USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1022 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 28 TYR OH : rot 80:sc= 0.53 USER MOD Set 1.2: A 47 SER OG : rot -134:sc= 1.65 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot -19:sc= 0.656 USER MOD Single : A 20 HIS : no HD1:sc= -0.205 X(o=-0.2,f=-0.14) USER MOD Single : A 21 MET CE :methyl 174:sc= -1.11 (180deg=-1.3) USER MOD Single : A 30 THR OG1 : rot -150:sc= 0.0598 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.177 X(o=-0.18,f=-0.18) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -5.63! C(o=-5.6!,f=-8.4!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 154:sc= -2.06 (180deg=-3.96!) USER MOD Single : A 44 TYR OH : rot 53:sc= 1.29 USER MOD Single : A 48 SER OG : rot -116:sc= -0.45 USER MOD Single : A 52 THR OG1 : rot 26:sc= 0.338 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 130:sc= -0.35 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.202 X(o=-0.2,f=-0.027) USER MOD Single : A 63 LYS NZ :NH3+ -167:sc= -1.22 (180deg=-1.45) USER MOD Single : A 65 ASN : amide:sc= 0.18 X(o=0.18,f=-0.043) USER MOD Single : A 67 TYR OH : rot -34:sc= 0.1! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -167:sc= -0.0331 (180deg=-0.0928) USER MOD Single : A 72 HIS : no HD1:sc= -0.155 X(o=-0.15,f=-0.29) USER MOD Single : A 75 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00099) USER MOD Single : A 81 GLN : amide:sc= -0.888 K(o=-0.89,f=-0.35) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -6.08! C(o=-6.1!,f=-5.6!) USER MOD Single : A 100 MET CE :methyl -145:sc= -3.1 (180deg=-4.56!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl -113:sc= -1.51 (180deg=-5.87!) USER MOD Single : A 112 THR OG1 : rot -43:sc= 0.534 USER MOD Single : A 113 MET CE :methyl -141:sc= -1.48 (180deg=-4.69!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -0.579 X(o=-0.58,f=-0.69) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.0944 USER MOD Single : A 123 THR OG1 : rot 54:sc= 0.225 USER MOD Single : A 127 LYS NZ :NH3+ 175:sc= -1.4 (180deg=-1.49) USER MOD Single : A 132 ASN : amide:sc= -0.942 K(o=-0.94,f=-1.7) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0.015 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 4.422 2.702 -1.318 1.00 44.35 N ATOM 2 CA SER A 12 4.929 1.757 -0.330 1.00 11.50 C ATOM 3 C SER A 12 4.036 0.523 -0.251 1.00 63.34 C ATOM 4 O SER A 12 2.815 0.617 -0.367 1.00 42.23 O ATOM 5 CB SER A 12 5.019 2.424 1.044 1.00 21.12 C ATOM 6 OG SER A 12 3.857 2.167 1.813 1.00 54.02 O ATOM 0 HA SER A 12 5.926 1.444 -0.640 1.00 11.50 H new ATOM 0 HB2 SER A 12 5.898 2.056 1.573 1.00 21.12 H new ATOM 0 HB3 SER A 12 5.147 3.499 0.922 1.00 21.12 H new ATOM 0 HG SER A 12 3.940 2.603 2.687 1.00 54.02 H new ATOM 12 N GLY A 13 4.657 -0.637 -0.053 1.00 55.33 N ATOM 13 CA GLY A 13 3.904 -1.874 0.037 1.00 22.44 C ATOM 14 C GLY A 13 4.730 -3.015 0.598 1.00 20.03 C ATOM 15 O GLY A 13 5.846 -2.807 1.077 1.00 13.12 O ATOM 0 H GLY A 13 5.667 -0.741 0.046 1.00 55.33 H new ATOM 0 HA2 GLY A 13 3.029 -1.718 0.668 1.00 22.44 H new ATOM 0 HA3 GLY A 13 3.539 -2.146 -0.953 1.00 22.44 H new ATOM 19 N LEU A 14 4.182 -4.224 0.541 1.00 11.24 N ATOM 20 CA LEU A 14 4.875 -5.403 1.050 1.00 52.35 C ATOM 21 C LEU A 14 4.764 -6.565 0.068 1.00 54.10 C ATOM 22 O LEU A 14 3.838 -7.373 0.148 1.00 2.14 O ATOM 23 CB LEU A 14 4.301 -5.810 2.407 1.00 34.34 C ATOM 24 CG LEU A 14 5.120 -6.825 3.205 1.00 32.43 C ATOM 25 CD1 LEU A 14 5.740 -6.168 4.428 1.00 14.15 C ATOM 26 CD2 LEU A 14 4.253 -8.007 3.615 1.00 74.04 C ATOM 0 H LEU A 14 3.260 -4.414 0.148 1.00 11.24 H new ATOM 0 HA LEU A 14 5.929 -5.152 1.170 1.00 52.35 H new ATOM 0 HB2 LEU A 14 4.183 -4.912 3.013 1.00 34.34 H new ATOM 0 HB3 LEU A 14 3.304 -6.221 2.249 1.00 34.34 H new ATOM 0 HG LEU A 14 5.925 -7.193 2.569 1.00 32.43 H new ATOM 0 HD11 LEU A 14 6.319 -6.906 4.983 1.00 14.15 H new ATOM 0 HD12 LEU A 14 6.395 -5.356 4.112 1.00 14.15 H new ATOM 0 HD13 LEU A 14 4.951 -5.770 5.067 1.00 14.15 H new ATOM 0 HD21 LEU A 14 4.853 -8.719 4.182 1.00 74.04 H new ATOM 0 HD22 LEU A 14 3.427 -7.655 4.233 1.00 74.04 H new ATOM 0 HD23 LEU A 14 3.857 -8.494 2.724 1.00 74.04 H new ATOM 38 N VAL A 15 5.714 -6.644 -0.858 1.00 24.23 N ATOM 39 CA VAL A 15 5.725 -7.710 -1.853 1.00 43.50 C ATOM 40 C VAL A 15 5.646 -9.081 -1.191 1.00 41.34 C ATOM 41 O VAL A 15 6.380 -9.388 -0.252 1.00 3.41 O ATOM 42 CB VAL A 15 6.991 -7.647 -2.729 1.00 10.44 C ATOM 43 CG1 VAL A 15 7.071 -8.862 -3.640 1.00 10.30 C ATOM 44 CG2 VAL A 15 7.014 -6.359 -3.539 1.00 61.51 C ATOM 0 H VAL A 15 6.486 -5.983 -0.940 1.00 24.23 H new ATOM 0 HA VAL A 15 4.848 -7.563 -2.483 1.00 43.50 H new ATOM 0 HB VAL A 15 7.864 -7.655 -2.077 1.00 10.44 H new ATOM 0 HG11 VAL A 15 7.971 -8.800 -4.251 1.00 10.30 H new ATOM 0 HG12 VAL A 15 7.104 -9.768 -3.036 1.00 10.30 H new ATOM 0 HG13 VAL A 15 6.195 -8.890 -4.287 1.00 10.30 H new ATOM 0 HG21 VAL A 15 7.915 -6.331 -4.152 1.00 61.51 H new ATOM 0 HG22 VAL A 15 6.135 -6.318 -4.183 1.00 61.51 H new ATOM 0 HG23 VAL A 15 7.008 -5.504 -2.863 1.00 61.51 H new ATOM 54 N PRO A 16 4.734 -9.927 -1.692 1.00 20.32 N ATOM 55 CA PRO A 16 4.537 -11.281 -1.165 1.00 24.10 C ATOM 56 C PRO A 16 5.710 -12.203 -1.482 1.00 2.40 C ATOM 57 O PRO A 16 6.185 -12.938 -0.617 1.00 22.23 O ATOM 58 CB PRO A 16 3.272 -11.760 -1.881 1.00 62.12 C ATOM 59 CG PRO A 16 3.228 -10.968 -3.142 1.00 71.22 C ATOM 60 CD PRO A 16 3.825 -9.628 -2.811 1.00 71.40 C ATOM 0 HA PRO A 16 4.456 -11.287 -0.078 1.00 24.10 H new ATOM 0 HB2 PRO A 16 3.314 -12.830 -2.087 1.00 62.12 H new ATOM 0 HB3 PRO A 16 2.384 -11.587 -1.274 1.00 62.12 H new ATOM 0 HG2 PRO A 16 3.792 -11.462 -3.933 1.00 71.22 H new ATOM 0 HG3 PRO A 16 2.204 -10.861 -3.500 1.00 71.22 H new ATOM 0 HD2 PRO A 16 4.360 -9.205 -3.661 1.00 71.40 H new ATOM 0 HD3 PRO A 16 3.060 -8.906 -2.525 1.00 71.40 H new ATOM 68 N ARG A 17 6.173 -12.157 -2.727 1.00 51.10 N ATOM 69 CA ARG A 17 7.290 -12.989 -3.158 1.00 1.42 C ATOM 70 C ARG A 17 7.011 -14.462 -2.878 1.00 34.34 C ATOM 71 O ARG A 17 5.924 -14.824 -2.429 1.00 74.22 O ATOM 72 CB ARG A 17 8.576 -12.559 -2.450 1.00 3.13 C ATOM 73 CG ARG A 17 9.616 -11.963 -3.384 1.00 50.54 C ATOM 74 CD ARG A 17 10.421 -13.045 -4.086 1.00 75.33 C ATOM 75 NE ARG A 17 11.147 -13.888 -3.140 1.00 13.00 N ATOM 76 CZ ARG A 17 11.932 -14.895 -3.505 1.00 72.32 C ATOM 77 NH1 ARG A 17 12.092 -15.184 -4.789 1.00 53.54 N ATOM 78 NH2 ARG A 17 12.559 -15.616 -2.585 1.00 24.31 N ATOM 0 H ARG A 17 5.792 -11.552 -3.455 1.00 51.10 H new ATOM 0 HA ARG A 17 7.414 -12.859 -4.233 1.00 1.42 H new ATOM 0 HB2 ARG A 17 8.330 -11.828 -1.680 1.00 3.13 H new ATOM 0 HB3 ARG A 17 9.008 -13.422 -1.943 1.00 3.13 H new ATOM 0 HG2 ARG A 17 9.123 -11.336 -4.127 1.00 50.54 H new ATOM 0 HG3 ARG A 17 10.288 -11.318 -2.818 1.00 50.54 H new ATOM 0 HD2 ARG A 17 9.752 -13.664 -4.684 1.00 75.33 H new ATOM 0 HD3 ARG A 17 11.127 -12.582 -4.775 1.00 75.33 H new ATOM 0 HE ARG A 17 11.046 -13.693 -2.144 1.00 13.00 H new ATOM 0 HH11 ARG A 17 11.611 -14.632 -5.500 1.00 53.54 H new ATOM 0 HH12 ARG A 17 12.696 -15.958 -5.066 1.00 53.54 H new ATOM 0 HH21 ARG A 17 12.438 -15.397 -1.596 1.00 24.31 H new ATOM 0 HH22 ARG A 17 13.162 -16.389 -2.866 1.00 24.31 H new ATOM 92 N GLY A 18 8.000 -15.309 -3.146 1.00 42.22 N ATOM 93 CA GLY A 18 7.841 -16.733 -2.918 1.00 12.04 C ATOM 94 C GLY A 18 7.892 -17.093 -1.446 1.00 74.20 C ATOM 95 O GLY A 18 7.460 -18.176 -1.050 1.00 11.32 O ATOM 0 H GLY A 18 8.909 -15.034 -3.517 1.00 42.22 H new ATOM 0 HA2 GLY A 18 6.889 -17.061 -3.336 1.00 12.04 H new ATOM 0 HA3 GLY A 18 8.625 -17.273 -3.448 1.00 12.04 H new ATOM 99 N SER A 19 8.422 -16.184 -0.634 1.00 31.51 N ATOM 100 CA SER A 19 8.533 -16.414 0.802 1.00 72.31 C ATOM 101 C SER A 19 8.675 -15.094 1.554 1.00 70.51 C ATOM 102 O SER A 19 9.258 -15.044 2.638 1.00 52.34 O ATOM 103 CB SER A 19 9.730 -17.318 1.104 1.00 33.01 C ATOM 104 OG SER A 19 9.638 -18.540 0.393 1.00 64.23 O ATOM 0 H SER A 19 8.781 -15.282 -0.946 1.00 31.51 H new ATOM 0 HA SER A 19 7.621 -16.907 1.138 1.00 72.31 H new ATOM 0 HB2 SER A 19 10.654 -16.806 0.835 1.00 33.01 H new ATOM 0 HB3 SER A 19 9.777 -17.519 2.174 1.00 33.01 H new ATOM 0 HG SER A 19 8.711 -18.686 0.112 1.00 64.23 H new ATOM 110 N HIS A 20 8.138 -14.027 0.971 1.00 60.53 N ATOM 111 CA HIS A 20 8.204 -12.706 1.585 1.00 72.20 C ATOM 112 C HIS A 20 9.638 -12.357 1.970 1.00 43.34 C ATOM 113 O HIS A 20 9.877 -11.710 2.989 1.00 45.22 O ATOM 114 CB HIS A 20 7.304 -12.649 2.820 1.00 60.22 C ATOM 115 CG HIS A 20 5.960 -13.277 2.611 1.00 24.13 C ATOM 116 ND1 HIS A 20 4.821 -12.547 2.347 1.00 41.40 N ATOM 117 CD2 HIS A 20 5.578 -14.575 2.628 1.00 73.44 C ATOM 118 CE1 HIS A 20 3.795 -13.368 2.212 1.00 65.24 C ATOM 119 NE2 HIS A 20 4.228 -14.605 2.377 1.00 71.22 N ATOM 0 H HIS A 20 7.652 -14.051 0.074 1.00 60.53 H new ATOM 0 HA HIS A 20 7.854 -11.976 0.856 1.00 72.20 H new ATOM 0 HB2 HIS A 20 7.805 -13.150 3.648 1.00 60.22 H new ATOM 0 HB3 HIS A 20 7.168 -11.608 3.113 1.00 60.22 H new ATOM 0 HD2 HIS A 20 6.216 -15.428 2.806 1.00 73.44 H new ATOM 0 HE1 HIS A 20 2.776 -13.077 2.002 1.00 65.24 H new ATOM 0 HE2 HIS A 20 3.653 -15.446 2.326 1.00 71.22 H new ATOM 127 N MET A 21 10.589 -12.790 1.148 1.00 55.13 N ATOM 128 CA MET A 21 11.999 -12.522 1.402 1.00 22.14 C ATOM 129 C MET A 21 12.404 -11.161 0.844 1.00 34.31 C ATOM 130 O MET A 21 13.575 -10.785 0.887 1.00 60.14 O ATOM 131 CB MET A 21 12.868 -13.619 0.784 1.00 43.20 C ATOM 132 CG MET A 21 12.507 -15.018 1.254 1.00 33.33 C ATOM 133 SD MET A 21 13.394 -15.500 2.748 1.00 64.21 S ATOM 134 CE MET A 21 12.139 -16.458 3.594 1.00 40.42 C ATOM 0 H MET A 21 10.408 -13.328 0.300 1.00 55.13 H new ATOM 0 HA MET A 21 12.152 -12.512 2.481 1.00 22.14 H new ATOM 0 HB2 MET A 21 12.777 -13.575 -0.301 1.00 43.20 H new ATOM 0 HB3 MET A 21 13.913 -13.422 1.025 1.00 43.20 H new ATOM 0 HG2 MET A 21 11.434 -15.069 1.441 1.00 33.33 H new ATOM 0 HG3 MET A 21 12.726 -15.732 0.460 1.00 33.33 H new ATOM 0 HE1 MET A 21 12.569 -16.914 4.486 1.00 40.42 H new ATOM 0 HE2 MET A 21 11.315 -15.805 3.882 1.00 40.42 H new ATOM 0 HE3 MET A 21 11.768 -17.239 2.930 1.00 40.42 H new ATOM 144 N VAL A 22 11.427 -10.427 0.321 1.00 72.23 N ATOM 145 CA VAL A 22 11.681 -9.108 -0.245 1.00 43.13 C ATOM 146 C VAL A 22 10.525 -8.156 0.038 1.00 13.12 C ATOM 147 O VAL A 22 9.383 -8.584 0.210 1.00 41.34 O ATOM 148 CB VAL A 22 11.908 -9.184 -1.767 1.00 31.02 C ATOM 149 CG1 VAL A 22 12.598 -7.924 -2.268 1.00 32.42 C ATOM 150 CG2 VAL A 22 12.716 -10.422 -2.123 1.00 65.33 C ATOM 0 H VAL A 22 10.452 -10.724 0.278 1.00 72.23 H new ATOM 0 HA VAL A 22 12.585 -8.729 0.231 1.00 43.13 H new ATOM 0 HB VAL A 22 10.938 -9.257 -2.259 1.00 31.02 H new ATOM 0 HG11 VAL A 22 12.750 -7.996 -3.345 1.00 32.42 H new ATOM 0 HG12 VAL A 22 11.977 -7.056 -2.046 1.00 32.42 H new ATOM 0 HG13 VAL A 22 13.563 -7.816 -1.772 1.00 32.42 H new ATOM 0 HG21 VAL A 22 12.867 -10.460 -3.202 1.00 65.33 H new ATOM 0 HG22 VAL A 22 13.683 -10.382 -1.622 1.00 65.33 H new ATOM 0 HG23 VAL A 22 12.178 -11.313 -1.800 1.00 65.33 H new ATOM 160 N ARG A 23 10.828 -6.863 0.086 1.00 51.23 N ATOM 161 CA ARG A 23 9.813 -5.849 0.349 1.00 24.41 C ATOM 162 C ARG A 23 10.222 -4.504 -0.244 1.00 71.21 C ATOM 163 O ARG A 23 11.408 -4.187 -0.329 1.00 3.42 O ATOM 164 CB ARG A 23 9.584 -5.706 1.855 1.00 71.42 C ATOM 165 CG ARG A 23 10.581 -4.785 2.538 1.00 21.11 C ATOM 166 CD ARG A 23 10.347 -4.727 4.040 1.00 44.44 C ATOM 167 NE ARG A 23 11.589 -4.881 4.793 1.00 11.52 N ATOM 168 CZ ARG A 23 12.266 -6.021 4.869 1.00 13.04 C ATOM 169 NH1 ARG A 23 11.824 -7.101 4.241 1.00 75.41 N ATOM 170 NH2 ARG A 23 13.388 -6.082 5.575 1.00 33.12 N ATOM 0 H ARG A 23 11.768 -6.492 -0.054 1.00 51.23 H new ATOM 0 HA ARG A 23 8.885 -6.168 -0.125 1.00 24.41 H new ATOM 0 HB2 ARG A 23 8.576 -5.328 2.026 1.00 71.42 H new ATOM 0 HB3 ARG A 23 9.637 -6.692 2.317 1.00 71.42 H new ATOM 0 HG2 ARG A 23 11.595 -5.133 2.340 1.00 21.11 H new ATOM 0 HG3 ARG A 23 10.500 -3.783 2.117 1.00 21.11 H new ATOM 0 HD2 ARG A 23 9.882 -3.776 4.298 1.00 44.44 H new ATOM 0 HD3 ARG A 23 9.648 -5.512 4.329 1.00 44.44 H new ATOM 0 HE ARG A 23 11.957 -4.068 5.288 1.00 11.52 H new ATOM 0 HH11 ARG A 23 10.962 -7.058 3.698 1.00 75.41 H new ATOM 0 HH12 ARG A 23 12.346 -7.975 4.301 1.00 75.41 H new ATOM 0 HH21 ARG A 23 13.731 -5.253 6.060 1.00 33.12 H new ATOM 0 HH22 ARG A 23 13.907 -6.958 5.633 1.00 33.12 H new ATOM 184 N ARG A 24 9.231 -3.719 -0.654 1.00 3.45 N ATOM 185 CA ARG A 24 9.488 -2.409 -1.240 1.00 55.23 C ATOM 186 C ARG A 24 9.943 -1.415 -0.175 1.00 74.51 C ATOM 187 O ARG A 24 9.159 -0.590 0.293 1.00 61.00 O ATOM 188 CB ARG A 24 8.231 -1.885 -1.938 1.00 44.55 C ATOM 189 CG ARG A 24 7.472 -2.952 -2.708 1.00 72.54 C ATOM 190 CD ARG A 24 6.823 -2.382 -3.959 1.00 54.34 C ATOM 191 NE ARG A 24 5.397 -2.130 -3.770 1.00 14.12 N ATOM 192 CZ ARG A 24 4.578 -1.763 -4.750 1.00 4.11 C ATOM 193 NH1 ARG A 24 5.043 -1.606 -5.982 1.00 33.22 N ATOM 194 NH2 ARG A 24 3.293 -1.552 -4.499 1.00 34.55 N ATOM 0 H ARG A 24 8.244 -3.967 -0.591 1.00 3.45 H new ATOM 0 HA ARG A 24 10.286 -2.518 -1.974 1.00 55.23 H new ATOM 0 HB2 ARG A 24 7.568 -1.446 -1.192 1.00 44.55 H new ATOM 0 HB3 ARG A 24 8.513 -1.086 -2.623 1.00 44.55 H new ATOM 0 HG2 ARG A 24 8.154 -3.756 -2.985 1.00 72.54 H new ATOM 0 HG3 ARG A 24 6.707 -3.389 -2.067 1.00 72.54 H new ATOM 0 HD2 ARG A 24 7.322 -1.453 -4.235 1.00 54.34 H new ATOM 0 HD3 ARG A 24 6.962 -3.076 -4.788 1.00 54.34 H new ATOM 0 HE ARG A 24 5.008 -2.242 -2.834 1.00 14.12 H new ATOM 0 HH11 ARG A 24 6.031 -1.767 -6.179 1.00 33.22 H new ATOM 0 HH12 ARG A 24 4.413 -1.324 -6.733 1.00 33.22 H new ATOM 0 HH21 ARG A 24 2.932 -1.671 -3.553 1.00 34.55 H new ATOM 0 HH22 ARG A 24 2.666 -1.270 -5.252 1.00 34.55 H new ATOM 208 N ALA A 25 11.214 -1.502 0.203 1.00 34.42 N ATOM 209 CA ALA A 25 11.773 -0.611 1.211 1.00 1.25 C ATOM 210 C ALA A 25 12.646 0.463 0.571 1.00 0.11 C ATOM 211 O ALA A 25 13.007 0.365 -0.602 1.00 11.12 O ATOM 212 CB ALA A 25 12.574 -1.405 2.232 1.00 21.24 C ATOM 0 H ALA A 25 11.876 -2.181 -0.174 1.00 34.42 H new ATOM 0 HA ALA A 25 10.946 -0.115 1.720 1.00 1.25 H new ATOM 0 HB1 ALA A 25 12.986 -0.726 2.979 1.00 21.24 H new ATOM 0 HB2 ALA A 25 11.923 -2.131 2.720 1.00 21.24 H new ATOM 0 HB3 ALA A 25 13.388 -1.928 1.729 1.00 21.24 H new ATOM 218 N ARG A 26 12.981 1.488 1.348 1.00 23.33 N ATOM 219 CA ARG A 26 13.810 2.581 0.856 1.00 44.13 C ATOM 220 C ARG A 26 15.177 2.069 0.411 1.00 42.04 C ATOM 221 O ARG A 26 15.438 0.866 0.429 1.00 34.44 O ATOM 222 CB ARG A 26 13.982 3.648 1.939 1.00 74.31 C ATOM 223 CG ARG A 26 13.789 5.067 1.432 1.00 54.44 C ATOM 224 CD ARG A 26 12.745 5.814 2.248 1.00 22.22 C ATOM 225 NE ARG A 26 13.059 5.807 3.674 1.00 1.35 N ATOM 226 CZ ARG A 26 12.314 6.411 4.594 1.00 42.34 C ATOM 227 NH1 ARG A 26 11.218 7.066 4.238 1.00 53.04 N ATOM 228 NH2 ARG A 26 12.665 6.361 5.872 1.00 25.52 N ATOM 0 H ARG A 26 12.691 1.584 2.321 1.00 23.33 H new ATOM 0 HA ARG A 26 13.309 3.024 -0.004 1.00 44.13 H new ATOM 0 HB2 ARG A 26 13.269 3.458 2.741 1.00 74.31 H new ATOM 0 HB3 ARG A 26 14.979 3.558 2.371 1.00 74.31 H new ATOM 0 HG2 ARG A 26 14.738 5.602 1.476 1.00 54.44 H new ATOM 0 HG3 ARG A 26 13.485 5.042 0.386 1.00 54.44 H new ATOM 0 HD2 ARG A 26 12.678 6.844 1.896 1.00 22.22 H new ATOM 0 HD3 ARG A 26 11.767 5.359 2.090 1.00 22.22 H new ATOM 0 HE ARG A 26 13.896 5.311 3.981 1.00 1.35 H new ATOM 0 HH11 ARG A 26 10.945 7.107 3.256 1.00 53.04 H new ATOM 0 HH12 ARG A 26 10.648 7.529 4.946 1.00 53.04 H new ATOM 0 HH21 ARG A 26 13.508 5.858 6.150 1.00 25.52 H new ATOM 0 HH22 ARG A 26 12.092 6.825 6.577 1.00 25.52 H new ATOM 242 N CYS A 27 16.047 2.991 0.010 1.00 73.51 N ATOM 243 CA CYS A 27 17.386 2.634 -0.441 1.00 63.31 C ATOM 244 C CYS A 27 18.291 3.862 -0.483 1.00 23.32 C ATOM 245 O CYS A 27 18.040 4.806 -1.232 1.00 63.34 O ATOM 246 CB CYS A 27 17.325 1.985 -1.825 1.00 61.52 C ATOM 247 SG CYS A 27 18.359 0.494 -1.994 1.00 3.41 S ATOM 0 H CYS A 27 15.848 3.991 -0.011 1.00 73.51 H new ATOM 0 HA CYS A 27 17.803 1.920 0.270 1.00 63.31 H new ATOM 0 HB2 CYS A 27 16.290 1.723 -2.047 1.00 61.52 H new ATOM 0 HB3 CYS A 27 17.636 2.716 -2.571 1.00 61.52 H new ATOM 252 N TYR A 28 19.344 3.841 0.327 1.00 41.31 N ATOM 253 CA TYR A 28 20.286 4.953 0.385 1.00 55.34 C ATOM 254 C TYR A 28 21.719 4.464 0.198 1.00 15.02 C ATOM 255 O TYR A 28 22.060 3.325 0.519 1.00 52.35 O ATOM 256 CB TYR A 28 20.156 5.690 1.719 1.00 72.02 C ATOM 257 CG TYR A 28 20.499 4.836 2.918 1.00 21.41 C ATOM 258 CD1 TYR A 28 21.822 4.560 3.243 1.00 34.42 C ATOM 259 CD2 TYR A 28 19.501 4.304 3.726 1.00 65.45 C ATOM 260 CE1 TYR A 28 22.140 3.779 4.338 1.00 62.04 C ATOM 261 CE2 TYR A 28 19.811 3.523 4.823 1.00 52.34 C ATOM 262 CZ TYR A 28 21.131 3.264 5.124 1.00 24.44 C ATOM 263 OH TYR A 28 21.444 2.485 6.216 1.00 54.54 O ATOM 0 H TYR A 28 19.567 3.066 0.952 1.00 41.31 H new ATOM 0 HA TYR A 28 20.048 5.640 -0.427 1.00 55.34 H new ATOM 0 HB2 TYR A 28 20.808 6.563 1.707 1.00 72.02 H new ATOM 0 HB3 TYR A 28 19.135 6.056 1.824 1.00 72.02 H new ATOM 0 HD1 TYR A 28 22.615 4.963 2.630 1.00 34.42 H new ATOM 0 HD2 TYR A 28 18.466 4.504 3.493 1.00 65.45 H new ATOM 0 HE1 TYR A 28 23.173 3.573 4.577 1.00 62.04 H new ATOM 0 HE2 TYR A 28 19.023 3.118 5.441 1.00 52.34 H new ATOM 0 HH TYR A 28 21.702 3.061 6.965 1.00 54.54 H new ATOM 273 N PRO A 29 22.579 5.345 -0.332 1.00 41.55 N ATOM 274 CA PRO A 29 23.990 5.028 -0.573 1.00 72.11 C ATOM 275 C PRO A 29 24.781 4.886 0.723 1.00 44.54 C ATOM 276 O PRO A 29 24.935 5.848 1.477 1.00 63.30 O ATOM 277 CB PRO A 29 24.492 6.229 -1.378 1.00 13.31 C ATOM 278 CG PRO A 29 23.584 7.347 -0.996 1.00 73.00 C ATOM 279 CD PRO A 29 22.241 6.720 -0.738 1.00 4.21 C ATOM 0 HA PRO A 29 24.112 4.074 -1.086 1.00 72.11 H new ATOM 0 HB2 PRO A 29 25.529 6.461 -1.137 1.00 13.31 H new ATOM 0 HB3 PRO A 29 24.450 6.033 -2.449 1.00 13.31 H new ATOM 0 HG2 PRO A 29 23.951 7.862 -0.108 1.00 73.00 H new ATOM 0 HG3 PRO A 29 23.522 8.089 -1.792 1.00 73.00 H new ATOM 0 HD2 PRO A 29 21.695 7.247 0.044 1.00 4.21 H new ATOM 0 HD3 PRO A 29 21.613 6.733 -1.629 1.00 4.21 H new ATOM 287 N THR A 30 25.283 3.682 0.976 1.00 70.40 N ATOM 288 CA THR A 30 26.058 3.414 2.181 1.00 42.32 C ATOM 289 C THR A 30 27.335 4.247 2.209 1.00 13.13 C ATOM 290 O THR A 30 27.441 5.211 2.967 1.00 43.40 O ATOM 291 CB THR A 30 26.429 1.923 2.291 1.00 11.30 C ATOM 292 OG1 THR A 30 25.662 1.157 1.355 1.00 2.41 O ATOM 293 CG2 THR A 30 26.181 1.407 3.700 1.00 22.13 C ATOM 0 H THR A 30 25.167 2.876 0.362 1.00 70.40 H new ATOM 0 HA THR A 30 25.429 3.687 3.028 1.00 42.32 H new ATOM 0 HB THR A 30 27.490 1.817 2.064 1.00 11.30 H new ATOM 0 HG1 THR A 30 25.520 0.255 1.710 1.00 2.41 H new ATOM 0 HG21 THR A 30 26.450 0.352 3.754 1.00 22.13 H new ATOM 0 HG22 THR A 30 26.788 1.973 4.407 1.00 22.13 H new ATOM 0 HG23 THR A 30 25.127 1.526 3.951 1.00 22.13 H new ATOM 301 N SER A 31 28.301 3.869 1.379 1.00 40.24 N ATOM 302 CA SER A 31 29.572 4.580 1.311 1.00 4.01 C ATOM 303 C SER A 31 29.710 5.322 -0.015 1.00 2.11 C ATOM 304 O SER A 31 28.835 5.244 -0.876 1.00 64.21 O ATOM 305 CB SER A 31 30.737 3.603 1.485 1.00 11.23 C ATOM 306 OG SER A 31 30.696 2.982 2.758 1.00 12.45 O ATOM 0 H SER A 31 28.228 3.074 0.744 1.00 40.24 H new ATOM 0 HA SER A 31 29.595 5.310 2.120 1.00 4.01 H new ATOM 0 HB2 SER A 31 30.698 2.843 0.705 1.00 11.23 H new ATOM 0 HB3 SER A 31 31.682 4.134 1.366 1.00 11.23 H new ATOM 0 HG SER A 31 31.450 2.361 2.844 1.00 12.45 H new ATOM 312 N ASN A 32 30.816 6.042 -0.170 1.00 43.54 N ATOM 313 CA ASN A 32 31.070 6.800 -1.391 1.00 32.23 C ATOM 314 C ASN A 32 31.298 5.864 -2.574 1.00 53.31 C ATOM 315 O ASN A 32 30.704 6.037 -3.638 1.00 33.30 O ATOM 316 CB ASN A 32 32.284 7.712 -1.206 1.00 41.33 C ATOM 317 CG ASN A 32 32.352 8.310 0.186 1.00 41.13 C ATOM 318 OD1 ASN A 32 33.274 8.027 0.951 1.00 62.14 O ATOM 319 ND2 ASN A 32 31.373 9.142 0.521 1.00 74.13 N ATOM 0 H ASN A 32 31.551 6.117 0.534 1.00 43.54 H new ATOM 0 HA ASN A 32 30.193 7.412 -1.599 1.00 32.23 H new ATOM 0 HB2 ASN A 32 33.194 7.144 -1.399 1.00 41.33 H new ATOM 0 HB3 ASN A 32 32.247 8.515 -1.942 1.00 41.33 H new ATOM 0 HD21 ASN A 32 31.365 9.575 1.444 1.00 74.13 H new ATOM 0 HD22 ASN A 32 30.629 9.348 -0.145 1.00 74.13 H new ATOM 326 N ALA A 33 32.162 4.873 -2.380 1.00 54.21 N ATOM 327 CA ALA A 33 32.466 3.909 -3.430 1.00 21.23 C ATOM 328 C ALA A 33 31.566 2.682 -3.326 1.00 23.12 C ATOM 329 O ALA A 33 30.880 2.319 -4.282 1.00 12.13 O ATOM 330 CB ALA A 33 33.930 3.499 -3.362 1.00 11.41 C ATOM 0 H ALA A 33 32.664 4.717 -1.506 1.00 54.21 H new ATOM 0 HA ALA A 33 32.277 4.385 -4.392 1.00 21.23 H new ATOM 0 HB1 ALA A 33 34.143 2.779 -4.152 1.00 11.41 H new ATOM 0 HB2 ALA A 33 34.561 4.378 -3.493 1.00 11.41 H new ATOM 0 HB3 ALA A 33 34.136 3.046 -2.392 1.00 11.41 H new ATOM 336 N THR A 34 31.574 2.045 -2.159 1.00 24.11 N ATOM 337 CA THR A 34 30.761 0.858 -1.931 1.00 33.53 C ATOM 338 C THR A 34 30.868 0.387 -0.485 1.00 24.41 C ATOM 339 O THR A 34 31.934 0.466 0.126 1.00 74.55 O ATOM 340 CB THR A 34 31.173 -0.295 -2.866 1.00 44.41 C ATOM 341 OG1 THR A 34 30.296 -1.412 -2.684 1.00 5.23 O ATOM 342 CG2 THR A 34 32.609 -0.721 -2.598 1.00 71.24 C ATOM 0 H THR A 34 32.135 2.332 -1.357 1.00 24.11 H new ATOM 0 HA THR A 34 29.729 1.137 -2.144 1.00 33.53 H new ATOM 0 HB THR A 34 31.101 0.057 -3.895 1.00 44.41 H new ATOM 0 HG1 THR A 34 30.564 -2.139 -3.283 1.00 5.23 H new ATOM 0 HG21 THR A 34 32.878 -1.536 -3.270 1.00 71.24 H new ATOM 0 HG22 THR A 34 33.277 0.124 -2.767 1.00 71.24 H new ATOM 0 HG23 THR A 34 32.702 -1.056 -1.565 1.00 71.24 H new ATOM 350 N ASN A 35 29.758 -0.104 0.057 1.00 5.01 N ATOM 351 CA ASN A 35 29.729 -0.588 1.432 1.00 31.24 C ATOM 352 C ASN A 35 30.760 -1.693 1.643 1.00 41.25 C ATOM 353 O ASN A 35 30.947 -2.555 0.783 1.00 23.14 O ATOM 354 CB ASN A 35 28.332 -1.105 1.783 1.00 23.51 C ATOM 355 CG ASN A 35 28.294 -1.797 3.132 1.00 32.21 C ATOM 356 OD1 ASN A 35 27.706 -2.870 3.276 1.00 45.43 O ATOM 357 ND2 ASN A 35 28.921 -1.184 4.129 1.00 24.41 N ATOM 0 H ASN A 35 28.867 -0.177 -0.435 1.00 