USER MOD reduce.3.24.130724 H: found=0, std=0, add=1186, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1185 hydrogens (30 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: B 1 FME CE :methyl -143:sc= -0.541 (180deg=0) USER MOD Set 1.2: C 42 THR OG1 : rot 73:sc= 0.327 USER MOD Set 2.1: A 42 THR OG1 : rot 73:sc= 0.365 USER MOD Set 2.2: C 1 FME CE :methyl -141:sc= -0.61 (180deg=0) USER MOD Set 3.1: A 1 FME CE :methyl -143:sc= -0.377 (180deg=0) USER MOD Set 3.2: B 42 THR OG1 : rot 72:sc= 0.417 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.377 USER MOD Single : A 14 LYS NZ :NH3+ -170:sc=-0.00303 (180deg=-0.123) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot -27:sc= -3.26! USER MOD Single : A 30 SER OG : rot 60:sc= 0.0391 USER MOD Single : A 32 LYS NZ :NH3+ -176:sc= 1.25 (180deg=1.15) USER MOD Single : A 37 THR OG1 : rot -166:sc= -0.109 USER MOD Single : A 39 GLN : amide:sc= -0.346 X(o=-0.35,f=-0.48) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0.482 K(o=0.48,f=-0.7) USER MOD Single : A 49 LYS NZ :NH3+ -142:sc= 1.63 (180deg=0.894) USER MOD Single : A 50 HIS : no HD1:sc= -1.39 K(o=-1.4,f=-3.9!) USER MOD Single : A 52 ASN : amide:sc= -2.68! C(o=-2.7!,f=-3!) USER MOD Single : A 53 LYS NZ :NH3+ -157:sc= 1.21 (180deg=1.04) USER MOD Single : B 5 THR OG1 : rot 93:sc= -0.106 USER MOD Single : B 14 LYS NZ :NH3+ -173:sc=-0.00245 (180deg=-0.0753) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 180:sc= 0.0405 USER MOD Single : B 32 LYS NZ :NH3+ -179:sc= 1.27 (180deg=1.19) USER MOD Single : B 37 THR OG1 : rot -166:sc= -0.216 USER MOD Single : B 39 GLN : amide:sc= -0.384 X(o=-0.38,f=-0.61) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= 0.132 K(o=0.13,f=-0.64) USER MOD Single : B 49 LYS NZ :NH3+ -151:sc= 1.68 (180deg=0.692) USER MOD Single : B 50 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-4!) USER MOD Single : B 52 ASN : amide:sc= -3.04! C(o=-3!,f=-4.3!) USER MOD Single : B 53 LYS NZ :NH3+ -176:sc= 1.14 (180deg=1.01) USER MOD Single : C 5 THR OG1 : rot 180:sc= -0.253 USER MOD Single : C 14 LYS NZ :NH3+ -169:sc= -0.0227 (180deg=-0.171) USER MOD Single : C 24 THR OG1 : rot 180:sc= 0 USER MOD Single : C 30 SER OG : rot 180:sc= 0.0349 USER MOD Single : C 32 LYS NZ :NH3+ -171:sc= 1.27 (180deg=1.1) USER MOD Single : C 37 THR OG1 : rot -166:sc= -0.0713 USER MOD Single : C 39 GLN : amide:sc= -0.47 X(o=-0.47,f=-0.54) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 48 GLN : amide:sc= 0.2 K(o=0.2,f=-0.72) USER MOD Single : C 49 LYS NZ :NH3+ -154:sc= 1.61 (180deg=1.1) USER MOD Single : C 50 HIS : no HD1:sc= -1.3 K(o=-1.3,f=-3.9!) USER MOD Single : C 52 ASN : amide:sc= -2.74! C(o=-2.7!,f=-3.6!) USER MOD Single : C 53 LYS NZ :NH3+ -153:sc= 1.17 (180deg=1.08) USER MOD ----------------------------------------------------------------- HETATM 1 N FME A 1 2.097 -11.177 14.062 1.00 0.00 N HETATM 2 CN FME A 1 2.909 -10.330 14.676 1.00 0.00 C HETATM 3 O1 FME A 1 3.836 -10.714 15.390 1.00 0.00 O HETATM 4 CA FME A 1 1.005 -10.701 13.227 1.00 0.00 C HETATM 5 CB FME A 1 0.365 -11.875 12.482 1.00 0.00 C HETATM 6 CG FME A 1 -0.624 -11.463 11.403 1.00 0.00 C HETATM 7 SD FME A 1 -1.325 -12.884 10.539 1.00 0.00 S HETATM 8 CE FME A 1 -2.277 -12.072 9.258 1.00 0.00 C HETATM 9 C FME A 1 -0.030 -9.986 14.088 1.00 0.00 C HETATM 10 O FME A 1 -0.781 -10.620 14.828 1.00 0.00 O HETATM 0 HG3 FME A 1 -1.428 -10.881 11.853 1.00 0.00 H new HETATM 0 HG2 FME A 1 -0.125 -10.813 10.684 1.00 0.00 H new HETATM 0 HE3 FME A 1 -3.202 -12.623 9.087 1.00 0.00 H new HETATM 0 HE2 FME A 1 -2.514 -11.055 9.570 1.00 0.00 H new HETATM 0 HE1 FME A 1 -1.696 -12.043 8.336 1.00 0.00 H new HETATM 0 HCN FME A 1 2.752 -9.259 14.545 1.00 0.00 H new HETATM 0 HB3 FME A 1 1.153 -12.475 12.027 1.00 0.00 H new HETATM 0 HB2 FME A 1 -0.146 -12.513 13.203 1.00 0.00 H new HETATM 0 HA FME A 1 1.395 -9.997 12.492 1.00 0.00 H new HETATM 0 H FME A 1 2.240 -12.180 14.177 1.00 0.00 H new ATOM 21 N VAL A 2 -0.056 -8.665 13.995 1.00 0.00 N ATOM 22 CA VAL A 2 -0.945 -7.861 14.825 1.00 0.00 C ATOM 23 C VAL A 2 -2.117 -7.327 14.005 1.00 0.00 C ATOM 24 O VAL A 2 -3.126 -6.879 14.551 1.00 0.00 O ATOM 25 CB VAL A 2 -0.175 -6.683 15.473 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.322 -5.703 14.417 1.00 0.00 C ATOM 27 CG2 VAL A 2 -1.030 -5.973 16.512 1.00 0.00 C ATOM 0 H VAL A 2 0.527 -8.126 13.354 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.335 -8.503 15.615 1.00 0.00 H new ATOM 0 HB VAL A 2 0.695 -7.098 15.982 1.00 0.00 H new ATOM 0 HG11 VAL A 2 0.858 -4.887 14.902 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.991 -6.219 13.728 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.528 -5.301 13.865 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.463 -5.151 16.950 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.929 -5.581 16.037 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.311 -6.677 17.295 1.00 0.00 H new ATOM 37 N ILE A 3 -1.991 -7.402 12.693 1.00 0.00 N ATOM 38 CA ILE A 3 -3.022 -6.890 11.811 1.00 0.00 C ATOM 39 C ILE A 3 -3.641 -8.019 10.996 1.00 0.00 C ATOM 40 O ILE A 3 -2.941 -8.917 10.526 1.00 0.00 O ATOM 41 CB ILE A 3 -2.470 -5.793 10.867 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.603 -5.181 10.037 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.379 -6.353 9.961 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.164 -4.025 9.164 1.00 0.00 C ATOM 0 H ILE A 3 -1.187 -7.811 12.216 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.793 -6.440 12.436 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.028 -5.007 11.479 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.038 -5.956 9.406 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.389 -4.838 10.709 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.008 -5.563 9.308 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.560 -6.735 10.571 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.788 -7.162 9.356 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.020 -3.644 8.607 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.756 -3.231 9.790 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.399 -4.366 8.466 1.00 0.00 H new ATOM 56 N ALA A 4 -4.959 -8.004 10.895 1.00 0.00 N ATOM 57 CA ALA A 4 -5.668 -8.926 10.029 1.00 0.00 C ATOM 58 C ALA A 4 -6.528 -8.152 9.045 1.00 0.00 C ATOM 59 O ALA A 4 -7.019 -7.063 9.349 1.00 0.00 O ATOM 60 CB ALA A 4 -6.515 -9.884 10.850 1.00 0.00 C ATOM 0 H ALA A 4 -5.561 -7.359 11.406 1.00 0.00 H new ATOM 0 HA ALA A 4 -4.942 -9.515 9.469 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.040 -10.568 10.183 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -5.873 -10.453 11.522 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.241 -9.319 11.434 1.00 0.00 H new ATOM 66 N THR A 5 -6.697 -8.721 7.860 1.00 0.00 N ATOM 67 CA THR A 5 -7.407 -8.065 6.772 1.00 0.00 C ATOM 68 C THR A 5 -8.887 -7.878 7.103 1.00 0.00 C ATOM 69 O THR A 5 -9.586 -7.114 6.448 1.00 0.00 O ATOM 70 CB THR A 5 -7.267 -8.888 5.481 1.00 0.00 C ATOM 71 OG1 THR A 5 -5.999 -9.559 5.481 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.360 -7.994 4.254 1.00 0.00 C ATOM 0 H THR A 5 -6.346 -9.650 7.626 1.00 0.00 H new ATOM 0 HA THR A 5 -6.963 -7.080 6.630 1.00 0.00 H new ATOM 0 HB THR A 5 -8.078 -9.615 5.444 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.908 -10.086 4.660 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.258 -8.600 3.354 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.326 -7.489 4.244 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.563 -7.251 4.284 1.00 0.00 H new ATOM 80 N ASP A 6 -9.343 -8.549 8.153 1.00 0.00 N ATOM 81 CA ASP A 6 -10.745 -8.501 8.553 1.00 0.00 C ATOM 82 C ASP A 6 -11.048 -7.248 9.364 1.00 0.00 C ATOM 83 O ASP A 6 -12.193 -7.007 9.742 1.00 0.00 O ATOM 84 CB ASP A 6 -11.107 -9.740 9.375 1.00 0.00 C ATOM 85 CG ASP A 6 -10.999 -11.021 8.576 1.00 0.00 C ATOM 86 OD1 ASP A 6 -9.867 -11.508 8.376 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.045 -11.552 8.145 1.00 0.00 O ATOM 0 H ASP A 6 -8.758 -9.137 8.747 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.346 -8.478 7.644 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.450 -9.801 10.242 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.124 -9.636 9.753 1.00 0.00 H new ATOM 92 N ASP A 7 -10.021 -6.453 9.642 1.00 0.00 N ATOM 93 CA ASP A 7 -10.217 -5.193 10.350 1.00 0.00 C ATOM 94 C ASP A 7 -10.133 -4.012 9.390 1.00 0.00 C ATOM 95 O ASP A 7 -10.560 -2.904 9.714 1.00 0.00 O ATOM 96 CB ASP A 7 -9.158 -5.018 11.445 1.00 0.00 C ATOM 97 CG ASP A 7 -9.195 -6.114 12.489 1.00 0.00 C ATOM 98 OD1 ASP A 7 -10.069 -6.063 13.380 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.338 -7.019 12.439 1.00 0.00 O ATOM 0 H ASP A 7 -9.053 -6.655 9.391 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.209 -5.221 10.802 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.170 -4.995 10.986 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.305 -4.055 11.933 1.00 0.00 H new ATOM 104 N LEU A 8 -9.585 -4.247 8.206 1.00 0.00 N ATOM 105 CA LEU A 8 -9.420 -3.176 7.227 1.00 0.00 C ATOM 106 C LEU A 8 -10.293 -3.408 6.007 1.00 0.00 C ATOM 107 O LEU A 8 -10.629 -2.471 5.281 1.00 0.00 O ATOM 108 CB LEU A 8 -7.956 -3.032 6.806 1.00 0.00 C ATOM 109 CG LEU A 8 -7.042 -2.386 7.848 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.740 -3.347 8.988 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.758 -1.906 7.197 1.00 0.00 C ATOM 0 H LEU A 8 -9.249 -5.160 7.900 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.735 -2.248 7.705 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.565 -4.020 6.565 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.914 -2.440 5.891 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.563 -1.526 8.269 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.088 -2.859 9.712 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.671 -3.637 9.475 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.244 -4.234 8.594 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.117 -1.448 7.951 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.240 -2.752 6.746 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -5.993 -1.172 6.426 1.00 0.00 H new ATOM 123 N GLU A 9 -10.661 -4.657 5.797 1.00 0.00 N ATOM 124 CA GLU A 9 -11.557 -5.020 4.722 1.00 0.00 C ATOM 125 C GLU A 9 -12.726 -5.806 5.284 1.00 0.00 C ATOM 126 O GLU A 9 -12.549 -6.797 5.993 1.00 0.00 O ATOM 127 CB GLU A 9 -10.838 -5.822 3.636 1.00 0.00 C ATOM 128 CG GLU A 9 -9.808 -5.009 2.868 1.00 0.00 C ATOM 129 CD GLU A 9 -9.186 -5.773 1.715 1.00 0.00 C ATOM 130 OE1 GLU A 9 -9.193 -7.016 1.739 1.00 0.00 O ATOM 131 OE2 GLU A 9 -8.679 -5.123 0.776 1.00 0.00 O ATOM 0 H GLU A 9 -10.348 -5.444 6.365 1.00 0.00 H new ATOM 0 HA GLU A 9 -11.925 -4.106 4.256 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.345 -6.680 4.094 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.576 -6.215 2.936 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.281 -4.105 2.484 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.021 -4.691 3.552 1.00 0.00 H new ATOM 138 N VAL A 10 -13.915 -5.349 4.962 1.00 0.00 N ATOM 139 CA VAL A 10 -15.133 -5.939 5.470 1.00 0.00 C ATOM 140 C VAL A 10 -16.027 -6.305 4.298 1.00 0.00 C ATOM 141 O VAL A 10 -16.082 -5.582 3.304 1.00 0.00 O ATOM 142 CB VAL A 10 -15.866 -4.967 6.433 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.183 -3.644 5.748 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.135 -5.601 6.986 1.00 0.00 C ATOM 0 H VAL A 10 -14.065 -4.556 4.339 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.886 -6.836 6.038 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.194 -4.762 7.267 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -16.696 -2.985 6.449 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.256 -3.173 5.419 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -16.824 -3.825 4.885 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.629 -4.899 7.658 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.806 -5.850 6.164 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.880 -6.508 7.533 1.00 0.00 H new ATOM 154 N ALA A 11 -16.704 -7.434 4.398 1.00 0.00 N ATOM 155 CA ALA A 11 -17.552 -7.905 3.321 1.00 0.00 C ATOM 156 C ALA A 11 -18.692 -6.927 3.067 1.00 0.00 C ATOM 157 O ALA A 11 -19.386 -6.508 3.994 1.00 0.00 O ATOM 158 CB ALA A 11 -18.078 -9.286 3.680 1.00 0.00 C ATOM 0 H ALA A 11 -16.682 -8.042 5.216 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.974 -7.972 2.399 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.718 -9.652 2.877 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.241 -9.970 3.817 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.653 -9.227 4.604 1.00 0.00 H new ATOM 164 N CYS A 12 -18.863 -6.564 1.795 1.00 0.00 N ATOM 165 CA CYS A 12 -19.742 -5.482 1.368 1.00 0.00 C ATOM 166 C CYS A 12 -21.221 -5.762 1.692 1.00 0.00 C ATOM 167 O CYS A 12 -21.588 -6.911 1.898 1.00 0.00 O ATOM 168 CB CYS A 12 -19.530 -5.332 -0.146 1.00 0.00 C ATOM 169 SG CYS A 12 -20.428 -3.994 -0.954 1.00 0.00 S ATOM 0 H CYS A 12 -18.384 -7.024 1.021 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.498 -4.564 1.904 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -18.465 -5.188 -0.329 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -19.811 -6.270 -0.625 1.00 0.00 H new ATOM 174 N PRO A 13 -22.082 -4.725 1.764 1.00 0.00 N ATOM 175 CA PRO A 13 -23.523 -4.884 2.013 1.00 0.00 C ATOM 176 C PRO A 13 -24.175 -6.102 1.332 1.00 0.00 C ATOM 177 O PRO A 13 -25.001 -6.789 1.938 1.00 0.00 O ATOM 178 CB PRO A 13 -24.086 -3.597 1.414 1.00 0.00 C ATOM 179 CG PRO A 13 -23.048 -2.565 1.685 1.00 0.00 C ATOM 180 CD PRO A 13 -21.719 -3.292 1.672 1.00 0.00 C ATOM 0 HA PRO A 13 -23.721 -5.053 3.072 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.267 -3.705 0.345 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.038 -3.330 1.873 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.071 -1.781 0.928 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.219 -2.083 2.648 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.160 -3.081 0.760 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.091 -2.987 2.509 1.00 0.00 H new ATOM 188 N LYS A 14 -23.775 -6.395 0.094 1.00 0.00 N ATOM 189 CA LYS A 14 -24.550 -7.317 -0.736 1.00 0.00 C ATOM 190 C LYS A 14 -23.697 -8.184 -1.678 1.00 0.00 C ATOM 191 O LYS A 14 -24.122 -9.272 -2.055 1.00 0.00 O ATOM 192 CB LYS A 14 -25.583 -6.501 -1.536 1.00 0.00 C ATOM 193 CG LYS A 14 -26.565 -7.324 -2.370 1.00 0.00 C ATOM 194 CD LYS A 14 -26.068 -7.514 -3.801 1.00 0.00 C ATOM 195 CE LYS A 14 -27.073 -8.277 -4.650 1.00 0.00 C ATOM 196 NZ LYS A 14 -27.317 -9.646 -4.129 1.00 0.00 N ATOM 0 H LYS A 14 -22.938 -6.017 -0.349 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.040 -8.024 -0.067 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.152 -5.884 -0.840 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.049 -5.822 -2.200 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -26.712 -8.298 -1.903 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.535 -6.828 -2.384 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -25.876 -6.540 -4.252 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -25.120 -8.052 -3.788 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.014 -7.727 -4.679 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -26.708 -8.339 -5.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -27.871 -10.188 -4.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -26.407 -10.122 -3.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -27.844 -9.588 -3.234 1.00 0.00 H new ATOM 210 N CYS A 15 -22.513 -7.733 -2.090 1.00 0.00 N ATOM 211 CA CYS A 15 -21.779 -8.486 -3.121 1.00 0.00 C ATOM 212 C CYS A 15 -20.420 -9.019 -2.683 1.00 0.00 C ATOM 213 O CYS A 15 -19.454 -8.955 -3.449 1.00 0.00 O ATOM 214 CB CYS A 15 -21.535 -7.566 -4.311 1.00 0.00 C ATOM 215 SG CYS A 15 -20.727 -6.002 -3.878 1.00 0.00 S ATOM 0 H CYS A 15 -22.053 -6.889 -1.748 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.403 -9.349 -3.354 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -20.921 -8.090 -5.043 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.489 -7.350 -4.792 1.00 0.00 H new ATOM 220 N GLU A 16 -20.356 -9.638 -1.527 1.00 0.00 N ATOM 221 CA GLU A 16 -19.093 -10.089 -0.973 1.00 0.00 C ATOM 222 C GLU A 16 -18.773 -11.503 -1.404 1.00 0.00 C ATOM 223 O GLU A 16 -18.004 -12.203 -0.743 1.00 0.00 O ATOM 224 CB GLU A 16 -19.155 -10.064 0.552 1.00 0.00 C ATOM 225 CG GLU A 16 -20.375 -9.369 1.126 1.00 0.00 C ATOM 226 CD GLU A 16 -21.596 -10.266 1.150 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.247 -10.406 0.102 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.897 -10.843 2.216 1.00 0.00 O ATOM 0 H GLU A 16 -21.168 -9.844 -0.946 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.318 -9.416 -1.341 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.132 -11.090 0.920 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.260 -9.569 0.930 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.155 -9.033 2.139 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.593 -8.479 0.536 1.00 0.00 H new ATOM 235 N ARG A 17 -19.341 -11.927 -2.521 1.00 0.00 N ATOM 236 CA ARG A 17 -19.167 -13.282 -2.986 1.00 0.00 C ATOM 237 C ARG A 17 -19.199 -13.249 -4.514 1.00 0.00 C ATOM 238 O ARG A 17 -18.793 -14.195 -5.186 1.00 0.00 O ATOM 239 CB ARG A 17 -20.238 -14.239 -2.431 1.00 0.00 C ATOM 240 CG ARG A 17 -21.661 -13.989 -2.922 1.00 0.00 C ATOM 241 CD ARG A 17 -22.403 -12.963 -2.074 1.00 0.00 C ATOM 242 NE ARG A 17 -23.844 -13.012 -2.325 1.00 0.00 N ATOM 243 CZ ARG A 17 -24.770 -12.453 -1.540 1.00 0.00 C ATOM 244 NH1 ARG A 17 -24.420 -11.699 -0.508 1.00 0.00 N ATOM 245 NH2 ARG A 17 -26.054 -12.635 -1.810 1.00 0.00 N ATOM 0 H ARG A 17 -19.927 -11.346 -3.120 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.214 -13.668 -2.625 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -19.957 -15.260 -2.690 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.231 -14.173 -1.343 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.629 -13.645 -3.956 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.214 -14.928 -2.915 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -22.208 -13.151 -1.018 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.026 -11.964 -2.295 1.00 0.00 H new ATOM 0 HE ARG A 17 -24.164 -13.507 -3.157 