USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1183 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 95 GLN : amide:sc= 1.36 K(o=2.6,f=-8.3!) USER MOD Set 1.2: A 97 LYS NZ :NH3+ -167:sc= 1.26 (180deg=0) USER MOD Set 2.1: A 92 ASN : amide:sc= 2.24 K(o=3.6,f=-5.9) USER MOD Set 2.2: A 94 LYS NZ :NH3+ 170:sc= 1.31 (180deg=0) USER MOD Set 3.1: A 70 CYS SG : rot 47:sc= -2.5! USER MOD Set 3.2: A 114 SER OG : rot -76:sc= 1.23 USER MOD Set 4.1: A 1 MET CE :methyl -138:sc= 0 (180deg=-0.029) USER MOD Set 4.2: A 65 LYS NZ :NH3+ 159:sc= 0 (180deg=0) USER MOD Set 5.1: A 21 GLN : amide:sc= 1.08 X(o=2.3,f=2) USER MOD Set 5.2: A 35 TYR OH : rot 166:sc= 1.27 USER MOD Set 6.1: A 28 ASN : amide:sc= 0.295 X(o=0.61,f=0.2) USER MOD Set 6.2: A 30 GLN : amide:sc= 0.315 X(o=0.61,f=0.2) USER MOD Single : A 1 MET N :NH3+ -164:sc= 1.34 (180deg=1.05) USER MOD Single : A 4 SER OG : rot 14:sc= 1.07 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0.219 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0.31 X(o=0.31,f=0) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 158:sc= 1.21 (180deg=0.654) USER MOD Single : A 23 THR OG1 : rot -56:sc= 1.28 USER MOD Single : A 25 TYR OH : rot 180:sc= -0.205 USER MOD Single : A 29 ASN : amide:sc= 1.17 K(o=1.2,f=-0.053) USER MOD Single : A 37 GLN : amide:sc= 0.77 K(o=0.77,f=-4.2!) USER MOD Single : A 40 ASN : amide:sc= 0.801 K(o=0.8,f=-8!) USER MOD Single : A 42 ASN : amide:sc=0.000953 X(o=0.00095,f=0) USER MOD Single : A 46 LYS NZ :NH3+ -147:sc= 1.4 (180deg=0.569) USER MOD Single : A 55 HIS : no HD1:sc= 0.0143 K(o=0.014,f=-1.8!) USER MOD Single : A 62 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 66 MET CE :methyl -170:sc= -0.103 (180deg=-0.255) USER MOD Single : A 67 CYS SG : rot 95:sc= 0.412 USER MOD Single : A 69 SER OG : rot 160:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 137:sc= 2.36 (180deg=1.24) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 130:sc= 0.46 USER MOD Single : A 80 GLN : amide:sc= 0.478 K(o=0.48,f=-0.074) USER MOD Single : A 85 ASN : amide:sc= -0.062 X(o=-0.062,f=-0.098) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc=0.000211 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot -2:sc= 1.08 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 123:sc= 0.773 USER MOD Single : A 111 SER OG : rot -64:sc= -0.163 USER MOD Single : A 117 CYS SG : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 111:sc= -5.15! USER MOD Single : A 124 THR OG1 : rot -170:sc= 0.632 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 GLN : amide:sc= 0.717 K(o=0.72,f=-4.8!) USER MOD Single : A 133 SER OG : rot 5:sc= 1.44 USER MOD Single : A 135 THR OG1 : rot -119:sc= 1.23 USER MOD Single : A 136 ASN : amide:sc= 0.31 K(o=0.31,f=-3.8!) USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -47:sc= 0.828 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc= 1.11 K(o=1.1,f=0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.212 5.029 -1.483 1.00 0.00 N ATOM 2 CA MET A 1 -8.071 5.874 -2.353 1.00 0.00 C ATOM 3 C MET A 1 -9.328 5.132 -2.906 1.00 0.00 C ATOM 4 O MET A 1 -9.383 4.769 -4.084 1.00 0.00 O ATOM 5 CB MET A 1 -7.130 6.424 -3.464 1.00 0.00 C ATOM 6 CG MET A 1 -7.704 7.593 -4.294 1.00 0.00 C ATOM 7 SD MET A 1 -6.594 8.032 -5.656 1.00 0.00 S ATOM 8 CE MET A 1 -5.245 8.869 -4.796 1.00 0.00 C ATOM 0 H1 MET A 1 -6.564 5.635 -0.941 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.809 4.487 -0.826 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.661 4.372 -2.072 1.00 0.00 H new ATOM 0 HA MET A 1 -8.516 6.689 -1.783 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.200 6.752 -3.000 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.878 5.608 -4.141 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.680 7.316 -4.691 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.856 8.460 -3.651 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.945 9.751 -5.362 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.578 9.171 -3.803 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.396 8.191 -4.703 1.00 0.00 H new ATOM 20 N ARG A 2 -10.348 4.904 -2.055 1.00 0.00 N ATOM 21 CA ARG A 2 -11.669 4.392 -2.529 1.00 0.00 C ATOM 22 C ARG A 2 -12.836 5.075 -1.709 1.00 0.00 C ATOM 23 O ARG A 2 -13.554 4.362 -1.000 1.00 0.00 O ATOM 24 CB ARG A 2 -11.640 2.835 -2.500 1.00 0.00 C ATOM 25 CG ARG A 2 -12.884 2.125 -3.100 1.00 0.00 C ATOM 26 CD ARG A 2 -12.614 0.651 -3.459 1.00 0.00 C ATOM 27 NE ARG A 2 -13.889 -0.027 -3.825 1.00 0.00 N ATOM 28 CZ ARG A 2 -14.104 -1.337 -3.719 1.00 0.00 C ATOM 29 NH1 ARG A 2 -13.147 -2.219 -3.652 1.00 0.00 N ATOM 30 NH2 ARG A 2 -15.329 -1.759 -3.665 1.00 0.00 N ATOM 0 H ARG A 2 -10.294 5.061 -1.049 1.00 0.00 H new ATOM 0 HA ARG A 2 -11.869 4.665 -3.565 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -10.756 2.497 -3.041 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -11.524 2.512 -1.466 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -13.706 2.176 -2.386 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -13.206 2.659 -3.994 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -11.911 0.594 -4.290 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -12.151 0.141 -2.614 1.00 0.00 H new ATOM 0 HE ARG A 2 -14.650 0.552 -4.181 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -12.173 -1.918 -3.680 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -13.372 -3.211 -3.571 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -16.100 -1.093 -3.704 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -15.521 -2.757 -3.584 1.00 0.00 H new ATOM 44 N PRO A 3 -13.104 6.420 -1.792 1.00 0.00 N ATOM 45 CA PRO A 3 -14.176 7.091 -1.009 1.00 0.00 C ATOM 46 C PRO A 3 -15.550 7.256 -1.748 1.00 0.00 C ATOM 47 O PRO A 3 -15.612 7.505 -2.956 1.00 0.00 O ATOM 48 CB PRO A 3 -13.493 8.447 -0.743 1.00 0.00 C ATOM 49 CG PRO A 3 -12.748 8.763 -2.046 1.00 0.00 C ATOM 50 CD PRO A 3 -12.303 7.395 -2.570 1.00 0.00 C ATOM 0 HA PRO A 3 -14.483 6.523 -0.131 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -14.224 9.220 -0.506 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -12.807 8.387 0.102 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -13.395 9.271 -2.761 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -11.895 9.417 -1.867 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.491 7.299 -3.639 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -11.235 7.241 -2.419 1.00 0.00 H new ATOM 58 N SER A 4 -16.645 7.186 -0.982 1.00 0.00 N ATOM 59 CA SER A 4 -18.032 7.384 -1.486 1.00 0.00 C ATOM 60 C SER A 4 -18.766 8.487 -0.661 1.00 0.00 C ATOM 61 O SER A 4 -19.222 9.471 -1.252 1.00 0.00 O ATOM 62 CB SER A 4 -18.788 6.034 -1.428 1.00 0.00 C ATOM 63 OG SER A 4 -18.333 5.129 -2.430 1.00 0.00 O ATOM 0 H SER A 4 -16.605 6.989 0.018 1.00 0.00 H new ATOM 0 HA SER A 4 -18.001 7.725 -2.521 1.00 0.00 H new ATOM 0 HB2 SER A 4 -18.654 5.584 -0.444 1.00 0.00 H new ATOM 0 HB3 SER A 4 -19.856 6.210 -1.555 1.00 0.00 H new ATOM 0 HG SER A 4 -17.493 5.459 -2.811 1.00 0.00 H new ATOM 69 N GLY A 5 -18.913 8.345 0.676 1.00 0.00 N ATOM 70 CA GLY A 5 -19.611 9.358 1.515 1.00 0.00 C ATOM 71 C GLY A 5 -18.732 10.519 2.020 1.00 0.00 C ATOM 72 O GLY A 5 -18.542 10.662 3.230 1.00 0.00 O ATOM 0 H GLY A 5 -18.561 7.544 1.200 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -20.437 9.775 0.939 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -20.046 8.853 2.377 1.00 0.00 H new ATOM 76 N ARG A 6 -18.244 11.371 1.103 1.00 0.00 N ATOM 77 CA ARG A 6 -17.369 12.518 1.459 1.00 0.00 C ATOM 78 C ARG A 6 -17.937 13.858 0.895 1.00 0.00 C ATOM 79 O ARG A 6 -17.917 14.110 -0.313 1.00 0.00 O ATOM 80 CB ARG A 6 -15.933 12.232 0.923 1.00 0.00 C ATOM 81 CG ARG A 6 -14.901 13.356 1.226 1.00 0.00 C ATOM 82 CD ARG A 6 -13.443 13.025 0.855 1.00 0.00 C ATOM 83 NE ARG A 6 -12.758 12.243 1.925 1.00 0.00 N ATOM 84 CZ ARG A 6 -12.051 12.763 2.934 1.00 0.00 C ATOM 85 NH1 ARG A 6 -11.941 14.046 3.167 1.00 0.00 N ATOM 86 NH2 ARG A 6 -11.441 11.956 3.750 1.00 0.00 N ATOM 0 H ARG A 6 -18.437 11.293 0.105 1.00 0.00 H new ATOM 0 HA ARG A 6 -17.333 12.629 2.543 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -15.575 11.299 1.358 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -15.983 12.082 -0.155 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -15.200 14.256 0.689 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -14.944 13.590 2.290 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -13.425 12.458 -0.076 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -12.896 13.950 0.675 1.00 0.00 H new ATOM 0 HE ARG A 6 -12.835 11.227 1.883 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -12.412 14.717 2.560 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -11.385 14.375 3.956 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.507 10.947 3.614 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.896 12.331 4.526 1.00 0.00 H new ATOM 100 N LYS A 7 -18.383 14.738 1.805 1.00 0.00 N ATOM 101 CA LYS A 7 -18.776 16.138 1.456 1.00 0.00 C ATOM 102 C LYS A 7 -17.517 17.053 1.669 1.00 0.00 C ATOM 103 O LYS A 7 -17.017 17.632 0.703 1.00 0.00 O ATOM 104 CB LYS A 7 -20.023 16.558 2.286 1.00 0.00 C ATOM 105 CG LYS A 7 -21.340 15.887 1.827 1.00 0.00 C ATOM 106 CD LYS A 7 -22.558 16.320 2.669 1.00 0.00 C ATOM 107 CE LYS A 7 -23.857 15.646 2.189 1.00 0.00 C ATOM 108 NZ LYS A 7 -25.012 16.155 2.978 1.00 0.00 N ATOM 0 H LYS A 7 -18.485 14.516 2.795 1.00 0.00 H new ATOM 0 HA LYS A 7 -19.079 16.235 0.414 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -19.849 16.313 3.334 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -20.139 17.640 2.226 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -21.522 16.133 0.781 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -21.230 14.804 1.886 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -22.384 16.069 3.715 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -22.670 17.403 2.616 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -24.012 15.848 1.129 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -23.778 14.564 2.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -25.886 15.697 2.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -24.866 15.941 3.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -25.092 17.184 2.851 1.00 0.00 H new ATOM 122 N SER A 8 -16.994 17.159 2.909 1.00 0.00 N ATOM 123 CA SER A 8 -15.734 17.887 3.219 1.00 0.00 C ATOM 124 C SER A 8 -14.783 16.868 3.940 1.00 0.00 C ATOM 125 O SER A 8 -14.052 16.144 3.256 1.00 0.00 O ATOM 126 CB SER A 8 -16.086 19.190 3.992 1.00 0.00 C ATOM 127 OG SER A 8 -16.755 18.939 5.235 1.00 0.00 O ATOM 0 H SER A 8 -17.432 16.742 3.730 1.00 0.00 H new ATOM 0 HA SER A 8 -15.188 18.239 2.344 1.00 0.00 H new ATOM 0 HB2 SER A 8 -15.171 19.750 4.185 1.00 0.00 H new ATOM 0 HB3 SER A 8 -16.719 19.818 3.365 1.00 0.00 H new ATOM 0 HG SER A 8 -16.951 19.790 5.679 1.00 0.00 H new ATOM 133 N SER A 9 -14.842 16.762 5.289 1.00 0.00 N ATOM 134 CA SER A 9 -14.042 15.817 6.140 1.00 0.00 C ATOM 135 C SER A 9 -12.479 15.983 6.062 1.00 0.00 C ATOM 136 O SER A 9 -11.910 16.542 5.121 1.00 0.00 O ATOM 137 CB SER A 9 -14.477 14.356 5.821 1.00 0.00 C ATOM 138 OG SER A 9 -15.847 14.153 6.157 1.00 0.00 O ATOM 0 H SER A 9 -15.466 17.347 5.844 1.00 0.00 H new ATOM 0 HA SER A 9 -14.271 16.074 7.174 1.00 0.00 H new ATOM 0 HB2 SER A 9 -14.323 14.148 4.762 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.854 13.656 6.377 1.00 0.00 H new ATOM 0 HG SER A 9 -16.102 13.230 5.948 1.00 0.00 H new ATOM 144 N LYS A 10 -11.766 15.457 7.078 1.00 0.00 N ATOM 145 CA LYS A 10 -10.276 15.538 7.158 1.00 0.00 C ATOM 146 C LYS A 10 -9.542 14.666 6.077 1.00 0.00 C ATOM 147 O LYS A 10 -10.084 13.692 5.535 1.00 0.00 O ATOM 148 CB LYS A 10 -9.829 15.076 8.583 1.00 0.00 C ATOM 149 CG LYS A 10 -10.056 16.057 9.766 1.00 0.00 C ATOM 150 CD LYS A 10 -11.461 16.061 10.418 1.00 0.00 C ATOM 151 CE LYS A 10 -11.893 14.767 11.145 1.00 0.00 C ATOM 152 NZ LYS A 10 -11.140 14.560 12.413 1.00 0.00 N ATOM 0 H LYS A 10 -12.193 14.967 7.864 1.00 0.00 H new ATOM 0 HA LYS A 10 -9.997 16.574 6.964 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -10.351 14.147 8.813 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.765 14.842 8.541 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -9.324 15.828 10.541 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -9.843 17.066 9.414 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -11.502 16.883 11.133 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -12.196 16.277 9.642 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -12.960 14.812 11.361 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -11.736 13.912 10.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -11.461 13.682 12.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -10.123 14.491 12.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -11.309 15.363 13.052 1.00 0.00 H new ATOM 166 N MET A 11 -8.289 15.042 5.766 1.00 0.00 N ATOM 167 CA MET A 11 -7.419 14.287 4.822 1.00 0.00 C ATOM 168 C MET A 11 -6.829 13.002 5.501 1.00 0.00 C ATOM 169 O MET A 11 -6.395 13.026 6.658 1.00 0.00 O ATOM 170 CB MET A 11 -6.307 15.245 4.298 1.00 0.00 C ATOM 171 CG MET A 11 -5.304 15.850 5.312 1.00 0.00 C ATOM 172 SD MET A 11 -4.089 16.881 4.460 1.00 0.00 S ATOM 173 CE MET A 11 -4.956 18.462 4.409 1.00 0.00 C ATOM 0 H MET A 11 -7.844 15.873 6.156 1.00 0.00 H new ATOM 0 HA MET A 11 -8.006 13.936 3.973 1.00 0.00 H new ATOM 0 HB2 MET A 11 -5.731 14.703 3.548 1.00 0.00 H new ATOM 0 HB3 MET A 11 -6.799 16.072 3.786 1.00 0.00 H new ATOM 0 HG2 MET A 11 -5.840 16.445 6.052 1.00 0.00 H new ATOM 0 HG3 MET A 11 -4.797 15.051 5.852 1.00 0.00 H new ATOM 0 HE1 MET A 11 -4.331 19.204 3.911 1.00 0.00 H new ATOM 0 HE2 MET A 11 -5.891 18.347 3.860 1.00 0.00 H new ATOM 0 HE3 MET A 11 -5.171 18.792 5.425 1.00 0.00 H new ATOM 183 N GLN A 12 -6.814 11.873 4.775 1.00 0.00 N ATOM 184 CA GLN A 12 -6.311 10.573 5.315 1.00 0.00 C ATOM 185 C GLN A 12 -4.771 10.382 5.079 1.00 0.00 C ATOM 186 O GLN A 12 -4.354 9.480 4.341 1.00 0.00 O ATOM 187 CB GLN A 12 -7.156 9.465 4.622 1.00 0.00 C ATOM 188 CG GLN A 12 -8.658 9.339 5.001 1.00 0.00 C ATOM 189 CD GLN A 12 -8.962 8.921 6.442 1.00 0.00 C ATOM 190 OE1 GLN A 12 -9.502 9.681 7.238 1.00 0.00 O ATOM 191 NE2 GLN A 12 -8.644 7.704 6.815 1.00 0.00 N ATOM 0 H GLN A 12 -7.142 11.821 3.811 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.426 10.532 6.398 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -7.097 9.626 3.546 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -6.680 8.506 4.827 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -9.139 10.299 4.815 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -9.120 8.615 4.330 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.195 7.069 6.155 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -8.846 7.393 7.765 1.00 0.00 H new ATOM 200 N ALA A 13 -3.941 11.206 5.755 1.00 0.00 N ATOM 201 CA ALA A 13 -2.468 11.221 5.565 1.00 0.00 C ATOM 202 C ALA A 13 -1.694 10.119 6.343 1.00 0.00 C ATOM 203 O ALA A 13 -1.752 9.993 7.570 1.00 0.00 O ATOM 204 CB ALA A 13 -2.000 12.630 5.971 1.00 0.00 C ATOM 0 H ALA A 13 -4.269 11.879 6.447 1.00 0.00 H new ATOM 0 HA ALA A 13 -2.246 10.991 4.523 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.919 12.703 5.852 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -2.486 13.372 5.337 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -2.264 12.815 7.012 1.00 0.00 H new ATOM 210 N PHE A 14 -0.915 9.337 5.578 1.00 0.00 N ATOM 211 CA PHE A 14 -0.170 8.170 6.088 1.00 0.00 C ATOM 212 C PHE A 14 1.005 7.756 5.133 1.00 0.00 C ATOM 213 O PHE A 14 0.880 7.778 3.898 1.00 0.00 O ATOM 214 CB PHE A 14 -1.229 7.041 6.222 1.00 0.00 C ATOM 215 CG PHE A 14 -0.746 5.826 6.989 1.00 0.00 C ATOM 216 CD1 PHE A 14 -0.728 5.886 8.379 1.00 0.00 C ATOM 217 CD2 PHE A 14 -0.183 4.734 6.328 1.00 0.00 C ATOM 218 CE1 PHE A 14 -0.056 4.911 9.105 1.00 0.00 C ATOM 219 CE2 PHE A 14 0.436 3.728 7.064 1.00 0.00 C ATOM 220 CZ PHE A 14 0.549 3.849 8.446 1.00 0.00 C ATOM 0 H PHE A 14 -0.782 9.497 4.579 1.00 0.00 H new ATOM 0 HA PHE A 14 0.311 8.389 7.041 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.112 7.443 6.719 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -1.539 6.728 5.225 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.236 6.689 8.892 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -0.227 4.670 5.251 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.004 4.979 10.182 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.828 2.855 6.564 1.00 0.00 H new ATOM 0 HZ PHE A 14 1.109 3.115 9.007 1.00 0.00 H new ATOM 230 N ARG A 15 2.102 7.284 5.761 1.00 0.00 N ATOM 231 CA ARG A 15 3.354 6.831 5.086 1.00 0.00 C ATOM 232 C ARG A 15 3.971 5.574 5.799 1.00 0.00 C ATOM 233 O ARG A 15 3.710 5.303 6.978 1.00 0.00 O ATOM 234 CB ARG A 15 4.284 8.091 5.022 1.00 0.00 C ATOM 235 CG ARG A 15 5.820 7.965 5.268 1.00 0.00 C ATOM 236 CD ARG A 15 6.591 9.281 5.524 1.00 0.00 C ATOM 237 NE ARG A 15 6.228 10.365 4.560 1.00 0.00 N ATOM 238 CZ ARG A 15 5.629 11.507 4.915 1.00 0.00 C ATOM 239 NH1 ARG A 15 5.670 12.008 6.125 1.00 0.00 N ATOM 240 NH2 ARG A 15 4.954 12.181 4.033 1.00 0.00 N ATOM 0 H ARG A 15 2.151 7.202 6.777 1.00 0.00 H new ATOM 0 HA ARG A 15 3.181 6.471 4.072 1.00 0.00 H new ATOM 0 HB2 ARG A 15 4.153 8.535 4.035 1.00 0.00 H new ATOM 0 HB3 ARG A 15 3.901 8.808 5.748 1.00 0.00 H new ATOM 0 HG2 ARG A 15 5.975 7.307 6.123 1.00 0.00 H new ATOM 0 HG3 ARG A 15 6.264 7.473 4.403 1.00 0.00 H new ATOM 0 HD2 ARG A 15 6.390 9.622 6.539 1.00 0.00 H new ATOM 0 HD3 ARG A 15 7.662 9.087 5.459 1.00 0.00 H new ATOM 0 HE ARG A 15 6.450 10.225 3.574 1.00 0.00 H new ATOM 0 HH11 ARG A 15 6.181 11.521 6.861 1.00 0.00 H new ATOM 0 HH12 ARG A 15 5.191 12.885 6.330 1.00 0.00 H new ATOM 0 HH21 ARG A 15 4.883 11.839 3.075 1.00 0.00 H new ATOM 0 HH22 ARG A 15 4.495 13.052 4.299 1.00 0.00 H new ATOM 254 N ILE A 16 4.786 4.784 5.060 1.00 0.00 N ATOM 255 