 HA PRO A 118 -19.250 -2.953 -0.520 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -18.528 -1.904 -2.945 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -17.268 -2.501 -1.883 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -18.407 -3.743 -4.344 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -16.789 -3.876 -3.684 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -18.911 -5.771 -3.389 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -17.345 -5.827 -2.603 1.00 0.00 H new ATOM 1819 N LEU A 119 -20.886 -1.887 -2.431 1.00 0.00 N ATOM 1820 CA LEU A 119 -22.168 -1.464 -2.976 1.00 0.00 C ATOM 1821 C LEU A 119 -23.316 -2.402 -2.595 1.00 0.00 C ATOM 1822 O LEU A 119 -23.576 -3.389 -3.284 1.00 0.00 O ATOM 1823 CB LEU A 119 -22.059 -1.351 -4.492 1.00 0.00 C ATOM 1824 CG LEU A 119 -20.852 -0.560 -5.013 1.00 0.00 C ATOM 1825 CD1 LEU A 119 -21.046 -0.207 -6.477 1.00 0.00 C ATOM 1826 CD2 LEU A 119 -20.633 0.695 -4.182 1.00 0.00 C ATOM 0 H LEU A 119 -20.210 -1.128 -2.343 1.00 0.00 H new ATOM 0 HA LEU A 119 -22.405 -0.493 -2.541 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -22.020 -2.356 -4.911 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -22.968 -0.883 -4.870 1.00 0.00 H new ATOM 0 HG LEU A 119 -19.964 -1.185 -4.923 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -20.182 0.354 -6.834 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -21.151 -1.121 -7.061 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -21.944 0.400 -6.589 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -19.772 1.241 -4.568 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -21.519 1.327 -4.238 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -20.450 0.417 -3.144 1.00 0.00 H new ATOM 1838 N PRO A 120 -24.026 -2.098 -1.490 1.00 0.00 N ATOM 1839 CA PRO A 120 -25.153 -2.907 -1.022 1.00 0.00 C ATOM 1840 C PRO A 120 -26.390 -2.717 -1.894 1.00 0.00 C ATOM 1841 O PRO A 120 -26.292 -2.257 -3.031 1.00 0.00 O ATOM 1842 CB PRO A 120 -25.421 -2.388 0.401 1.00 0.00 C ATOM 1843 CG PRO A 120 -24.301 -1.449 0.712 1.00 0.00 C ATOM 1844 CD PRO A 120 -23.787 -0.953 -0.607 1.00 0.00 C ATOM 0 HA PRO A 120 -24.927 -3.973 -1.057 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -26.384 -1.880 0.457 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -25.452 -3.209 1.117 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -24.648 -0.621 1.330 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -23.513 -1.955 1.271 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -24.320 -0.064 -0.942 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -22.730 -0.691 -0.558 1.00 0.00 H new ATOM 1852 N GLN A 121 -27.554 -3.072 -1.356 1.00 0.00 N ATOM 1853 CA GLN A 121 -28.807 -2.944 -2.079 1.00 0.00 C ATOM 1854 C GLN A 121 -29.681 -1.838 -1.490 1.00 0.00 C ATOM 1855 O GLN A 121 -30.050 -1.887 -0.316 1.00 0.00 O ATOM 1856 CB GLN A 121 -29.560 -4.271 -2.029 1.00 0.00 C ATOM 1857 CG GLN A 121 -29.012 -5.327 -2.974 1.00 0.00 C ATOM 1858 CD GLN