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -23.433 -11.539 -0.305 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -25.137 -11.278 0.083 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -26.331 -13.199 -2.613 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -26.765 -12.211 -1.215 1.00 0.00 H new ATOM 259 N ALA A 18 -19.691 -12.121 -5.055 1.00 0.00 N ATOM 260 CA ALA A 18 -19.930 -12.004 -6.487 1.00 0.00 C ATOM 261 C ALA A 18 -19.041 -10.948 -7.132 1.00 0.00 C ATOM 262 O ALA A 18 -18.529 -11.144 -8.231 1.00 0.00 O ATOM 263 CB ALA A 18 -21.394 -11.685 -6.753 1.00 0.00 C ATOM 0 H ALA A 18 -19.927 -11.287 -4.518 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.679 -12.965 -6.937 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.559 -11.600 -7.827 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -22.019 -12.483 -6.352 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.655 -10.743 -6.271 1.00 0.00 H new ATOM 269 N GLY A 19 -18.851 -9.831 -6.437 1.00 0.00 N ATOM 270 CA GLY A 19 -18.062 -8.747 -6.989 1.00 0.00 C ATOM 271 C GLY A 19 -18.895 -7.785 -7.814 1.00 0.00 C ATOM 272 O GLY A 19 -18.357 -6.953 -8.538 1.00 0.00 O ATOM 0 H GLY A 19 -19.228 -9.658 -5.505 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.581 -8.202 -6.177 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.267 -9.160 -7.610 1.00 0.00 H new ATOM 276 N GLU A 20 -20.208 -7.857 -7.662 1.00 0.00 N ATOM 277 CA GLU A 20 -21.113 -7.058 -8.478 1.00 0.00 C ATOM 278 C GLU A 20 -22.437 -6.852 -7.754 1.00 0.00 C ATOM 279 O GLU A 20 -22.758 -7.586 -6.825 1.00 0.00 O ATOM 280 CB GLU A 20 -21.369 -7.742 -9.820 1.00 0.00 C ATOM 281 CG GLU A 20 -21.974 -9.125 -9.669 1.00 0.00 C ATOM 282 CD GLU A 20 -22.915 -9.481 -10.797 1.00 0.00 C ATOM 283 OE1 GLU A 20 -22.440 -9.815 -11.903 1.00 0.00 O ATOM 284 OE2 GLU A 20 -24.144 -9.445 -10.576 1.00 0.00 O ATOM 0 H GLU A 20 -20.672 -8.460 -6.982 1.00 0.00 H new ATOM 0 HA GLU A 20 -20.645 -6.089 -8.655 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.037 -7.121 -10.417 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -20.430 -7.819 -10.368 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.173 -9.863 -9.624 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.512 -9.179 -8.723 1.00 0.00 H new ATOM 291 N ILE A 21 -23.200 -5.861 -8.189 1.00 0.00 N ATOM 292 CA ILE A 21 -24.520 -5.599 -7.631 1.00 0.00 C ATOM 293 C ILE A 21 -25.459 -5.195 -8.755 1.00 0.00 C ATOM 294 O ILE A 21 -25.208 -4.221 -9.457 1.00 0.00 O ATOM 295 CB ILE A 21 -24.520 -4.509 -6.524 1.00 0.00 C ATOM 296 CG1 ILE A 21 -23.752 -5.003 -5.288 1.00 0.00 C ATOM 297 CG2 ILE A 21 -25.948 -4.128 -6.148 1.00 0.00 C ATOM 298 CD1 ILE A 21 -23.903 -4.124 -4.058 1.00 0.00 C ATOM 0 H ILE A 21 -22.926 -5.219 -8.933 1.00 0.00 H new ATOM 0 HA ILE A 21 -24.856 -6.519 -7.152 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.019 -3.622 -6.912 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.092 -6.009 -5.043 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -22.694 -5.076 -5.539 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -25.928 -3.363 -5.371 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -26.464 -3.740 -7.026 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -26.474 -5.008 -5.777 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.328 -4.548 -3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -23.535 -3.122 -4.279 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.955 -4.070 -3.776 1.00 0.00 H new ATOM 310 N GLU A 22 -26.536 -5.953 -8.905 1.00 0.00 N ATOM 311 CA GLU A 22 -27.474 -5.774 -10.008 1.00 0.00 C ATOM 312 C GLU A 22 -26.753 -5.848 -11.347 1.00 0.00 C ATOM 313 O GLU A 22 -27.011 -5.052 -12.249 1.00 0.00 O ATOM 314 CB GLU A 22 -28.174 -4.425 -9.868 1.00 0.00 C ATOM 315 CG GLU A 22 -29.554 -4.384 -10.504 1.00 0.00 C ATOM 316 CD GLU A 22 -30.501 -3.459 -9.779 1.00 0.00 C ATOM 317 OE1 GLU A 22 -30.475 -2.241 -10.038 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.291 -3.956 -8.949 1.00 0.00 O ATOM 0 H GLU A 22 -26.785 -6.709 -8.267 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.213 -6.574 -9.972 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.264 -4.180 -8.810 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -27.551 -3.654 -10.322 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -29.462 -4.063 -11.542 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -29.974 -5.390 -10.517 1.00 0.00 H new ATOM 325 N GLY A 23 -25.830 -6.797 -11.467 1.00 0.00 N ATOM 326 CA GLY A 23 -25.014 -6.897 -12.666 1.00 0.00 C ATOM 327 C GLY A 23 -24.232 -5.637 -12.950 1.00 0.00 C ATOM 328 O GLY A 23 -23.639 -5.485 -14.021 1.00 0.00 O ATOM 0 H GLY A 23 -25.631 -7.500 -10.755 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.322 -7.732 -12.560 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -25.655 -7.121 -13.518 1.00 0.00 H new ATOM 332 N THR A 24 -24.224 -4.746 -11.987 1.00 0.00 N ATOM 333 CA THR A 24 -23.665 -3.432 -12.146 1.00 0.00 C ATOM 334 C THR A 24 -22.520 -3.211 -11.145 1.00 0.00 C ATOM 335 O THR A 24 -22.540 -3.757 -10.036 1.00 0.00 O ATOM 336 CB THR A 24 -24.827 -2.435 -11.965 1.00 0.00 C ATOM 337 OG1 THR A 24 -25.358 -2.073 -13.246 1.00 0.00 O ATOM 338 CG2 THR A 24 -24.445 -1.184 -11.183 1.00 0.00 C ATOM 0 H THR A 24 -24.612 -4.920 -11.060 1.00 0.00 H new ATOM 0 HA THR A 24 -23.220 -3.293 -13.131 1.00 0.00 H new ATOM 0 HB THR A 24 -25.584 -2.945 -11.370 1.00 0.00 H new ATOM 0 HG1 THR A 24 -26.097 -1.441 -13.127 1.00 0.00 H new ATOM 0 HG21 THR A 24 -25.313 -0.530 -11.096 1.00 0.00 H new ATOM 0 HG22 THR A 24 -24.103 -1.467 -10.188 1.00 0.00 H new ATOM 0 HG23 THR A 24 -23.645 -0.658 -11.705 1.00 0.00 H new ATOM 346 N PRO A 25 -21.477 -2.455 -11.551 1.00 0.00 N ATOM 347 CA PRO A 25 -20.299 -2.198 -10.713 1.00 0.00 C ATOM 348 C PRO A 25 -20.667 -1.560 -9.378 1.00 0.00 C ATOM 349 O PRO A 25 -21.335 -0.528 -9.322 1.00 0.00 O ATOM 350 CB PRO A 25 -19.443 -1.246 -11.559 1.00 0.00 C ATOM 351 CG PRO A 25 -20.380 -0.688 -12.571 1.00 0.00 C ATOM 352 CD PRO A 25 -21.366 -1.784 -12.855 1.00 0.00 C ATOM 0 HA PRO A 25 -19.780 -3.120 -10.450 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -19.007 -0.457 -10.947 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -18.617 -1.774 -12.034 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -20.882 0.202 -12.192 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -19.849 -0.394 -13.476 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -22.325 -1.390 -13.192 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -21.009 -2.461 -13.631 1.00 0.00 H new ATOM 360 N CYS A 26 -20.211 -2.191 -8.308 1.00 0.00 N ATOM 361 CA CYS A 26 -20.622 -1.833 -6.962 1.00 0.00 C ATOM 362 C CYS A 26 -19.911 -0.581 -6.429 1.00 0.00 C ATOM 363 O CYS A 26 -18.696 -0.443 -6.561 1.00 0.00 O ATOM 364 CB CYS A 26 -20.369 -3.024 -6.048 1.00 0.00 C ATOM 365 SG CYS A 26 -20.833 -2.763 -4.304 1.00 0.00 S ATOM 0 H CYS A 26 -19.547 -2.964 -8.349 1.00 0.00 H new ATOM 0 HA CYS A 26 -21.683 -1.585 -6.986 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -20.921 -3.882 -6.432 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.310 -3.280 -6.093 1.00 0.00 H new ATOM 370 N PRO A 27 -20.702 0.310 -5.780 1.00 0.00 N ATOM 371 CA PRO A 27 -20.285 1.608 -5.220 1.00 0.00 C ATOM 372 C PRO A 27 -18.817 1.732 -4.790 1.00 0.00 C ATOM 373 O PRO A 27 -18.086 2.590 -5.281 1.00 0.00 O ATOM 374 CB PRO A 27 -21.183 1.697 -3.986 1.00 0.00 C ATOM 375 CG PRO A 27 -22.459 1.015 -4.365 1.00 0.00 C ATOM 376 CD PRO A 27 -22.150 0.121 -5.555 1.00 0.00 C ATOM 0 HA PRO A 27 -20.376 2.394 -5.970 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -20.719 1.211 -3.128 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -21.362 2.735 -3.706 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -22.844 0.428 -3.532 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.226 1.746 -4.621 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -22.388 -0.921 -5.343 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -22.731 0.409 -6.431 1.00 0.00 H new ATOM 384 N ALA A 28 -18.389 0.855 -3.889 1.00 0.00 N ATOM 385 CA ALA A 28 -17.107 1.033 -3.209 1.00 0.00 C ATOM 386 C ALA A 28 -16.200 -0.175 -3.387 1.00 0.00 C ATOM 387 O ALA A 28 -15.044 -0.167 -2.974 1.00 0.00 O ATOM 388 CB ALA A 28 -17.334 1.312 -1.731 1.00 0.00 C ATOM 0 H ALA A 28 -18.904 0.019 -3.613 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.606 1.888 -3.663 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -16.373 1.443 -1.234 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -17.927 2.220 -1.619 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -17.865 0.474 -1.280 1.00 0.00 H new ATOM 394 N CYS A 29 -16.735 -1.226 -3.977 1.00 0.00 N ATOM 395 CA CYS A 29 -15.955 -2.420 -4.245 1.00 0.00 C ATOM 396 C CYS A 29 -16.166 -2.854 -5.688 1.00 0.00 C ATOM 397 O CYS A 29 -17.128 -3.567 -5.996 1.00 0.00 O ATOM 398 CB CYS A 29 -16.343 -3.539 -3.266 1.00 0.00 C ATOM 399 SG CYS A 29 -18.068 -4.077 -3.382 1.00 0.00 S ATOM 0 H CYS A 29 -17.707 -1.278 -4.280 1.00 0.00 H new ATOM 0 HA CYS A 29 -14.897 -2.203 -4.101 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -15.696 -4.398 -3.442 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.150 -3.197 -2.249 1.00 0.00 H new ATOM 0 HG CYS A 29 -18.797 -3.102 -3.837 1.00 0.00 H new ATOM 404 N SER A 30 -15.290 -2.405 -6.578 1.00 0.00 N ATOM 405 CA SER A 30 -15.414 -2.683 -8.003 1.00 0.00 C ATOM 406 C SER A 30 -15.004 -4.116 -8.347 1.00 0.00 C ATOM 407 O SER A 30 -14.152 -4.347 -9.205 1.00 0.00 O ATOM 408 CB SER A 30 -14.570 -1.675 -8.790 1.00 0.00 C ATOM 409 OG SER A 30 -13.293 -1.502 -8.190 1.00 0.00 O ATOM 0 H SER A 30 -14.477 -1.840 -6.334 1.00 0.00 H new ATOM 0 HA SER A 30 -16.463 -2.581 -8.281 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.450 -2.019 -9.817 1.00 0.00 H new ATOM 0 HB3 SER A 30 -15.088 -0.717 -8.834 1.00 0.00 H new ATOM 0 HG SER A 30 -12.821 -2.360 -8.173 1.00 0.00 H new ATOM 415 N GLY A 31 -15.615 -5.075 -7.667 1.00 0.00 N ATOM 416 CA GLY A 31 -15.407 -6.463 -8.004 1.00 0.00 C ATOM 417 C GLY A 31 -14.368 -7.138 -7.143 1.00 0.00 C ATOM 418 O GLY A 31 -13.483 -7.820 -7.657 1.00 0.00 O ATOM 0 H GLY A 31 -16.252 -4.913 -6.887 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.352 -6.998 -7.908 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.105 -6.534 -9.049 1.00 0.00 H new ATOM 422 N LYS A 32 -14.465 -6.963 -5.829 1.00 0.00 N ATOM 423 CA LYS A 32 -13.569 -7.638 -4.904 1.00 0.00 C ATOM 424 C LYS A 32 -14.382 -8.586 -4.032 1.00 0.00 C ATOM 425 O LYS A 32 -14.046 -9.752 -3.859 1.00 0.00 O ATOM 426 CB LYS A 32 -12.882 -6.628 -3.983 1.00 0.00 C ATOM 427 CG LYS A 32 -12.512 -5.319 -4.644 1.00 0.00 C ATOM 428 CD LYS A 32 -11.958 -4.348 -3.620 1.00 0.00 C ATOM 429 CE LYS A 32 -11.819 -2.956 -4.191 1.00 0.00 C ATOM 430 NZ LYS A 32 -10.875 -2.910 -5.343 1.00 0.00 N ATOM 0 H LYS A 32 -15.156 -6.359 -5.383 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.817 -8.176 -5.481 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.540 -6.420 -3.139 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.978 -7.083 -3.578 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.772 -5.495 -5.425 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -13.389 -4.887 -5.127 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -12.615 -4.321 -2.751 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.986 -4.699 -3.274 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.797 -2.597 -4.511 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.471 -2.279 -3.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -10.760 -1.926 -5.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.952 -3.290 -5.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.253 -3.482 -6.125 1.00 0.00 H new ATOM 444 N GLY A 33 -15.484 -8.052 -3.504 1.00 0.00 N ATOM 445 CA GLY A 33 -16.275 -8.742 -2.525 1.00 0.00 C ATOM 446 C GLY A 33 -16.321 -7.950 -1.237 1.00 0.00 C ATOM 447 O GLY A 33 -17.373 -7.804 -0.618 1.00 0.00 O ATOM 0 H GLY A 33 -15.840 -7.129 -3.753 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.286 -8.892 -2.904 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.854 -9.730 -2.338 1.00 0.00 H new ATOM 451 N VAL A 34 -15.192 -7.355 -0.881 1.00 0.00 N ATOM 452 CA VAL A 34 -15.082 -6.610 0.366 1.00 0.00 C ATOM 453 C VAL A 34 -14.871 -5.118 0.119 1.00 0.00 C ATOM 454 O VAL A 34 -14.503 -4.700 -0.984 1.00 0.00 O ATOM 455 CB VAL A 34 -13.922 -7.144 1.233 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.178 -8.584 1.654 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.597 -7.034 0.490 1.00 0.00 C ATOM 0 H VAL A 34 -14.338 -7.373 -1.438 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.025 -6.749 0.894 1.00 0.00 H new ATOM 0 HB VAL A 34 -13.864 -6.530 2.132 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.347 -8.938 2.264 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.100 -8.635 2.233 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.270 -9.211 0.767 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.794 -7.416 1.120 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.646 -7.617 -0.429 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.402 -5.990 0.247 1.00 0.00 H new ATOM 467 N ILE A 35 -15.147 -4.327 1.147 1.00 0.00 N ATOM 468 CA ILE A 35 -14.885 -2.894 1.135 1.00 0.00 C ATOM 469 C ILE A 35 -14.016 -2.514 2.330 1.00 0.00 C ATOM 470 O ILE A 35 -13.799 -3.321 3.228 1.00 0.00 O ATOM 471 CB ILE A 35 -16.189 -2.064 1.180 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.081 -2.532 2.330 1.00 0.00 C ATOM 473 CG2 ILE A 35 -16.928 -2.148 -0.145 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.339 -1.708 2.506 1.00 0.00 C ATOM 0 H ILE A 35 -15.561 -4.663 2.017 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.369 -2.669 0.202 1.00 0.00 H new ATOM 0 HB ILE A 35 -15.926 -1.021 1.353 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.360 -3.572 2.160 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.507 -2.504 3.256 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -17.842 -1.557 -0.090 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.292 -1.761 -0.941 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.180 -3.187 -0.356 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -18.918 -2.102 3.341 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.070 -0.671 2.709 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -18.936 -1.756 1.595 1.00 0.00 H new ATOM 486 N LEU A 36 -13.525 -1.287 2.330 1.00 0.00 N ATOM 487 CA LEU A 36 -12.577 -0.840 3.346 1.00 0.00 C ATOM 488 C LEU A 36 -13.257 -0.264 4.586 1.00 0.00 C ATOM 489 O LEU A 36 -14.432 0.109 4.564 1.00 0.00 O ATOM 490 CB LEU A 36 -11.641 0.213 2.751 1.00 0.00 C ATOM 491 CG LEU A 36 -10.994 -0.185 1.426 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.765 0.389 0.246 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.545 0.252 1.395 1.00 0.00 C ATOM 0 H LEU A 36 -13.765 -0.578 1.637 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.017 -1.720 3.662 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.202 1.136 2.603 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.854 0.430 3.473 1.00 0.00 H new ATOM 0 HG LEU A 36 -11.026 -1.271 1.342 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.282 0.090 -0.684 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.788 0.012 0.262 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.778 1.477 0.314 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.098 -0.039 0.445 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.489 1.335 1.506 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.004 -0.225 2.212 1.00 0.00 H new ATOM 505 N THR A 37 -12.481 -0.202 5.665 1.00 0.00 N ATOM 506 CA THR A 37 -12.889 0.453 6.899 1.00 0.00 C ATOM 507 C THR A 37 -12.138 1.774 7.010 1.00 0.00 C ATOM 508 O THR A 37 -11.383 2.106 6.110 1.00 0.00 O ATOM 509 CB THR A 37 -12.561 -0.419 8.130 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.139 -0.596 8.242 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.226 -1.782 8.028 1.00 0.00 C ATOM 0 H THR A 37 -11.546 -0.608 5.705 1.00 0.00 H new ATOM 0 HA THR A 37 -13.967 0.615 6.875 1.00 0.00 H new ATOM 0 HB THR A 37 -12.942 0.092 9.014 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.948 -1.319 8.876 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.978 -2.375 8.908 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.307 -1.656 7.969 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.871 -2.294 7.134 1.00 0.00 H new ATOM 519 N ALA A 38 -12.312 2.517 8.094 1.00 0.00 N ATOM 520 CA ALA A 38 -11.635 3.806 8.238 1.00 0.00 C ATOM 521 C ALA A 38 -10.118 3.641 8.208 1.00 0.00 C ATOM 522 O ALA A 38 -9.424 4.382 7.509 1.00 0.00 O ATOM 523 CB ALA A 38 -12.072 4.508 9.508 1.00 0.00 C ATOM 0 H ALA A 38 -12.908 2.257 8.880 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.921 4.426 7.389 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.555 5.464 9.592 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.148 4.679 9.477 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.828 3.887 10.370 1.00 0.00 H new ATOM 529 N GLN A 39 -9.603 2.672 8.963 1.00 0.00 N ATOM 530 CA GLN A 39 -8.179 2.363 8.920 1.00 0.00 C ATOM 531 C GLN A 39 -7.767 1.945 7.511 1.00 0.00 C ATOM 532 O GLN A 39 -6.700 2.320 7.028 1.00 0.00 O ATOM 533 CB GLN A 39 -7.822 1.260 9.922 1.00 0.00 C ATOM 534 CG GLN A 39 -6.330 0.960 9.968 1.00 0.00 C ATOM 535 CD GLN A 39 -5.964 -0.122 10.964 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.627 -0.300 11.985 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.895 -0.846 10.672 1.00 0.00 N ATOM 0 H GLN A 39 -10.146 2.094 9.605 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.632 3.265 9.196 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.158 1.556 10.916 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.362 0.350 9.661 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -5.997 0.657 8.975 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.791 1.873 10.220 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.375 -0.664 9.814 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.592 -1.586 11.305 1.00 0.00 H new ATOM 546 N GLY A 40 -8.632 1.181 6.849 1.00 0.00 N ATOM 547 CA GLY A 40 -8.365 0.769 5.486 1.00 0.00 C ATOM 548 C GLY A 40 -8.433 1.936 4.521 1.00 0.00 C ATOM 549 O GLY A 40 -7.697 1.988 3.540 1.00 0.00 O ATOM 0 H GLY A 