5.01 H new ATOM 0 HA ASN A 35 29.977 0.246 2.089 1.00 31.24 H new ATOM 0 HB2 ASN A 35 27.629 -0.272 1.785 1.00 23.51 H new ATOM 0 HB3 ASN A 35 28.000 -1.800 1.012 1.00 23.51 H new ATOM 0 HD21 ASN A 35 28.928 -1.601 5.060 1.00 24.41 H new ATOM 0 HD22 ASN A 35 29.395 -0.296 3.964 1.00 24.41 H new ATOM 364 N THR A 36 31.427 -1.661 2.792 1.00 65.20 N ATOM 365 CA THR A 36 32.440 -2.658 3.116 1.00 71.34 C ATOM 366 C THR A 36 32.081 -3.413 4.391 1.00 53.25 C ATOM 367 O THR A 36 31.408 -2.878 5.272 1.00 11.22 O ATOM 368 CB THR A 36 33.828 -2.014 3.288 1.00 43.20 C ATOM 369 OG1 THR A 36 33.734 -0.595 3.118 1.00 22.13 O ATOM 370 CG2 THR A 36 34.818 -2.585 2.284 1.00 24.14 C ATOM 0 H THR A 36 31.284 -0.955 3.514 1.00 65.20 H new ATOM 0 HA THR A 36 32.473 -3.357 2.280 1.00 71.34 H new ATOM 0 HB THR A 36 34.185 -2.237 4.293 1.00 43.20 H new ATOM 0 HG1 THR A 36 34.620 -0.193 3.231 1.00 22.13 H new ATOM 0 HG21 THR A 36 35.791 -2.115 2.425 1.00 24.14 H new ATOM 0 HG22 THR A 36 34.909 -3.661 2.435 1.00 24.14 H new ATOM 0 HG23 THR A 36 34.464 -2.389 1.272 1.00 24.14 H new ATOM 378 N CYS A 37 32.534 -4.659 4.483 1.00 52.42 N ATOM 379 CA CYS A 37 32.261 -5.488 5.650 1.00 13.35 C ATOM 380 C CYS A 37 33.509 -6.255 6.077 1.00 72.24 C ATOM 381 O CYS A 37 33.831 -7.301 5.512 1.00 50.32 O ATOM 382 CB CYS A 37 31.124 -6.467 5.352 1.00 15.20 C ATOM 383 SG CYS A 37 30.656 -7.516 6.766 1.00 71.33 S ATOM 0 H CYS A 37 33.092 -5.117 3.762 1.00 52.42 H new ATOM 0 HA CYS A 37 31.962 -4.832 6.468 1.00 13.35 H new ATOM 0 HB2 CYS A 37 30.250 -5.903 5.026 1.00 15.20 H new ATOM 0 HB3 CYS A 37 31.419 -7.107 4.520 1.00 15.20 H new ATOM 388 N PHE A 38 34.208 -5.729 7.077 1.00 54.21 N ATOM 389 CA PHE A 38 35.421 -6.363 7.579 1.00 72.31 C ATOM 390 C PHE A 38 36.409 -6.621 6.445 1.00 2.51 C ATOM 391 O PHE A 38 36.925 -7.727 6.296 1.00 73.55 O ATOM 392 CB PHE A 38 35.080 -7.679 8.282 1.00 3.10 C ATOM 393 CG PHE A 38 34.158 -7.510 9.455 1.00 31.14 C ATOM 394 CD1 PHE A 38 34.112 -6.313 10.151 1.00 50.31 C ATOM 395 CD2 PHE A 38 33.337 -8.549 9.863 1.00 30.31 C ATOM 396 CE1 PHE A 38 33.264 -6.154 11.231 1.00 40.02 C ATOM 397 CE2 PHE A 38 32.487 -8.396 10.942 1.00 72.31 C ATOM 398 CZ PHE A 38 32.451 -7.198 11.627 1.00 1.34 C ATOM 0 H PHE A 38 33.955 -4.865 7.556 1.00 54.21 H new ATOM 0 HA PHE A 38 35.886 -5.685 8.295 1.00 72.31 H new ATOM 0 HB2 PHE A 38 34.620 -8.357 7.563 1.00 3.10 H new ATOM 0 HB3 PHE A 38 36.003 -8.151 8.620 1.00 3.10 H new ATOM 0 HD1 PHE A 38 34.747 -5.494 9.846 1.00 50.31 H new ATOM 0 HD2 PHE A 38 33.362 -9.489 9.332 1.00 30.31 H new ATOM 0 HE1 PHE A 38 33.237 -5.215 11.764 1.00 40.02 H new ATOM 0 HE2 PHE A 38 31.851 -9.213 11.249 1.00 72.31 H new ATOM 0 HZ PHE A 38 31.788 -7.077 12.471 1.00 1.34 H new ATOM 408 N GLY A 39 36.668 -5.588 5.648 1.00 70.32 N ATOM 409 CA GLY A 39 37.593 -5.722 4.537 1.00 35.43 C ATOM 410 C GLY A 39 36.909 -6.184 3.266 1.00 75.21 C ATOM 411 O GLY A 39 37.137 -5.627 2.192 1.00 23.13 O ATOM 0 H GLY A 39 36.254 -4.662 5.752 1.00 70.32 H new ATOM 0 HA2 GLY A 39 38.080 -4.764 4.356 1.00 35.43 H new ATOM 0 HA3 GLY A 39 38.376 -6.432 4.804 1.00 35.43 H new ATOM 415 N SER A 40 36.068 -7.207 3.386 1.00 53.31 N ATOM 416 CA SER A 40 35.352 -7.747 2.236 1.00 64.11 C ATOM 417 C SER A 40 34.220 -6.816 1.814 1.00 42.33 C ATOM 418 O SER A 40 33.221 -6.674 2.519 1.00 72.14 O ATOM 419 CB SER A 40 34.793 -9.133 2.562 1.00 71.20 C ATOM 420 OG SER A 40 35.825 -10.103 2.603 1.00 61.24 O ATOM 0 H SER A 40 35.866 -7.678 4.268 1.00 53.31 H new ATOM 0 HA SER A 40 36.056 -7.832 1.408 1.00 64.11 H new ATOM 0 HB2 SER A 40 34.279 -9.104 3.523 1.00 71.20 H new ATOM 0 HB3 SER A 40 34.054 -9.416 1.813 1.00 71.20 H new ATOM 0 HG SER A 40 35.442 -10.980 2.815 1.00 61.24 H new ATOM 426 N LYS A 41 34.384 -6.182 0.658 1.00 43.35 N ATOM 427 CA LYS A 41 33.377 -5.264 0.138 1.00 65.01 C ATOM 428 C LYS A 41 32.110 -6.015 -0.259 1.00 1.54 C ATOM 429 O LYS A 41 32.174 -7.088 -0.860 1.00 3.41 O ATOM 430 CB LYS A 41 33.928 -4.499 -1.068 1.00 24.33 C ATOM 431 CG LYS A 41 35.253 -3.807 -0.796 1.00 33.04 C ATOM 432 CD LYS A 41 35.162 -2.311 -1.046 1.00 15.05 C ATOM 433 CE LYS A 41 35.575 -1.957 -2.466 1.00 31.02 C ATOM 434 NZ LYS A 41 34.857 -2.784 -3.475 1.00 12.11 N ATOM 0 H LYS A 41 35.206 -6.287 0.063 1.00 43.35 H new ATOM 0 HA LYS A 41 33.126 -4.555 0.927 1.00 65.01 H new ATOM 0 HB2 LYS A 41 34.053 -5.191 -1.900 1.00 24.33 H new ATOM 0 HB3 LYS A 41 33.196 -3.754 -1.380 1.00 24.33 H new ATOM 0 HG2 LYS A 41 35.553 -3.987 0.236 1.00 33.04 H new ATOM 0 HG3 LYS A 41 36.026 -4.237 -1.432 1.00 33.04 H new ATOM 0 HD2 LYS A 41 34.141 -1.973 -0.868 1.00 15.05 H new ATOM 0 HD3 LYS A 41 35.801 -1.783 -0.338 1.00 15.05 H new ATOM 0 HE2 LYS A 41 35.373 -0.902 -2.651 1.00 31.02 H new ATOM 0 HE3 LYS A 41 36.650 -2.100 -2.578 1.00 31.02 H new ATOM 0 HZ1 LYS A 41 34.805 -2.266 -4.375 1.00 12.11 H new ATOM 0 HZ2 LYS A 41 35.369 -3.678 -3.619 1.00 12.11 H new ATOM 0 HZ3 LYS A 41 33.895 -2.987 -3.136 1.00 12.11 H new ATOM 448 N LEU A 42 30.960 -5.444 0.080 1.00 15.42 N ATOM 449 CA LEU A 42 29.676 -6.058 -0.242 1.00 63.11 C ATOM 450 C LEU A 42 29.318 -5.833 -1.708 1.00 33.45 C ATOM 451 O LEU A 42 29.742 -4.862 -2.334 1.00 15.11 O ATOM 452 CB LEU A 42 28.577 -5.490 0.657 1.00 75.32 C ATOM 453 CG LEU A 42 28.723 -5.767 2.153 1.00 24.05 C ATOM 454 CD1 LEU A 42 29.120 -7.216 2.392 1.00 11.31 C ATOM 455 CD2 LEU A 42 29.745 -4.824 2.773 1.00 55.25 C ATOM 0 H LEU A 42 30.890 -4.557 0.578 1.00 15.42 H new ATOM 0 HA LEU A 42 29.760 -7.131 -0.068 1.00 63.11 H new ATOM 0 HB2 LEU A 42 28.537 -4.411 0.510 1.00 75.32 H new ATOM 0 HB3 LEU A 42 27.620 -5.893 0.325 1.00 75.32 H new ATOM 0 HG LEU A 42 27.759 -5.592 2.631 1.00 24.05 H new ATOM 0 HD11 LEU A 42 29.219 -7.394 3.463 1.00 11.31 H new ATOM 0 HD12 LEU A 42 28.354 -7.875 1.984 1.00 11.31 H new ATOM 0 HD13 LEU A 42 30.072 -7.418 1.901 1.00 11.31 H new ATOM 0 HD21 LEU A 42 29.836 -5.036 3.838 1.00 55.25 H new ATOM 0 HD22 LEU A 42 30.712 -4.967 2.291 1.00 55.25 H new ATOM 0 HD23 LEU A 42 29.420 -3.793 2.634 1.00 55.25 H new ATOM 467 N PRO A 43 28.516 -6.751 -2.268 1.00 61.03 N ATOM 468 CA PRO A 43 28.080 -6.673 -3.666 1.00 22.33 C ATOM 469 C PRO A 43 27.101 -5.529 -3.905 1.00 31.23 C ATOM 470 O PRO A 43 26.737 -5.239 -5.044 1.00 52.25 O ATOM 471 CB PRO A 43 27.394 -8.022 -3.899 1.00 3.22 C ATOM 472 CG PRO A 43 26.946 -8.457 -2.547 1.00 34.34 C ATOM 473 CD PRO A 43 27.973 -7.935 -1.581 1.00 42.21 C ATOM 0 HA PRO A 43 28.913 -6.480 -4.343 1.00 22.33 H new ATOM 0 HB2 PRO A 43 26.551 -7.925 -4.583 1.00 3.22 H new ATOM 0 HB3 PRO A 43 28.081 -8.744 -4.340 1.00 3.22 H new ATOM 0 HG2 PRO A 43 25.957 -8.060 -2.317 1.00 34.34 H new ATOM 0 HG3 PRO A 43 26.874 -9.543 -2.491 1.00 34.34 H new ATOM 0 HD2 PRO A 43 27.526 -7.673 -0.622 1.00 42.21 H new ATOM 0 HD3 PRO A 43 28.749 -8.674 -1.380 1.00 42.21 H new ATOM 481 N TYR A 44 26.678 -4.883 -2.824 1.00 4.11 N ATOM 482 CA TYR A 44 25.739 -3.771 -2.916 1.00 64.33 C ATOM 483 C TYR A 44 26.366 -2.483 -2.391 1.00 23.50 C ATOM 484 O TYR A 44 27.319 -2.517 -1.612 1.00 74.14 O ATOM 485 CB TYR A 44 24.464 -4.087 -2.133 1.00 60.22 C ATOM 486 CG TYR A 44 24.704 -4.922 -0.896 1.00 5.14 C ATOM 487 CD1 TYR A 44 25.073 -4.328 0.305 1.00 23.35 C ATOM 488 CD2 TYR A 44 24.564 -6.304 -0.927 1.00 50.33 C ATOM 489 CE1 TYR A 44 25.295 -5.087 1.439 1.00 53.23 C ATOM 490 CE2 TYR A 44 24.782 -7.070 0.201 1.00 11.13 C ATOM 491 CZ TYR A 44 25.147 -6.457 1.382 1.00 43.03 C ATOM 492 OH TYR A 44 25.367 -7.217 2.508 1.00 53.12 O ATOM 0 H TYR A 44 26.971 -5.110 -1.874 1.00 4.11 H new ATOM 0 HA TYR A 44 25.486 -3.628 -3.967 1.00 64.33 H new ATOM 0 HB2 TYR A 44 23.985 -3.152 -1.843 1.00 60.22 H new ATOM 0 HB3 TYR A 44 23.767 -4.612 -2.786 1.00 60.22 H new ATOM 0 HD1 TYR A 44 25.188 -3.255 0.353 1.00 23.35 H new ATOM 0 HD2 TYR A 44 24.280 -6.788 -1.850 1.00 50.33 H new ATOM 0 HE1 TYR A 44 25.583 -4.610 2.364 1.00 53.23 H new ATOM 0 HE2 TYR A 44 24.667 -8.143 0.159 1.00 11.13 H new ATOM 0 HH TYR A 44 24.827 -6.869 3.248 1.00 53.12 H new ATOM 502 N GLU A 45 25.823 -1.350 -2.823 1.00 45.52 N ATOM 503 CA GLU A 45 26.329 -0.050 -2.397 1.00 24.11 C ATOM 504 C GLU A 45 25.225 0.776 -1.743 1.00 62.13 C ATOM 505 O GLU A 45 25.425 1.943 -1.403 1.00 65.25 O ATOM 506 CB GLU A 45 26.913 0.711 -3.589 1.00 51.02 C ATOM 507 CG GLU A 45 25.859 1.266 -4.532 1.00 14.31 C ATOM 508 CD GLU A 45 26.173 0.987 -5.989 1.00 21.43 C ATOM 509 OE1 GLU A 45 26.388 -0.195 -6.332 1.00 53.24 O ATOM 510 OE2 GLU A 45 26.205 1.948 -6.785 1.00 0.14 O ATOM 0 H GLU A 45 25.033 -1.305 -3.467 1.00 45.52 H new ATOM 0 HA GLU A 45 27.116 -0.218 -1.662 1.00 24.11 H new ATOM 0 HB2 GLU A 45 27.527 1.533 -3.219 1.00 51.02 H new ATOM 0 HB3 GLU A 45 27.573 0.046 -4.146 1.00 51.02 H new ATOM 0 HG2 GLU A 45 24.890 0.832 -4.284 1.00 14.31 H new ATOM 0 HG3 GLU A 45 25.774 2.342 -4.382 1.00 14.31 H new ATOM 517 N LEU A 46 24.059 0.163 -1.571 1.00 24.10 N ATOM 518 CA LEU A 46 22.922 0.840 -0.959 1.00 12.43 C ATOM 519 C LEU A 46 22.465 0.109 0.300 1.00 45.41 C ATOM 520 O LEU A 46 22.940 -0.986 0.600 1.00 73.33 O ATOM 521 CB LEU A 46 21.764 0.937 -1.954 1.00 63.01 C ATOM 522 CG LEU A 46 22.038 1.741 -3.226 1.00 12.25 C ATOM 523 CD1 LEU A 46 20.968 1.467 -4.271 1.00 13.41 C ATOM 524 CD2 LEU A 46 22.110 3.228 -2.911 1.00 4.33 C ATOM 0 H LEU A 46 23.877 -0.802 -1.847 1.00 24.10 H new ATOM 0 HA LEU A 46 23.238 1.845 -0.679 1.00 12.43 H new ATOM 0 HB2 LEU A 46 21.473 -0.073 -2.242 1.00 63.01 H new ATOM 0 HB3 LEU A 46 20.909 1.382 -1.444 1.00 63.01 H new ATOM 0 HG LEU A 46 23.001 1.428 -3.631 1.00 12.25 H new ATOM 0 HD11 LEU A 46 21.179 2.048 -5.169 1.00 13.41 H new ATOM 0 HD12 LEU A 46 20.964 0.405 -4.518 1.00 13.41 H new ATOM 0 HD13 LEU A 46 19.993 1.751 -3.876 1.00 13.41 H new ATOM 0 HD21 LEU A 46 22.306 3.785 -3.827 1.00 4.33 H new ATOM 0 HD22 LEU A 46 21.163 3.555 -2.482 1.00 4.33 H new ATOM 0 HD23 LEU A 46 22.913 3.410 -2.197 1.00 4.33 H new ATOM 536 N SER A 47 21.541 0.722 1.032 1.00 54.43 N ATOM 537 CA SER A 47 21.021 0.131 2.259 1.00 71.30 C ATOM 538 C SER A 47 19.624 0.660 2.568 1.00 10.53 C ATOM 539 O SER A 47 19.224 1.714 2.074 1.00 41.34 O ATOM 540 CB SER A 47 21.961 0.424 3.430 1.00 51.53 C ATOM 541 OG SER A 47 21.261 0.410 4.662 1.00 70.02 O ATOM 0 H SER A 47 21.137 1.628 0.797 1.00 54.43 H new ATOM 0 HA SER A 47 20.958 -0.948 2.115 1.00 71.30 H new ATOM 0 HB2 SER A 47 22.760 -0.317 3.454 1.00 51.53 H new ATOM 0 HB3 SER A 47 22.433 1.396 3.287 1.00 51.53 H new ATOM 0 HG SER A 47 21.521 1.190 5.195 1.00 70.02 H new ATOM 547 N SER A 48 18.886 -0.079 3.390 1.00 2.14 N ATOM 548 CA SER A 48 17.532 0.313 3.764 1.00 42.13 C ATOM 549 C SER A 48 17.368 0.321 5.280 1.00 13.14 C ATOM 550 O SER A 48 17.357 -0.731 5.921 1.00 1.22 O ATOM 551 CB SER A 48 16.512 -0.637 3.134 1.00 54.44 C ATOM 552 OG SER A 48 15.247 -0.517 3.763 1.00 44.13 O ATOM 0 H SER A 48 19.203 -0.953 3.810 1.00 2.14 H new ATOM 0 HA SER A 48 17.356 1.322 3.392 1.00 42.13 H new ATOM 0 HB2 SER A 48 16.415 -0.418 2.071 1.00 54.44 