CA ILE A 16 5.496 3.595 5.640 1.00 0.00 C ATOM 256 C ILE A 16 6.983 3.579 5.097 1.00 0.00 C ATOM 257 O ILE A 16 7.300 3.606 3.890 1.00 0.00 O ATOM 258 CB ILE A 16 4.807 2.203 5.376 1.00 0.00 C ATOM 259 CG1 ILE A 16 4.647 1.790 3.877 1.00 0.00 C ATOM 260 CG2 ILE A 16 3.411 2.139 6.027 1.00 0.00 C ATOM 261 CD1 ILE A 16 5.377 0.474 3.581 1.00 0.00 C ATOM 0 H ILE A 16 4.974 4.938 4.069 1.00 0.00 H new ATOM 0 HA ILE A 16 5.461 3.718 6.722 1.00 0.00 H new ATOM 0 HB ILE A 16 5.504 1.497 5.827 1.00 0.00 H new ATOM 0 HG12 ILE A 16 3.589 1.683 3.638 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.041 2.579 3.236 1.00 0.00 H new ATOM 0 HG21 ILE A 16 2.961 1.167 5.827 1.00 0.00 H new ATOM 0 HG22 ILE A 16 3.505 2.281 7.104 1.00 0.00 H new ATOM 0 HG23 ILE A 16 2.779 2.924 5.611 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.247 0.214 2.531 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.439 0.590 3.797 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.965 -0.319 4.205 1.00 0.00 H new ATOM 273 N TRP A 17 7.915 3.539 6.058 1.00 0.00 N ATOM 274 CA TRP A 17 9.378 3.464 5.775 1.00 0.00 C ATOM 275 C TRP A 17 9.981 2.288 6.630 1.00 0.00 C ATOM 276 O TRP A 17 9.281 1.308 6.883 1.00 0.00 O ATOM 277 CB TRP A 17 9.906 4.936 5.975 1.00 0.00 C ATOM 278 CG TRP A 17 10.408 5.380 7.361 1.00 0.00 C ATOM 279 CD1 TRP A 17 9.684 5.322 8.572 1.00 0.00 C ATOM 280 CD2 TRP A 17 11.695 5.762 7.713 1.00 0.00 C ATOM 281 NE1 TRP A 17 10.499 5.620 9.681 1.00 0.00 N ATOM 282 CE2 TRP A 17 11.744 5.871 9.126 1.00 0.00 C ATOM 283 CE3 TRP A 17 12.864 5.991 6.933 1.00 0.00 C ATOM 284 CZ2 TRP A 17 12.965 6.166 9.773 1.00 0.00 C ATOM 285 CZ3 TRP A 17 14.056 6.287 7.597 1.00 0.00 C ATOM 286 CH2 TRP A 17 14.108 6.365 8.994 1.00 0.00 C ATOM 0 H TRP A 17 7.691 3.557 7.053 1.00 0.00 H new ATOM 0 HA TRP A 17 9.686 3.186 4.767 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.721 5.089 5.268 1.00 0.00 H new ATOM 0 HB3 TRP A 17 9.102 5.613 5.686 1.00 0.00 H new ATOM 0 HD1 TRP A 17 8.634 5.079 8.639 1.00 0.00 H new ATOM 0 HE1 TRP A 17 10.234 5.645 10.666 1.00 0.00 H new ATOM 0 HE3 TRP A 17 12.830 5.937 5.855 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 13.014 6.236 10.850 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 14.954 6.459 7.023 1.00 0.00 H new ATOM 0 HH2 TRP A 17 15.048 6.583 9.478 1.00 0.00 H new ATOM 297 N ASP A 18 11.267 2.285 7.014 1.00 0.00 N ATOM 298 CA ASP A 18 11.797 1.338 8.033 1.00 0.00 C ATOM 299 C ASP A 18 13.101 1.999 8.610 1.00 0.00 C ATOM 300 O ASP A 18 13.875 2.718 7.945 1.00 0.00 O ATOM 301 CB ASP A 18 11.919 -0.152 7.562 1.00 0.00 C ATOM 302 CG ASP A 18 13.237 -0.805 7.161 1.00 0.00 C ATOM 303 OD1 ASP A 18 14.253 -0.642 7.872 1.00 0.00 O ATOM 304 OD2 ASP A 18 13.252 -1.530 6.144 1.00 0.00 O ATOM 0 H ASP A 18 11.967 2.925 6.639 1.00 0.00 H new ATOM 0 HA ASP A 18 11.077 1.199 8.840 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.507 -0.762 8.366 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.252 -0.259 6.707 1.00 0.00 H new ATOM 309 N VAL A 19 13.268 1.705 9.914 1.00 0.00 N ATOM 310 CA VAL A 19 14.362 2.243 10.790 1.00 0.00 C ATOM 311 C VAL A 19 15.828 1.962 10.299 1.00 0.00 C ATOM 312 O VAL A 19 16.719 2.721 10.693 1.00 0.00 O ATOM 313 CB VAL A 19 14.109 1.687 12.248 1.00 0.00 C ATOM 314 CG1 VAL A 19 15.184 2.064 13.301 1.00 0.00 C ATOM 315 CG2 VAL A 19 12.767 2.159 12.865 1.00 0.00 C ATOM 0 H VAL A 19 12.640 1.074 10.412 1.00 0.00 H new ATOM 0 HA VAL A 19 14.308 3.331 10.758 1.00 0.00 H new ATOM 0 HB VAL A 19 14.124 0.613 12.064 1.00 0.00 H new ATOM 0 HG11 VAL A 19 14.915 1.633 14.266 1.00 0.00 H new ATOM 0 HG12 VAL A 19 16.153 1.675 12.987 1.00 0.00 H new ATOM 0 HG13 VAL A 19 15.240 3.149 13.391 1.00 0.00 H new ATOM 0 HG21 VAL A 19 12.659 1.740 13.865 1.00 0.00 H new ATOM 0 HG22 VAL A 19 12.757 3.247 12.925 1.00 0.00 H new ATOM 0 HG23 VAL A 19 11.940 1.822 12.239 1.00 0.00 H new ATOM 325 N ASN A 20 16.123 0.952 9.454 1.00 0.00 N ATOM 326 CA ASN A 20 17.496 0.756 8.891 1.00 0.00 C ATOM 327 C ASN A 20 17.745 1.641 7.604 1.00 0.00 C ATOM 328 O ASN A 20 18.481 1.239 6.697 1.00 0.00 O ATOM 329 CB ASN A 20 17.661 -0.771 8.616 1.00 0.00 C ATOM 330 CG ASN A 20 17.772 -1.675 9.852 1.00 0.00 C ATOM 331 OD1 ASN A 20 16.826 -2.328 10.276 1.00 0.00 O ATOM 332 ND2 ASN A 20 18.928 -1.760 10.468 1.00 0.00 N ATOM 0 H ASN A 20 15.442 0.259 9.142 1.00 0.00 H new ATOM 0 HA ASN A 20 18.253 1.089 9.601 1.00 0.00 H new ATOM 0 HB2 ASN A 20 16.811 -1.106 8.022 1.00 0.00 H new ATOM 0 HB3 ASN A 20 18.552 -0.915 8.005 1.00 0.00 H new ATOM 0 HD21 ASN A 20 19.027 -2.362 11.285 1.00 0.00 H new ATOM 0 HD22 ASN A 20 19.727 -1.224 10.129 1.00 0.00 H new ATOM 339 N GLN A 21 17.213 2.890 7.583 1.00 0.00 N ATOM 340 CA GLN A 21 17.282 3.865 6.452 1.00 0.00 C ATOM 341 C GLN A 21 16.635 3.274 5.158 1.00 0.00 C ATOM 342 O GLN A 21 17.319 2.982 4.173 1.00 0.00 O ATOM 343 CB GLN A 21 18.745 4.366 6.250 1.00 0.00 C ATOM 344 CG GLN A 21 19.199 5.473 7.235 1.00 0.00 C ATOM 345 CD GLN A 21 20.483 6.182 6.795 1.00 0.00 C ATOM 346 OE1 GLN A 21 20.469 7.071 5.947 1.00 0.00 O ATOM 347 NE2 GLN A 21 21.622 5.820 7.333 1.00 0.00 N ATOM 0 H GLN A 21 16.703 3.265 8.383 1.00 0.00 H new ATOM 0 HA GLN A 21 16.689 4.745 6.701 1.00 0.00 H new ATOM 0 HB2 GLN A 21 19.421 3.516 6.345 1.00 0.00 H new ATOM 0 HB3 GLN A 21 18.847 4.742 5.232 1.00 0.00 H new ATOM 0 HG2 GLN A 21 18.402 6.209 7.337 1.00 0.00 H new ATOM 0 HG3 GLN A 21 19.354 5.033 8.220 1.00 0.00 H new ATOM 0 HE21 GLN A 21 21.642 5.083 8.038 1.00 0.00 H new ATOM 0 HE22 GLN A 21 22.489 6.276 7.047 1.00 0.00 H new ATOM 356 N LYS A 22 15.297 3.108 5.161 1.00 0.00 N ATOM 357 CA LYS A 22 14.555 2.504 4.038 1.00 0.00 C ATOM 358 C LYS A 22 13.166 3.218 3.939 1.00 0.00 C ATOM 359 O LYS A 22 12.562 3.643 4.919 1.00 0.00 O ATOM 360 CB LYS A 22 14.384 0.978 4.347 1.00 0.00 C ATOM 361 CG LYS A 22 15.631 0.077 4.564 1.00 0.00 C ATOM 362 CD LYS A 22 16.551 -0.148 3.344 1.00 0.00 C ATOM 363 CE LYS A 22 17.865 -0.892 3.670 1.00 0.00 C ATOM 364 NZ LYS A 22 17.621 -2.331 3.959 1.00 0.00 N ATOM 0 H LYS A 22 14.702 3.389 5.941 1.00 0.00 H new ATOM 0 HA LYS A 22 15.079 2.619 3.089 1.00 0.00 H new ATOM 0 HB2 LYS A 22 13.768 0.897 5.243 1.00 0.00 H new ATOM 0 HB3 LYS A 22 13.812 0.545 3.527 1.00 0.00 H new ATOM 0 HG2 LYS A 22 16.229 0.513 5.364 1.00 0.00 H new ATOM 0 HG3 LYS A 22 15.289 -0.897 4.915 1.00 0.00 H new ATOM 0 HD2 LYS A 22 16.004 -0.714 2.590 1.00 0.00 H new ATOM 0 HD3 LYS A 22 16.794 0.819 2.903 1.00 0.00 H new ATOM 0 HE2 LYS A 22 18.554 -0.800 2.830 1.00 0.00 H new ATOM 0 HE3 LYS A 22 18.346 -0.424 4.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 18.498 -2.869 3.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 17.315 -2.440 4.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 16.879 -2.691 3.325 1.00 0.00 H new ATOM 378 N THR A 23 12.648 3.280 2.724 1.00 0.00 N ATOM 379 CA THR A 23 11.374 3.970 2.346 1.00 0.00 C ATOM 380 C THR A 23 10.549 3.135 1.308 1.00 0.00 C ATOM 381 O THR A 23 11.136 2.536 0.398 1.00 0.00 O ATOM 382 CB THR A 23 11.693 5.373 1.714 1.00 0.00 C ATOM 383 OG1 THR A 23 12.504 5.250 0.547 1.00 0.00 O ATOM 384 CG2 THR A 23 12.452 6.346 2.629 1.00 0.00 C ATOM 0 H THR A 23 13.103 2.841 1.924 1.00 0.00 H new ATOM 0 HA THR A 23 10.784 4.083 3.255 1.00 0.00 H new ATOM 0 HB THR A 23 10.700 5.772 1.507 1.00 0.00 H new ATOM 0 HG1 THR A 23 13.324 4.761 0.768 1.00 0.00 H new ATOM 0 HG21 THR A 23 12.623 7.284 2.101 1.00 0.00 H new ATOM 0 HG22 THR A 23 11.862 6.537 3.526 1.00 0.00 H new ATOM 0 HG23 THR A 23 13.410 5.908 2.911 1.00 0.00 H new ATOM 392 N PHE A 24 9.197 3.099 1.386 1.00 0.00 N ATOM 393 CA PHE A 24 8.377 2.464 0.298 1.00 0.00 C ATOM 394 C PHE A 24 7.891 3.609 -0.661 1.00 0.00 C ATOM 395 O PHE A 24 6.997 4.368 -0.279 1.00 0.00 O ATOM 396 CB PHE A 24 7.232 1.687 0.991 1.00 0.00 C ATOM 397 CG PHE A 24 6.189 1.051 0.061 1.00 0.00 C ATOM 398 CD1 PHE A 24 6.475 -0.141 -0.606 1.00 0.00 C ATOM 399 CD2 PHE A 24 4.937 1.653 -0.110 1.00 0.00 C ATOM 400 CE1 PHE A 24 5.524 -0.721 -1.437 1.00 0.00 C ATOM 401 CE2 PHE A 24 3.980 1.062 -0.932 1.00 0.00 C ATOM 402 CZ PHE A 24 4.274 -0.128 -1.593 1.00 0.00 C ATOM 0 H PHE A 24 8.655 3.485 2.159 1.00 0.00 H new ATOM 0 HA PHE A 24 8.929 1.753 -0.317 1.00 0.00 H new ATOM 0 HB2 PHE A 24 7.673 0.899 1.602 1.00 0.00 H new ATOM 0 HB3 PHE A 24 6.717 2.367 1.670 1.00 0.00 H new ATOM 0 HD1 PHE A 24 7.437 -0.614 -0.476 1.00 0.00 H new ATOM 0 HD2 PHE A 24 4.712 2.579 0.397 1.00 0.00 H new ATOM 0 HE1 PHE A 24 5.755 -1.635 -1.964 1.00 0.00 H new ATOM 0 HE2 PHE A 24 3.012 1.526 -1.056 1.00 0.00 H new ATOM 0 HZ PHE A 24 3.532 -0.591 -2.227 1.00 0.00 H new ATOM 412 N TYR A 25 8.438 3.730 -1.893 1.00 0.00 N ATOM 413 CA TYR A 25 8.146 4.903 -2.784 1.00 0.00 C ATOM 414 C TYR A 25 7.876 4.581 -4.294 1.00 0.00 C ATOM 415 O TYR A 25 8.496 3.709 -4.908 1.00 0.00 O ATOM 416 CB TYR A 25 9.356 5.882 -2.643 1.00 0.00 C ATOM 417 CG TYR A 25 10.735 5.474 -3.181 1.00 0.00 C ATOM 418 CD1 TYR A 25 11.572 4.662 -2.409 1.00 0.00 C ATOM 419 CD2 TYR A 25 11.185 5.956 -4.411 1.00 0.00 C ATOM 420 CE1 TYR A 25 12.845 4.332 -2.861 1.00 0.00 C ATOM 421 CE2 TYR A 25 12.459 5.627 -4.864 1.00 0.00 C ATOM 422 CZ TYR A 25 13.277 4.807 -4.096 1.00 0.00 C ATOM 423 OH TYR A 25 14.506 4.483 -4.574 1.00 0.00 O ATOM 0 H TYR A 25 9.077 3.046 -2.299 1.00 0.00 H new ATOM 0 HA TYR A 25 7.200 5.331 -2.452 1.00 0.00 H new ATOM 0 HB2 TYR A 25 9.078 6.815 -3.134 1.00 0.00 H new ATOM 0 HB3 TYR A 25 9.473 6.103 -1.582 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.228 4.289 -1.456 1.00 0.00 H new ATOM 0 HD2 TYR A 25 10.544 6.585 -5.012 1.00 0.00 H new ATOM 0 HE1 TYR A 25 13.493 3.712 -2.259 1.00 0.00 H new ATOM 0 HE2 TYR A 25 12.812 6.008 -5.811 1.00 0.00 H new ATOM 0 HH TYR A 25 14.637 4.902 -5.450 1.00 0.00 H new ATOM 433 N LEU A 26 6.985 5.384 -4.903 1.00 0.00 N ATOM 434 CA LEU A 26 6.592 5.274 -6.336 1.00 0.00 C ATOM 435 C LEU A 26 7.551 6.030 -7.318 1.00 0.00 C ATOM 436 O LEU A 26 8.037 7.129 -7.030 1.00 0.00 O ATOM 437 CB LEU A 26 5.145 5.849 -6.391 1.00 0.00 C ATOM 438 CG LEU A 26 4.443 5.951 -7.770 1.00 0.00 C ATOM 439 CD1 LEU A 26 4.173 4.572 -8.393 1.00 0.00 C ATOM 440 CD2 LEU A 26 3.129 6.737 -7.639 1.00 0.00 C ATOM 0 H LEU A 26 6.506 6.141 -4.415 1.00 0.00 H new ATOM 0 HA LEU A 26 6.651 4.239 -6.671 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.519 5.234 -5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.168 6.848 -5.956 1.00 0.00 H new ATOM 0 HG LEU A 26 5.122 6.481 -8.438 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.680 4.698 -9.357 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.117 4.045 -8.534 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.530 3.993 -7.730 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.645 6.802 -8.614 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.468 6.226 -6.939 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.341 7.741 -7.271 1.00 0.00 H new ATOM 452 N ARG A 27 7.760 5.467 -8.527 1.00 0.00 N ATOM 453 CA ARG A 27 8.597 6.089 -9.582 1.00 0.00 C ATOM 454 C ARG A 27 8.087 5.531 -10.945 1.00 0.00 C ATOM 455 O ARG A 27 8.356 4.372 -11.275 1.00 0.00 O ATOM 456 CB ARG A 27 10.091 5.776 -9.291 1.00 0.00 C ATOM 457 CG ARG A 27 11.090 6.721 -9.996 1.00 0.00 C ATOM 458 CD ARG A 27 12.507 6.558 -9.412 1.00 0.00 C ATOM 459 NE ARG A 27 13.408 7.706 -9.716 1.00 0.00 N ATOM 460 CZ ARG A 27 13.456 8.847 -9.026 1.00 0.00 C ATOM 461 NH1 ARG A 27 12.540 9.220 -8.170 1.00 0.00 N ATOM 462 NH2 ARG A 27 14.473 9.636 -9.198 1.00 0.00 N ATOM 0 H ARG A 27 7.356 4.572 -8.801 1.00 0.00 H new ATOM 0 HA ARG A 27 8.519 7.176 -9.609 1.00 0.00 H new ATOM 0 HB2 ARG A 27 10.258 5.828 -8.215 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.301 4.751 -9.597 1.00 0.00 H new ATOM 0 HG2 ARG A 27 11.106 6.508 -11.065 1.00 0.00 H new ATOM 0 HG3 ARG A 27 10.762 7.754 -9.882 1.00 0.00 H new ATOM 0 HD2 ARG A 27 12.435 6.439 -8.331 1.00 0.00 H new ATOM 0 HD3 ARG A 27 12.951 5.643 -9.805 1.00 0.00 H new ATOM 0 HE ARG A 27 14.037 7.612 -10.514 1.00 0.00 H new ATOM 0 HH11 ARG A 27 11.730 8.625 -7.999 1.00 0.00 H new ATOM 0 HH12 ARG A 27 12.636 10.106 -7.674 1.00 0.00 H new ATOM 0 HH21 ARG A 27 15.214 9.378 -9.850 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.531 10.513 -8.681 1.00 0.00 H new ATOM 476 N ASN A 28 7.319 6.341 -11.716 1.00 0.00 N ATOM 477 CA ASN A 28 6.688 5.946 -13.028 1.00 0.00 C ATOM 478 C ASN A 28 5.943 4.557 -12.969 1.00 0.00 C ATOM 479 O ASN A 28 6.403 3.561 -13.530 1.00 0.00 O ATOM 480 CB ASN A 28 7.736 6.072 -14.187 1.00 0.00 C ATOM 481 CG ASN A 28 9.038 5.245 -14.175 1.00 0.00 C ATOM 482 OD1 ASN A 28 9.070 4.050 -14.444 1.00 0.00 O ATOM 483 ND2 ASN A 28 10.168 5.856 -13.907 1.00 0.00 N ATOM 0 H ASN A 28 7.110 7.304 -11.451 1.00 0.00 H new ATOM 0 HA ASN A 28 5.885 6.650 -13.247 1.00 0.00 H new ATOM 0 HB2 ASN A 28 7.216 5.835 -15.115 1.00 0.00 H new ATOM 0 HB3 ASN A 28 8.025 7.121 -14.243 1.00 0.00 H new ATOM 0 HD21 ASN A 28 11.046 5.336 -13.926 1.00 0.00 H new ATOM 0 HD22 ASN A 28 10.169 6.850 -13.680 1.00 0.00 H new ATOM 490 N ASN A 29 4.792 4.496 -12.251 1.00 0.00 N ATOM 491 CA ASN A 29 3.993 3.238 -11.998 1.00 0.00 C ATOM 492 C ASN A 29 4.722 2.144 -11.107 1.00 0.00 C ATOM 493 O ASN A 29 4.031 1.255 -10.604 1.00 0.00 O ATOM 494 CB ASN A 29 3.475 2.672 -13.368 1.00 0.00 C ATOM 495 CG ASN A 29 2.639 1.384 -13.336 1.00 0.00 C ATOM 496 OD1 ASN A 29 3.166 0.279 -13.406 1.00 0.00 O ATOM 497 ND2 ASN A 29 1.335 1.441 -13.236 1.00 0.00 N ATOM 0 H ASN A 29 4.376 5.322 -11.820 1.00 0.00 H new ATOM 0 HA ASN A 29 3.142 3.519 -11.378 1.00 0.00 H new ATOM 0 HB2 ASN A 29 2.878 3.448 -13.848 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.340 2.495 -14.007 1.00 0.00 H new ATOM 0 HD21 ASN A 29 0.787 0.581 -13.218 1.00 0.00 H new ATOM 0 HD22 ASN A 29 0.867 2.345 -13.176 1.00 0.00 H new ATOM 504 N GLN A 30 6.048 2.182 -10.862 1.00 0.00 N ATOM 505 CA GLN A 30 6.778 1.118 -10.123 1.00 0.00 C ATOM 506 C GLN A 30 7.055 1.580 -8.670 1.00 0.00 C ATOM 507 O GLN A 30 7.543 2.688 -8.434 1.00 0.00 O ATOM 508 CB GLN A 30 8.127 0.824 -10.833 1.00 0.00 C ATOM 509 CG GLN A 30 8.053 0.368 -12.316 1.00 0.00 C ATOM 510 CD GLN A 30 9.423 0.226 -12.983 1.00 0.00 C ATOM 511 OE1 GLN A 30 10.074 -0.811 -12.910 1.00 0.00 O ATOM 512 NE2 GLN A 30 9.910 1.245 -13.652 1.00 0.00 N ATOM 0 H GLN A 30 6.647 2.948 -11.169 1.00 0.00 H new ATOM 0 HA GLN A 30 6.168 0.215 -10.105 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.740 1.724 -10.785 1.00 0.00 H new ATOM 0 HB3 GLN A 30 8.648 0.053 -10.266 1.00 0.00 H new ATOM 0 HG2 GLN A 30 7.532 -0.588 -12.368 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.457 1.086 -12.879 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.377 2.112 -13.719 1.00 0.00 H new ATOM 0 HE22 GLN A 30 10.821 1.169 -14.105 1.00 0.00 H new ATOM 521 N LEU A 31 6.762 0.719 -7.695 1.00 0.00 N ATOM 522 CA LEU A 31 6.988 1.040 -6.257 1.00 0.00 C ATOM 523 C LEU A 31 8.280 0.305 -5.803 1.00 0.00 C ATOM 524 O LEU A 31 8.257 -0.904 -5.546 1.00 0.00 O ATOM 525 CB LEU A 31 5.721 0.688 -5.434 1.00 0.00 C ATOM 526 CG LEU A 31 4.496 1.606 -5.739 1.00 0.00 C ATOM 527 CD1 LEU A 31 3.486 0.926 -6.683 1.00 0.00 C ATOM 528 CD2 LEU A 31 3.801 2.084 -4.458 1.00 0.00 C ATOM 0 H LEU A 31 6.368 -0.208 -7.859 1.00 0.00 H new ATOM 0 HA LEU A 31 7.148 2.105 -6.092 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.446 -0.348 -5.634 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.958 0.756 -4.372 1.00 0.00 H new ATOM 0 HG LEU A 31 4.892 2.484 -6.250 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.650 1.600 -6.868 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.975 0.686 -7.627 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.118 0.009 -6.222 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.955 2.720 -4.719 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.447 1.222 -3.893 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.507 2.651 -3.851 1.00 0.00 H new ATOM 540 N VAL A 32 9.402 1.056 -5.784 1.00 0.00 N ATOM 541 CA VAL A 32 10.760 0.529 -5.442 1.00 0.00 C ATOM 542 C VAL A 32 10.971 0.583 -3.891 1.00 0.00 C ATOM 543 O VAL A 32 10.369 1.386 -3.161 1.00 0.00 O ATOM 544 CB VAL A 32 11.937 1.304 -6.178 1.00 0.00 C ATOM 545 CG1 VAL A 32 13.002 0.297 -6.655 1.00 0.00 C ATOM 546 CG2 VAL A 32 11.593 2.177 -7.414 1.00 0.00 C ATOM 0 H VAL A 32 9.401 2.052 -6.005 1.00 0.00 H new ATOM 0 HA VAL A 32 10.798 -0.502 -5.794 1.00 0.00 H new ATOM 0 HB VAL A 32 12.263 1.999 -5.405 1.00 0.00 H new ATOM 0 HG11 VAL A 32 13.808 0.831 -7.159 1.00 0.00 H new ATOM 0 HG12 VAL A 32 13.405 -0.241 -5.797 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.548 -0.412 -7.347 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.503 2.637 -7.799 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.147 1.552 -8.188 1.00 0.00 H new ATOM 0 HG23 VAL A 32 10.887 2.956 -7.124 1.00 0.00 H new ATOM 556 N ALA A 33 11.859 -0.286 -3.389 1.00 0.00 N ATOM 557 CA ALA A 33 12.116 -0.400 -1.943 1.00 0.00 C ATOM 558 C ALA A 33 13.352 0.340 -1.412 1.00 0.00 C ATOM 559 O ALA A 33 14.427 0.403 -2.024 1.00 0.00 O ATOM 560 CB ALA A 33 12.438 -1.876 -1.663 1.00 0.00 C ATOM 0 H ALA A 33 12.413 -0.922 -3.962 1.00 0.00 H new ATOM 0 HA ALA A 33 11.232 0.022 -1.466 1.00 0.00 H new ATOM 0 HB1 ALA A 33 12.636 -2.010 -0.600 1.00 0.00 H new ATOM 0 HB2 ALA A 33 11.590 -2.495 -1.955 1.00 0.00 H new ATOM 0 HB3 ALA A 33 13.317 -2.172 -2.236 1.00 0.00 H new ATOM 566 N GLY A 34 13.204 0.690 -0.136 1.00 0.00 N ATOM 567 CA GLY A 34 14.310 1.154 0.681 1.00 0.00 C ATOM 568 C GLY A 34 14.977 2.462 0.305 1.00 0.00 C ATOM 569 O GLY A 34 14.514 3.548 0.654 1.00 0.00 O ATOM 0 H GLY A 34 12.311 0.658 0.356 1.00 0.00 H new ATOM 0 HA2 GLY A 34 13.951 1.245 1.706 1.00 0.00 H new ATOM 0 HA3 GLY A 34 15.075 0.377 0.679 1.00 0.00 H new ATOM 573 N TYR A 35 16.129 2.279 -0.313 1.00 0.00 N ATOM 574 CA TYR A 35 17.037 3.405 -0.658 1.00 0.00 C ATOM 575 C TYR A 35 17.606 3.365 -2.127 1.00 0.00 C ATOM 576 O TYR