40 -9.513 0.841 7.234 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.378 0.310 5.432 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.087 0.009 5.188 1.00 0.00 H new ATOM 553 N TYR A 41 -9.304 2.887 4.821 1.00 0.00 N ATOM 554 CA TYR A 41 -9.472 4.072 3.995 1.00 0.00 C ATOM 555 C TYR A 41 -8.267 4.990 4.086 1.00 0.00 C ATOM 556 O TYR A 41 -7.888 5.619 3.096 1.00 0.00 O ATOM 557 CB TYR A 41 -10.731 4.829 4.434 1.00 0.00 C ATOM 558 CG TYR A 41 -11.975 4.499 3.638 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.183 5.049 2.380 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.946 3.647 4.147 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.320 4.758 1.653 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.085 3.350 3.426 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.267 3.908 2.181 1.00 0.00 C ATOM 564 OH TYR A 41 -15.402 3.618 1.459 1.00 0.00 O ATOM 0 H TYR A 41 -9.912 2.860 5.640 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.572 3.750 2.958 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.921 4.613 5.485 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.540 5.899 4.358 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.443 5.716 1.963 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.808 3.209 5.124 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.466 5.194 0.676 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.829 2.684 3.836 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.967 3.003 1.971 1.00 0.00 H new ATOM 574 N THR A 42 -7.643 5.046 5.250 1.00 0.00 N ATOM 575 CA THR A 42 -6.441 5.847 5.422 1.00 0.00 C ATOM 576 C THR A 42 -5.278 5.227 4.662 1.00 0.00 C ATOM 577 O THR A 42 -4.418 5.927 4.115 1.00 0.00 O ATOM 578 CB THR A 42 -6.071 5.946 6.910 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.216 6.359 7.658 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.932 6.931 7.131 1.00 0.00 C ATOM 0 H THR A 42 -7.946 4.549 6.088 1.00 0.00 H new ATOM 0 HA THR A 42 -6.641 6.845 5.031 1.00 0.00 H new ATOM 0 HB THR A 42 -5.740 4.964 7.248 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.855 5.618 7.714 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.693 6.979 8.193 1.00 0.00 H new ATOM 0 HG22 THR A 42 -4.053 6.602 6.576 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.232 7.919 6.782 1.00 0.00 H new ATOM 588 N LEU A 43 -5.294 3.909 4.570 1.00 0.00 N ATOM 589 CA LEU A 43 -4.214 3.191 3.932 1.00 0.00 C ATOM 590 C LEU A 43 -4.451 3.128 2.438 1.00 0.00 C ATOM 591 O LEU A 43 -3.504 2.981 1.675 1.00 0.00 O ATOM 592 CB LEU A 43 -4.080 1.767 4.494 1.00 0.00 C ATOM 593 CG LEU A 43 -3.010 1.555 5.582 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.192 2.542 6.722 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.079 0.132 6.108 1.00 0.00 C ATOM 0 H LEU A 43 -6.044 3.318 4.930 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.287 3.726 4.136 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.046 1.469 4.903 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -3.863 1.092 3.666 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.030 1.725 5.137 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.424 2.372 7.477 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.106 3.559 6.340 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.177 2.405 7.168 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.319 -0.009 6.877 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.065 -0.051 6.535 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.902 -0.567 5.291 1.00 0.00 H new ATOM 607 N LEU A 44 -5.699 3.295 1.999 1.00 0.00 N ATOM 608 CA LEU A 44 -6.003 3.173 0.587 1.00 0.00 C ATOM 609 C LEU A 44 -5.588 4.444 -0.138 1.00 0.00 C ATOM 610 O LEU A 44 -4.958 4.384 -1.181 1.00 0.00 O ATOM 611 CB LEU A 44 -7.501 2.841 0.367 1.00 0.00 C ATOM 612 CG LEU A 44 -8.487 4.016 0.174 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.392 4.609 -1.228 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.914 3.557 0.409 1.00 0.00 C ATOM 0 H LEU A 44 -6.498 3.511 2.595 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.434 2.343 0.169 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.574 2.197 -0.509 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.842 2.257 1.222 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.214 4.781 0.900 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.100 5.432 -1.324 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.381 4.979 -1.399 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.627 3.841 -1.965 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.594 4.397 0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.163 2.766 -0.299 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.011 3.177 1.426 1.00 0.00 H new ATOM 626 N ASP A 45 -5.913 5.598 0.432 1.00 0.00 N ATOM 627 CA ASP A 45 -5.635 6.870 -0.226 1.00 0.00 C ATOM 628 C ASP A 45 -4.143 7.158 -0.218 1.00 0.00 C ATOM 629 O ASP A 45 -3.634 7.914 -1.048 1.00 0.00 O ATOM 630 CB ASP A 45 -6.398 7.998 0.464 1.00 0.00 C ATOM 631 CG ASP A 45 -6.343 9.294 -0.316 1.00 0.00 C ATOM 632 OD1 ASP A 45 -7.163 9.460 -1.244 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.489 10.147 -0.010 1.00 0.00 O ATOM 0 H ASP A 45 -6.366 5.680 1.342 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.968 6.806 -1.262 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.438 7.701 0.597 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.983 8.158 1.459 1.00 0.00 H new ATOM 638 N PHE A 46 -3.442 6.517 0.699 1.00 0.00 N ATOM 639 CA PHE A 46 -1.991 6.580 0.743 1.00 0.00 C ATOM 640 C PHE A 46 -1.395 5.711 -0.347 1.00 0.00 C ATOM 641 O PHE A 46 -0.485 6.132 -1.062 1.00 0.00 O ATOM 642 CB PHE A 46 -1.535 6.065 2.107 1.00 0.00 C ATOM 643 CG PHE A 46 -0.058 6.125 2.361 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.512 7.249 2.930 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.756 5.045 2.055 1.00 0.00 C ATOM 646 CE1 PHE A 46 1.867 7.298 3.188 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.111 5.091 2.305 1.00 0.00 C ATOM 648 CZ PHE A 46 2.666 6.217 2.875 1.00 0.00 C ATOM 0 H PHE A 46 -3.858 5.941 1.431 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.660 7.607 0.588 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.042 6.641 2.881 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.862 5.031 2.213 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -0.110 8.097 3.175 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.324 4.158 1.616 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.301 8.181 3.634 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.736 4.247 2.055 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.726 6.253 3.077 1.00 0.00 H new ATOM 658 N ILE A 47 -1.938 4.523 -0.519 1.00 0.00 N ATOM 659 CA ILE A 47 -1.381 3.606 -1.486 1.00 0.00 C ATOM 660 C ILE A 47 -1.841 3.977 -2.895 1.00 0.00 C ATOM 661 O ILE A 47 -1.159 3.701 -3.876 1.00 0.00 O ATOM 662 CB ILE A 47 -1.730 2.140 -1.158 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.248 1.946 -1.110 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.096 1.753 0.169 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.689 0.555 -0.703 1.00 0.00 C ATOM 0 H ILE A 47 -2.751 4.176 -0.010 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.295 3.693 -1.438 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.335 1.494 -1.942 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.672 2.667 -0.411 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.662 2.172 -2.093 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.342 0.717 0.401 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.014 1.862 0.101 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.477 2.402 0.957 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.778 0.506 -0.695 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.298 -0.173 -1.414 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.309 0.330 0.293 1.00 0.00 H new ATOM 677 N GLN A 48 -2.995 4.624 -2.983 1.00 0.00 N ATOM 678 CA GLN A 48 -3.401 5.295 -4.199 1.00 0.00 C ATOM 679 C GLN A 48 -2.351 6.326 -4.575 1.00 0.00 C ATOM 680 O GLN A 48 -1.680 6.198 -5.576 1.00 0.00 O ATOM 681 CB GLN A 48 -4.749 5.997 -4.006 1.00 0.00 C ATOM 682 CG GLN A 48 -5.925 5.055 -3.807 1.00 0.00 C ATOM 683 CD GLN A 48 -6.082 4.048 -4.929 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.751 4.318 -6.083 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.593 2.878 -4.591 1.00 0.00 N ATOM 0 H GLN A 48 -3.667 4.695 -2.219 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.502 4.553 -4.991 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.680 6.659 -3.143 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.945 6.625 -4.875 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.799 4.522 -2.865 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.841 5.640 -3.723 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.854 2.696 -3.622 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.727 2.156 -5.299 1.00 0.00 H new ATOM 694 N LYS A 49 -2.124 7.257 -3.670 1.00 0.00 N ATOM 695 CA LYS A 49 -1.403 8.491 -3.962 1.00 0.00 C ATOM 696 C LYS A 49 0.111 8.278 -4.033 1.00 0.00 C ATOM 697 O LYS A 49 0.862 9.218 -4.305 1.00 0.00 O ATOM 698 CB LYS A 49 -1.738 9.508 -2.867 1.00 0.00 C ATOM 699 CG LYS A 49 -1.342 10.941 -3.181 1.00 0.00 C ATOM 700 CD LYS A 49 -1.455 11.847 -1.955 1.00 0.00 C ATOM 701 CE LYS A 49 -2.837 11.790 -1.313 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.934 10.744 -0.259 1.00 0.00 N ATOM 0 H LYS A 49 -2.435 7.183 -2.702 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.714 8.853 -4.942 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.811 9.476 -2.678 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.243 9.203 -1.945 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.318 10.961 -3.554 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.978 11.327 -3.977 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.704 11.555 -1.221 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.234 12.874 -2.245 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.072 12.762 -0.879 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.584 11.596 -2.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.870 10.293 -0.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.196 10.027 -0.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.804 11.180 0.676 1.00 0.00 H new ATOM 716 N HIS A 50 0.584 7.068 -3.751 1.00 0.00 N ATOM 717 CA HIS A 50 1.993 6.795 -4.033 1.00 0.00 C ATOM 718 C HIS A 50 2.212 5.702 -5.086 1.00 0.00 C ATOM 719 O HIS A 50 3.355 5.420 -5.440 1.00 0.00 O ATOM 720 CB HIS A 50 2.719 6.443 -2.731 1.00 0.00 C ATOM 721 CG HIS A 50 2.596 7.523 -1.700 1.00 0.00 C ATOM 722 ND1 HIS A 50 3.115 8.779 -1.875 1.00 0.00 N ATOM 723 CD2 HIS A 50 1.940 7.556 -0.521 1.00 0.00 C ATOM 724 CE1 HIS A 50 2.781 9.540 -0.855 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.062 8.825 -0.013 1.00 0.00 N ATOM 0 H HIS A 50 0.049 6.298 -3.350 1.00 0.00 H new ATOM 0 HA HIS A 50 2.411 7.706 -4.462 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.312 5.514 -2.331 1.00 0.00 H new ATOM 0 HB3 HIS A 50 3.773 6.264 -2.943 1.00 0.00 H new ATOM 0 HD2 HIS A 50 1.414 6.733 -0.061 1.00 0.00 H new ATOM 0 HE1 HIS A 50 3.051 10.578 -0.729 1.00 0.00 H new ATOM 0 HE2 HIS A 50 1.664 9.158 0.865 1.00 0.00 H new ATOM 734 N LEU A 51 1.144 5.100 -5.597 1.00 0.00 N ATOM 735 CA LEU A 51 1.275 4.165 -6.723 1.00 0.00 C ATOM 736 C LEU A 51 0.461 4.635 -7.921 1.00 0.00 C ATOM 737 O LEU A 51 0.983 4.813 -9.019 1.00 0.00 O ATOM 738 CB LEU A 51 0.806 2.743 -6.370 1.00 0.00 C ATOM 739 CG LEU A 51 1.690 1.924 -5.414 1.00 0.00 C ATOM 740 CD1 LEU A 51 3.136 1.883 -5.887 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.607 2.464 -4.004 1.00 0.00 C ATOM 0 H LEU A 51 0.190 5.235 -5.261 1.00 0.00 H new ATOM 0 HA LEU A 51 2.338 4.141 -6.962 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.189 2.816 -5.930 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.704 2.182 -7.299 1.00 0.00 H new ATOM 0 HG LEU A 51 1.310 0.902 -5.414 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.731 1.296 -5.187 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.183 1.426 -6.876 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.531 2.898 -5.937 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.241 1.867 -3.348 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.945 3.500 -3.991 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.575 2.414 -3.655 1.00 0.00 H new ATOM 753 N ASN A 52 -0.822 4.846 -7.686 1.00 0.00 N ATOM 754 CA ASN A 52 -1.789 5.055 -8.755 1.00 0.00 C ATOM 755 C ASN A 52 -2.244 6.509 -8.868 1.00 0.00 C ATOM 756 O ASN A 52 -2.694 6.940 -9.931 1.00 0.00 O ATOM 757 CB ASN A 52 -2.998 4.151 -8.522 1.00 0.00 C ATOM 758 CG ASN A 52 -2.981 2.907 -9.400 1.00 0.00 C ATOM 759 OD1 ASN A 52 -3.512 1.863 -9.023 1.00 0.00 O ATOM 760 ND2 ASN A 52 -2.392 3.008 -10.585 1.00 0.00 N ATOM 0 H ASN A 52 -1.225 4.878 -6.750 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.297 4.805 -9.695 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -3.025 3.851 -7.475 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.911 4.715 -8.716 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -2.370 2.205 -11.214 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -1.961 3.888 -10.867 1.00 0.00 H new ATOM 767 N LYS A 53 -2.123 7.263 -7.795 1.00 0.00 N ATOM 768 CA LYS A 53 -2.489 8.663 -7.804 1.00 0.00 C ATOM 769 C LYS A 53 -1.238 9.525 -7.744 1.00 0.00 C ATOM 770 O LYS A 53 -0.791 9.866 -6.633 1.00 0.00 O ATOM 771 CB LYS A 53 -3.414 8.982 -6.623 1.00 0.00 C ATOM 772 CG LYS A 53 -4.882 9.049 -6.999 1.00 0.00 C ATOM 773 CD LYS A 53 -5.678 9.882 -6.004 1.00 0.00 C ATOM 774 CE LYS A 53 -5.873 9.176 -4.674 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.767 9.955 -3.774 1.00 0.00 N ATOM 776 OXT LYS A 53 -0.687 9.841 -8.816 1.00 0.00 O ATOM 0 H LYS A 53 -1.771 6.926 -6.899 1.00 0.00 H new ATOM 0 HA LYS A 53 -3.024 8.881 -8.728 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.280 8.223 -5.852 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -3.116 9.935 -6.187 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.984 9.477 -7.996 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.294 8.041 -7.042 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -5.165 10.829 -5.836 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.652 10.119 -6.432 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -6.297 8.186 -4.844 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.906 9.030 -4.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.584 9.687 -2.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -6.583 10.971 -3.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.759 9.752 -4.010 1.00 0.00 H new TER 790 LYS A 53 HETATM 791 N FME B 1 8.673 7.163 14.170 1.00 0.00 N HETATM 792 CN FME B 1 7.538 7.483 14.772 1.00 0.00 C HETATM 793 O1 FME B 1 7.443 8.469 15.505 1.00 0.00 O HETATM 794 CA FME B 1 8.770 5.994 13.306 1.00 0.00 C HETATM 795 CB FME B 1 10.091 6.031 12.533 1.00 0.00 C HETATM 796 CG FME B 1 10.216 4.973 11.448 1.00 0.00 C HETATM 797 SD FME B 1 11.797 5.073 10.585 1.00 0.00 S HETATM 798 CE FME B 1 11.563 3.874 9.277 1.00 0.00 C HETATM 799 C FME B 1 8.680 4.721 14.141 1.00 0.00 C HETATM 800 O FME B 1 9.621 4.364 14.847 1.00 0.00 O HETATM 0 HG3 FME B 1 10.108 3.984 11.892 1.00 0.00 H new HETATM 0 HG2 FME B 1 9.404 5.091 10.731 1.00 0.00 H new HETATM 0 HE3 FME B 1 12.498 3.344 9.098 1.00 0.00 H new HETATM 0 HE2 FME B 1 10.793 3.161 9.571 1.00 0.00 H new HETATM 0 HE1 FME B 1 11.255 4.386 8.365 1.00 0.00 H new HETATM 0 HCN FME B 1 6.661 6.855 14.614 1.00 0.00 H new HETATM 0 HB3 FME B 1 10.204 7.015 12.078 1.00 0.00 H new HETATM 0 HB2 FME B 1 10.913 5.910 13.238 1.00 0.00 H new HETATM 0 HA FME B 1 7.945 6.003 12.594 1.00 0.00 H new HETATM 0 H FME B 1 9.497 7.747 14.314 1.00 0.00 H new ATOM 811 N VAL B 2 7.545 4.042 14.057 1.00 0.00 N ATOM 812 CA VAL B 2 7.306 2.858 14.874 1.00 0.00 C ATOM 813 C VAL B 2 7.421 1.586 14.033 1.00 0.00 C ATOM 814 O VAL B 2 7.538 0.479 14.560 1.00 0.00 O ATOM 815 CB VAL B 2 5.908 2.929 15.541 1.00 0.00 C ATOM 816 CG1 VAL B 2 4.800 2.876 14.497 1.00 0.00 C ATOM 817 CG2 VAL B 2 5.734 1.824 16.574 1.00 0.00 C ATOM 0 H VAL B 2 6.776 4.289 13.434 1.00 0.00 H new ATOM 0 HA VAL B 2 8.066 2.828 15.654 1.00 0.00 H new ATOM 0 HB VAL B 2 5.837 3.885 16.059 1.00 0.00 H new ATOM 0 HG11 VAL B 2 3.830 2.927 14.992 1.00 0.00 H new ATOM 0 HG12 VAL B 2 4.903 3.719 13.814 1.00 0.00 H new ATOM 0 HG13 VAL B 2 4.872 1.944 13.937 1.00 0.00 H new ATOM 0 HG21 VAL B 2 4.744 1.900 17.025 1.00 0.00 H new ATOM 0 HG22 VAL B 2 5.839 0.853 16.090 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.494 1.927 17.348 1.00 0.00 H new ATOM 827 N ILE B 3 7.418 1.756 12.721 1.00 0.00 N ATOM 828 CA ILE B 3 7.487 0.623 11.816 1.00 0.00 C ATOM 829 C ILE B 3 8.763 0.674 10.986 1.00 0.00 C ATOM 830 O ILE B 3 9.170 1.738 10.516 1.00 0.00 O ATOM 831 CB ILE B 3 6.251 0.563 10.884 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.282 -0.713 10.036 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.180 1.799 9.992 1.00 0.00 C ATOM 834 CD1 ILE B 3 5.055 -0.899 9.171 1.00 0.00 C ATOM 0 H ILE B 3 7.369 2.665 12.261 1.00 0.00 H new ATOM 0 HA ILE B 3 7.496 -0.280 12.426 1.00 0.00 H new ATOM 0 HB ILE B 3 5.356 0.544 11.506 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.166 -0.693 9.398 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.384 -1.575 10.696 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.304 1.733 9.347 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.107 2.692 10.613 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.079 1.857 9.378 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.149 -1.823 8.600 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.169 -0.952 9.803 1.00 0.00 H new ATOM 0 HD13 ILE B 3 4.962 -0.057 8.485 1.00 0.00 H new ATOM 846 N ALA B 4 9.417 -0.468 10.860 1.00 0.00 N ATOM 847 CA ALA B 4 10.564 -0.599 9.984 1.00 0.00 C ATOM 848 C ALA B 4 10.328 -1.720 8.986 1.00 0.00 C ATOM 849 O ALA B 4 9.633 -2.696 9.276 1.00 0.00 O ATOM 850 CB ALA B 4 11.824 -0.854 10.793 1.00 0.00 C ATOM 0 H ALA B 4 9.169 -1.323 11.358 1.00 0.00 H new ATOM 0 HA ALA B 4 10.698 0.333 9.435 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.676 -0.950 10.119 1.00 0.00 H new ATOM 0 HB2 ALA B 