A 121 -29.831 -6.603 -2.955 1.00 0.00 C ATOM 1859 OE1 GLN A 121 -31.042 -6.573 -2.736 1.00 0.00 O ATOM 1860 NE2 GLN A 121 -29.172 -7.733 -3.183 1.00 0.00 N ATOM 0 H GLN A 121 -27.651 -3.453 -0.415 1.00 0.00 H new ATOM 0 HA GLN A 121 -28.579 -2.681 -3.112 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -29.528 -4.657 -1.010 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -30.608 -4.092 -2.269 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -28.991 -4.927 -3.988 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -27.982 -5.556 -2.700 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -28.168 -7.711 -3.360 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -29.670 -8.623 -3.181 1.00 0.00 H new ATOM 1869 N CYS A 122 -30.009 -0.842 -2.309 1.00 0.00 N ATOM 1870 CA CYS A 122 -30.861 0.255 -1.860 1.00 0.00 C ATOM 1871 C CYS A 122 -32.271 0.071 -2.412 1.00 0.00 C ATOM 1872 O CYS A 122 -32.507 0.246 -3.607 1.00 0.00 O ATOM 1873 CB CYS A 122 -30.296 1.607 -2.306 1.00 0.00 C ATOM 1874 SG CYS A 122 -28.816 2.148 -1.388 1.00 0.00 S ATOM 0 H CYS A 122 -29.701 -0.772 -3.279 1.00 0.00 H new ATOM 0 HA CYS A 122 -30.893 0.243 -0.771 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -30.050 1.552 -3.366 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -31.072 2.364 -2.198 1.00 0.00 H new ATOM 1879 N GLU A 123 -33.205 -0.284 -1.534 1.00 0.00 N ATOM 1880 CA GLU A 123 -34.587 -0.509 -1.946 1.00 0.00 C ATOM 1881 C GLU A 123 -35.545 0.344 -1.121 1.00 0.00 C ATOM 1882 O GLU A 123 -35.326 0.588 0.065 1.00 0.00 O ATOM 1883 CB GLU A 123 -34.946 -1.988 -1.793 1.00 0.00 C ATOM 1884 CG GLU A 123 -36.299 -2.350 -2.384 1.00 0.00 C ATOM 1885 CD GLU A 123 -36.365 -2.105 -3.879 1.00 0.00 C ATOM 1886 OE1 GLU A 123 -36.010 -3.024 -4.646 1.00 0.00 O ATOM 1887 OE2 GLU A 123 -36.768 -0.994 -4.281 1.00 0.00 O ATOM 0 H GLU A 123 -33.032 -0.421 -0.538 1.00 0.00 H new ATOM 0 HA GLU A 123 -34.682 -0.222 -2.993 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -34.176 -2.592 -2.273 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -34.940 -2.247 -0.734 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -36.511 -3.400 -2.182 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -37.076 -1.767 -1.889 1.00 0.00 H new ATOM 1894 N ILE A 124 -36.609 0.790 -1.781 1.00 0.00 N ATOM 1895 CA ILE A 124 -37.620 1.629 -1.147 1.00 0.00 C ATOM 1896 C ILE A 124 -38.262 0.917 0.041 1.00 0.00 C ATOM 1897 O ILE A 124 -38.277 -0.312 0.107 1.00 0.00 O ATOM 1898 CB ILE A 124 -38.719 2.021 -2.158 1.00 0.00 C ATOM 1899 CG1 ILE A 124 -39.671 3.056 -1.553 1.00 0.00 C ATOM 1900 CG2 ILE A 124 -39.488 0.789 -2.610 1.00 0.00 C ATOM 1901 CD1 ILE A 124 -39.121 4.465 -1.567 1.00 0.00 C ATOM 0 H ILE A 124 -36.794 0.582 -2.762 1.00 0.00 H new ATOM 0 HA ILE A 124 -37.118 2.529 -0.791 1.00 0.00 H new ATOM 0 HB ILE A 124 -38.239 2.469 -3.028 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -40.612 3.037 -2.102 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -39.896 