USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 839 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 97 THR OG1 : rot 94:sc= 1.71 USER MOD Set 1.2: A 112 LYS NZ :NH3+ -172:sc= 0.46 (180deg=0) USER MOD Set 2.1: A 71 SER OG : rot 66:sc= 2.38 USER MOD Set 2.2: A 86 THR OG1 : rot 23:sc= 0.555 USER MOD Set 3.1: A 74 ASN : amide:sc= 0.593 X(o=1.2,f=0.78) USER MOD Set 3.2: A 89 SER OG : rot 180:sc= 0.559 USER MOD Set 4.1: A 73 TYR OH : rot 15:sc= 1.21 USER MOD Set 4.2: A 83 THR OG1 : rot -7:sc= 0.987 USER MOD Set 5.1: A 47 ASN : amide:sc= -0.0449 K(o=2,f=0.53) USER MOD Set 5.2: A 62 GLN : amide:sc= 0.922 K(o=2,f=-1.6) USER MOD Set 5.3: A 64 TYR OH : rot 176:sc= 1.07 USER MOD Set 6.1: A 57 ASN : amide:sc= 0.873 K(o=3.4,f=1.4) USER MOD Set 6.2: A 72 GLN : amide:sc= 1.55 K(o=3.4,f=0.37) USER MOD Set 6.3: A 87 SER OG : rot 81:sc= 0.944 USER MOD Set 6.4: A 121 MET CE :methyl -175:sc= -0.0189 (180deg=-0.0469) USER MOD Set 7.1: A 19 LYS NZ :NH3+ -156:sc= 1.8 (180deg=1.08) USER MOD Set 7.2: A 35 THR OG1 : rot 180:sc= 0.584 USER MOD Set 8.1: A 14 ASN : amide:sc= 1.05 K(o=3.1,f=0.72) USER MOD Set 8.2: A 29 ASN : amide:sc= 2 K(o=3.1,f=-0.4) USER MOD Set 9.1: A 12 THR OG1 : rot 120:sc= 1.21 USER MOD Set 9.2: A 15 SER OG : rot 111:sc= 1.76 USER MOD Set10.1: A 8 ASN : amide:sc= 0.629 K(o=2,f=0.2) USER MOD Set10.2: A 24 ASN : amide:sc= 1.39 K(o=2,f=-1) USER MOD Set11.1: A 6 ASN : amide:sc= 1.35 K(o=2.4,f=-11!) USER MOD Set11.2: A 9 SER OG : rot 87:sc= 1.05 USER MOD Single : A 1 ASP N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 92:sc= 1.31 USER MOD Single : A 7 THR OG1 : rot 170:sc= -0.771 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 20 SER OG : rot 92:sc= 1.43 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 80:sc= 1.9 USER MOD Single : A 31 GLN : amide:sc= 0.712 K(o=0.71,f=-0.34) USER MOD Single : A 36 SER OG : rot 66:sc= 1.31 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 63:sc= 1.7 USER MOD Single : A 42 GLN : amide:sc= 1.31 K(o=1.3,f=0) USER MOD Single : A 43 TYR OH : rot 15:sc= -0.152 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -161:sc= 1.25 (180deg=0.655) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 77:sc= 1.7 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0906 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -166:sc= 1.23 (180deg=1.14) USER MOD Single : A 61 SER OG : rot 62:sc= 1.61 USER MOD Single : A 66 THR OG1 : rot 71:sc= 1.41 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 68:sc= 1.54 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 110:sc= 0.982 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 78:sc= 1.15 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 82:sc= 1.26 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 0.612 -2.060 -0.442 1.00 0.00 N ATOM 2 CA ASP A 1 1.730 -2.616 -1.237 1.00 0.00 C ATOM 3 C ASP A 1 2.710 -3.360 -0.329 1.00 0.00 C ATOM 4 O ASP A 1 3.321 -2.756 0.556 1.00 0.00 O ATOM 5 CB ASP A 1 2.461 -1.527 -2.038 1.00 0.00 C ATOM 6 CG ASP A 1 3.693 -2.093 -2.753 1.00 0.00 C ATOM 7 OD1 ASP A 1 3.697 -3.296 -3.102 1.00 0.00 O ATOM 8 OD2 ASP A 1 4.659 -1.332 -2.981 1.00 0.00 O ATOM 0 H1 ASP A 1 -0.046 -1.557 -1.072 1.00 0.00 H new ATOM 0 H2 ASP A 1 0.109 -2.833 0.038 1.00 0.00 H new ATOM 0 H3 ASP A 1 0.986 -1.398 0.267 1.00 0.00 H new ATOM 0 HA ASP A 1 1.305 -3.319 -1.954 1.00 0.00 H new ATOM 0 HB2 ASP A 1 1.780 -1.093 -2.770 1.00 0.00 H new ATOM 0 HB3 ASP A 1 2.764 -0.722 -1.368 1.00 0.00 H new ATOM 15 N GLY A 2 2.864 -4.672 -0.541 1.00 0.00 N ATOM 16 CA GLY A 2 3.766 -5.523 0.229 1.00 0.00 C ATOM 17 C GLY A 2 5.150 -5.669 -0.407 1.00 0.00 C ATOM 18 O GLY A 2 6.022 -6.287 0.203 1.00 0.00 O ATOM 0 H GLY A 2 2.354 -5.177 -1.266 1.00 0.00 H new ATOM 0 HA2 GLY A 2 3.876 -5.110 1.232 1.00 0.00 H new ATOM 0 HA3 GLY A 2 3.318 -6.511 0.338 1.00 0.00 H new ATOM 22 N THR A 3 5.377 -5.139 -1.612 1.00 0.00 N ATOM 23 CA THR A 3 6.627 -5.314 -2.345 1.00 0.00 C ATOM 24 C THR A 3 7.801 -4.669 -1.582 1.00 0.00 C ATOM 25 O THR A 3 7.624 -3.689 -0.849 1.00 0.00 O ATOM 26 CB THR A 3 6.472 -4.732 -3.770 1.00 0.00 C ATOM 27 OG1 THR A 3 5.192 -5.014 -4.305 1.00 0.00 O ATOM 28 CG2 THR A 3 7.502 -5.295 -4.759 1.00 0.00 C ATOM 0 H THR A 3 4.690 -4.572 -2.108 1.00 0.00 H new ATOM 0 HA THR A 3 6.854 -6.377 -2.433 1.00 0.00 H new ATOM 0 HB THR A 3 6.623 -3.659 -3.655 1.00 0.00 H new ATOM 0 HG1 THR A 3 4.582 -4.274 -4.102 1.00 0.00 H new ATOM 0 HG21 THR A 3 7.344 -4.850 -5.741 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.508 -5.058 -4.411 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.387 -6.377 -4.828 1.00 0.00 H new ATOM 36 N CYS A 4 9.007 -5.222 -1.751 1.00 0.00 N ATOM 37 CA CYS A 4 10.243 -4.605 -1.277 1.00 0.00 C ATOM 38 C CYS A 4 10.498 -3.305 -2.057 1.00 0.00 C ATOM 39 O CYS A 4 9.996 -3.128 -3.171 1.00 0.00 O ATOM 40 CB CYS A 4 11.410 -5.582 -1.492 1.00 0.00 C ATOM 41 SG CYS A 4 12.958 -5.181 -0.628 1.00 0.00 S ATOM 0 H CYS A 4 9.150 -6.115 -2.223 1.00 0.00 H new ATOM 0 HA CYS A 4 10.157 -4.373 -0.215 1.00 0.00 H new ATOM 0 HB2 CYS A 4 11.089 -6.575 -1.177 1.00 0.00 H new ATOM 0 HB3 CYS A 4 11.618 -5.638 -2.560 1.00 0.00 H new ATOM 46 N VAL A 5 11.359 -2.445 -1.521 1.00 0.00 N ATOM 47 CA VAL A 5 11.880 -1.256 -2.183 1.00 0.00 C ATOM 48 C VAL A 5 13.400 -1.439 -2.188 1.00 0.00 C ATOM 49 O VAL A 5 14.099 -0.986 -1.281 1.00 0.00 O ATOM 50 CB VAL A 5 11.364 0.024 -1.482 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.807 1.286 -2.239 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.829 0.044 -1.371 1.00 0.00 C ATOM 0 H VAL A 5 11.726 -2.563 -0.577 1.00 0.00 H new ATOM 0 HA VAL A 5 11.537 -1.133 -3.210 1.00 0.00 H new ATOM 0 HB VAL A 5 11.795 0.016 -0.481 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.431 2.170 -1.724 1.00 0.00 H new ATOM 0 HG12 VAL A 5 12.896 1.324 -2.277 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.409 1.260 -3.254 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.512 0.960 -0.873 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.392 0.004 -2.369 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.495 -0.818 -0.793 1.00 0.00 H new ATOM 62 N ASN A 6 13.900 -2.208 -3.159 1.00 0.00 N ATOM 63 CA ASN A 6 15.298 -2.631 -3.217 1.00 0.00 C ATOM 64 C ASN A 6 16.046 -1.812 -4.270 1.00 0.00 C ATOM 65 O ASN A 6 15.576 -1.721 -5.406 1.00 0.00 O ATOM 66 CB ASN A 6 15.378 -4.127 -3.570 1.00 0.00 C ATOM 67 CG ASN A 6 16.822 -4.608 -3.599 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.701 -3.958 -3.051 1.00 0.00 O ATOM 69 ND2 ASN A 6 17.110 -5.738 -4.222 1.00 0.00 N ATOM 0 H ASN A 6 13.337 -2.557 -3.935 1.00 0.00 H new ATOM 0 HA ASN A 6 15.759 -2.468 -2.243 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.813 -4.707 -2.840 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.915 -4.300 -4.541 1.00 0.00 H new ATOM 0 HD21 ASN A 6 18.072 -6.075 -4.249 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.370 -6.273 -4.676 1.00 0.00 H new ATOM 76 N THR A 7 17.201 -1.238 -3.922 1.00 0.00 N ATOM 77 CA THR A 7 18.058 -0.550 -4.880 1.00 0.00 C ATOM 78 C THR A 7 18.895 -1.583 -5.647 1.00 0.00 C ATOM 79 O THR A 7 18.748 -1.743 -6.862 1.00 0.00 O ATOM 80 CB THR A 7 18.932 0.495 -4.154 1.00 0.00 C ATOM 81 OG1 THR A 7 19.835 -0.099 -3.236 1.00 0.00 O ATOM 82 CG2 THR A 7 18.080 1.481 -3.356 1.00 0.00 C ATOM 0 H THR A 7 17.564 -1.239 -2.969 1.00 0.00 H new ATOM 0 HA THR A 7 17.452 -0.008 -5.606 1.00 0.00 H new ATOM 0 HB THR A 7 19.483 1.004 -4.945 1.00 0.00 H new ATOM 0 HG1 THR A 7 20.473 0.575 -2.922 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.728 2.202 -2.858 1.00 0.00 H new ATOM 0 HG22 THR A 7 17.404 2.006 -4.030 1.00 0.00 H new ATOM 0 HG23 THR A 7 17.499 0.939 -2.609 1.00 0.00 H new ATOM 90 N ASN A 8 19.760 -2.296 -4.918 1.00 0.00 N ATOM 91 CA ASN A 8 20.796 -3.193 -5.437 1.00 0.00 C ATOM 92 C ASN A 8 21.194 -4.269 -4.411 1.00 0.00 C ATOM 93 O ASN A 8 22.237 -4.911 -4.535 1.00 0.00 O ATOM 94 CB ASN A 8 22.023 -2.355 -5.851 1.00 0.00 C ATOM 95 CG ASN A 8 23.032 -3.164 -6.666 1.00 0.00 C ATOM 96 OD1 ASN A 8 22.692 -3.749 -7.693 1.00 0.00 O ATOM 97 ND2 ASN A 8 24.290 -3.197 -6.259 1.00 0.00 N ATOM 0 H ASN A 8 19.756 -2.261 -3.899 1.00 0.00 H new ATOM 0 HA ASN A 8 20.396 -3.719 -6.304 1.00 0.00 H new ATOM 0 HB2 ASN A 8 21.693 -1.496 -6.436 1.00 0.00 H new ATOM 0 HB3 ASN A 8 22.511 -1.964 -4.958 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.987 -3.711 -6.798 1.00 0.00 H new ATOM 0 HD22 ASN A 8 24.563 -2.709 -5.406 1.00 0.00 H new ATOM 104 N SER A 9 20.404 -4.435 -3.352 1.00 0.00 N ATOM 105 CA SER A 9 20.626 -5.426 -2.307 1.00 0.00 C ATOM 106 C SER A 9 20.477 -6.839 -2.854 1.00 0.00 C ATOM 107 O SER A 9 19.795 -7.056 -3.863 1.00 0.00 O ATOM 108 CB SER A 9 19.622 -5.229 -1.166 1.00 0.00 C ATOM 109 OG SER A 9 19.514 -3.855 -0.852 1.00 0.00 O ATOM 0 H SER A 9 19.571 -3.868 -3.195 1.00 0.00 H new ATOM 0 HA SER A 9 21.642 -5.292 -1.935 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.648 -5.622 -1.455 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.943 -5.788 -0.287 1.00 0.00 H new ATOM 0 HG SER A 9 18.837 -3.440 -1.427 1.00 0.00 H new ATOM 115 N GLN A 10 21.042 -7.796 -2.120 1.00 0.00 N ATOM 116 CA GLN A 10 20.910 -9.219 -2.393 1.00 0.00 C ATOM 117 C GLN A 10 20.097 -9.874 -1.275 1.00 0.00 C ATOM 118 O GLN A 10 20.321 -9.590 -0.097 1.00 0.00 O ATOM 119 CB GLN A 10 22.297 -9.845 -2.609 1.00 0.00 C ATOM 120 CG GLN A 10 23.221 -9.923 -1.386 1.00 0.00 C ATOM 121 CD GLN A 10 24.570 -10.533 -1.768 1.00 0.00 C ATOM 122 OE1 GLN A 10 25.525 -9.826 -2.080 1.00 0.00 O ATOM 123 NE2 GLN A 10 24.682 -11.852 -1.769 1.00 0.00 N ATOM 0 H GLN A 10 21.616 -7.595 -1.301 1.00 0.00 H new ATOM 0 HA GLN A 10 20.361 -9.389 -3.319 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.157 -10.855 -2.994 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.809 -9.276 -3.385 1.00 0.00 H new ATOM 0 HG2 GLN A 10 23.371 -8.926 -0.973 1.00 0.00 H new ATOM 0 HG3 GLN A 10 22.752 -10.524 -0.607 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.884 -12.432 -1.509 1.00 0.00 H new ATOM 0 HE22 GLN A 10 25.566 -12.289 -2.030 1.00 0.00 H new ATOM 132 N ILE A 11 19.147 -10.729 -1.658 1.00 0.00 N ATOM 133 CA ILE A 11 18.181 -11.374 -0.777 1.00 0.00 C ATOM 134 C ILE A 11 18.141 -12.833 -1.229 1.00 0.00 C ATOM 135 O ILE A 11 17.876 -13.091 -2.408 1.00 0.00 O ATOM 136 CB ILE A 11 16.796 -10.670 -0.873 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.846 -9.146 -0.597 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.797 -11.298 0.114 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.929 -8.293 -1.868 1.00 0.00 C ATOM 0 H ILE A 11 19.028 -11.000 -2.634 1.00 0.00 H new ATOM 0 HA ILE A 11 18.458 -11.308 0.275 1.00 0.00 H new ATOM 0 HB ILE A 11 16.477 -10.814 -1.905 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.958 -8.858 -0.034 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.708 -8.928 0.034 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.836 -10.791 0.031 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.671 -12.355 -0.119 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.175 -11.193 1.131 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.960 -7.238 -1.597 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.831 -8.552 -2.422 1.00 0.00 H new ATOM 0 HD13 ILE A 11 16.054 -8.482 -2.490 1.00 0.00 H new ATOM 151 N THR A 12 18.468 -13.779 -0.342 1.00 0.00 N ATOM 152 CA THR A 12 18.516 -15.191 -0.740 1.00 0.00 C ATOM 153 C THR A 12 17.108 -15.751 -1.008 1.00 0.00 C ATOM 154 O THR A 12 16.098 -15.144 -0.641 1.00 0.00 O ATOM 155 CB THR A 12 19.300 -16.045 0.271 1.00 0.00 C ATOM 156 OG1 THR A 12 18.729 -15.981 1.564 1.00 0.00 O ATOM 157 CG2 THR A 12 20.770 -15.631 0.343 1.00 0.00 C ATOM 0 H THR A 12 18.699 -13.600 0.635 1.00 0.00 H new ATOM 0 HA THR A 12 19.063 -15.245 -1.681 1.00 0.00 H new ATOM 0 HB THR A 12 19.243 -17.073 -0.087 1.00 0.00 H new ATOM 0 HG1 THR A 12 18.461 -16.880 1.848 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.289 -16.258 1.068 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.231 -15.752 -0.637 1.00 0.00 H new ATOM 0 HG23 THR A 12 20.839 -14.587 0.650 1.00 0.00 H new ATOM 165 N ALA A 13 17.041 -16.948 -1.604 1.00 0.00 N ATOM 166 CA ALA A 13 15.797 -17.623 -1.970 1.00 0.00 C ATOM 167 C ALA A 13 14.845 -17.851 -0.786 1.00 0.00 C ATOM 168 O ALA A 13 13.635 -17.940 -1.000 1.00 0.00 O ATOM 169 CB ALA A 13 16.143 -18.973 -2.602 1.00 0.00 C ATOM 0 H ALA A 13 17.873 -17.484 -1.850 1.00 0.00 H new ATOM 0 HA ALA A 13 15.272 -16.970 -2.668 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.225 -19.490 -2.881 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.754 -18.813 -3.490 1.00 0.00 H new ATOM 0 HB3 ALA A 13 16.697 -19.579 -1.885 1.00 0.00 H new ATOM 175 N ASN A 14 15.373 -17.954 0.442 1.00 0.00 N ATOM 176 CA ASN A 14 14.572 -18.187 1.654 1.00 0.00 C ATOM 177 C ASN A 14 14.553 -16.963 2.578 1.00 0.00 C ATOM 178 O ASN A 14 13.975 -16.999 3.666 1.00 0.00 O ATOM 179 CB ASN A 14 15.040 -19.454 2.385 1.00 0.00 C ATOM 180 CG ASN A 14 13.981 -19.938 3.378 1.00 0.00 C ATOM 181 OD1 ASN A 14 12.835 -20.183 3.011 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.329 -20.114 4.640 1.00 0.00 N ATOM 0 H ASN A 14 16.374 -17.878 0.624 1.00 0.00 H new ATOM 0 HA ASN A 14 13.541 -18.349 1.340 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.249 -20.240 1.660 1.00 0.00 H new ATOM 0 HB3 ASN A 14 15.972 -19.250 2.912 1.00 0.00 H new ATOM 0 HD21 ASN A 14 13.645 -20.455 5.315 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.282 -19.909 4.940 1.00 0.00 H new ATOM 189 N SER A 15 15.208 -15.879 2.168 1.00 0.00 N ATOM 190 CA SER A 15 15.079 -14.589 2.819 1.00 0.00 C ATOM 191 C SER A 15 13.805 -13.922 2.292 1.00 0.00 C ATOM 192 O SER A 15 13.255 -14.352 1.272 1.00 0.00 O ATOM 193 CB SER A 15 16.293 -13.742 2.467 1.00 0.00 C ATOM 194 OG SER A 15 17.449 -14.231 3.107 1.00 0.00 O ATOM 0 H SER A 15 15.844 -15.877 1.371 1.00 0.00 H new ATOM 0 HA SER A 15 15.021 -14.698 3.902 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.442 -13.744 1.387 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.118 -12.708 2.763 1.00 0.00 H new ATOM 0 HG SER A 15 18.052 -14.621 2.440 1.00 0.00 H new ATOM 200 N GLN A 16 13.345 -12.847 2.935 1.00 0.00 N ATOM 201 CA GLN A 16 12.214 -12.052 2.463 1.00 0.00 C ATOM 202 C GLN A 16 12.464 -10.581 2.781 1.00 0.00 C ATOM 203 O GLN A 16 13.102 -10.251 3.782 1.00 0.00 O ATOM 204 CB GLN A 16 10.899 -12.488 3.145 1.00 0.00 C ATOM 205 CG GLN A 16 10.370 -13.884 2.775 1.00 0.00 C ATOM 206 CD GLN A 16 9.791 -13.938 1.358 1.00 0.00 C ATOM 207 OE1 GLN A 16 8.603 -13.705 1.145 1.00 0.00 O ATOM 208 NE2 GLN A 16 10.603 -14.238 0.360 1.00 0.00 N ATOM 0 H GLN A 16 13.752 -12.502 3.805 1.00 0.00 H new ATOM 0 HA GLN A 16 12.118 -12.204 1.388 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.045 -12.453 4.225 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.129 -11.755 2.904 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.179 -14.610 2.861 1.00 0.00 H new ATOM 0 HG3 GLN A 16 9.601 -14.178 3.489 1.00 0.00 H new ATOM 0 HE21 GLN A 16 11.588 -14.430 0.544 1.00 0.00 H new ATOM 0 HE22 GLN A 16 10.245 -14.277 -0.594 1.00 0.00 H new ATOM 217 N CYS A 17 11.886 -9.713 1.951 1.00 0.00 N ATOM 218 CA CYS A 17 11.791 -8.280 2.156 1.00 0.00 C ATOM 219 C CYS A 17 10.333 -7.929 1.857 1.00 0.00 C ATOM 220 O CYS A 17 9.868 -8.209 0.750 1.00 0.00 O ATOM 221 CB CYS A 17 12.753 -7.537 1.227 1.00 0.00 C ATOM 222 SG CYS A 17 12.575 -5.733 1.289 1.00 0.00 S ATOM 0 H CYS A 17 11.452 -10.011 1.077 1.00 0.00 H new ATOM 0 HA CYS A 17 12.069 -7.988 3.169 1.00 0.00 H new ATOM 0 HB2 CYS A 17 13.777 -7.802 1.491 1.00 0.00 H new ATOM 0 HB3 CYS A 17 12.590 -7.875 0.204 1.00 0.00 H new ATOM 227 N VAL A 18 9.602 -7.368 2.824 1.00 0.00 N ATOM 228 CA VAL A 18 8.158 -7.150 2.712 1.00 0.00 C ATOM 229 C VAL A 18 7.849 -5.760 3.261 1.00 0.00 C ATOM 230 O VAL A 18 8.228 -5.451 4.392 1.00 0.00 O ATOM 231 CB VAL A 18 7.369 -8.250 3.464 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.865 -8.156 3.167 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.833 -9.674 3.110 1.00 0.00 C ATOM 0 H VAL A 18 9.997 -7.051 3.710 1.00 0.00 H new ATOM 0 HA VAL A 18 7.848 -7.208 1.669 1.00 0.00 H new ATOM 0 HB VAL A 18 7.565 -8.071 4.521 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.337 -8.941 3.709 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.492 -7.182 3.484 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.697 -8.278 2.097 1.00 0.00 H new ATOM 0 HG21 VAL A 18 7.242 -10.399 3.669 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.701 -9.845 2.042 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.886 -9.788 3.368 1.00 0.00 H new ATOM 243 N LYS A 19 7.171 -4.929 2.459 1.00 0.00 N ATOM 244 CA LYS A 19 6.881 -3.508 2.707 1.00 0.00 C ATOM 245 C LYS A 19 8.051 -2.763 3.367 1.00 0.00 C ATOM 246 O LYS A 19 7.837 -1.943 4.255 1.00 0.00 O ATOM 247 CB LYS A 19 5.519 -3.320 3.417 1.00 0.00 C ATOM 248 CG LYS A 19 5.415 -3.926 4.826 1.00 0.00 C ATOM 249 CD LYS A 19 4.019 -3.792 5.458 1.00 0.00 C ATOM 250 CE LYS A 19 3.527 -2.356 5.711 1.00 0.00 C ATOM 251 NZ LYS A 19 4.231 -1.659 6.818 1.00 0.00 N ATOM 0 H LYS A 19 6.788 -5.247 1.569 1.00 0.00 H new ATOM 0 HA LYS A 19 6.775 -3.024 1.736 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.309 -2.253 3.484 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.741 -3.760 2.793 1.00 0.00 H new ATOM 0 HG2 LYS A 19 5.682 -4.982 4.778 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.145 -3.442 5.474 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.299 -4.292 4.810 1.00 0.00 H new ATOM 0 HD3 LYS A 19 4.019 -4.327 6.408 1.00 0.00 H new ATOM 0 HE2 LYS A 19 3.647 -1.776 4.796 1.00 0.00 H new ATOM 0 HE3 LYS A 19 2.460 -2.383 5.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 3.621 -0.907 7.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 4.452 -2.340 7.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 5.114 -1.241 6.460 1.00 0.00 H new ATOM 265 N SER A 20 9.282 -3.073 2.961 1.00 0.00 N ATOM 266 CA SER A 20 10.515 -2.633 3.600 1.00 0.00 C ATOM 267 C SER A 20 11.494 -2.181 2.517 1.00 0.00 C ATOM 268 O SER A 20 11.316 -2.512 1.339 1.00 0.00 O ATOM 269 CB SER A 20 11.080 -3.789 4.436 1.00 0.00 C ATOM 270 OG SER A 20 10.217 -4.052 5.524 1.00 0.00 O ATOM 0 H SER A 20 9.451 -3.661 2.145 1.00 0.00 H new ATOM 0 HA SER A 20 10.335 -1.791 4.268 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.185 -4.681 3.818 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.075 -3.535 4.801 1.00 0.00 H new ATOM 0 HG SER A 20 9.570 -4.743 5.269 1.00 0.00 H new ATOM 276 N THR A 21 12.521 -1.431 2.906 1.00 0.00 N ATOM 277 CA THR A 21 13.444 -0.783 1.982 1.00 0.00 C ATOM 278 C THR A 21 14.836 -1.366 2.209 1.00 0.00 C ATOM 279 O THR A 21 15.244 -1.577 3.354 1.00 0.00 O ATOM 280 CB THR A 21 13.400 0.741 2.200 1.00 0.00 C ATOM 281 OG1 THR A 21 12.063 1.211 2.156 1.00 0.00 O ATOM 282 CG2 THR A 21 14.201 1.525 1.155 1.00 0.00 C ATOM 0 H THR A 21 12.738 -1.254 3.887 1.00 0.00 H new ATOM 0 HA THR A 21 13.163 -0.966 0.945 1.00 0.00 H new ATOM 0 HB THR A 21 13.849 0.909 3.179 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.052 2.181 2.298 1.00 0.00 H new ATOM 0 HG21 THR A 21 14.128 2.592 1.366 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.246 1.218 1.192 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.799 1.324 0.162 1.00 0.00 H new ATOM 290 N ALA A 22 15.570 -1.618 1.125 1.00 0.00 N ATOM 291 CA ALA A 22 16.875 -2.244 1.176 1.00 0.00 C ATOM 292 C ALA A 22 17.804 -1.498 0.229 1.00 0.00 C ATOM 293 O ALA A 22 17.616 -1.532 -0.990 1.00 0.00 O ATOM 294 CB ALA A 22 16.745 -3.737 0.842 1.00 0.00 C ATOM 0 H ALA A 22 15.264 -1.387 0.180 1.00 0.00 H new ATOM 0 HA ALA A 22 17.304 -2.187 2.176 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.728 -4.206 0.881 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.086 -4.216 1.566 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.328 -3.851 -0.159 1.00 0.00 H new ATOM 300 N THR A 23 18.796 -0.818 0.797 1.00 0.00 N ATOM 301 CA THR A 23 19.731 0.013 0.066 1.00 0.00 C ATOM 302 C THR A 23 21.086 -0.703 0.065 1.00 0.00 C ATOM 303 O THR A 23 21.857 -0.578 1.020 1.00 0.00 O ATOM 304 CB THR A 23 19.755 1.432 0.670 1.00 0.00 C ATOM 305 OG1 THR A 23 18.437 1.942 0.792 1.00 0.00 O ATOM 306 CG2 THR A 23 20.572 2.406 -0.183 1.00 0.00 C ATOM 0 H THR A 23 18.971 -0.834 1.802 1.00 0.00 H new ATOM 0 HA THR A 23 19.436 0.153 -0.974 1.00 0.00 H new ATOM 0 HB THR A 23 20.222 1.346 1.651 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.469 2.842 1.178 1.00 0.00 H new ATOM 0 HG21 THR A 23 20.561 3.393 0.280 1.00 0.00 H new ATOM 0 HG22 THR A 23 21.600 2.051 -0.257 1.00 0.00 H new ATOM 0 HG23 THR A 23 20.137 2.469 -1.181 1.00 0.00 H new ATOM 314 N ASN A 24 21.362 -1.465 -1.002 1.00 0.00 N ATOM 315 CA ASN A 24 22.570 -2.276 -1.197 1.00 0.00 C ATOM 316 C ASN A 24 22.947 -3.084 0.060 1.00 0.00 C ATOM 317 O ASN A 24 24.040 -2.928 0.609 1.00 0.00 O ATOM 318 CB ASN A 24 23.710 -1.401 -1.750 1.00 0.00 C ATOM 319 CG ASN A 24 24.804 -2.230 -2.419 1.00 0.00 C ATOM 320 OD1 ASN A 24 24.910 -2.252 -3.642 1.00 0.00 O ATOM 321 ND2 ASN A 24 25.629 -2.929 -1.662 1.00 0.00 N ATOM 0 H ASN A 24 20.718 -1.536 -1.790 1.00 0.00 H new ATOM 0 HA ASN A 24 22.363 -3.037 -1.949 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.303 -0.691 -2.470 1.00 0.00 H new ATOM 0 HB3 ASN A 24 24.144 -0.818 -0.938 1.00 0.00 H new ATOM 0 HD21 ASN A 24 26.362 -3.493 -2.092 1.00 0.00 H new ATOM 0 HD22 ASN A 24 25.534 -2.905 -0.647 1.00 0.00 H new ATOM 328 N CYS A 25 22.030 -3.924 0.543 1.00 0.00 N ATOM 329 CA CYS A 25 22.207 -4.756 1.729 1.00 0.00 C ATOM 330 C CYS A 25 22.515 -6.195 1.305 1.00 0.00 C ATOM 331 O CYS A 25 22.396 -6.553 0.130 1.00 0.00 O ATOM 332 CB CYS A 25 20.931 -4.727 2.592 1.00 0.00 C ATOM 333 SG CYS A 25 20.240 -3.088 2.943 1.00 0.00 S ATOM 0 H CYS A 25 21.117 -4.046 0.105 1.00 0.00 H new ATOM 0 HA CYS A 25 23.038 -4.366 2.317 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.166 -5.322 2.093 1.00 0.00 H new ATOM 0 HB3 CYS A 25 21.148 -5.218 3.541 1.00 0.00 H new ATOM 338 N TYR A 26 22.831 -7.041 2.280 1.00 0.00 N ATOM 339 CA TYR A 26 23.029 -8.472 2.124 1.00 0.00 C ATOM 340 C TYR A 26 22.074 -9.131 3.110 1.00 0.00 C ATOM 341 O TYR A 26 22.086 -8.785 4.293 1.00 0.00 O ATOM 342 CB TYR A 26 24.504 -8.789 2.426 1.00 0.00 C ATOM 343 CG TYR A 26 24.898 -10.257 2.458 1.00 0.00 C ATOM 344 CD1 TYR A 26 24.499 -11.087 3.526 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.754 -10.774 1.467 1.00 0.00 C ATOM 346 CE1 TYR A 26 24.954 -12.412 3.606 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.189 -12.111 1.525 1.00 0.00 C ATOM 348 CZ TYR A 26 25.790 -12.940 2.599 1.00 0.00 C ATOM 349 OH TYR A 26 26.214 -14.232 2.683 1.00 0.00 O ATOM 0 H TYR A 26 22.961 -6.731 3.243 1.00 0.00 H new ATOM 0 HA TYR A 26 22.823 -8.838 1.118 1.00 0.00 H new ATOM 0 HB2 TYR A 26 25.119 -8.289 1.678 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.755 -8.349 3.391 1.00 0.00 H new ATOM 0 HD1 TYR A 26 23.838 -10.700 4.288 1.00 0.00 H new ATOM 0 HD2 TYR A 26 26.079 -10.139 0.656 1.00 0.00 H new ATOM 0 HE1 TYR A 26 24.663 -13.031 4.442 1.00 0.00 H new ATOM 0 HE2 TYR A 26 26.828 -12.504 0.748 1.00 0.00 H new ATOM 0 HH TYR A 26 26.781 -14.441 1.911 1.00 0.00 H new ATOM 359 N ILE A 27 21.246 -10.057 2.636 1.00 0.00 N ATOM 360 CA ILE A 27 20.185 -10.679 3.411 1.00 0.00 C ATOM 361 C ILE A 27 20.276 -12.174 3.097 1.00 0.00 C ATOM 362 O ILE A 27 19.939 -12.590 1.986 1.00 0.00 O ATOM 363 CB ILE A 27 18.819 -10.039 3.041 1.00 0.00 C ATOM 364 CG1 ILE A 27 18.834 -8.497 3.191 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.689 -10.658 3.871 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.481 -7.798 3.017 1.00 0.00 C ATOM 0 H ILE A 27 21.298 -10.402 1.678 1.00 0.00 H new ATOM 0 HA ILE A 27 20.284 -10.528 4.486 1.00 0.00 H new ATOM 0 HB ILE A 27 18.637 -10.254 1.988 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.225 -8.250 4.178 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.531 -8.086 2.460 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.741 -10.196 3.597 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.640 -11.729 3.677 1.00 0.00 H new ATOM 0 HG23 ILE A 27 17.881 -10.489 4.931 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.608 -6.723 3.142 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.091 -8.003 2.020 1.00 0.00 H new ATOM 0 HD13 ILE A 27 16.780 -8.170 3.765 1.00 0.00 H new ATOM 378 N ASP A 28 20.766 -12.965 4.055 1.00 0.00 N ATOM 379 CA ASP A 28 20.941 -14.412 3.939 1.00 0.00 C ATOM 380 C ASP A 28 20.096 -15.084 5.010 1.00 0.00 C ATOM 381 O ASP A 28 20.225 -14.759 6.189 1.00 0.00 O ATOM 382 CB ASP A 28 22.412 -14.790 4.127 1.00 0.00 C ATOM 383 CG ASP A 28 22.585 -16.301 4.365 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.238 -17.102 3.471 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.097 -16.694 5.437 1.00 0.00 O ATOM 0 H ASP A 28 21.061 -12.602 4.962 1.00 0.00 H new ATOM 0 HA ASP A 28 20.628 -14.741 2.948 1.00 0.00 H new ATOM 0 HB2 ASP A 28 22.980 -14.493 3.245 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.824 -14.239 4.972 1.00 0.00 H new ATOM 390 N ASN A 29 19.224 -16.001 4.594 1.00 0.00 N ATOM 391 CA ASN A 29 18.160 -16.637 5.379 1.00 0.00 C ATOM 392 C ASN A 29 17.438 -15.679 6.346 1.00 0.00 C ATOM 393 O ASN A 29 16.977 -16.103 7.408 1.00 0.00 O ATOM 394 CB ASN A 29 18.699 -17.893 6.093 1.00 0.00 C ATOM 395 CG ASN A 29 17.563 -18.863 6.411 1.00 0.00 C ATOM 396 OD1 ASN A 29 16.883 -19.326 5.501 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.321 -19.225 7.659 1.00 0.00 N ATOM 0 H ASN A 29 19.241 -16.345 3.634 1.00 0.00 H new ATOM 0 HA