4 11.993 -0.021 11.475 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.709 -1.774 11.365 1.00 0.00 H new ATOM 856 N THR B 5 10.913 -1.565 7.807 1.00 0.00 N ATOM 857 CA THR B 5 10.716 -2.493 6.703 1.00 0.00 C ATOM 858 C THR B 5 11.285 -3.869 7.025 1.00 0.00 C ATOM 859 O THR B 5 10.961 -4.855 6.371 1.00 0.00 O ATOM 860 CB THR B 5 11.395 -1.952 5.435 1.00 0.00 C ATOM 861 OG1 THR B 5 11.467 -0.521 5.512 1.00 0.00 O ATOM 862 CG2 THR B 5 10.623 -2.358 4.188 1.00 0.00 C ATOM 0 H THR B 5 11.539 -0.790 7.589 1.00 0.00 H new ATOM 0 HA THR B 5 9.643 -2.590 6.540 1.00 0.00 H new ATOM 0 HB THR B 5 12.398 -2.374 5.369 1.00 0.00 H new ATOM 0 HG1 THR B 5 12.327 -0.257 5.901 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.125 -1.963 3.305 1.00 0.00 H new ATOM 0 HG22 THR B 5 10.580 -3.445 4.125 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.611 -1.957 4.240 1.00 0.00 H new ATOM 870 N ASP B 6 12.101 -3.929 8.068 1.00 0.00 N ATOM 871 CA ASP B 6 12.779 -5.159 8.447 1.00 0.00 C ATOM 872 C ASP B 6 11.863 -6.070 9.259 1.00 0.00 C ATOM 873 O ASP B 6 12.256 -7.175 9.636 1.00 0.00 O ATOM 874 CB ASP B 6 14.038 -4.841 9.259 1.00 0.00 C ATOM 875 CG ASP B 6 15.066 -4.048 8.474 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.906 -2.815 8.343 1.00 0.00 O ATOM 877 OD2 ASP B 6 16.050 -4.649 7.997 1.00 0.00 O ATOM 0 H ASP B 6 12.310 -3.133 8.671 1.00 0.00 H new ATOM 0 HA ASP B 6 13.058 -5.680 7.531 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.757 -4.279 10.150 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.489 -5.773 9.599 1.00 0.00 H new ATOM 882 N ASP B 7 10.648 -5.606 9.542 1.00 0.00 N ATOM 883 CA ASP B 7 9.664 -6.434 10.237 1.00 0.00 C ATOM 884 C ASP B 7 8.606 -6.950 9.267 1.00 0.00 C ATOM 885 O ASP B 7 7.883 -7.899 9.570 1.00 0.00 O ATOM 886 CB ASP B 7 8.960 -5.638 11.345 1.00 0.00 C ATOM 887 CG ASP B 7 9.900 -5.070 12.389 1.00 0.00 C ATOM 888 OD1 ASP B 7 10.305 -5.810 13.307 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.201 -3.860 12.320 1.00 0.00 O ATOM 0 H ASP B 7 10.323 -4.669 9.303 1.00 0.00 H new ATOM 0 HA ASP B 7 10.203 -7.274 10.675 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.401 -4.820 10.891 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.234 -6.285 11.838 1.00 0.00 H new ATOM 894 N LEU B 8 8.509 -6.322 8.102 1.00 0.00 N ATOM 895 CA LEU B 8 7.494 -6.702 7.120 1.00 0.00 C ATOM 896 C LEU B 8 8.126 -7.321 5.885 1.00 0.00 C ATOM 897 O LEU B 8 7.475 -8.064 5.147 1.00 0.00 O ATOM 898 CB LEU B 8 6.628 -5.505 6.723 1.00 0.00 C ATOM 899 CG LEU B 8 5.614 -5.058 7.777 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.298 -4.332 8.925 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.549 -4.177 7.147 1.00 0.00 C ATOM 0 H LEU B 8 9.114 -5.553 7.813 1.00 0.00 H new ATOM 0 HA LEU B 8 6.855 -7.448 7.591 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.282 -4.664 6.491 1.00 0.00 H new ATOM 0 HB3 LEU B 8 6.091 -5.753 5.807 1.00 0.00 H new ATOM 0 HG LEU B 8 5.135 -5.949 8.183 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.552 -4.026 9.658 1.00 0.00 H new ATOM 0 HD12 LEU B 8 7.020 -4.998 9.398 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.813 -3.451 8.543 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.835 -3.867 7.910 1.00 0.00 H new ATOM 0 HD22 LEU B 8 5.018 -3.296 6.710 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.029 -4.735 6.369 1.00 0.00 H new ATOM 913 N GLU B 9 9.390 -7.014 5.673 1.00 0.00 N ATOM 914 CA GLU B 9 10.147 -7.592 4.583 1.00 0.00 C ATOM 915 C GLU B 9 11.414 -8.225 5.128 1.00 0.00 C ATOM 916 O GLU B 9 12.180 -7.599 5.864 1.00 0.00 O ATOM 917 CB GLU B 9 10.475 -6.547 3.513 1.00 0.00 C ATOM 918 CG GLU B 9 9.251 -6.052 2.757 1.00 0.00 C ATOM 919 CD GLU B 9 9.598 -5.122 1.612 1.00 0.00 C ATOM 920 OE1 GLU B 9 10.634 -4.436 1.682 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.825 -5.070 0.632 1.00 0.00 O ATOM 0 H GLU B 9 9.919 -6.359 6.249 1.00 0.00 H new ATOM 0 HA GLU B 9 9.539 -8.360 4.105 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.970 -5.698 3.985 1.00 0.00 H new ATOM 0 HB3 GLU B 9 11.183 -6.974 2.803 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.700 -6.908 2.368 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.588 -5.534 3.450 1.00 0.00 H new ATOM 928 N VAL B 10 11.616 -9.472 4.772 1.00 0.00 N ATOM 929 CA VAL B 10 12.734 -10.245 5.263 1.00 0.00 C ATOM 930 C VAL B 10 13.498 -10.813 4.080 1.00 0.00 C ATOM 931 O VAL B 10 12.899 -11.206 3.078 1.00 0.00 O ATOM 932 CB VAL B 10 12.252 -11.380 6.204 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.260 -12.297 5.505 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.427 -12.179 6.746 1.00 0.00 C ATOM 0 H VAL B 10 11.007 -9.981 4.131 1.00 0.00 H new ATOM 0 HA VAL B 10 13.392 -9.598 5.843 1.00 0.00 H new ATOM 0 HB VAL B 10 11.741 -10.910 7.045 1.00 0.00 H new ATOM 0 HG11 VAL B 10 10.943 -13.081 6.192 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.392 -11.719 5.187 1.00 0.00 H new ATOM 0 HG13 VAL B 10 11.734 -12.749 4.633 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.059 -12.968 7.402 1.00 0.00 H new ATOM 0 HG22 VAL B 10 13.977 -12.624 5.917 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.088 -11.519 7.307 1.00 0.00 H new ATOM 944 N ALA B 11 14.815 -10.827 4.179 1.00 0.00 N ATOM 945 CA ALA B 11 15.643 -11.303 3.088 1.00 0.00 C ATOM 946 C ALA B 11 15.377 -12.777 2.819 1.00 0.00 C ATOM 947 O ALA B 11 15.383 -13.599 3.736 1.00 0.00 O ATOM 948 CB ALA B 11 17.108 -11.066 3.431 1.00 0.00 C ATOM 0 H ALA B 11 15.332 -10.515 5.001 1.00 0.00 H new ATOM 0 HA ALA B 11 15.398 -10.753 2.179 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.735 -11.422 2.614 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.279 -10.000 3.581 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.360 -11.606 4.344 1.00 0.00 H new ATOM 954 N CYS B 12 15.133 -13.091 1.546 1.00 0.00 N ATOM 955 CA CYS B 12 14.627 -14.385 1.114 1.00 0.00 C ATOM 956 C CYS B 12 15.604 -15.538 1.386 1.00 0.00 C ATOM 957 O CYS B 12 16.790 -15.295 1.549 1.00 0.00 O ATOM 958 CB CYS B 12 14.316 -14.267 -0.383 1.00 0.00 C ATOM 959 SG CYS B 12 13.759 -15.779 -1.178 1.00 0.00 S ATOM 0 H CYS B 12 15.286 -12.439 0.777 1.00 0.00 H new ATOM 0 HA CYS B 12 13.734 -14.631 1.688 1.00 0.00 H new ATOM 0 HB2 CYS B 12 13.551 -13.503 -0.518 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.211 -13.916 -0.896 1.00 0.00 H new ATOM 964 N PRO B 13 15.124 -16.800 1.462 1.00 0.00 N ATOM 965 CA PRO B 13 15.973 -17.979 1.678 1.00 0.00 C ATOM 966 C PRO B 13 17.339 -17.952 0.980 1.00 0.00 C ATOM 967 O PRO B 13 18.330 -18.414 1.543 1.00 0.00 O ATOM 968 CB PRO B 13 15.129 -19.089 1.069 1.00 0.00 C ATOM 969 CG PRO B 13 13.724 -18.703 1.360 1.00 0.00 C ATOM 970 CD PRO B 13 13.699 -17.190 1.400 1.00 0.00 C ATOM 0 HA PRO B 13 16.228 -18.075 2.733 1.00 0.00 H new ATOM 0 HB2 PRO B 13 15.302 -19.173 -0.004 1.00 0.00 H new ATOM 0 HB3 PRO B 13 15.372 -20.057 1.508 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.049 -19.083 0.593 1.00 0.00 H new ATOM 0 HG3 PRO B 13 13.394 -19.123 2.310 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.212 -16.777 0.516 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.149 -16.824 2.267 1.00 0.00 H new ATOM 978 N LYS B 14 17.396 -17.405 -0.236 1.00 0.00 N ATOM 979 CA LYS B 14 18.578 -17.598 -1.076 1.00 0.00 C ATOM 980 C LYS B 14 18.883 -16.415 -2.019 1.00 0.00 C ATOM 981 O LYS B 14 20.020 -16.252 -2.444 1.00 0.00 O ATOM 982 CB LYS B 14 18.401 -18.905 -1.876 1.00 0.00 C ATOM 983 CG LYS B 14 19.598 -19.320 -2.734 1.00 0.00 C ATOM 984 CD LYS B 14 19.521 -18.762 -4.155 1.00 0.00 C ATOM 985 CE LYS B 14 20.697 -19.225 -5.006 1.00 0.00 C ATOM 986 NZ LYS B 14 22.010 -18.747 -4.490 1.00 0.00 N ATOM 0 H LYS B 14 16.657 -16.839 -0.653 1.00 0.00 H new ATOM 0 HA LYS B 14 19.442 -17.659 -0.414 1.00 0.00 H new ATOM 0 HB2 LYS B 14 18.181 -19.711 -1.177 1.00 0.00 H new ATOM 0 HB3 LYS B 14 17.531 -18.799 -2.524 1.00 0.00 H new ATOM 0 HG2 LYS B 14 20.517 -18.975 -2.261 1.00 0.00 H new ATOM 0 HG3 LYS B 14 19.651 -20.408 -2.777 1.00 0.00 H new ATOM 0 HD2 LYS B 14 18.588 -19.079 -4.620 1.00 0.00 H new ATOM 0 HD3 LYS B 14 19.505 -17.673 -4.118 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.703 -20.314 -5.046 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.562 -18.869 -6.027 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.759 -18.990 -5.169 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 21.979 -17.715 -4.364 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 22.210 -19.202 -3.576 1.00 0.00 H new ATOM 1000 N CYS B 15 17.891 -15.607 -2.389 1.00 0.00 N ATOM 1001 CA CYS B 15 18.135 -14.588 -3.423 1.00 0.00 C ATOM 1002 C CYS B 15 17.944 -13.145 -2.980 1.00 0.00 C ATOM 1003 O CYS B 15 17.433 -12.324 -3.747 1.00 0.00 O ATOM 1004 CB CYS B 15 17.158 -14.838 -4.561 1.00 0.00 C ATOM 1005 SG CYS B 15 15.431 -14.915 -4.021 1.00 0.00 S ATOM 0 H CYS B 15 16.944 -15.629 -2.010 1.00 0.00 H new ATOM 0 HA CYS B 15 19.185 -14.691 -3.699 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.264 -14.046 -5.302 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.419 -15.774 -5.055 1.00 0.00 H new ATOM 1010 N GLU B 16 18.451 -12.801 -1.821 1.00 0.00 N ATOM 1011 CA GLU B 16 18.215 -11.496 -1.247 1.00 0.00 C ATOM 1012 C GLU B 16 19.272 -10.513 -1.674 1.00 0.00 C ATOM 1013 O GLU B 16 19.486 -9.505 -1.007 1.00 0.00 O ATOM 1014 CB GLU B 16 18.252 -11.584 0.279 1.00 0.00 C ATOM 1015 CG GLU B 16 18.310 -12.990 0.833 1.00 0.00 C ATOM 1016 CD GLU B 16 19.715 -13.553 0.799 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.138 -14.015 -0.274 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.407 -13.524 1.835 1.00 0.00 O ATOM 0 H GLU B 16 19.035 -13.413 -1.251 1.00 0.00 H new ATOM 0 HA GLU B 16 17.239 -11.158 -1.595 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.119 -11.031 0.640 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.368 -11.087 0.679 1.00 0.00 H new ATOM 0 HG2 GLU B 16 17.943 -12.991 1.859 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.647 -13.635 0.257 1.00 0.00 H new ATOM 1025 N ARG B 17 19.923 -10.782 -2.788 1.00 0.00 N ATOM 1026 CA ARG B 17 21.001 -9.941 -3.237 1.00 0.00 C ATOM 1027 C ARG B 17 20.997 -9.955 -4.765 1.00 0.00 C ATOM 1028 O ARG B 17 21.617 -9.119 -5.414 1.00 0.00 O ATOM 1029 CB ARG B 17 22.363 -10.383 -2.684 1.00 0.00 C ATOM 1030 CG ARG B 17 22.873 -11.723 -3.203 1.00 0.00 C ATOM 1031 CD ARG B 17 22.359 -12.899 -2.385 1.00 0.00 C ATOM 1032 NE ARG B 17 23.142 -14.108 -2.648 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.175 -15.174 -1.844 1.00 0.00 C ATOM 1034 NH1 ARG B 17 22.367 -15.256 -0.796 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.995 -16.181 -2.115 1.00 0.00 N ATOM 0 H ARG B 17 19.721 -11.577 -3.395 1.00 0.00 H new ATOM 0 HA ARG B 17 20.845 -8.930 -2.861 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.100 -9.616 -2.922 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.296 -10.435 -1.597 1.00 0.00 H new ATOM 0 HG2 ARG B 17 22.568 -11.846 -4.242 1.00 0.00 H new ATOM 0 HG3 ARG B 17 23.963 -11.723 -3.189 1.00 0.00 H new ATOM 0 HD2 ARG B 17 22.406 -12.656 -1.324 1.00 0.00 H new ATOM 0 HD3 ARG B 17 21.311 -13.082 -2.624 1.00 0.00 H new ATOM 0 HE ARG B 17 23.699 -14.138 -3.502 1.00 0.00 H new ATOM 0 HH11 ARG B 17 21.712 -14.500 -0.597 1.00 0.00 H new ATOM 0 HH12 ARG B 17 22.401 -16.075 -0.189 1.00 0.00 H new ATOM 0 HH21 ARG B 17 24.599 -16.140 -2.936 1.00 0.00 H new ATOM 0 HH22 ARG B 17 24.022 -16.996 -1.502 1.00 0.00 H new ATOM 1049 N ALA B 18 20.281 -10.935 -5.330 1.00 0.00 N ATOM 1050 CA ALA B 18 20.287 -11.134 -6.773 1.00 0.00 C ATOM 1051 C ALA B 18 18.921 -10.879 -7.397 1.00 0.00 C ATOM 1052 O ALA B 18 18.820 -10.322 -8.487 1.00 0.00 O ATOM 1053 CB ALA B 18 20.760 -12.539 -7.103 1.00 0.00 C ATOM 0 H ALA B 18 19.698 -11.592 -4.812 1.00 0.00 H new ATOM 0 HA ALA B 18 20.978 -10.406 -7.199 1.00 0.00 H new ATOM 0 HB1 ALA B 18 20.761 -12.678 -8.184 1.00 0.00 H new ATOM 0 HB2 ALA B 18 21.769 -12.683 -6.718 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.090 -13.266 -6.644 1.00 0.00 H new ATOM 1059 N GLY B 19 17.870 -11.279 -6.695 1.00 0.00 N ATOM 1060 CA GLY B 19 16.531 -11.128 -7.228 1.00 0.00 C ATOM 1061 C GLY B 19 16.114 -12.311 -8.081 1.00 0.00 C ATOM 1062 O GLY B 19 15.120 -12.249 -8.800 1.00 0.00 O ATOM 0 H GLY B 19 17.920 -11.704 -5.769 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.826 -11.010 -6.405 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.480 -10.217 -7.824 1.00 0.00 H new ATOM 1066 N GLU B 20 16.842 -13.409 -7.957 1.00 0.00 N ATOM 1067 CA GLU B 20 16.610 -14.581 -8.793 1.00 0.00 C ATOM 1068 C GLU B 20 17.134 -15.833 -8.105 1.00 0.00 C ATOM 1069 O GLU B 20 17.972 -15.745 -7.207 1.00 0.00 O ATOM 1070 CB GLU B 20 17.302 -14.426 -10.147 1.00 0.00 C ATOM 1071 CG GLU B 20 18.809 -14.284 -10.031 1.00 0.00 C ATOM 1072 CD GLU B 20 19.543 -14.882 -11.209 1.00 0.00 C ATOM 1073 OE1 GLU B 20 19.652 -14.215 -12.257 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.025 -16.025 -11.084 1.00 0.00 O ATOM 0 H GLU B 20 17.601 -13.515 -7.284 1.00 0.00 H new ATOM 0 HA GLU B 20 15.535 -14.674 -8.950 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.071 -15.292 -10.768 1.00 0.00 H new ATOM 0 HB3 GLU B 20 16.898 -13.551 -10.657 1.00 0.00 H new ATOM 0 HG2 GLU B 20 19.065 -13.228 -9.947 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.146 -14.768 -9.114 1.00 0.00 H new ATOM 1081 N ILE B 21 16.659 -16.987 -8.544 1.00 0.00 N ATOM 1082 CA ILE B 21 17.105 -18.263 -8.004 1.00 0.00 C ATOM 1083 C ILE B 21 17.207 -19.267 -9.137 1.00 0.00 C ATOM 1084 O ILE B 21 16.233 -19.506 -9.844 1.00 0.00 O ATOM 1085 CB ILE B 21 16.179 -18.810 -6.881 1.00 0.00 C ATOM 1086 CG1 ILE B 21 16.272 -17.909 -5.638 1.00 0.00 C ATOM 1087 CG2 ILE B 21 16.551 -20.247 -6.534 1.00 0.00 C ATOM 1088 CD1 ILE B 21 15.622 -18.470 -4.385 1.00 0.00 C ATOM 0 H ILE B 21 15.958 -17.067 -9.280 1.00 0.00 H new ATOM 0 HA ILE B 21 18.079 -18.103 -7.542 1.00 0.00 H new ATOM 0 HB ILE B 21 15.150 -18.804 -7.240 1.00 0.00 H new ATOM 0 HG12 ILE B 21 17.324 -17.715 -5.427 1.00 0.00 H new ATOM 0 HG13 ILE B 21 15.811 -16.949 -5.869 1.00 0.00 H new ATOM 0 HG21 ILE B 21 15.893 -20.613 -5.746 1.00 0.00 H new ATOM 0 HG22 ILE B 21 16.443 -20.875 -7.419 1.00 0.00 H new ATOM 0 HG23 ILE B 21 17.584 -20.282 -6.189 1.00 0.00 H new ATOM 0 HD11 ILE B 21 15.741 -17.762 -3.565 1.00 0.00 H new ATOM 0 HD12 ILE B 21 14.561 -18.637 -4.569 1.00 0.00 H new ATOM 0 HD13 ILE B 21 16.097 -19.415 -4.120 1.00 0.00 H new ATOM 1100 N GLU B 22 18.392 -19.839 -9.299 1.00 0.00 N ATOM 1101 CA GLU B 22 18.682 -20.730 -10.420 1.00 0.00 C ATOM 1102 C GLU B 22 18.353 -20.059 -11.745 1.00 0.00 C ATOM 1103 O GLU B 22 17.763 -20.674 -12.634 1.00 0.00 O ATOM 1104 CB GLU B 22 17.869 -22.012 -10.279 1.00 0.00 C ATOM 1105 CG GLU B 22 18.512 -23.212 -10.953 1.00 0.00 C ATOM 1106 CD GLU B 22 18.116 -24.523 -10.317 1.00 0.00 C ATOM 1107 OE1 GLU B 22 16.971 -24.967 -10.522 1.00 0.00 O ATOM 1108 OE2 GLU B 22 18.964 -25.128 -9.626 1.00 0.00 O ATOM 0 H GLU B 22 19.177 -19.701 -8.663 1.00 0.00 H new ATOM 0 HA GLU B 22 19.746 -20.966 -10.407 1.00 0.00 H new ATOM 0 HB2 GLU B 22 17.730 -22.231 -9.220 1.00 0.00 H new ATOM 0 HB3 GLU B 22 16.878 -21.854 -10.704 1.00 0.00 H new ATOM 0 HG2 GLU B 22 18.231 -23.225 -12.006 1.00 0.00 H new ATOM 0 HG3 GLU B 22 19.596 -23.107 -10.914 1.00 0.00 H new ATOM 1115 N GLY B 23 18.707 -18.782 -11.866 1.00 0.00 N ATOM 1116 CA GLY B 23 18.370 -18.019 -13.053 1.00 0.00 C ATOM 1117 C GLY B 23 16.890 -17.996 -13.329 1.00 0.00 C ATOM 1118 O GLY B 23 16.450 -17.618 -14.415 1.00 0.00 O ATOM 0 H GLY B 23 19.224 -18.261 -11.158 1.00 0.00 H new ATOM 0 HA2 GLY B 23 18.730 -16.997 -12.937 1.00 0.00 H new ATOM 0 HA3 GLY B 23 18.889 -18.444 -13.912 1.00 0.00 H new ATOM 1122 N THR B 24 16.130 -18.407 -12.344 1.00 0.00 N ATOM 1123 CA THR B 24 14.715 -18.581 -12.490 1.00 0.00 C ATOM 1124 C THR B 24 13.954 -17.715 -11.477 1.00 0.00 C ATOM 1125 O THR B 24 14.431 -17.477 -10.361 1.00 0.00 O ATOM 1126 CB THR B 24 14.438 -20.088 -12.335 1.00 0.00 C ATOM 1127 OG1 THR B 24 14.364 -20.697 -13.630 1.00 0.00 O ATOM 1128 CG2 THR B 24 13.181 -20.399 -11.536 1.00 0.00 C ATOM 0 H THR B 24 16.483 -18.630 -11.414 1.00 0.00 H new ATOM 0 HA THR B 24 14.362 -18.249 -13.467 1.00 0.00 H new ATOM 0 HB THR B 24 15.269 -20.504 -11.765 1.00 0.00 H new ATOM 0 HG1 THR B 24 14.189 -21.656 -13.531 1.00 0.00 H new ATOM 0 HG21 THR B 24 13.051 -21.479 -11.469 1.00 0.00 H new ATOM 0 HG22 THR B 24 13.275 -19.981 -10.533 1.00 0.00 H new ATOM 0 HG23 THR B 24 12.316 -19.960 -12.033 1.00 0.00 H new ATOM 1136 N PRO B 25 12.781 -17.187 -11.883 1.00 0.00 N ATOM 1137 CA PRO B 25 11.964 -16.307 -11.040 1.00 0.00 C ATOM 1138 C PRO B 25 11.597 -16.963 -9.718 1.00 0.00 C ATOM 1139 O PRO B 25 11.007 -18.044 -9.678 1.00 0.00 O ATOM 1140 CB PRO B 25 10.715 -16.034 -11.887 1.00 0.00 C ATOM 1141 CG PRO B 25 10.703 -17.122 -12.904 1.00 0.00 C ATOM 1142 CD PRO B 25 12.148 -17.413 -13.192 1.00 0.00 C ATOM 0 HA PRO B 25 12.496 -15.396 -10.765 1.00 0.00 H new ATOM 0 HB2 PRO B 25 9.812 -16.052 -11.277 1.00 0.00 H new ATOM 0 HB3 PRO B 25 10.763 -15.052 -12.358 1.00 0.00 H new ATOM 0 HG2 PRO B 25 10.191 -18.007 -12.526 1.00 0.00 H new ATOM 0 HG3 PRO B 25 10.177 -16.811 -13.807 1.00 0.00 H new ATOM 0 HD2 PRO B 25 12.295 -18.434 -13.544 1.00 0.00 H new ATOM 0 HD3 PRO B 25 12.551 -16.751 -13.958 1.00 0.00 H new ATOM 1150 N CYS B 26 11.945 -16.282 -8.642 1.00 0.00 N ATOM 1151 CA CYS B 26 11.872 -16.840 -7.305 1.00 0.00 C ATOM 1152 C CYS B 26 10.442 -16.874 -6.752 1.00 0.00 C ATOM 1153 O CYS B 26 9.714 -15.889 -6.850 1.00 0.00 O ATOM 1154 CB CYS B 26 12.755 -16.011 -6.389 1.00 0.00 C ATOM 1155 SG CYS B 26 12.886 -16.655 -4.698 1.00 0.00 S ATOM 0 H CYS B 26 12.288 -15.322 -8.671 1.00 0.00 H new ATOM 0 HA CYS B 26 12.214 -17.874 -7.353 1.00 0.00 H new ATOM 0 HB2 CYS B 26 13.754 -15.952 -6.822 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.364 -14.994 -6.349 1.00 0.00 H new ATOM 1160 N PRO B 27 10.080 -18.015 -6.111 1.00 0.00 N ATOM 1161 CA PRO B 27 8.751 -18.318 -5.545 1.00 0.00 C ATOM 1162 C PRO B 27 7.913 -17.121 -5.084 1.00 0.00 C ATOM 1163 O PRO B 27 6.786 -16.932 -5.534 1.00 0.00 O ATOM 1164 CB PRO B 27 9.128 -19.163 -4.334 1.00 0.00 C ATOM 1165 CG PRO B 27 10.360 -19.911 -4.726 1.00 0.00 C ATOM 1166 CD PRO B 27 10.978 -19.169 -5.902 1.00 0.00 C ATOM 0 HA PRO B 27 8.113 -18.777 -6.301 