A 35 18.713 3.867 -2.346 1.00 0.00 O ATOM 577 CB TYR A 35 18.184 3.444 0.428 1.00 0.00 C ATOM 578 CG TYR A 35 18.208 4.593 1.472 1.00 0.00 C ATOM 579 CD1 TYR A 35 17.071 5.263 1.945 1.00 0.00 C ATOM 580 CD2 TYR A 35 19.465 4.980 1.962 1.00 0.00 C ATOM 581 CE1 TYR A 35 17.186 6.292 2.877 1.00 0.00 C ATOM 582 CE2 TYR A 35 19.580 6.012 2.889 1.00 0.00 C ATOM 583 CZ TYR A 35 18.441 6.664 3.348 1.00 0.00 C ATOM 584 OH TYR A 35 18.542 7.616 4.328 1.00 0.00 O ATOM 0 H TYR A 35 16.477 1.363 -0.596 1.00 0.00 H new ATOM 0 HA TYR A 35 16.457 4.328 -0.642 1.00 0.00 H new ATOM 0 HB2 TYR A 35 18.146 2.504 0.978 1.00 0.00 H new ATOM 0 HB3 TYR A 35 19.136 3.464 -0.103 1.00 0.00 H new ATOM 0 HD1 TYR A 35 16.094 4.978 1.583 1.00 0.00 H new ATOM 0 HD2 TYR A 35 20.353 4.472 1.616 1.00 0.00 H new ATOM 0 HE1 TYR A 35 16.302 6.800 3.233 1.00 0.00 H new ATOM 0 HE2 TYR A 35 20.554 6.306 3.252 1.00 0.00 H new ATOM 0 HH TYR A 35 19.447 7.604 4.703 1.00 0.00 H new ATOM 594 N LEU A 36 16.844 2.980 -3.182 1.00 0.00 N ATOM 595 CA LEU A 36 17.428 2.914 -4.579 1.00 0.00 C ATOM 596 C LEU A 36 17.679 4.275 -5.342 1.00 0.00 C ATOM 597 O LEU A 36 18.255 4.296 -6.431 1.00 0.00 O ATOM 598 CB LEU A 36 16.465 1.942 -5.346 1.00 0.00 C ATOM 599 CG LEU A 36 16.800 1.383 -6.763 1.00 0.00 C ATOM 600 CD1 LEU A 36 16.350 2.271 -7.936 1.00 0.00 C ATOM 601 CD2 LEU A 36 18.260 0.933 -6.934 1.00 0.00 C ATOM 0 H LEU A 36 15.861 2.717 -3.116 1.00 0.00 H new ATOM 0 HA LEU A 36 18.459 2.564 -4.518 1.00 0.00 H new ATOM 0 HB2 LEU A 36 16.310 1.079 -4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 36 15.506 2.454 -5.430 1.00 0.00 H new ATOM 0 HG LEU A 36 16.183 0.486 -6.812 1.00 0.00 H new ATOM 0 HD11 LEU A 36 16.627 1.798 -8.878 1.00 0.00 H new ATOM 0 HD12 LEU A 36 15.268 2.401 -7.900 1.00 0.00 H new ATOM 0 HD13 LEU A 36 16.835 3.244 -7.862 1.00 0.00 H new ATOM 0 HD21 LEU A 36 18.409 0.558 -7.947 1.00 0.00 H new ATOM 0 HD22 LEU A 36 18.924 1.779 -6.759 1.00 0.00 H new ATOM 0 HD23 LEU A 36 18.483 0.142 -6.218 1.00 0.00 H new ATOM 613 N GLN A 37 17.293 5.411 -4.759 1.00 0.00 N ATOM 614 CA GLN A 37 17.413 6.773 -5.356 1.00 0.00 C ATOM 615 C GLN A 37 17.599 7.825 -4.214 1.00 0.00 C ATOM 616 O GLN A 37 16.823 7.850 -3.252 1.00 0.00 O ATOM 617 CB GLN A 37 16.136 7.117 -6.183 1.00 0.00 C ATOM 618 CG GLN A 37 15.862 6.285 -7.463 1.00 0.00 C ATOM 619 CD GLN A 37 16.754 6.582 -8.676 1.00 0.00 C ATOM 620 OE1 GLN A 37 16.448 7.424 -9.516 1.00 0.00 O ATOM 621 NE2 GLN A 37 17.860 5.896 -8.819 1.00 0.00 N ATOM 0 H GLN A 37 16.873 5.426 -3.829 1.00 0.00 H new ATOM 0 HA GLN A 37 18.277 6.795 -6.021 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.273 7.015 -5.525 1.00 0.00 H new ATOM 0 HB3 GLN A 37 16.195 8.167 -6.471 1.00 0.00 H new ATOM 0 HG2 GLN A 37 15.967 5.229 -7.213 1.00 0.00 H new ATOM 0 HG3 GLN A 37 14.824 6.442 -7.756 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.119 5.195 -8.124 1.00 0.00 H new ATOM 0 HE22 GLN A 37 18.463 6.062 -9.625 1.00 0.00 H new ATOM 630 N GLY A 38 18.593 8.725 -4.341 1.00 0.00 N ATOM 631 CA GLY A 38 18.883 9.743 -3.291 1.00 0.00 C ATOM 632 C GLY A 38 18.209 11.137 -3.444 1.00 0.00 C ATOM 633 O GLY A 38 17.112 11.296 -2.899 1.00 0.00 O ATOM 0 H GLY A 38 19.210 8.775 -5.152 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.586 9.328 -2.328 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.962 9.892 -3.254 1.00 0.00 H new ATOM 637 N PRO A 39 18.786 12.161 -4.142 1.00 0.00 N ATOM 638 CA PRO A 39 18.195 13.532 -4.207 1.00 0.00 C ATOM 639 C PRO A 39 16.866 13.653 -5.025 1.00 0.00 C ATOM 640 O PRO A 39 16.853 13.557 -6.256 1.00 0.00 O ATOM 641 CB PRO A 39 19.361 14.349 -4.803 1.00 0.00 C ATOM 642 CG PRO A 39 20.181 13.351 -5.625 1.00 0.00 C ATOM 643 CD PRO A 39 20.092 12.053 -4.825 1.00 0.00 C ATOM 0 HA PRO A 39 17.855 13.882 -3.232 1.00 0.00 H new ATOM 0 HB2 PRO A 39 18.991 15.162 -5.428 1.00 0.00 H new ATOM 0 HB3 PRO A 39 19.966 14.801 -4.017 1.00 0.00 H new ATOM 0 HG2 PRO A 39 19.773 13.230 -6.629 1.00 0.00 H new ATOM 0 HG3 PRO A 39 21.214 13.680 -5.738 1.00 0.00 H new ATOM 0 HD2 PRO A 39 20.135 11.178 -5.473 1.00 0.00 H new ATOM 0 HD3 PRO A 39 20.912 11.963 -4.112 1.00 0.00 H new ATOM 651 N ASN A 40 15.746 13.865 -4.309 1.00 0.00 N ATOM 652 CA ASN A 40 14.393 14.001 -4.927 1.00 0.00 C ATOM 653 C ASN A 40 13.599 15.141 -4.200 1.00 0.00 C ATOM 654 O ASN A 40 13.461 16.228 -4.764 1.00 0.00 O ATOM 655 CB ASN A 40 13.664 12.617 -4.899 1.00 0.00 C ATOM 656 CG ASN A 40 14.217 11.542 -5.841 1.00 0.00 C ATOM 657 OD1 ASN A 40 13.851 11.452 -7.009 1.00 0.00 O ATOM 658 ND2 ASN A 40 15.091 10.682 -5.373 1.00 0.00 N ATOM 0 H ASN A 40 15.742 13.948 -3.292 1.00 0.00 H new ATOM 0 HA ASN A 40 14.471 14.292 -5.975 1.00 0.00 H new ATOM 0 HB2 ASN A 40 13.700 12.231 -3.880 1.00 0.00 H new ATOM 0 HB3 ASN A 40 12.614 12.778 -5.142 1.00 0.00 H new ATOM 0 HD21 ASN A 40 15.459 9.948 -5.978 1.00 0.00 H new ATOM 0 HD22 ASN A 40 15.402 10.747 -4.404 1.00 0.00 H new ATOM 665 N VAL A 41 13.054 14.900 -2.982 1.00 0.00 N ATOM 666 CA VAL A 41 12.274 15.876 -2.125 1.00 0.00 C ATOM 667 C VAL A 41 10.908 16.400 -2.732 1.00 0.00 C ATOM 668 O VAL A 41 9.979 16.614 -1.948 1.00 0.00 O ATOM 669 CB VAL A 41 13.200 17.083 -1.682 1.00 0.00 C ATOM 670 CG1 VAL A 41 12.520 18.092 -0.721 1.00 0.00 C ATOM 671 CG2 VAL A 41 14.507 16.651 -0.966 1.00 0.00 C ATOM 0 H VAL A 41 13.140 13.987 -2.536 1.00 0.00 H new ATOM 0 HA VAL A 41 11.967 15.294 -1.256 1.00 0.00 H new ATOM 0 HB VAL A 41 13.417 17.550 -2.643 1.00 0.00 H new ATOM 0 HG11 VAL A 41 13.224 18.885 -0.469 1.00 0.00 H new ATOM 0 HG12 VAL A 41 11.645 18.524 -1.207 1.00 0.00 H new ATOM 0 HG13 VAL A 41 12.212 17.577 0.189 1.00 0.00 H new ATOM 0 HG21 VAL A 41 15.083 17.536 -0.696 1.00 0.00 H new ATOM 0 HG22 VAL A 41 14.260 16.090 -0.065 1.00 0.00 H new ATOM 0 HG23 VAL A 41 15.097 16.023 -1.634 1.00 0.00 H new ATOM 681 N ASN A 42 10.703 16.498 -4.058 1.00 0.00 N ATOM 682 CA ASN A 42 9.417 16.952 -4.663 1.00 0.00 C ATOM 683 C ASN A 42 8.710 15.728 -5.339 1.00 0.00 C ATOM 684 O ASN A 42 8.696 15.593 -6.568 1.00 0.00 O ATOM 685 CB ASN A 42 9.770 18.121 -5.627 1.00 0.00 C ATOM 686 CG ASN A 42 8.570 18.916 -6.154 1.00 0.00 C ATOM 687 OD1 ASN A 42 8.169 19.931 -5.596 1.00 0.00 O ATOM 688 ND2 ASN A 42 7.959 18.491 -7.232 1.00 0.00 N ATOM 0 H ASN A 42 11.418 16.267 -4.748 1.00 0.00 H new ATOM 0 HA ASN A 42 8.698 17.329 -3.935 1.00 0.00 H new ATOM 0 HB2 ASN A 42 10.441 18.807 -5.110 1.00 0.00 H new ATOM 0 HB3 ASN A 42 10.320 17.717 -6.477 1.00 0.00 H new ATOM 0 HD21 ASN A 42 7.157 19.004 -7.600 1.00 0.00 H new ATOM 0 HD22 ASN A 42 8.285 17.647 -7.704 1.00 0.00 H new ATOM 695 N LEU A 43 8.129 14.830 -4.521 1.00 0.00 N ATOM 696 CA LEU A 43 7.459 13.589 -5.019 1.00 0.00 C ATOM 697 C LEU A 43 6.382 13.063 -4.011 1.00 0.00 C ATOM 698 O LEU A 43 5.235 12.891 -4.428 1.00 0.00 O ATOM 699 CB LEU A 43 8.565 12.520 -5.334 1.00 0.00 C ATOM 700 CG LEU A 43 8.170 11.297 -6.212 1.00 0.00 C ATOM 701 CD1 LEU A 43 9.432 10.605 -6.760 1.00 0.00 C ATOM 702 CD2 LEU A 43 7.335 10.237 -5.470 1.00 0.00 C ATOM 0 H LEU A 43 8.104 14.932 -3.506 1.00 0.00 H new ATOM 0 HA LEU A 43 6.911 13.810 -5.935 1.00 0.00 H new ATOM 0 HB2 LEU A 43 9.393 13.031 -5.826 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.943 12.141 -4.385 1.00 0.00 H new ATOM 0 HG LEU A 43 7.554 11.705 -7.013 1.00 0.00 H new ATOM 0 HD11 LEU A 43 9.142 9.751 -7.372 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.000 11.311 -7.367 1.00 0.00 H new ATOM 0 HD13 LEU A 43 10.049 10.263 -5.929 1.00 0.00 H new ATOM 0 HD21 LEU A 43 7.100 9.418 -6.149 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.903 9.854 -4.622 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.409 10.688 -5.112 1.00 0.00 H new ATOM 714 N GLU A 44 6.745 12.794 -2.729 1.00 0.00 N ATOM 715 CA GLU A 44 5.864 12.179 -1.678 1.00 0.00 C ATOM 716 C GLU A 44 5.600 10.674 -2.064 1.00 0.00 C ATOM 717 O GLU A 44 4.882 10.334 -3.013 1.00 0.00 O ATOM 718 CB GLU A 44 4.585 13.027 -1.388 1.00 0.00 C ATOM 719 CG GLU A 44 3.472 12.374 -0.516 1.00 0.00 C ATOM 720 CD GLU A 44 3.757 11.952 0.920 1.00 0.00 C ATOM 721 OE1 GLU A 44 4.928 11.817 1.337 1.00 0.00 O ATOM 722 OE2 GLU A 44 2.776 11.740 1.660 1.00 0.00 O ATOM 0 H GLU A 44 7.681 13.001 -2.380 1.00 0.00 H new ATOM 0 HA GLU A 44 6.373 12.183 -0.714 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.897 13.950 -0.899 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.143 13.306 -2.344 1.00 0.00 H new ATOM 0 HG2 GLU A 44 2.637 13.074 -0.485 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.126 11.488 -1.048 1.00 0.00 H new ATOM 729 N GLU A 45 6.197 9.774 -1.269 1.00 0.00 N ATOM 730 CA GLU A 45 6.162 8.304 -1.481 1.00 0.00 C ATOM 731 C GLU A 45 4.872 7.501 -1.115 1.00 0.00 C ATOM 732 O GLU A 45 4.695 6.357 -1.546 1.00 0.00 O ATOM 733 CB GLU A 45 7.420 7.800 -0.702 1.00 0.00 C ATOM 734 CG GLU A 45 7.705 8.153 0.785 1.00 0.00 C ATOM 735 CD GLU A 45 6.598 7.835 1.763 1.00 0.00 C ATOM 736 OE1 GLU A 45 6.407 6.656 2.127 1.00 0.00 O ATOM 737 OE2 GLU A 45 5.926 8.792 2.208 1.00 0.00 O ATOM 0 H GLU A 45 6.730 10.044 -0.442 1.00 0.00 H new ATOM 0 HA GLU A 45 6.158 8.116 -2.555 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.403 6.712 -0.761 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.288 8.136 -1.269 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.604 7.622 1.098 1.00 0.00 H new ATOM 0 HG3 GLU A 45 7.925 9.219 0.849 1.00 0.00 H new ATOM 744 N LYS A 46 3.976 8.133 -0.371 1.00 0.00 N ATOM 745 CA LYS A 46 2.669 7.564 0.046 1.00 0.00 C ATOM 746 C LYS A 46 1.618 8.729 -0.029 1.00 0.00 C ATOM 747 O LYS A 46 1.537 9.354 -1.089 1.00 0.00 O ATOM 748 CB LYS A 46 2.885 6.794 1.391 1.00 0.00 C ATOM 749 CG LYS A 46 2.591 5.267 1.373 1.00 0.00 C ATOM 750 CD LYS A 46 1.363 4.760 2.175 1.00 0.00 C ATOM 751 CE LYS A 46 -0.005 4.699 1.457 1.00 0.00 C ATOM 752 NZ LYS A 46 -0.649 6.037 1.374 1.00 0.00 N ATOM 0 H LYS A 46 4.126 9.080 -0.024 1.00 0.00 H new ATOM 0 HA LYS A 46 2.245 6.795 -0.600 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.919 6.938 1.704 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.254 7.254 2.152 1.00 0.00 H new ATOM 0 HG2 LYS A 46 2.462 4.962 0.334 1.00 0.00 H new ATOM 0 HG3 LYS A 46 3.474 4.751 1.750 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.593 3.758 2.538 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.251 5.399 3.051 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.130 4.298 0.452 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.663 4.012 1.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.682 5.929 1.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.320 6.630 2.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.396 6.489 0.472 1.00 0.00 H new ATOM 766 N ILE A 47 0.737 8.918 0.977 1.00 0.00 N ATOM 767 CA ILE A 47 -0.275 10.025 1.097 1.00 0.00 C ATOM 768 C ILE A 47 -1.580 9.405 1.684 1.00 0.00 C ATOM 769 O ILE A 47 -1.753 9.334 2.896 1.00 0.00 O ATOM 770 CB ILE A 47 -0.452 11.108 -0.067 1.00 0.00 C ATOM 771 CG1 ILE A 47 -1.159 12.407 0.436 1.00 0.00 C ATOM 772 CG2 ILE A 47 -1.249 10.673 -1.325 1.00 0.00 C ATOM 773 CD1 ILE A 47 -0.373 13.238 1.467 1.00 0.00 C ATOM 0 H ILE A 47 0.699 8.280 1.772 1.00 0.00 H new ATOM 0 HA ILE A 47 0.162 10.751 1.783 1.00 0.00 H new ATOM 0 HB ILE A 47 0.588 11.261 -0.357 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -1.373 13.039 -0.426 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -2.118 12.130 0.874 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.293 11.501 -2.032 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.754 9.822 -1.793 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -2.261 10.390 -1.035 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.955 14.116 1.747 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.181 12.632 2.353 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.575 13.555 1.032 1.00 0.00 H new ATOM 785 N ASP A 48 -2.503 9.020 0.838 1.00 0.00 N ATOM 786 CA ASP A 48 -3.883 8.608 1.202 1.00 0.00 C ATOM 787 C ASP A 48 -4.012 7.125 1.705 1.00 0.00 C ATOM 788 O ASP A 48 -3.417 6.183 1.159 1.00 0.00 O ATOM 789 CB ASP A 48 -4.727 8.947 -0.073 1.00 0.00 C ATOM 790 CG ASP A 48 -6.105 8.297 -0.259 1.00 0.00 C ATOM 791 OD1 ASP A 48 -6.179 7.049 -0.250 1.00 0.00 O ATOM 792 OD2 ASP A 48 -7.107 9.008 -0.469 1.00 0.00 O ATOM 0 H ASP A 48 -2.332 8.975 -0.166 1.00 0.00 H new ATOM 0 HA ASP A 48 -4.249 9.142 2.079 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -4.870 10.027 -0.093 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -4.123 8.689 -0.943 1.00 0.00 H new ATOM 797 N VAL A 49 -4.883 6.945 2.717 1.00 0.00 N ATOM 798 CA VAL A 49 -5.289 5.592 3.215 1.00 0.00 C ATOM 799 C VAL A 49 -6.827 5.582 3.521 1.00 0.00 C ATOM 800 O VAL A 49 -7.297 6.244 4.452 1.00 0.00 O ATOM 801 CB VAL A 49 -4.473 5.130 4.470 1.00 0.00 C ATOM 802 CG1 VAL A 49 -3.046 4.696 4.077 1.00 0.00 C ATOM 803 CG2 VAL A 49 -4.433 6.091 5.681 1.00 0.00 C ATOM 0 H VAL A 49 -5.327 7.716 3.215 1.00 0.00 H new ATOM 0 HA VAL A 49 -5.064 4.875 2.425 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.049 4.280 4.835 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.503 4.381 4.968 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.099 3.866 3.372 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.526 5.534 3.613 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -3.835 5.648 6.478 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.988 7.039 5.379 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -5.447 6.264 6.042 1.00 0.00 H new ATOM 813 N VAL A 50 -7.626 4.808 2.760 1.00 0.00 N ATOM 814 CA VAL A 50 -9.103 4.707 2.999 1.00 0.00 C ATOM 815 C VAL A 50 -9.363 3.300 3.657 1.00 0.00 C ATOM 816 O VAL A 50 -9.287 2.295 2.939 1.00 0.00 O ATOM 817 CB VAL A 50 -9.906 4.954 1.674 1.00 0.00 C ATOM 818 CG1 VAL A 50 -11.427 4.721 1.848 1.00 0.00 C ATOM 819 CG2 VAL A 50 -9.734 6.403 1.147 1.00 0.00 C ATOM 0 H VAL A 50 -7.290 4.244 1.979 1.00 0.00 H new ATOM 0 HA VAL A 50 -9.460 5.482 3.678 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.493 4.236 0.966 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -11.934 4.906 0.901 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -11.604 3.692 2.160 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -11.815 5.401 2.606 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -10.308 6.527 0.229 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -10.093 7.108 1.897 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.680 6.594 0.945 1.00 0.00 H new ATOM 829 N PRO A 51 -9.687 3.161 4.979 1.00 0.00 N ATOM 830 CA PRO A 51 -9.899 1.837 5.619 1.00 0.00 C ATOM 831 C PRO A 51 -11.293 1.170 5.370 1.00 0.00 C ATOM 832 O PRO A 51 -12.322 1.841 5.204 1.00 0.00 O ATOM 833 CB PRO A 51 -9.667 2.180 7.104 1.00 0.00 C ATOM 834 CG PRO A 51 -10.156 3.622 7.261 1.00 0.00 C ATOM 835 CD PRO A 51 -9.780 4.285 5.936 1.00 0.00 C ATOM 0 HA PRO A 51 -9.237 1.076 5.206 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -10.219 1.503 7.756 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -8.614 2.090 7.370 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -11.231 3.662 7.437 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.676 4.117 8.105 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.533 5.010 5.626 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -8.834 4.821 6.014 1.00 0.00 H new ATOM 843 N ILE A 52 -11.305 -0.179 5.373 1.00 0.00 N ATOM 844 CA ILE A 52 -12.571 -0.973 5.298 1.00 0.00 C ATOM 845 C ILE A 52 -13.084 -1.125 6.782 1.00 0.00 C ATOM 846 O ILE A 52 -13.221 -0.105 7.471 1.00 0.00 O ATOM 847 CB ILE A 52 -12.340 -2.216 4.344 1.00 0.00 C ATOM 848 CG1 ILE A 52 -13.711 -2.822 3.905 1.00 0.00 C ATOM 849 CG2 ILE A 52 -11.438 -3.327 4.939 1.00 0.00 C ATOM 850 CD1 ILE A 52 -13.643 -3.943 2.851 1.00 0.00 C ATOM 0 H ILE A 52 -10.461 -0.749 5.426 1.00 0.00 H new ATOM 0 HA ILE A 52 -13.428 -0.522 4.798 1.00 0.00 H new ATOM 0 HB ILE A 52 -11.800 -1.825 3.482 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -14.214 -3.211 4.790 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -14.333 -2.018 3.512 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -11.335 -4.138 4.217 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -10.454 -2.915 5.165 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -11.889 -3.711 5.854 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -14.651 -4.289 2.622 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -13.175 -3.561 1.944 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -13.055 -4.774 3.241 1.00 0.00 H new ATOM 862 N GLU A 53 -13.358 -2.327 7.284 1.00 0.00 N ATOM 863 CA GLU A 53 -13.894 -2.512 8.672 1.00 0.00 C ATOM 864 C GLU A 53 -12.758 -2.788 9.738 1.00 0.00 C ATOM 865 O GLU A 53 -12.718 -1.992 10.683 1.00 0.00 O ATOM 866 CB GLU A 53 -15.037 -3.578 8.688 1.00 0.00 C ATOM 867 CG GLU A 53 -16.210 -3.422 7.677 1.00 0.00 C ATOM 868 CD GLU A 53 -16.805 -2.034 7.496 1.00 0.00 C ATOM 869 OE1 GLU A 53 -17.716 -1.651 8.256 1.00 0.00 O ATOM 870 OE2 GLU A 53 -16.374 -1.321 6.560 1.00 0.00 O ATOM 0 H GLU A 53 -13.226 -3.198 6.769 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.338 -1.567 8.984 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.582 -4.554 8.521 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -15.463 -3.592 9.691 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -15.862 -3.768 6.704 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -17.011 -4.093 7.986 1.00 0.00 H new ATOM 877 N PRO A 54 -11.826 -3.800 9.705 1.00 0.00 N ATOM 878 CA PRO A 54 -10.787 -3.980 10.764 1.00 0.00 C ATOM 879 C PRO A 54 -9.448 -3.211 10.449 1.00 0.00 C ATOM 880 O PRO A 54 -9.478 -2.077 9.959 1.00 0.00 O ATOM 881 CB PRO A 54 -10.750 -5.528 10.755 1.00 0.00 C ATOM 882 CG PRO A 54 -10.831 -5.906 9.271 1.00 0.00 C ATOM 883 CD PRO A 54 -11.757 -4.846 8.664 1.00 0.00 C ATOM 0 HA PRO A 54 -10.979 -3.558 11.750 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -9.835 -5.906 