2.773 -0.525 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -40.259 1.082 -3.322 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -38.803 0.087 -3.085 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -39.954 0.314 -1.747 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -39.849 5.144 -1.123 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -38.195 4.500 -0.993 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -38.922 4.768 -2.595 1.00 0.00 H new ATOM 1913 N LEU A 125 -38.793 1.700 0.977 1.00 0.00 N ATOM 1914 CA LEU A 125 -39.442 1.148 2.160 1.00 0.00 C ATOM 1915 C LEU A 125 -40.770 0.494 1.789 1.00 0.00 C ATOM 1916 O LEU A 125 -41.151 -0.528 2.360 1.00 0.00 O ATOM 1917 CB LEU A 125 -39.674 2.249 3.198 1.00 0.00 C ATOM 1918 CG LEU A 125 -38.406 2.821 3.838 1.00 0.00 C ATOM 1919 CD1 LEU A 125 -38.739 4.050 4.669 1.00 0.00 C ATOM 1920 CD2 LEU A 125 -37.718 1.770 4.696 1.00 0.00 C ATOM 0 H LEU A 125 -38.786 2.719 0.938 1.00 0.00 H new ATOM 0 HA LEU A 125 -38.788 0.388 2.587 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -40.221 3.064 2.724 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -40.313 1.853 3.987 1.00 0.00 H new ATOM 0 HG LEU A 125 -37.722 3.115 3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -37.827 4.444 5.117 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -39.188 4.811 4.030 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -39.441 3.777 5.457 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -36.819 2.196 5.142 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -38.395 1.444 5.485 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -37.446 0.916 4.076 1.00 0.00 H new ATOM 1932 N GLU A 126 -41.469 1.093 0.828 1.00 0.00 N ATOM 1933 CA GLU A 126 -42.753 0.571 0.377 1.00 0.00 C ATOM 1934 C GLU A 126 -43.165 1.211 -0.947 1.00 0.00 C ATOM 1935 O GLU A 126 -43.799 2.265 -0.967 1.00 0.00 O ATOM 1936 CB GLU A 126 -43.831 0.821 1.433 1.00 0.00 C ATOM 1937 CG GLU A 126 -45.175 0.198 1.095 1.00 0.00 C ATOM 1938 CD GLU A 126 -46.265 0.597 2.070 1.00 0.00 C ATOM 1939 OE1 GLU A 126 -46.277 0.062 3.198 1.00 0.00 O ATOM 1940 OE2 GLU A 126 -47.105 1.448 1.706 1.00 0.00 O ATOM 0 H GLU A 126 -41.166 1.940 0.348 1.00 0.00 H new ATOM 0 HA GLU A 126 -42.646 -0.503 0.225 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -43.488 0.426 2.390 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -43.961 1.896 1.560 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -45.467 0.496 0.088 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -45.077 -0.888 1.090 1.00 0.00 H new ATOM 1947 N HIS A 127 -42.792 0.567 -2.051 1.00 0.00 N ATOM 1948 CA HIS A 127 -43.119 1.072 -3.382 1.00 0.00 C ATOM 1949 C HIS A 127 -42.724 0.063 -4.456 1.00 0.00 C ATOM 1950 O HIS A 127 -41.658 -0.548 -4.387 1.00 0.00 O ATOM 1951 CB HIS A 127 -42.412 2.406 -3.632 1.00 0.00 C ATOM 1952 CG HIS A 127 -42.697 2.999 -4.978 1.00 0.00 C ATOM 1953 ND1 HIS A 127 -43.735 3.876 -5.209 1.00 0.00 N ATOM 1954 CD2 HIS A 127 -42.068 2.842 -6.167 1.00 0.00 C ATOM 1955 CE1 HIS A 127 -43.733 4.233 -6.481 1.00 0.00 C ATOM 1956 NE2 HIS A 127 -42.731 3.620 -7.084 1.00 0.00 N ATOM 0 H HIS A 127 -42.263 -0.305 -2.050 1.00 0.00 H new ATOM 0 HA HIS A 127 -44.197 1.226 -3.432 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -42.713 3.116 -2.862 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -41.337 2.261 -3.530 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -41.206 2.221 -6.358 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -44.432 4.911 -6.948 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -42.489 3.710 -8.071 1.00 0.00 H new ATOM 1965 N HIS A 128 -43.593 -0.105 -5.449 1.00 0.00 N ATOM 1966 CA HIS A 128 -43.336 -1.038 -6.539 1.00 0.00 C ATOM 1967 C HIS A 128 -44.077 -0.609 -7.801 1.00 0.00 C ATOM 1968 O HIS A 128 -45.300 -0.469 -7.796 1.00 0.00 O ATOM 1969 CB HIS A 128 -43.759 -2.453 -6.137 1.00 0.00 C ATOM 1970 CG HIS A 128 -43.433 -3.494 -7.163 1.00 0.00 C ATOM 1971 ND1 HIS A 128 -42.312 -4.294 -7.092 1.00 0.00 N ATOM 1972 CD2 HIS A 128 -44.089 -3.868 -8.287 1.00 0.00 C ATOM 1973 CE1 HIS A 128 -42.292 -5.114 -8.128 1.00 0.00 C ATOM 1974 NE2 HIS A 128 -43.360 -4.875 -8.867 1.00 0.00 N ATOM 0 H HIS A 128 -44.480 0.393 -5.520 1.00 0.00 H new ATOM 0 HA HIS A 128 -42.266 -1.034 -6.748 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -43.271 -2.716 -5.198 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -44.833 -2.463 -5.951 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -45.014 -3.451 -8.658 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -41.532 -5.853 -8.335 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -43.604 -5.361 -9.730 1.00 0.00 H new ATOM 1983 N HIS A 129 -43.329 -0.402 -8.880 1.00 0.00 N ATOM 1984 CA HIS A 129 -43.916 0.015 -10.147 1.00 0.00 C ATOM 1985 C HIS A 129 -43.044 -0.420 -11.321 1.00 0.00 C ATOM 1986 O HIS A 129 -43.427 -1.291 -12.101 1.00 0.00 O ATOM 1987 CB HIS A 129 -44.102 1.534 -10.166 1.00 0.00 C ATOM 1988 CG HIS A 129 -44.756 2.045 -11.411 1.00 0.00 C ATOM 1989 ND1 HIS A 129 -44.104 2.835 -12.335 1.00 0.00 N ATOM 1990 CD2 HIS A 129 -46.015 1.881 -11.883 1.00 0.00 C ATOM 1991 CE1 HIS A 129 -44.934 3.136 -13.319 1.00 0.00 C ATOM 1992 NE2 HIS A 129 -46.099 2.569 -13.068 1.00 0.00 N ATOM 0 H HIS A 129 -42.316 -0.516 -8.902 1.00 0.00 H new ATOM 0 HA HIS A 129 -44.889 -0.466 -10.247 1.00 0.00 H new ATOM 0 HB2 HIS A 129 -44.701 1.828 -9.304 1.00 0.00 H new ATOM 0 HB3 HIS A 129 -43.128 2.012 -10.055 1.00 0.00 H new ATOM 0 HD2 HIS A 129 -46.806 1.314 -11.414 1.00 0.00 H new ATOM 0 HE1 HIS A 129 -44.699 3.742 -14.181 1.00 0.00 H new ATOM 0 HE2 HIS A 129 -46.928 2.632 -13.659 1.00 0.00 H new ATOM 2001 N HIS A 130 -41.870 0.193 -11.437 1.00 0.00 N ATOM 2002 CA HIS A 130 -40.944 -0.129 -12.516 1.00 0.00 C ATOM 2003 C HIS A 130 -39.521 0.283 -12.149 1.00 0.00 C ATOM 2004 O HIS A 130 -39.261 1.447 -11.842 1.00 0.00 O ATOM 2005 CB HIS A 130 -41.375 0.566 -13.809 1.00 0.00 C ATOM 2006 CG HIS A 