ASN A 29 17.389 -16.943 4.672 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.439 -18.386 5.463 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.206 -17.604 7.014 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.572 -19.887 7.862 1.00 0.00 H new ATOM 0 HD22 ASN A 29 17.884 -18.843 8.419 1.00 0.00 H new ATOM 404 N SER A 30 17.340 -14.391 6.007 1.00 0.00 N ATOM 405 CA SER A 30 16.887 -13.347 6.917 1.00 0.00 C ATOM 406 C SER A 30 15.607 -12.693 6.419 1.00 0.00 C ATOM 407 O SER A 30 15.304 -12.690 5.225 1.00 0.00 O ATOM 408 CB SER A 30 18.000 -12.317 7.123 1.00 0.00 C ATOM 409 OG SER A 30 19.115 -12.904 7.755 1.00 0.00 O ATOM 0 H SER A 30 17.578 -14.044 5.078 1.00 0.00 H new ATOM 0 HA SER A 30 16.655 -13.802 7.880 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.299 -11.901 6.161 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.628 -11.489 7.727 1.00 0.00 H new ATOM 0 HG SER A 30 19.644 -13.397 7.094 1.00 0.00 H new ATOM 415 N GLN A 31 14.843 -12.130 7.350 1.00 0.00 N ATOM 416 CA GLN A 31 13.493 -11.658 7.100 1.00 0.00 C ATOM 417 C GLN A 31 13.438 -10.184 7.506 1.00 0.00 C ATOM 418 O GLN A 31 13.698 -9.850 8.665 1.00 0.00 O ATOM 419 CB GLN A 31 12.487 -12.537 7.874 1.00 0.00 C ATOM 420 CG GLN A 31 12.770 -14.059 7.872 1.00 0.00 C ATOM 421 CD GLN A 31 12.865 -14.701 6.481 1.00 0.00 C ATOM 422 OE1 GLN A 31 12.070 -14.415 5.593 1.00 0.00 O ATOM 423 NE2 GLN A 31 13.816 -15.599 6.257 1.00 0.00 N ATOM 0 H GLN A 31 15.152 -11.989 8.312 1.00 0.00 H new ATOM 0 HA GLN A 31 13.221 -11.735 6.047 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.458 -12.195 8.909 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.494 -12.372 7.455 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.704 -14.240 8.403 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.982 -14.560 8.434 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.477 -15.837 6.996 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.886 -16.052 5.346 1.00 0.00 H new ATOM 432 N LEU A 32 13.139 -9.312 6.544 1.00 0.00 N ATOM 433 CA LEU A 32 13.153 -7.857 6.675 1.00 0.00 C ATOM 434 C LEU A 32 11.725 -7.400 6.396 1.00 0.00 C ATOM 435 O LEU A 32 11.316 -7.377 5.233 1.00 0.00 O ATOM 436 CB LEU A 32 14.176 -7.296 5.662 1.00 0.00 C ATOM 437 CG LEU A 32 14.321 -5.762 5.676 1.00 0.00 C ATOM 438 CD1 LEU A 32 15.135 -5.294 6.887 1.00 0.00 C ATOM 439 CD2 LEU A 32 15.025 -5.262 4.411 1.00 0.00 C ATOM 0 H LEU A 32 12.868 -9.616 5.609 1.00 0.00 H new ATOM 0 HA LEU A 32 13.454 -7.503 7.661 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.150 -7.741 5.865 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.885 -7.611 4.660 1.00 0.00 H new ATOM 0 HG LEU A 32 13.312 -5.353 5.726 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.221 -4.207 6.870 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.634 -5.604 7.804 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.130 -5.737 6.850 1.00 0.00 H new ATOM 0 HD21 LEU A 32 15.113 -4.176 4.449 1.00 0.00 H new ATOM 0 HD22 LEU A 32 16.019 -5.705 4.349 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.444 -5.549 3.534 1.00 0.00 H new ATOM 451 N VAL A 33 10.941 -7.083 7.428 1.00 0.00 N ATOM 452 CA VAL A 33 9.507 -6.868 7.244 1.00 0.00 C ATOM 453 C VAL A 33 9.001 -5.596 7.927 1.00 0.00 C ATOM 454 O VAL A 33 9.661 -5.031 8.804 1.00 0.00 O ATOM 455 CB VAL A 33 8.721 -8.136 7.667 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.158 -9.384 6.879 1.00 0.00 C ATOM 457 CG2 VAL A 33 8.820 -8.461 9.165 1.00 0.00 C ATOM 0 H VAL A 33 11.270 -6.971 8.387 1.00 0.00 H new ATOM 0 HA VAL A 33 9.327 -6.700 6.182 1.00 0.00 H new ATOM 0 HB VAL A 33 7.685 -7.888 7.436 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.579 -10.245 7.211 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.987 -9.221 5.815 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.218 -9.571 7.052 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.244 -9.361 9.381 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.864 -8.625 9.434 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.423 -7.628 9.745 1.00 0.00 H new ATOM 467 N ASP A 34 7.787 -5.197 7.541 1.00 0.00 N ATOM 468 CA ASP A 34 6.985 -4.143 8.157 1.00 0.00 C ATOM 469 C ASP A 34 7.735 -2.816 8.286 1.00 0.00 C ATOM 470 O ASP A 34 8.060 -2.383 9.385 1.00 0.00 O ATOM 471 CB ASP A 34 6.367 -4.624 9.474 1.00 0.00 C ATOM 472 CG ASP A 34 5.405 -3.577 10.054 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.689 -2.912 9.267 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.320 -3.486 11.300 1.00 0.00 O ATOM 0 H ASP A 34 7.313 -5.626 6.746 1.00 0.00 H new ATOM 0 HA ASP A 34 6.160 -3.925 7.479 1.00 0.00 H new ATOM 0 HB2 ASP A 34 5.833 -5.559 9.307 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.158 -4.833 10.194 1.00 0.00 H new ATOM 479 N THR A 35 8.028 -2.167 7.158 1.00 0.00 N ATOM 480 CA THR A 35 8.756 -0.917 7.078 1.00 0.00 C ATOM 481 C THR A 35 10.110 -0.931 7.799 1.00 0.00 C ATOM 482 O THR A 35 10.500 0.036 8.462 1.00 0.00 O ATOM 483 CB THR A 35 7.838 0.269 7.401 1.00 0.00 C ATOM 484 OG1 THR A 35 6.501 0.044 6.964 1.00 0.00 O ATOM 485 CG2 THR A 35 8.355 1.516 6.676 1.00 0.00 C ATOM 0 H THR A 35 7.749 -2.519 6.242 1.00 0.00 H new ATOM 0 HA THR A 35 9.063 -0.778 6.042 1.00 0.00 H new ATOM 0 HB THR A 35 7.841 0.397 8.483 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.948 0.821 7.190 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.707 2.363 6.901 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.369 1.736 7.009 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.357 1.337 5.601 1.00 0.00 H new ATOM 493 N SER A 36 10.826 -2.051 7.709 1.00 0.00 N ATOM 494 CA SER A 36 12.213 -2.074 8.114 1.00 0.00 C ATOM 495 C SER A 36 12.973 -1.396 6.973 1.00 0.00 C ATOM 496 O SER A 36 12.515 -1.358 5.824 1.00 0.00 O ATOM 497 CB SER A 36 12.710 -3.499 8.320 1.00 0.00 C ATOM 498 OG SER A 36 12.078 -4.091 9.429 1.00 0.00 O ATOM 0 H SER A 36 10.466 -2.940 7.362 1.00 0.00 H new ATOM 0 HA SER A 36 12.359 -1.565 9.067 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.515 -4.090 7.425 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.790 -3.495 8.470 1.00 0.00 H new ATOM 0 HG SER A 36 11.123 -4.205 9.239 1.00 0.00 H new ATOM 504 N ILE A 37 14.133 -0.836 7.277 1.00 0.00 N ATOM 505 CA ILE A 37 14.926 -0.079 6.327 1.00 0.00 C ATOM 506 C ILE A 37 16.380 -0.471 6.603 1.00 0.00 C ATOM 507 O ILE A 37 16.814 -0.417 7.756 1.00 0.00 O ATOM 508 CB ILE A 37 14.633 1.440 6.487 1.00 0.00 C ATOM 509 CG1 ILE A 37 13.156 1.779 6.164 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.596 2.277 5.620 1.00 0.00 C ATOM 511 CD1 ILE A 37 12.788 3.263 6.290 1.00 0.00 C ATOM 0 H ILE A 37 14.554 -0.897 8.204 1.00 0.00 H new ATOM 0 HA ILE A 37 14.688 -0.300 5.286 1.00 0.00 H new ATOM 0 HB ILE A 37 14.801 1.698 7.533 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.938 1.451 5.148 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.513 1.203 6.830 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.373 3.336 5.747 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.624 2.083 5.927 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.473 2.004 4.572 1.00 0.00 H new ATOM 0 HD11 ILE A 37 11.735 3.399 6.044 1.00 0.00 H new ATOM 0 HD12 ILE A 37 12.968 3.597 7.312 1.00 0.00 H new ATOM 0 HD13 ILE A 37 13.399 3.849 5.604 1.00 0.00 H new ATOM 523 N CYS A 38 17.142 -0.848 5.575 1.00 0.00 N ATOM 524 CA CYS A 38 18.558 -1.156 5.718 1.00 0.00 C ATOM 525 C CYS A 38 19.360 -0.381 4.682 1.00 0.00 C ATOM 526 O CYS A 38 18.871 -0.126 3.576 1.00 0.00 O ATOM 527 CB CYS A 38 18.804 -2.670 5.640 1.00 0.00 C ATOM 528 SG CYS A 38 18.556 -3.480 4.035 1.00 0.00 S ATOM 0 H CYS A 38 16.791 -0.947 4.622 1.00 0.00 H new ATOM 0 HA CYS A 38 18.897 -0.841 6.705 1.00 0.00 H new ATOM 0 HB2 CYS A 38 19.829 -2.861 5.958 1.00 0.00 H new ATOM 0 HB3 CYS A 38 18.150 -3.154 6.365 1.00 0.00 H new ATOM 533 N THR A 39 20.601 -0.051 5.032 1.00 0.00 N ATOM 534 CA THR A 39 21.551 0.631 4.176 1.00 0.00 C ATOM 535 C THR A 39 22.910 -0.005 4.437 1.00 0.00 C ATOM 536 O THR A 39 23.370 -0.032 5.582 1.00 0.00 O ATOM 537 CB THR A 39 21.551 2.142 4.487 1.00 0.00 C ATOM 538 OG1 THR A 39 20.246 2.684 4.413 1.00 0.00 O ATOM 539 CG2 THR A 39 22.437 2.927 3.512 1.00 0.00 C ATOM 0 H THR A 39 20.980 -0.262 5.955 1.00 0.00 H new ATOM 0 HA THR A 39 21.292 0.531 3.122 1.00 0.00 H new ATOM 0 HB THR A 39 21.943 2.238 5.499 1.00 0.00 H new ATOM 0 HG1 THR A 39 20.278 3.642 4.616 1.00 0.00 H new ATOM 0 HG21 THR A 39 22.408 3.986 3.767 1.00 0.00 H new ATOM 0 HG22 THR A 39 23.463 2.565 3.580 1.00 0.00 H new ATOM 0 HG23 THR A 39 22.070 2.788 2.495 1.00 0.00 H new ATOM 547 N ARG A 40 23.535 -0.528 3.379 1.00 0.00 N ATOM 548 CA ARG A 40 24.884 -1.107 3.363 1.00 0.00 C ATOM 549 C ARG A 40 25.150 -2.031 4.561 1.00 0.00 C ATOM 550 O ARG A 40 26.210 -1.962 5.183 1.00 0.00 O ATOM 551 CB ARG A 40 25.929 0.017 3.150 1.00 0.00 C ATOM 552 CG ARG A 40 27.052 -0.351 2.162 1.00 0.00 C ATOM 553 CD ARG A 40 27.903 -1.573 2.539 1.00 0.00 C ATOM 554 NE ARG A 40 28.635 -1.371 3.802 1.00 0.00 N ATOM 555 CZ ARG A 40 29.923 -1.032 3.939 1.00 0.00 C ATOM 556 NH1 ARG A 40 30.693 -0.814 2.874 1.00 0.00 N ATOM 557 NH2 ARG A 40 30.444 -0.912 5.154 1.00 0.00 N ATOM 0 H ARG A 40 23.091 -0.561 2.461 1.00 0.00 H new ATOM 0 HA ARG A 40 24.977 -1.782 2.512 1.00 0.00 H new ATOM 0 HB2 ARG A 40 25.419 0.910 2.788 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.374 0.272 4.112 1.00 0.00 H new ATOM 0 HG2 ARG A 40 26.605 -0.531 1.184 1.00 0.00 H new ATOM 0 HG3 ARG A 40 27.713 0.509 2.056 1.00 0.00 H new ATOM 0 HD2 ARG A 40 27.260 -2.448 2.630 1.00 0.00 H new ATOM 0 HD3 ARG A 40 28.613 -1.781 1.738 1.00 0.00 H new ATOM 0 HE ARG A 40 28.104 -1.503 4.663 1.00 0.00 H new ATOM 0 HH11 ARG A 40 30.303 -0.905 1.936 1.00 0.00 H new ATOM 0 HH12 ARG A 40 31.672 -0.556 2.997 1.00 0.00 H new ATOM 0 HH21 ARG A 40 29.864 -1.078 5.976 1.00 0.00 H new ATOM 0 HH22 ARG A 40 31.425 -0.654 5.265 1.00 0.00 H new ATOM 571 N SER A 41 24.176 -2.876 4.901 1.00 0.00 N ATOM 572 CA SER A 41 24.214 -3.729 6.084 1.00 0.00 C ATOM 573 C SER A 41 24.060 -5.195 5.693 1.00 0.00 C ATOM 574 O SER A 41 23.628 -5.517 4.583 1.00 0.00 O ATOM 575 CB SER A 41 23.109 -3.302 7.051 1.00 0.00 C ATOM 576 OG SER A 41 23.344 -1.978 7.489 1.00 0.00 O ATOM 0 H SER A 41 23.324 -2.987 4.351 1.00 0.00 H new ATOM 0 HA SER A 41 25.179 -3.618 6.578 1.00 0.00 H new ATOM 0 HB2 SER A 41 22.138 -3.366 6.560 1.00 0.00 H new ATOM 0 HB3 SER A 41 23.079 -3.978 7.906 1.00 0.00 H new ATOM 0 HG SER A 41 23.300 -1.368 6.724 1.00 0.00 H new ATOM 582 N GLN A 42 24.398 -6.075 6.629 1.00 0.00 N ATOM 583 CA GLN A 42 24.437 -7.516 6.457 1.00 0.00 C ATOM 584 C GLN A 42 23.515 -8.147 7.495 1.00 0.00 C ATOM 585 O GLN A 42 23.603 -7.815 8.678 1.00 0.00 O ATOM 586 CB GLN A 42 25.890 -7.986 6.614 1.00 0.00 C ATOM 587 CG GLN A 42 26.035 -9.513 6.537 1.00 0.00 C ATOM 588 CD GLN A 42 27.386 -9.898 5.940 1.00 0.00 C ATOM 589 OE1 GLN A 42 28.433 -9.757 6.566 1.00 0.00 O ATOM 590 NE2 GLN A 42 27.396 -10.348 4.695 1.00 0.00 N ATOM 0 H GLN A 42 24.664 -5.786 7.570 1.00 0.00 H new ATOM 0 HA GLN A 42 24.091 -7.815 5.468 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.501 -7.528 5.836 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.278 -7.637 7.571 1.00 0.00 H new ATOM 0 HG2 GLN A 42 25.937 -9.943 7.534 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.232 -9.929 5.929 1.00 0.00 H new ATOM 0 HE21 GLN A 42 26.519 -10.460 4.186 1.00 0.00 H new ATOM 0 HE22 GLN A 42 28.281 -10.582 4.244 1.00 0.00 H new ATOM 599 N TYR A 43 22.686 -9.089 7.055 1.00 0.00 N ATOM 600 CA TYR A 43 21.832 -9.904 7.897 1.00 0.00 C ATOM 601 C TYR A 43 22.078 -11.361 7.530 1.00 0.00 C ATOM 602 O TYR A 43 22.112 -11.697 6.341 1.00 0.00 O ATOM 603 CB TYR A 43 20.357 -9.570 7.672 1.00 0.00 C ATOM 604 CG TYR A 43 19.974 -8.132 7.934 1.00 0.00 C ATOM 605 CD1 TYR A 43 19.551 -7.735 9.215 1.00 0.00 C ATOM 606 CD2 TYR A 43 19.990 -7.204 6.877 1.00 0.00 C ATOM 607 CE1 TYR A 43 19.096 -6.424 9.429 1.00 0.00 C ATOM 608 CE2 TYR A 43 19.506 -5.902 7.077 1.00 0.00 C ATOM 609 CZ TYR A 43 19.030 -5.515 8.349 1.00 0.00 C ATOM 610 OH TYR A 43 18.480 -4.284 8.521 1.00 0.00 O ATOM 0 H TYR A 43 22.591 -9.310 6.064 1.00 0.00 H new ATOM 0 HA TYR A 43 22.064 -9.713 8.945 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.099 -9.816 6.642 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.754 -10.212 8.314 1.00 0.00 H new ATOM 0 HD1 TYR A 43 19.576 -8.438 10.034 1.00 0.00 H new ATOM 0 HD2 TYR A 43 20.375 -7.494 5.911 1.00 0.00 H new ATOM 0 HE1 TYR A 43 18.797 -6.111 10.418 1.00 0.00 H new ATOM 0 HE2 TYR A 43 19.498 -5.197 6.259 1.00 0.00 H new ATOM 0 HH TYR A 43 18.398 -4.093 9.479 1.00 0.00 H new ATOM 620 N SER A 44 22.213 -12.206 8.547 1.00 0.00 N ATOM 621 CA SER A 44 22.471 -13.622 8.406 1.00 0.00 C ATOM 622 C SER A 44 21.599 -14.356 9.426 