11.211 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -11.584 -5.948 11.318 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -9.847 -5.891 8.802 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.233 -6.910 9.137 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.357 -4.454 7.729 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -12.743 -5.255 8.442 1.00 0.00 H new ATOM 891 N HIS A 55 -8.260 -3.807 10.695 1.00 0.00 N ATOM 892 CA HIS A 55 -6.949 -3.180 10.324 1.00 0.00 C ATOM 893 C HIS A 55 -6.592 -3.466 8.810 1.00 0.00 C ATOM 894 O HIS A 55 -5.522 -3.983 8.474 1.00 0.00 O ATOM 895 CB HIS A 55 -5.859 -3.719 11.301 1.00 0.00 C ATOM 896 CG HIS A 55 -5.985 -3.358 12.788 1.00 0.00 C ATOM 897 ND1 HIS A 55 -6.127 -2.065 13.287 1.00 0.00 N ATOM 898 CD2 HIS A 55 -5.889 -4.284 13.841 1.00 0.00 C ATOM 899 CE1 HIS A 55 -6.127 -2.347 14.631 1.00 0.00 C ATOM 900 NE2 HIS A 55 -5.987 -3.638 15.059 1.00 0.00 N ATOM 0 H HIS A 55 -8.171 -4.717 11.146 1.00 0.00 H new ATOM 0 HA HIS A 55 -7.007 -2.096 10.420 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -5.846 -4.806 11.221 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -4.890 -3.362 10.951 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -5.757 -5.349 13.716 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -6.238 -1.549 15.350 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -5.962 -4.016 16.006 1.00 0.00 H new ATOM 908 N ALA A 56 -7.501 -3.095 7.887 1.00 0.00 N ATOM 909 CA ALA A 56 -7.364 -3.332 6.428 1.00 0.00 C ATOM 910 C ALA A 56 -7.801 -2.077 5.616 1.00 0.00 C ATOM 911 O ALA A 56 -8.702 -1.333 6.022 1.00 0.00 O ATOM 912 CB ALA A 56 -8.192 -4.589 6.100 1.00 0.00 C ATOM 0 H ALA A 56 -8.366 -2.614 8.133 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.325 -3.503 6.144 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -8.121 -4.803 5.034 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.807 -5.437 6.667 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -9.235 -4.418 6.367 1.00 0.00 H new ATOM 918 N LEU A 57 -7.176 -1.843 4.445 1.00 0.00 N ATOM 919 CA LEU A 57 -7.379 -0.573 3.689 1.00 0.00 C ATOM 920 C LEU A 57 -7.102 -0.610 2.147 1.00 0.00 C ATOM 921 O LEU A 57 -6.438 -1.496 1.604 1.00 0.00 O ATOM 922 CB LEU A 57 -6.433 0.485 4.369 1.00 0.00 C ATOM 923 CG LEU A 57 -4.892 0.226 4.301 1.00 0.00 C ATOM 924 CD1 LEU A 57 -4.119 1.533 4.140 1.00 0.00 C ATOM 925 CD2 LEU A 57 -4.349 -0.516 5.537 1.00 0.00 C ATOM 0 H LEU A 57 -6.535 -2.500 4.001 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.442 -0.337 3.741 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -6.631 1.455 3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -6.715 0.562 5.419 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.743 -0.410 3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.051 1.321 4.096 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.429 2.028 3.220 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.325 2.184 4.989 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.275 -0.665 5.429 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -4.545 0.075 6.432 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.843 -1.484 5.626 1.00 0.00 H new ATOM 937 N PHE A 58 -7.594 0.445 1.476 1.00 0.00 N ATOM 938 CA PHE A 58 -7.388 0.718 0.025 1.00 0.00 C ATOM 939 C PHE A 58 -6.318 1.868 -0.055 1.00 0.00 C ATOM 940 O PHE A 58 -6.476 2.904 0.611 1.00 0.00 O ATOM 941 CB PHE A 58 -8.748 1.119 -0.627 1.00 0.00 C ATOM 942 CG PHE A 58 -9.949 0.164 -0.414 1.00 0.00 C ATOM 943 CD1 PHE A 58 -9.971 -1.100 -1.010 1.00 0.00 C ATOM 944 CD2 PHE A 58 -11.017 0.551 0.407 1.00 0.00 C ATOM 945 CE1 PHE A 58 -11.047 -1.961 -0.795 1.00 0.00 C ATOM 946 CE2 PHE A 58 -12.103 -0.301 0.600 1.00 0.00 C ATOM 947 CZ PHE A 58 -12.118 -1.554 -0.005 1.00 0.00 C ATOM 0 H PHE A 58 -8.164 1.158 1.932 1.00 0.00 H new ATOM 0 HA PHE A 58 -7.031 -0.155 -0.522 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -9.027 2.102 -0.247 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -8.589 1.226 -1.700 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -9.151 -1.411 -1.640 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -10.998 1.515 0.893 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -11.049 -2.944 -1.242 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -12.932 0.011 1.218 1.00 0.00 H new ATOM 0 HZ PHE A 58 -12.962 -2.212 0.139 1.00 0.00 H new ATOM 957 N LEU A 59 -5.230 1.728 -0.842 1.00 0.00 N ATOM 958 CA LEU A 59 -4.093 2.704 -0.782 1.00 0.00 C ATOM 959 C LEU A 59 -4.187 3.879 -1.818 1.00 0.00 C ATOM 960 O LEU A 59 -4.816 3.776 -2.878 1.00 0.00 O ATOM 961 CB LEU A 59 -2.751 1.946 -1.014 1.00 0.00 C ATOM 962 CG LEU A 59 -2.342 0.747 -0.114 1.00 0.00 C ATOM 963 CD1 LEU A 59 -2.857 -0.589 -0.692 1.00 0.00 C ATOM 964 CD2 LEU A 59 -0.808 0.652 0.013 1.00 0.00 C ATOM 0 H LEU A 59 -5.104 0.972 -1.515 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.143 3.157 0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.763 1.584 -2.042 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.952 2.684 -0.945 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.789 0.921 0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.555 -1.408 -0.040 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.945 -0.561 -0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.436 -0.742 -1.686 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.547 -0.195 0.648 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.369 0.514 -0.975 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.422 1.570 0.456 1.00 0.00 H new ATOM 976 N GLY A 60 -3.515 4.998 -1.495 1.00 0.00 N ATOM 977 CA GLY A 60 -3.447 6.206 -2.357 1.00 0.00 C ATOM 978 C GLY A 60 -2.065 6.903 -2.310 1.00 0.00 C ATOM 979 O GLY A 60 -1.585 7.238 -1.218 1.00 0.00 O ATOM 0 H GLY A 60 -2.997 5.097 -0.622 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -3.672 5.925 -3.386 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -4.216 6.913 -2.044 1.00 0.00 H new ATOM 983 N ILE A 61 -1.428 7.146 -3.475 1.00 0.00 N ATOM 984 CA ILE A 61 -0.035 7.707 -3.530 1.00 0.00 C ATOM 985 C ILE A 61 -0.019 9.059 -4.328 1.00 0.00 C ATOM 986 O ILE A 61 -0.648 9.194 -5.384 1.00 0.00 O ATOM 987 CB ILE A 61 0.947 6.673 -4.218 1.00 0.00 C ATOM 988 CG1 ILE A 61 0.832 5.183 -3.755 1.00 0.00 C ATOM 989 CG2 ILE A 61 2.422 7.121 -4.032 1.00 0.00 C ATOM 990 CD1 ILE A 61 1.126 4.856 -2.282 1.00 0.00 C ATOM 0 H ILE A 61 -1.841 6.969 -4.391 1.00 0.00 H new ATOM 0 HA ILE A 61 0.299 7.893 -2.509 1.00 0.00 H new ATOM 0 HB ILE A 61 0.633 6.686 -5.262 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.180 4.843 -3.976 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.509 4.590 -4.369 1.00 0.00 H new ATOM 0 HG21 ILE A 61 3.084 6.400 -4.511 1.00 0.00 H new ATOM 0 HG22 ILE A 61 2.564 8.102 -4.486 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.654 7.177 -2.968 1.00 0.00 H new ATOM 0 HD11 ILE A 61 1.005 3.786 -2.116 1.00 0.00 H new ATOM 0 HD12 ILE A 61 2.149 5.147 -2.042 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.433 5.403 -1.643 1.00 0.00 H new ATOM 1002 N HIS A 62 0.787 10.029 -3.857 1.00 0.00 N ATOM 1003 CA HIS A 62 0.891 11.379 -4.479 1.00 0.00 C ATOM 1004 C HIS A 62 1.684 11.430 -5.826 1.00 0.00 C ATOM 1005 O HIS A 62 1.124 11.978 -6.778 1.00 0.00 O ATOM 1006 CB HIS A 62 1.529 12.313 -3.419 1.00 0.00 C ATOM 1007 CG HIS A 62 1.325 13.803 -3.682 1.00 0.00 C ATOM 1008 ND1 HIS A 62 0.184 14.495 -3.298 1.00 0.00 N ATOM 1009 CD2 HIS A 62 2.223 14.648 -4.355 1.00 0.00 C ATOM 1010 CE1 HIS A 62 0.510 15.734 -3.787 1.00 0.00 C ATOM 1011 NE2 HIS A 62 1.703 15.927 -4.432 1.00 0.00 N ATOM 0 H HIS A 62 1.385 9.908 -3.039 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.112 11.699 -4.762 1.00 0.00 H new ATOM 0 HB2 HIS A 62 1.113 12.069 -2.441 1.00 0.00 H new ATOM 0 HB3 HIS A 62 2.599 12.109 -3.370 1.00 0.00 H new ATOM 0 HD2 HIS A 62 3.179 14.343 -4.754 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.175 16.559 -3.663 1.00 0.00 H new ATOM 0 HE2 HIS A 62 2.095 16.771 -4.849 1.00 0.00 H new ATOM 1019 N GLY A 63 2.921 10.876 -5.923 1.00 0.00 N ATOM 1020 CA GLY A 63 3.774 10.896 -7.161 1.00 0.00 C ATOM 1021 C GLY A 63 3.117 10.943 -8.566 1.00 0.00 C ATOM 1022 O GLY A 63 3.454 11.799 -9.385 1.00 0.00 O ATOM 0 H GLY A 63 3.367 10.396 -5.141 1.00 0.00 H new ATOM 0 HA2 GLY A 63 4.433 11.761 -7.084 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.407 10.009 -7.131 1.00 0.00 H new ATOM 1026 N GLY A 64 2.203 9.999 -8.821 1.00 0.00 N ATOM 1027 CA GLY A 64 1.345 10.006 -10.039 1.00 0.00 C ATOM 1028 C GLY A 64 -0.188 9.985 -9.778 1.00 0.00 C ATOM 1029 O GLY A 64 -0.919 9.544 -10.664 1.00 0.00 O ATOM 0 H GLY A 64 2.029 9.208 -8.201 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.584 10.893 -10.625 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.604 9.141 -10.650 1.00 0.00 H new ATOM 1033 N LYS A 65 -0.689 10.455 -8.604 1.00 0.00 N ATOM 1034 CA LYS A 65 -2.139 10.421 -8.195 1.00 0.00 C ATOM 1035 C LYS A 65 -2.754 8.978 -8.368 1.00 0.00 C ATOM 1036 O LYS A 65 -3.706 8.754 -9.131 1.00 0.00 O ATOM 1037 CB LYS A 65 -2.880 11.560 -8.972 1.00 0.00 C ATOM 1038 CG LYS A 65 -4.083 12.219 -8.255 1.00 0.00 C ATOM 1039 CD LYS A 65 -5.349 11.338 -8.180 1.00 0.00 C ATOM 1040 CE LYS A 65 -6.603 12.015 -7.594 1.00 0.00 C ATOM 1041 NZ LYS A 65 -6.461 12.253 -6.130 1.00 0.00 N ATOM 0 H LYS A 65 -0.092 10.879 -7.894 1.00 0.00 H new ATOM 0 HA LYS A 65 -2.259 10.620 -7.130 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.155 12.339 -9.207 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.230 11.153 -9.921 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.783 12.487 -7.242 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.332 13.147 -8.770 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.585 10.987 -9.185 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.121 10.457 -7.580 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.777 12.963 -8.103 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -7.476 11.389 -7.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -7.123 12.999 -5.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -6.674 11.376 -5.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.487 12.551 -5.920 1.00 0.00 H new ATOM 1055 N MET A 66 -2.176 7.998 -7.645 1.00 0.00 N ATOM 1056 CA MET A 66 -2.480 6.566 -7.884 1.00 0.00 C ATOM 1057 C MET A 66 -3.405 5.905 -6.837 1.00 0.00 C ATOM 1058 O MET A 66 -3.206 6.014 -5.627 1.00 0.00 O ATOM 1059 CB MET A 66 -1.140 5.781 -7.952 1.00 0.00 C ATOM 1060 CG MET A 66 -0.304 6.003 -9.229 1.00 0.00 C ATOM 1061 SD MET A 66 1.089 4.861 -9.236 1.00 0.00 S ATOM 1062 CE MET A 66 0.396 3.419 -10.053 1.00 0.00 C ATOM 0 H MET A 66 -1.502 8.165 -6.897 1.00 0.00 H new ATOM 0 HA MET A 66 -3.033 6.527 -8.822 1.00 0.00 H new ATOM 0 HB2 MET A 66 -0.534 6.057 -7.089 1.00 0.00 H new ATOM 0 HB3 MET A 66 -1.358 4.717 -7.862 1.00 0.00 H new ATOM 0 HG2 MET A 66 -0.922 5.846 -10.113 1.00 0.00 H new ATOM 0 HG3 MET A 66 0.054 7.032 -9.268 1.00 0.00 H new ATOM 0 HE1 MET A 66 1.089 2.582 -9.964 1.00 0.00 H new ATOM 0 HE2 MET A 66 -0.552 3.156 -9.584 1.00 0.00 H new ATOM 0 HE3 MET A 66 0.230 3.643 -11.107 1.00 0.00 H new ATOM 1072 N CYS A 67 -4.418 5.204 -7.367 1.00 0.00 N ATOM 1073 CA CYS A 67 -5.294 4.304 -6.601 1.00 0.00 C ATOM 1074 C CYS A 67 -4.617 2.898 -6.670 1.00 0.00 C ATOM 1075 O CYS A 67 -4.429 2.324 -7.763 1.00 0.00 O ATOM 1076 CB CYS A 67 -6.708 4.328 -7.215 1.00 0.00 C ATOM 1077 SG CYS A 67 -7.778 3.059 -6.452 1.00 0.00 S ATOM 0 H CYS A 67 -4.656 5.247 -8.358 1.00 0.00 H new ATOM 0 HA CYS A 67 -5.415 4.599 -5.559 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -7.152 5.314 -7.076 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -6.644 4.156 -8.289 1.00 0.00 H new ATOM 0 HG CYS A 67 -8.472 3.596 -5.493 1.00 0.00 H new ATOM 1083 N LEU A 68 -4.213 2.411 -5.478 1.00 0.00 N ATOM 1084 CA LEU A 68 -3.511 1.114 -5.326 1.00 0.00 C ATOM 1085 C LEU A 68 -4.458 0.065 -4.636 1.00 0.00 C ATOM 1086 O LEU A 68 -5.052 0.267 -3.563 1.00 0.00 O ATOM 1087 CB LEU A 68 -2.177 1.326 -4.549 1.00 0.00 C ATOM 1088 CG LEU A 68 -0.868 1.237 -5.369 1.00 0.00 C ATOM 1089 CD1 LEU A 68 -0.707 2.392 -6.370 1.00 0.00 C ATOM 1090 CD2 LEU A 68 0.337 1.190 -4.419 1.00 0.00 C ATOM 0 H LEU A 68 -4.362 2.901 -4.596 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.253 0.711 -6.305 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.213 2.306 -4.073 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -2.128 0.586 -3.750 1.00 0.00 H new ATOM 0 HG LEU A 68 -0.919 0.320 -5.955 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.230 2.274 -6.915 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -1.539 2.382 -7.074 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.697 3.340 -5.833 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.257 1.127 -5.001 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.355 2.093 -3.809 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.257 0.316 -3.772 1.00 0.00 H new ATOM 1102 N SER A 69 -4.586 -1.059 -5.351 1.00 0.00 N ATOM 1103 CA SER A 69 -5.458 -2.222 -5.029 1.00 0.00 C ATOM 1104 C SER A 69 -4.755 -3.543 -5.482 1.00 0.00 C ATOM 1105 O SER A 69 -3.781 -3.557 -6.250 1.00 0.00 O ATOM 1106 CB SER A 69 -6.799 -1.977 -5.760 1.00 0.00 C ATOM 1107 OG SER A 69 -7.491 -0.876 -5.168 1.00 0.00 O ATOM 0 H SER A 69 -4.063 -1.201 -6.215 1.00 0.00 H new ATOM 0 HA SER A 69 -5.642 -2.325 -3.960 1.00 0.00 H new ATOM 0 HB2 SER A 69 -6.615 -1.775 -6.815 1.00 0.00 H new ATOM 0 HB3 SER A 69 -7.417 -2.873 -5.711 1.00 0.00 H new ATOM 0 HG SER A 69 -8.151 -0.525 -5.802 1.00 0.00 H new ATOM 1113 N CYS A 70 -5.265 -4.684 -5.001 1.00 0.00 N ATOM 1114 CA CYS A 70 -4.727 -6.018 -5.362 1.00 0.00 C ATOM 1115 C CYS A 70 -5.258 -6.488 -6.759 1.00 0.00 C ATOM 1116 O CYS A 70 -6.314 -7.108 -6.886 1.00 0.00 O ATOM 1117 CB CYS A 70 -5.122 -6.936 -4.196 1.00 0.00 C ATOM 1118 SG CYS A 70 -4.376 -8.582 -4.410 1.00 0.00 S ATOM 0 H CYS A 70 -6.055 -4.718 -4.356 1.00 0.00 H new ATOM 0 HA CYS A 70 -3.644 -6.020 -5.487 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -4.793 -6.500 -3.253 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -6.207 -7.025 -4.145 1.00 0.00 H new ATOM 0 HG CYS A 70 -3.120 -8.452 -4.719 1.00 0.00 H new ATOM 1124 N VAL A 71 -4.521 -6.151 -7.825 1.00 0.00 N ATOM 1125 CA VAL A 71 -4.929 -6.433 -9.234 1.00 0.00 C ATOM 1126 C VAL A 71 -4.223 -7.720 -9.790 1.00 0.00 C ATOM 1127 O VAL A 71 -3.125 -8.105 -9.365 1.00 0.00 O ATOM 1128 CB VAL A 71 -4.650 -5.113 -10.047 1.00 0.00 C ATOM 1129 CG1 VAL A 71 -3.166 -4.787 -10.317 1.00 0.00 C ATOM 1130 CG2 VAL A 71 -5.429 -5.006 -11.374 1.00 0.00 C ATOM 0 H VAL A 71 -3.622 -5.674 -7.750 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.988 -6.676 -9.320 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.025 -4.364 -9.350 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.095 -3.858 -10.883 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.640 -4.676 -9.369 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -2.714 -5.597 -10.890 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.178 -4.068 -11.869 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.161 -5.841 -12.022 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.500 -5.034 -11.171 1.00 0.00 H new ATOM 1140 N LYS A 72 -4.877 -8.412 -10.743 1.00 0.00 N ATOM 1141 CA LYS A 72 -4.306 -9.632 -11.379 1.00 0.00 C ATOM 1142 C LYS A 72 -3.405 -9.231 -12.601 1.00 0.00 C ATOM 1143 O LYS A 72 -3.886 -8.738 -13.627 1.00 0.00 O ATOM 1144 CB LYS A 72 -5.466 -10.617 -11.718 1.00 0.00 C ATOM 1145 CG LYS A 72 -6.529 -10.229 -12.790 1.00 0.00 C ATOM 1146 CD LYS A 72 -6.445 -11.043 -14.101 1.00 0.00 C ATOM 1147 CE LYS A 72 -6.980 -12.487 -13.989 1.00 0.00 C ATOM 1148 NZ LYS A 72 -6.660 -13.249 -15.224 1.00 0.00 N ATOM 0 H LYS A 72 -5.799 -8.154 -11.094 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.642 -10.163 -10.697 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.012 -11.555 -12.036 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.000 -10.820 -10.790 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -7.523 -10.357 -12.361 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -6.418 -9.171 -13.027 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.005 -10.520 -14.876 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -5.406 -11.078 -14.427 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -6.538 -12.980 -13.123 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -8.058 -12.472 -13.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -6.327 -14.200 -14.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.513 -13.328 -15.