H new ATOM 0 HB3 SER A 48 16.867 -1.664 3.217 1.00 54.44 H new ATOM 0 HG SER A 48 15.018 -1.363 4.202 1.00 44.13 H new ATOM 558 N LEU A 49 17.240 1.515 5.849 1.00 74.12 N ATOM 559 CA LEU A 49 17.075 1.662 7.291 1.00 43.11 C ATOM 560 C LEU A 49 15.803 0.968 7.768 1.00 44.13 C ATOM 561 O LEU A 49 15.669 0.639 8.946 1.00 34.32 O ATOM 562 CB LEU A 49 17.035 3.143 7.671 1.00 51.31 C ATOM 563 CG LEU A 49 17.894 3.553 8.868 1.00 35.31 C ATOM 564 CD1 LEU A 49 17.329 2.969 10.154 1.00 24.11 C ATOM 565 CD2 LEU A 49 19.335 3.110 8.667 1.00 64.14 C ATOM 0 H LEU A 49 17.247 2.395 5.334 1.00 74.12 H new ATOM 0 HA LEU A 49 17.928 1.191 7.779 1.00 43.11 H new ATOM 0 HB2 LEU A 49 17.349 3.728 6.807 1.00 51.31 H new ATOM 0 HB3 LEU A 49 16.001 3.416 7.881 1.00 51.31 H new ATOM 0 HG LEU A 49 17.877 4.640 8.948 1.00 35.31 H new ATOM 0 HD11 LEU A 49 17.953 3.271 10.995 1.00 24.11 H new ATOM 0 HD12 LEU A 49 16.314 3.336 10.305 1.00 24.11 H new ATOM 0 HD13 LEU A 49 17.315 1.881 10.084 1.00 24.11 H new ATOM 0 HD21 LEU A 49 19.931 3.410 9.528 1.00 64.14 H new ATOM 0 HD22 LEU A 49 19.371 2.026 8.561 1.00 64.14 H new ATOM 0 HD23 LEU A 49 19.737 3.576 7.767 1.00 64.14 H new ATOM 577 N ASP A 50 14.875 0.747 6.844 1.00 15.41 N ATOM 578 CA ASP A 50 13.614 0.089 7.169 1.00 4.31 C ATOM 579 C ASP A 50 13.858 -1.321 7.698 1.00 4.41 C ATOM 580 O ASP A 50 13.070 -1.845 8.486 1.00 11.32 O ATOM 581 CB ASP A 50 12.710 0.036 5.937 1.00 72.41 C ATOM 582 CG ASP A 50 11.329 -0.504 6.255 1.00 2.44 C ATOM 583 OD1 ASP A 50 10.618 0.128 7.064 1.00 21.14 O ATOM 584 OD2 ASP A 50 10.960 -1.558 5.696 1.00 0.22 O ATOM 0 H ASP A 50 14.972 1.013 5.864 1.00 15.41 H new ATOM 0 HA ASP A 50 13.119 0.669 7.948 1.00 4.31 H new ATOM 0 HB2 ASP A 50 12.617 1.037 5.515 1.00 72.41 H new ATOM 0 HB3 ASP A 50 13.175 -0.590 5.175 1.00 72.41 H new ATOM 589 N LEU A 51 14.954 -1.930 7.259 1.00 20.22 N ATOM 590 CA LEU A 51 15.302 -3.281 7.688 1.00 51.44 C ATOM 591 C LEU A 51 15.417 -3.357 9.207 1.00 73.44 C ATOM 592 O LEU A 51 15.279 -4.429 9.798 1.00 64.13 O ATOM 593 CB LEU A 51 16.618 -3.718 7.042 1.00 21.35 C ATOM 594 CG LEU A 51 16.705 -5.187 6.626 1.00 44.14 C ATOM 595 CD1 LEU A 51 16.633 -5.317 5.112 1.00 33.32 C ATOM 596 CD2 LEU A 51 17.985 -5.817 7.156 1.00 2.41 C ATOM 0 H LEU A 51 15.617 -1.511 6.607 1.00 20.22 H new ATOM 0 HA LEU A 51 14.506 -3.954 7.369 1.00 51.44 H new ATOM 0 HB2 LEU A 51 16.790 -3.100 6.160 1.00 21.35 H new ATOM 0 HB3 LEU A 51 17.429 -3.510 7.740 1.00 21.35 H new ATOM 0 HG LEU A 51 15.857 -5.718 7.058 1.00 44.14 H new ATOM 0 HD11 LEU A 51 16.696 -6.369 4.834 1.00 33.32 H new ATOM 0 HD12 LEU A 51 15.689 -4.904 4.756 1.00 33.32 H new ATOM 0 HD13 LEU A 51 17.462 -4.772 4.660 1.00 33.32 H new ATOM 0 HD21 LEU A 51 18.030 -6.862 6.850 1.00 2.41 H new ATOM 0 HD22 LEU A 51 18.847 -5.284 6.754 1.00 2.41 H new ATOM 0 HD23 LEU A 51 17.997 -5.757 8.244 1.00 2.41 H new ATOM 608 N THR A 52 15.667 -2.213 9.835 1.00 45.22 N ATOM 609 CA THR A 52 15.800 -2.150 11.285 1.00 55.22 C ATOM 610 C THR A 52 14.686 -1.312 11.902 1.00 1.44 C ATOM 611 O THR A 52 13.815 -0.802 11.197 1.00 64.23 O ATOM 612 CB THR A 52 17.161 -1.560 11.700 1.00 72.31 C ATOM 613 OG1 THR A 52 17.558 -0.545 10.772 1.00 65.03 O ATOM 614 CG2 THR A 52 18.225 -2.646 11.759 1.00 41.41 C ATOM 0 H THR A 52 15.782 -1.317 9.362 1.00 45.22 H new ATOM 0 HA THR A 52 15.729 -3.173 11.654 1.00 55.22 H new ATOM 0 HB THR A 52 17.056 -1.122 12.693 1.00 72.31 H new ATOM 0 HG1 THR A 52 16.762 -0.157 10.352 1.00 65.03 H new ATOM 0 HG21 THR A 52 19.178 -2.206 12.054 1.00 41.41 H new ATOM 0 HG22 THR A 52 17.933 -3.402 12.488 1.00 41.41 H new ATOM 0 HG23 THR A 52 18.327 -3.109 10.777 1.00 41.41 H new ATOM 622 N ASP A 53 14.720 -1.172 13.223 1.00 42.00 N ATOM 623 CA ASP A 53 13.714 -0.393 13.936 1.00 61.22 C ATOM 624 C ASP A 53 14.304 0.916 14.451 1.00 65.32 C ATOM 625 O ASP A 53 13.888 1.431 15.488 1.00 13.14 O ATOM 626 CB ASP A 53 13.143 -1.203 15.101 1.00 51.21 C ATOM 627 CG ASP A 53 11.638 -1.065 15.219 1.00 72.13 C ATOM 628 OD1 ASP A 53 11.151 0.082 15.303 1.00 4.24 O ATOM 629 OD2 ASP A 53 10.946 -2.105 15.225 1.00 0.42 O ATOM 0 H ASP A 53 15.433 -1.588 13.822 1.00 42.00 H new ATOM 0 HA ASP A 53 12.910 -0.158 13.238 1.00 61.22 H new ATOM 0 HB2 ASP A 53 13.399 -2.254 14.969 1.00 51.21 H new ATOM 0 HB3 ASP A 53 13.609 -0.876 16.030 1.00 51.21 H new ATOM 634 N PHE A 54 15.278 1.448 13.719 1.00 11.13 N ATOM 635 CA PHE A 54 15.927 2.696 14.103 1.00 4.11 C ATOM 636 C PHE A 54 15.255 3.889 13.429 1.00 23.32 C ATOM 637 O PHE A 54 14.211 3.749 12.792 1.00 32.20 O ATOM 638 CB PHE A 54 17.412 2.657 13.734 1.00 11.54 C ATOM 639 CG PHE A 54 18.153 1.507 14.352 1.00 24.25 C ATOM 640 CD1 PHE A 54 18.260 1.394 15.729 1.00 23.32 C ATOM 641 CD2 PHE A 54 18.744 0.538 13.557 1.00 51.44 C ATOM 642 CE1 PHE A 54 18.942 0.336 16.301 1.00 34.23 C ATOM 643 CE2 PHE A 54 19.426 -0.522 14.123 1.00 40.20 C ATOM 644 CZ PHE A 54 19.526 -0.623 15.497 1.00 41.41 C ATOM 0 H PHE A 54 15.635 1.034 12.857 1.00 11.13 H new ATOM 0 HA PHE A 54 15.830 2.810 15.183 1.00 4.11 H new ATOM 0 HB2 PHE A 54 17.507 2.600 12.650 1.00 11.54 H new ATOM 0 HB3 PHE A 54 17.880 3.590 14.046 1.00 11.54 H new ATOM 0 HD1 PHE A 54 17.805 2.141 16.363 1.00 23.32 H new ATOM 0 HD2 PHE A 54 18.671 0.612 12.482 1.00 51.44 H new ATOM 0 HE1 PHE A 54 19.018 0.260 17.376 1.00 34.23 H new ATOM 0 HE2 PHE A 54 19.881 -1.271 13.492 1.00 40.20 H new ATOM 0 HZ PHE A 54 20.060 -1.450 15.941 1.00 41.41 H new ATOM 654 N HIS A 55 15.862 5.063 13.575 1.00 32.51 N ATOM 655 CA HIS A 55 15.323 6.281 12.981 1.00 73.31 C ATOM 656 C HIS A 55 16.409 7.047 12.233 1.00 4.31 C ATOM 657 O HIS A 55 16.227 8.210 11.870 1.00 73.20 O ATOM 658 CB HIS A 55 14.706 7.170 14.061 1.00 51.33 C ATOM 659 CG HIS A 55 13.365 6.698 14.533 1.00 64.44 C ATOM 660 ND1 HIS A 55 13.182 6.015 15.716 1.00 21.34 N ATOM 661 CD2 HIS A 55 12.138 6.814 13.973 1.00 3.23 C ATOM 662 CE1 HIS A 55 11.901 5.730 15.864 1.00 15.32 C ATOM 663 NE2 HIS A 55 11.245 6.205 14.820 1.00 23.02 N ATOM 0 H HIS A 55 16.727 5.196 14.099 1.00 32.51 H new ATOM 0 HA HIS A 55 14.548 5.997 12.269 1.00 73.31 H new ATOM 0 HB2 HIS A 55 15.385 7.218 14.912 1.00 51.33 H new ATOM 0 HB3 HIS A 55 14.609 8.184 13.673 1.00 51.33 H new ATOM 0 HD2 HIS A 55 11.905 7.296 13.035 1.00 3.23 H new ATOM 0 HE1 HIS A 55 11.464 5.199 16.697 1.00 15.32 H new ATOM 0 HE2 HIS A 55 10.239 6.131 14.668 1.00 23.02 H new ATOM 671 N THR A 56 17.542 6.389 12.006 1.00 30.01 N ATOM 672 CA THR A 56 18.659 7.009 11.304 1.00 74.53 C ATOM 673 C THR A 56 19.844 6.055 11.207 1.00 42.31 C ATOM 674 O THR A 56 19.962 5.116 11.993 1.00 42.01 O ATOM 675 CB THR A 56 19.112 8.304 12.002 1.00 10.50 C ATOM 676 OG1 THR A 56 20.431 8.658 11.570 1.00 14.20 O ATOM 677 CG2 THR A 56 19.096 8.139 13.514 1.00 34.31 C ATOM 0 H THR A 56 17.710 5.426 12.298 1.00 30.01 H new ATOM 0 HA THR A 56 18.307 7.251 10.301 1.00 74.53 H new ATOM 0 HB THR A 56 18.416 9.098 11.732 1.00 10.50 H new ATOM 0 HG1 THR A 56 20.443 9.598 11.293 1.00 14.20 H new ATOM 0 HG21 THR A 56 19.420 9.067 13.985 1.00 34.31 H new ATOM 0 HG22 THR A 56 18.085 7.899 13.843 1.00 34.31 H new ATOM 0 HG23 THR A 56 19.772 7.333 13.799 1.00 34.31 H new ATOM 685 N GLU A 57 20.720 6.304 10.238 1.00 2.14 N ATOM 686 CA GLU A 57 21.897 5.466 10.040 1.00 2.41 C ATOM 687 C GLU A 57 22.774 5.456 11.289 1.00 61.31 C ATOM 688 O GLU A 57 23.282 4.411 11.696 1.00 23.21 O ATOM 689 CB GLU A 57 22.706 5.961 8.840 1.00 44.35 C ATOM 690 CG GLU A 57 21.860 6.242 7.609 1.00 23.40 C ATOM 691 CD GLU A 57 21.883 7.703 7.206 1.00 42.21 C ATOM 692 OE1 GLU A 57 22.967 8.320 7.274 1.00 63.32 O ATOM 693 OE2 GLU A 57 20.818 8.230 6.823 1.00 1.50 O ATOM 0 H GLU A 57 20.637 7.078 9.579 1.00 2.14 H new ATOM 0 HA GLU A 57 21.559 4.448 9.846 1.00 2.41 H new ATOM 0 HB2 GLU A 57 23.237 6.871 9.121 1.00 44.35 H new ATOM 0 HB3 GLU A 57 23.461 5.216 8.589 1.00 44.35 H new ATOM 0 HG2 GLU A 57 22.220 5.634 6.779 1.00 23.40 H new ATOM 0 HG3 GLU A 57 20.831 5.939 7.803 1.00 23.40 H new ATOM 700 N LYS A 58 22.948 6.627 11.893 1.00 72.53 N ATOM 701 CA LYS A 58 23.762 6.754 13.095 1.00 0.44 C ATOM 702 C LYS A 58 23.295 5.782 14.174 1.00 5.22 C ATOM 703 O LYS A 58 24.097 5.295 14.971 1.00 74.32 O ATOM 704 CB LYS A 58 23.703 8.189 13.626 1.00 32.51 C ATOM 705 CG LYS A 58 22.405 8.519 14.343 1.00 70.23 C ATOM 706 CD LYS A 58 22.023 9.978 14.160 1.00 75.14 C ATOM 707 CE LYS A 58 21.485 10.579 15.449 1.00 12.30 C ATOM 708 NZ LYS A 58 20.599 11.748 15.189 1.00 61.20 N ATOM 0 H LYS A 58 22.536 7.502 11.569 1.00 72.53 H new ATOM 0 HA LYS A 58 24.792 6.511 12.834 1.00 0.44 H new ATOM 0 HB2 LYS A 58 24.537 8.349 14.310 1.00 32.51 H new ATOM 0 HB3 LYS A 58 23.835 8.881 12.794 1.00 32.51 H new ATOM 0 HG2 LYS A 58 21.606 7.882 13.963 1.00 70.23 H new ATOM 0 HG3 LYS A 58 22.509 8.300 15.406 1.00 70.23 H new ATOM 0 HD2 LYS A 58 22.893 10.544 13.829 1.00 75.14 H new ATOM 0 HD3 LYS A 58 21.270 10.063 13.376 1.00 75.14 H new ATOM 0 HE2 LYS A 58 20.931 9.819 16.000 1.00 12.30 H new ATOM 0 HE3 LYS A 58 22.318 10.888 16.081 1.00 12.30 H new ATOM 0 HZ1 LYS A 58 20.253 12.129 16.093 1.00 61.20 H new ATOM 0 HZ2 LYS A 58 21.134 12.484 14.685 1.00 61.20 H new ATOM 0 HZ3 LYS A 58 19.791 11.448 14.607 1.00 61.20 H new ATOM 722 N GLU A 59 21.996 5.504 14.192 1.00 14.42 N ATOM 723 CA GLU A 59 21.424 4.590 15.173 1.00 22.54 C ATOM 724 C GLU A 59 21.839 3.150 14.882 1.00 41.34 C ATOM 725 O GLU A 59 22.122 2.376 15.797 1.00 72.11 O ATOM 726 CB GLU A 59 19.898 4.701 15.179 1.00 21.32 C ATOM 727 CG GLU A 59 19.353 5.536 16.326 1.00 60.33 C ATOM 728 CD GLU A 59 18.103 4.937 16.941 1.00 72.05 C ATOM 729 OE1 GLU A 59 18.233 4.015 17.772 1.00 1.05 O ATOM 730 OE2 GLU A 59 16.994 5.391 16.589 1.00 12.33 O ATOM 0 H GLU A 59 21.320 5.899 13.538 1.00 14.42 H new ATOM 0 HA GLU A 59 21.805 4.869 16.156 1.00 22.54 H new ATOM 0 HB2 GLU A 59 19.570 5.137 14.235 1.00 21.32 H new ATOM 0 HB3 GLU A 59 19.470 3.700 15.234 1.00 21.32 H new ATOM 0 HG2 GLU A 59 20.120 5.635 17.094 1.00 60.33 H new ATOM 0 HG3 GLU A 59 19.131 6.540 15.966 1.00 60.33 H new ATOM 737 N LEU A 60 21.873 2.799 13.601 1.00 34.30 N ATOM 738 CA LEU A 60 22.252 1.452 13.187 1.00 43.41 C ATOM 739 C LEU A 60 23.728 1.191 13.470 1.00 1.44 C ATOM 740 O LEU A 60 24.094 0.137 13.988 1.00 73.12 O ATOM 741 CB LEU A 60 21.965 1.256 11.697 1.00 33.45 C ATOM 742 CG LEU A 60 21.632 -0.172 11.261 1.00 12.40 C ATOM 743 CD1 LEU A 60 21.358 -0.222 9.766 1.00 61.41 C ATOM 744 CD2 LEU A 60 22.763 -1.120 11.631 1.00 40.14 C ATOM 0 H LEU A 60 21.643 3.428 12.831 1.00 34.30 H new ATOM 0 HA LEU A 60 21.659 0.741 13.762 1.00 43.41 H new ATOM 0 HB2 LEU A 60 21.133 1.903 11.419 1.00 33.45 H new ATOM 0 HB3 LEU A 60 22.834 1.594 11.132 1.00 33.45 H new ATOM 0 HG LEU A 60 20.732 -0.492 11.785 1.00 12.40 H new ATOM 0 HD11 LEU A 60 21.123 -1.245 9.473 1.00 61.41 H new ATOM 0 HD12 LEU A 60 20.514 0.426 9.529 1.00 61.41 H new ATOM 0 HD13 LEU A 60 22.240 0.117 9.223 1.00 61.41 H new ATOM 0 HD21 LEU A 60 22.509 -2.131 11.313 