130 -40.465 0.300 -14.968 1.00 0.00 C ATOM 2007 ND1 HIS A 130 -40.665 -0.731 -15.863 1.00 0.00 N ATOM 2008 CD2 HIS A 130 -39.343 0.940 -15.379 1.00 0.00 C ATOM 2009 CE1 HIS A 130 -39.706 -0.714 -16.772 1.00 0.00 C ATOM 2010 NE2 HIS A 130 -38.893 0.289 -16.500 1.00 0.00 N ATOM 0 H HIS A 130 -41.538 0.915 -10.797 1.00 0.00 H new ATOM 0 HA HIS A 130 -40.962 -1.208 -12.671 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -42.383 0.240 -14.068 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -41.422 1.641 -13.635 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -38.888 1.801 -14.912 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -39.605 -1.404 -17.597 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -38.063 0.540 -17.037 1.00 0.00 H new ATOM 2019 N HIS A 131 -38.603 -0.679 -12.183 1.00 0.00 N ATOM 2020 CA HIS A 131 -37.207 -0.416 -11.854 1.00 0.00 C ATOM 2021 C HIS A 131 -36.271 -1.124 -12.829 1.00 0.00 C ATOM 2022 O HIS A 131 -36.625 -2.148 -13.414 1.00 0.00 O ATOM 2023 CB HIS A 131 -36.906 -0.871 -10.424 1.00 0.00 C ATOM 2024 CG HIS A 131 -37.711 -0.156 -9.385 1.00 0.00 C ATOM 2025 ND1 HIS A 131 -38.928 -0.617 -8.925 1.00 0.00 N ATOM 2026 CD2 HIS A 131 -37.470 0.995 -8.712 1.00 0.00 C ATOM 2027 CE1 HIS A 131 -39.399 0.217 -8.016 1.00 0.00 C ATOM 2028 NE2 HIS A 131 -38.534 1.203 -7.869 1.00 0.00 N ATOM 0 H HIS A 131 -38.802 -1.647 -12.435 1.00 0.00 H new ATOM 0 HA HIS A 131 -37.039 0.658 -11.933 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -37.095 -1.942 -10.345 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -35.846 -0.719 -10.219 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -36.603 1.630 -8.819 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -40.333 0.110 -7.484 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -38.639 1.993 -7.232 1.00 0.00 H new ATOM 2037 N HIS A 132 -35.075 -0.568 -12.999 1.00 0.00 N ATOM 2038 CA HIS A 132 -34.083 -1.143 -13.902 1.00 0.00 C ATOM 2039 C HIS A 132 -33.168 -2.110 -13.157 1.00 0.00 C ATOM 2040 O HIS A 132 -32.184 -1.642 -12.545 1.00 0.00 O ATOM 2041 CB HIS A 132 -33.254 -0.035 -14.554 1.00 0.00 C ATOM 2042 CG HIS A 132 -32.215 -0.543 -15.505 1.00 0.00 C ATOM 2043 ND1 HIS A 132 -32.463 -0.764 -16.843 1.00 0.00 N ATOM 2044 CD2 HIS A 132 -30.916 -0.874 -15.305 1.00 0.00 C ATOM 2045 CE1 HIS A 132 -31.364 -1.211 -17.425 1.00 0.00 C ATOM 2046 NE2 HIS A 132 -30.412 -1.286 -16.514 1.00 0.00 N ATOM 2047 OXT HIS A 132 -33.443 -3.328 -13.192 1.00 0.00 O ATOM 0 H HIS A 132 -34.769 0.281 -12.523 1.00 0.00 H new ATOM 0 HA HIS A 132 -34.610 -1.696 -14.679 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -33.922 0.641 -15.087 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -32.766 0.549 -13.774 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -30.378 -0.823 -14.370 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -31.262 -1.471 -18.468 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -29.456 -1.600 -16.681 1.00 0.00 H new TER 2056 HIS A 132