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -5.916 -12.753 -15.755 1.00 0.00 H new ATOM 1162 N SER A 73 -2.078 -9.403 -12.458 1.00 0.00 N ATOM 1163 CA SER A 73 -1.084 -9.091 -13.525 1.00 0.00 C ATOM 1164 C SER A 73 -0.978 -10.311 -14.494 1.00 0.00 C ATOM 1165 O SER A 73 -0.131 -11.197 -14.330 1.00 0.00 O ATOM 1166 CB SER A 73 0.240 -8.745 -12.802 1.00 0.00 C ATOM 1167 OG SER A 73 1.282 -8.488 -13.740 1.00 0.00 O ATOM 0 H SER A 73 -1.655 -9.762 -11.602 1.00 0.00 H new ATOM 0 HA SER A 73 -1.368 -8.242 -14.147 1.00 0.00 H new ATOM 0 HB2 SER A 73 0.094 -7.871 -12.167 1.00 0.00 H new ATOM 0 HB3 SER A 73 0.528 -9.569 -12.149 1.00 0.00 H new ATOM 0 HG SER A 73 2.108 -8.270 -13.260 1.00 0.00 H new ATOM 1173 N GLY A 74 -1.859 -10.353 -15.515 1.00 0.00 N ATOM 1174 CA GLY A 74 -2.001 -11.552 -16.393 1.00 0.00 C ATOM 1175 C GLY A 74 -3.017 -12.514 -15.736 1.00 0.00 C ATOM 1176 O GLY A 74 -4.175 -12.590 -16.152 1.00 0.00 O ATOM 0 H GLY A 74 -2.481 -9.582 -15.757 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.343 -11.258 -17.385 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.038 -12.046 -16.521 1.00 0.00 H new ATOM 1180 N ASP A 75 -2.550 -13.223 -14.697 1.00 0.00 N ATOM 1181 CA ASP A 75 -3.410 -14.043 -13.793 1.00 0.00 C ATOM 1182 C ASP A 75 -2.899 -14.027 -12.297 1.00 0.00 C ATOM 1183 O ASP A 75 -3.733 -14.165 -11.395 1.00 0.00 O ATOM 1184 CB ASP A 75 -3.586 -15.476 -14.374 1.00 0.00 C ATOM 1185 CG ASP A 75 -4.951 -16.081 -14.030 1.00 0.00 C ATOM 1186 OD1 ASP A 75 -5.957 -15.674 -14.656 1.00 0.00 O ATOM 1187 OD2 ASP A 75 -5.032 -16.927 -13.119 1.00 0.00 O ATOM 0 H ASP A 75 -1.561 -13.252 -14.449 1.00 0.00 H new ATOM 0 HA ASP A 75 -4.400 -13.588 -13.752 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -3.469 -15.443 -15.457 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -2.797 -16.122 -13.987 1.00 0.00 H new ATOM 1192 N GLU A 76 -1.604 -13.758 -11.989 1.00 0.00 N ATOM 1193 CA GLU A 76 -1.085 -13.710 -10.592 1.00 0.00 C ATOM 1194 C GLU A 76 -1.533 -12.380 -9.882 1.00 0.00 C ATOM 1195 O GLU A 76 -1.462 -11.270 -10.418 1.00 0.00 O ATOM 1196 CB GLU A 76 0.461 -13.914 -10.624 1.00 0.00 C ATOM 1197 CG GLU A 76 1.374 -12.865 -11.328 1.00 0.00 C ATOM 1198 CD GLU A 76 2.125 -11.910 -10.414 1.00 0.00 C ATOM 1199 OE1 GLU A 76 1.585 -10.841 -10.082 1.00 0.00 O ATOM 1200 OE2 GLU A 76 3.290 -12.181 -10.058 1.00 0.00 O ATOM 0 H GLU A 76 -0.892 -13.569 -12.695 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.508 -14.517 -9.994 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.798 -13.995 -9.591 1.00 0.00 H new ATOM 0 HB3 GLU A 76 0.651 -14.877 -11.097 1.00 0.00 H new ATOM 0 HG2 GLU A 76 2.102 -13.399 -11.939 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.758 -12.276 -12.008 1.00 0.00 H new ATOM 1207 N THR A 77 -2.104 -12.539 -8.679 1.00 0.00 N ATOM 1208 CA THR A 77 -2.711 -11.423 -7.896 1.00 0.00 C ATOM 1209 C THR A 77 -1.657 -10.670 -7.028 1.00 0.00 C ATOM 1210 O THR A 77 -1.073 -11.255 -6.116 1.00 0.00 O ATOM 1211 CB THR A 77 -3.870 -12.087 -7.089 1.00 0.00 C ATOM 1212 OG1 THR A 77 -4.861 -12.538 -8.009 1.00 0.00 O ATOM 1213 CG2 THR A 77 -4.582 -11.152 -6.111 1.00 0.00 C ATOM 0 H THR A 77 -2.164 -13.443 -8.210 1.00 0.00 H new ATOM 0 HA THR A 77 -3.103 -10.627 -8.529 1.00 0.00 H new ATOM 0 HB THR A 77 -3.407 -12.886 -6.510 1.00 0.00 H new ATOM 0 HG1 THR A 77 -5.087 -13.472 -7.815 1.00 0.00 H new ATOM 0 HG21 THR A 77 -5.372 -11.698 -5.595 1.00 0.00 H new ATOM 0 HG22 THR A 77 -3.865 -10.774 -5.382 1.00 0.00 H new ATOM 0 HG23 THR A 77 -5.017 -10.316 -6.658 1.00 0.00 H new ATOM 1221 N ARG A 78 -1.452 -9.363 -7.286 1.00 0.00 N ATOM 1222 CA ARG A 78 -0.436 -8.547 -6.560 1.00 0.00 C ATOM 1223 C ARG A 78 -0.868 -7.066 -6.301 1.00 0.00 C ATOM 1224 O ARG A 78 -1.785 -6.521 -6.924 1.00 0.00 O ATOM 1225 CB ARG A 78 0.896 -8.603 -7.368 1.00 0.00 C ATOM 1226 CG ARG A 78 0.954 -7.902 -8.759 1.00 0.00 C ATOM 1227 CD ARG A 78 2.380 -7.582 -9.254 1.00 0.00 C ATOM 1228 NE ARG A 78 3.161 -8.842 -9.405 1.00 0.00 N ATOM 1229 CZ ARG A 78 4.332 -9.118 -8.838 1.00 0.00 C ATOM 1230 NH1 ARG A 78 5.060 -8.233 -8.210 1.00 0.00 N ATOM 1231 NH2 ARG A 78 4.776 -10.336 -8.904 1.00 0.00 N ATOM 0 H ARG A 78 -1.973 -8.842 -7.991 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.314 -8.978 -5.566 1.00 0.00 H new ATOM 0 HB2 ARG A 78 1.679 -8.170 -6.746 1.00 0.00 H new ATOM 0 HB3 ARG A 78 1.150 -9.653 -7.515 1.00 0.00 H new ATOM 0 HG2 ARG A 78 0.462 -8.539 -9.494 1.00 0.00 H new ATOM 0 HG3 ARG A 78 0.384 -6.975 -8.709 1.00 0.00 H new ATOM 0 HD2 ARG A 78 2.333 -7.057 -10.208 1.00 0.00 H new ATOM 0 HD3 ARG A 78 2.878 -6.918 -8.548 1.00 0.00 H new ATOM 0 HE ARG A 78 2.758 -9.564 -10.002 1.00 0.00 H new ATOM 0 HH11 ARG A 78 4.737 -7.268 -8.134 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.951 -8.507 -7.795 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.230 -11.053 -9.382 1.00 0.00 H new ATOM 0 HH22 ARG A 78 5.671 -10.576 -8.478 1.00 0.00 H new ATOM 1245 N LEU A 79 -0.143 -6.392 -5.386 1.00 0.00 N ATOM 1246 CA LEU A 79 -0.392 -4.967 -5.037 1.00 0.00 C ATOM 1247 C LEU A 79 0.159 -4.009 -6.147 1.00 0.00 C ATOM 1248 O LEU A 79 1.370 -3.841 -6.326 1.00 0.00 O ATOM 1249 CB LEU A 79 0.284 -4.670 -3.667 1.00 0.00 C ATOM 1250 CG LEU A 79 -0.451 -3.639 -2.768 1.00 0.00 C ATOM 1251 CD1 LEU A 79 -1.776 -4.189 -2.201 1.00 0.00 C ATOM 1252 CD2 LEU A 79 0.445 -3.211 -1.593 1.00 0.00 C ATOM 0 H LEU A 79 0.629 -6.811 -4.867 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.466 -4.792 -4.966 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.375 -5.606 -3.116 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.296 -4.309 -3.852 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.678 -2.784 -3.405 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.249 -3.429 -1.580 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.442 -4.452 -3.023 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.574 -5.075 -1.599 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.087 -2.488 -0.974 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.700 -4.084 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.358 -2.756 -1.978 1.00 0.00 H new ATOM 1264 N GLN A 80 -0.763 -3.443 -6.927 1.00 0.00 N ATOM 1265 CA GLN A 80 -0.456 -2.495 -8.036 1.00 0.00 C ATOM 1266 C GLN A 80 -1.753 -1.649 -8.290 1.00 0.00 C ATOM 1267 O GLN A 80 -2.293 -1.065 -7.355 1.00 0.00 O ATOM 1268 CB GLN A 80 0.176 -3.315 -9.226 1.00 0.00 C ATOM 1269 CG GLN A 80 0.766 -2.529 -10.428 1.00 0.00 C ATOM 1270 CD GLN A 80 1.893 -1.550 -10.083 1.00 0.00 C ATOM 1271 OE1 GLN A 80 3.018 -1.932 -9.778 1.00 0.00 O ATOM 1272 NE2 GLN A 80 1.633 -0.267 -10.131 1.00 0.00 N ATOM 0 H GLN A 80 -1.761 -3.623 -6.817 1.00 0.00 H new ATOM 0 HA GLN A 80 0.310 -1.748 -7.827 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.969 -3.940 -8.815 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -0.591 -3.986 -9.612 1.00 0.00 H new ATOM 0 HG2 GLN A 80 1.141 -3.245 -11.160 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -0.040 -1.974 -10.908 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.699 0.055 -10.384 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.365 0.410 -9.915 1.00 0.00 H new ATOM 1281 N LEU A 81 -2.257 -1.621 -9.526 1.00 0.00 N ATOM 1282 CA LEU A 81 -3.432 -0.833 -10.044 1.00 0.00 C ATOM 1283 C LEU A 81 -2.829 0.423 -10.770 1.00 0.00 C ATOM 1284 O LEU A 81 -1.875 0.254 -11.545 1.00 0.00 O ATOM 1285 CB LEU A 81 -4.602 -0.671 -9.004 1.00 0.00 C ATOM 1286 CG LEU A 81 -6.082 -0.459 -9.456 1.00 0.00 C ATOM 1287 CD1 LEU A 81 -6.412 0.839 -10.210 1.00 0.00 C ATOM 1288 CD2 LEU A 81 -6.643 -1.658 -10.238 1.00 0.00 C ATOM 0 H LEU A 81 -1.838 -2.184 -10.266 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.016 -1.360 -10.798 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.589 -1.560 -8.374 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -4.343 0.175 -8.367 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.582 -0.363 -8.492 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -7.472 0.854 -10.462 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.177 1.696 -9.579 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.821 0.889 -11.124 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -7.674 -1.454 -10.526 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -6.042 -1.822 -11.132 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.611 -2.549 -9.611 1.00 0.00 H new ATOM 1300 N GLU A 82 -3.422 1.626 -10.673 1.00 0.00 N ATOM 1301 CA GLU A 82 -2.999 2.781 -11.559 1.00 0.00 C ATOM 1302 C GLU A 82 -3.459 4.227 -11.125 1.00 0.00 C ATOM 1303 O GLU A 82 -4.062 4.437 -10.072 1.00 0.00 O ATOM 1304 CB GLU A 82 -3.466 2.463 -13.039 1.00 0.00 C ATOM 1305 CG GLU A 82 -2.313 2.427 -14.086 1.00 0.00 C ATOM 1306 CD GLU A 82 -1.433 3.669 -14.192 1.00 0.00 C ATOM 1307 OE1 GLU A 82 -1.955 4.739 -14.559 1.00 0.00 O ATOM 1308 OE2 GLU A 82 -0.232 3.594 -13.857 1.00 0.00 O ATOM 0 H GLU A 82 -4.174 1.844 -10.019 1.00 0.00 H new ATOM 0 HA GLU A 82 -1.915 2.839 -11.465 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.977 1.500 -13.046 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.195 3.213 -13.346 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -1.672 1.577 -13.854 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -2.751 2.238 -15.066 1.00 0.00 H new ATOM 1315 N ALA A 83 -3.154 5.244 -11.969 1.00 0.00 N ATOM 1316 CA ALA A 83 -3.521 6.668 -11.762 1.00 0.00 C ATOM 1317 C ALA A 83 -5.037 6.919 -12.037 1.00 0.00 C ATOM 1318 O ALA A 83 -5.541 6.622 -13.125 1.00 0.00 O ATOM 1319 CB ALA A 83 -2.630 7.485 -12.716 1.00 0.00 C ATOM 0 H ALA A 83 -2.634 5.093 -12.833 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.360 6.965 -10.726 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.857 8.546 -12.607 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.582 7.311 -12.473 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -2.820 7.177 -13.744 1.00 0.00 H new ATOM 1325 N VAL A 84 -5.779 7.422 -11.026 1.00 0.00 N ATOM 1326 CA VAL A 84 -7.263 7.614 -11.155 1.00 0.00 C ATOM 1327 C VAL A 84 -7.663 8.971 -10.490 1.00 0.00 C ATOM 1328 O VAL A 84 -7.398 9.235 -9.312 1.00 0.00 O ATOM 1329 CB VAL A 84 -8.078 6.435 -10.502 1.00 0.00 C ATOM 1330 CG1 VAL A 84 -9.607 6.521 -10.748 1.00 0.00 C ATOM 1331 CG2 VAL A 84 -7.663 5.010 -10.949 1.00 0.00 C ATOM 0 H VAL A 84 -5.395 7.701 -10.123 1.00 0.00 H new ATOM 0 HA VAL A 84 -7.509 7.624 -12.217 1.00 0.00 H new ATOM 0 HB VAL A 84 -7.833 6.576 -9.449 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -10.101 5.676 -10.269 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -9.991 7.451 -10.329 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -9.805 6.497 -11.820 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -8.286 4.274 -10.441 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -7.794 4.914 -12.027 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -6.617 4.839 -10.694 1.00 0.00 H new ATOM 1341 N ASN A 85 -8.391 9.799 -11.249 1.00 0.00 N ATOM 1342 CA ASN A 85 -8.894 11.136 -10.792 1.00 0.00 C ATOM 1343 C ASN A 85 -10.274 11.126 -10.019 1.00 0.00 C ATOM 1344 O ASN A 85 -11.035 12.088 -10.126 1.00 0.00 O ATOM 1345 CB ASN A 85 -8.940 12.025 -12.076 1.00 0.00 C ATOM 1346 CG ASN A 85 -9.887 11.612 -13.222 1.00 0.00 C ATOM 1347 OD1 ASN A 85 -9.509 10.884 -14.133 1.00 0.00 O ATOM 1348 ND2 ASN A 85 -11.129 12.030 -13.203 1.00 0.00 N ATOM 0 H ASN A 85 -8.659 9.575 -12.207 1.00 0.00 H new ATOM 0 HA ASN A 85 -8.219 11.528 -10.032 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -9.210 13.036 -11.770 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.930 12.074 -12.482 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -11.773 11.749 -13.943 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -11.452 12.636 -12.449 1.00 0.00 H new ATOM 1355 N ILE A 86 -10.555 10.071 -9.227 1.00 0.00 N ATOM 1356 CA ILE A 86 -11.821 9.818 -8.452 1.00 0.00 C ATOM 1357 C ILE A 86 -13.159 10.063 -9.266 1.00 0.00 C ATOM 1358 O ILE A 86 -13.576 11.184 -9.566 1.00 0.00 O ATOM 1359 CB ILE A 86 -11.727 10.521 -7.042 1.00 0.00 C ATOM 1360 CG1 ILE A 86 -12.617 9.768 -6.001 1.00 0.00 C ATOM 1361 CG2 ILE A 86 -12.039 12.041 -7.024 1.00 0.00 C ATOM 1362 CD1 ILE A 86 -14.152 9.930 -6.013 1.00 0.00 C ATOM 0 H ILE A 86 -9.877 9.321 -9.093 1.00 0.00 H new ATOM 0 HA ILE A 86 -11.899 8.747 -8.264 1.00 0.00 H new ATOM 0 HB ILE A 86 -10.674 10.455 -6.768 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -12.406 8.704 -6.109 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -12.271 10.063 -5.010 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -11.945 12.420 -6.006 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -11.337 12.564 -7.673 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -13.055 12.208 -7.380 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -14.588 9.328 -5.215 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -14.408 10.978 -5.859 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -14.545 9.598 -6.974 1.00 0.00 H new ATOM 1374 N THR A 87 -13.812 8.952 -9.645 1.00 0.00 N ATOM 1375 CA THR A 87 -15.116 8.968 -10.397 1.00 0.00 C ATOM 1376 C THR A 87 -15.991 7.670 -10.214 1.00 0.00 C ATOM 1377 O THR A 87 -17.209 7.780 -10.370 1.00 0.00 O ATOM 1378 CB THR A 87 -14.861 9.255 -11.920 1.00 0.00 C ATOM 1379 OG1 THR A 87 -16.113 9.431 -12.574 1.00 0.00 O ATOM 1380 CG2 THR A 87 -14.113 8.167 -12.717 1.00 0.00 C ATOM 0 H THR A 87 -13.468 8.012 -9.449 1.00 0.00 H new ATOM 0 HA THR A 87 -15.703 9.775 -9.958 1.00 0.00 H new ATOM 0 HB THR A 87 -14.219 10.136 -11.912 1.00 0.00 H new ATOM 0 HG1 THR A 87 -15.963 9.612 -13.525 1.00 0.00 H new ATOM 0 HG21 THR A 87 -14.001 8.487 -13.753 1.00 0.00 H new ATOM 0 HG22 THR A 87 -13.128 8.007 -12.278 1.00 0.00 H new ATOM 0 HG23 THR A 87 -14.680 7.237 -12.684 1.00 0.00 H new ATOM 1388 N ASP A 88 -15.432 6.486 -9.884 1.00 0.00 N ATOM 1389 CA ASP A 88 -16.215 5.238 -9.632 1.00 0.00 C ATOM 1390 C ASP A 88 -15.531 4.428 -8.472 1.00 0.00 C ATOM 1391 O ASP A 88 -15.044 3.305 -8.640 1.00 0.00 O ATOM 1392 CB ASP A 88 -16.332 4.463 -10.976 1.00 0.00 C ATOM 1393 CG ASP A 88 -17.244 3.233 -10.932 1.00 0.00 C ATOM 1394 OD1 ASP A 88 -18.340 3.308 -10.335 1.00 0.00 O ATOM 1395 OD2 ASP A 88 -16.869 2.191 -11.510 1.00 0.00 O ATOM 0 H ASP A 88 -14.425 6.359 -9.783 1.00 0.00 H new ATOM 0 HA ASP A 88 -17.231 5.443 -9.294 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -16.702 5.145 -11.741 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -15.335 4.148 -11.285 1.00 0.00 H new ATOM 1400 N LEU A 89 -15.518 5.009 -7.258 1.00 0.00 N ATOM 1401 CA LEU A 89 -14.878 4.389 -6.068 1.00 0.00 C ATOM 1402 C LEU A 89 -15.960 4.042 -4.993 1.00 0.00 C ATOM 1403 O LEU A 89 -16.265 4.829 -4.092 1.00 0.00 O ATOM 1404 CB LEU A 89 -13.793 5.380 -5.556 1.00 0.00 C ATOM 1405 CG LEU A 89 -12.404 5.445 -6.267 1.00 0.00 C ATOM 1406 CD1 LEU A 89 -11.675 4.096 -6.413 1.00 0.00 C ATOM 1407 CD2 LEU A 89 -12.463 6.113 -7.647 1.00 0.00 C ATOM 0 H LEU A 89 -15.946 5.915 -7.068 1.00 0.00 H new ATOM 0 HA LEU A 89 -14.395 3.443 -6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -14.224 6.381 -5.592 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -13.611 5.149 -4.507 1.00 0.00 H new ATOM 0 HG LEU A 89 -11.824 6.060 -5.579 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -10.722 4.250 -6.919 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -11.497 3.670 -5.426 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -12.290 3.412 -6.998 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -11.466 6.127 -8.088 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -13.138 5.553 -8.294 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -12.827 7.135 -7.541 1.00 0.00 H new ATOM 1419 N SER A 90 -16.500 2.814 -5.068 1.00 0.00 N ATOM 1420 CA SER A 90 -17.578 2.336 -4.161 1.00 0.00 C ATOM 1421 C SER A 90 -17.063 1.817 -2.777 1.00 0.00 C ATOM 1422 O SER A 90 -16.296 0.852 -2.723 1.00 0.00 O ATOM 1423 CB SER A 90 -18.332 1.227 -4.945 1.00 0.00 C ATOM 1424 OG SER A 90 -17.519 0.078 -5.227 1.00 0.00 O ATOM 0 H SER A 90 -16.208 2.119 -5.755 1.00 0.00 H new ATOM 0 HA SER A 90 -18.231 3.168 -3.897 1.00 0.00 H new ATOM 0 HB2 SER A 90 -19.204 0.914 -4.370 1.00 0.00 H new ATOM 0 HB3 SER A 90 -18.701 1.642 -5.883 1.00 0.00 H new ATOM 0 HG SER A 90 -18.048 -0.584 -5.719 1.00 0.00 H new ATOM 1430 N GLU A 91 -17.508 2.409 -1.649 1.00 0.00 N ATOM 1431 CA GLU A 91 -17.118 1.941 -0.285 1.00 0.00 C ATOM 1432 C GLU A 91 -17.968 0.688 0.100 1.00 0.00 C ATOM 1433 O GLU A 91 -19.123 0.783 0.534 1.00 0.00 O ATOM 1434 CB GLU A 91 -17.330 3.060 0.769 1.00 0.00 C ATOM 1435 CG GLU A 91 -16.236 4.149 0.820 1.00 0.00 C ATOM 1436 CD GLU A 91 -16.436 5.165 1.934 1.00 0.00 C ATOM 1437 OE1 GLU A 91 -16.284 4.781 3.118 1.00 0.00 O ATOM 1438 OE2 GLU A 91 -16.743 6.339 1.638 1.00 0.00 O ATOM 0 H GLU A 91 -18.137 3.212 -1.647 1.00 0.00 H new ATOM 0 HA GLU A 91 -16.060 1.680 -0.299 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -18.288 3.542 0.572 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -17.402 2.597 1.753 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -15.265 3.670 0.947 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -16.211 4.672 -0.136 1.00 0.00 H new ATOM 1445 N ASN A 92 -17.371 -0.503 -0.050 1.00 0.00 N ATOM 1446 CA ASN A 92 -18.069 -1.779 0.232 1.00 0.00 C ATOM 1447 C ASN A 92 -17.782 -2.225 1.701 1.00 0.00 C ATOM 1448 O ASN A 92 -16.793 -2.902 1.992 1.00 0.00 O ATOM 1449 CB ASN A 92 -17.603 -2.770 -0.866 1.00 0.00 C ATOM 1450 CG ASN A 92 -18.483 -4.005 -1.063 1.00 0.00 C ATOM 1451 OD1 ASN A 92 -19.613 -4.109 -0.595 1.00 0.00 O ATOM 1452 ND2 ASN A 92 -18.020 -4.951 -1.835 1.00 0.00 N ATOM 0 H ASN A 92 -16.407 -0.616 -0.364 1.00 0.00 H new ATOM 0 HA ASN A 92 -19.156 -1.707 0.184 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -17.545 -2.233 -1.813 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.593 -3.101 -0.625 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -18.596 -5.766 -2.044 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -17.082 -4.874 -2.229 1.00 0.00 H new ATOM 1459 N ARG A 93 -18.701 -1.867 2.615 1.00 0.00 N ATOM 1460 CA ARG A 93 -18.561 -2.167 4.076 1.00 0.00 C ATOM 1461 C ARG A 93 -18.882 -3.660 4.437 1.00 0.00 C ATOM 1462 O ARG A 93 -18.187 -4.221 5.288 1.00 0.00 O ATOM 1463 CB ARG A 93 -19.448 -1.118 4.827 1.00 0.00 C ATOM 1464 CG ARG A 93 -18.796 0.257 5.189 1.00 0.00 C ATOM 1465 CD ARG A 93 -17.898 0.912 4.113 1.00 0.00 C ATOM 1466 NE ARG A 93 -17.154 2.133 4.544 1.00 0.00 N ATOM 1467 CZ ARG A 93 -15.944 2.117 5.104 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -15.470 1.128 5.823 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -15.180 3.153 4.919 1.00 0.00 N ATOM 0 H ARG A 93 -19.558 -1.366 2.379 1.00 0.00 H new ATOM 0 HA ARG A 93 -17.523 -2.070 4.395 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -20.327 -0.921 4.214 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -19.800 -1.576 5.751 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -19.595 0.956 5.436 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -18.200 0.122 6.092 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -17.176 0.172 3.770 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -18.520 1.172 3.256 1.00 0.00 H new ATOM 0 HE ARG A 93 -17.601 3.039 4.401 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -16.039 0.297 5.986 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -14.532 1.189 6.219 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -15.514 3.940 4.362 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -14.247 3.179 5.331 1.00 0.00 H new ATOM 1483 N LYS A 94 -19.860 -4.346 3.804 1.00 0.00 N ATOM 1484 CA LYS A 94 -20.109 -5.803 4.049 1.00 0.00 C ATOM 1485 C LYS A 94 -19.145 -6.707 3.174 1.00 0.00 C ATOM 1486 O LYS A 94 -19.577 -7.485 2.321 1.00 0.00 O ATOM 1487 CB LYS A 94 -21.647 -6.043 3.869 1.00 0.00 C ATOM 1488 CG LYS A 94 -22.313 -6.205 2.472 1.00 0.00 C ATOM 1489 CD LYS A 94 -22.049 -5.079 1.452 1.00 0.00 C ATOM 1490 CE LYS A 94 -22.673 -5.374 0.076 1.00 0.00 C ATOM 1491 NZ LYS A 94 -22.335 -4.277 -0.868 1.00 0.00 N ATOM 0 H LYS A 94 -20.492 -3.926 3.122 1.00 0.00 H new ATOM 0 HA LYS A 94 -19.856 -6.107 5.065 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -21.890 -6.942 4.436 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -22.151 -5.211 4.360 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -21.973 -7.145 2.038 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -23.390 -6.291 2.615 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -22.452 -4.142 1.837 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -20.974 -4.941 1.338 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -22.302 -6.325 -0.307 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -23.755 -5.468 0.