1.00 40.14 H new ATOM 0 HD22 LEU A 60 23.680 -0.803 11.134 1.00 40.14 H new ATOM 0 HD23 LEU A 60 22.911 -1.105 12.711 1.00 40.14 H new ATOM 756 N ASN A 61 24.571 2.161 13.130 1.00 63.45 N ATOM 757 CA ASN A 61 26.008 2.036 13.349 1.00 53.20 C ATOM 758 C ASN A 61 26.337 2.086 14.838 1.00 72.41 C ATOM 759 O ASN A 61 27.062 1.234 15.352 1.00 33.25 O ATOM 760 CB ASN A 61 26.755 3.150 12.613 1.00 65.43 C ATOM 761 CG ASN A 61 27.733 2.609 11.587 1.00 51.42 C ATOM 762 OD1 ASN A 61 28.884 3.041 11.522 1.00 1.03 O ATOM 763 ND2 ASN A 61 27.277 1.660 10.778 1.00 31.11 N ATOM 0 H ASN A 61 24.284 3.041 12.702 1.00 63.45 H new ATOM 0 HA ASN A 61 26.328 1.071 12.956 1.00 53.20 H new ATOM 0 HB2 ASN A 61 26.035 3.801 12.117 1.00 65.43 H new ATOM 0 HB3 ASN A 61 27.293 3.763 13.336 1.00 65.43 H new ATOM 0 HD21 ASN A 61 27.888 1.259 10.067 1.00 31.11 H new ATOM 0 HD22 ASN A 61 26.315 1.332 10.868 1.00 31.11 H new ATOM 770 N ASP A 62 25.799 3.088 15.524 1.00 31.20 N ATOM 771 CA ASP A 62 26.033 3.248 16.954 1.00 25.04 C ATOM 772 C ASP A 62 25.543 2.026 17.726 1.00 43.44 C ATOM 773 O ASP A 62 26.187 1.578 18.675 1.00 40.24 O ATOM 774 CB ASP A 62 25.334 4.507 17.470 1.00 72.51 C ATOM 775 CG ASP A 62 25.998 5.779 16.982 1.00 52.10 C ATOM 776 OD1 ASP A 62 27.223 5.754 16.741 1.00 33.14 O ATOM 777 OD2 ASP A 62 25.293 6.800 16.842 1.00 53.53 O ATOM 0 H ASP A 62 25.198 3.802 15.113 1.00 31.20 H new ATOM 0 HA ASP A 62 27.107 3.348 17.112 1.00 25.04 H new ATOM 0 HB2 ASP A 62 24.292 4.498 17.149 1.00 72.51 H new ATOM 0 HB3 ASP A 62 25.332 4.497 18.560 1.00 72.51 H new ATOM 782 N LYS A 63 24.399 1.492 17.312 1.00 10.34 N ATOM 783 CA LYS A 63 23.821 0.322 17.963 1.00 1.41 C ATOM 784 C LYS A 63 24.802 -0.846 17.954 1.00 41.44 C ATOM 785 O LYS A 63 24.834 -1.650 18.886 1.00 64.12 O ATOM 786 CB LYS A 63 22.521 -0.084 17.266 1.00 33.12 C ATOM 787 CG LYS A 63 22.130 -1.532 17.505 1.00 34.21 C ATOM 788 CD LYS A 63 22.423 -2.397 16.290 1.00 13.34 C ATOM 789 CE LYS A 63 23.381 -3.528 16.630 1.00 74.43 C ATOM 790 NZ LYS A 63 22.693 -4.643 17.339 1.00 4.22 N ATOM 0 H LYS A 63 23.854 1.851 16.528 1.00 10.34 H new ATOM 0 HA LYS A 63 23.604 0.583 18.999 1.00 1.41 H new ATOM 0 HB2 LYS A 63 21.715 0.563 17.612 1.00 33.12 H new ATOM 0 HB3 LYS A 63 22.626 0.083 16.194 1.00 33.12 H new ATOM 0 HG2 LYS A 63 22.673 -1.919 18.367 1.00 34.21 H new ATOM 0 HG3 LYS A 63 21.068 -1.588 17.745 1.00 34.21 H new ATOM 0 HD2 LYS A 63 21.492 -2.811 15.904 1.00 13.34 H new ATOM 0 HD3 LYS A 63 22.851 -1.782 15.498 1.00 13.34 H new ATOM 0 HE2 LYS A 63 23.836 -3.906 15.715 1.00 74.43 H new ATOM 0 HE3 LYS A 63 24.189 -3.145 17.253 1.00 74.43 H new ATOM 0 HZ1 LYS A 63 23.402 -5.286 17.746 1.00 4.22 H new ATOM 0 HZ2 LYS A 63 22.099 -4.256 18.100 1.00 4.22 H new ATOM 0 HZ3 LYS A 63 22.097 -5.166 16.667 1.00 4.22 H new ATOM 804 N LEU A 64 25.601 -0.932 16.896 1.00 62.30 N ATOM 805 CA LEU A 64 26.585 -2.002 16.766 1.00 10.40 C ATOM 806 C LEU A 64 27.445 -2.106 18.021 1.00 2.34 C ATOM 807 O LEU A 64 27.860 -3.196 18.413 1.00 41.34 O ATOM 808 CB LEU A 64 27.473 -1.759 15.544 1.00 11.23 C ATOM 809 CG LEU A 64 26.749 -1.629 14.204 1.00 61.44 C ATOM 810 CD1 LEU A 64 27.640 -2.108 13.068 1.00 72.03 C ATOM 811 CD2 LEU A 64 25.443 -2.410 14.225 1.00 21.30 C ATOM 0 H LEU A 64 25.587 -0.275 16.116 1.00 62.30 H new ATOM 0 HA LEU A 64 26.049 -2.942 16.637 1.00 10.40 H new ATOM 0 HB2 LEU A 64 28.048 -0.849 15.713 1.00 11.23 H new ATOM 0 HB3 LEU A 64 28.188 -2.579 15.470 1.00 11.23 H new ATOM 0 HG LEU A 64 26.517 -0.577 14.039 1.00 61.44 H new ATOM 0 HD11 LEU A 64 27.108 -2.008 12.122 1.00 72.03 H new ATOM 0 HD12 LEU A 64 28.548 -1.506 13.039 1.00 72.03 H new ATOM 0 HD13 LEU A 64 27.903 -3.154 13.228 1.00 72.03 H new ATOM 0 HD21 LEU A 64 24.941 -2.306 13.263 1.00 21.30 H new ATOM 0 HD22 LEU A 64 25.652 -3.463 14.413 1.00 21.30 H new ATOM 0 HD23 LEU A 64 24.799 -2.021 15.014 1.00 21.30 H new ATOM 823 N ASN A 65 27.707 -0.964 18.649 1.00 1.03 N ATOM 824 CA ASN A 65 28.517 -0.927 19.862 1.00 54.11 C ATOM 825 C ASN A 65 27.972 -1.893 20.909 1.00 15.15 C ATOM 826 O ASN A 65 28.733 -2.555 21.614 1.00 25.21 O ATOM 827 CB ASN A 65 28.554 0.493 20.432 1.00 64.44 C ATOM 828 CG ASN A 65 29.473 1.407 19.645 1.00 45.02 C ATOM 829 OD1 ASN A 65 30.663 1.128 19.491 1.00 34.33 O ATOM 830 ND2 ASN A 65 28.925 2.507 19.142 1.00 32.10 N ATOM 0 H ASN A 65 27.371 -0.053 18.338 1.00 1.03 H new ATOM 0 HA ASN A 65 29.530 -1.234 19.603 1.00 54.11 H new ATOM 0 HB2 ASN A 65 27.546 0.908 20.432 1.00 64.44 H new ATOM 0 HB3 ASN A 65 28.884 0.457 21.470 1.00 64.44 H new ATOM 0 HD21 ASN A 65 29.494 3.160 18.604 1.00 32.10 H new ATOM 0 HD22 ASN A 65 27.935 2.699 19.294 1.00 32.10 H new ATOM 837 N ASP A 66 26.649 -1.968 21.005 1.00 13.15 N ATOM 838 CA ASP A 66 26.001 -2.854 21.966 1.00 72.05 C ATOM 839 C ASP A 66 26.358 -4.311 21.688 1.00 42.24 C ATOM 840 O ASP A 66 26.689 -5.065 22.603 1.00 73.01 O ATOM 841 CB ASP A 66 24.483 -2.670 21.918 1.00 62.20 C ATOM 842 CG ASP A 66 23.966 -1.824 23.065 1.00 63.02 C ATOM 843 OD1 ASP A 66 24.758 -1.039 23.627 1.00 24.15 O ATOM 844 OD2 ASP A 66 22.769 -1.946 23.399 1.00 25.01 O ATOM 0 H ASP A 66 26.004 -1.426 20.429 1.00 13.15 H new ATOM 0 HA ASP A 66 26.360 -2.594 22.962 1.00 72.05 H new ATOM 0 HB2 ASP A 66 24.206 -2.203 20.973 1.00 62.20 H new ATOM 0 HB3 ASP A 66 24.000 -3.647 21.945 1.00 62.20 H new ATOM 849 N TYR A 67 26.288 -4.700 20.419 1.00 5.14 N ATOM 850 CA TYR A 67 26.601 -6.067 20.021 1.00 21.32 C ATOM 851 C TYR A 67 28.106 -6.316 20.062 1.00 52.01 C ATOM 852 O TYR A 67 28.555 -7.435 20.311 1.00 2.24 O ATOM 853 CB TYR A 67 26.064 -6.347 18.616 1.00 5.04 C ATOM 854 CG TYR A 67 27.149 -6.546 17.582 1.00 4.22 C ATOM 855 CD1 TYR A 67 27.797 -7.768 17.453 1.00 63.31 C ATOM 856 CD2 TYR A 67 27.527 -5.511 16.735 1.00 24.52 C ATOM 857 CE1 TYR A 67 28.790 -7.955 16.510 1.00 14.40 C ATOM 858 CE2 TYR A 67 28.518 -5.689 15.789 1.00 75.15 C ATOM 859 CZ TYR A 67 29.146 -6.912 15.680 1.00 72.21 C ATOM 860 OH TYR A 67 30.134 -7.093 14.739 1.00 14.30 O ATOM 0 H TYR A 67 26.017 -4.088 19.649 1.00 5.14 H new ATOM 0 HA TYR A 67 26.120 -6.743 20.728 1.00 21.32 H new ATOM 0 HB2 TYR A 67 25.436 -7.237 18.647 1.00 5.04 H new ATOM 0 HB3 TYR A 67 25.427 -5.518 18.307 1.00 5.04 H new ATOM 0 HD1 TYR A 67 27.520 -8.586 18.101 1.00 63.31 H new ATOM 0 HD2 TYR A 67 27.038 -4.552 16.818 1.00 24.52 H new ATOM 0 HE1 TYR A 67 29.284 -8.911 16.423 1.00 14.40 H new ATOM 0 HE2 TYR A 67 28.800 -4.874 15.138 1.00 75.15 H new ATOM 0 HH TYR A 67 30.811 -7.708 15.090 1.00 14.30 H new ATOM 870 N TYR A 68 28.879 -5.265 19.815 1.00 2.43 N ATOM 871 CA TYR A 68 30.334 -5.367 19.822 1.00 74.45 C ATOM 872 C TYR A 68 30.825 -6.068 21.085 1.00 51.32 C ATOM 873 O TYR A 68 31.806 -6.810 21.055 1.00 74.43 O ATOM 874 CB TYR A 68 30.965 -3.978 19.717 1.00 15.22 C ATOM 875 CG TYR A 68 31.469 -3.644 18.331 1.00 21.54 C ATOM 876 CD1 TYR A 68 32.631 -4.223 17.836 1.00 21.41 C ATOM 877 CD2 TYR A 68 30.785 -2.750 17.518 1.00 72.02 C ATOM 878 CE1 TYR A 68 33.096 -3.921 16.571 1.00 64.42 C ATOM 879 CE2 TYR A 68 31.242 -2.443 16.251 1.00 72.32 C ATOM 880 CZ TYR A 68 32.398 -3.031 15.782 1.00 61.31 C ATOM 881 OH TYR A 68 32.857 -2.727 14.521 1.00 65.21 O ATOM 0 H TYR A 68 28.523 -4.332 19.607 1.00 2.43 H new ATOM 0 HA TYR A 68 30.635 -5.961 18.959 1.00 74.45 H new ATOM 0 HB2 TYR A 68 30.230 -3.231 20.017 1.00 15.22 H new ATOM 0 HB3 TYR A 68 31.794 -3.911 20.422 1.00 15.22 H new ATOM 0 HD1 TYR A 68 33.180 -4.921 18.451 1.00 21.41 H new ATOM 0 HD2 TYR A 68 29.880 -2.287 17.882 1.00 72.02 H new ATOM 0 HE1 TYR A 68 34.001 -4.379 16.202 1.00 64.42 H new ATOM 0 HE2 TYR A 68 30.697 -1.746 15.631 1.00 72.32 H new ATOM 0 HH TYR A 68 32.249 -2.085 14.098 1.00 65.21 H new ATOM 891 N ALA A 69 30.135 -5.825 22.194 1.00 33.13 N ATOM 892 CA ALA A 69 30.498 -6.434 23.468 1.00 14.41 C ATOM 893 C ALA A 69 30.591 -7.951 23.345 1.00 13.31 C ATOM 894 O ALA A 69 31.390 -8.591 24.029 1.00 20.50 O ATOM 895 CB ALA A 69 29.490 -6.050 24.542 1.00 25.12 C ATOM 0 H ALA A 69 29.322 -5.211 22.236 1.00 33.13 H new ATOM 0 HA ALA A 69 31.480 -6.059 23.756 1.00 14.41 H new ATOM 0 HB1 ALA A 69 29.773 -6.511 25.488 1.00 25.12 H new ATOM 0 HB2 ALA A 69 29.476 -4.966 24.657 1.00 25.12 H new ATOM 0 HB3 ALA A 69 28.499 -6.397 24.251 1.00 25.12 H new ATOM 901 N LEU A 70 29.769 -8.520 22.470 1.00 32.14 N ATOM 902 CA LEU A 70 29.758 -9.963 22.258 1.00 30.32 C ATOM 903 C LEU A 70 31.114 -10.450 21.756 1.00 35.10 C ATOM 904 O LEU A 70 31.425 -11.639 21.830 1.00 51.04 O ATOM 905 CB LEU A 70 28.664 -10.343 21.258 1.00 25.43 C ATOM 906 CG LEU A 70 28.238 -11.812 21.256 1.00 41.22 C ATOM 907 CD1 LEU A 70 26.746 -11.935 21.523 1.00 40.22 C ATOM 908 CD2 LEU A 70 28.601 -12.470 19.933 1.00 62.31 C ATOM 0 H LEU A 70 29.102 -8.004 21.896 1.00 32.14 H new ATOM 0 HA LEU A 70 29.551 -10.445 23.214 1.00 30.32 H new ATOM 0 HB2 LEU A 70 27.785 -9.731 21.461 1.00 25.43 H new ATOM 0 HB3 LEU A 70 29.009 -10.084 20.257 1.00 25.43 H new ATOM 0 HG LEU A 70 28.773 -12.327 22.054 1.00 41.22 H new ATOM 0 HD11 LEU A 70 26.461 -12.987 21.518 1.00 40.22 H new ATOM 0 HD12 LEU A 70 26.513 -11.501 22.495 1.00 40.22 H new ATOM 0 HD13 LEU A 70 26.193 -11.405 20.747 1.00 40.22 H new ATOM 0 HD21 LEU A 70 28.291 -13.515 19.949 1.00 62.31 H new ATOM 0 HD22 LEU A 70 28.094 -11.953 19.118 1.00 62.31 H new ATOM 0 HD23 LEU A 70 29.679 -12.414 19.783 1.00 62.31 H new ATOM 920 N LYS A 71 31.918 -9.523 21.247 1.00 12.01 N ATOM 921 CA LYS A 71 33.242 -9.855 20.736 1.00 62.43 C ATOM 922 C LYS A 71 34.018 -10.700 21.742 1.00 52.42 C ATOM 923 O LYS A 71 34.825 -11.549 21.363 1.00 31.10 O ATOM 924 CB LYS A 71 34.023 -8.579 20.416 1.00 41.24 C ATOM 925 CG LYS A 71 34.494 -7.829 21.649 1.00 3.44 C ATOM 926 CD LYS A 71 35.425 -6.685 21.285 1.00 44.44 C ATOM 927 CE LYS A 71 34.788 -5.749 20.269 1.00 14.23 C ATOM 928 NZ LYS A 71 35.427 -5.865 18.929 1.00 33.54 N ATOM 0 H LYS A 71 31.675 -8.535 21.177 1.00 12.01 H new ATOM 0 HA LYS A 71 33.116 -10.435 19.822 1.00 62.43 H new ATOM 0 HB2 LYS A 71 34.888 -8.836 19.805 1.00 41.24 H new ATOM 0 HB3 LYS A 71 33.395 -7.919 19.817 1.00 41.24 H new ATOM 0 HG2 LYS A 71 33.632 -7.439 22.190 1.00 3.44 H new ATOM 0 HG3 LYS A 71 35.007 -8.517 22.320 1.00 3.44 H new ATOM 0 HD2 LYS A 71 35.684 -6.126 22.184 1.00 44.44 H new ATOM 0 HD3 LYS A 71 36.354 -7.086 20.880 1.00 44.44 H new ATOM 0 HE2 LYS A 71 33.725 -5.974 20.185 1.00 14.23 H new ATOM 0 HE3 LYS A 71 34.869 -4.721 20.622 1.00 14.23 H new ATOM 0 HZ1 LYS A 71 35.124 -5.071 18.330 1.00 33.54 H new ATOM 0 HZ2 LYS A 71 36.461 -5.844 19.035 1.00 33.54 H new ATOM 0 HZ3 LYS A 71 35.143 -6.762 18.485 1.00 33.54 H new ATOM 942 N HIS A 72 33.767 -10.462 23.025 1.00 1.53 N ATOM 943 CA HIS A 72 34.441 -11.202 24.086 1.00 31.10 C ATOM 944 C HIS A 72 34.329 -12.706 23.854 1.00 12.14 C ATOM 945 O HIS A 72 35.281 -13.452 24.081 1.00 24.10 O ATOM 946 CB HIS A 72 33.847 -10.838 25.447 1.00 23.33 C ATOM 947 CG HIS A 72 34.869 -10.386 26.445 1.00 51.24 C ATOM 948 ND1 HIS A 72 