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.313 -18.536 -3.462 1.00 0.00 H new ATOM 0 HB3 PRO B 27 8.322 -19.848 -4.069 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.060 -19.963 -3.892 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.116 -20.937 -5.003 1.00 0.00 H new ATOM 0 HD2 PRO B 27 11.996 -18.847 -5.680 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.029 -19.800 -6.789 1.00 0.00 H new ATOM 1174 N ALA B 28 8.467 -16.315 -4.190 1.00 0.00 N ATOM 1175 CA ALA B 28 7.672 -15.302 -3.495 1.00 0.00 C ATOM 1176 C ALA B 28 8.263 -13.907 -3.651 1.00 0.00 C ATOM 1177 O ALA B 28 7.671 -12.920 -3.217 1.00 0.00 O ATOM 1178 CB ALA B 28 7.544 -15.651 -2.023 1.00 0.00 C ATOM 0 H ALA B 28 9.452 -16.338 -3.928 1.00 0.00 H new ATOM 0 HA ALA B 28 6.683 -15.295 -3.953 1.00 0.00 H new ATOM 0 HB1 ALA B 28 6.950 -14.889 -1.519 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.054 -16.619 -1.920 1.00 0.00 H new ATOM 0 HB3 ALA B 28 8.535 -15.696 -1.572 1.00 0.00 H new ATOM 1184 N CYS B 29 9.443 -13.835 -4.245 1.00 0.00 N ATOM 1185 CA CYS B 29 10.088 -12.554 -4.497 1.00 0.00 C ATOM 1186 C CYS B 29 10.536 -12.498 -5.957 1.00 0.00 C ATOM 1187 O CYS B 29 11.615 -12.980 -6.309 1.00 0.00 O ATOM 1188 CB CYS B 29 11.270 -12.338 -3.523 1.00 0.00 C ATOM 1189 SG CYS B 29 12.709 -13.410 -3.808 1.00 0.00 S ATOM 0 H CYS B 29 9.974 -14.646 -4.562 1.00 0.00 H new ATOM 0 HA CYS B 29 9.380 -11.744 -4.321 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.591 -11.299 -3.591 1.00 0.00 H new ATOM 0 HB3 CYS B 29 10.915 -12.496 -2.505 1.00 0.00 H new ATOM 1194 N SER B 30 9.697 -11.943 -6.817 1.00 0.00 N ATOM 1195 CA SER B 30 9.979 -11.887 -8.242 1.00 0.00 C ATOM 1196 C SER B 30 11.013 -10.809 -8.579 1.00 0.00 C ATOM 1197 O SER B 30 10.787 -9.952 -9.429 1.00 0.00 O ATOM 1198 CB SER B 30 8.670 -11.631 -8.991 1.00 0.00 C ATOM 1199 OG SER B 30 7.911 -10.617 -8.346 1.00 0.00 O ATOM 0 H SER B 30 8.808 -11.522 -6.549 1.00 0.00 H new ATOM 0 HA SER B 30 10.408 -12.840 -8.552 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.885 -11.334 -10.017 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.088 -12.551 -9.041 1.00 0.00 H new ATOM 0 HG SER B 30 7.079 -10.467 -8.841 1.00 0.00 H new ATOM 1205 N GLY B 31 12.147 -10.861 -7.902 1.00 0.00 N ATOM 1206 CA GLY B 31 13.236 -9.969 -8.220 1.00 0.00 C ATOM 1207 C GLY B 31 13.275 -8.749 -7.335 1.00 0.00 C ATOM 1208 O GLY B 31 13.343 -7.627 -7.830 1.00 0.00 O ATOM 0 H GLY B 31 12.332 -11.508 -7.135 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.179 -10.508 -8.128 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.149 -9.654 -9.260 1.00 0.00 H new ATOM 1212 N LYS B 32 13.226 -8.951 -6.023 1.00 0.00 N ATOM 1213 CA LYS B 32 13.354 -7.849 -5.083 1.00 0.00 C ATOM 1214 C LYS B 32 14.577 -8.088 -4.213 1.00 0.00 C ATOM 1215 O LYS B 32 15.407 -7.205 -4.012 1.00 0.00 O ATOM 1216 CB LYS B 32 12.132 -7.773 -4.164 1.00 0.00 C ATOM 1217 CG LYS B 32 10.815 -8.112 -4.825 1.00 0.00 C ATOM 1218 CD LYS B 32 9.700 -8.132 -3.797 1.00 0.00 C ATOM 1219 CE LYS B 32 8.428 -8.720 -4.364 1.00 0.00 C ATOM 1220 NZ LYS B 32 7.895 -7.924 -5.507 1.00 0.00 N ATOM 0 H LYS B 32 13.099 -9.865 -5.589 1.00 0.00 H new ATOM 0 HA LYS B 32 13.441 -6.921 -5.648 1.00 0.00 H new ATOM 0 HB2 LYS B 32 12.285 -8.450 -3.324 1.00 0.00 H new ATOM 0 HB3 LYS B 32 12.067 -6.765 -3.753 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.591 -7.380 -5.601 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.885 -9.083 -5.314 1.00 0.00 H new ATOM 0 HD2 LYS B 32 10.015 -8.713 -2.930 1.00 0.00 H new ATOM 0 HD3 LYS B 32 9.508 -7.117 -3.448 1.00 0.00 H new ATOM 0 HE2 LYS B 32 8.618 -9.741 -4.693 1.00 0.00 H new ATOM 0 HE3 LYS B 32 7.674 -8.773 -3.579 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 7.014 -8.357 -5.851 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 7.703 -6.951 -5.193 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 8.595 -7.908 -6.276 1.00 0.00 H new ATOM 1234 N GLY B 33 14.671 -9.319 -3.710 1.00 0.00 N ATOM 1235 CA GLY B 33 15.666 -9.676 -2.740 1.00 0.00 C ATOM 1236 C GLY B 33 15.006 -10.137 -1.457 1.00 0.00 C ATOM 1237 O GLY B 33 15.415 -11.125 -0.852 1.00 0.00 O ATOM 0 H GLY B 33 14.052 -10.086 -3.974 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.302 -10.468 -3.135 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.311 -8.821 -2.539 1.00 0.00 H new ATOM 1241 N VAL B 34 13.924 -9.474 -1.087 1.00 0.00 N ATOM 1242 CA VAL B 34 13.238 -9.775 0.161 1.00 0.00 C ATOM 1243 C VAL B 34 11.840 -10.336 -0.080 1.00 0.00 C ATOM 1244 O VAL B 34 11.284 -10.218 -1.177 1.00 0.00 O ATOM 1245 CB VAL B 34 13.130 -8.519 1.054 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.510 -8.036 1.474 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.372 -7.411 0.335 1.00 0.00 C ATOM 0 H VAL B 34 13.500 -8.723 -1.632 1.00 0.00 H new ATOM 0 HA VAL B 34 13.836 -10.532 0.669 1.00 0.00 H new ATOM 0 HB VAL B 34 12.574 -8.788 1.952 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.410 -7.151 2.102 1.00 0.00 H new ATOM 0 HG12 VAL B 34 15.016 -8.823 2.034 1.00 0.00 H new ATOM 0 HG13 VAL B 34 15.094 -7.788 0.588 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.307 -6.536 0.981 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.898 -7.147 -0.582 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.368 -7.757 0.091 1.00 0.00 H new ATOM 1257 N ILE B 35 11.302 -10.978 0.948 1.00 0.00 N ATOM 1258 CA ILE B 35 9.933 -11.472 0.939 1.00 0.00 C ATOM 1259 C ILE B 35 9.175 -10.930 2.145 1.00 0.00 C ATOM 1260 O ILE B 35 9.769 -10.358 3.053 1.00 0.00 O ATOM 1261 CB ILE B 35 9.869 -13.016 0.964 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.742 -13.572 2.092 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.290 -13.590 -0.375 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.653 -15.076 2.252 1.00 0.00 C ATOM 0 H ILE B 35 11.805 -11.171 1.814 1.00 0.00 H new ATOM 0 HA ILE B 35 9.475 -11.126 0.012 1.00 0.00 H new ATOM 0 HB ILE B 35 8.838 -13.314 1.152 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.780 -13.297 1.904 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.452 -13.099 3.030 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.238 -14.678 -0.337 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.623 -13.222 -1.155 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.312 -13.283 -0.597 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.299 -15.394 3.070 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.623 -15.358 2.472 1.00 0.00 H new ATOM 0 HD13 ILE B 35 10.972 -15.560 1.329 1.00 0.00 H new ATOM 1276 N LEU B 36 7.868 -11.117 2.142 1.00 0.00 N ATOM 1277 CA LEU B 36 7.008 -10.538 3.167 1.00 0.00 C ATOM 1278 C LEU B 36 6.854 -11.436 4.390 1.00 0.00 C ATOM 1279 O LEU B 36 7.100 -12.642 4.337 1.00 0.00 O ATOM 1280 CB LEU B 36 5.628 -10.249 2.580 1.00 0.00 C ATOM 1281 CG LEU B 36 5.646 -9.473 1.265 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.529 -10.410 0.072 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.543 -8.437 1.252 1.00 0.00 C ATOM 0 H LEU B 36 7.374 -11.667 1.440 1.00 0.00 H new ATOM 0 HA LEU B 36 7.488 -9.617 3.497 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.110 -11.195 2.421 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.047 -9.686 3.311 1.00 0.00 H new ATOM 0 HG LEU B 36 6.603 -8.958 1.185 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.545 -9.829 -0.850 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.366 -11.109 0.075 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.593 -10.965 0.135 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.568 -7.891 0.309 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.578 -8.932 1.360 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.688 -7.741 2.078 1.00 0.00 H new ATOM 1295 N THR B 37 6.429 -10.815 5.485 1.00 0.00 N ATOM 1296 CA THR B 37 6.085 -11.518 6.711 1.00 0.00 C ATOM 1297 C THR B 37 4.568 -11.537 6.840 1.00 0.00 C ATOM 1298 O THR B 37 3.889 -11.048 5.949 1.00 0.00 O ATOM 1299 CB THR B 37 6.687 -10.812 7.944 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.130 -9.494 8.076 1.00 0.00 O ATOM 1301 CG2 THR B 37 8.199 -10.705 7.827 1.00 0.00 C ATOM 0 H THR B 37 6.314 -9.803 5.545 1.00 0.00 H new ATOM 0 HA THR B 37 6.488 -12.530 6.666 1.00 0.00 H new ATOM 0 HB THR B 37 6.444 -11.407 8.824 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.663 -8.976 8.715 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.598 -10.204 8.709 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.630 -11.703 7.752 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.455 -10.131 6.936 1.00 0.00 H new ATOM 1309 N ALA B 38 4.026 -12.069 7.929 1.00 0.00 N ATOM 1310 CA ALA B 38 2.574 -12.144 8.082 1.00 0.00 C ATOM 1311 C ALA B 38 1.947 -10.756 8.066 1.00 0.00 C ATOM 1312 O ALA B 38 0.953 -10.525 7.372 1.00 0.00 O ATOM 1313 CB ALA B 38 2.203 -12.886 9.352 1.00 0.00 C ATOM 0 H ALA B 38 4.559 -12.451 8.710 1.00 0.00 H new ATOM 0 HA ALA B 38 2.178 -12.701 7.233 1.00 0.00 H new ATOM 0 HB1 ALA B 38 1.118 -12.929 9.444 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.604 -13.899 9.312 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.620 -12.364 10.213 1.00 0.00 H new ATOM 1319 N GLN B 39 2.529 -9.830 8.824 1.00 0.00 N ATOM 1320 CA GLN B 39 2.077 -8.444 8.803 1.00 0.00 C ATOM 1321 C GLN B 39 2.215 -7.859 7.399 1.00 0.00 C ATOM 1322 O GLN B 39 1.337 -7.135 6.929 1.00 0.00 O ATOM 1323 CB GLN B 39 2.863 -7.597 9.806 1.00 0.00 C ATOM 1324 CG GLN B 39 2.369 -6.161 9.889 1.00 0.00 C ATOM 1325 CD GLN B 39 3.150 -5.323 10.877 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.670 -5.832 11.868 1.00 0.00 O ATOM 1327 NE2 GLN B 39 3.227 -4.029 10.617 1.00 0.00 N ATOM 0 H GLN B 39 3.309 -10.013 9.456 1.00 0.00 H new ATOM 0 HA GLN B 39 1.026 -8.428 9.090 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.795 -8.056 10.792 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.916 -7.597 9.526 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.433 -5.703 8.902 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.317 -6.161 10.173 1.00 0.00 H new ATOM 0 HE21 GLN B 39 2.780 -3.649 9.783 1.00 0.00 H new ATOM 0 HE22 GLN B 39 3.733 -3.411 11.251 1.00 0.00 H new ATOM 1336 N GLY B 40 3.312 -8.194 6.726 1.00 0.00 N ATOM 1337 CA GLY B 40 3.519 -7.733 5.367 1.00 0.00 C ATOM 1338 C GLY B 40 2.541 -8.372 4.401 1.00 0.00 C ATOM 1339 O GLY B 40 2.116 -7.755 3.430 1.00 0.00 O ATOM 0 H GLY B 40 4.061 -8.777 7.099 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.410 -6.649 5.330 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.539 -7.962 5.057 1.00 0.00 H new ATOM 1343 N TYR B 41 2.169 -9.610 4.690 1.00 0.00 N ATOM 1344 CA TYR B 41 1.227 -10.350 3.868 1.00 0.00 C ATOM 1345 C TYR B 41 -0.181 -9.789 3.984 1.00 0.00 C ATOM 1346 O TYR B 41 -0.939 -9.810 3.012 1.00 0.00 O ATOM 1347 CB TYR B 41 1.227 -11.822 4.290 1.00 0.00 C ATOM 1348 CG TYR B 41 2.129 -12.715 3.466 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.753 -13.132 2.197 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.351 -13.150 3.960 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.568 -13.959 1.447 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.172 -13.973 3.217 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.777 -14.375 1.961 1.00 0.00 C ATOM 1354 OH TYR B 41 4.592 -15.200 1.218 1.00 0.00 O ATOM 0 H TYR B 41 2.511 -10.128 5.499 1.00 0.00 H new ATOM 0 HA TYR B 41 1.542 -10.256 2.829 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.531 -11.887 5.335 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.208 -12.203 4.230 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.808 -12.805 1.789 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.665 -12.838 4.945 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.259 -14.278 0.463 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.120 -14.300 3.619 1.00 0.00 H new ATOM 0 HH TYR B 41 5.407 -15.398 1.725 1.00 0.00 H new ATOM 1364 N THR B 42 -0.530 -9.278 5.152 1.00 0.00 N ATOM 1365 CA THR B 42 -1.825 -8.639 5.339 1.00 0.00 C ATOM 1366 C THR B 42 -1.877 -7.315 4.590 1.00 0.00 C ATOM 1367 O THR B 42 -2.914 -6.920 4.048 1.00 0.00 O ATOM 1368 CB THR B 42 -2.088 -8.383 6.832 1.00 0.00 C ATOM 1369 OG1 THR B 42 -1.867 -9.586 7.572 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.508 -7.892 7.064 1.00 0.00 C ATOM 0 H THR B 42 0.061 -9.292 5.983 1.00 0.00 H new ATOM 0 HA THR B 42 -2.591 -9.308 4.947 1.00 0.00 H new ATOM 0 HB THR B 42 -1.400 -7.609 7.172 1.00 0.00 H new ATOM 0 HG1 THR B 42 -0.906 -9.774 7.612 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.664 -7.720 8.129 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.665 -6.961 6.519 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.215 -8.643 6.711 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.730 -6.663 4.504 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.657 -5.356 3.885 1.00 0.00 C ATOM 1380 C LEU B 43 -0.492 -5.503 2.388 1.00 0.00 C ATOM 1381 O LEU B 43 -0.837 -4.595 1.642 1.00 0.00 O ATOM 1382 CB LEU B 43 0.510 -4.533 4.453 1.00 0.00 C ATOM 1383 CG LEU B 43 0.163 -3.516 5.556 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.590 -4.186 6.693 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.432 -2.866 6.082 1.00 0.00 C ATOM 0 H LEU B 43 0.160 -7.018 4.855 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.586 -4.829 4.103 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.254 -5.224 4.849 1.00 0.00 H new ATOM 0 HB3 LEU B 43 0.981 -3.996 3.630 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.480 -2.749 5.125 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.824 -3.447 7.460 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.515 -4.619 6.312 1.00 0.00 H new ATOM 0 HD13 LEU B 43 0.028 -4.973 7.124 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.177 -2.148 6.862 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.089 -3.632 6.495 1.00 0.00 H new ATOM 0 HD23 LEU B 43 1.942 -2.351 5.268 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.017 -6.659 1.926 1.00 0.00 N ATOM 1398 CA LEU B 44 0.233 -6.836 0.510 1.00 0.00 C ATOM 1399 C LEU B 44 -1.078 -7.102 -0.213 1.00 0.00 C ATOM 1400 O LEU B 44 -1.344 -6.514 -1.248 1.00 0.00 O ATOM 1401 CB LEU B 44 1.268 -7.964 0.264 1.00 0.00 C ATOM 1402 CG LEU B 44 0.745 -9.402 0.054 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.171 -9.596 -1.347 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.861 -10.408 0.263 1.00 0.00 C ATOM 0 H LEU B 44 0.197 -7.470 2.506 1.00 0.00 H new ATOM 0 HA LEU B 44 0.664 -5.920 0.107 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.855 -7.692 -0.613 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.952 -7.979 1.113 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.048 -9.562 0.785 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.186 -10.620 -1.455 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.658 -8.905 -1.500 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.947 -9.402 -2.088 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.475 -11.416 0.111 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.663 -10.215 -0.450 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.248 -10.317 1.278 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.913 -7.964 0.352 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.157 -8.347 -0.303 1.00 0.00 C ATOM 1418 C ASP B 45 -4.149 -7.195 -0.276 1.00 0.00 C ATOM 1419 O ASP B 45 -5.055 -7.114 -1.105 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.754 -9.580 0.371 1.00 0.00 C ATOM 1421 CG ASP B 45 -4.936 -10.133 -0.392 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -4.717 -10.820 -1.407 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.087 -9.878 0.012 1.00 0.00 O ATOM 0 H ASP B 45 -1.754 -8.409 1.256 1.00 0.00 H new ATOM 0 HA ASP B 45 -2.940 -8.591 -1.343 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -2.988 -10.350 0.459 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.065 -9.323 1.384 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.942 -6.285 0.657 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.722 -5.063 0.723 1.00 0.00 C ATOM 1430 C PHE B 46 -4.272 -4.095 -0.355 1.00 0.00 C ATOM 1431 O PHE B 46 -5.095 -3.501 -1.049 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.500 -4.431 2.097 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.290 -3.186 2.370 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.548 -3.264 2.943 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.765 -1.938 2.080 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.268 -2.121 3.218 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.483 -0.791 2.350 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.733 -0.883 2.921 1.00 0.00 C ATOM 0 H PHE B 46 -3.234 -6.370 1.386 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.777 -5.289 0.569 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.743 -5.170 2.861 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.440 -4.199 2.204 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -6.970 -4.230 3.177 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.783 -1.861 1.638 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.249 -2.194 3.665 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -5.066 0.177 2.114 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.295 0.014 3.137 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.973 -3.974 -0.536 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.463 -3.018 -1.494 1.00 0.00 C ATOM 1450 C ILE B 47 -2.568 -3.579 -2.910 1.00 0.00 C ATOM 1451 O ILE B 47 -2.681 -2.834 -3.879 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.015 -2.593 -1.171 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.087 -3.810 -1.154 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.985 -1.875 0.169 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.341 -3.501 -0.755 1.00 0.00 C ATOM 0 H ILE B 47 -2.263 -4.515 -0.042 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.079 -2.121 -1.428 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.661 -1.914 -1.946 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.492 -4.551 -0.465 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.085 -4.264 -2.145 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.037 -1.574 0.398 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.621 -0.991 0.123 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.350 -2.544 0.948 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.929 -4.418 -0.769 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.768 -2.785 -1.457 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.355 -3.077 0.249 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.549 -4.900 -3.018 1.00 0.00 N ATOM 1468 CA GLN B 48 -2.939 -5.569 -4.239 1.00 0.00 C ATOM 1469 C GLN B 48 -4.359 -5.168 -4.599 1.00 0.00 C ATOM 1470 O GLN B 48 -4.589 -4.507 -5.590 1.00 0.00 O ATOM 1471 CB GLN B 48 -2.873 -7.091 -4.063 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.467 -7.641 -3.895 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.561 -7.324 -5.066 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -1.011 -7.218 -6.207 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.721 -7.166 -4.786 1.00 0.00 N ATOM 0 H GLN B 48 -2.265 -5.528 -2.266 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.254 -5.276 -5.034 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.466 -7.370 -3.192 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.335 -7.565 -4.929 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.030 -7.232 -2.984 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.519 -8.722 -3.766 1.00 0.00 H new ATOM 0 HE21 GLN B 48 1.049 -7.263 -3.825 1.00 0.00 H new ATOM 0 HE22 GLN B 48 1.382 -6.947 -5.531 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.273 -5.450 -3.693 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.705 -5.438 -3.976 1.00 0.00 C ATOM 1486 C LYS B 49 -7.278 -4.018 -4.021 1.00 0.00 C ATOM 1487 O LYS B 49 -8.469 -3.829 -4.283 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.410 -6.256 -2.888 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.842 -6.645 -3.209 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.561 -7.232 -1.994 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.809 -8.407 -1.378 1.00 0.00 C ATOM 1492 NZ LYS B 49 -7.870 -7.982 -0.303 1.00 0.00 N ATOM 0 H LYS B 49 -5.047 -5.697 -2.729 1.00 0.00 H new ATOM 0 HA LYS B 49 -6.871 -5.872 -4.962 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.834 -7.163 -2.706 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.404 -5.683 -1.961 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.385 -5.769 -3.564 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -8.847 -7.373 -4.020 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.690 -6.454 -1.242 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.558 -7.558 -2.289 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -9.526 -9.119 -0.969 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -8.252 -8.927 -2.158 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -7.072 -8.647 -0.256 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -7.513 -7.027 -0.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -8.368 -7.974 0.610 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.466 -3.008 -3.728 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.936 -1.648 -3.988 1.00 0.00 C ATOM 1508 C HIS B 50 -6.108 -0.898 -5.035 1.00 0.00 C ATOM 1509 O HIS B 50 -6.426 0.241 -5.364 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.988 -0.865 -2.672 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.852 -1.534 -1.647 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -9.200 -1.719 -1.817 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -7.542 -2.142 -0.483 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -9.680 -2.414 -0.809 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.695 -2.691 0.020 1.00 0.00 N ATOM 0 H HIS B 50 -5.530 -3.091 -3.332 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.936 -1.733 -4.414 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.978 -0.755 -2.277 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.366 0.139 -2.864 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -6.563 -2.188 -0.029 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -10.711 -2.709 -0.682 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -8.775 -3.222 0.887 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.061 -1.519 -5.566 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.331 -0.927 -6.695 1.00 0.00 C ATOM 1526 C LEU B 51 -4.352 -1.856 -7.901 1.00 0.00 C ATOM 1527 O LEU B 51 -4.811 -1.492 -8.985 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.859 -0.629 -6.360 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.577 0.536 -5.397 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -3.265 1.817 -5.850 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -2.990 0.183 -3.985 1.00 0.00 C ATOM 0 H LEU B 51 -4.699 -2.417 -5.244 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.841 0.010 -6.917 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.420 -1.532 -5.935 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.334 -0.429 -7.294 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.502 0.714 -5.408 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -3.043 2.618 -5.145 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.903 2.094 -6.840 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.342 1.657 -5.890 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.780 1.024 -3.324 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.057 -0.039 -3.963 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.431 -0.691 -3.650 1.00 0.00 H new ATOM 1543 N ASN B 52 -3.873 -3.067 -7.688 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.572 -3.988 -8.771 1.00 0.00 C ATOM 1545 C ASN B 52 -4.595 -5.115 -8.889 1.00 0.00 C ATOM 1546 O ASN B 52 -4.735 -5.719 -9.952 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.173 -4.564 -8.556 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.125 -3.882 -9.425 1.00 0.00 C ATOM 1549 OD1 ASN B 52 0.038 -3.765 -9.043 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -1.521 -3.445 -10.614 1.00 0.00 N ATOM 0 H ASN B 52 -3.681 -3.442 -6.759 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.616 -3.431 -9.707 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -1.896 -4.458 -7.507 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.185 -5.632 -8.776 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -0.853 -2.997 -11.241 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -2.493 -3.558 -10.901 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.308 -5.393 -7.818 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.338 -6.407 -7.832 1.00 0.00 C ATOM 1559 C LYS B 53 -7.712 -5.758 -7.745 1.00 0.00 C ATOM 1560 O LYS B 53 -8.075 -5.272 -6.661 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.132 -7.388 -6.676 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.454 -8.679 -7.093 1.00 0.00 C ATOM 1563 CD LYS B 53 -5.763 -9.808 -6.120 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.052 -9.642 -4.790 1.00 0.00 C ATOM 1565 NZ LYS B 53 -5.272 -10.822 -3.912 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.419 -5.724 -8.771 1.00 0.00 O ATOM 0 H LYS B 53 -5.190 -4.925 -6.919 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.275 -6.961 -8.768 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.534 -6.906 -5.903 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.099 -7.622 -6.231 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -5.784 -8.958 -8.094 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.376 -8.526 -7.144 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -6.839 -9.852 -5.950 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -5.472 -10.758 -6.567 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -3.984 -9.506 -4.960 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.413 -8.742 -4.292 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -4.832 -10.652 -2.985 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -6.293 -10.976 -3.787 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -4.846 -11.664 -4.349 1.00 0.00 H new TER 1580 LYS B 53 HETATM 1581 N FME C 1 -10.496 3.685 14.211 1.00 0.00 N HETATM 1582 CN FME C 1 -10.182 2.572 14.856 1.00 0.00 C HETATM 1583 O1 FME C 1 -10.979 2.004 15.604 1.00 0.00 O HETATM 1584 CA FME C 1 -9.538 4.362 13.349 1.00 0.00 C HETATM 1585 CB FME C 1 -10.235 5.502 12.600 1.00 0.00 C HETATM 1586 CG FME C 1 -9.388 6.162 11.524 1.00 0.00 C HETATM 1587 SD FME C 1 -10.284 7.473 10.665 1.00 0.00 S HETATM 1588 CE FME C 1 -9.113 7.914 9.386 1.00 0.00 C HETATM 1589 C FME C 1 -8.380 4.901 14.183 1.00 0.00 C HETATM 1590 O FME C 1 -8.531 5.882 14.909 1.00 0.00 O HETATM 0 HG3 FME C 1 -8.486 6.575 11.976 1.00 0.00 H new HETATM 0 HG2 FME C 1 -9.067 5.410 10.803 1.00 0.00 H new HETATM 0 HE3 FME C 1 -9.117 8.995 9.246 1.00 0.00 H new HETATM 0 HE2 FME C 1 -8.114 7.590 9.680 1.00 0.00 H new HETATM 0 HE1 FME C 1 -9.393 7.426 8.453 1.00 0.00 H new HETATM 0 HCN FME C 1 -9.188 2.145 14.721 1.00 0.00 H new HETATM 0 HB3 FME C 1 -11.145 5.115 12.141 1.00 0.00 H new HETATM 0 HB2 FME C 1 -10.539 6.261 13.321 1.00 0.00 H new HETATM 0 HA FME C 1 -9.142 3.654 12.621 1.00 0.00 H new HETATM 0 H FME C 1 -11.431 4.077 14.321 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.228 4.253 14.081 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.074 4.615 14.897 1.00 0.00 C ATOM 1603 C VAL C 2 -5.029 5.355 14.064 1.00 0.00 C ATOM 1604 O VAL C 2 -4.087 5.946 14.591 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.440 3.355 15.539 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -4.841 2.442 14.478 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.396 3.732 16.583 1.00 0.00 C ATOM 0 H VAL C 2 -7.066 3.474 13.442 1.00 0.00 H new ATOM 0 HA VAL C 2 -6.421 5.277 15.690 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.235 2.808 16.045 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.403 1.566 14.957 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -5.622 2.125 13.787 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.068 2.980 13.929 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -3.970 2.826 17.015 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.605 4.316 16.112 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -4.865 4.323 17.370 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.212 5.339 12.757 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.265 5.975 11.864 1.00 0.00 C ATOM 1619 C ILE C 3 -4.947 7.067 11.053 1.00 0.00 C ATOM 1620 O ILE C 3 -6.072 6.896 10.586 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.594 4.947 10.922 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.503 5.619 10.083 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.628 4.275 10.025 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.728 4.657 9.210 1.00 0.00 C ATOM 0 H ILE C 3 -6.004 4.895 12.293 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.485 6.425 12.477 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.129 4.176 11.536 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.960 6.381 9.452 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.809 6.131 10.749 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.132 3.557 9.372 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.363 3.757 10.641 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -5.130 5.030 9.419 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.973 5.205 8.646 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.241 3.909 9.836 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.410 4.163 8.518 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.290 8.209 10.952 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.752 9.283 10.095 1.00 0.00 C ATOM 1638 C ALA C 4 -3.666 9.645 9.096 1.00 0.00 C ATOM 1639 O ALA C 4 -2.474 9.512 9.381 1.00 0.00 O ATOM 1640 CB ALA C 4 -5.145 10.495 10.923 1.00 0.00 C ATOM 0 H ALA C 4 -3.429 8.416 11.458 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.634 8.947 9.550 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.489 11.291 10.262 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.946 10.222 11.610 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.282 10.843 11.491 1.00 0.00 H new ATOM 1646 N THR C 5 -4.091 10.093 7.924 1.00 0.00 N ATOM 1647 CA THR C 5 -3.186 10.391 6.824 1.00 0.00 C ATOM 1648 C THR C 5 -2.269 11.569 7.156 1.00 0.00 C ATOM 1649 O THR C 5 -1.265 11.790 6.489 1.00 0.00 O ATOM 1650 CB THR C 5 -3.993 10.707 5.553 1.00 0.00 C ATOM 1651 OG1 THR C 5 -5.229 9.976 5.581 1.00 0.00 O ATOM 1652 CG2 THR C 5 -3.215 10.325 4.304 1.00 0.00 C ATOM 0 H THR C 5 -5.074 10.260 7.709 1.00 0.00 H new ATOM 0 HA THR C 5 -2.563 9.512 6.657 1.00 0.00 H new ATOM 0 HB THR C 5 -4.188 11.779 5.526 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.746 10.177 4.773 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.808 10.559 3.420 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.280 10.885 4.272 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.998 9.257 4.323 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.600 12.283 8.224 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.858 13.476 8.624 1.00 0.00 C ATOM 1662 C ASP C 6 -0.588 13.106 9.382 1.00 0.00 C ATOM 1663 O ASP C 6 0.229 13.971 9.702 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.727 14.365 9.518 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.978 14.869 8.830 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.874 14.047 8.533 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -4.091 16.094 8.612 1.00 0.00 O ATOM 0 H ASP C 6 -3.384 12.055 8.835 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.585 14.014 7.716 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -3.012 13.804 10.408 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -2.137 15.218 9.853 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.420 11.822 9.673 1.00 0.00 N ATOM 1673 CA ASP C 7 0.773 11.357 10.370 1.00 0.00 C ATOM 1674 C ASP C 7 1.740 10.682 9.405 1.00 0.00 C ATOM 1675 O ASP C 7 2.908 10.464 9.729 1.00 0.00 O ATOM 1676 CB ASP C 7 0.396 10.358 11.474 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.510 10.949 12.534 1.00 0.00 C ATOM 1678 OD1 ASP C 7 0.007 11.508 13.521 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.746 10.838 12.403 1.00 0.00 O ATOM 0 H ASP C 7 -1.089 11.089 9.439 1.00 0.00 H new ATOM 0 HA ASP C 7 1.256 12.229 10.812 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.098 9.498 11.022 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.306 9.990 11.948 1.00 0.00 H new ATOM 1684 N LEU C 8 1.256 10.351 8.215 1.00 0.00 N ATOM 1685 CA LEU C 8 2.085 9.676 7.224 1.00 0.00 C ATOM 1686 C LEU C 8 2.299 10.552 6.003 1.00 0.00 C ATOM 1687 O LEU C 8 3.264 10.373 5.257 1.00 0.00 O ATOM 1688 CB LEU C 8 1.474 8.338 6.807 1.00 0.00 C ATOM 1689 CG LEU C 8 1.593 7.223 7.846 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.620 7.435 8.995 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.366 5.870 7.195 1.00 0.00 C ATOM 0 H LEU C 8 0.300 10.537 7.913 1.00 0.00 H new ATOM 0 HA LEU C 8 3.052 9.483 7.688 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.419 8.492 6.580 1.00 0.00 H new ATOM 0 HB3 LEU C 8 1.953 8.008 5.885 1.00 0.00 H new ATOM 0 HG LEU C 8 2.602 7.249 8.257 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.728 6.626 9.718 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.833 8.387 9.481 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.400 7.444 8.611 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.454 5.085 7.946 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.369 5.841 6.754 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.112 5.711 6.416 1.00 0.00 H new ATOM 1703 N GLU C 9 1.400 11.498 5.814 1.00 0.00 N ATOM 1704 CA GLU C 9 1.519 12.461 4.742 1.00 0.00 C ATOM 1705 C GLU C 9 1.431 13.864 5.316 1.00 0.00 C ATOM 1706 O GLU C 9 0.515 14.192 6.068 1.00 0.00 O ATOM 1707 CB GLU C 9 0.448 12.244 3.667 1.00 0.00 C ATOM 1708 CG GLU C 9 0.628 10.945 2.893 1.00 0.00 C ATOM 1709 CD GLU C 9 -0.351 10.793 1.746 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -1.453 11.365 1.807 1.00 0.00 O ATOM 1711 OE2 GLU C 9 -0.018 10.084 0.771 1.00 0.00 O ATOM 0 H GLU C 9 0.572 11.619 6.397 1.00 0.00 H new ATOM 0 HA GLU C 9 2.487 12.327 4.259 1.00 0.00 H new ATOM 0 HB2 GLU C 9 -0.535 12.245 4.138 1.00 0.00 H new ATOM 0 HB3 GLU C 9 0.469 13.081 2.969 1.00 0.00 H new ATOM 0 HG2 GLU C 9 1.645 10.900 2.503 1.00 0.00 H new ATOM 0 HG3 GLU C 9 0.511 10.104 3.576 1.00 0.00 H new ATOM 1718 N VAL C 10 2.403 14.676 4.967 1.00 0.00 N ATOM 1719 CA VAL C 10 2.501 16.027 5.476 1.00 0.00 C ATOM 1720 C VAL C 10 2.610 16.988 4.305 1.00 0.00 C ATOM 1721 O VAL C 10 3.248 16.678 3.298 1.00 0.00 O ATOM 1722 CB VAL C 10 3.720 16.182 6.425 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.013 15.791 5.727 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.816 17.600 6.972 1.00 0.00 C ATOM 0 H VAL C 10 3.150 14.419 4.321 1.00 0.00 H new ATOM 0 HA VAL C 10 1.607 16.255 6.056 1.00 0.00 H new ATOM 0 HB VAL C 10 3.568 15.504 7.265 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.849 15.910 6.416 1.00 0.00 H new ATOM 0 HG12 VAL C 10 4.953 14.751 5.405 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.165 16.431 4.858 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.679 17.677 7.633 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.928 18.302 6.146 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.910 17.837 7.529 1.00 0.00 H new ATOM 1734 N ALA C 11 1.970 18.138 4.421 1.00 0.00 N ATOM 1735 CA ALA C 11 1.969 19.113 3.349 1.00 0.00 C ATOM 1736 C ALA C 11 3.383 19.617 3.085 1.00 0.00 C ATOM 1737 O ALA C 11 4.098 20.013 4.005 1.00 0.00 O ATOM 1738 CB ALA C 11 1.038 20.257 3.725 1.00 0.00 C ATOM 0 H ALA C 11 1.444 18.418 5.249 1.00 0.00 H new ATOM 0 HA ALA C 11 1.611 18.650 2.429 1.00 0.00 H new ATOM 0 HB1 ALA C 11 1.029 20.997 2.925 1.00 0.00 H new ATOM 0 HB2 ALA C 11 0.029 19.871 3.873 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.388 20.723 4.646 1.00 0.00 H new ATOM 1744 N CYS C 12 3.776 19.582 1.812 1.00 0.00 N ATOM 1745 CA CYS C 12 5.150 19.805 1.386 1.00 0.00 C ATOM 1746 C CYS C 12 5.651 21.223 1.715 1.00 0.00 C ATOM 1747 O CYS C 12 4.843 22.117 1.924 1.00 0.00 O ATOM 1748 CB CYS C 12 5.189 19.540 -0.124 1.00 0.00 C ATOM 1749 SG CYS C 12 6.791 19.738 -0.917 1.00 0.00 S ATOM 0 H CYS C 12 3.137 19.395 1.040 1.00 0.00 H new ATOM 0 HA CYS C 12 5.819 19.134 1.925 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.840 18.523 -0.304 1.00 0.00 H new ATOM 0 HB3 CYS C 12 