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -22.608 -4.553 -1.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -22.849 -3.414 -0.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -21.312 -4.095 -0.836 1.00 0.00 H new ATOM 1505 N GLN A 95 -17.829 -6.606 3.475 1.00 0.00 N ATOM 1506 CA GLN A 95 -16.673 -7.301 2.815 1.00 0.00 C ATOM 1507 C GLN A 95 -16.562 -7.143 1.248 1.00 0.00 C ATOM 1508 O GLN A 95 -17.534 -7.246 0.495 1.00 0.00 O ATOM 1509 CB GLN A 95 -16.582 -8.795 3.280 1.00 0.00 C ATOM 1510 CG GLN A 95 -17.671 -9.863 2.975 1.00 0.00 C ATOM 1511 CD GLN A 95 -17.808 -10.333 1.521 1.00 0.00 C ATOM 1512 OE1 GLN A 95 -16.999 -11.087 0.985 1.00 0.00 O ATOM 1513 NE2 GLN A 95 -18.855 -9.931 0.844 1.00 0.00 N ATOM 0 H GLN A 95 -17.514 -6.000 4.233 1.00 0.00 H new ATOM 0 HA GLN A 95 -15.792 -6.765 3.167 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -15.649 -9.185 2.874 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -16.472 -8.771 4.364 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -17.469 -10.737 3.594 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -18.634 -9.463 3.292 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -19.533 -9.305 1.278 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -18.992 -10.244 -0.117 1.00 0.00 H new ATOM 1522 N ASP A 96 -15.330 -6.885 0.762 1.00 0.00 N ATOM 1523 CA ASP A 96 -15.031 -6.766 -0.698 1.00 0.00 C ATOM 1524 C ASP A 96 -14.213 -8.023 -1.196 1.00 0.00 C ATOM 1525 O ASP A 96 -14.272 -9.084 -0.562 1.00 0.00 O ATOM 1526 CB ASP A 96 -14.368 -5.369 -0.863 1.00 0.00 C ATOM 1527 CG ASP A 96 -14.429 -4.823 -2.282 1.00 0.00 C ATOM 1528 OD1 ASP A 96 -15.471 -4.274 -2.698 1.00 0.00 O ATOM 1529 OD2 ASP A 96 -13.412 -4.893 -2.996 1.00 0.00 O ATOM 0 H ASP A 96 -14.513 -6.753 1.358 1.00 0.00 H new ATOM 0 HA ASP A 96 -15.904 -6.793 -1.350 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -14.857 -4.664 -0.191 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -13.325 -5.434 -0.553 1.00 0.00 H new ATOM 1534 N LYS A 97 -13.515 -7.970 -2.355 1.00 0.00 N ATOM 1535 CA LYS A 97 -12.793 -9.165 -2.902 1.00 0.00 C ATOM 1536 C LYS A 97 -11.294 -8.846 -3.245 1.00 0.00 C ATOM 1537 O LYS A 97 -10.456 -8.867 -2.339 1.00 0.00 O ATOM 1538 CB LYS A 97 -13.632 -9.750 -4.096 1.00 0.00 C ATOM 1539 CG LYS A 97 -15.060 -10.292 -3.821 1.00 0.00 C ATOM 1540 CD LYS A 97 -15.130 -11.440 -2.788 1.00 0.00 C ATOM 1541 CE LYS A 97 -16.564 -11.944 -2.541 1.00 0.00 C ATOM 1542 NZ LYS A 97 -16.621 -12.689 -1.252 1.00 0.00 N ATOM 0 H LYS A 97 -13.431 -7.131 -2.929 1.00 0.00 H new ATOM 0 HA LYS A 97 -12.718 -9.943 -2.142 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -13.717 -8.969 -4.852 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -13.053 -10.560 -4.539 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -15.685 -9.470 -3.472 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.488 -10.641 -4.761 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -14.514 -12.270 -3.134 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -14.704 -11.098 -1.845 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -17.256 -11.102 -2.516 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -16.878 -12.591 -3.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -17.519 -13.211 -1.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -15.827 -13.359 -1.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -16.557 -12.018 -0.460 1.00 0.00 H new ATOM 1556 N ARG A 98 -10.921 -8.590 -4.516 1.00 0.00 N ATOM 1557 CA ARG A 98 -9.499 -8.388 -4.926 1.00 0.00 C ATOM 1558 C ARG A 98 -9.091 -6.871 -4.925 1.00 0.00 C ATOM 1559 O ARG A 98 -8.781 -6.294 -5.969 1.00 0.00 O ATOM 1560 CB ARG A 98 -9.366 -9.099 -6.317 1.00 0.00 C ATOM 1561 CG ARG A 98 -8.018 -9.826 -6.558 1.00 0.00 C ATOM 1562 CD ARG A 98 -7.682 -10.123 -8.039 1.00 0.00 C ATOM 1563 NE ARG A 98 -8.664 -11.028 -8.709 1.00 0.00 N ATOM 1564 CZ ARG A 98 -8.636 -12.363 -8.704 1.00 0.00 C ATOM 1565 NH1 ARG A 98 -7.660 -13.075 -8.200 1.00 0.00 N ATOM 1566 NH2 ARG A 98 -9.637 -13.001 -9.238 1.00 0.00 N ATOM 0 H ARG A 98 -11.584 -8.516 -5.288 1.00 0.00 H new ATOM 0 HA ARG A 98 -8.795 -8.825 -4.217 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -10.174 -9.823 -6.416 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -9.506 -8.356 -7.102 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.217 -9.220 -6.135 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.029 -10.768 -6.009 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -7.636 -9.182 -8.587 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -6.691 -10.573 -8.094 1.00 0.00 H new ATOM 0 HE ARG A 98 -9.428 -10.584 -9.218 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -6.856 -12.611 -7.777 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.704 -14.094 -8.230 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -10.414 -12.481 -9.645 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -9.644 -14.021 -9.249 1.00 0.00 H new ATOM 1580 N PHE A 99 -9.067 -6.220 -3.743 1.00 0.00 N ATOM 1581 CA PHE A 99 -8.760 -4.756 -3.634 1.00 0.00 C ATOM 1582 C PHE A 99 -8.132 -4.269 -2.289 1.00 0.00 C ATOM 1583 O PHE A 99 -7.549 -3.181 -2.342 1.00 0.00 O ATOM 1584 CB PHE A 99 -10.087 -3.947 -3.855 1.00 0.00 C ATOM 1585 CG PHE A 99 -10.683 -3.853 -5.277 1.00 0.00 C ATOM 1586 CD1 PHE A 99 -10.338 -2.795 -6.125 1.00 0.00 C ATOM 1587 CD2 PHE A 99 -11.654 -4.770 -5.697 1.00 0.00 C ATOM 1588 CE1 PHE A 99 -10.922 -2.677 -7.384 1.00 0.00 C ATOM 1589 CE2 PHE A 99 -12.241 -4.652 -6.954 1.00 0.00 C ATOM 1590 CZ PHE A 99 -11.872 -3.607 -7.798 1.00 0.00 C ATOM 0 H PHE A 99 -9.254 -6.672 -2.848 1.00 0.00 H new ATOM 0 HA PHE A 99 -7.999 -4.581 -4.394 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -10.849 -4.382 -3.208 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -9.914 -2.930 -3.504 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -9.613 -2.064 -5.801 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -11.950 -5.575 -5.041 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -10.638 -1.866 -8.038 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -12.982 -5.370 -7.274 1.00 0.00 H new ATOM 0 HZ PHE A 99 -12.324 -3.518 -8.775 1.00 0.00 H new ATOM 1600 N ALA A 100 -8.227 -4.934 -1.113 1.00 0.00 N ATOM 1601 CA ALA A 100 -7.685 -4.355 0.144 1.00 0.00 C ATOM 1602 C ALA A 100 -6.322 -4.971 0.562 1.00 0.00 C ATOM 1603 O ALA A 100 -5.926 -6.059 0.129 1.00 0.00 O ATOM 1604 CB ALA A 100 -8.772 -4.590 1.217 1.00 0.00 C ATOM 0 H ALA A 100 -8.663 -5.850 -1.006 1.00 0.00 H new ATOM 0 HA ALA A 100 -7.470 -3.295 0.011 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -8.435 -4.185 2.171 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -9.694 -4.091 0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -8.956 -5.659 1.321 1.00 0.00 H new ATOM 1610 N PHE A 101 -5.592 -4.249 1.424 1.00 0.00 N ATOM 1611 CA PHE A 101 -4.342 -4.765 2.036 1.00 0.00 C ATOM 1612 C PHE A 101 -4.578 -4.824 3.576 1.00 0.00 C ATOM 1613 O PHE A 101 -5.058 -3.848 4.167 1.00 0.00 O ATOM 1614 CB PHE A 101 -3.103 -3.928 1.564 1.00 0.00 C ATOM 1615 CG PHE A 101 -2.201 -3.184 2.573 1.00 0.00 C ATOM 1616 CD1 PHE A 101 -1.344 -3.912 3.402 1.00 0.00 C ATOM 1617 CD2 PHE A 101 -2.191 -1.788 2.642 1.00 0.00 C ATOM 1618 CE1 PHE A 101 -0.495 -3.254 4.289 1.00 0.00 C ATOM 1619 CE2 PHE A 101 -1.303 -1.129 3.490 1.00 0.00 C ATOM 1620 CZ PHE A 101 -0.459 -1.864 4.317 1.00 0.00 C ATOM 0 H PHE A 101 -5.839 -3.304 1.718 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.099 -5.775 1.707 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.459 -4.604 1.002 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -3.474 -3.183 0.860 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.340 -4.991 3.355 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -2.876 -1.216 2.034 1.00 0.00 H new ATOM 0 HE1 PHE A 101 0.136 -3.824 4.955 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -1.270 -0.050 3.505 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.224 -1.355 4.981 1.00 0.00 H new ATOM 1630 N ILE A 102 -4.275 -5.970 4.226 1.00 0.00 N ATOM 1631 CA ILE A 102 -4.407 -6.065 5.723 1.00 0.00 C ATOM 1632 C ILE A 102 -2.997 -5.692 6.281 1.00 0.00 C ATOM 1633 O ILE A 102 -1.980 -6.323 5.961 1.00 0.00 O ATOM 1634 CB ILE A 102 -4.887 -7.441 6.329 1.00 0.00 C ATOM 1635 CG1 ILE A 102 -6.123 -8.048 5.599 1.00 0.00 C ATOM 1636 CG2 ILE A 102 -5.233 -7.256 7.838 1.00 0.00 C ATOM 1637 CD1 ILE A 102 -6.525 -9.468 6.044 1.00 0.00 C ATOM 0 H ILE A 102 -3.948 -6.822 3.770 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.214 -5.395 6.020 1.00 0.00 H new ATOM 0 HB ILE A 102 -4.061 -8.139 6.195 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.974 -7.384 5.750 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.918 -8.066 4.529 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.564 -8.207 8.255 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -4.348 -6.913 8.375 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.029 -6.518 7.941 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.395 -9.795 5.474 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -5.696 -10.153 5.866 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.769 -9.461 7.106 1.00 0.00 H new ATOM 1649 N ARG A 103 -2.958 -4.629 7.098 1.00 0.00 N ATOM 1650 CA ARG A 103 -1.715 -4.175 7.764 1.00 0.00 C ATOM 1651 C ARG A 103 -1.596 -4.930 9.130 1.00 0.00 C ATOM 1652 O ARG A 103 -2.197 -4.551 10.141 1.00 0.00 O ATOM 1653 CB ARG A 103 -1.731 -2.619 7.857 1.00 0.00 C ATOM 1654 CG ARG A 103 -2.888 -1.912 8.605 1.00 0.00 C ATOM 1655 CD ARG A 103 -2.534 -0.474 9.035 1.00 0.00 C ATOM 1656 NE ARG A 103 -3.653 0.159 9.787 1.00 0.00 N ATOM 1657 CZ ARG A 103 -4.012 -0.139 11.038 1.00 0.00 C ATOM 1658 NH1 ARG A 103 -3.328 -0.916 11.846 1.00 0.00 N ATOM 1659 NH2 ARG A 103 -5.126 0.365 11.482 1.00 0.00 N ATOM 0 H ARG A 103 -3.776 -4.060 7.318 1.00 0.00 H new ATOM 0 HA ARG A 103 -0.814 -4.419 7.201 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -0.799 -2.310 8.331 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -1.715 -2.231 6.839 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -3.768 -1.887 7.962 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -3.153 -2.495 9.487 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -1.638 -0.488 9.656 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -2.301 0.124 8.154 1.00 0.00 H new ATOM 0 HE ARG A 103 -4.190 0.881 9.306 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -2.456 -1.339 11.529 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -3.669 -1.096 12.790 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.690 0.964 10.880 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -5.435 0.161 12.432 1.00 0.00 H new ATOM 1673 N SER A 104 -0.844 -6.047 9.144 1.00 0.00 N ATOM 1674 CA SER A 104 -0.654 -6.858 10.378 1.00 0.00 C ATOM 1675 C SER A 104 0.495 -6.242 11.243 1.00 0.00 C ATOM 1676 O SER A 104 1.678 -6.564 11.081 1.00 0.00 O ATOM 1677 CB SER A 104 -0.424 -8.323 9.936 1.00 0.00 C ATOM 1678 OG SER A 104 -0.051 -9.144 11.043 1.00 0.00 O ATOM 0 H SER A 104 -0.358 -6.413 8.325 1.00 0.00 H new ATOM 0 HA SER A 104 -1.529 -6.848 11.028 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.333 -8.715 9.479 1.00 0.00 H new ATOM 0 HB3 SER A 104 0.356 -8.358 9.175 1.00 0.00 H new ATOM 0 HG SER A 104 0.087 -10.064 10.736 1.00 0.00 H new ATOM 1684 N ASP A 105 0.081 -5.366 12.175 1.00 0.00 N ATOM 1685 CA ASP A 105 0.976 -4.623 13.099 1.00 0.00 C ATOM 1686 C ASP A 105 0.429 -4.629 14.566 1.00 0.00 C ATOM 1687 O ASP A 105 -0.647 -5.134 14.914 1.00 0.00 O ATOM 1688 CB ASP A 105 1.166 -3.155 12.581 1.00 0.00 C ATOM 1689 CG ASP A 105 -0.017 -2.337 12.056 1.00 0.00 C ATOM 1690 OD1 ASP A 105 -0.834 -1.851 12.863 1.00 0.00 O ATOM 1691 OD2 ASP A 105 -0.118 -2.158 10.822 1.00 0.00 O ATOM 0 H ASP A 105 -0.905 -5.145 12.315 1.00 0.00 H new ATOM 0 HA ASP A 105 1.943 -5.126 13.117 1.00 0.00 H new ATOM 0 HB2 ASP A 105 1.609 -2.585 13.398 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.906 -3.194 11.781 1.00 0.00 H new ATOM 1696 N SER A 106 1.268 -4.112 15.472 1.00 0.00 N ATOM 1697 CA SER A 106 0.914 -3.898 16.904 1.00 0.00 C ATOM 1698 C SER A 106 1.750 -2.693 17.457 1.00 0.00 C ATOM 1699 O SER A 106 2.498 -2.818 18.432 1.00 0.00 O ATOM 1700 CB SER A 106 1.122 -5.234 17.662 1.00 0.00 C ATOM 1701 OG SER A 106 0.145 -6.192 17.246 1.00 0.00 O ATOM 0 H SER A 106 2.220 -3.825 15.243 1.00 0.00 H new ATOM 0 HA SER A 106 -0.132 -3.624 17.041 1.00 0.00 H new ATOM 0 HB2 SER A 106 2.124 -5.618 17.470 1.00 0.00 H new ATOM 0 HB3 SER A 106 1.045 -5.067 18.736 1.00 0.00 H new ATOM 0 HG SER A 106 -0.460 -5.780 16.594 1.00 0.00 H new ATOM 1707 N GLY A 107 1.595 -1.507 16.828 1.00 0.00 N ATOM 1708 CA GLY A 107 2.326 -0.273 17.207 1.00 0.00 C ATOM 1709 C GLY A 107 3.550 0.082 16.312 1.00 0.00 C ATOM 1710 O GLY A 107 3.341 0.850 15.369 1.00 0.00 O ATOM 0 H GLY A 107 0.959 -1.376 16.042 1.00 0.00 H new ATOM 0 HA2 GLY A 107 1.627 0.563 17.186 1.00 0.00 H new ATOM 0 HA3 GLY A 107 2.668 -0.376 18.237 1.00 0.00 H new ATOM 1714 N PRO A 108 4.803 -0.427 16.517 1.00 0.00 N ATOM 1715 CA PRO A 108 5.990 0.002 15.716 1.00 0.00 C ATOM 1716 C PRO A 108 6.038 -0.343 14.186 1.00 0.00 C ATOM 1717 O PRO A 108 6.180 0.581 13.380 1.00 0.00 O ATOM 1718 CB PRO A 108 7.165 -0.634 16.504 1.00 0.00 C ATOM 1719 CG PRO A 108 6.619 -0.970 17.890 1.00 0.00 C ATOM 1720 CD PRO A 108 5.157 -1.326 17.634 1.00 0.00 C ATOM 0 HA PRO A 108 5.997 1.089 15.634 1.00 0.00 H new ATOM 0 HB2 PRO A 108 7.530 -1.530 16.002 1.00 0.00 H new ATOM 0 HB3 PRO A 108 8.005 0.057 16.574 1.00 0.00 H new ATOM 0 HG2 PRO A 108 7.159 -1.802 18.341 1.00 0.00 H new ATOM 0 HG3 PRO A 108 6.711 -0.124 18.571 1.00 0.00 H new ATOM 0 HD2 PRO A 108 5.035 -2.375 17.365 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.536 -1.148 18.512 1.00 0.00 H new ATOM 1728 N THR A 109 5.982 -1.632 13.783 1.00 0.00 N ATOM 1729 CA THR A 109 6.153 -2.043 12.348 1.00 0.00 C ATOM 1730 C THR A 109 5.003 -2.956 11.805 1.00 0.00 C ATOM 1731 O THR A 109 4.428 -3.768 12.538 1.00 0.00 O ATOM 1732 CB THR A 109 7.520 -2.788 12.138 1.00 0.00 C ATOM 1733 OG1 THR A 109 7.643 -3.905 13.009 1.00 0.00 O ATOM 1734 CG2 THR A 109 8.769 -1.925 12.378 1.00 0.00 C ATOM 0 H THR A 109 5.821 -2.412 14.420 1.00 0.00 H new ATOM 0 HA THR A 109 6.127 -1.111 11.784 1.00 0.00 H new ATOM 0 HB THR A 109 7.486 -3.079 11.088 1.00 0.00 H new ATOM 0 HG1 THR A 109 8.503 -4.348 12.853 1.00 0.00 H new ATOM 0 HG21 THR A 109 9.663 -2.525 12.209 1.00 0.00 H new ATOM 0 HG22 THR A 109 8.764 -1.079 11.691 1.00 0.00 H new ATOM 0 HG23 THR A 109 8.766 -1.559 13.405 1.00 0.00 H new ATOM 1742 N THR A 110 4.727 -2.847 10.484 1.00 0.00 N ATOM 1743 CA THR A 110 3.665 -3.637 9.791 1.00 0.00 C ATOM 1744 C THR A 110 4.226 -4.608 8.687 1.00 0.00 C ATOM 1745 O THR A 110 5.429 -4.812 8.494 1.00 0.00 O ATOM 1746 CB THR A 110 2.578 -2.613 9.283 1.00 0.00 C ATOM 1747 OG1 THR A 110 1.319 -3.282 9.253 1.00 0.00 O ATOM 1748 CG2 THR A 110 2.769 -2.031 7.874 1.00 0.00 C ATOM 0 H THR A 110 5.230 -2.212 9.864 1.00 0.00 H new ATOM 0 HA THR A 110 3.195 -4.333 10.486 1.00 0.00 H new ATOM 0 HB THR A 110 2.656 -1.778 9.979 1.00 0.00 H new ATOM 0 HG1 THR A 110 0.677 -2.795 9.810 1.00 0.00 H new ATOM 0 HG21 THR A 110 1.953 -1.343 7.651 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.718 -1.497 7.827 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.771 -2.840 7.143 1.00 0.00 H new ATOM 1756 N SER A 111 3.259 -5.280 8.050 1.00 0.00 N ATOM 1757 CA SER A 111 3.461 -6.309 6.984 1.00 0.00 C ATOM 1758 C SER A 111 2.258 -6.283 5.972 1.00 0.00 C ATOM 1759 O SER A 111 1.175 -5.770 6.285 1.00 0.00 O ATOM 1760 CB SER A 111 3.651 -7.692 7.659 1.00 0.00 C ATOM 1761 OG SER A 111 2.625 -8.000 8.601 1.00 0.00 O ATOM 0 H SER A 111 2.273 -5.127 8.260 1.00 0.00 H new ATOM 0 HA SER A 111 4.357 -6.093 6.402 1.00 0.00 H new ATOM 0 HB2 SER A 111 3.674 -8.465 6.891 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.617 -7.714 8.163 1.00 0.00 H new ATOM 0 HG SER A 111 2.657 -7.359 9.341 1.00 0.00 H new ATOM 1767 N PHE A 112 2.437 -6.809 4.739 1.00 0.00 N ATOM 1768 CA PHE A 112 1.407 -6.679 3.665 1.00 0.00 C ATOM 1769 C PHE A 112 0.598 -7.971 3.289 1.00 0.00 C ATOM 1770 O PHE A 112 1.058 -8.803 2.497 1.00 0.00 O ATOM 1771 CB PHE A 112 2.138 -6.177 2.378 1.00 0.00 C ATOM 1772 CG PHE A 112 