36.137 -10.922 26.519 1.00 41.00 N ATOM 949 CD2 HIS A 72 34.805 -9.440 27.411 1.00 35.52 C ATOM 950 CE1 HIS A 72 36.808 -10.327 27.489 1.00 20.33 C ATOM 951 NE2 HIS A 72 36.022 -9.424 28.046 1.00 11.23 N ATOM 0 H HIS A 72 33.102 -9.763 23.355 1.00 1.53 H new ATOM 0 HA HIS A 72 35.496 -10.928 24.074 1.00 31.10 H new ATOM 0 HB2 HIS A 72 33.108 -10.048 25.312 1.00 23.33 H new ATOM 0 HB3 HIS A 72 33.319 -11.703 25.847 1.00 23.33 H new ATOM 0 HD2 HIS A 72 33.955 -8.814 27.640 1.00 35.52 H new ATOM 0 HE1 HIS A 72 37.826 -10.543 27.777 1.00 20.33 H new ATOM 0 HE2 HIS A 72 36.278 -8.814 28.822 1.00 11.23 H new ATOM 959 N VAL A 73 33.158 -13.145 23.402 1.00 2.43 N ATOM 960 CA VAL A 73 32.922 -14.559 23.140 1.00 75.12 C ATOM 961 C VAL A 73 33.027 -14.867 21.650 1.00 14.33 C ATOM 962 O VAL A 73 32.126 -14.570 20.865 1.00 62.13 O ATOM 963 CB VAL A 73 31.536 -15.000 23.647 1.00 13.13 C ATOM 964 CG1 VAL A 73 31.265 -16.449 23.271 1.00 2.32 C ATOM 965 CG2 VAL A 73 31.432 -14.803 25.152 1.00 4.11 C ATOM 0 H VAL A 73 32.359 -12.541 23.210 1.00 2.43 H new ATOM 0 HA VAL A 73 33.691 -15.113 23.678 1.00 75.12 H new ATOM 0 HB VAL A 73 30.779 -14.378 23.169 1.00 13.13 H new ATOM 0 HG11 VAL A 73 30.281 -16.742 23.638 1.00 2.32 H new ATOM 0 HG12 VAL A 73 31.294 -16.555 22.187 1.00 2.32 H new ATOM 0 HG13 VAL A 73 32.025 -17.089 23.719 1.00 2.32 H new ATOM 0 HG21 VAL A 73 30.446 -15.120 25.493 1.00 4.11 H new ATOM 0 HG22 VAL A 73 32.197 -15.398 25.651 1.00 4.11 H new ATOM 0 HG23 VAL A 73 31.578 -13.750 25.392 1.00 4.11 H new ATOM 975 N PRO A 74 34.152 -15.477 21.250 1.00 2.41 N ATOM 976 CA PRO A 74 34.402 -15.839 19.852 1.00 71.21 C ATOM 977 C PRO A 74 33.502 -16.975 19.378 1.00 54.12 C ATOM 978 O PRO A 74 33.230 -17.109 18.184 1.00 22.45 O ATOM 979 CB PRO A 74 35.866 -16.284 19.857 1.00 25.30 C ATOM 980 CG PRO A 74 36.121 -16.733 21.255 1.00 61.24 C ATOM 981 CD PRO A 74 35.268 -15.860 22.132 1.00 55.20 C ATOM 0 HA PRO A 74 34.196 -15.011 19.174 1.00 71.21 H new ATOM 0 HB2 PRO A 74 36.037 -17.091 19.145 1.00 25.30 H new ATOM 0 HB3 PRO A 74 36.529 -15.466 19.577 1.00 25.30 H new ATOM 0 HG2 PRO A 74 35.862 -17.784 21.381 1.00 61.24 H new ATOM 0 HG3 PRO A 74 37.176 -16.632 21.511 1.00 61.24 H new ATOM 0 HD2 PRO A 74 34.917 -16.396 23.014 1.00 55.20 H new ATOM 0 HD3 PRO A 74 35.817 -14.988 22.487 1.00 55.20 H new ATOM 989 N LYS A 75 33.040 -17.791 20.320 1.00 44.42 N ATOM 990 CA LYS A 75 32.169 -18.915 20.000 1.00 54.44 C ATOM 991 C LYS A 75 30.929 -18.444 19.245 1.00 21.23 C ATOM 992 O LYS A 75 30.467 -19.106 18.316 1.00 71.43 O ATOM 993 CB LYS A 75 31.754 -19.645 21.279 1.00 74.34 C ATOM 994 CG LYS A 75 32.764 -20.680 21.743 1.00 1.33 C ATOM 995 CD LYS A 75 33.759 -20.085 22.726 1.00 62.13 C ATOM 996 CE LYS A 75 35.109 -20.780 22.641 1.00 45.14 C ATOM 997 NZ LYS A 75 35.030 -22.202 23.076 1.00 50.13 N ATOM 0 H LYS A 75 33.255 -17.694 21.312 1.00 44.42 H new ATOM 0 HA LYS A 75 32.723 -19.602 19.361 1.00 54.44 H new ATOM 0 HB2 LYS A 75 31.605 -18.913 22.073 1.00 74.34 H new ATOM 0 HB3 LYS A 75 30.795 -20.135 21.113 1.00 74.34 H new ATOM 0 HG2 LYS A 75 32.242 -21.514 22.212 1.00 1.33 H new ATOM 0 HG3 LYS A 75 33.298 -21.081 20.881 1.00 1.33 H new ATOM 0 HD2 LYS A 75 33.882 -19.021 22.522 1.00 62.13 H new ATOM 0 HD3 LYS A 75 33.367 -20.171 23.739 1.00 62.13 H new ATOM 0 HE2 LYS A 75 35.477 -20.734 21.616 1.00 45.14 H new ATOM 0 HE3 LYS A 75 35.830 -20.250 23.263 1.00 45.14 H new ATOM 0 HZ1 LYS A 75 35.974 -22.635 23.019 1.00 50.13 H new ATOM 0 HZ2 LYS A 75 34.687 -22.246 24.057 1.00 50.13 H new ATOM 0 HZ3 LYS A 75 34.374 -22.719 22.456 1.00 50.13 H new ATOM 1011 N CYS A 76 30.396 -17.296 19.650 1.00 32.42 N ATOM 1012 CA CYS A 76 29.211 -16.736 19.012 1.00 34.25 C ATOM 1013 C CYS A 76 29.580 -15.553 18.123 1.00 53.25 C ATOM 1014 O CYS A 76 28.962 -15.330 17.081 1.00 2.02 O ATOM 1015 CB CYS A 76 28.196 -16.296 20.070 1.00 25.22 C ATOM 1016 SG CYS A 76 26.491 -16.843 19.738 1.00 31.41 S ATOM 0 H CYS A 76 30.766 -16.735 20.417 1.00 32.42 H new ATOM 0 HA CYS A 76 28.764 -17.511 18.389 1.00 34.25 H new ATOM 0 HB2 CYS A 76 28.508 -16.683 21.040 1.00 25.22 H new ATOM 0 HB3 CYS A 76 28.210 -15.208 20.141 1.00 25.22 H new ATOM 1021 N TRP A 77 30.590 -14.799 18.540 1.00 12.41 N ATOM 1022 CA TRP A 77 31.042 -13.638 17.781 1.00 73.00 C ATOM 1023 C TRP A 77 31.378 -14.024 16.345 1.00 64.30 C ATOM 1024 O TRP A 77 30.918 -13.388 15.397 1.00 32.44 O ATOM 1025 CB TRP A 77 32.263 -13.008 18.452 1.00 11.33 C ATOM 1026 CG TRP A 77 33.145 -12.260 17.499 1.00 52.50 C ATOM 1027 CD1 TRP A 77 34.498 -12.383 17.366 1.00 44.03 C ATOM 1028 CD2 TRP A 77 32.734 -11.271 16.548 1.00 65.11 C ATOM 1029 NE1 TRP A 77 34.954 -11.531 16.389 1.00 42.21 N ATOM 1030 CE2 TRP A 77 33.892 -10.838 15.871 1.00 33.33 C ATOM 1031 CE3 TRP A 77 31.502 -10.711 16.200 1.00 22.15 C ATOM 1032 CZ2 TRP A 77 33.851 -9.872 14.870 1.00 15.31 C ATOM 1033 CZ3 TRP A 77 31.463 -9.752 15.207 1.00 41.42 C ATOM 1034 CH2 TRP A 77 32.631 -9.340 14.550 1.00 33.34 C ATOM 0 H TRP A 77 31.112 -14.970 19.399 1.00 12.41 H new ATOM 0 HA TRP A 77 30.231 -12.910 17.761 1.00 73.00 H new ATOM 0 HB2 TRP A 77 31.928 -12.328 19.235 1.00 11.33 H new ATOM 0 HB3 TRP A 77 32.846 -13.791 18.937 1.00 11.33 H new ATOM 0 HD1 TRP A 77 35.119 -13.052 17.944 1.00 44.03 H new ATOM 0 HE1 TRP A 77 35.926 -11.431 16.097 1.00 42.21 H new ATOM 0 HE3 TRP A 77 30.596 -11.023 16.699 1.00 22.15 H new ATOM 0 HZ2 TRP A 77 34.750 -9.553 14.364 1.00 15.31 H new ATOM 0 HZ3 TRP A 77 30.516 -9.312 14.932 1.00 41.42 H new ATOM 0 HH2 TRP A 77 32.567 -8.589 13.777 1.00 33.34 H new ATOM 1045 N ALA A 78 32.184 -15.070 16.191 1.00 31.14 N ATOM 1046 CA ALA A 78 32.580 -15.542 14.870 1.00 12.23 C ATOM 1047 C ALA A 78 31.380 -16.080 14.097 1.00 5.42 C ATOM 1048 O ALA A 78 31.462 -16.314 12.892 1.00 74.21 O ATOM 1049 CB ALA A 78 33.655 -16.612 14.992 1.00 14.12 C ATOM 0 H ALA A 78 32.575 -15.606 16.965 1.00 31.14 H new ATOM 0 HA ALA A 78 32.987 -14.696 14.316 1.00 12.23 H new ATOM 0 HB1 ALA A 78 33.941 -16.955 13.998 1.00 14.12 H new ATOM 0 HB2 ALA A 78 34.527 -16.196 15.497 1.00 14.12 H new ATOM 0 HB3 ALA A 78 33.268 -17.452 15.569 1.00 14.12 H new ATOM 1055 N ALA A 79 30.269 -16.273 14.799 1.00 74.32 N ATOM 1056 CA ALA A 79 29.052 -16.782 14.178 1.00 62.44 C ATOM 1057 C ALA A 79 28.329 -15.684 13.405 1.00 24.20 C ATOM 1058 O ALA A 79 27.726 -15.940 12.363 1.00 71.14 O ATOM 1059 CB ALA A 79 28.133 -17.382 15.231 1.00 14.01 C ATOM 0 H ALA A 79 30.186 -16.085 15.798 1.00 74.32 H new ATOM 0 HA ALA A 79 29.334 -17.562 13.471 1.00 62.44 H new ATOM 0 HB1 ALA A 79 27.228 -17.758 14.753 1.00 14.01 H new ATOM 0 HB2 ALA A 79 28.644 -18.202 15.736 1.00 14.01 H new ATOM 0 HB3 ALA A 79 27.867 -16.617 15.960 1.00 14.01 H new ATOM 1065 N ILE A 80 28.394 -14.462 13.923 1.00 61.22 N ATOM 1066 CA ILE A 80 27.746 -13.326 13.281 1.00 52.35 C ATOM 1067 C ILE A 80 28.714 -12.588 12.362 1.00 53.40 C ATOM 1068 O ILE A 80 28.425 -11.484 11.899 1.00 25.41 O ATOM 1069 CB ILE A 80 27.186 -12.336 14.319 1.00 31.04 C ATOM 1070 CG1 ILE A 80 26.093 -11.468 13.692 1.00 32.40 C ATOM 1071 CG2 ILE A 80 28.303 -11.468 14.879 1.00 13.23 C ATOM 1072 CD1 ILE A 80 25.617 -10.351 14.594 1.00 74.05 C ATOM 0 H ILE A 80 28.889 -14.234 14.785 1.00 61.22 H new ATOM 0 HA ILE A 80 26.921 -13.726 12.691 1.00 52.35 H new ATOM 0 HB ILE A 80 26.746 -12.903 15.139 1.00 31.04 H new ATOM 0 HG12 ILE A 80 26.469 -11.039 12.763 1.00 32.40 H new ATOM 0 HG13 ILE A 80 25.244 -12.100 13.430 1.00 32.40 H new ATOM 0 HG21 ILE A 80 27.892 -10.773 15.611 1.00 13.23 H new ATOM 0 HG22 ILE A 80 29.050 -12.101 15.359 1.00 13.23 H new ATOM 0 HG23 ILE A 80 28.769 -10.907 14.069 1.00 13.23 H new ATOM 0 HD11 ILE A 80 24.843 -9.777 14.085 1.00 74.05 H new ATOM 0 HD12 ILE A 80 25.210 -10.774 15.513 1.00 74.05 H new ATOM 0 HD13 ILE A 80 26.454 -9.696 14.835 1.00 74.05 H new ATOM 1084 N GLN A 81 29.861 -13.205 12.102 1.00 63.45 N ATOM 1085 CA GLN A 81 30.871 -12.607 11.237 1.00 64.02 C ATOM 1086 C GLN A 81 30.309 -12.345 9.844 1.00 40.44 C ATOM 1087 O GLN A 81 30.283 -11.212 9.361 1.00 21.22 O ATOM 1088 CB GLN A 81 32.096 -13.518 11.142 1.00 65.00 C ATOM 1089 CG GLN A 81 33.382 -12.860 11.616 1.00 1.03 C ATOM 1090 CD GLN A 81 34.400 -13.864 12.119 1.00 25.04 C ATOM 1091 OE1 GLN A 81 34.716 -14.840 11.438 1.00 30.01 O ATOM 1092 NE2 GLN A 81 34.921 -13.629 13.318 1.00 23.31 N ATOM 0 H GLN A 81 30.115 -14.119 12.478 1.00 63.45 H new ATOM 0 HA GLN A 81 31.169 -11.654 11.674 1.00 64.02 H new ATOM 0 HB2 GLN A 81 31.918 -14.416 11.734 1.00 65.00 H new ATOM 0 HB3 GLN A 81 32.221 -13.838 10.108 1.00 65.00 H new ATOM 0 HG2 GLN A 81 33.816 -12.288 10.796 1.00 1.03 H new ATOM 0 HG3 GLN A 81 33.151 -12.152 12.412 1.00 1.03 H new ATOM 0 HE21 GLN A 81 34.630 -12.808 13.848 1.00 23.31 H new ATOM 0 HE22 GLN A 81 35.612 -14.270 13.708 1.00 23.31 H new ATOM 1101 N PRO A 82 29.848 -13.415 9.180 1.00 72.11 N ATOM 1102 CA PRO A 82 29.277 -13.326 7.833 1.00 43.35 C ATOM 1103 C PRO A 82 27.928 -12.615 7.820 1.00 4.42 C ATOM 1104 O PRO A 82 27.582 -11.935 6.854 1.00 64.14 O ATOM 1105 CB PRO A 82 29.113 -14.790 7.419 1.00 64.32 C ATOM 1106 CG PRO A 82 28.992 -15.535 8.703 1.00 21.41 C ATOM 1107 CD PRO A 82 29.847 -14.795 9.694 1.00 64.02 C ATOM 0 HA PRO A 82 29.910 -12.747 7.161 1.00 43.35 H new ATOM 0 HB2 PRO A 82 28.229 -14.929 6.796 1.00 64.32 H new ATOM 0 HB3 PRO A 82 29.969 -15.136 6.840 1.00 64.32 H new ATOM 0 HG2 PRO A 82 27.955 -15.574 9.035 1.00 21.41 H new ATOM 0 HG3 PRO A 82 29.329 -16.565 8.590 1.00 21.41 H new ATOM 0 HD2 PRO A 82 29.433 -14.849 10.701 1.00 64.02 H new ATOM 0 HD3 PRO A 82 30.855 -15.207 9.742 1.00 64.02 H new ATOM 1115 N PHE A 83 27.170 -12.775 8.900 1.00 43.12 N ATOM 1116 CA PHE A 83 25.858 -12.148 9.013 1.00 64.33 C ATOM 1117 C PHE A 83 25.990 -10.676 9.391 1.00 33.05 C ATOM 1118 O PHE A 83 25.048 -9.897 9.239 1.00 74.33 O ATOM 1119 CB PHE A 83 25.008 -12.880 10.053 1.00 71.31 C ATOM 1120 CG PHE A 83 23.622 -12.319 10.197 1.00 4.51 C ATOM 1121 CD1 PHE A 83 22.879 -11.977 9.079 1.00 42.31 C ATOM 1122 CD2 PHE A 83 23.063 -12.132 11.451 1.00 4.21 C ATOM 1123 CE1 PHE A 83 21.604 -11.460 9.208 1.00 12.20 C ATOM 1124 CE2 PHE A 83 21.788 -11.616 11.586 1.00 4.15 C ATOM 1125 CZ PHE A 83 21.058 -11.278 10.464 1.00 62.33 C ATOM 0 H PHE A 83 27.442 -13.333 9.709 1.00 43.12 H new ATOM 0 HA PHE A 83 25.367 -12.213 8.042 1.00 64.33 H new ATOM 0 HB2 PHE A 83 24.939 -13.932 9.778 1.00 71.31 H new ATOM 0 HB3 PHE A 83 25.512 -12.835 11.019 1.00 71.31 H new ATOM 0 HD1 PHE A 83 23.301 -12.116 8.095 1.00 42.31 H new ATOM 0 HD2 PHE A 83 23.630 -12.392 12.333 1.00 4.21 H new ATOM 0 HE1 PHE A 83 21.035 -11.199 8.328 1.00 12.20 H new ATOM 0 HE2 PHE A 83 21.363 -11.477 12.569 1.00 4.15 H new ATOM 0 HZ PHE A 83 20.063 -10.872 10.568 1.00 62.33 H new ATOM 1135 N LEU A 84 27.164 -10.301 9.887 1.00 70.42 N ATOM 1136 CA LEU A 84 27.420 -8.923 10.289 1.00 41.43 C ATOM 1137 C LEU A 84 27.101 -7.956 9.153 1.00 74.02 C ATOM 1138 O LEU A 84 26.846 -6.773 9.383 1.00 