4.480 20.211 -0.609 1.00 0.00 H new ATOM 1754 N PRO C 13 6.983 21.446 1.787 1.00 0.00 N ATOM 1755 CA PRO C 13 7.572 22.769 2.039 1.00 0.00 C ATOM 1756 C PRO C 13 6.841 23.943 1.371 1.00 0.00 C ATOM 1757 O PRO C 13 6.680 25.002 1.978 1.00 0.00 O ATOM 1758 CB PRO C 13 8.959 22.617 1.422 1.00 0.00 C ATOM 1759 CG PRO C 13 9.334 21.200 1.675 1.00 0.00 C ATOM 1760 CD PRO C 13 8.038 20.415 1.676 1.00 0.00 C ATOM 0 HA PRO C 13 7.538 23.016 3.100 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.944 22.838 0.355 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.673 23.303 1.879 1.00 0.00 H new ATOM 0 HG2 PRO C 13 10.011 20.833 0.904 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.852 21.098 2.629 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.927 19.830 0.763 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.998 19.715 2.510 1.00 0.00 H new ATOM 1768 N LYS C 14 6.370 23.747 0.139 1.00 0.00 N ATOM 1769 CA LYS C 14 5.945 24.885 -0.674 1.00 0.00 C ATOM 1770 C LYS C 14 4.761 24.582 -1.607 1.00 0.00 C ATOM 1771 O LYS C 14 4.023 25.493 -1.965 1.00 0.00 O ATOM 1772 CB LYS C 14 7.156 25.392 -1.481 1.00 0.00 C ATOM 1773 CG LYS C 14 6.901 26.639 -2.329 1.00 0.00 C ATOM 1774 CD LYS C 14 6.459 26.281 -3.745 1.00 0.00 C ATOM 1775 CE LYS C 14 6.228 27.522 -4.594 1.00 0.00 C ATOM 1776 NZ LYS C 14 5.141 28.375 -4.047 1.00 0.00 N ATOM 0 H LYS C 14 6.275 22.835 -0.308 1.00 0.00 H new ATOM 0 HA LYS C 14 5.581 25.653 0.008 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.970 25.604 -0.788 1.00 0.00 H new ATOM 0 HB3 LYS C 14 7.496 24.590 -2.137 1.00 0.00 H new ATOM 0 HG2 LYS C 14 6.135 27.252 -1.853 1.00 0.00 H new ATOM 0 HG3 LYS C 14 7.809 27.241 -2.373 1.00 0.00 H new ATOM 0 HD2 LYS C 14 7.217 25.655 -4.215 1.00 0.00 H new ATOM 0 HD3 LYS C 14 5.542 25.694 -3.702 1.00 0.00 H new ATOM 0 HE2 LYS C 14 7.150 28.101 -4.649 1.00 0.00 H new ATOM 0 HE3 LYS C 14 5.978 27.224 -5.612 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 4.888 29.104 -4.744 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 4.308 27.787 -3.843 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 5.466 28.831 -3.171 1.00 0.00 H new ATOM 1790 N CYS C 15 4.566 23.336 -2.030 1.00 0.00 N ATOM 1791 CA CYS C 15 3.588 23.090 -3.095 1.00 0.00 C ATOM 1792 C CYS C 15 2.410 22.200 -2.688 1.00 0.00 C ATOM 1793 O CYS C 15 1.960 21.362 -3.475 1.00 0.00 O ATOM 1794 CB CYS C 15 4.330 22.389 -4.227 1.00 0.00 C ATOM 1795 SG CYS C 15 5.058 20.803 -3.740 1.00 0.00 S ATOM 0 H CYS C 15 5.047 22.510 -1.673 1.00 0.00 H new ATOM 0 HA CYS C 15 3.163 24.055 -3.370 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.641 22.224 -5.055 1.00 0.00 H new ATOM 0 HB3 CYS C 15 5.119 23.045 -4.594 1.00 0.00 H new ATOM 1800 N GLU C 16 1.848 22.437 -1.520 1.00 0.00 N ATOM 1801 CA GLU C 16 0.832 21.553 -0.969 1.00 0.00 C ATOM 1802 C GLU C 16 -0.565 21.965 -1.381 1.00 0.00 C ATOM 1803 O GLU C 16 -1.542 21.595 -0.727 1.00 0.00 O ATOM 1804 CB GLU C 16 0.889 21.569 0.557 1.00 0.00 C ATOM 1805 CG GLU C 16 2.103 22.266 1.138 1.00 0.00 C ATOM 1806 CD GLU C 16 1.930 23.767 1.213 1.00 0.00 C ATOM 1807 OE1 GLU C 16 2.178 24.444 0.199 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.545 24.275 2.285 1.00 0.00 O ATOM 0 H GLU C 16 2.076 23.237 -0.929 1.00 0.00 H new ATOM 0 HA GLU C 16 1.042 20.557 -1.359 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.009 22.057 0.935 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.869 20.541 0.919 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.298 21.876 2.137 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.977 22.034 0.529 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.682 22.699 -2.471 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.969 23.208 -2.891 1.00 0.00 C ATOM 1817 C ARG C 17 -1.975 23.250 -4.419 1.00 0.00 C ATOM 1818 O ARG C 17 -3.011 23.451 -5.051 1.00 0.00 O ATOM 1819 CB ARG C 17 -2.276 24.590 -2.293 1.00 0.00 C ATOM 1820 CG ARG C 17 -1.390 25.726 -2.787 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.105 25.862 -1.982 1.00 0.00 C ATOM 1822 NE ARG C 17 0.550 27.145 -2.244 1.00 0.00 N ATOM 1823 CZ ARG C 17 1.533 27.657 -1.504 1.00 0.00 C ATOM 1824 NH1 ARG C 17 2.048 26.971 -0.499 1.00 0.00 N ATOM 1825 NH2 ARG C 17 2.017 28.858 -1.785 1.00 0.00 N ATOM 0 H ARG C 17 0.097 22.954 -3.078 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.756 22.549 -2.524 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -3.314 24.840 -2.512 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -2.186 24.526 -1.209 1.00 0.00 H new ATOM 0 HG2 ARG C 17 -1.141 25.558 -3.835 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -1.946 26.662 -2.738 1.00 0.00 H new ATOM 0 HD2 ARG C 17 -0.328 25.775 -0.919 1.00 0.00 H new ATOM 0 HD3 ARG C 17 0.573 25.046 -2.233 1.00 0.00 H new ATOM 0 HE ARG C 17 0.232 27.685 -3.049 1.00 0.00 H new ATOM 0 HH11 ARG C 17 1.693 26.039 -0.283 1.00 0.00 H new ATOM 0 HH12 ARG C 17 2.800 27.373 0.061 1.00 0.00 H new ATOM 0 HH21 ARG C 17 1.637 29.391 -2.568 1.00 0.00 H new ATOM 0 HH22 ARG C 17 2.769 29.250 -1.219 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.785 23.037 -4.998 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.589 23.178 -6.437 1.00 0.00 C ATOM 1841 C ALA C 18 -0.109 21.880 -7.075 1.00 0.00 C ATOM 1842 O ALA C 18 -0.576 21.492 -8.146 1.00 0.00 O ATOM 1843 CB ALA C 18 0.399 24.299 -6.726 1.00 0.00 C ATOM 0 H ALA C 18 0.054 22.766 -4.486 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.555 23.425 -6.877 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.537 24.394 -7.803 1.00 0.00 H new ATOM 0 HB2 ALA C 18 0.013 25.236 -6.325 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.356 24.071 -6.257 1.00 0.00 H new ATOM 1849 N GLY C 19 0.808 21.198 -6.397 1.00 0.00 N ATOM 1850 CA GLY C 19 1.372 19.979 -6.943 1.00 0.00 C ATOM 1851 C GLY C 19 2.613 20.229 -7.779 1.00 0.00 C ATOM 1852 O GLY C 19 3.065 19.348 -8.503 1.00 0.00 O ATOM 0 H GLY C 19 1.169 21.467 -5.482 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.620 19.301 -6.126 1.00 0.00 H new ATOM 0 HA3 GLY C 19 0.621 19.479 -7.555 1.00 0.00 H new ATOM 1856 N GLU C 20 3.200 21.405 -7.634 1.00 0.00 N ATOM 1857 CA GLU C 20 4.327 21.801 -8.468 1.00 0.00 C ATOM 1858 C GLU C 20 5.169 22.849 -7.755 1.00 0.00 C ATOM 1859 O GLU C 20 4.701 23.488 -6.816 1.00 0.00 O ATOM 1860 CB GLU C 20 3.828 22.373 -9.792 1.00 0.00 C ATOM 1861 CG GLU C 20 2.984 23.620 -9.606 1.00 0.00 C ATOM 1862 CD GLU C 20 3.139 24.607 -10.737 1.00 0.00 C ATOM 1863 OE1 GLU C 20 2.503 24.413 -11.788 1.00 0.00 O ATOM 1864 OE2 GLU C 20 3.887 25.597 -10.569 1.00 0.00 O ATOM 0 H GLU C 20 2.916 22.104 -6.947 1.00 0.00 H new ATOM 0 HA GLU C 20 4.937 20.919 -8.661 1.00 0.00 H new ATOM 0 HB2 GLU C 20 4.682 22.608 -10.427 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.242 21.616 -10.313 1.00 0.00 H new ATOM 0 HG2 GLU C 20 1.936 23.334 -9.521 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.260 24.103 -8.668 1.00 0.00 H new ATOM 1871 N ILE C 21 6.399 23.028 -8.209 1.00 0.00 N ATOM 1872 CA ILE C 21 7.282 24.047 -7.658 1.00 0.00 C ATOM 1873 C ILE C 21 8.095 24.658 -8.784 1.00 0.00 C ATOM 1874 O ILE C 21 8.813 23.956 -9.489 1.00 0.00 O ATOM 1875 CB ILE C 21 8.221 23.507 -6.543 1.00 0.00 C ATOM 1876 CG1 ILE C 21 7.393 23.127 -5.307 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.283 24.544 -6.183 1.00 0.00 C ATOM 1878 CD1 ILE C 21 8.197 22.836 -4.052 1.00 0.00 C ATOM 0 H ILE C 21 6.812 22.478 -8.962 1.00 0.00 H new ATOM 0 HA ILE C 21 6.656 24.803 -7.185 1.00 0.00 H new ATOM 0 HB ILE C 21 8.732 22.618 -6.912 1.00 0.00 H new ATOM 0 HG12 ILE C 21 6.697 23.938 -5.093 1.00 0.00 H new ATOM 0 HG13 ILE C 21 6.794 22.248 -5.547 1.00 0.00 H new ATOM 0 HG21 ILE C 21 9.930 24.146 -5.401 1.00 0.00 H new ATOM 0 HG22 ILE C 21 9.880 24.775 -7.065 1.00 0.00 H new ATOM 0 HG23 ILE C 21 8.798 25.452 -5.826 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.520 22.578 -3.238 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.874 22.002 -4.239 1.00 0.00 H new ATOM 0 HD13 ILE C 21 8.775 23.718 -3.777 1.00 0.00 H new ATOM 1890 N GLU C 22 7.972 25.970 -8.934 1.00 0.00 N ATOM 1891 CA GLU C 22 8.592 26.690 -10.040 1.00 0.00 C ATOM 1892 C GLU C 22 8.163 26.099 -11.378 1.00 0.00 C ATOM 1893 O GLU C 22 8.979 25.931 -12.282 1.00 0.00 O ATOM 1894 CB GLU C 22 10.110 26.613 -9.904 1.00 0.00 C ATOM 1895 CG GLU C 22 10.849 27.777 -10.544 1.00 0.00 C ATOM 1896 CD GLU C 22 12.162 28.074 -9.860 1.00 0.00 C ATOM 1897 OE1 GLU C 22 13.123 27.301 -10.039 1.00 0.00 O ATOM 1898 OE2 GLU C 22 12.239 29.089 -9.133 1.00 0.00 O ATOM 0 H GLU C 22 7.442 26.564 -8.296 1.00 0.00 H new ATOM 0 HA GLU C 22 8.270 27.731 -10.006 1.00 0.00 H new ATOM 0 HB2 GLU C 22 10.368 26.570 -8.846 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.458 25.683 -10.355 1.00 0.00 H new ATOM 0 HG2 GLU C 22 11.033 27.553 -11.595 1.00 0.00 H new ATOM 0 HG3 GLU C 22 10.218 28.665 -10.513 1.00 0.00 H new ATOM 1905 N GLY C 23 6.883 25.753 -11.495 1.00 0.00 N ATOM 1906 CA GLY C 23 6.390 25.109 -12.699 1.00 0.00 C ATOM 1907 C GLY C 23 7.099 23.813 -12.997 1.00 0.00 C ATOM 1908 O GLY C 23 6.951 23.235 -14.074 1.00 0.00 O ATOM 0 H GLY C 23 6.178 25.908 -10.775 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.322 24.918 -12.593 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.510 25.787 -13.544 1.00 0.00 H new ATOM 1912 N THR C 24 7.863 23.361 -12.035 1.00 0.00 N ATOM 1913 CA THR C 24 8.733 22.232 -12.198 1.00 0.00 C ATOM 1914 C THR C 24 8.354 21.120 -11.209 1.00 0.00 C ATOM 1915 O THR C 24 7.897 21.399 -10.093 1.00 0.00 O ATOM 1916 CB THR C 24 10.163 22.762 -11.990 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.725 23.152 -13.249 1.00 0.00 O ATOM 1918 CG2 THR C 24 11.083 21.776 -11.284 1.00 0.00 C ATOM 0 H THR C 24 7.896 23.776 -11.104 1.00 0.00 H new ATOM 0 HA THR C 24 8.649 21.781 -13.187 1.00 0.00 H new ATOM 0 HB THR C 24 10.082 23.626 -11.330 1.00 0.00 H new ATOM 0 HG1 THR C 24 11.634 23.490 -13.111 1.00 0.00 H new ATOM 0 HG21 THR C 24 12.073 22.218 -11.172 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.678 21.541 -10.300 1.00 0.00 H new ATOM 0 HG23 THR C 24 11.158 20.862 -11.873 1.00 0.00 H new ATOM 1926 N PRO C 25 8.483 19.844 -11.631 1.00 0.00 N ATOM 1927 CA PRO C 25 8.125 18.687 -10.803 1.00 0.00 C ATOM 1928 C PRO C 25 8.852 18.695 -9.463 1.00 0.00 C ATOM 1929 O PRO C 25 10.076 18.825 -9.396 1.00 0.00 O ATOM 1930 CB PRO C 25 8.535 17.476 -11.653 1.00 0.00 C ATOM 1931 CG PRO C 25 9.473 18.024 -12.672 1.00 0.00 C ATOM 1932 CD PRO C 25 8.995 19.423 -12.944 1.00 0.00 C ATOM 0 HA PRO C 25 7.066 18.682 -10.547 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.016 16.710 -11.044 1.00 0.00 H new ATOM 0 HB3 PRO C 25 7.668 17.011 -12.123 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.498 18.024 -12.302 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.462 17.422 -13.580 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.803 20.068 -13.291 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.219 19.445 -13.709 1.00 0.00 H new ATOM 1940 N CYS C 26 8.074 18.558 -8.403 1.00 0.00 N ATOM 1941 CA CYS C 26 8.568 18.756 -7.051 1.00 0.00 C ATOM 1942 C CYS C 26 9.336 17.536 -6.517 1.00 0.00 C ATOM 1943 O CYS C 26 8.869 16.406 -6.635 1.00 0.00 O ATOM 1944 CB CYS C 26 7.399 19.071 -6.137 1.00 0.00 C ATOM 1945 SG CYS C 26 7.891 19.589 -4.464 1.00 0.00 S ATOM 0 H CYS C 26 7.087 18.308 -8.454 1.00 0.00 H new ATOM 0 HA CYS C 26 9.272 19.588 -7.073 1.00 0.00 H new ATOM 0 HB2 CYS C 26 6.799 19.860 -6.590 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.762 18.190 -6.061 1.00 0.00 H new ATOM 1950 N PRO C 27 10.503 17.799 -5.877 1.00 0.00 N ATOM 1951 CA PRO C 27 11.447 16.802 -5.335 1.00 0.00 C ATOM 1952 C PRO C 27 10.859 15.455 -4.887 1.00 0.00 C ATOM 1953 O PRO C 27 11.290 14.398 -5.341 1.00 0.00 O ATOM 1954 CB PRO C 27 11.988 17.538 -4.111 1.00 0.00 C ATOM 1955 CG PRO C 27 11.996 18.987 -4.479 1.00 0.00 C ATOM 1956 CD PRO C 27 11.038 19.157 -5.647 1.00 0.00 C ATOM 0 HA PRO C 27 12.157 16.504 -6.106 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.360 17.360 -3.238 1.00 0.00 H new ATOM 0 HB3 PRO C 27 12.991 17.193 -3.858 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.685 19.601 -3.634 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.000 19.309 -4.755 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.243 19.864 -5.410 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.550 19.538 -6.530 1.00 0.00 H new ATOM 1964 N ALA C 28 9.876 15.500 -3.996 1.00 0.00 N ATOM 1965 CA ALA C 28 9.413 14.291 -3.317 1.00 0.00 C ATOM 1966 C ALA C 28 7.910 14.098 -3.476 1.00 0.00 C ATOM 1967 O ALA C 28 7.361 13.069 -3.100 1.00 0.00 O ATOM 1968 CB ALA C 28 9.790 14.332 -1.840 1.00 0.00 C ATOM 0 H ALA C 28 9.386 16.353 -3.727 1.00 0.00 H new ATOM 0 HA ALA C 28 9.908 13.440 -3.785 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.438 13.425 -1.349 1.00 0.00 H new ATOM 0 HB2 ALA C 28 10.874 14.400 -1.743 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.328 15.201 -1.371 1.00 0.00 H new ATOM 1974 N CYS C 29 7.247 15.097 -4.023 1.00 0.00 N ATOM 1975 CA CYS C 29 5.815 15.019 -4.251 1.00 0.00 C ATOM 1976 C CYS C 29 5.511 15.420 -5.689 1.00 0.00 C ATOM 1977 O CYS C 29 5.336 16.604 -5.987 1.00 0.00 O ATOM 1978 CB CYS C 29 5.069 15.928 -3.256 1.00 0.00 C ATOM 1979 SG CYS C 29 5.464 17.689 -3.403 1.00 0.00 S ATOM 0 H CYS C 29 7.676 15.974 -4.319 1.00 0.00 H new ATOM 0 HA CYS C 29 5.474 13.996 -4.092 1.00 0.00 H new ATOM 0 HB2 CYS C 29 3.996 15.797 -3.398 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.299 15.601 -2.242 1.00 0.00 H new ATOM 1984 N SER C 30 5.484 14.439 -6.582 1.00 0.00 N ATOM 1985 CA SER C 30 5.294 14.685 -8.006 1.00 0.00 C ATOM 1986 C SER C 30 3.850 15.050 -8.349 1.00 0.00 C ATOM 1987 O SER C 30 3.229 14.435 -9.218 1.00 0.00 O ATOM 1988 CB SER C 30 5.728 13.443 -8.782 1.00 0.00 C ATOM 1989 OG SER C 30 5.207 12.269 -8.176 1.00 0.00 O ATOM 0 H SER C 30 5.593 13.454 -6.341 1.00 0.00 H new ATOM 0 HA SER C 30 5.906 15.542 -8.288 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.381 13.512 -9.813 1.00 0.00 H new ATOM 0 HB3 SER C 30 6.816 13.390 -8.815 1.00 0.00 H new ATOM 0 HG SER C 30 5.493 11.483 -8.686 1.00 0.00 H new ATOM 1995 N GLY C 31 3.324 16.049 -7.659 1.00 0.00 N ATOM 1996 CA GLY C 31 2.009 16.553 -7.979 1.00 0.00 C ATOM 1997 C GLY C 31 0.926 15.969 -7.108 1.00 0.00 C ATOM 1998 O GLY C 31 -0.094 15.506 -7.612 1.00 0.00 O ATOM 0 H GLY C 31 3.787 16.520 -6.881 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.006 17.638 -7.874 1.00 0.00 H new ATOM 0 HA3 GLY C 31 1.786 16.333 -9.023 1.00 0.00 H new ATOM 2002 N LYS C 32 1.138 15.984 -5.797 1.00 0.00 N ATOM 2003 CA LYS C 32 0.126 15.521 -4.859 1.00 0.00 C ATOM 2004 C LYS C 32 -0.286 16.682 -3.961 1.00 0.00 C ATOM 2005 O LYS C 32 -1.467 16.929 -3.732 1.00 0.00 O ATOM 2006 CB LYS C 32 0.687 14.416 -3.960 1.00 0.00 C ATOM 2007 CG LYS C 32 1.638 13.459 -4.647 1.00 0.00 C ATOM 2008 CD LYS C 32 2.225 12.489 -3.639 1.00 0.00 C ATOM 2009 CE LYS C 32 3.356 11.675 -4.231 1.00 0.00 C ATOM 2010 NZ LYS C 32 2.901 10.798 -5.350 1.00 0.00 N ATOM 0 H LYS C 32 2.000 16.311 -5.362 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.721 15.138 -5.428 1.00 0.00 H new ATOM 0 HB2 LYS C 32 1.204 14.879 -3.119 1.00 0.00 H new ATOM 0 HB3 LYS C 32 -0.145 13.845 -3.547 1.00 0.00 H new ATOM 0 HG2 LYS C 32 1.112 12.909 -5.427 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.438 14.017 -5.134 1.00 0.00 H new ATOM 0 HD2 LYS C 32 2.590 13.042 -2.773 1.00 0.00 H new ATOM 0 HD3 LYS C 32 1.443 11.818 -3.283 1.00 0.00 H new ATOM 0 HE2 LYS C 32 4.133 12.348 -4.593 1.00 0.00 H new ATOM 0 HE3 LYS C 32 3.805 11.060 -3.451 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 3.671 10.153 -5.620 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 2.076 10.244 -5.043 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 2.639 11.386 -6.167 1.00 0.00 H new ATOM 2024 N GLY C 33 0.729 17.392 -3.462 1.00 0.00 N ATOM 2025 CA GLY C 33 0.536 18.418 -2.478 1.00 0.00 C ATOM 2026 C GLY C 33 1.264 18.060 -1.198 1.00 0.00 C ATOM 2027 O GLY C 33 1.920 18.900 -0.584 1.00 0.00 O ATOM 0 H GLY C 33 1.701 17.259 -3.740 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.903 19.371 -2.859 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.528 18.543 -2.277 1.00 0.00 H new ATOM 2031 N VAL C 34 1.223 16.784 -0.844 1.00 0.00 N ATOM 2032 CA VAL C 34 1.833 16.316 0.393 1.00 0.00 C ATOM 2033 C VAL C 34 3.015 15.388 0.130 1.00 0.00 C ATOM 2034 O VAL C 34 3.176 14.857 -0.976 1.00 0.00 O ATOM 2035 CB VAL C 34 0.802 15.577 1.275 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.308 16.520 1.712 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.223 14.378 0.538 1.00 0.00 C ATOM 0 H VAL C 34 0.774 16.053 -1.396 1.00 0.00 H new ATOM 0 HA VAL C 34 2.194 17.202 0.915 1.00 0.00 H new ATOM 0 HB VAL C 34 1.316 15.217 2.166 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -1.023 15.978 2.332 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.119 17.343 2.285 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.817 16.915 0.833 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.501 13.872 1.178 1.00 0.00 H new ATOM 0 HG22 VAL C 34 -0.271 14.715 -0.373 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.026 13.687 0.281 1.00 0.00 H new ATOM 2047 N ILE C 35 3.851 15.231 1.146 1.00 0.00 N ATOM 2048 CA ILE C 35 4.965 14.293 1.118 1.00 0.00 C ATOM 2049 C ILE C 35 4.878 13.346 2.311 1.00 0.00 C ATOM 2050 O ILE C 35 4.085 13.560 3.223 1.00 0.00 O ATOM 2051 CB ILE C 35 6.334 15.011 1.152 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.386 16.011 2.310 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.613 15.704 -0.171 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.728 16.696 2.469 1.00 0.00 C ATOM 0 H ILE C 35 3.775 15.754 2.019 1.00 0.00 H new ATOM 0 HA ILE C 35 4.893 13.739 0.182 1.00 0.00 H new ATOM 0 HB ILE C 35 7.110 14.262 1.310 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.618 16.769 2.157 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.142 15.492 3.237 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.581 16.202 -0.124 1.00 0.00 H new ATOM 0 HG22 ILE C 35 6.623 14.966 -0.973 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.835 16.442 -0.367 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.686 17.389 3.309 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.499 15.948 2.654 