2.709 -4.754 2.223 1.00 0.00 C ATOM 1773 CD1 PHE A 112 2.715 -3.781 3.231 1.00 0.00 C ATOM 1774 CD2 PHE A 112 3.186 -4.416 0.951 1.00 0.00 C ATOM 1775 CE1 PHE A 112 3.141 -2.484 2.956 1.00 0.00 C ATOM 1776 CE2 PHE A 112 3.623 -3.124 0.682 1.00 0.00 C ATOM 1777 CZ PHE A 112 3.587 -2.157 1.679 1.00 0.00 C ATOM 0 H PHE A 112 3.272 -7.323 4.458 1.00 0.00 H new ATOM 0 HA PHE A 112 0.660 -5.994 4.065 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.970 -6.861 2.211 1.00 0.00 H new ATOM 0 HB3 PHE A 112 1.439 -6.318 1.554 1.00 0.00 H new ATOM 0 HD1 PHE A 112 2.387 -4.038 4.227 1.00 0.00 H new ATOM 0 HD2 PHE A 112 3.215 -5.164 0.173 1.00 0.00 H new ATOM 0 HE1 PHE A 112 3.125 -1.733 3.732 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.990 -2.872 -0.302 1.00 0.00 H new ATOM 0 HZ PHE A 112 3.906 -1.148 1.462 1.00 0.00 H new ATOM 1787 N GLU A 113 -0.657 -8.076 3.761 1.00 0.00 N ATOM 1788 CA GLU A 113 -1.634 -9.083 3.218 1.00 0.00 C ATOM 1789 C GLU A 113 -2.365 -8.384 2.000 1.00 0.00 C ATOM 1790 O GLU A 113 -2.452 -7.152 1.976 1.00 0.00 O ATOM 1791 CB GLU A 113 -2.652 -9.552 4.284 1.00 0.00 C ATOM 1792 CG GLU A 113 -2.118 -10.052 5.655 1.00 0.00 C ATOM 1793 CD GLU A 113 -1.258 -11.302 5.625 1.00 0.00 C ATOM 1794 OE1 GLU A 113 -1.811 -12.409 5.459 1.00 0.00 O ATOM 1795 OE2 GLU A 113 -0.025 -11.183 5.782 1.00 0.00 O ATOM 0 H GLU A 113 -1.032 -7.491 4.508 1.00 0.00 H new ATOM 0 HA GLU A 113 -1.109 -9.985 2.904 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -3.334 -8.724 4.477 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -3.243 -10.356 3.846 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -1.539 -9.249 6.110 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -2.971 -10.239 6.307 1.00 0.00 H new ATOM 1802 N SER A 114 -2.885 -9.104 0.982 1.00 0.00 N ATOM 1803 CA SER A 114 -3.405 -8.476 -0.277 1.00 0.00 C ATOM 1804 C SER A 114 -4.587 -9.303 -0.877 1.00 0.00 C ATOM 1805 O SER A 114 -4.524 -10.532 -1.001 1.00 0.00 O ATOM 1806 CB SER A 114 -2.230 -8.350 -1.273 1.00 0.00 C ATOM 1807 OG SER A 114 -2.570 -7.521 -2.379 1.00 0.00 O ATOM 0 H SER A 114 -2.961 -10.121 0.997 1.00 0.00 H new ATOM 0 HA SER A 114 -3.806 -7.486 -0.061 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.361 -7.937 -0.761 1.00 0.00 H new ATOM 0 HB3 SER A 114 -1.948 -9.340 -1.632 1.00 0.00 H new ATOM 0 HG SER A 114 -3.152 -8.016 -2.992 1.00 0.00 H new ATOM 1813 N ALA A 115 -5.617 -8.549 -1.336 1.00 0.00 N ATOM 1814 CA ALA A 115 -7.005 -9.033 -1.657 1.00 0.00 C ATOM 1815 C ALA A 115 -7.633 -8.871 -0.256 1.00 0.00 C ATOM 1816 O ALA A 115 -8.174 -7.788 0.024 1.00 0.00 O ATOM 1817 CB ALA A 115 -7.136 -10.339 -2.460 1.00 0.00 C ATOM 0 H ALA A 115 -5.511 -7.548 -1.503 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.557 -8.492 -2.425 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -8.191 -10.565 -2.617 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -6.642 -10.224 -3.425 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -6.668 -11.154 -1.908 1.00 0.00 H new ATOM 1823 N ALA A 116 -7.467 -9.901 0.588 1.00 0.00 N ATOM 1824 CA ALA A 116 -7.493 -9.682 2.062 1.00 0.00 C ATOM 1825 C ALA A 116 -6.865 -10.897 2.801 1.00 0.00 C ATOM 1826 O ALA A 116 -5.702 -10.836 3.207 1.00 0.00 O ATOM 1827 CB ALA A 116 -8.913 -9.278 2.563 1.00 0.00 C ATOM 0 H ALA A 116 -7.317 -10.868 0.299 1.00 0.00 H new ATOM 0 HA ALA A 116 -6.866 -8.825 2.308 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -8.889 -9.128 3.642 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -9.222 -8.354 2.075 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.623 -10.070 2.323 1.00 0.00 H new ATOM 1833 N CYS A 117 -7.660 -11.937 3.073 1.00 0.00 N ATOM 1834 CA CYS A 117 -7.178 -13.202 3.698 1.00 0.00 C ATOM 1835 C CYS A 117 -6.753 -14.095 2.488 1.00 0.00 C ATOM 1836 O CYS A 117 -5.537 -14.272 2.348 1.00 0.00 O ATOM 1837 CB CYS A 117 -8.236 -13.762 4.673 1.00 0.00 C ATOM 1838 SG CYS A 117 -8.311 -12.712 6.163 1.00 0.00 S ATOM 0 H CYS A 117 -8.660 -11.939 2.871 1.00 0.00 H new ATOM 0 HA CYS A 117 -6.315 -13.102 4.356 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -9.212 -13.793 4.188 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -7.985 -14.786 4.950 1.00 0.00 H new ATOM 0 HG CYS A 117 -9.204 -13.184 6.982 1.00 0.00 H new ATOM 1844 N PRO A 118 -7.620 -14.615 1.557 1.00 0.00 N ATOM 1845 CA PRO A 118 -7.129 -15.189 0.286 1.00 0.00 C ATOM 1846 C PRO A 118 -6.535 -14.066 -0.650 1.00 0.00 C ATOM 1847 O PRO A 118 -6.742 -12.848 -0.459 1.00 0.00 O ATOM 1848 CB PRO A 118 -8.393 -15.885 -0.257 1.00 0.00 C ATOM 1849 CG PRO A 118 -9.556 -15.027 0.249 1.00 0.00 C ATOM 1850 CD PRO A 118 -9.093 -14.537 1.623 1.00 0.00 C ATOM 0 HA PRO A 118 -6.296 -15.886 0.378 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -8.381 -15.934 -1.346 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -8.469 -16.909 0.107 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -9.758 -14.193 -0.424 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -10.476 -15.607 0.322 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -9.430 -13.519 1.817 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -9.490 -15.162 2.423 1.00 0.00 H new ATOM 1858 N GLY A 119 -5.784 -14.552 -1.649 1.00 0.00 N ATOM 1859 CA GLY A 119 -5.087 -13.705 -2.643 1.00 0.00 C ATOM 1860 C GLY A 119 -3.570 -13.907 -2.597 1.00 0.00 C ATOM 1861 O GLY A 119 -3.057 -14.834 -3.228 1.00 0.00 O ATOM 0 H GLY A 119 -5.639 -15.551 -1.796 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -5.455 -13.939 -3.642 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -5.320 -12.657 -2.455 1.00 0.00 H new ATOM 1865 N TRP A 120 -2.857 -13.024 -1.881 1.00 0.00 N ATOM 1866 CA TRP A 120 -1.367 -13.094 -1.777 1.00 0.00 C ATOM 1867 C TRP A 120 -0.890 -12.323 -0.493 1.00 0.00 C ATOM 1868 O TRP A 120 -1.474 -11.300 -0.123 1.00 0.00 O ATOM 1869 CB TRP A 120 -0.765 -12.554 -3.128 1.00 0.00 C ATOM 1870 CG TRP A 120 0.296 -13.428 -3.834 1.00 0.00 C ATOM 1871 CD1 TRP A 120 0.286 -14.842 -3.901 1.00 0.00 C ATOM 1872 CD2 TRP A 120 1.329 -13.043 -4.688 1.00 0.00 C ATOM 1873 NE1 TRP A 120 1.315 -15.347 -4.716 1.00 0.00 N ATOM 1874 CE2 TRP A 120 1.945 -14.218 -5.193 1.00 0.00 C ATOM 1875 CE3 TRP A 120 1.754 -11.769 -5.150 1.00 0.00 C ATOM 1876 CZ2 TRP A 120 2.997 -14.127 -6.132 1.00 0.00 C ATOM 1877 CZ3 TRP A 120 2.798 -11.702 -6.074 1.00 0.00 C ATOM 1878 CH2 TRP A 120 3.411 -12.864 -6.555 1.00 0.00 C ATOM 0 H TRP A 120 -3.274 -12.251 -1.362 1.00 0.00 H new ATOM 0 HA TRP A 120 -1.007 -14.115 -1.649 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -1.589 -12.396 -3.824 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -0.321 -11.578 -2.933 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -0.431 -15.463 -3.385 1.00 0.00 H new ATOM 0 HE1 TRP A 120 1.542 -16.322 -4.909 1.00 0.00 H new ATOM 0 HE3 TRP A 120 1.278 -10.868 -4.793 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 3.471 -15.018 -6.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 3.138 -10.738 -6.423 1.00 0.00 H new ATOM 0 HH2 TRP A 120 4.219 -12.782 -7.267 1.00 0.00 H new ATOM 1889 N PHE A 121 0.175 -12.784 0.197 1.00 0.00 N ATOM 1890 CA PHE A 121 0.647 -12.150 1.475 1.00 0.00 C ATOM 1891 C PHE A 121 2.211 -12.101 1.658 1.00 0.00 C ATOM 1892 O PHE A 121 2.835 -13.159 1.649 1.00 0.00 O ATOM 1893 CB PHE A 121 -0.022 -12.934 2.657 1.00 0.00 C ATOM 1894 CG PHE A 121 0.276 -14.446 2.838 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -0.435 -15.403 2.105 1.00 0.00 C ATOM 1896 CD2 PHE A 121 1.301 -14.865 3.694 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -0.094 -16.751 2.190 1.00 0.00 C ATOM 1898 CE2 PHE A 121 1.642 -16.214 3.778 1.00 0.00 C ATOM 1899 CZ PHE A 121 0.947 -17.154 3.023 1.00 0.00 C ATOM 0 H PHE A 121 0.730 -13.588 -0.097 1.00 0.00 H new ATOM 0 HA PHE A 121 0.350 -11.101 1.452 1.00 0.00 H new ATOM 0 HB2 PHE A 121 0.261 -12.433 3.583 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -1.101 -12.824 2.552 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -1.252 -15.095 1.470 1.00 0.00 H new ATOM 0 HD2 PHE A 121 1.831 -14.139 4.293 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -0.637 -17.483 1.610 1.00 0.00 H new ATOM 0 HE2 PHE A 121 2.445 -16.529 4.428 1.00 0.00 H new ATOM 0 HZ PHE A 121 1.215 -18.198 3.083 1.00 0.00 H new ATOM 1909 N LEU A 122 2.863 -10.910 1.720 1.00 0.00 N ATOM 1910 CA LEU A 122 4.309 -10.767 2.120 1.00 0.00 C ATOM 1911 C LEU A 122 4.698 -9.245 2.270 1.00 0.00 C ATOM 1912 O LEU A 122 4.321 -8.665 3.296 1.00 0.00 O ATOM 1913 CB LEU A 122 5.361 -11.567 1.264 1.00 0.00 C ATOM 1914 CG LEU A 122 6.777 -11.754 1.871 1.00 0.00 C ATOM 1915 CD1 LEU A 122 6.791 -12.347 3.291 1.00 0.00 C ATOM 1916 CD2 LEU A 122 7.616 -12.645 0.939 1.00 0.00 C ATOM 0 H LEU A 122 2.414 -10.021 1.498 1.00 0.00 H new ATOM 0 HA LEU A 122 4.370 -11.259 3.091 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.948 -12.555 1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 122 5.469 -11.062 0.304 1.00 0.00 H new ATOM 0 HG LEU A 122 7.201 -10.754 1.959 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.821 -12.442 3.635 1.00 0.00 H new ATOM 0 HD12 LEU A 122 6.242 -11.689 3.965 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.320 -13.330 3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.612 -12.779 1.362 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.133 -13.617 0.833 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.698 -12.172 -0.040 1.00 0.00 H new ATOM 1928 N CYS A 123 5.491 -8.590 1.367 1.00 0.00 N ATOM 1929 CA CYS A 123 6.037 -7.220 1.618 1.00 0.00 C ATOM 1930 C CYS A 123 6.542 -6.472 0.311 1.00 0.00 C ATOM 1931 O CYS A 123 5.767 -6.095 -0.577 1.00 0.00 O ATOM 1932 CB CYS A 123 7.126 -7.430 2.706 1.00 0.00 C ATOM 1933 SG CYS A 123 8.461 -8.482 2.064 1.00 0.00 S ATOM 0 H CYS A 123 5.763 -8.986 0.467 1.00 0.00 H new ATOM 0 HA CYS A 123 5.263 -6.534 1.962 1.00 0.00 H new ATOM 0 HB2 CYS A 123 7.530 -6.467 3.017 1.00 0.00 H new ATOM 0 HB3 CYS A 123 6.684 -7.890 3.589 1.00 0.00 H new ATOM 0 HG CYS A 123 9.541 -7.773 1.920 1.00 0.00 H new ATOM 1939 N THR A 124 7.850 -6.152 0.227 1.00 0.00 N ATOM 1940 CA THR A 124 8.502 -5.396 -0.882 1.00 0.00 C ATOM 1941 C THR A 124 10.026 -5.710 -0.791 1.00 0.00 C ATOM 1942 O THR A 124 10.637 -5.511 0.261 1.00 0.00 O ATOM 1943 CB THR A 124 8.270 -3.858 -0.724 1.00 0.00 C ATOM 1944 OG1 THR A 124 6.873 -3.585 -0.642 1.00 0.00 O ATOM 1945 CG2 THR A 124 8.820 -2.955 -1.844 1.00 0.00 C ATOM 0 H THR A 124 8.513 -6.420 0.954 1.00 0.00 H new ATOM 0 HA THR A 124 8.084 -5.690 -1.845 1.00 0.00 H new ATOM 0 HB THR A 124 8.827 -3.616 0.181 1.00 0.00 H new ATOM 0 HG1 THR A 124 6.724 -2.619 -0.709 1.00 0.00 H new ATOM 0 HG21 THR A 124 8.594 -1.913 -1.616 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.900 -3.084 -1.918 1.00 0.00 H new ATOM 0 HG23 THR A 124 8.356 -3.227 -2.792 1.00 0.00 H new ATOM 1953 N ALA A 125 10.607 -6.234 -1.881 1.00 0.00 N ATOM 1954 CA ALA A 125 12.070 -6.542 -2.018 1.00 0.00 C ATOM 1955 C ALA A 125 12.859 -7.339 -0.912 1.00 0.00 C ATOM 1956 O ALA A 125 12.401 -7.593 0.204 1.00 0.00 O ATOM 1957 CB ALA A 125 12.752 -5.163 -2.182 1.00 0.00 C ATOM 0 H ALA A 125 10.075 -6.467 -2.720 1.00 0.00 H new ATOM 0 HA ALA A 125 12.109 -7.252 -2.844 1.00 0.00 H new ATOM 0 HB1 ALA A 125 13.828 -5.300 -2.289 1.00 0.00 H new ATOM 0 HB2 ALA A 125 12.360 -4.666 -3.069 1.00 0.00 H new ATOM 0 HB3 ALA A 125 12.549 -4.550 -1.304 1.00 0.00 H new ATOM 1963 N MET A 126 14.090 -7.750 -1.280 1.00 0.00 N ATOM 1964 CA MET A 126 15.088 -8.342 -0.343 1.00 0.00 C ATOM 1965 C MET A 126 15.913 -7.179 0.320 1.00 0.00 C ATOM 1966 O MET A 126 15.927 -7.075 1.550 1.00 0.00 O ATOM 1967 CB MET A 126 15.923 -9.373 -1.157 1.00 0.00 C ATOM 1968 CG MET A 126 16.929 -10.224 -0.353 1.00 0.00 C ATOM 1969 SD MET A 126 18.336 -9.250 0.230 1.00 0.00 S ATOM 1970 CE MET A 126 19.410 -9.295 -1.218 1.00 0.00 C ATOM 0 H MET A 126 14.429 -7.683 -2.240 1.00 0.00 H new ATOM 0 HA MET A 126 14.640 -8.884 0.490 1.00 0.00 H new ATOM 0 HB2 MET A 126 15.233 -10.047 -1.665 1.00 0.00 H new ATOM 0 HB3 MET A 126 16.471 -8.835 -1.931 1.00 0.00 H new ATOM 0 HG2 MET A 126 16.422 -10.673 0.501 1.00 0.00 H new ATOM 0 HG3 MET A 126 17.289 -11.043 -0.976 1.00 0.00 H new ATOM 0 HE1 MET A 126 20.322 -8.735 -1.012 1.00 0.00 H new ATOM 0 HE2 MET A 126 19.664 -10.329 -1.451 1.00 0.00 H new ATOM 0 HE3 MET A 126 18.894 -8.848 -2.068 1.00 0.00 H new ATOM 1980 N GLU A 127 16.581 -6.315 -0.478 1.00 0.00 N ATOM 1981 CA GLU A 127 17.328 -5.127 0.028 1.00 0.00 C ATOM 1982 C GLU A 127 16.822 -3.812 -0.692 1.00 0.00 C ATOM 1983 O GLU A 127 15.756 -3.773 -1.320 1.00 0.00 O ATOM 1984 CB GLU A 127 18.863 -5.431 -0.138 1.00 0.00 C ATOM 1985 CG GLU A 127 19.716 -5.285 1.155 1.00 0.00 C ATOM 1986 CD GLU A 127 19.657 -3.955 1.898 1.00 0.00 C ATOM 1987 OE1 GLU A 127 19.703 -2.885 1.257 1.00 0.00 O ATOM 1988 OE2 GLU A 127 19.485 -3.965 3.136 1.00 0.00 O ATOM 0 H GLU A 127 16.621 -6.417 -1.492 1.00 0.00 H new ATOM 0 HA GLU A 127 17.146 -4.941 1.086 1.00 0.00 H new ATOM 0 HB2 GLU A 127 18.976 -6.448 -0.515 1.00 0.00 H new ATOM 0 HB3 GLU A 127 19.268 -4.763 -0.898 1.00 0.00 H new ATOM 0 HG2 GLU A 127 19.412 -6.070 1.848 1.00 0.00 H new ATOM 0 HG3 GLU A 127 20.757 -5.477 0.893 1.00 0.00 H new ATOM 1995 N ALA A 128 17.583 -2.705 -0.595 1.00 0.00 N ATOM 1996 CA ALA A 128 17.237 -1.388 -1.204 1.00 0.00 C ATOM 1997 C ALA A 128 17.357 -1.269 -2.770 1.00 0.00 C ATOM 1998 O ALA A 128 18.090 -0.422 -3.292 1.00 0.00 O ATOM 1999 CB ALA A 128 18.200 -0.429 -0.465 1.00 0.00 C ATOM 0 H ALA A 128 18.468 -2.691 -0.087 1.00 0.00 H new ATOM 0 HA ALA A 128 16.175 -1.174 -1.081 1.00 0.00 H new ATOM 0 HB1 ALA A 128 18.047 0.589 -0.824 1.00 0.00 H new ATOM 0 HB2 ALA A 128 18.002 -0.469 0.606 1.00 0.00 H new ATOM 0 HB3 ALA A 128 19.230 -0.730 -0.655 1.00 0.00 H new ATOM 2005 N ASP A 129 16.576 -2.069 -3.523 1.00 0.00 N ATOM 2006 CA ASP A 129 16.618 -2.084 -5.022 1.00 0.00 C ATOM 2007 C ASP A 129 15.346 -2.681 -5.711 1.00 0.00 C ATOM 2008 O ASP A 129 14.870 -2.096 -6.687 1.00 0.00 O ATOM 2009 CB ASP A 129 17.929 -2.840 -5.436 1.00 0.00 C ATOM 2010 CG ASP A 129 18.092 -3.279 -6.895 1.00 0.00 C ATOM 2011 OD1 ASP A 129 18.521 -2.463 -7.735 1.00 0.00 O ATOM 2012 OD2 ASP A 129 17.787 -4.458 -7.190 1.00 0.00 O ATOM 0 H ASP A 129 15.900 -2.722 -3.126 1.00 0.00 H new ATOM 0 HA ASP A 129 16.624 -1.054 -5.379 1.00 0.00 H new ATOM 0 HB2 ASP A 129 18.774 -2.198 -5.187 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.009 -3.730 -4.811 1.00 0.00 H new ATOM 2017 N GLN A 130 14.800 -3.823 -5.266 1.00 0.00 N ATOM 2018 CA GLN A 130 13.668 -4.492 -5.966 1.00 0.00 C ATOM 2019 C GLN A 130 12.256 -3.833 -5.656 1.00 0.00 C ATOM 2020 O GLN A 130 12.159 -2.987 -4.750 1.00 0.00 O ATOM 2021 CB GLN A 130 13.749 -6.006 -5.584 1.00 0.00 C ATOM 2022 CG GLN A 130 15.061 -6.784 -5.901 1.00 0.00 C ATOM 2023 CD GLN A 130 16.127 -6.739 -4.794 1.00 0.00 C ATOM 2024 OE1 GLN A 130 15.866 -7.027 -3.629 1.00 0.00 O ATOM 2025 NE2 GLN A 130 17.348 -6.377 -5.099 1.00 0.00 N ATOM 0 H GLN A 130 15.116 -4.310 -4.427 1.00 0.00 H new ATOM 0 HA GLN A 130 13.759 -4.368 -7.045 1.00 0.00 H new ATOM 0 HB2 GLN A 130 13.566 -6.088 -4.513 1.00 0.00 H new ATOM 0 HB3 GLN A 130 12.930 -6.519 -6.087 1.00 0.00 H new ATOM 0 HG2 GLN A 130 14.809 -7.826 -6.100 1.00 0.00 H new ATOM 0 HG3 GLN A 130 15.493 -6.380 -6.817 1.00 0.00 H new ATOM 0 HE21 GLN A 130 17.583 -6.134 -6.062 1.00 0.00 H new ATOM 0 HE22 GLN A 130 18.064 -6.338 -4.374 1.00 0.00 H new ATOM 2034 N PRO A 131 11.125 -4.190 -6.346 1.00 0.00 N ATOM 2035 CA PRO A 131 9.797 -3.571 -6.089 1.00 0.00 C ATOM 2036 C PRO A 131 8.827 -4.329 -5.105 1.00 0.00 C ATOM 2037 O PRO A 131 9.155 -5.342 -4.470 1.00 0.00 O ATOM 2038 CB PRO A 131 9.307 -3.484 -7.555 1.00 0.00 C ATOM 2039 CG PRO A 131 9.776 -4.788 -8.204 1.00 0.00 C ATOM 2040 CD PRO A 131 11.112 -5.093 -7.522 1.00 0.00 C ATOM 0 HA PRO A 131 9.841 -2.633 -5.536 1.00 0.00 H new ATOM 0 HB2 PRO A 131 8.223 -3.386 -7.604 1.00 0.00 H new ATOM 0 HB3 PRO A 131 9.729 -2.616 -8.062 1.00 0.00 H new ATOM 0 HG2 PRO A 131 9.057 -5.592 -8.046 1.00 0.00 H new ATOM 0 HG3 PRO A 131 9.896 -4.675 -9.281 1.00 0.00 H new ATOM 0 HD2 PRO A 131 11.179 -6.139 -7.223 1.00 0.00 H new ATOM 0 HD3 PRO A 131 11.954 -4.897 -8.186 1.00 0.00 H new ATOM 2048 N VAL A 132 7.588 -3.802 -5.029 1.00 0.00 N ATOM 2049 CA VAL A 132 6.467 -4.359 -4.202 1.00 0.00 C ATOM 2050 C VAL A 132 6.049 -5.817 -4.593 1.00 0.00 C ATOM 2051 O VAL A 132 5.857 -6.108 -5.782 1.00 0.00 O ATOM 2052 CB VAL A 132 5.260 -3.357 -4.314 1.00 0.00 C ATOM 2053 CG1 VAL A 132 4.591 -3.204 -5.705 1.00 0.00 C ATOM 2054 CG2 VAL A 132 4.155 -3.667 -3.282 1.00 0.00 C ATOM 0 H VAL A 132 7.321 -2.963 -5.544 1.00 0.00 H new ATOM 0 HA VAL A 132 6.807 -4.451 -3.170 1.00 0.00 H new ATOM 0 HB VAL A 132 5.749 -2.404 -4.112 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.775 -2.484 -5.639 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.328 -2.852 -6.427 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.199 -4.168 -6.028 1.00 0.00 H new ATOM 0 HG21 VAL A 132 3.341 -2.951 -3.395 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.776 -4.676 -3.446 1.00 0.00 H new ATOM 0 HG23 VAL A 132 4.566 -3.593 -2.275 1.00 0.00 H new ATOM 2064 N SER A 133 5.971 -6.769 -3.630 1.00 0.00 N ATOM 2065 CA SER A 133 5.538 -8.165 -3.947 1.00 0.00 C ATOM 2066 C SER A 133 5.128 -8.996 -2.693 1.00 0.00 C ATOM 2067 O SER A 133 5.722 -8.919 -1.611 1.00 0.00 O ATOM 2068 CB SER A 133 6.677 -8.928 -4.690 1.00 0.00 C ATOM 2069 OG SER A 133 6.870 -8.407 -6.003 1.00 0.00 O ATOM 0 H SER A 133 6.195 -6.608 -2.648 1.00 0.00 H new ATOM 0 HA SER A 133 4.655 -8.061 -4.577 1.00 0.00 H new ATOM 0 HB2 SER A 133 7.604 -8.846 -4.123 1.00 0.00 H new ATOM 0 HB3 SER A 133 6.431 -9.988 -4.748 1.00 0.00 H new ATOM 0 HG SER A 133 6.298 -7.621 -6.130 1.00 0.00 H new ATOM 2075 N LEU A 134 4.108 -9.843 -2.890 1.00 0.00 N ATOM 2076 CA LEU A 134 3.580 -10.754 -1.841 1.00 0.00 C ATOM 2077 C