1.00 0.00 C ATOM 623 O SER A 44 21.746 -14.161 10.634 1.00 0.00 O ATOM 624 CB SER A 44 23.964 -13.897 8.634 1.00 0.00 C ATOM 625 OG SER A 44 24.777 -13.163 7.726 1.00 0.00 O ATOM 0 H SER A 44 22.142 -11.908 9.520 1.00 0.00 H new ATOM 0 HA SER A 44 22.225 -13.973 7.404 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.231 -13.633 9.657 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.160 -14.963 8.518 1.00 0.00 H new ATOM 0 HG SER A 44 25.721 -13.360 7.900 1.00 0.00 H new ATOM 631 N ASP A 45 20.694 -15.202 8.931 1.00 0.00 N ATOM 632 CA ASP A 45 19.728 -15.994 9.691 1.00 0.00 C ATOM 633 C ASP A 45 18.996 -15.191 10.784 1.00 0.00 C ATOM 634 O ASP A 45 18.834 -15.657 11.913 1.00 0.00 O ATOM 635 CB ASP A 45 20.422 -17.267 10.199 1.00 0.00 C ATOM 636 CG ASP A 45 19.430 -18.296 10.758 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.355 -18.489 10.148 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.777 -18.986 11.744 1.00 0.00 O ATOM 0 H ASP A 45 20.612 -15.362 7.927 1.00 0.00 H new ATOM 0 HA ASP A 45 18.916 -16.292 9.028 1.00 0.00 H new ATOM 0 HB2 ASP A 45 20.987 -17.718 9.384 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.139 -17.000 10.975 1.00 0.00 H new ATOM 643 N ALA A 46 18.577 -13.958 10.464 1.00 0.00 N ATOM 644 CA ALA A 46 18.059 -12.973 11.414 1.00 0.00 C ATOM 645 C ALA A 46 16.644 -12.504 11.047 1.00 0.00 C ATOM 646 O ALA A 46 16.183 -12.700 9.921 1.00 0.00 O ATOM 647 CB ALA A 46 19.033 -11.787 11.449 1.00 0.00 C ATOM 0 H ALA A 46 18.591 -13.612 9.505 1.00 0.00 H new ATOM 0 HA ALA A 46 17.983 -13.434 12.399 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.668 -11.037 12.151 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.017 -12.133 11.766 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.106 -11.347 10.454 1.00 0.00 H new ATOM 653 N ASN A 47 15.959 -11.833 11.979 1.00 0.00 N ATOM 654 CA ASN A 47 14.620 -11.274 11.763 1.00 0.00 C ATOM 655 C ASN A 47 14.610 -9.807 12.162 1.00 0.00 C ATOM 656 O ASN A 47 15.242 -9.426 13.147 1.00 0.00 O ATOM 657 CB ASN A 47 13.563 -12.023 12.585 1.00 0.00 C ATOM 658 CG ASN A 47 12.167 -11.427 12.397 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.743 -11.164 11.278 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.424 -11.189 13.466 1.00 0.00 N ATOM 0 H ASN A 47 16.323 -11.661 12.916 1.00 0.00 H new ATOM 0 HA ASN A 47 14.377 -11.381 10.706 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.552 -13.073 12.292 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.833 -11.989 13.640 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.493 -10.785 13.361 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.782 -11.410 14.395 1.00 0.00 H new ATOM 667 N VAL A 48 13.885 -8.997 11.404 1.00 0.00 N ATOM 668 CA VAL A 48 13.899 -7.547 11.498 1.00 0.00 C ATOM 669 C VAL A 48 12.471 -7.053 11.274 1.00 0.00 C ATOM 670 O VAL A 48 11.846 -7.430 10.277 1.00 0.00 O ATOM 671 CB VAL A 48 14.850 -6.955 10.436 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.188 -5.492 10.755 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.164 -7.725 10.236 1.00 0.00 C ATOM 0 H VAL A 48 13.251 -9.344 10.684 1.00 0.00 H new ATOM 0 HA VAL A 48 14.257 -7.230 12.478 1.00 0.00 H new ATOM 0 HB VAL A 48 14.291 -7.038 9.504 1.00 0.00 H new ATOM 0 HG11 VAL A 48 15.859 -5.099 9.992 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.272 -4.902 10.771 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.673 -5.435 11.729 1.00 0.00 H new ATOM 0 HG21 VAL A 48 16.762 -7.231 9.471 1.00 0.00 H new ATOM 0 HG22 VAL A 48 16.720 -7.746 11.174 1.00 0.00 H new ATOM 0 HG23 VAL A 48 15.944 -8.745 9.922 1.00 0.00 H new ATOM 683 N LYS A 49 11.965 -6.199 12.169 1.00 0.00 N ATOM 684 CA LYS A 49 10.625 -5.626 12.053 1.00 0.00 C ATOM 685 C LYS A 49 10.710 -4.140 12.354 1.00 0.00 C ATOM 686 O LYS A 49 11.244 -3.766 13.401 1.00 0.00 O ATOM 687 CB LYS A 49 9.662 -6.338 13.015 1.00 0.00 C ATOM 688 CG LYS A 49 8.190 -5.985 12.737 1.00 0.00 C ATOM 689 CD LYS A 49 7.259 -6.655 13.758 1.00 0.00 C ATOM 690 CE LYS A 49 5.765 -6.510 13.418 1.00 0.00 C ATOM 691 NZ LYS A 49 5.253 -5.120 13.530 1.00 0.00 N ATOM 0 H LYS A 49 12.476 -5.887 12.995 1.00 0.00 H new ATOM 0 HA LYS A 49 10.239 -5.764 11.043 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.797 -7.416 12.929 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.911 -6.067 14.041 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.059 -4.904 12.775 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.920 -6.304 11.730 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.507 -7.714 13.823 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.443 -6.224 14.742 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.598 -6.867 12.402 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.188 -7.154 14.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.216 -5.137 13.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.656 -4.669 14.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.528 -4.579 12.685 1.00 0.00 H new ATOM 705 N LYS A 50 10.160 -3.310 11.467 1.00 0.00 N ATOM 706 CA LYS A 50 10.105 -1.850 11.548 1.00 0.00 C ATOM 707 C LYS A 50 11.373 -1.209 12.125 1.00 0.00 C ATOM 708 O LYS A 50 11.282 -0.313 12.964 1.00 0.00 O ATOM 709 CB LYS A 50 8.807 -1.458 12.287 1.00 0.00 C ATOM 710 CG LYS A 50 8.319 -0.037 11.964 1.00 0.00 C ATOM 711 CD LYS A 50 6.992 0.244 12.683 1.00 0.00 C ATOM 712 CE LYS A 50 6.548 1.689 12.425 1.00 0.00 C ATOM 713 NZ LYS A 50 5.246 2.003 13.067 1.00 0.00 N ATOM 0 H LYS A 50 9.713 -3.661 10.620 1.00 0.00 H new ATOM 0 HA LYS A 50 10.075 -1.439 10.539 1.00 0.00 H new ATOM 0 HB2 LYS A 50 8.023 -2.170 12.029 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.971 -1.541 13.361 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.069 0.692 12.272 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.189 0.075 10.888 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.226 -0.448 12.333 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.107 0.077 13.754 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.309 2.373 12.800 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.470 1.856 11.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.988 2.990 12.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.512 1.369 12.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.325 1.870 14.095 1.00 0.00 H new ATOM 727 N SER A 51 12.556 -1.668 11.715 1.00 0.00 N ATOM 728 CA SER A 51 13.818 -1.222 12.296 1.00 0.00 C ATOM 729 C SER A 51 14.676 -0.586 11.211 1.00 0.00 C ATOM 730 O SER A 51 14.524 -0.923 10.038 1.00 0.00 O ATOM 731 CB SER A 51 14.516 -2.410 12.957 1.00 0.00 C ATOM 732 OG SER A 51 13.723 -2.900 14.025 1.00 0.00 O ATOM 0 H SER A 51 12.664 -2.358 10.972 1.00 0.00 H new ATOM 0 HA SER A 51 13.642 -0.469 13.064 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.683 -3.199 12.224 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.495 -2.108 13.328 1.00 0.00 H new ATOM 0 HG SER A 51 12.977 -3.424 13.665 1.00 0.00 H new ATOM 738 N VAL A 52 15.566 0.330 11.587 1.00 0.00 N ATOM 739 CA VAL A 52 16.317 1.168 10.659 1.00 0.00 C ATOM 740 C VAL A 52 17.793 0.900 10.940 1.00 0.00 C ATOM 741 O VAL A 52 18.261 1.126 12.055 1.00 0.00 O ATOM 742 CB VAL A 52 15.913 2.649 10.825 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.626 3.531 9.788 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.395 2.849 10.670 1.00 0.00 C ATOM 0 H VAL A 52 15.789 0.513 12.565 1.00 0.00 H new ATOM 0 HA VAL A 52 16.103 0.933 9.616 1.00 0.00 H new ATOM 0 HB VAL A 52 16.211 2.940 11.832 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.325 4.570 9.925 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.705 3.446 9.918 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.354 3.204 8.784 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.153 3.904 10.794 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.084 2.519 9.679 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.872 2.265 11.427 1.00 0.00 H new ATOM 754 N THR A 53 18.532 0.400 9.956 1.00 0.00 N ATOM 755 CA THR A 53 19.863 -0.106 10.143 1.00 0.00 C ATOM 756 C THR A 53 20.766 0.518 9.072 1.00 0.00 C ATOM 757 O THR A 53 20.410 0.554 7.891 1.00 0.00 O ATOM 758 CB THR A 53 19.675 -1.630 10.068 1.00 0.00 C ATOM 759 OG1 THR A 53 19.399 -2.173 11.345 1.00 0.00 O ATOM 760 CG2 THR A 53 20.845 -2.339 9.430 1.00 0.00 C ATOM 0 H THR A 53 18.205 0.339 8.992 1.00 0.00 H new ATOM 0 HA THR A 53 20.356 0.143 11.083 1.00 0.00 H new ATOM 0 HB THR A 53 18.815 -1.799 9.420 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.282 -3.143 11.270 1.00 0.00 H new ATOM 0 HG21 THR A 53 20.652 -3.411 9.407 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.982 -1.973 8.413 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.748 -2.146 10.010 1.00 0.00 H new ATOM 768 N THR A 54 21.938 0.998 9.484 1.00 0.00 N ATOM 769 CA THR A 54 22.925 1.622 8.619 1.00 0.00 C ATOM 770 C THR A 54 24.295 1.068 9.013 1.00 0.00 C ATOM 771 O THR A 54 24.713 1.205 10.166 1.00 0.00 O ATOM 772 CB THR A 54 22.856 3.155 8.769 1.00 0.00 C ATOM 773 OG1 THR A 54 21.534 3.632 8.578 1.00 0.00 O ATOM 774 CG2 THR A 54 23.760 3.870 7.758 1.00 0.00 C ATOM 0 H THR A 54 22.231 0.960 10.460 1.00 0.00 H new ATOM 0 HA THR A 54 22.735 1.398 7.569 1.00 0.00 H new ATOM 0 HB THR A 54 23.194 3.373 9.782 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.520 4.607 8.680 1.00 0.00 H new ATOM 0 HG21 THR A 54 23.681 4.948 7.898 1.00 0.00 H new ATOM 0 HG22 THR A 54 24.793 3.559 7.910 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.449 3.612 6.746 1.00 0.00 H new ATOM 782 N ASP A 55 24.986 0.471 8.041 1.00 0.00 N ATOM 783 CA ASP A 55 26.271 -0.207 8.189 1.00 0.00 C ATOM 784 C ASP A 55 26.344 -1.085 9.446 1.00 0.00 C ATOM 785 O ASP A 55 27.121 -0.810 10.365 1.00 0.00 O ATOM 786 CB ASP A 55 27.428 0.794 8.071 1.00 0.00 C ATOM 787 CG ASP A 55 28.793 0.087 8.123 1.00 0.00 C ATOM 788 OD1 ASP A 55 28.956 -0.967 7.466 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.734 0.623 8.751 1.00 0.00 O ATOM 0 H ASP A 55 24.645 0.447 7.080 1.00 0.00 H new ATOM 0 HA ASP A 55 26.372 -0.910 7.362 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.339 1.346 7.136 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.364 1.523 8.879 1.00 0.00 H new ATOM 794 N CYS A 56 25.518 -2.137 9.501 1.00 0.00 N ATOM 795 CA CYS A 56 25.519 -3.095 10.602 1.00 0.00 C ATOM 796 C CYS A 56 25.714 -4.525 10.096 1.00 0.00 C ATOM 797 O CYS A 56 25.552 -4.796 8.904 1.00 0.00 O ATOM 798 CB CYS A 56 24.239 -2.976 11.446 1.00 0.00 C ATOM 799 SG CYS A 56 24.095 -1.464 12.439 1.00 0.00 S ATOM 0 H CYS A 56 24.829 -2.344 8.778 1.00 0.00 H new ATOM 0 HA CYS A 56 26.365 -2.854 11.245 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.379 -3.035 10.780 1.00 0.00 H new ATOM 0 HB3 CYS A 56 24.184 -3.835 12.114 1.00 0.00 H new ATOM 804 N ASN A 57 26.032 -5.447 11.009 1.00 0.00 N ATOM 805 CA ASN A 57 26.238 -6.864 10.734 1.00 0.00 C ATOM 806 C ASN A 57 25.423 -7.577 11.795 1.00 0.00 C ATOM 807 O ASN A 57 25.718 -7.440 12.980 1.00 0.00 O ATOM 808 CB ASN A 57 27.727 -7.223 10.829 1.00 0.00 C ATOM 809 CG ASN A 57 27.947 -8.731 10.904 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.248 -9.511 10.262 1.00 0.00 O ATOM 811 ND2 ASN A 57 28.916 -9.171 11.690 1.00 0.00 N ATOM 0 H ASN A 57 26.157 -5.214 11.994 1.00 0.00 H new ATOM 0 HA ASN A 57 25.929 -7.147 9.728 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.253 -6.822 9.962 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.159 -6.749 11.711 1.00 0.00 H new ATOM 0 HD21 ASN A 57 29.093 -10.172 11.770 1.00 0.00 H new ATOM 0 HD22 ASN A 57 29.487 -8.509 12.216 1.00 0.00 H new ATOM 818 N ILE A 58 24.370 -8.270 11.386 1.00 0.00 N ATOM 819 CA ILE A 58 23.357 -8.800 12.279 1.00 0.00 C ATOM 820 C ILE A 58 23.266 -10.300 12.013 1.00 0.00 C ATOM 821 O ILE A 58 22.837 -10.716 10.938 1.00 0.00 O ATOM 822 CB ILE A 58 22.053 -7.992 12.040 1.00 0.00 C ATOM 823 CG1 ILE A 58 22.280 -6.515 12.468 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.854 -8.619 12.775 1.00 0.00 C ATOM 825 CD1 ILE A 58 21.122 -5.546 12.211 1.00 0.00 C ATOM 0 H ILE A 58 24.195 -8.482 10.404 1.00 0.00 H new ATOM 0 HA ILE A 58 23.583 -8.691 13.340 1.00 0.00 H new ATOM 0 HB ILE A 58 21.810 -8.018 10.978 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.508 -6.499 13.534 1.00 0.00 H new ATOM 0 HG13 ILE A 58 23.161 -6.140 11.948 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.960 -8.026 12.584 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.698 -9.636 12.416 1.00 0.00 H new ATOM 0 HG23 ILE A 58 21.054 -8.639 13.846 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.400 -4.548 12.551 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.902 -5.517 11.144 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.239 -5.882 12.755 1.00 0.00 H new ATOM 837 N ASP A 59 23.686 -11.115 12.981 1.00 0.00 N ATOM 838 CA ASP A 59 23.777 -12.564 12.833 1.00 0.00 C ATOM 839 C ASP A 59 22.921 -13.234 13.898 1.00 0.00 C ATOM 840 O ASP A 59 23.012 -12.870 15.073 1.00 0.00 O ATOM 841 CB ASP A 59 25.236 -13.012 12.962 1.00 0.00 C ATOM 842 CG ASP A 59 25.348 -14.543 12.887 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.141 -15.108 11.792 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.677 -15.181 13.911 1.00 0.00 O ATOM 0 H ASP A 59 23.976 -10.781 13.900 1.00 0.00 H new ATOM 0 HA ASP A 59 23.412 -12.854 11.847 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.831 -12.560 12.168 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.647 -12.659 13.908 1.00 0.00 H new ATOM 849 N LYS A 60 22.082 -14.192 13.489 1.00 0.00 N ATOM 850 CA LYS A 60 21.210 -15.005 14.347 1.00 0.00 C ATOM 851 C LYS A 60 20.474 -14.194 15.423 1.00 0.00 C ATOM 852 O LYS A 60 20.289 -14.671 16.545 1.00 0.00 O ATOM 853 CB LYS A 60 21.995 -16.214 14.897 1.00 0.00 C ATOM 854 CG LYS A 60 22.279 -17.236 13.787 1.00 0.00 C ATOM 855 CD LYS A 60 23.027 -18.463 14.327 1.00 0.00 C ATOM 856 CE LYS A 60 23.185 -19.554 13.257 1.00 0.00 C ATOM 857 NZ LYS A 60 21.918 -20.273 12.968 1.00 0.00 N ATOM 0 H LYS A 60 21.987 -14.434 12.503 1.00 0.00 H new ATOM 0 HA LYS A 60 20.399 -15.393 13.731 1.00 0.00 H new ATOM 0 HB2 LYS A 60 22.935 -15.874 15.333 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.426 -16.689 15.696 1.00 0.00 H new ATOM 0 HG2 LYS A 60 21.340 -17.552 13.334 1.00 0.00 H new ATOM 0 HG3 LYS A 60 22.870 -16.766 13.001 1.00 0.00 H new ATOM 0 HD2 LYS A 60 24.011 -18.160 14.685 1.00 0.00 H new ATOM 0 HD3 LYS A 60 22.488 -18.869 15.183 1.00 0.00 H new ATOM 0 HE2 LYS A 60 23.557 -19.102 12.338 1.00 0.00 H new ATOM 0 HE3 LYS A 60 23.936 -20.272 13.