1.00 0.00 H new ATOM 0 HD13 ILE C 35 7.967 17.245 1.558 1.00 0.00 H new ATOM 2066 N LEU C 36 5.692 12.308 2.293 1.00 0.00 N ATOM 2067 CA LEU C 36 5.622 11.258 3.305 1.00 0.00 C ATOM 2068 C LEU C 36 6.480 11.553 4.531 1.00 0.00 C ATOM 2069 O LEU C 36 7.396 12.375 4.492 1.00 0.00 O ATOM 2070 CB LEU C 36 6.059 9.924 2.697 1.00 0.00 C ATOM 2071 CG LEU C 36 5.375 9.569 1.379 1.00 0.00 C ATOM 2072 CD1 LEU C 36 6.242 9.957 0.190 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.035 8.095 1.347 1.00 0.00 C ATOM 0 H LEU C 36 6.414 12.164 1.587 1.00 0.00 H new ATOM 0 HA LEU C 36 4.585 11.211 3.637 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.137 9.949 2.536 1.00 0.00 H new ATOM 0 HB3 LEU C 36 5.863 9.130 3.418 1.00 0.00 H new ATOM 0 HG LEU C 36 4.448 10.138 1.308 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.730 9.693 -0.735 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.426 11.031 0.209 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.192 9.425 0.244 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.548 7.854 0.402 1.00 0.00 H new ATOM 0 HD22 LEU C 36 5.949 7.509 1.444 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.363 7.859 2.172 1.00 0.00 H new ATOM 2085 N THR C 37 6.160 10.855 5.615 1.00 0.00 N ATOM 2086 CA THR C 37 6.951 10.884 6.836 1.00 0.00 C ATOM 2087 C THR C 37 7.722 9.573 6.939 1.00 0.00 C ATOM 2088 O THR C 37 7.601 8.742 6.052 1.00 0.00 O ATOM 2089 CB THR C 37 6.052 11.034 8.083 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.195 9.888 8.211 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.197 12.288 7.995 1.00 0.00 C ATOM 0 H THR C 37 5.340 10.251 5.670 1.00 0.00 H new ATOM 0 HA THR C 37 7.627 11.738 6.797 1.00 0.00 H new ATOM 0 HB THR C 37 6.701 11.113 8.956 1.00 0.00 H new ATOM 0 HG1 THR C 37 4.487 10.080 8.861 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.575 12.367 8.886 1.00 0.00 H new ATOM 0 HG22 THR C 37 5.842 13.164 7.924 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.561 12.233 7.112 1.00 0.00 H new ATOM 2099 N ALA C 38 8.493 9.370 7.998 1.00 0.00 N ATOM 2100 CA ALA C 38 9.267 8.136 8.143 1.00 0.00 C ATOM 2101 C ALA C 38 8.367 6.905 8.111 1.00 0.00 C ATOM 2102 O ALA C 38 8.654 5.940 7.401 1.00 0.00 O ATOM 2103 CB ALA C 38 10.090 8.165 9.416 1.00 0.00 C ATOM 0 H ALA C 38 8.602 10.034 8.765 1.00 0.00 H new ATOM 0 HA ALA C 38 9.947 8.071 7.294 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.657 7.238 9.504 1.00 0.00 H new ATOM 0 HB2 ALA C 38 10.778 9.010 9.385 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.427 8.268 10.275 1.00 0.00 H new ATOM 2109 N GLN C 39 7.279 6.936 8.877 1.00 0.00 N ATOM 2110 CA GLN C 39 6.300 5.855 8.845 1.00 0.00 C ATOM 2111 C GLN C 39 5.718 5.704 7.441 1.00 0.00 C ATOM 2112 O GLN C 39 5.522 4.590 6.956 1.00 0.00 O ATOM 2113 CB GLN C 39 5.178 6.104 9.856 1.00 0.00 C ATOM 2114 CG GLN C 39 4.179 4.961 9.937 1.00 0.00 C ATOM 2115 CD GLN C 39 3.059 5.219 10.924 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.234 5.927 11.913 1.00 0.00 O ATOM 2117 NE2 GLN C 39 1.900 4.638 10.660 1.00 0.00 N ATOM 0 H GLN C 39 7.055 7.693 9.523 1.00 0.00 H new ATOM 0 HA GLN C 39 6.809 4.930 9.117 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.615 6.266 10.841 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.651 7.019 9.586 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.752 4.789 8.949 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.703 4.048 10.221 1.00 0.00 H new ATOM 0 HE21 GLN C 39 1.798 4.058 9.827 1.00 0.00 H new ATOM 0 HE22 GLN C 39 1.108 4.770 11.289 1.00 0.00 H new ATOM 2126 N GLY C 40 5.462 6.833 6.787 1.00 0.00 N ATOM 2127 CA GLY C 40 4.954 6.807 5.429 1.00 0.00 C ATOM 2128 C GLY C 40 5.990 6.291 4.449 1.00 0.00 C ATOM 2129 O GLY C 40 5.658 5.635 3.465 1.00 0.00 O ATOM 0 H GLY C 40 5.598 7.766 7.175 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.066 6.176 5.385 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.646 7.811 5.137 1.00 0.00 H new ATOM 2133 N TYR C 41 7.251 6.574 4.738 1.00 0.00 N ATOM 2134 CA TYR C 41 8.357 6.135 3.902 1.00 0.00 C ATOM 2135 C TYR C 41 8.556 4.632 3.987 1.00 0.00 C ATOM 2136 O TYR C 41 8.895 3.992 2.991 1.00 0.00 O ATOM 2137 CB TYR C 41 9.642 6.852 4.336 1.00 0.00 C ATOM 2138 CG TYR C 41 9.965 8.101 3.541 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.535 8.015 2.277 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.708 9.363 4.057 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.839 9.150 1.552 1.00 0.00 C ATOM 2142 CE2 TYR C 41 10.008 10.505 3.338 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.572 10.393 2.087 1.00 0.00 C ATOM 2144 OH TYR C 41 10.871 11.527 1.368 1.00 0.00 O ATOM 0 H TYR C 41 7.536 7.113 5.556 1.00 0.00 H new ATOM 0 HA TYR C 41 8.121 6.385 2.867 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.556 7.119 5.389 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.477 6.157 4.251 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.744 7.043 1.854 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.266 9.455 5.038 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.283 9.065 0.571 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.801 11.479 3.755 1.00 0.00 H new ATOM 0 HH TYR C 41 10.620 12.319 1.887 1.00 0.00 H new ATOM 2154 N THR C 42 8.311 4.061 5.153 1.00 0.00 N ATOM 2155 CA THR C 42 8.408 2.618 5.322 1.00 0.00 C ATOM 2156 C THR C 42 7.281 1.920 4.575 1.00 0.00 C ATOM 2157 O THR C 42 7.451 0.827 4.025 1.00 0.00 O ATOM 2158 CB THR C 42 8.330 2.246 6.810 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.267 3.032 7.550 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.618 0.769 7.025 1.00 0.00 C ATOM 0 H THR C 42 8.044 4.570 5.995 1.00 0.00 H new ATOM 0 HA THR C 42 9.367 2.294 4.918 1.00 0.00 H new ATOM 0 HB THR C 42 7.318 2.449 7.160 1.00 0.00 H new ATOM 0 HG1 THR C 42 8.945 3.956 7.608 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.555 0.537 8.088 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.887 0.173 6.480 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.619 0.537 6.662 1.00 0.00 H new ATOM 2168 N LEU C 43 6.144 2.590 4.500 1.00 0.00 N ATOM 2169 CA LEU C 43 4.977 2.013 3.873 1.00 0.00 C ATOM 2170 C LEU C 43 5.022 2.254 2.380 1.00 0.00 C ATOM 2171 O LEU C 43 4.412 1.510 1.622 1.00 0.00 O ATOM 2172 CB LEU C 43 3.681 2.603 4.454 1.00 0.00 C ATOM 2173 CG LEU C 43 2.980 1.778 5.550 1.00 0.00 C ATOM 2174 CD1 LEU C 43 3.941 1.448 6.679 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.783 2.543 6.088 1.00 0.00 C ATOM 0 H LEU C 43 6.008 3.532 4.866 1.00 0.00 H new ATOM 0 HA LEU C 43 4.983 0.941 4.072 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.908 3.588 4.861 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.977 2.751 3.635 1.00 0.00 H new ATOM 0 HG LEU C 43 2.638 0.841 5.110 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.422 0.865 7.440 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.778 0.870 6.287 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.314 2.372 7.121 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.292 1.953 6.862 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.117 3.491 6.510 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.080 2.735 5.278 1.00 0.00 H new ATOM 2187 N LEU C 44 5.783 3.254 1.933 1.00 0.00 N ATOM 2188 CA LEU C 44 5.811 3.581 0.521 1.00 0.00 C ATOM 2189 C LEU C 44 6.697 2.591 -0.218 1.00 0.00 C ATOM 2190 O LEU C 44 6.318 2.078 -1.259 1.00 0.00 O ATOM 2191 CB LEU C 44 6.267 5.047 0.297 1.00 0.00 C ATOM 2192 CG LEU C 44 7.775 5.319 0.090 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.229 4.940 -1.316 1.00 0.00 C ATOM 2194 CD2 LEU C 44 8.088 6.785 0.322 1.00 0.00 C ATOM 0 H LEU C 44 6.376 3.838 2.522 1.00 0.00 H new ATOM 0 HA LEU C 44 4.802 3.501 0.117 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.737 5.431 -0.574 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.938 5.633 1.155 1.00 0.00 H new ATOM 0 HG LEU C 44 8.311 4.703 0.812 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.294 5.146 -1.422 1.00 0.00 H new ATOM 0 HD12 LEU C 44 8.046 3.879 -1.484 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.672 5.524 -2.048 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.154 6.958 0.172 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.519 7.394 -0.381 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.816 7.058 1.342 1.00 0.00 H new ATOM 2206 N ASP C 45 7.864 2.294 0.339 1.00 0.00 N ATOM 2207 CA ASP C 45 8.820 1.420 -0.330 1.00 0.00 C ATOM 2208 C ASP C 45 8.326 -0.019 -0.319 1.00 0.00 C ATOM 2209 O ASP C 45 8.723 -0.836 -1.153 1.00 0.00 O ATOM 2210 CB ASP C 45 10.185 1.522 0.345 1.00 0.00 C ATOM 2211 CG ASP C 45 11.258 0.754 -0.394 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.769 1.272 -1.403 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.600 -0.363 0.038 1.00 0.00 O ATOM 0 H ASP C 45 8.171 2.643 1.247 1.00 0.00 H new ATOM 0 HA ASP C 45 8.918 1.739 -1.368 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.475 2.570 0.413 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.111 1.145 1.365 1.00 0.00 H new ATOM 2218 N PHE C 46 7.431 -0.311 0.607 1.00 0.00 N ATOM 2219 CA PHE C 46 6.762 -1.600 0.652 1.00 0.00 C ATOM 2220 C PHE C 46 5.698 -1.677 -0.425 1.00 0.00 C ATOM 2221 O PHE C 46 5.600 -2.673 -1.142 1.00 0.00 O ATOM 2222 CB PHE C 46 6.107 -1.744 2.025 1.00 0.00 C ATOM 2223 CG PHE C 46 5.423 -3.053 2.281 1.00 0.00 C ATOM 2224 CD1 PHE C 46 6.117 -4.112 2.838 1.00 0.00 C ATOM 2225 CD2 PHE C 46 4.077 -3.215 1.991 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.484 -5.310 3.098 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.441 -4.412 2.243 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.145 -5.459 2.800 1.00 0.00 C ATOM 0 H PHE C 46 7.148 0.334 1.345 1.00 0.00 H new ATOM 0 HA PHE C 46 7.484 -2.399 0.483 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.870 -1.598 2.789 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.377 -0.943 2.146 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.165 -4.000 3.072 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.520 -2.394 1.563 1.00 0.00 H new ATOM 0 HE1 PHE C 46 6.036 -6.130 3.534 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.394 -4.529 2.005 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.648 -6.396 3.003 1.00 0.00 H new ATOM 2238 N ILE C 47 4.937 -0.615 -0.581 1.00 0.00 N ATOM 2239 CA ILE C 47 3.851 -0.638 -1.534 1.00 0.00 C ATOM 2240 C ILE C 47 4.383 -0.422 -2.947 1.00 0.00 C ATOM 2241 O ILE C 47 3.792 -0.872 -3.922 1.00 0.00 O ATOM 2242 CB ILE C 47 2.757 0.395 -1.191 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.345 1.808 -1.153 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.124 0.039 0.146 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.365 2.883 -0.730 1.00 0.00 C ATOM 0 H ILE C 47 5.047 0.261 -0.070 1.00 0.00 H new ATOM 0 HA ILE C 47 3.385 -1.622 -1.481 1.00 0.00 H new ATOM 0 HB ILE C 47 1.989 0.373 -1.964 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.193 1.817 -0.468 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.731 2.054 -2.142 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.351 0.769 0.388 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.679 -0.954 0.085 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.888 0.047 0.924 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.865 3.852 -0.731 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.527 2.906 -1.427 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.997 2.665 0.273 1.00 0.00 H new ATOM 2257 N GLN C 48 5.516 0.260 -3.047 1.00 0.00 N ATOM 2258 CA GLN C 48 6.284 0.282 -4.273 1.00 0.00 C ATOM 2259 C GLN C 48 6.650 -1.140 -4.662 1.00 0.00 C ATOM 2260 O GLN C 48 6.192 -1.653 -5.660 1.00 0.00 O ATOM 2261 CB GLN C 48 7.567 1.100 -4.091 1.00 0.00 C ATOM 2262 CG GLN C 48 7.333 2.590 -3.905 1.00 0.00 C ATOM 2263 CD GLN C 48 6.560 3.214 -5.047 1.00 0.00 C ATOM 2264 OE1 GLN C 48 6.656 2.779 -6.195 1.00 0.00 O ATOM 2265 NE2 GLN C 48 5.789 4.240 -4.738 1.00 0.00 N ATOM 0 H GLN C 48 5.921 0.806 -2.287 1.00 0.00 H new ATOM 0 HA GLN C 48 5.681 0.742 -5.056 1.00 0.00 H new ATOM 0 HB2 GLN C 48 8.109 0.718 -3.226 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.207 0.950 -4.960 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.790 2.754 -2.974 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.295 3.094 -3.806 1.00 0.00 H new ATOM 0 HE21 GLN C 48 5.739 4.568 -3.774 1.00 0.00 H new ATOM 0 HE22 GLN C 48 5.243 4.705 -5.464 1.00 0.00 H new ATOM 2274 N LYS C 49 7.358 -1.803 -3.772 1.00 0.00 N ATOM 2275 CA LYS C 49 8.063 -3.041 -4.084 1.00 0.00 C ATOM 2276 C LYS C 49 7.121 -4.247 -4.144 1.00 0.00 C ATOM 2277 O LYS C 49 7.555 -5.367 -4.422 1.00 0.00 O ATOM 2278 CB LYS C 49 9.132 -3.257 -3.007 1.00 0.00 C ATOM 2279 CG LYS C 49 10.186 -4.295 -3.349 1.00 0.00 C ATOM 2280 CD LYS C 49 11.054 -4.646 -2.140 1.00 0.00 C ATOM 2281 CE LYS C 49 11.690 -3.417 -1.496 1.00 0.00 C ATOM 2282 NZ LYS C 49 10.838 -2.833 -0.421 1.00 0.00 N ATOM 0 H LYS C 49 7.465 -1.501 -2.804 1.00 0.00 H new ATOM 0 HA LYS C 49 8.515 -2.951 -5.072 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.629 -2.306 -2.814 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.639 -3.553 -2.081 1.00 0.00 H new ATOM 0 HG2 LYS C 49 9.700 -5.197 -3.721 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.819 -3.919 -4.153 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.446 -5.166 -1.400 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.839 -5.336 -2.449 1.00 0.00 H new ATOM 0 HE2 LYS C 49 12.660 -3.689 -1.079 1.00 0.00 H new ATOM 0 HE3 LYS C 49 11.872 -2.663 -2.261 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 11.051 -1.820 -0.321 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 9.835 -2.953 -0.669 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 11.032 -3.318 0.478 1.00 0.00 H new ATOM 2296 N HIS C 50 5.841 -4.051 -3.842 1.00 0.00 N ATOM 2297 CA HIS C 50 4.892 -5.131 -4.112 1.00 0.00 C ATOM 2298 C HIS C 50 3.822 -4.768 -5.147 1.00 0.00 C ATOM 2299 O HIS C 50 2.982 -5.602 -5.474 1.00 0.00 O ATOM 2300 CB HIS C 50 4.241 -5.584 -2.801 1.00 0.00 C ATOM 2301 CG HIS C 50 5.255 -6.030 -1.790 1.00 0.00 C ATOM 2302 ND1 HIS C 50 6.072 -7.112 -1.987 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.635 -5.488 -0.615 1.00 0.00 C ATOM 2304 CE1 HIS C 50 6.916 -7.213 -0.983 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.680 -6.237 -0.132 1.00 0.00 N ATOM 0 H HIS C 50 5.449 -3.203 -3.432 1.00 0.00 H new ATOM 0 HA HIS C 50 5.463 -5.949 -4.551 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.654 -4.765 -2.387 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.549 -6.401 -3.004 1.00 0.00 H new ATOM 0 HD2 HIS C 50 5.197 -4.622 -0.140 1.00 0.00 H new ATOM 0 HE1 HIS C 50 7.677 -7.972 -0.875 1.00 0.00 H new ATOM 0 HE2 HIS C 50 7.186 -6.066 0.737 1.00 0.00 H new ATOM 2314 N LEU C 51 3.841 -3.545 -5.663 1.00 0.00 N ATOM 2315 CA LEU C 51 2.957 -3.190 -6.783 1.00 0.00 C ATOM 2316 C LEU C 51 3.765 -2.702 -7.980 1.00 0.00 C ATOM 2317 O LEU C 51 3.669 -3.243 -9.081 1.00 0.00 O ATOM 2318 CB LEU C 51 1.949 -2.086 -6.417 1.00 0.00 C ATOM 2319 CG LEU C 51 0.809 -2.458 -5.452 1.00 0.00 C ATOM 2320 CD1 LEU C 51 0.054 -3.694 -5.924 1.00 0.00 C ATOM 2321 CD2 LEU C 51 1.331 -2.656 -4.047 1.00 0.00 C ATOM 0 H LEU C 51 4.444 -2.790 -5.336 1.00 0.00 H new ATOM 0 HA LEU C 51 2.412 -4.101 -7.028 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.503 -1.256 -5.979 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.502 -1.719 -7.341 1.00 0.00 H new ATOM 0 HG LEU C 51 0.107 -1.624 -5.443 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -0.743 -3.925 -5.217 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.377 -3.504 -6.907 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.741 -4.538 -5.986 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.505 -2.918 -3.386 1.00 0.00 H new ATOM 0 HD22 LEU C 51 2.068 -3.459 -4.043 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.797 -1.734 -3.699 1.00 0.00 H new ATOM 2333 N ASN C 52 4.574 -1.686 -7.741 1.00 0.00 N ATOM 2334 CA ASN C 52 5.215 -0.929 -8.807 1.00 0.00 C ATOM 2335 C ASN C 52 6.703 -1.235 -8.943 1.00 0.00 C ATOM 2336 O ASN C 52 7.291 -0.992 -9.996 1.00 0.00 O ATOM 2337 CB ASN C 52 5.016 0.564 -8.552 1.00 0.00 C ATOM 2338 CG ASN C 52 3.908 1.163 -9.406 1.00 0.00 C ATOM 2339 OD1 ASN C 52 3.240 2.112 -9.001 1.00 0.00 O ATOM 2340 ND2 ASN C 52 3.722 0.632 -10.608 1.00 0.00 N ATOM 0 H ASN C 52 4.807 -1.360 -6.803 1.00 0.00 H new ATOM 0 HA ASN C 52 4.746 -1.226 -9.745 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.782 0.721 -7.499 1.00 0.00 H new ATOM 0 HB3 ASN C 52 5.949 1.090 -8.753 1.00 0.00 H new ATOM 0 HD21 ASN C 52 3.006 1.011 -11.228 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.295 -0.155 -10.912 1.00 0.00 H new ATOM 2347 N LYS C 53 7.313 -1.753 -7.896 1.00 0.00 N ATOM 2348 CA LYS C 53 8.712 -2.121 -7.931 1.00 0.00 C ATOM 2349 C LYS C 53 8.860 -3.634 -7.906 1.00 0.00 C ATOM 2350 O LYS C 53 8.682 -4.236 -6.832 1.00 0.00 O ATOM 2351 CB LYS C 53 9.460 -1.492 -6.754 1.00 0.00 C ATOM 2352 CG LYS C 53 10.242 -0.249 -7.135 1.00 0.00 C ATOM 2353 CD LYS C 53 11.377 0.018 -6.160 1.00 0.00 C ATOM 2354 CE LYS C 53 10.882 0.506 -4.811 1.00 0.00 C ATOM 2355 NZ LYS C 53 12.014 0.897 -3.930 1.00 0.00 N ATOM 2356 OXT LYS C 53 9.141 -4.219 -8.972 1.00 0.00 O ATOM 0 H LYS C 53 6.855 -1.930 -7.002 1.00 0.00 H new ATOM 0 HA LYS C 53 9.147 -1.744 -8.857 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.744 -1.237 -5.972 1.00 0.00 H new ATOM 0 HB3 LYS C 53 10.144 -2.228 -6.332 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.645 -0.366 -8.141 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.572 0.610 -7.158 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.956 -0.895 -6.022 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.051 0.761 -6.587 1.00 0.00 H new ATOM 0 HE2 LYS C 53 10.217 1.358 -4.952 1.00 0.00 H new ATOM 0 HE3 LYS C 53 10.298 -0.279 -4.330 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.734 0.785 -2.935 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.835 0.290 -4.130 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 12.266 1.890 -4.109 1.00 0.00 H new TER 2370 LYS C 53 HETATM 2371 ZN ZN A 54 -19.983 -4.308 -3.206 1.00 0.00 ZN HETATM 2372 ZN ZN B 54 13.501 -15.192 -3.396 1.00 0.00 ZN HETATM 2373 ZN ZN C 54 6.343 19.413 -3.164 1.00 0.00 ZN