LEU A 134 3.917 -12.268 -2.177 1.00 0.00 C ATOM 2078 O LEU A 134 4.487 -12.564 -3.234 1.00 0.00 O ATOM 2079 CB LEU A 134 2.054 -10.517 -1.734 1.00 0.00 C ATOM 2080 CG LEU A 134 1.387 -9.130 -1.523 1.00 0.00 C ATOM 2081 CD1 LEU A 134 2.177 -8.102 -0.699 1.00 0.00 C ATOM 2082 CD2 LEU A 134 0.947 -8.512 -2.854 1.00 0.00 C ATOM 0 H LEU A 134 3.618 -9.923 -3.781 1.00 0.00 H new ATOM 0 HA LEU A 134 4.053 -10.542 -0.882 1.00 0.00 H new ATOM 0 HB2 LEU A 134 1.622 -10.923 -2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 134 1.709 -11.145 -0.913 1.00 0.00 H new ATOM 0 HG LEU A 134 0.521 -9.367 -0.905 1.00 0.00 H new ATOM 0 HD11 LEU A 134 1.604 -7.178 -0.625 1.00 0.00 H new ATOM 0 HD12 LEU A 134 2.358 -8.498 0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 134 3.131 -7.900 -1.187 1.00 0.00 H new ATOM 0 HD21 LEU A 134 0.484 -7.542 -2.670 1.00 0.00 H new ATOM 0 HD22 LEU A 134 1.815 -8.383 -3.500 1.00 0.00 H new ATOM 0 HD23 LEU A 134 0.228 -9.171 -3.341 1.00 0.00 H new ATOM 2094 N THR A 135 3.566 -13.248 -1.310 1.00 0.00 N ATOM 2095 CA THR A 135 3.795 -14.705 -1.596 1.00 0.00 C ATOM 2096 C THR A 135 2.536 -15.582 -1.260 1.00 0.00 C ATOM 2097 O THR A 135 1.627 -15.210 -0.511 1.00 0.00 O ATOM 2098 CB THR A 135 5.076 -15.219 -0.835 1.00 0.00 C ATOM 2099 OG1 THR A 135 5.483 -16.463 -1.399 1.00 0.00 O ATOM 2100 CG2 THR A 135 4.958 -15.518 0.674 1.00 0.00 C ATOM 0 H THR A 135 3.125 -13.068 -0.408 1.00 0.00 H new ATOM 0 HA THR A 135 3.966 -14.808 -2.668 1.00 0.00 H new ATOM 0 HB THR A 135 5.761 -14.379 -0.948 1.00 0.00 H new ATOM 0 HG1 THR A 135 5.443 -17.162 -0.713 1.00 0.00 H new ATOM 0 HG21 THR A 135 5.920 -15.862 1.053 1.00 0.00 H new ATOM 0 HG22 THR A 135 4.663 -14.612 1.203 1.00 0.00 H new ATOM 0 HG23 THR A 135 4.207 -16.292 0.834 1.00 0.00 H new ATOM 2108 N ASN A 136 2.510 -16.776 -1.869 1.00 0.00 N ATOM 2109 CA ASN A 136 1.529 -17.862 -1.564 1.00 0.00 C ATOM 2110 C ASN A 136 2.217 -18.880 -0.584 1.00 0.00 C ATOM 2111 O ASN A 136 1.693 -19.140 0.502 1.00 0.00 O ATOM 2112 CB ASN A 136 0.993 -18.507 -2.880 1.00 0.00 C ATOM 2113 CG ASN A 136 1.976 -19.044 -3.942 1.00 0.00 C ATOM 2114 OD1 ASN A 136 3.195 -18.922 -3.862 1.00 0.00 O ATOM 2115 ND2 ASN A 136 1.470 -19.645 -4.990 1.00 0.00 N ATOM 0 H ASN A 136 3.174 -17.032 -2.600 1.00 0.00 H new ATOM 0 HA ASN A 136 0.644 -17.468 -1.064 1.00 0.00 H new ATOM 0 HB2 ASN A 136 0.345 -19.335 -2.593 1.00 0.00 H new ATOM 0 HB3 ASN A 136 0.363 -17.764 -3.370 1.00 0.00 H new ATOM 0 HD21 ASN A 136 2.086 -20.001 -5.720 1.00 0.00 H new ATOM 0 HD22 ASN A 136 0.460 -19.757 -5.076 1.00 0.00 H new ATOM 2122 N MET A 137 3.396 -19.427 -0.948 1.00 0.00 N ATOM 2123 CA MET A 137 4.224 -20.288 -0.067 1.00 0.00 C ATOM 2124 C MET A 137 5.026 -19.349 0.920 1.00 0.00 C ATOM 2125 O MET A 137 5.776 -18.498 0.418 1.00 0.00 O ATOM 2126 CB MET A 137 5.188 -21.135 -0.942 1.00 0.00 C ATOM 2127 CG MET A 137 4.515 -22.220 -1.813 1.00 0.00 C ATOM 2128 SD MET A 137 5.728 -22.999 -2.902 1.00 0.00 S ATOM 2129 CE MET A 137 5.764 -21.820 -4.268 1.00 0.00 C ATOM 0 H MET A 137 3.807 -19.284 -1.871 1.00 0.00 H new ATOM 0 HA MET A 137 3.604 -20.972 0.512 1.00 0.00 H new ATOM 0 HB2 MET A 137 5.744 -20.462 -1.595 1.00 0.00 H new ATOM 0 HB3 MET A 137 5.915 -21.617 -0.289 1.00 0.00 H new ATOM 0 HG2 MET A 137 4.054 -22.973 -1.174 1.00 0.00 H new ATOM 0 HG3 MET A 137 3.717 -21.775 -2.407 1.00 0.00 H new ATOM 0 HE1 MET A 137 6.470 -22.162 -5.025 1.00 0.00 H new ATOM 0 HE2 MET A 137 4.770 -21.742 -4.708 1.00 0.00 H new ATOM 0 HE3 MET A 137 6.074 -20.843 -3.897 1.00 0.00 H new ATOM 2139 N PRO A 138 4.919 -19.448 2.283 1.00 0.00 N ATOM 2140 CA PRO A 138 5.623 -18.537 3.238 1.00 0.00 C ATOM 2141 C PRO A 138 7.164 -18.290 3.088 1.00 0.00 C ATOM 2142 O PRO A 138 7.922 -19.113 2.567 1.00 0.00 O ATOM 2143 CB PRO A 138 5.314 -19.213 4.591 1.00 0.00 C ATOM 2144 CG PRO A 138 3.957 -19.882 4.399 1.00 0.00 C ATOM 2145 CD PRO A 138 4.017 -20.400 2.965 1.00 0.00 C ATOM 0 HA PRO A 138 5.266 -17.520 3.075 1.00 0.00 H new ATOM 0 HB2 PRO A 138 6.080 -19.943 4.851 1.00 0.00 H new ATOM 0 HB3 PRO A 138 5.283 -18.482 5.399 1.00 0.00 H new ATOM 0 HG2 PRO A 138 3.804 -20.692 5.112 1.00 0.00 H new ATOM 0 HG3 PRO A 138 3.138 -19.176 4.537 1.00 0.00 H new ATOM 0 HD2 PRO A 138 4.405 -21.418 2.923 1.00 0.00 H new ATOM 0 HD3 PRO A 138 3.030 -20.416 2.504 1.00 0.00 H new ATOM 2153 N ASP A 139 7.596 -17.123 3.591 1.00 0.00 N ATOM 2154 CA ASP A 139 9.018 -16.681 3.589 1.00 0.00 C ATOM 2155 C ASP A 139 9.855 -17.321 4.754 1.00 0.00 C ATOM 2156 O ASP A 139 9.347 -17.529 5.862 1.00 0.00 O ATOM 2157 CB ASP A 139 8.919 -15.132 3.701 1.00 0.00 C ATOM 2158 CG ASP A 139 10.216 -14.325 3.671 1.00 0.00 C ATOM 2159 OD1 ASP A 139 10.919 -14.272 4.699 1.00 0.00 O ATOM 2160 OD2 ASP A 139 10.536 -13.718 2.632 1.00 0.00 O ATOM 0 H ASP A 139 6.967 -16.444 4.019 1.00 0.00 H new ATOM 0 HA ASP A 139 9.551 -17.001 2.694 1.00 0.00 H new ATOM 0 HB2 ASP A 139 8.287 -14.778 2.886 1.00 0.00 H new ATOM 0 HB3 ASP A 139 8.401 -14.897 4.631 1.00 0.00 H new ATOM 2165 N GLU A 140 11.139 -17.641 4.492 1.00 0.00 N ATOM 2166 CA GLU A 140 12.065 -18.181 5.543 1.00 0.00 C ATOM 2167 C GLU A 140 13.201 -17.138 5.882 1.00 0.00 C ATOM 2168 O GLU A 140 14.377 -17.480 6.035 1.00 0.00 O ATOM 2169 CB GLU A 140 12.568 -19.560 5.013 1.00 0.00 C ATOM 2170 CG GLU A 140 13.278 -20.453 6.067 1.00 0.00 C ATOM 2171 CD GLU A 140 13.702 -21.827 5.564 1.00 0.00 C ATOM 2172 OE1 GLU A 140 14.812 -21.948 5.004 1.00 0.00 O ATOM 2173 OE2 GLU A 140 12.934 -22.794 5.749 1.00 0.00 O ATOM 0 H GLU A 140 11.568 -17.540 3.572 1.00 0.00 H new ATOM 0 HA GLU A 140 11.571 -18.340 6.502 1.00 0.00 H new ATOM 0 HB2 GLU A 140 11.717 -20.109 4.609 1.00 0.00 H new ATOM 0 HB3 GLU A 140 13.256 -19.385 4.186 1.00 0.00 H new ATOM 0 HG2 GLU A 140 14.161 -19.927 6.431 1.00 0.00 H new ATOM 0 HG3 GLU A 140 12.611 -20.584 6.919 1.00 0.00 H new ATOM 2180 N GLY A 141 12.828 -15.861 6.112 1.00 0.00 N ATOM 2181 CA GLY A 141 13.788 -14.748 6.335 1.00 0.00 C ATOM 2182 C GLY A 141 14.476 -14.263 5.040 1.00 0.00 C ATOM 2183 O GLY A 141 15.708 -14.257 4.985 1.00 0.00 O ATOM 0 H GLY A 141 11.852 -15.568 6.149 1.00 0.00 H new ATOM 0 HA2 GLY A 141 13.262 -13.911 6.794 1.00 0.00 H new ATOM 0 HA3 GLY A 141 14.550 -15.072 7.043 1.00 0.00 H new ATOM 2187 N VAL A 142 13.700 -13.829 4.026 1.00 0.00 N ATOM 2188 CA VAL A 142 14.273 -13.443 2.696 1.00 0.00 C ATOM 2189 C VAL A 142 13.837 -11.979 2.358 1.00 0.00 C ATOM 2190 O VAL A 142 14.701 -11.106 2.231 1.00 0.00 O ATOM 2191 CB VAL A 142 13.880 -14.575 1.650 1.00 0.00 C ATOM 2192 CG1 VAL A 142 12.956 -14.241 0.448 1.00 0.00 C ATOM 2193 CG2 VAL A 142 15.162 -15.095 0.954 1.00 0.00 C ATOM 0 H VAL A 142 12.686 -13.734 4.089 1.00 0.00 H new ATOM 0 HA VAL A 142 15.362 -13.403 2.680 1.00 0.00 H new ATOM 0 HB VAL A 142 13.329 -15.254 2.300 1.00 0.00 H new ATOM 0 HG11 VAL A 142 12.802 -15.138 -0.152 1.00 0.00 H new ATOM 0 HG12 VAL A 142 11.995 -13.881 0.817 1.00 0.00 H new ATOM 0 HG13 VAL A 142 13.421 -13.469 -0.165 1.00 0.00 H new ATOM 0 HG21 VAL A 142 14.897 -15.871 0.236 1.00 0.00 H new ATOM 0 HG22 VAL A 142 15.653 -14.272 0.434 1.00 0.00 H new ATOM 0 HG23 VAL A 142 15.840 -15.508 1.701 1.00 0.00 H new ATOM 2203 N MET A 143 12.529 -11.694 2.227 1.00 0.00 N ATOM 2204 CA MET A 143 12.034 -10.315 1.919 1.00 0.00 C ATOM 2205 C MET A 143 11.859 -9.453 3.226 1.00 0.00 C ATOM 2206 O MET A 143 11.647 -9.974 4.328 1.00 0.00 O ATOM 2207 CB MET A 143 10.708 -10.392 1.114 1.00 0.00 C ATOM 2208 CG MET A 143 10.725 -11.140 -0.236 1.00 0.00 C ATOM 2209 SD MET A 143 12.065 -10.557 -1.292 1.00 0.00 S ATOM 2210 CE MET A 143 11.831 -11.634 -2.715 1.00 0.00 C ATOM 0 H MET A 143 11.788 -12.388 2.327 1.00 0.00 H new ATOM 0 HA MET A 143 12.784 -9.814 1.307 1.00 0.00 H new ATOM 0 HB2 MET A 143 9.958 -10.865 1.749 1.00 0.00 H new ATOM 0 HB3 MET A 143 10.371 -9.373 0.927 1.00 0.00 H new ATOM 0 HG2 MET A 143 10.837 -12.210 -0.060 1.00 0.00 H new ATOM 0 HG3 MET A 143 9.771 -10.999 -0.744 1.00 0.00 H new ATOM 0 HE1 MET A 143 12.582 -11.406 -3.471 1.00 0.00 H new ATOM 0 HE2 MET A 143 11.932 -12.674 -2.405 1.00 0.00 H new ATOM 0 HE3 MET A 143 10.837 -11.475 -3.132 1.00 0.00 H new ATOM 2220 N VAL A 144 11.941 -8.107 3.117 1.00 0.00 N ATOM 2221 CA VAL A 144 11.850 -7.195 4.307 1.00 0.00 C ATOM 2222 C VAL A 144 10.345 -6.896 4.660 1.00 0.00 C ATOM 2223 O VAL A 144 9.716 -5.973 4.140 1.00 0.00 O ATOM 2224 CB VAL A 144 12.748 -5.926 4.059 1.00 0.00 C ATOM 2225 CG1 VAL A 144 12.427 -5.034 2.837 1.00 0.00 C ATOM 2226 CG2 VAL A 144 12.841 -5.015 5.305 1.00 0.00 C ATOM 0 H VAL A 144 12.069 -7.620 2.230 1.00 0.00 H new ATOM 0 HA VAL A 144 12.250 -7.674 5.201 1.00 0.00 H new ATOM 0 HB VAL A 144 13.701 -6.403 3.829 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.130 -4.202 2.799 1.00 0.00 H new ATOM 0 HG12 VAL A 144 12.513 -5.623 1.924 1.00 0.00 H new ATOM 0 HG13 VAL A 144 11.412 -4.648 2.925 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.472 -4.155 5.081 1.00 0.00 H new ATOM 0 HG22 VAL A 144 11.844 -4.672 5.580 1.00 0.00 H new ATOM 0 HG23 VAL A 144 13.273 -5.575 6.134 1.00 0.00 H new ATOM 2236 N THR A 145 9.779 -7.696 5.585 1.00 0.00 N ATOM 2237 CA THR A 145 8.347 -7.584 6.026 1.00 0.00 C ATOM 2238 C THR A 145 8.131 -6.847 7.400 1.00 0.00 C ATOM 2239 O THR A 145 7.212 -7.196 8.150 1.00 0.00 O ATOM 2240 CB THR A 145 7.754 -9.040 6.021 1.00 0.00 C ATOM 2241 OG1 THR A 145 6.370 -8.955 6.329 1.00 0.00 O ATOM 2242 CG2 THR A 145 8.350 -10.042 7.031 1.00 0.00 C ATOM 0 H THR A 145 10.290 -8.443 6.056 1.00 0.00 H new ATOM 0 HA THR A 145 7.815 -6.938 5.327 1.00 0.00 H new ATOM 0 HB THR A 145 7.993 -9.422 5.028 1.00 0.00 H new ATOM 0 HG1 THR A 145 6.242 -8.365 7.101 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.853 -11.006 6.923 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.417 -10.160 6.840 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.202 -9.669 8.044 1.00 0.00 H new ATOM 2250 N LYS A 146 8.934 -5.816 7.709 1.00 0.00 N ATOM 2251 CA LYS A 146 8.796 -5.011 8.959 1.00 0.00 C ATOM 2252 C LYS A 146 8.933 -3.500 8.594 1.00 0.00 C ATOM 2253 O LYS A 146 10.012 -2.913 8.722 1.00 0.00 O ATOM 2254 CB LYS A 146 9.865 -5.452 10.001 1.00 0.00 C ATOM 2255 CG LYS A 146 9.662 -6.855 10.624 1.00 0.00 C ATOM 2256 CD LYS A 146 10.640 -7.181 11.773 1.00 0.00 C ATOM 2257 CE LYS A 146 12.099 -7.393 11.319 1.00 0.00 C ATOM 2258 NZ LYS A 146 12.952 -7.708 12.497 1.00 0.00 N ATOM 0 H LYS A 146 9.699 -5.508 7.109 1.00 0.00 H new ATOM 0 HA LYS A 146 7.818 -5.175 9.412 1.00 0.00 H new ATOM 0 HB2 LYS A 146 10.844 -5.426 9.522 1.00 0.00 H new ATOM 0 HB3 LYS A 146 9.885 -4.717 10.806 1.00 0.00 H new ATOM 0 HG2 LYS A 146 8.641 -6.931 10.998 1.00 0.00 H new ATOM 0 HG3 LYS A 146 9.772 -7.607 9.843 1.00 0.00 H new ATOM 0 HD2 LYS A 146 10.612 -6.370 12.501 1.00 0.00 H new ATOM 0 HD3 LYS A 146 10.296 -8.080 12.284 1.00 0.00 H new ATOM 0 HE2 LYS A 146 12.150 -8.205 10.594 1.00 0.00 H new ATOM 0 HE3 LYS A 146 12.468 -6.497 10.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 13.934 -7.850 12.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 12.914 -6.920 13.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 12.605 -8.575 12.955 1.00 0.00 H new ATOM 2272 N PHE A 147 7.830 -2.860 8.171 1.00 0.00 N ATOM 2273 CA PHE A 147 7.854 -1.423 7.757 1.00 0.00 C ATOM 2274 C PHE A 147 7.341 -0.512 8.907 1.00 0.00 C ATOM 2275 O PHE A 147 6.253 -0.738 9.441 1.00 0.00 O ATOM 2276 CB PHE A 147 6.956 -1.196 6.507 1.00 0.00 C ATOM 2277 CG PHE A 147 7.239 -2.046 5.261 1.00 0.00 C ATOM 2278 CD1 PHE A 147 8.385 -1.825 4.490 1.00 0.00 C ATOM 2279 CD2 PHE A 147 6.332 -3.042 4.882 1.00 0.00 C ATOM 2280 CE1 PHE A 147 8.626 -2.602 3.360 1.00 0.00 C ATOM 2281 CE2 PHE A 147 6.571 -3.809 3.747 1.00 0.00 C ATOM 2282 CZ PHE A 147 7.720 -3.593 2.994 1.00 0.00 C ATOM 0 H PHE A 147 6.912 -3.299 8.102 1.00 0.00 H new ATOM 0 HA PHE A 147 8.886 -1.167 7.519 1.00 0.00 H new ATOM 0 HB2 PHE A 147 5.921 -1.368 6.802 1.00 0.00 H new ATOM 0 HB3 PHE A 147 7.036 -0.147 6.223 1.00 0.00 H new ATOM 0 HD1 PHE A 147 9.084 -1.051 4.771 1.00 0.00 H new ATOM 0 HD2 PHE A 147 5.444 -3.215 5.472 1.00 0.00 H new ATOM 0 HE1 PHE A 147 9.514 -2.436 2.769 1.00 0.00 H new ATOM 0 HE2 PHE A 147 5.865 -4.571 3.451 1.00 0.00 H new ATOM 0 HZ PHE A 147 7.910 -4.198 2.120 1.00 0.00 H new ATOM 2292 N TYR A 148 8.094 0.539 9.264 1.00 0.00 N ATOM 2293 CA TYR A 148 7.728 1.462 10.365 1.00 0.00 C ATOM 2294 C TYR A 148 6.595 2.446 9.905 1.00 0.00 C ATOM 2295 O TYR A 148 6.674 3.153 8.893 1.00 0.00 O ATOM 2296 CB TYR A 148 9.015 2.194 10.831 1.00 0.00 C ATOM 2297 CG TYR A 148 8.911 2.754 12.258 1.00 0.00 C ATOM 2298 CD1 TYR A 148 9.242 1.940 13.348 1.00 0.00 C ATOM 2299 CD2 TYR A 148 8.455 4.056 12.490 1.00 0.00 C ATOM 2300 CE1 TYR A 148 9.125 2.423 14.649 1.00 0.00 C ATOM 2301 CE2 TYR A 148 8.336 4.535 13.793 1.00 0.00 C ATOM 2302 CZ TYR A 148 8.670 3.718 14.870 1.00 0.00 C ATOM 2303 OH TYR A 148 8.550 4.185 16.150 1.00 0.00 O ATOM 0 H TYR A 148 8.972 0.778 8.804 1.00 0.00 H new ATOM 0 HA TYR A 148 7.319 0.913 11.213 1.00 0.00 H new ATOM 0 HB2 TYR A 148 9.857 1.503 10.779 1.00 0.00 H new ATOM 0 HB3 TYR A 148 9.230 3.011 10.142 1.00 0.00 H new ATOM 0 HD1 TYR A 148 9.590 0.932 13.179 1.00 0.00 H new ATOM 0 HD2 TYR A 148 8.194 4.692 11.657 1.00 0.00 H new ATOM 0 HE1 TYR A 148 9.387 1.792 15.485 1.00 0.00 H new ATOM 0 HE2 TYR A 148 7.984 5.541 13.968 1.00 0.00 H new ATOM 0 HH TYR A 148 8.221 5.108 16.132 1.00 0.00 H new ATOM 2313 N PHE A 149 5.529 2.416 10.708 1.00 0.00 N ATOM 2314 CA PHE A 149 4.247 3.131 10.486 1.00 0.00 C ATOM 2315 C PHE A 149 4.287 4.651 10.866 1.00 0.00 C ATOM 2316 O PHE A 149 4.547 4.980 12.027 1.00 0.00 O ATOM 2317 CB PHE A 149 3.309 2.246 11.395 1.00 0.00 C ATOM 2318 CG PHE A 149 1.818 2.562 11.616 1.00 0.00 C ATOM 2319 CD1 PHE A 149 1.435 3.667 12.387 1.00 0.00 C ATOM 2320 CD2 PHE A 149 0.840 1.639 11.219 1.00 0.00 C ATOM 2321 CE1 PHE A 149 0.097 3.869 12.714 1.00 0.00 C ATOM 2322 CE2 PHE A 149 -0.498 1.848 11.544 1.00 0.00 C ATOM 2323 CZ PHE A 149 -0.870 2.966 12.285 1.00 0.00 C ATOM 0 H PHE A 149 5.524 1.872 11.571 1.00 0.00 H new ATOM 0 HA PHE A 149 3.931 3.209 9.446 1.00 0.00 H new ATOM 0 HB2 PHE A 149 3.355 1.233 10.994 1.00 0.00 H new ATOM 0 HB3 PHE A 149 3.770 2.219 12.382 1.00 0.00 H new ATOM 0 HD1 PHE A 149 2.183 4.367 12.730 1.00 0.00 H new ATOM 0 HD2 PHE A 149 1.126 0.761 10.658 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -0.191 4.728 13.302 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -1.248 1.142 11.221 1.00 0.00 H new ATOM 0 HZ PHE A 149 -1.909 3.132 12.527 1.00 0.00 H new ATOM 2333 N GLN A 150 3.993 5.570 9.918 1.00 0.00 N ATOM 2334 CA GLN A 150 3.981 7.040 10.197 1.00 0.00 C ATOM 2335 C GLN A 150 2.622 7.689 9.755 1.00 0.00 C ATOM 2336 O GLN A 150 2.434 8.070 8.593 1.00 0.00 O ATOM 2337 CB GLN A 150 5.178 7.737 9.474 1.00 0.00 C ATOM 2338 CG GLN A 150 6.614 7.444 9.991 1.00 0.00 C ATOM 2339 CD GLN A 150 6.893 7.801 11.457 1.00 0.00 C ATOM 2340 OE1 GLN A 150 6.742 6.983 12.355 1.00 0.00 O ATOM 2341 NE2 GLN A 150 7.313 8.996 11.787 1.00 0.00 N ATOM 0 H GLN A 150 3.761 5.329 8.954 1.00 0.00 H new ATOM 0 HA GLN A 150 4.087 7.182 11.273 1.00 0.00 H new ATOM 0 HB2 GLN A 150 5.139 7.459 8.421 1.00 0.00 H new ATOM 0 HB3 GLN A 150 5.018 8.814 9.526 1.00 0.00 H new ATOM 0 HG2 GLN A 150 6.818 6.382 9.852 1.00 0.00 H new ATOM 0 HG3 GLN A 150 7.321 7.989 9.365 1.00 0.00 H new ATOM 0 HE21 GLN A 150 7.451 9.705 11.067 1.00 0.00 H new ATOM 0 HE22 GLN A 150 7.502 9.218 12.764 1.00 0.00 H new ATOM 2350 N GLU A 151 1.695 7.863 10.715 1.00 0.00 N ATOM 2351 CA GLU A 151 0.393 8.565 10.490 1.00 0.00 C ATOM 2352 C GLU A 151 0.487 10.115 10.730 1.00 0.00 C ATOM 2353 O GLU A 151 1.112 10.570 11.692 1.00 0.00 O ATOM 2354 CB GLU A 151 -0.683 7.898 11.396 1.00 0.00 C ATOM 2355 CG GLU A 151 -0.590 8.049 12.940 1.00 0.00 C ATOM 2356 CD GLU A 151 -1.538 7.151 13.731 1.00 0.00 C ATOM 2357 OE1 GLU A 151 -2.715 6.989 13.345 1.00 0.00 O ATOM 2358 OE2 GLU A 151 -1.091 6.593 14.755 1.00 0.00 O ATOM 0 H GLU A 151 1.816 7.526 11.670 1.00 0.00 H new ATOM 0 HA GLU A 151 0.110 8.460 9.443 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -1.654 8.287 11.089 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -0.681 6.831 11.172 1.00 0.00 H new ATOM 0 HG2 GLU A 151 0.433 7.836 13.251 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -0.793 9.087 13.202 1.00 0.00 H new ATOM 2365 N ASP A 152 -0.125 10.912 9.821 1.00 0.00 N ATOM 2366 CA ASP A 152 -0.160 12.416 9.851 1.00 0.00 C ATOM 2367 C ASP A 152 1.250 13.090 10.073 1.00 0.00 C ATOM 2368 O ASP A 152 1.580 13.576 11.161 1.00 0.00 O ATOM 2369 CB ASP A 152 -1.234 12.879 10.887 1.00 0.00 C ATOM 2370 CG ASP A 152 -2.690 12.767 10.416 1.00 0.00 C ATOM 2371 OD1 ASP A 152 -3.053 13.444 9.429 1.00 0.00 O ATOM 2372 OD2 ASP A 152 -3.475 12.022 11.039 1.00 0.00 O ATOM 0 H ASP A 152 -0.625 10.527 9.020 1.00 0.00 H new ATOM 0 HA ASP A 152 -0.450 12.765 8.860 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -1.117 12.288 11.796 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -1.034 13.917 11.153 1.00 0.00 H new ATOM 2377 N GLU A 153 2.072 13.123 9.005 1.00 0.00 N ATOM 2378 CA GLU A 153 3.446 13.694 9.039 1.00 0.00 C ATOM 2379 C GLU A 153 3.729 14.438 7.697 1.00 0.00 C ATOM 2380 O GLU A 153 3.819 13.800 6.614 1.00 0.00 O ATOM 2381 CB GLU A 153 4.429 12.521 9.331 1.00 0.00 C ATOM 2382 CG GLU A 153 5.924 12.910 9.489 1.00 0.00 C ATOM 2383 CD GLU A 153 6.885 11.732 9.446 1.00 0.00 C ATOM 2384 OE1 GLU A 153 7.013 11.112 8.365 1.00 0.00 O ATOM 2385 OE2 GLU A 153 7.522 11.421 10.470 1.00 0.00 O ATOM 2386 OXT GLU A 153 3.900 15.677 7.729 1.00 0.00 O ATOM 0 H GLU A 153 1.808 12.756 8.091 1.00 0.00 H new ATOM 0 HA GLU A 153 3.571 14.439 9.825 1.00 0.00 H new ATOM 0 HB2 GLU A 153 4.106 12.021 10.244 1.00 0.00 H new ATOM 0 HB3 GLU A 153 4.347 11.794 8.523 1.00 0.00 H new ATOM 0 HG2 GLU A 153 6.191 13.610 8.698 1.00 0.00 H new ATOM 0 HG3 GLU A 153 6.053 13.435 10.436 1.00 0.00 H new