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 22.125 -21.138 12.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 21.451 -20.526 13.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 21.290 -19.659 12.411 1.00 0.00 H new ATOM 871 N SER A 61 20.049 -12.976 15.091 1.00 0.00 N ATOM 872 CA SER A 61 19.436 -12.051 16.035 1.00 0.00 C ATOM 873 C SER A 61 18.014 -11.709 15.596 1.00 0.00 C ATOM 874 O SER A 61 17.635 -11.931 14.441 1.00 0.00 O ATOM 875 CB SER A 61 20.310 -10.796 16.152 1.00 0.00 C ATOM 876 OG SER A 61 21.605 -11.126 16.623 1.00 0.00 O ATOM 0 H SER A 61 20.123 -12.602 14.145 1.00 0.00 H new ATOM 0 HA SER A 61 19.368 -12.517 17.018 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.385 -10.308 15.180 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.842 -10.084 16.831 1.00 0.00 H new ATOM 0 HG SER A 61 22.040 -11.731 15.987 1.00 0.00 H new ATOM 882 N GLN A 62 17.233 -11.136 16.509 1.00 0.00 N ATOM 883 CA GLN A 62 15.895 -10.637 16.234 1.00 0.00 C ATOM 884 C GLN A 62 15.862 -9.170 16.649 1.00 0.00 C ATOM 885 O GLN A 62 16.358 -8.809 17.718 1.00 0.00 O ATOM 886 CB GLN A 62 14.829 -11.459 16.962 1.00 0.00 C ATOM 887 CG GLN A 62 14.859 -12.957 16.613 1.00 0.00 C ATOM 888 CD GLN A 62 13.643 -13.718 17.151 1.00 0.00 C ATOM 889 OE1 GLN A 62 12.725 -13.152 17.742 1.00 0.00 O ATOM 890 NE2 GLN A 62 13.603 -15.027 16.955 1.00 0.00 N ATOM 0 H GLN A 62 17.522 -11.005 17.478 1.00 0.00 H new ATOM 0 HA GLN A 62 15.666 -10.730 15.172 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.964 -11.343 18.037 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.845 -11.058 16.719 1.00 0.00 H new ATOM 0 HG2 GLN A 62 14.903 -13.072 15.530 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.768 -13.401 17.018 1.00 0.00 H new ATOM 0 HE21 GLN A 62 14.366 -15.493 16.464 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.809 -15.570 17.295 1.00 0.00 H new ATOM 899 N VAL A 63 15.273 -8.337 15.799 1.00 0.00 N ATOM 900 CA VAL A 63 15.334 -6.891 15.891 1.00 0.00 C ATOM 901 C VAL A 63 13.918 -6.355 15.677 1.00 0.00 C ATOM 902 O VAL A 63 13.278 -6.701 14.680 1.00 0.00 O ATOM 903 CB VAL A 63 16.317 -6.397 14.802 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.496 -4.881 14.859 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.705 -7.059 14.882 1.00 0.00 C ATOM 0 H VAL A 63 14.724 -8.664 15.004 1.00 0.00 H new ATOM 0 HA VAL A 63 15.690 -6.541 16.860 1.00 0.00 H new ATOM 0 HB VAL A 63 15.859 -6.687 13.856 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.192 -4.567 14.081 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.533 -4.395 14.702 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.890 -4.598 15.835 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.342 -6.666 14.090 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.156 -6.843 15.851 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.601 -8.137 14.763 1.00 0.00 H new ATOM 915 N TYR A 64 13.434 -5.505 16.585 1.00 0.00 N ATOM 916 CA TYR A 64 12.080 -4.961 16.538 1.00 0.00 C ATOM 917 C TYR A 64 12.140 -3.476 16.881 1.00 0.00 C ATOM 918 O TYR A 64 12.711 -3.124 17.912 1.00 0.00 O ATOM 919 CB TYR A 64 11.188 -5.706 17.549 1.00 0.00 C ATOM 920 CG TYR A 64 11.107 -7.210 17.348 1.00 0.00 C ATOM 921 CD1 TYR A 64 10.158 -7.751 16.460 1.00 0.00 C ATOM 922 CD2 TYR A 64 11.982 -8.071 18.041 1.00 0.00 C ATOM 923 CE1 TYR A 64 10.113 -9.136 16.224 1.00 0.00 C ATOM 924 CE2 TYR A 64 11.926 -9.461 17.831 1.00 0.00 C ATOM 925 CZ TYR A 64 11.006 -9.998 16.900 1.00 0.00 C ATOM 926 OH TYR A 64 10.966 -11.333 16.633 1.00 0.00 O ATOM 0 H TYR A 64 13.979 -5.173 17.381 1.00 0.00 H new ATOM 0 HA TYR A 64 11.657 -5.089 15.542 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.561 -5.509 18.554 1.00 0.00 H new ATOM 0 HB3 TYR A 64 10.181 -5.293 17.496 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.460 -7.098 15.957 1.00 0.00 H new ATOM 0 HD2 TYR A 64 12.699 -7.661 18.737 1.00 0.00 H new ATOM 0 HE1 TYR A 64 9.396 -9.542 15.526 1.00 0.00 H new ATOM 0 HE2 TYR A 64 12.585 -10.118 18.380 1.00 0.00 H new ATOM 0 HH TYR A 64 11.682 -11.787 17.125 1.00 0.00 H new ATOM 936 N LEU A 65 11.535 -2.611 16.061 1.00 0.00 N ATOM 937 CA LEU A 65 11.401 -1.161 16.268 1.00 0.00 C ATOM 938 C LEU A 65 12.719 -0.472 16.695 1.00 0.00 C ATOM 939 O LEU A 65 12.702 0.539 17.400 1.00 0.00 O ATOM 940 CB LEU A 65 10.211 -0.863 17.212 1.00 0.00 C ATOM 941 CG LEU A 65 8.818 -0.992 16.561 1.00 0.00 C ATOM 942 CD1 LEU A 65 8.414 -2.433 16.212 1.00 0.00 C ATOM 943 CD2 LEU A 65 7.759 -0.410 17.506 1.00 0.00 C ATOM 0 H LEU A 65 11.102 -2.917 15.189 1.00 0.00 H new ATOM 0 HA LEU A 65 11.175 -0.710 15.302 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.262 -1.542 18.063 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.321 0.148 17.604 1.00 0.00 H new ATOM 0 HG LEU A 65 8.876 -0.442 15.622 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.423 -2.433 15.759 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.134 -2.853 15.509 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.399 -3.036 17.120 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.774 -0.500 17.048 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.772 -0.957 18.449 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.977 0.641 17.694 1.00 0.00 H new ATOM 955 N THR A 66 13.867 -1.002 16.276 1.00 0.00 N ATOM 956 CA THR A 66 15.187 -0.615 16.762 1.00 0.00 C ATOM 957 C THR A 66 15.956 0.183 15.697 1.00 0.00 C ATOM 958 O THR A 66 15.616 0.160 14.510 1.00 0.00 O ATOM 959 CB THR A 66 15.870 -1.919 17.225 1.00 0.00 C ATOM 960 OG1 THR A 66 15.256 -2.334 18.432 1.00 0.00 O ATOM 961 CG2 THR A 66 17.377 -1.869 17.481 1.00 0.00 C ATOM 0 H THR A 66 13.903 -1.735 15.567 1.00 0.00 H new ATOM 0 HA THR A 66 15.143 0.073 17.607 1.00 0.00 H new ATOM 0 HB THR A 66 15.742 -2.602 16.385 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.347 -2.649 18.245 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.725 -2.852 17.800 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.892 -1.582 16.565 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.589 -1.138 18.261 1.00 0.00 H new ATOM 969 N THR A 67 17.007 0.888 16.118 1.00 0.00 N ATOM 970 CA THR A 67 17.888 1.662 15.260 1.00 0.00 C ATOM 971 C THR A 67 19.322 1.156 15.462 1.00 0.00 C ATOM 972 O THR A 67 19.779 1.029 16.602 1.00 0.00 O ATOM 973 CB THR A 67 17.730 3.160 15.579 1.00 0.00 C ATOM 974 OG1 THR A 67 16.364 3.541 15.544 1.00 0.00 O ATOM 975 CG2 THR A 67 18.486 4.042 14.578 1.00 0.00 C ATOM 0 H THR A 67 17.273 0.934 17.102 1.00 0.00 H new ATOM 0 HA THR A 67 17.632 1.537 14.208 1.00 0.00 H new ATOM 0 HB THR A 67 18.144 3.306 16.577 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.285 4.496 15.751 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.348 5.091 14.840 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.548 3.798 14.607 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.101 3.865 13.574 1.00 0.00 H new ATOM 983 N CYS A 68 20.031 0.886 14.362 1.00 0.00 N ATOM 984 CA CYS A 68 21.382 0.339 14.352 1.00 0.00 C ATOM 985 C CYS A 68 22.247 1.234 13.472 1.00 0.00 C ATOM 986 O CYS A 68 21.905 1.456 12.309 1.00 0.00 O ATOM 987 CB CYS A 68 21.351 -1.091 13.793 1.00 0.00 C ATOM 988 SG CYS A 68 22.887 -2.030 13.987 1.00 0.00 S ATOM 0 H CYS A 68 19.664 1.049 13.425 1.00 0.00 H new ATOM 0 HA CYS A 68 21.792 0.305 15.361 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.546 -1.638 14.283 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.105 -1.044 12.732 1.00 0.00 H new ATOM 993 N THR A 69 23.367 1.721 14.002 1.00 0.00 N ATOM 994 CA THR A 69 24.298 2.566 13.271 1.00 0.00 C ATOM 995 C THR A 69 25.708 2.088 13.606 1.00 0.00 C ATOM 996 O THR A 69 26.092 2.113 14.778 1.00 0.00 O ATOM 997 CB THR A 69 24.084 4.042 13.668 1.00 0.00 C ATOM 998 OG1 THR A 69 22.713 4.400 13.641 1.00 0.00 O ATOM 999 CG2 THR A 69 24.833 4.991 12.726 1.00 0.00 C ATOM 0 H THR A 69 23.654 1.535 14.963 1.00 0.00 H new ATOM 0 HA THR A 69 24.139 2.498 12.195 1.00 0.00 H new ATOM 0 HB THR A 69 24.471 4.138 14.682 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.615 5.340 13.899 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.660 6.022 13.035 1.00 0.00 H new ATOM 0 HG22 THR A 69 25.901 4.775 12.765 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.472 4.852 11.707 1.00 0.00 H new ATOM 1007 N GLY A 70 26.479 1.643 12.608 1.00 0.00 N ATOM 1008 CA GLY A 70 27.877 1.251 12.794 1.00 0.00 C ATOM 1009 C GLY A 70 28.039 0.262 13.948 1.00 0.00 C ATOM 1010 O GLY A 70 28.908 0.442 14.797 1.00 0.00 O ATOM 0 H GLY A 70 26.149 1.545 11.648 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.254 0.803 11.875 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.481 2.138 12.987 1.00 0.00 H new ATOM 1014 N SER A 71 27.154 -0.729 14.032 1.00 0.00 N ATOM 1015 CA SER A 71 27.010 -1.627 15.169 1.00 0.00 C ATOM 1016 C SER A 71 26.876 -3.063 14.665 1.00 0.00 C ATOM 1017 O SER A 71 26.752 -3.294 13.462 1.00 0.00 O ATOM 1018 CB SER A 71 25.787 -1.161 15.973 1.00 0.00 C ATOM 1019 OG SER A 71 26.072 0.067 16.618 1.00 0.00 O ATOM 0 H SER A 71 26.495 -0.934 13.281 1.00 0.00 H new ATOM 0 HA SER A 71 27.883 -1.605 15.822 1.00 0.00 H new ATOM 0 HB2 SER A 71 24.929 -1.043 15.311 1.00 0.00 H new ATOM 0 HB3 SER A 71 25.518 -1.916 16.712 1.00 0.00 H new ATOM 0 HG SER A 71 26.205 0.767 15.945 1.00 0.00 H new ATOM 1025 N GLN A 72 26.917 -4.051 15.554 1.00 0.00 N ATOM 1026 CA GLN A 72 26.775 -5.449 15.169 1.00 0.00 C ATOM 1027 C GLN A 72 25.903 -6.142 16.197 1.00 0.00 C ATOM 1028 O GLN A 72 25.999 -5.823 17.382 1.00 0.00 O ATOM 1029 CB GLN A 72 28.131 -6.174 15.075 1.00 0.00 C ATOM 1030 CG GLN A 72 29.185 -5.447 14.232 1.00 0.00 C ATOM 1031 CD GLN A 72 30.419 -6.324 14.033 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.443 -7.196 13.165 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.455 -6.131 14.832 1.00 0.00 N ATOM 0 H GLN A 72 27.049 -3.905 16.555 1.00 0.00 H new ATOM 0 HA GLN A 72 26.323 -5.485 14.178 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.524 -6.315 16.082 1.00 0.00 H new ATOM 0 HB3 GLN A 72 27.969 -7.166 14.654 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.762 -5.181 13.263 1.00 0.00 H new ATOM 0 HG3 GLN A 72 29.470 -4.516 14.722 1.00 0.00 H new ATOM 0 HE21 GLN A 72 31.419 -5.404 15.547 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.290 -6.709 14.734 1.00 0.00 H new ATOM 1042 N TYR A 73 25.114 -7.118 15.759 1.00 0.00 N ATOM 1043 CA TYR A 73 24.297 -7.941 16.636 1.00 0.00 C ATOM 1044 C TYR A 73 24.683 -9.385 16.351 1.00 0.00 C ATOM 1045 O TYR A 73 24.778 -9.770 15.187 1.00 0.00 O ATOM 1046 CB TYR A 73 22.804 -7.739 16.341 1.00 0.00 C ATOM 1047 CG TYR A 73 22.201 -6.345 16.471 1.00 0.00 C ATOM 1048 CD1 TYR A 73 22.766 -5.343 17.289 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.021 -6.064 15.758 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.192 -4.061 17.343 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.434 -4.791 15.813 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.023 -3.780 16.599 1.00 0.00 C ATOM 1053 OH TYR A 73 20.449 -2.554 16.634 1.00 0.00 O ATOM 0 H TYR A 73 25.025 -7.360 14.772 1.00 0.00 H new ATOM 0 HA TYR A 73 24.464 -7.674 17.680 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.622 -8.081 15.322 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.246 -8.401 17.004 1.00 0.00 H new ATOM 0 HD1 TYR A 73 23.645 -5.563 17.877 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.561 -6.838 15.161 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.643 -3.292 17.952 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.533 -4.586 15.254 1.00 0.00 H new ATOM 0 HH TYR A 73 21.078 -1.909 17.020 1.00 0.00 H new ATOM 1063 N ASN A 74 24.922 -10.181 17.386 1.00 0.00 N ATOM 1064 CA ASN A 74 25.335 -11.569 17.246 1.00 0.00 C ATOM 1065 C ASN A 74 24.609 -12.412 18.298 1.00 0.00 C ATOM 1066 O ASN A 74 25.005 -12.429 19.463 1.00 0.00 O ATOM 1067 CB ASN A 74 26.864 -11.640 17.400 1.00 0.00 C ATOM 1068 CG ASN A 74 27.368 -13.040 17.737 1.00 0.00 C ATOM 1069 OD1 ASN A 74 26.953 -14.033 17.148 1.00 0.00 O ATOM 1070 ND2 ASN A 74 28.277 -13.142 18.693 1.00 0.00 N ATOM 0 H ASN A 74 24.833 -9.876 18.355 1.00 0.00 H new ATOM 0 HA ASN A 74 25.073 -11.966 16.265 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.332 -11.305 16.474 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.177 -10.950 18.183 1.00 0.00 H new ATOM 0 HD21 ASN A 74 28.645 -14.058 18.951 1.00 0.00 H new ATOM 0 HD22 ASN A 74 28.610 -12.305 19.171 1.00 0.00 H new ATOM 1077 N GLY A 75 23.540 -13.101 17.905 1.00 0.00 N ATOM 1078 CA GLY A 75 22.769 -13.949 18.803 1.00 0.00 C ATOM 1079 C GLY A 75 22.028 -13.148 19.875 1.00 0.00 C ATOM 1080 O GLY A 75 22.116 -13.509 21.052 1.00 0.00 O ATOM 0 H GLY A 75 23.185 -13.085 16.949 1.00 0.00 H new ATOM 0 HA2 GLY A 75 22.049 -14.526 18.223 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.436 -14.664 19.285 1.00 0.00 H new ATOM 1084 N ILE A 76 21.333 -12.060 19.509 1.00 0.00 N ATOM 1085 CA ILE A 76 20.652 -11.187 20.473 1.00 0.00 C ATOM 1086 C ILE A 76 19.174 -10.992 20.112 1.00 0.00 C ATOM 1087 O ILE A 76 18.755 -11.237 18.980 1.00 0.00 O ATOM 1088 CB ILE A 76 21.395 -9.833 20.651 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.945 -8.735 19.660 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.932 -10.002 20.628 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.660 -7.393 19.850 1.00 0.00 C ATOM 0 H ILE A 76 21.228 -11.763 18.539 1.00 0.00 H new ATOM 0 HA ILE A 76 20.679 -11.689 21.440 1.00 0.00 H new ATOM 0 HB ILE A 76 21.105 -9.485 21.643 1.00 0.00 H new ATOM 0 HG12 ILE A 76 21.117 -9.086 18.642 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.871 -8.581 19.767 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.407 -9.029 20.756 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.237 -10.664 21.438 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.237 -10.432 19.674 1.00 0.00 H new ATOM 0 HD11 ILE A 76 21.289 -6.676 19.117 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.468 -7.017 20.855 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.733 -7.530 19.713 1.00 0.00 H new ATOM 1103 N TYR A 77 18.405 -10.470 21.063 1.00 0.00 N ATOM 1104 CA TYR A 77 17.041 -10.003 20.877 1.00 0.00 C ATOM 1105 C TYR A 77 17.064 -8.534 21.292 1.00 0.00 C ATOM 1106 O TYR A 77 17.509 -8.225 22.400 1.00 0.00 O ATOM 1107 CB TYR A 77 16.073 -10.815 21.754 1.00 0.00 C ATOM 1108 CG TYR A 77 16.003 -12.302 21.444 1.00 0.00 C ATOM 1109 CD1 TYR A 77 16.972 -13.180 21.973 1.00 0.00 C ATOM 1110 CD2 TYR A 77 14.956 -12.817 20.656 1.00 0.00 C ATOM 1111 CE1 TYR A 77 16.911 -14.558 21.702 1.00 0.00 C ATOM 1112 CE2 TYR A 77 14.879 -14.197 20.394 1.00 0.00 C ATOM 1113 CZ TYR A 77 15.861 -15.074 20.908 1.00 0.00 C ATOM 1114 OH TYR A 77 15.776 -16.408 20.640 1.00 0.00 O ATOM 0 H TYR A 77 18.732 -10.358 22.023 1.00 0.00 H new ATOM 0 HA TYR A 77 16.698 -10.123 19.849 1.00 0.00 H new ATOM 0 HB2 TYR A 77 16.364 -10.692 22.797 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.074 -10.392 21.650 1.00 0.00 H new ATOM 0 HD1 TYR A 77 17.767 -12.790 22.591 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.209 -12.150 20.251 1.00 0.00 H new ATOM 0 HE1 TYR A 77 17.665 -15.221 22.100 1.00 0.00 H new ATOM 0 HE2 TYR A 77 14.067 -14.587 19.798 1.00 0.00 H new ATOM 0 HH TYR A 77 14.990 -16.580 20.081 1.00 0.00 H new ATOM 1124 N ILE A 78 16.626 -7.622 20.425 1.00 0.00 N ATOM 1125 CA ILE A 78 16.667 -6.190 20.702 1.00 0.00 C ATOM 1126 C ILE A 78 15.357 -5.546 20.243 1.00 0.00 C ATOM 1127 O ILE A 78 14.861 -5.832 19.148 1.00 0.00 O ATOM 1128 CB ILE A 78 17.955 -5.559 20.123 1.00 0.00 C ATOM 1129 CG1 ILE A 78 18.010 -4.058 20.478 1.00 0.00 C ATOM 1130 CG2 ILE A 78 18.127 -5.800 18.612 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.388 -3.421 20.259 1.00 0.00 C ATOM 0 H ILE A 78 16.234 -7.856 19.513 1.00 0.00 H new ATOM 0 HA ILE A 78 16.731 -6.001 21.774 1.00 0.00 H new ATOM 0 HB ILE A 78 18.802 -6.063 20.589 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.274 -3.525 19.877 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.722 -3.930 21.522 1.00 0.00 H new ATOM 0 HG21 ILE A 78 19.050 -5.331 18.271 1.00 0.00 H new ATOM 0 HG22 ILE A 78 18.171 -6.872 18.417 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.282 -5.368 18.076 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.348 -2.366 20.530 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.126 -3.928 20.881 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.670 -3.516 19.210 1.00 0.00 H new ATOM 1143 N ARG A 79 14.779 -4.709 21.107 1.00 0.00 N ATOM 1144 CA ARG A 79 13.439 -4.168 20.948 1.00 0.00 C ATOM 1145 C ARG A 79 13.455 -2.686 21.284 1.00 0.00 C ATOM 1146 O ARG A 79 13.959 -2.298 22.342 1.00 0.00 O ATOM 1147 CB ARG A 79 12.516 -4.971 21.878 1.00 0.00 C ATOM 1148 CG ARG A 79 11.080 -4.431 21.958 1.00 0.00 C ATOM 1149 CD ARG A 79 10.170 -5.388 22.736 1.00 0.00 C ATOM 1150 NE ARG A 79 10.634 -5.615 24.119 1.00 0.00 N ATOM 1151 CZ ARG A 79 9.943 -6.208 25.098 1.00 0.00 C ATOM 1152 NH1 ARG A 79 8.693 -6.622 24.904 1.00 0.00 N ATOM 1153 NH2 ARG A 79 10.531 -6.381 26.274 1.00 0.00 N ATOM 0 H ARG A 79 15.245 -4.385 21.954 1.00 0.00 H new ATOM 0 HA ARG A 79 13.076 -4.256 19.924 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.485 -6.006 21.536 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.946 -4.979 22.880 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.083 -3.454 22.441 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.686 -4.288 20.952 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.158 -4.984 22.758 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.120 -6.343 22.212 1.00 0.00 H new ATOM 0 HE ARG A 79 11.572 -5.288 24.350 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.247 -6.489 23.997 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.181 -7.072 25.663 1.00 0.00 H new ATOM 0 HH21 ARG A 79 11.490 -6.064 26.416 1.00 0.00 H new ATOM 0 HH22 ARG A 79 10.024 -6.831 27.036 1.00 0.00 H new ATOM 1167 N SER A 80 12.860 -1.867 20.421 1.00 0.00 N ATOM 1168 CA SER A 80 12.601 -0.450 20.643 1.00 0.00 C ATOM 1169 C SER A 80 13.842 0.339 21.099 1.00 0.00 C ATOM 1170 O SER A 80 13.709 1.306 21.853 1.00 0.00 O ATOM 1171 CB SER A 80 11.413 -0.334 21.606 1.00 0.00 C ATOM 1172 OG SER A 80 10.296 -1.060 21.108 1.00 0.00 O ATOM 0 H SER A 80 12.532 -2.188 19.510 1.00 0.00 H new ATOM 0 HA SER A 80 12.344 0.022 19.695 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.694 -0.716 22.587 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.144 0.714 21.737 1.00 0.00 H new ATOM 0 HG SER A 80 9.547 -0.978 21.734 1.00 0.00 H new ATOM 1178 N SER A 81 15.044 -0.065 20.672 1.00 0.00 N ATOM 1179 CA SER A 81 16.308 0.454 21.193 1.00 0.00 C ATOM 1180 C SER A 81 17.113 1.182 20.109 1.00 0.00 C ATOM 1181 O SER A 81 16.744 1.172 18.935 1.00 0.00 O ATOM 1182 CB SER A 81 17.097 -0.714 21.797 1.00 0.00 C ATOM 1183 OG SER A 81 16.408 -1.272 22.902 1.00 0.00 O ATOM 0 H SER A 81 15.165 -0.771 19.946 1.00 0.00 H new ATOM 0 HA SER A 81 16.106 1.196 21.966 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.257 -1.480 21.039 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.081 -0.368 22.114 1.00 0.00 H new ATOM 0 HG SER A 81 15.590 -1.712 22.589 1.00 0.00 H new ATOM 1189 N THR A 82 18.228 1.803 20.492 1.00 0.00 N ATOM 1190 CA THR A 82 19.136 2.512 19.599 1.00 0.00 C ATOM 1191 C THR A 82 20.561 2.074 19.945 1.00 0.00 C ATOM 1192 O THR A 82 20.904 1.948 21.123 1.00 0.00 O ATOM 1193 CB THR A 82 18.924 4.029 19.762 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.582 4.377 19.477 1.00 0.00 O ATOM 1195 CG2 THR A 82 19.823 4.863 18.840 1.00 0.00 C ATOM 0 H THR A 82 18.532 1.826 21.465 1.00 0.00 H new ATOM 0 HA THR A 82 18.947 2.277 18.552 1.00 0.00 H new ATOM 0 HB THR A 82 19.180 4.252 20.798 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.464 5.344 19.587 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.627 5.923 19.002 1.00 0.00 H new ATOM 0 HG22 THR A 82 20.869 4.650 19.061 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.613 4.610 17.801 1.00 0.00 H new ATOM 1203 N THR A 83 21.391 1.844 18.928 1.00 0.00 N ATOM 1204 CA THR A 83 22.741 1.312 19.068 1.00 0.00 C ATOM 1205 C THR A 83 23.643 2.041 18.068 1.00 0.00 C ATOM 1206 O THR A 83 23.283 2.175 16.892 1.00 0.00 O ATOM 1207 CB THR A 83 22.722 -0.218 18.870 1.00 0.00 C ATOM 1208 OG1 THR A 83 21.870 -0.618 17.810 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.237 -0.952 20.124 1.00 0.00 C ATOM 0 H THR A 83 21.133 2.029 17.959 1.00 0.00 H new ATOM 0 HA THR A 83 23.139 1.484 20.068 1.00 0.00 H new ATOM 0 HB THR A 83 23.755 -0.481 18.643 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.369 0.158 17.482 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.239 -2.026 19.940 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.901 -0.725 20.958 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.225 -0.628 20.367 1.00 0.00 H new ATOM 1217 N THR A 84 24.775 2.563 18.545 1.00 0.00 N ATOM 1218 CA THR A 84 25.676 3.420 17.790 1.00 0.00 C ATOM 1219 C THR A 84 27.115 3.043 18.156 1.00 0.00 C ATOM 1220 O THR A 84 27.525 3.212 19.307 1.00 0.00 O ATOM 1221 CB THR A 84 25.376 4.899 18.109 1.00 0.00 C ATOM 1222 OG1 THR A 84 23.990 5.190 18.022 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.109 5.838 17.144 1.00 0.00 C ATOM 0 H THR A 84 25.095 2.392 19.498 1.00 0.00 H new ATOM 0 HA THR A 84 25.537 3.283 16.718 1.00 0.00 H new ATOM 0 HB THR A 84 25.722 5.060 19.130 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.840 6.135 18.232 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.876 6.873 17.396 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.184 5.677 17.226 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.789 5.632 16.123 1.00 0.00 H new ATOM 1231 N GLY A 85 27.910 2.564 17.193 1.00 0.00 N ATOM 1232 CA GLY A 85 29.291 2.171 17.460 1.00 0.00 C ATOM 1233 C GLY A 85 29.354 1.015 18.458 1.00 0.00 C ATOM 1234 O GLY A 85 30.176 1.046 19.376 1.00 0.00 O ATOM 0 H GLY A 85 27.618 2.441 16.224 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.775 1.877 16.528 1.00 0.00 H new ATOM 0 HA3 GLY A 85 29.845 3.024 17.852 1.00 0.00 H new ATOM 1238 N THR A 86 28.479 0.016 18.327 1.00 0.00 N ATOM 1239 CA THR A 86 28.292 -1.011 19.345 1.00 0.00 C ATOM 1240 C THR A 86 28.195 -2.415 18.744 1.00 0.00 C ATOM 1241 O THR A 86 27.172 -2.783 18.174 1.00 0.00 O ATOM 1242 CB THR A 86 27.038 -0.660 20.183 1.00 0.00 C ATOM 1243 OG1 THR A 86 26.022 0.003 19.454 1.00 0.00 O ATOM 1244 CG2 THR A 86 27.368 0.268 21.345 1.00 0.00 C ATOM 0 H THR A 86 27.881 -0.101 17.509 1.00 0.00 H new ATOM 0 HA THR A 86 29.169 -1.027 19.992 1.00 0.00 H new ATOM 0 HB THR A 86 26.685 -1.635 20.519 1.00 0.00 H new ATOM 0 HG1 THR A 86 26.121 -0.196 18.500 1.00 0.00 H new ATOM 0 HG21 THR A 86 26.459 0.487 21.905 1.00 0.00 H new ATOM 0 HG22 THR A 86 28.091 -0.215 22.002 1.00 0.00 H new ATOM 0 HG23 THR A 86 27.790 1.196 20.961 1.00 0.00 H new ATOM 1252 N SER A 87 29.255 -3.216 18.863 1.00 0.00 N ATOM 1253 CA SER A 87 29.192 -4.637 18.545 1.00 0.00 C ATOM 1254 C SER A 87 28.660 -5.340 19.798 1.00 0.00 C ATOM 1255 O SER A 87 29.197 -5.109 20.885 1.00 0.00 O ATOM 1256 CB SER A 87 30.585 -5.147 18.167 1.00 0.00 C ATOM 1257 OG SER A 87 31.130 -4.362 17.121 1.00 0.00 O ATOM 0 H SER A 87 30.171 -2.899 19.180 1.00 0.00 H new ATOM 0 HA SER A 87 28.539 -4.834 17.695 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.241 -5.112 19.037 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.525 -6.190 17.855 1.00 0.00 H new ATOM 0 HG SER A 87 31.511 -3.539 17.494 1.00 0.00 H new ATOM 1263 N ILE A 88 27.616 -6.163 19.672 1.00 0.00 N ATOM 1264 CA ILE A 88 26.886 -6.762 20.786 1.00 0.00 C ATOM 1265 C ILE A 88 26.661 -8.243 20.456 1.00 0.00 C ATOM 1266 O ILE A 88 26.315 -8.597 19.324 1.00 0.00 O ATOM 1267 CB ILE A 88 25.542 -6.021 21.030 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.718 -4.484 21.125 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.860 -6.550 22.306 1.00 0.00 C ATOM 1270 CD1 ILE A 88 24.425 -3.703 21.396 1.00 0.00 C ATOM 0 H ILE A 88 27.246 -6.438 18.762 1.00 0.00 H new ATOM 0 HA ILE A 88 27.461 -6.674 21.708 1.00 0.00 H new ATOM 0 HB ILE A 88 24.910 -6.223 20.165 1.00 0.00 H new ATOM 0 HG12 ILE A 88 26.432 -4.263 21.918 1.00 0.00 H new ATOM 0 HG13 ILE A 88 26.154 -4.124 20.193 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.920 -6.021 22.462 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.662 -7.616 22.197 1.00 0.00 H new ATOM 0 HG23 ILE A 88 25.515 -6.388 23.162 1.00 0.00 H new ATOM 0 HD11 ILE A 88 24.647 -2.637 21.446 1.00 0.00 H new ATOM 0 HD12 ILE A 88 23.713 -3.888 20.592 1.00 0.00 H new ATOM 0 HD13 ILE A 88 23.995 -4.028 22.343 1.00 0.00 H new ATOM 1282 N SER A 89 26.816 -9.092 21.466 1.00 0.00 N ATOM 1283 CA SER A 89 26.805 -10.541 21.395 1.00 0.00 C ATOM 1284 C SER A 89 25.970 -11.120 22.546 1.00 0.00 C ATOM 1285 O SER A 89 25.570 -10.395 23.461 1.00 0.00 O ATOM 1286 CB SER A 89 28.250 -11.051 21.445 1.00 0.00 C ATOM 1287 OG SER A 89 28.948 -10.702 20.259 1.00 0.00 O ATOM 0 H SER A 89 26.962 -8.759 22.419 1.00 0.00 H new ATOM 0 HA SER A 89 26.348 -10.866 20.460 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.760 -10.628 22.311 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.254 -12.134 21.570 1.00 0.00 H new ATOM 0 HG SER A 89 29.868 -11.035 20.311 1.00 0.00 H new ATOM 1293 N GLY A 90 25.710 -12.431 22.473 1.00 0.00 N ATOM 1294 CA GLY A 90 25.037 -13.254 23.477 1.00 0.00 C ATOM 1295 C GLY A 90 25.794 -13.363 24.817 1.00 0.00 C ATOM 1296 O GLY A 90 26.492 -12.423 25.207 1.00 0.00 O ATOM 0 H GLY A 90 25.983 -12.978 21.656 1.00 0.00 H new ATOM 0 HA2 GLY A 90 24.046 -12.840 23.665 1.00 0.00 H new ATOM 0 HA3 GLY A 90 24.892 -14.256 23.072 1.00 0.00 H new ATOM 1300 N PRO A 91 25.704 -14.494 25.546 1.00 0.00 N ATOM 1301 CA PRO A 91 25.123 -15.776 25.137 1.00 0.00 C ATOM 1302 C PRO A 91 23.586 -15.830 25.148 1.00 0.00 C ATOM 1303 O PRO A 91 23.017 -16.765 24.580 1.00 0.00 O ATOM 1304 CB PRO A 91 25.702 -16.799 26.124 1.00 0.00 C ATOM 1305 CG PRO A 91 25.908 -15.984 27.399 1.00 0.00 C ATOM 1306 CD PRO A 91 26.339 -14.627 26.852 1.00 0.00 C ATOM 0 HA PRO A 91 25.376 -15.970 24.095 1.00 0.00 H new ATOM 0 HB2 PRO A 91 25.018 -17.632 26.286 1.00 0.00 H new ATOM 0 HB3 PRO A 91 26.639 -17.221 25.761 1.00 0.00 H new ATOM 0 HG2 PRO A 91 24.994 -15.913 27.988 1.00 0.00 H new ATOM 0 HG3 PRO A 91 26.669 -16.423 28.044 1.00 0.00 H new ATOM 0 HD2 PRO A 91 26.029 -13.822 27.519 1.00 0.00 H new ATOM 0 HD3 PRO A 91 27.424 -14.569 26.765 1.00 0.00 H new ATOM 1314 N GLY A 92 22.907 -14.857 25.762 1.00 0.00 N ATOM 1315 CA GLY A 92 21.451 -14.843 25.898 1.00 0.00 C ATOM 1316 C GLY A 92 20.963 -13.403 25.950 1.00 0.00 C ATOM 1317 O GLY A 92 20.183 -13.036 26.830 1.00 0.00 O ATOM 0 H GLY A 92 23.361 -14.047 26.184 1.00 0.00 H new ATOM 0 HA2 GLY A 92 20.991 -15.364 25.059 1.00 0.00 H new ATOM 0 HA3 GLY A 92 21.154 -15.372 26.803 1.00 0.00 H new ATOM 1321 N CYS A 93 21.508 -12.576 25.057 1.00 0.00 N ATOM 1322 CA CYS A 93 21.343 -11.137 25.089 1.00 0.00 C ATOM 1323 C CYS A 93 19.921 -10.738 24.736 1.00 0.00 C ATOM 1324 O CYS A 93 19.397 -11.132 23.692 1.00 0.00 O ATOM 1325 CB CYS A 93 22.345 -10.505 24.128 1.00 0.00 C ATOM 1326 SG CYS A 93 22.351 -8.695 24.053 1.00 0.00 S ATOM 0 H CYS A 93 22.085 -12.901 24.281 1.00 0.00 H new ATOM 0 HA CYS A 93 21.532 -10.776 26.100 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.344 -10.839 24.407 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.148 -10.889 23.127 1.00 0.00 H new ATOM 1331 N SER A 94 19.357 -9.885 25.578 1.00 0.00 N ATOM 1332 CA SER A 94 18.020 -9.349 25.487 1.00 0.00 C ATOM 1333 C SER A 94 18.127 -7.875 25.863 1.00 0.00 C ATOM 1334 O SER A 94 18.722 -7.549 26.894 1.00 0.00 O ATOM 1335 CB SER A 94 17.135 -10.115 26.473 1.00 0.00 C ATOM 1336 OG SER A 94 16.936 -11.454 26.042 1.00 0.00 O ATOM 0 H SER A 94 19.858 -9.530 26.392 1.00 0.00 H new ATOM 0 HA SER A 94 17.584 -9.448 24.493 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.597 -10.112 27.460 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.172 -9.613 26.569 1.00 0.00 H new ATOM 0 HG SER A 94 16.369 -11.925 26.688 1.00 0.00 H new ATOM 1342 N ILE A 95 17.587 -6.991 25.024 1.00 0.00 N ATOM 1343 CA ILE A 95 17.695 -5.543 25.155 1.00 0.00 C ATOM 1344 C ILE A 95 16.311 -4.975 24.841 1.00 0.00 C ATOM 1345 O ILE A 95 15.717 -5.327 23.818 1.00 0.00 O ATOM 1346 CB ILE A 95 18.777 -4.998 24.183 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.155 -5.637 24.450 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.887 -3.465 24.283 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.308 -5.132 23.577 1.00 0.00 C ATOM 0 H ILE A 95 17.045 -7.276 24.208 1.00 0.00 H new ATOM 0 HA ILE A 95 18.003 -5.248 26.158 1.00 0.00 H new ATOM 0 HB ILE A 95 18.464 -5.267 23.174 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.416 -5.469 25.495 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.067 -6.715 24.313 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.652 -3.109 23.592 1.00 0.00 H new ATOM 0 HG22 ILE A 95 17.928 -3.014 24.027 1.00 0.00 H new ATOM 0 HG23 ILE A 95 19.159 -3.185 25.301 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.227 -5.650 23.852 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.082 -5.326 22.528 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.437 -4.060 23.728 1.00 0.00 H new ATOM 1361 N SER A 96 15.803 -4.082 25.691 1.00 0.00 N ATOM 1362 CA SER A 96 14.563 -3.358 25.458 1.00 0.00 C ATOM 1363 C SER A 96 14.741 -1.897 25.863 1.00 0.00 C ATOM 1364 O SER A 96 15.297 -1.609 26.928 1.00 0.00 O ATOM 1365 CB SER A 96 13.415 -4.004 26.236 1.00 0.00 C ATOM 1366 OG SER A 96 13.122 -5.294 25.720 1.00 0.00 O ATOM 0 H SER A 96 16.253 -3.841 26.574 1.00 0.00 H new ATOM 0 HA SER A 96 14.315 -3.400 24.397 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.681 -4.081 27.290 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.528 -3.373 26.176 1.00 0.00 H new ATOM 0 HG SER A 96 13.398 -5.976 26.367 1.00 0.00 H new ATOM 1372 N THR A 97 14.235 -1.003 25.008 1.00 0.00 N ATOM 1373 CA THR A 97 14.175 0.449 25.193 1.00 0.00 C ATOM 1374 C THR A 97 15.494 1.090 25.675 1.00 0.00 C ATOM 1375 O THR A 97 15.482 2.098 26.387 1.00 0.00 O ATOM 1376 CB THR A 97 12.898 0.831 25.983 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.646 -0.019 27.085 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.652 0.728 25.100 1.00 0.00 C ATOM 0 H THR A 97 13.833 -1.291 24.116 1.00 0.00 H new ATOM 0 HA THR A 97 14.075 0.913 24.212 1.00 0.00 H new ATOM 0 HB THR A 97 13.085 1.849 26.325 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.036 0.371 27.895 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.771 1.002 25.681 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.751 1.404 24.251 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.545 -0.295 24.739 1.00 0.00 H new ATOM 1386 N CYS A 98 16.643 0.530 25.278 1.00 0.00 N ATOM 1387 CA CYS A 98 17.961 1.071 25.594 1.00 0.00 C ATOM 1388 C CYS A 98 18.442 2.020 24.498 1.00 0.00 C ATOM 1389 O CYS A 98 18.016 1.937 23.348 1.00 0.00 O ATOM 1390 CB CYS A 98 18.971 -0.077 25.729 1.00 0.00 C ATOM 1391 SG CYS A 98 18.752 -1.138 27.179 1.00 0.00 S ATOM 0 H CYS A 98 16.679 -0.324 24.721 1.00 0.00 H new ATOM 0 HA CYS A 98 17.884 1.622 26.531 1.00 0.00 H new ATOM 0 HB2 CYS A 98 18.912 -0.697 24.834 1.00 0.00 H new ATOM 0 HB3 CYS A 98 19.975 0.347 25.758 1.00 0.00 H new ATOM 1396 N THR A 99 19.400 2.874 24.844 1.00 0.00 N ATOM 1397 CA THR A 99 20.151 3.701 23.913 1.00 0.00 C ATOM 1398 C THR A 99 21.601 3.453 24.311 1.00 0.00 C ATOM 1399 O THR A 99 21.945 3.644 25.481 1.00 0.00 O ATOM 1400 CB THR A 99 19.707 5.171 24.028 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.332 5.286 23.707 1.00 0.00 O ATOM 1402 CG2 THR A 99 20.489 6.096 23.090 1.00 0.00 C ATOM 0 H THR A 99 19.683 3.012 25.814 1.00 0.00 H new ATOM 0 HA THR A 99 19.993 3.461 22.862 1.00 0.00 H new ATOM 0 HB THR A 99 19.900 5.475 25.057 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.055 6.223 23.784 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.136 7.120 23.212 1.00 0.00 H new ATOM 0 HG22 THR A 99 21.551 6.047 23.332 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.337 5.780 22.058 1.00 0.00 H new ATOM 1410 N ILE A 100 22.429 2.958 23.394 1.00 0.00 N ATOM 1411 CA ILE A 100 23.771 2.477 23.696 1.00 0.00 C ATOM 1412 C ILE A 100 24.701 3.108 22.662 1.00 0.00 C ATOM 1413 O ILE A 100 24.414 3.066 21.463 1.00 0.00 O ATOM 1414 CB ILE A 100 23.827 0.924 23.669 1.00 0.00 C ATOM 1415 CG1 ILE A 100 22.608 0.256 24.358 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.134 0.424 24.316 1.00 0.00 C ATOM 1417 CD1 ILE A 100 22.641 -1.279 24.385 1.00 0.00 C ATOM 0 H ILE A 100 22.181 2.880 22.408 1.00 0.00 H new ATOM 0 HA ILE A 100 24.079 2.763 24.702 1.00 0.00 H new ATOM 0 HB ILE A 100 23.796 0.633 22.619 1.00 0.00 H new ATOM 0 HG12 ILE A 100 22.543 0.621 25.383 1.00 0.00 H new ATOM 0 HG13 ILE A 100 21.700 0.576 23.847 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.159 -0.665 24.290 1.00 0.00 H new ATOM 0 HG22 ILE A 100 25.987 0.820 23.765 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.181 0.763 25.351 1.00 0.00 H new ATOM 0 HD11 ILE A 100 21.748 -1.653 24.886 1.00 0.00 H new ATOM 0 HD12 ILE A 100 22.671 -1.660 23.364 1.00 0.00 H new ATOM 0 HD13 ILE A 100 23.527 -1.614 24.924 1.00 0.00 H new ATOM 1429 N THR A 101 25.810 3.685 23.121 1.00 0.00 N ATOM 1430 CA THR A 101 26.776 4.372 22.276 1.00 0.00 C ATOM 1431 C THR A 101 28.171 3.930 22.716 1.00 0.00 C ATOM 1432 O THR A 101 28.466 3.958 23.910 1.00 0.00 O ATOM 1433 CB THR A 101 26.582 5.896 22.398 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.240 6.260 22.123 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.481 6.673 21.430 1.00 0.00 C ATOM 0 H THR A 101 26.064 3.686 24.109 1.00 0.00 H new ATOM 0 HA THR A 101 26.639 4.119 21.225 1.00 0.00 H new ATOM 0 HB THR A 101 26.848 6.151 23.424 1.00 0.00 H new ATOM 0 HG1 THR A 101 25.140 7.231 22.208 1.00 0.00 H new ATOM 0 HG21 THR A 101 27.309 7.742 21.553 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.526 6.447 21.643 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.248 6.383 20.405 1.00 0.00 H new ATOM 1443 N ARG A 102 29.028 3.522 21.770 1.00 0.00 N ATOM 1444 CA ARG A 102 30.428 3.132 22.009 1.00 0.00 C ATOM 1445 C ARG A 102 30.590 2.200 23.224 1.00 0.00 C ATOM 1446 O ARG A 102 31.508 2.364 24.028 1.00 0.00 O ATOM 1447 CB ARG A 102 31.316 4.392 22.071 1.00 0.00 C ATOM 1448 CG ARG A 102 31.359 5.143 20.726 1.00 0.00 C ATOM 1449 CD ARG A 102 32.257 6.386 20.787 1.00 0.00 C ATOM 1450 NE ARG A 102 31.712 7.428 21.678 1.00 0.00 N ATOM 1451 CZ ARG A 102 30.836 8.386 21.340 1.00 0.00 C ATOM 1452 NH1 ARG A 102 30.361 8.471 20.100 1.00 0.00 N ATOM 1453 NH2 ARG A 102 30.430 9.257 22.260 1.00 0.00 N ATOM 0 H ARG A 102 28.760 3.451 20.788 1.00 0.00 H new ATOM 0 HA ARG A 102 30.769 2.530 21.166 1.00 0.00 H new ATOM 0 HB2 ARG A 102 30.941 5.060 22.846 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.328 4.107 22.358 1.00 0.00 H new ATOM 0 HG2 ARG A 102 31.722 4.472 19.948 1.00 0.00 H new ATOM 0 HG3 ARG A 102 30.349 5.440 20.445 1.00 0.00 H new ATOM 0 HD2 ARG A 102 33.249 6.098 21.133 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.376 6.795 19.784 1.00 0.00 H new ATOM 0 HE ARG A 102 32.033 7.419 22.646 1.00 0.00 H new ATOM 0 HH11 ARG A 102 30.662 7.802 19.391 1.00 0.00 H new ATOM 0 HH12 ARG A 102 29.695 9.205 19.858 1.00 0.00 H new ATOM 0 HH21 ARG A 102 30.785 9.193 23.214 1.00 0.00 H new ATOM 0 HH22 ARG A 102 29.764 9.988 22.011 1.00 0.00 H new ATOM 1467 N GLY A 103 29.691 1.219 23.370 1.00 0.00 N ATOM 1468 CA GLY A 103 29.758 0.217 24.431 1.00 0.00 C ATOM 1469 C GLY A 103 29.301 0.722 25.802 1.00 0.00 C ATOM 1470 O GLY A 103 29.571 0.052 26.800 1.00 0.00 O ATOM 0 H GLY A 103 28.891 1.101 22.748 1.00 0.00 H new ATOM 0 HA2 GLY A 103 29.143 -0.637 24.148 1.00 0.00 H new ATOM 0 HA3 GLY A 103 30.784 -0.142 24.512 1.00 0.00 H new ATOM 1474 N VAL A 104 28.609 1.862 25.878 1.00 0.00 N ATOM 1475 CA VAL A 104 28.101 2.435 27.120 1.00 0.00 C ATOM 1476 C VAL A 104 26.596 2.636 26.930 1.00 0.00 C ATOM 1477 O VAL A 104 26.168 3.341 26.013 1.00 0.00 O ATOM 1478 CB VAL A 104 28.856 3.746 27.448 1.00 0.00 C ATOM 1479 CG1 VAL A 104 28.395 4.337 28.788 1.00 0.00 C ATOM 1480 CG2 VAL A 104 30.379 3.532 27.523 1.00 0.00 C ATOM 0 H VAL A 104 28.383 2.423 25.056 1.00 0.00 H new ATOM 0 HA VAL A 104 28.266 1.779 27.975 1.00 0.00 H new ATOM 0 HB VAL A 104 28.626 4.435 26.635 1.00 0.00 H new ATOM 0 HG11 VAL A 104 28.945 5.257 28.988 1.00 0.00 H new ATOM 0 HG12 VAL A 104 27.328 4.555 28.742 1.00 0.00 H new ATOM 0 HG13 VAL A 104 28.585 3.620 29.587 1.00 0.00 H new ATOM 0 HG21 VAL A 104 30.868 4.478 27.755 1.00 0.00 H new ATOM 0 HG22 VAL A 104 30.606 2.805 28.303 1.00 0.00 H new ATOM 0 HG23 VAL A 104 30.742 3.162 26.564 1.00 0.00 H new ATOM 1490 N ALA A 105 25.788 1.973 27.764 1.00 0.00 N ATOM 1491 CA ALA A 105 24.350 2.204 27.811 1.00 0.00 C ATOM 1492 C ALA A 105 24.083 3.555 28.479 1.00 0.00 C ATOM 1493 O ALA A 105 24.777 3.939 29.423 1.00 0.00 O ATOM 1494 CB ALA A 105 23.660 1.071 28.580 1.00 0.00 C ATOM 0 H ALA A 105 26.116 1.265 28.421 1.00 0.00 H new ATOM 0 HA ALA A 105 23.945 2.220 26.799 1.00 0.00 H new ATOM 0 HB1 ALA A 105 22.586 1.253 28.610 1.00 0.00 H new ATOM 0 HB2 ALA A 105 23.854 0.122 28.081 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.049 1.032 29.597 1.00 0.00 H new ATOM 1500 N THR A 106 23.055 4.258 28.010 1.00 0.00 N ATOM 1501 CA THR A 106 22.596 5.506 28.606 1.00 0.00 C ATOM 1502 C THR A 106 22.068 5.202 30.022 1.00 0.00 C ATOM 1503 O THR A 106 21.343 4.215 30.189 1.00 0.00 O ATOM 1504 CB THR A 106 21.516 6.124 27.697 1.00 0.00 C ATOM 1505 OG1 THR A 106 22.022 6.262 26.382 1.00 0.00 O ATOM 1506 CG2 THR A 106 21.057 7.512 28.155 1.00 0.00 C ATOM 0 H THR A 106 22.512 3.972 27.195 1.00 0.00 H new ATOM 0 HA THR A 106 23.405 6.231 28.695 1.00 0.00 H new ATOM 0 HB THR A 106 20.663 5.447 27.742 1.00 0.00 H new ATOM 0 HG1 THR A 106 22.002 5.392 25.931 1.00 0.00 H new ATOM 0 HG21 THR A 106 20.297 7.888 27.471 1.00 0.00 H new ATOM 0 HG22 THR A 106 20.639 7.444 29.160 1.00 0.00 H new ATOM 0 HG23 THR A 106 21.908 8.193 28.161 1.00 0.00 H new ATOM 1514 N PRO A 107 22.397 6.017 31.044 1.00 0.00 N ATOM 1515 CA PRO A 107 21.889 5.859 32.401 1.00 0.00 C ATOM 1516 C PRO A 107 20.419 6.308 32.476 1.00 0.00 C ATOM 1517 O PRO A 107 20.112 7.408 32.945 1.00 0.00 O ATOM 1518 CB PRO A 107 22.846 6.666 33.289 1.00 0.00 C ATOM 1519 CG PRO A 107 23.309 7.792 32.368 1.00 0.00 C ATOM 1520 CD PRO A 107 23.346 7.121 30.996 1.00 0.00 C ATOM 0 HA PRO A 107 21.870 4.823 32.741 1.00 0.00 H new ATOM 0 HB2 PRO A 107 22.344 7.052 34.176 1.00 0.00 H new ATOM 0 HB3 PRO A 107 23.683 6.059 33.635 1.00 0.00 H new ATOM 0 HG2 PRO A 107 22.620 8.637 32.386 1.00 0.00 H new ATOM 0 HG3 PRO A 107 24.288 8.173 32.657 1.00 0.00 H new ATOM 0 HD2 PRO A 107 23.077 7.829 30.212 1.00 0.00 H new ATOM 0 HD3 PRO A 107 24.349 6.760 30.769 1.00 0.00 H new ATOM 1528 N ALA A 108 19.507 5.469 31.982 1.00 0.00 N ATOM 1529 CA ALA A 108 18.071 5.708 31.966 1.00 0.00 C ATOM 1530 C ALA A 108 17.358 4.416 32.345 1.00 0.00 C ATOM 1531 O ALA A 108 17.690 3.348 31.824 1.00 0.00 O ATOM 1532 CB ALA A 108 17.636 6.155 30.564 1.00 0.00 C ATOM 0 H ALA A 108 19.762 4.573 31.568 1.00 0.00 H new ATOM 0 HA ALA A 108 17.815 6.493 32.678 1.00 0.00 H new ATOM 0 HB1 ALA A 108 16.561 6.333 30.556 1.00 0.00 H new ATOM 0 HB2 ALA A 108 18.158 7.074 30.297 1.00 0.00 H new ATOM 0 HB3 ALA A 108 17.880 5.376 29.842 1.00 0.00 H new ATOM 1538 N ALA A 109 16.341 4.519 33.205 1.00 0.00 N ATOM 1539 CA ALA A 109 15.555 3.376 33.669 1.00 0.00 C ATOM 1540 C ALA A 109 14.783 2.694 32.529 1.00 0.00 C ATOM 1541 O ALA A 109 14.388 1.536 32.668 1.00 0.00 O ATOM 1542 CB ALA A 109 14.590 3.833 34.769 1.00 0.00 C ATOM 0 H ALA A 109 16.038 5.408 33.602 1.00 0.00 H new ATOM 0 HA ALA A 109 16.248 2.635 34.067 1.00 0.00 H new ATOM 0 HB1 ALA A 109 14.004 2.982 35.115 1.00 0.00 H new ATOM 0 HB2 ALA A 109 15.158 4.246 35.603 1.00 0.00 H new ATOM 0 HB3 ALA A 109 13.921 4.597 34.372 1.00 0.00 H new ATOM 1548 N ALA A 110 14.566 3.395 31.407 1.00 0.00 N ATOM 1549 CA ALA A 110 13.954 2.818 30.217 1.00 0.00 C ATOM 1550 C ALA A 110 14.816 1.700 29.622 1.00 0.00 C ATOM 1551 O ALA A 110 14.264 0.776 29.025 1.00 0.00 O ATOM 1552 CB ALA A 110 13.720 3.915 29.172 1.00 0.00 C ATOM 0 H ALA A 110 14.813 4.379 31.306 1.00 0.00 H new ATOM 0 HA ALA A 110 13.000 2.379 30.508 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.262 3.480 28.284 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.058 4.676 29.585 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.673 4.370 28.903 1.00 0.00 H new ATOM 1558 N CYS A 111 16.142 1.740 29.786 1.00 0.00 N ATOM 1559 CA CYS A 111 16.993 0.658 29.316 1.00 0.00 C ATOM 1560 C CYS A 111 16.805 -0.559 30.223 1.00 0.00 C ATOM 1561 O CYS A 111 16.946 -0.456 31.444 1.00 0.00 O ATOM 1562 CB CYS A 111 18.458 1.110 29.287 1.00 0.00 C ATOM 1563 SG CYS A 111 19.655 -0.134 28.713 1.00 0.00 S ATOM 0 H CYS A 111 16.640 2.507 30.238 1.00 0.00 H new ATOM 0 HA CYS A 111 16.713 0.383 28.299 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.536 1.987 28.644 1.00 0.00 H new ATOM 0 HB3 CYS A 111 18.742 1.425 30.291 1.00 0.00 H new ATOM 1568 N LYS A 112 16.550 -1.721 29.618 1.00 0.00 N ATOM 1569 CA LYS A 112 16.527 -3.026 30.274 1.00 0.00 C ATOM 1570 C LYS A 112 17.424 -3.928 29.438 1.00 0.00 C ATOM 1571 O LYS A 112 17.219 -4.029 28.227 1.00 0.00 O ATOM 1572 CB LYS A 112 15.089 -3.571 30.308 1.00 0.00 C ATOM 1573 CG LYS A 112 14.167 -2.830 31.297 1.00 0.00 C ATOM 1574 CD LYS A 112 12.714 -2.759 30.804 1.00 0.00 C ATOM 1575 CE LYS A 112 12.620 -1.744 29.657 1.00 0.00 C ATOM 1576 NZ LYS A 112 11.263 -1.617 29.076 1.00 0.00 N ATOM 0 H LYS A 112 16.346 -1.779 28.620 1.00 0.00 H new ATOM 0 HA LYS A 112 16.875 -2.969 31.305 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.661 -3.505 29.308 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.117 -4.628 30.574 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.196 -3.334 32.263 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.544 -1.819 31.453 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.384 -3.741 30.465 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.054 -2.465 31.620 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.941 -0.768 30.021 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.316 -2.035 28.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.304 -1.020 28.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 10.905 -2.560 28.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.626 -1.182 29.774 1.00 0.00 H new ATOM 1590 N ILE A 113 18.414 -4.563 30.063 1.00 0.00 N ATOM 1591 CA ILE A 113 19.390 -5.407 29.396 1.00 0.00 C ATOM 1592 C ILE A 113 19.688 -6.627 30.271 1.00 0.00 C ATOM 1593 O ILE A 113 19.800 -6.494 31.494 1.00 0.00 O ATOM 1594 CB ILE A 113 20.635 -4.555 29.063 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.616 -5.356 28.184 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.366 -3.985 30.294 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.578 -4.469 27.382 1.00 0.00 C ATOM 0 H ILE A 113 18.559 -4.500 31.071 1.00 0.00 H new ATOM 0 HA ILE A 113 19.009 -5.796 28.451 1.00 0.00 H new ATOM 0 HB ILE A 113 20.259 -3.691 28.515 1.00 0.00 H new ATOM 0 HG12 ILE A 113 22.195 -6.027 28.818 1.00 0.00 H new ATOM 0 HG13 ILE A 113 21.048 -5.980 27.494 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.227 -3.401 29.968 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.686 -3.346 30.857 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.703 -4.804 30.929 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.240 -5.097 26.786 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.006 -3.816 26.723 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.172 -3.864 28.067 1.00 0.00 H new ATOM 1609 N SER A 114 19.832 -7.798 29.646 1.00 0.00 N ATOM 1610 CA SER A 114 20.119 -9.063 30.315 1.00 0.00 C ATOM 1611 C SER A 114 20.937 -9.953 29.376 1.00 0.00 C ATOM 1612 O SER A 114 20.711 -9.934 28.167 1.00 0.00 O ATOM 1613 CB SER A 114 18.801 -9.780 30.661 1.00 0.00 C ATOM 1614 OG SER A 114 17.924 -8.974 31.435 1.00 0.00 O ATOM 0 H SER A 114 19.749 -7.892 28.634 1.00 0.00 H new ATOM 0 HA SER A 114 20.679 -8.868 31.230 1.00 0.00 H new ATOM 0 HB2 SER A 114 18.299 -10.073 29.739 1.00 0.00 H new ATOM 0 HB3 SER A 114 19.024 -10.696 31.208 1.00 0.00 H new ATOM 0 HG SER A 114 17.103 -9.474 31.626 1.00 0.00 H new ATOM 1620 N GLY A 115 21.859 -10.745 29.936 1.00 0.00 N ATOM 1621 CA GLY A 115 22.584 -11.813 29.243 1.00 0.00 C ATOM 1622 C GLY A 115 23.444 -11.376 28.054 1.00 0.00 C ATOM 1623 O GLY A 115 23.734 -12.214 27.196 1.00 0.00 O ATOM 0 H GLY A 115 22.129 -10.656 30.916 1.00 0.00 H new ATOM 0 HA2 GLY A 115 23.226 -12.317 29.965 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.860 -12.548 28.892 1.00 0.00 H new ATOM 1627 N CYS A 116 23.824 -10.097 27.969 1.00 0.00 N ATOM 1628 CA CYS A 116 24.581 -9.560 26.841 1.00 0.00 C ATOM 1629 C CYS A 116 26.077 -9.491 27.129 1.00 0.00 C ATOM 1630 O CYS A 116 26.509 -9.415 28.283 1.00 0.00 O ATOM 1631 CB CYS A 116 24.075 -8.150 26.501 1.00 0.00 C ATOM 1632 SG CYS A 116 22.343 -8.067 25.988 1.00 0.00 S ATOM 0 H CYS A 116 23.612 -9.404 28.687 1.00 0.00 H new ATOM 0 HA CYS A 116 24.429 -10.237 26.000 1.00 0.00 H new ATOM 0 HB2 CYS A 116 24.212 -7.510 27.373 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.695 -7.739 25.704 1.00 0.00 H new ATOM 1637 N SER A 117 26.841 -9.424 26.044 1.00 0.00 N ATOM 1638 CA SER A 117 28.265 -9.131 25.994 1.00 0.00 C ATOM 1639 C SER A 117 28.419 -8.089 24.884 1.00 0.00 C ATOM 1640 O SER A 117 27.618 -8.079 23.947 1.00 0.00 O ATOM 1641 CB SER A 117 29.062 -10.407 25.683 1.00 0.00 C ATOM 1642 OG SER A 117 28.667 -11.492 26.501 1.00 0.00 O ATOM 0 H SER A 117 26.453 -9.584 25.114 1.00 0.00 H new ATOM 0 HA SER A 117 28.647 -8.758 26.944 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.924 -10.674 24.635 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.125 -10.214 25.826 1.00 0.00 H new ATOM 0 HG SER A 117 27.859 -11.904 26.130 1.00 0.00 H new ATOM 1648 N LEU A 118 29.400 -7.192 24.959 1.00 0.00 N ATOM 1649 CA LEU A 118 29.603 -6.175 23.928 1.00 0.00 C ATOM 1650 C LEU A 118 31.070 -5.770 23.849 1.00 0.00 C ATOM 1651 O LEU A 118 31.841 -6.026 24.778 1.00 0.00 O ATOM 1652 CB LEU A 118 28.626 -4.989 24.112 1.00 0.00 C ATOM 1653 CG LEU A 118 28.550 -4.319 25.501 1.00 0.00 C ATOM 1654 CD1 LEU A 118 29.771 -3.446 25.810 1.00 0.00 C ATOM 1655 CD2 LEU A 118 27.282 -3.459 25.565 1.00 0.00 C ATOM 0 H LEU A 118 30.070 -7.149 25.727 1.00 0.00 H new ATOM 0 HA LEU A 118 29.360 -6.600 22.954 1.00 0.00 H new ATOM 0 HB2 LEU A 118 28.893 -4.221 23.386 1.00 0.00 H new ATOM 0 HB3 LEU A 118 27.626 -5.338 23.855 1.00 0.00 H new ATOM 0 HG LEU A 118 28.528 -5.112 26.248 1.00 0.00 H new ATOM 0 HD11 LEU A 118 29.660 -3.002 26.799 1.00 0.00 H new ATOM 0 HD12 LEU A 118 30.672 -4.059 25.786 1.00 0.00 H new ATOM 0 HD13 LEU A 118 29.851 -2.655 25.064 1.00 0.00 H new ATOM 0 HD21 LEU A 118 27.216 -2.980 26.542 1.00 0.00 H new ATOM 0 HD22 LEU A 118 27.321 -2.695 24.788 1.00 0.00 H new ATOM 0 HD23 LEU A 118 26.406 -4.090 25.411 1.00 0.00 H new ATOM 1667 N SER A 119 31.437 -5.138 22.732 1.00 0.00 N ATOM 1668 CA SER A 119 32.826 -4.862 22.366 1.00 0.00 C ATOM 1669 C SER A 119 33.010 -3.460 21.761 1.00 0.00 C ATOM 1670 O SER A 119 34.083 -3.171 21.226 1.00 0.00 O ATOM 1671 CB SER A 119 33.315 -5.954 21.398 1.00 0.00 C ATOM 1672 OG SER A 119 33.027 -7.263 21.876 1.00 0.00 O ATOM 0 H SER A 119 30.764 -4.798 22.045 1.00 0.00 H new ATOM 0 HA SER A 119 33.429 -4.878 23.274 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.844 -5.812 20.425 1.00 0.00 H new ATOM 0 HB3 SER A 119 34.390 -5.851 21.250 1.00 0.00 H new ATOM 0 HG SER A 119 33.352 -7.926 21.231 1.00 0.00 H new ATOM 1678 N ALA A 120 31.995 -2.583 21.867 1.00 0.00 N ATOM 1679 CA ALA A 120 31.993 -1.237 21.285 1.00 0.00 C ATOM 1680 C ALA A 120 32.382 -1.281 19.794 1.00 0.00 C ATOM 1681 O ALA A 120 32.000 -2.217 19.082 1.00 0.00 O ATOM 1682 CB ALA A 120 32.869 -0.308 22.149 1.00 0.00 C ATOM 0 H ALA A 120 31.136 -2.800 22.372 1.00 0.00 H new ATOM 0 HA ALA A 120 30.988 -0.816 21.297 1.00 0.00 H new ATOM 0 HB1 ALA A 120 32.870 0.694 21.720 1.00 0.00 H new ATOM 0 HB2 ALA A 120 32.468 -0.268 23.162 1.00 0.00 H new ATOM 0 HB3 ALA A 120 33.889 -0.692 22.177 1.00 0.00 H new ATOM 1688 N MET A 121 33.109 -0.264 19.336 1.00 0.00 N ATOM 1689 CA MET A 121 33.771 -0.160 18.044 1.00 0.00 C ATOM 1690 C MET A 121 35.083 0.572 18.296 1.00 0.00 C ATOM 1691 O MET A 121 36.099 0.219 17.664 1.00 0.00 O ATOM 1692 CB MET A 121 32.910 0.623 17.039 1.00 0.00 C ATOM 1693 CG MET A 121 31.862 -0.242 16.334 1.00 0.00 C ATOM 1694 SD MET A 121 32.541 -1.581 15.313 1.00 0.00 S ATOM 1695 CE MET A 121 31.009 -2.157 14.541 1.00 0.00 C ATOM 1696 OXT MET A 121 35.104 1.485 19.153 1.00 0.00 O ATOM 0 H MET A 121 33.260 0.570 19.904 1.00 0.00 H new ATOM 0 HA MET A 121 33.936 -1.148 17.614 1.00 0.00 H new ATOM 0 HB2 MET A 121 32.407 1.438 17.560 1.00 0.00 H new ATOM 0 HB3 MET A 121 33.560 1.076 16.290 1.00 0.00 H new ATOM 0 HG2 MET A 121 31.204 -0.676 17.087 1.00 0.00 H new ATOM 0 HG3 MET A 121 31.246 0.400 15.704 1.00 0.00 H new ATOM 0 HE1 MET A 121 31.215 -3.043 13.940 1.00 0.00 H new ATOM 0 HE2 MET A 121 30.282 -2.404 15.315 1.00 0.00 H new ATOM 0 HE3 MET A 121 30.606 -1.371 13.902 1.00 0.00 H new TER 1706 MET A 121