74.53 O ATOM 1139 CB LEU A 84 28.879 -8.758 10.718 1.00 21.40 C ATOM 1140 CG LEU A 84 29.112 -8.019 12.036 1.00 52.42 C ATOM 1141 CD1 LEU A 84 28.855 -6.529 11.864 1.00 22.44 C ATOM 1142 CD2 LEU A 84 28.226 -8.592 13.133 1.00 41.53 C ATOM 0 H LEU A 84 27.954 -10.933 10.020 1.00 70.42 H new ATOM 0 HA LEU A 84 26.771 -8.691 11.133 1.00 41.43 H new ATOM 0 HB2 LEU A 84 29.328 -9.748 10.796 1.00 21.40 H new ATOM 0 HB3 LEU A 84 29.411 -8.228 9.928 1.00 21.40 H new ATOM 0 HG LEU A 84 30.153 -8.156 12.329 1.00 52.42 H new ATOM 0 HD11 LEU A 84 29.026 -6.019 12.812 1.00 22.44 H new ATOM 0 HD12 LEU A 84 29.531 -6.128 11.109 1.00 22.44 H new ATOM 0 HD13 LEU A 84 27.824 -6.372 11.548 1.00 22.44 H new ATOM 0 HD21 LEU A 84 28.405 -8.054 14.064 1.00 41.53 H new ATOM 0 HD22 LEU A 84 27.179 -8.485 12.848 1.00 41.53 H new ATOM 0 HD23 LEU A 84 28.458 -9.648 13.274 1.00 41.53 H new ATOM 1154 N CYS A 85 27.114 -8.467 7.926 1.00 21.33 N ATOM 1155 CA CYS A 85 26.824 -7.651 6.754 1.00 42.02 C ATOM 1156 C CYS A 85 25.364 -7.798 6.336 1.00 31.20 C ATOM 1157 O CYS A 85 24.728 -6.833 5.915 1.00 14.42 O ATOM 1158 CB CYS A 85 27.740 -8.045 5.593 1.00 2.43 C ATOM 1159 SG CYS A 85 29.345 -8.732 6.113 1.00 2.10 S ATOM 0 H CYS A 85 27.323 -9.444 7.718 1.00 21.33 H new ATOM 0 HA CYS A 85 27.006 -6.608 7.015 1.00 42.02 H new ATOM 0 HB2 CYS A 85 27.227 -8.779 4.972 1.00 2.43 H new ATOM 0 HB3 CYS A 85 27.917 -7.168 4.970 1.00 2.43 H new ATOM 1164 N ALA A 86 24.840 -9.014 6.456 1.00 54.51 N ATOM 1165 CA ALA A 86 23.455 -9.287 6.093 1.00 34.23 C ATOM 1166 C ALA A 86 22.509 -8.949 7.241 1.00 5.32 C ATOM 1167 O ALA A 86 21.306 -9.194 7.160 1.00 13.44 O ATOM 1168 CB ALA A 86 23.293 -10.744 5.687 1.00 65.43 C ATOM 0 H ALA A 86 25.354 -9.825 6.802 1.00 54.51 H new ATOM 0 HA ALA A 86 23.197 -8.653 5.245 1.00 34.23 H new ATOM 0 HB1 ALA A 86 22.254 -10.934 5.419 1.00 65.43 H new ATOM 0 HB2 ALA A 86 23.933 -10.957 4.831 1.00 65.43 H new ATOM 0 HB3 ALA A 86 23.576 -11.387 6.520 1.00 65.43 H new ATOM 1174 N VAL A 87 23.063 -8.385 8.310 1.00 15.15 N ATOM 1175 CA VAL A 87 22.269 -8.012 9.475 1.00 34.52 C ATOM 1176 C VAL A 87 22.122 -6.499 9.579 1.00 54.41 C ATOM 1177 O VAL A 87 21.074 -5.992 9.980 1.00 11.25 O ATOM 1178 CB VAL A 87 22.896 -8.547 10.776 1.00 2.44 C ATOM 1179 CG1 VAL A 87 24.220 -7.851 11.056 1.00 70.54 C ATOM 1180 CG2 VAL A 87 21.935 -8.370 11.943 1.00 44.15 C ATOM 0 H VAL A 87 24.058 -8.177 8.393 1.00 15.15 H new ATOM 0 HA VAL A 87 21.284 -8.461 9.344 1.00 34.52 H new ATOM 0 HB VAL A 87 23.091 -9.612 10.653 1.00 2.44 H new ATOM 0 HG11 VAL A 87 24.648 -8.242 11.979 1.00 70.54 H new ATOM 0 HG12 VAL A 87 24.908 -8.033 10.231 1.00 70.54 H new ATOM 0 HG13 VAL A 87 24.053 -6.779 11.159 1.00 70.54 H new ATOM 0 HG21 VAL A 87 22.394 -8.753 12.854 1.00 44.15 H new ATOM 0 HG22 VAL A 87 21.707 -7.312 12.069 1.00 44.15 H new ATOM 0 HG23 VAL A 87 21.014 -8.918 11.743 1.00 44.15 H new ATOM 1190 N PHE A 88 23.179 -5.781 9.214 1.00 54.34 N ATOM 1191 CA PHE A 88 23.168 -4.323 9.266 1.00 70.42 C ATOM 1192 C PHE A 88 23.201 -3.729 7.861 1.00 50.31 C ATOM 1193 O PHE A 88 22.615 -2.676 7.606 1.00 65.14 O ATOM 1194 CB PHE A 88 24.361 -3.812 10.076 1.00 32.33 C ATOM 1195 CG PHE A 88 24.513 -4.487 11.409 1.00 20.25 C ATOM 1196 CD1 PHE A 88 23.436 -4.592 12.274 1.00 33.45 C ATOM 1197 CD2 PHE A 88 25.733 -5.017 11.797 1.00 1.25 C ATOM 1198 CE1 PHE A 88 23.573 -5.212 13.502 1.00 24.31 C ATOM 1199 CE2 PHE A 88 25.877 -5.638 13.024 1.00 73.22 C ATOM 1200 CZ PHE A 88 24.795 -5.737 13.877 1.00 50.13 C ATOM 0 H PHE A 88 24.054 -6.185 8.879 1.00 54.34 H new ATOM 0 HA PHE A 88 22.245 -4.008 9.753 1.00 70.42 H new ATOM 0 HB2 PHE A 88 25.273 -3.959 9.497 1.00 32.33 H new ATOM 0 HB3 PHE A 88 24.252 -2.739 10.231 1.00 32.33 H new ATOM 0 HD1 PHE A 88 22.478 -4.185 11.986 1.00 33.45 H new ATOM 0 HD2 PHE A 88 26.582 -4.944 11.133 1.00 1.25 H new ATOM 0 HE1 PHE A 88 22.726 -5.286 14.168 1.00 24.31 H new ATOM 0 HE2 PHE A 88 26.834 -6.045 13.315 1.00 73.22 H new ATOM 0 HZ PHE A 88 24.904 -6.224 14.835 1.00 50.13 H new ATOM 1210 N LYS A 89 23.891 -4.410 6.953 1.00 72.24 N ATOM 1211 CA LYS A 89 24.001 -3.952 5.573 1.00 43.02 C ATOM 1212 C LYS A 89 23.270 -4.897 4.625 1.00 31.43 C ATOM 1213 O LYS A 89 23.879 -5.699 3.917 1.00 43.34 O ATOM 1214 CB LYS A 89 25.473 -3.843 5.166 1.00 13.12 C ATOM 1215 CG LYS A 89 26.266 -2.863 6.012 1.00 4.53 C ATOM 1216 CD LYS A 89 26.953 -3.558 7.176 1.00 71.34 C ATOM 1217 CE LYS A 89 27.400 -2.563 8.235 1.00 3.10 C ATOM 1218 NZ LYS A 89 28.883 -2.519 8.364 1.00 22.10 N ATOM 0 H LYS A 89 24.383 -5.282 7.148 1.00 72.24 H new ATOM 0 HA LYS A 89 23.537 -2.968 5.506 1.00 43.02 H new ATOM 0 HB2 LYS A 89 25.935 -4.828 5.237 1.00 13.12 H new ATOM 0 HB3 LYS A 89 25.531 -3.538 4.121 1.00 13.12 H new ATOM 0 HG2 LYS A 89 27.012 -2.367 5.392 1.00 4.53 H new ATOM 0 HG3 LYS A 89 25.601 -2.088 6.392 1.00 4.53 H new ATOM 0 HD2 LYS A 89 26.272 -4.283 7.621 1.00 71.34 H new ATOM 0 HD3 LYS A 89 27.816 -4.114 6.811 1.00 71.34 H new ATOM 0 HE2 LYS A 89 27.028 -1.570 7.981 1.00 3.10 H new ATOM 0 HE3 LYS A 89 26.960 -2.832 9.195 1.00 3.10 H new ATOM 0 HZ1 LYS A 89 29.147 -1.829 9.096 1.00 22.10 H new ATOM 0 HZ2 LYS A 89 29.236 -3.460 8.631 1.00 22.10 H new ATOM 0 HZ3 LYS A 89 29.302 -2.237 7.455 1.00 22.10 H new ATOM 1232 N PRO A 90 21.932 -4.803 4.610 1.00 50.24 N ATOM 1233 CA PRO A 90 21.089 -5.641 3.752 1.00 42.24 C ATOM 1234 C PRO A 90 21.229 -5.285 2.276 1.00 44.34 C ATOM 1235 O PRO A 90 21.314 -4.111 1.915 1.00 41.34 O ATOM 1236 CB PRO A 90 19.671 -5.338 4.242 1.00 3.24 C ATOM 1237 CG PRO A 90 19.760 -3.975 4.838 1.00 32.33 C ATOM 1238 CD PRO A 90 21.139 -3.870 5.428 1.00 61.01 C ATOM 0 HA PRO A 90 21.362 -6.694 3.818 1.00 42.24 H new ATOM 0 HB2 PRO A 90 18.954 -5.365 3.421 1.00 3.24 H new ATOM 0 HB3 PRO A 90 19.341 -6.071 4.978 1.00 3.24 H new ATOM 0 HG2 PRO A 90 19.600 -3.207 4.081 1.00 32.33 H new ATOM 0 HG3 PRO A 90 18.996 -3.833 5.603 1.00 32.33 H new ATOM 0 HD2 PRO A 90 21.526 -2.853 5.366 1.00 61.01 H new ATOM 0 HD3 PRO A 90 21.148 -4.151 6.481 1.00 61.01 H new ATOM 1246 N LYS A 91 21.253 -6.305 1.425 1.00 20.31 N ATOM 1247 CA LYS A 91 21.381 -6.101 -0.013 1.00 2.12 C ATOM 1248 C LYS A 91 20.148 -5.400 -0.575 1.00 23.42 C ATOM 1249 O LYS A 91 19.158 -6.046 -0.920 1.00 0.13 O ATOM 1250 CB LYS A 91 21.588 -7.441 -0.723 1.00 14.21 C ATOM 1251 CG LYS A 91 21.712 -7.317 -2.232 1.00 10.14 C ATOM 1252 CD LYS A 91 22.321 -8.566 -2.845 1.00 61.34 C ATOM 1253 CE LYS A 91 21.843 -8.775 -4.274 1.00 70.31 C ATOM 1254 NZ LYS A 91 22.340 -10.059 -4.843 1.00 13.20 N ATOM 0 H LYS A 91 21.185 -7.283 1.707 1.00 20.31 H new ATOM 0 HA LYS A 91 22.250 -5.466 -0.189 1.00 2.12 H new ATOM 0 HB2 LYS A 91 22.488 -7.915 -0.331 1.00 14.21 H new ATOM 0 HB3 LYS A 91 20.752 -8.100 -0.488 1.00 14.21 H new ATOM 0 HG2 LYS A 91 20.728 -7.140 -2.666 1.00 10.14 H new ATOM 0 HG3 LYS A 91 22.328 -6.452 -2.478 1.00 10.14 H new ATOM 0 HD2 LYS A 91 23.408 -8.486 -2.832 1.00 61.34 H new ATOM 0 HD3 LYS A 91 22.058 -9.435 -2.241 1.00 61.34 H new ATOM 0 HE2 LYS A 91 20.753 -8.765 -4.298 1.00 70.31 H new ATOM 0 HE3 LYS A 91 22.183 -7.947 -4.896 1.00 70.31 H new ATOM 0 HZ1 LYS A 91 21.993 -10.164 -5.818 1.00 13.20 H new ATOM 0 HZ2 LYS A 91 23.380 -10.059 -4.844 1.00 13.20 H new ATOM 0 HZ3 LYS A 91 21.995 -10.852 -4.265 1.00 13.20 H new ATOM 1268 N CYS A 92 20.216 -4.076 -0.666 1.00 34.42 N ATOM 1269 CA CYS A 92 19.106 -3.288 -1.187 1.00 12.31 C ATOM 1270 C CYS A 92 19.285 -3.015 -2.678 1.00 21.04 C ATOM 1271 O CYS A 92 20.151 -2.237 -3.076 1.00 53.40 O ATOM 1272 CB CYS A 92 18.990 -1.966 -0.426 1.00 4.33 C ATOM 1273 SG CYS A 92 17.557 -0.951 -0.911 1.00 3.04 S ATOM 0 H CYS A 92 21.028 -3.527 -0.386 1.00 34.42 H new ATOM 0 HA CYS A 92 18.190 -3.861 -1.048 1.00 12.31 H new ATOM 0 HB2 CYS A 92 18.927 -2.178 0.641 1.00 4.33 H new ATOM 0 HB3 CYS A 92 19.901 -1.388 -0.583 1.00 4.33 H new ATOM 1278 N GLU A 93 18.460 -3.662 -3.495 1.00 42.33 N ATOM 1279 CA GLU A 93 18.529 -3.489 -4.942 1.00 15.14 C ATOM 1280 C GLU A 93 17.153 -3.162 -5.516 1.00 60.42 C ATOM 1281 O GLU A 93 16.146 -3.207 -4.810 1.00 34.31 O ATOM 1282 CB GLU A 93 19.083 -4.753 -5.603 1.00 14.41 C ATOM 1283 CG GLU A 93 20.553 -4.999 -5.309 1.00 50.42 C ATOM 1284 CD GLU A 93 21.402 -3.758 -5.504 1.00 3.42 C ATOM 1285 OE1 GLU A 93 21.316 -3.143 -6.587 1.00 53.50 O ATOM 1286 OE2 GLU A 93 22.154 -3.402 -4.572 1.00 13.42 O ATOM 0 H GLU A 93 17.737 -4.310 -3.181 1.00 42.33 H new ATOM 0 HA GLU A 93 19.199 -2.655 -5.152 1.00 15.14 H new ATOM 0 HB2 GLU A 93 18.505 -5.613 -5.265 1.00 14.41 H new ATOM 0 HB3 GLU A 93 18.944 -4.680 -6.682 1.00 14.41 H new ATOM 0 HG2 GLU A 93 20.661 -5.351 -4.283 1.00 50.42 H new ATOM 0 HG3 GLU A 93 20.922 -5.793 -5.959 1.00 50.42 H new ATOM 1293 N LYS A 94 17.119 -2.833 -6.803 1.00 10.21 N ATOM 1294 CA LYS A 94 15.869 -2.499 -7.475 1.00 12.12 C ATOM 1295 C LYS A 94 15.391 -3.659 -8.343 1.00 11.33 C ATOM 1296 O LYS A 94 15.932 -3.903 -9.422 1.00 11.44 O ATOM 1297 CB LYS A 94 16.047 -1.245 -8.334 1.00 13.12 C ATOM 1298 CG LYS A 94 15.237 -0.055 -7.848 1.00 22.01 C ATOM 1299 CD LYS A 94 15.291 1.097 -8.837 1.00 3.42 C ATOM 1300 CE LYS A 94 16.716 1.586 -9.046 1.00 65.43 C ATOM 1301 NZ LYS A 94 16.755 2.993 -9.532 1.00 71.33 N ATOM 0 H LYS A 94 17.944 -2.791 -7.402 1.00 10.21 H new ATOM 0 HA LYS A 94 15.116 -2.305 -6.711 1.00 12.12 H new ATOM 0 HB2 LYS A 94 17.102 -0.973 -8.351 1.00 13.12 H new ATOM 0 HB3 LYS A 94 15.761 -1.474 -9.360 1.00 13.12 H new ATOM 0 HG2 LYS A 94 14.201 -0.357 -7.696 1.00 22.01 H new ATOM 0 HG3 LYS A 94 15.618 0.276 -6.882 1.00 22.01 H new ATOM 0 HD2 LYS A 94 14.871 0.779 -9.791 1.00 3.42 H new ATOM 0 HD3 LYS A 94 14.673 1.918 -8.475 1.00 3.42 H new ATOM 0 HE2 LYS A 94 17.267 1.510 -8.108 1.00 65.43 H new ATOM 0 HE3 LYS A 94 17.220 0.940 -9.765 1.00 65.43 H new ATOM 0 HZ1 LYS A 94 17.744 3.288 -9.662 1.00 71.33 H new ATOM 0 HZ2 LYS A 94 16.251 3.061 -10.439 1.00 71.33 H new ATOM 0 HZ3 LYS A 94 16.297 3.614 -8.835 1.00 71.33 H new ATOM 1315 N ILE A 95 14.374 -4.369 -7.866 1.00 3.14 N ATOM 1316 CA ILE A 95 13.823 -5.501 -8.600 1.00 12.12 C ATOM 1317 C ILE A 95 12.725 -5.052 -9.559 1.00 5.01 C ATOM 1318 O ILE A 95 11.733 -4.453 -9.146 1.00 61.52 O ATOM 1319 CB ILE A 95 13.251 -6.566 -7.646 1.00 31.03 C ATOM 1320 CG1 ILE A 95 14.289 -6.944 -6.587 1.00 40.01 C ATOM 1321 CG2 ILE A 95 12.811 -7.795 -8.427 1.00 21.33 C ATOM 1322 CD1 ILE A 95 13.682 -7.490 -5.313 1.00 42.45 C ATOM 0 H ILE A 95 13.915 -4.180 -6.975 1.00 3.14 H new ATOM 0 HA ILE A 95 14.644 -5.938 -9.169 1.00 12.12 H new ATOM 0 HB ILE A 95 12.380 -6.150 -7.141 1.00 31.03 H new ATOM 0 HG12 ILE A 95 14.968 -7.688 -7.004 1.00 40.01 H new ATOM 0 HG13 ILE A 95 14.888 -6.065 -6.347 1.00 40.01 H new ATOM 0 HG21 ILE A 95 12.409 -8.539 -7.739 1.00 21.33 H new ATOM 0 HG22 ILE A 95 12.042 -7.513 -9.146 1.00 21.33 H new ATOM 0 HG23 ILE A 95 13.666 -8.215 -8.956 1.00 21.33 H new ATOM 0 HD11 ILE A 95 14.476 -7.737 -4.608 1.00 42.45 H new ATOM 0 HD12 ILE A 95 13.025 -6.740 -4.872 1.00 42.45 H new ATOM 0 HD13 ILE A 95 13.107 -8.388 -5.540 1.00 42.45 H new ATOM 1334 N ASN A 96 12.911 -5.347 -10.841 1.00 70.24 N ATOM 1335 CA ASN A 96 11.936 -4.975 -11.860 1.00 71.11 C ATOM 1336 C ASN A 96 11.735 -3.463 -11.895 1.00 22.14 C ATOM 1337 O ASN A 96 10.735 -2.971 -12.414 1.00 52.24 O ATOM 1338 CB ASN A 96 10.600 -5.672 -11.596 1.00 32.33 C ATOM 1339 CG ASN A 96 10.765 -6.962 -10.815 1.00 41.20 C ATOM 1340 OD1 ASN A 96 11.426 -7.896 -11.270 1.00 51.41 O ATOM 1341 ND2 ASN A 96 10.163 -7.019 -9.633 1.00 3.33 N ATOM 0 H ASN A 96 13.728 -5.842 -11.199 1.00 70.24 H new ATOM 0 HA ASN A 96 12.320 -5.295 -12.828 1.00 71.11 H new ATOM 0 HB2 ASN A 96 9.944 -4.998 -11.045 1.00 32.33 H new ATOM 0 HB3 ASN A 96 10.111 -5.886 -12.546 1.00 32.33 H new ATOM 0 HD21 ASN A 96 10.238 -7.861 -9.062 1.00 3.33 H new ATOM 0 HD22 ASN A 96 9.625 -6.221 -9.295 1.00 3.33 H new ATOM 1348 N GLY A 97 12.695 -2.731 -11.337 1.00 62.21 N ATOM 1349 CA GLY A 97 12.606 -1.283 -11.315 1.00 14.11 C ATOM 1350 C GLY A 97 11.998 -0.759 -10.029 1.00 24.24 C ATOM 1351 O GLY A 97 11.701 0.429 -9.915 1.00 13.32 O ATOM 0 H GLY A 97 13.533 -3.115 -10.900 1.00 62.21 H new ATOM 0 HA2 GLY A 97 13.602 -0.859 -11.442 1.00 14.11 H new ATOM 0 HA3 GLY A 97 12.006 -0.946 -12.161 1.00 14.11 H new ATOM 1355 N GLU A 98 11.813 -1.649 -9.058 1.00 41.22 N ATOM 1356 CA GLU A 98 11.235 -1.269 -7.775 1.00 13.23 C ATOM 1357 C GLU A 98 12.255 -1.424 -6.651 1.00 30.53 C ATOM 1358 O GLU A 98 12.855 -2.487 -6.486 1.00 4.53 O ATOM 1359 CB GLU A 98 9.997 -2.118 -7.476 1.00 43.04 C ATOM 1360 CG GLU A 98 9.033 -2.221 -8.646 1.00 64.24 C ATOM 1361 CD GLU A 98 7.905 -3.201 -8.388 1.00 41.20 C ATOM 1362 OE1 GLU A 98 8.126 -4.418 -8.555 1.00 32.41 O ATOM 1363 OE2 GLU A 98 6.801 -2.749 -8.018 1.00 40.24 O ATOM 0 H GLU A 98 12.055 -2.637 -9.136 1.00 41.22 H new ATOM 0 HA GLU A 98 10.942 -0.221 -7.834 1.00 13.23 H new ATOM 0 HB2 GLU A 98 10.315 -3.120 -7.189 1.00 43.04 H new ATOM 0 HB3 GLU A 98 9.473 -1.692 -6.620 1.00 43.04 H new ATOM 0 HG2 GLU A 98 8.614 -1.237 -8.854 1.00 64.24 H new ATOM 0 HG3 GLU A 98 9.580 -2.529 -9.537 1.00 64.24 H new ATOM 1370 N ASP A 99 12.446 -0.359 -5.881 1.00 52.53 N ATOM 1371 CA ASP A 99 13.393 -0.376 -4.772 1.00 54.43 C ATOM 1372 C ASP A 99 12.944 -1.353 -3.690 1.00 2.41 C ATOM 1373 O ASP A 99 11.939 -1.129 -3.016 1.00 2.41 O ATOM 1374 CB ASP A 99 13.543 1.027 -4.181 1.00 21.35 C ATOM 1375 CG ASP A 99 13.819 2.076 -5.240 1.00 22.52 C ATOM 1376 OD1 ASP A 99 15.006 2.296 -5.561 1.00 75.42 O ATOM 1377 OD2 ASP A 99 12.849 2.677 -5.747 1.00 20.01 O ATOM 0 H ASP A 99 11.957 0.528 -6.004 1.00 52.53 H new ATOM 0 HA ASP A 99 14.359 -0.705 -5.155 1.00 54.43 H new ATOM 0 HB2 ASP A 99 12.633 1.290 -3.642 1.00 21.35 H new ATOM 0 HB3 ASP A 99 14.355 1.027 -3.454 1.00 21.35 H new ATOM 1382 N MET A 100 13.696 -2.437 -3.530 1.00 51.22 N ATOM 1383 CA MET A 100 13.375 -3.448 -2.529 1.00 43.15 C ATOM 1384 C MET A 100 14.596 -3.772 -1.674 1.00 31.21 C ATOM 1385 O MET A 100 15.672 -3.207 -1.870 1.00 71.34 O ATOM 1386 CB MET A 100 12.859 -4.720 -3.205 1.00 44.34 C ATOM 1387 CG MET A 100 11.754 -4.465 -4.217 1.00 42.43 C ATOM 1388 SD MET A 100 10.238 -5.360 -3.830 1.00 71.45 S ATOM 1389 CE MET A 100 10.395 -6.777 -4.915 1.00 43.24 C ATOM 0 H MET A 100 14.531 -2.638 -4.080 1.00 51.22 H new ATOM 0 HA MET A 100 12.595 -3.048 -1.881 1.00 43.15 H new ATOM 0 HB2 MET A 100 13.690 -5.219 -3.704 1.00 44.34 H new ATOM 0 HB3 MET A 100 12.490 -5.404 -2.441 1.00 44.34 H new ATOM 0 HG2 MET A 100 11.541 -3.397 -4.255 1.00 42.43 H new ATOM 0 HG3 MET A 100 12.100 -4.756 -5.209 1.00 42.43 H new ATOM 0 HE1 MET A 100 9.409 -7.068 -5.279 1.00 43.24 H new ATOM 0 HE2 MET A 100 11.032 -6.519 -5.761 1.00 43.24 H new ATOM 0 HE3 MET A 100 10.839 -7.608 -4.367 1.00 43.24 H new ATOM 1399 N VAL A 101 14.421 -4.685 -0.723 1.00 63.05 N ATOM 1400 CA VAL A 101 15.509 -5.085 0.162 1.00 52.24 C ATOM 1401 C VAL A 101 15.567 -6.601 0.311 1.00 14.11 C ATOM 1402 O VAL A 101 14.576 -7.296 0.083 1.00 42.11 O ATOM 1403 CB VAL A 101 15.361 -4.448 1.556 1.00 14.30 C ATOM 1404 CG1 VAL A 101 15.238 -2.936 1.442 1.00 3.22 C ATOM 1405 CG2 VAL A 101 14.161 -5.035 2.285 1.00 42.53 C ATOM 0 H VAL A 101 13.537 -5.161 -0.546 1.00 63.05 H new ATOM 0 HA VAL A 101 16.434 -4.732 -0.294 1.00 52.24 H new ATOM 0 HB VAL A 101 16.256 -4.673 2.136 1.00 14.30 H new ATOM 0 HG11 VAL A 101 15.134 -2.503 2.437 1.00 3.22 H new ATOM 0 HG12 VAL A 101 16.130 -2.533 0.963 1.00 3.22 H new ATOM 0 HG13 VAL A 101 14.361 -2.686 0.845 1.00 3.22 H new ATOM 0 HG21 VAL A 101 14.071 -4.574 3.268 1.00 42.53 H new ATOM 0 HG22 VAL A 101 13.256 -4.842 1.710 1.00 42.53 H new ATOM 0 HG23 VAL A 101 14.295 -6.111 2.400 1.00 42.53 H new ATOM 1415 N TYR A 102 16.732 -7.108 0.696 1.00 5.43 N ATOM 1416 CA TYR A 102 16.921 -8.542 0.875 1.00 74.42 C ATOM 1417 C TYR A 102 17.212 -8.876 2.335 1.00 61.23 C ATOM 1418 O TYR A 102 18.106 -8.294 2.951 1.00 55.31 O ATOM 1419 CB TYR A 102 18.062 -9.043 -0.012 1.00 2.40 C ATOM 1420 CG TYR A 102 17.640 -9.336 -1.434 1.00 43.10 C ATOM 1421 CD1 TYR A 102 16.717 -10.336 -1.713 1.00 14.20 C ATOM 1422 CD2 TYR A 102 18.166 -8.614 -2.499 1.00 32.25 C ATOM 1423 CE1 TYR A 102 16.329 -10.608 -3.011 1.00 14.03 C ATOM 1424 CE2 TYR A 102 17.783 -8.878 -3.799 1.00 74.41 C ATOM 1425 CZ TYR A 102 16.864 -9.876 -4.050 1.00 70.21 C ATOM 1426 OH TYR A 102 16.481 -10.143 -5.344 1.00 73.45 O ATOM 0 H TYR A 102 17.561 -6.546 0.890 1.00 5.43 H new ATOM 0 HA TYR A 102 15.998 -9.043 0.584 1.00 74.42 H new ATOM 0 HB2 TYR A 102 18.856 -8.296 -0.024 1.00 2.40 H new ATOM 0 HB3 TYR A 102 18.482 -9.948 0.427 1.00 2.40 H new ATOM 0 HD1 TYR A 102 16.295 -10.911 -0.902 1.00 14.20 H new ATOM 0 HD2 TYR A 102 18.887 -7.833 -2.306 1.00 32.25 H new ATOM 0 HE1 TYR A 102 15.611 -11.389 -3.211 1.00 14.03 H new ATOM 0 HE2 TYR A 102 18.200 -8.306 -4.615 1.00 74.41 H new ATOM 0 HH TYR A 102 16.950 -9.538 -5.955 1.00 73.45 H new ATOM 1436 N LEU A 103 16.452 -9.818 2.882 1.00 22.32 N ATOM 1437 CA LEU A 103 16.628 -10.232 4.270 1.00 32.11 C ATOM 1438 C LEU A 103 17.361 -11.567 4.352 1.00 62.14 C ATOM 1439 O LEU A 103 17.406 -12.338 3.393 1.00 65.03 O ATOM 1440 CB LEU A 103 15.270 -10.340 4.966 1.00 0.24 C ATOM 1441 CG LEU A 103 14.124 -10.897 4.121 1.00 43.44 C ATOM 1442 CD1 LEU A 103 14.409 -12.335 3.717 1.00 51.12 C ATOM 1443 CD2 LEU A 103 12.808 -10.804 4.879 1.00 60.03 C ATOM 0 H LEU A 103 15.708 -10.309 2.386 1.00 22.32 H new ATOM 0 HA LEU A 103 17.230 -9.477 4.775 1.00 32.11 H new ATOM 0 HB2 LEU A 103 15.385 -10.971 5.847 1.00 0.24 H new ATOM 0 HB3 LEU A 103 14.986 -9.349 5.319 1.00 0.24 H new ATOM 0 HG LEU A 103 14.041 -10.297 3.215 1.00 43.44 H new ATOM 0 HD11 LEU A 103 13.583 -12.715 3.116 1.00 51.12 H new ATOM 0 HD12 LEU A 103 15.329 -12.374 3.134 1.00 51.12 H new ATOM 0 HD13 LEU A 103 14.520 -12.949 4.611 1.00 51.12 H new ATOM 0 HD21 LEU A 103 12.004 -11.205 4.262 1.00 60.03 H new ATOM 0 HD22 LEU A 103 12.878 -11.379 5.802 1.00 60.03 H new ATOM 0 HD23 LEU A 103 12.598 -9.761 5.116 1.00 60.03 H new ATOM 1455 N PRO A 104 17.948 -11.849 5.524 1.00 22.41 N ATOM 1456 CA PRO A 104 18.688 -13.093 5.760 1.00 52.10 C ATOM 1457 C PRO A 104 17.772 -14.311 5.814 1.00 51.14 C ATOM 1458 O PRO A 104 16.617 -14.213 6.227 1.00 14.10 O ATOM 1459 CB PRO A 104 19.348 -12.860 7.121 1.00 21.12 C ATOM 1460 CG PRO A 104 18.476 -11.861 7.799 1.00 11.34 C ATOM 1461 CD PRO A 104 17.935 -10.977 6.710 1.00 14.31 C ATOM 0 HA PRO A 104 19.395 -13.305 4.958 1.00 52.10 H new ATOM 0 HB2 PRO A 104 19.410 -13.785 7.694 1.00 21.12 H new ATOM 0 HB3 PRO A 104 20.366 -12.486 7.009 1.00 21.12 H new ATOM 0 HG2 PRO A 104 17.668 -12.352 8.340 1.00 11.34 H new ATOM 0 HG3 PRO A 104 19.041 -11.281 8.528 1.00 11.34 H new ATOM 0 HD2 PRO A 104 16.929 -10.626 6.940 1.00 14.31 H new ATOM 0 HD3 PRO A 104 18.555 -10.093 6.565 1.00 14.31 H new ATOM 1469 N SER A 105 18.295 -15.458 5.393 1.00 23.13 N ATOM 1470 CA SER A 105 17.523 -16.695 5.391 1.00 61.05 C ATOM 1471 C SER A 105 17.891 -17.568 6.586 1.00 1.04 C ATOM 1472 O SER A 105 18.746 -17.205 7.395 1.00 52.42 O ATOM 1473 CB SER A 105 17.759 -17.466 4.090 1.00 4.32 C ATOM 1474 OG SER A 105 17.254 -16.752 2.975 1.00 1.22 O ATOM 0 H SER A 105 19.250 -15.556 5.049 1.00 23.13 H new ATOM 0 HA SER A 105 16.467 -16.435 5.465 1.00 61.05 H new ATOM 0 HB2 SER A 105 18.826 -17.645 3.958 1.00 4.32 H new ATOM 0 HB3 SER A 105 17.277 -18.442 4.149 1.00 4.32 H new ATOM 0 HG SER A 105 17.419 -17.265 2.156 1.00 1.22 H new ATOM 1480 N TYR A 106 17.240 -18.721 6.692 1.00 52.22 N ATOM 1481 CA TYR A 106 17.496 -19.646 7.790 1.00 54.44 C ATOM 1482 C TYR A 106 18.986 -19.947 7.912 1.00 2.32 C ATOM 1483 O TYR A 106 19.490 -20.206 9.004 1.00 32.35 O ATOM 1484 CB TYR A 106 16.717 -20.946 7.581 1.00 11.41 C ATOM 1485 CG TYR A 106 17.384 -21.904 6.621 1.00 43.12 C ATOM 1486 CD1 TYR A 106 17.619 -21.543 5.300 1.00 62.04 C ATOM 1487 CD2 TYR A 106 17.779 -23.170 7.034 1.00 62.21 C ATOM 1488 CE1 TYR A 106 18.228 -22.415 4.418 1.00 20.43 C ATOM 1489 CE2 TYR A 106 18.390 -24.049 6.160 1.00 0.50 C ATOM 1490 CZ TYR A 106 18.612 -23.667 4.853 1.00 0.33 C ATOM 1491 OH TYR A 106 19.219 -24.539 3.979 1.00 31.33 O ATOM 0 H TYR A 106 16.531 -19.038 6.031 1.00 52.22 H new ATOM 0 HA TYR A 106 17.162 -19.175 8.714 1.00 54.44 H new ATOM 0 HB2 TYR A 106 16.588 -21.441 8.544 1.00 11.41 H new ATOM 0 HB3 TYR A 106 15.721 -20.707 7.209 1.00 11.41 H new ATOM 0 HD1 TYR A 106 17.320 -20.564 4.957 1.00 62.04 H new ATOM 0 HD2 TYR A 106 17.606 -23.473 8.056 1.00 62.21 H new ATOM 0 HE1 TYR A 106 18.402 -22.118 3.394 1.00 20.43 H new ATOM 0 HE2 TYR A 106 18.692 -25.029 6.498 1.00 0.50 H new ATOM 0 HH TYR A 106 19.427 -25.376 4.444 1.00 31.33 H new ATOM 1501 N GLU A 107 19.686 -19.909 6.782 1.00 12.04 N ATOM 1502 CA GLU A 107 21.119 -20.178 6.763 1.00 51.23 C ATOM 1503 C GLU A 107 21.886 -19.095 7.516 1.00 10.01 C ATOM 1504 O GLU A 107 22.620 -19.383 8.461 1.00 64.15 O ATOM 1505 CB GLU A 107 21.624 -20.267 5.321 1.00 11.31 C ATOM 1506 CG GLU A 107 22.586 -21.418 5.083 1.00 24.12 C ATOM 1507 CD GLU A 107 22.334 -22.127 3.767 1.00 34.51 C ATOM 1508 OE1 GLU A 107 21.705 -21.519 2.876 1.00 62.42 O ATOM 1509 OE2 GLU A 107 22.765 -23.291 3.629 1.00 71.41 O ATOM 0 H GLU A 107 19.284 -19.695 5.869 1.00 12.04 H new ATOM 0 HA GLU A 107 21.290 -21.133 7.260 1.00 51.23 H new ATOM 0 HB2 GLU A 107 20.770 -20.374 4.652 1.00 11.31 H new ATOM 0 HB3 GLU A 107 22.118 -19.331 5.060 1.00 11.31 H new ATOM 0 HG2 GLU A 107 23.609 -21.041 5.098 1.00 24.12 H new ATOM 0 HG3 GLU A 107 22.498 -22.134 5.900 1.00 24.12 H new ATOM 1516 N MET A 108 21.710 -17.848 7.090 1.00 31.43 N ATOM 1517 CA MET A 108 22.385 -16.722 7.725 1.00 72.03 C ATOM 1518 C MET A 108 22.118 -16.704 9.226 1.00 31.14 C ATOM 1519 O MET A 108 23.004 -16.389 10.021 1.00 2.30 O ATOM 1520 CB MET A 108 21.924 -15.405 7.097 1.00 3.13 C ATOM 1521 CG MET A 108 22.373 -15.229 5.656 1.00 44.42 C ATOM 1522 SD MET A 108 24.163 -15.078 5.499 1.00 3.35 S ATOM 1523 CE MET A 108 24.294 -13.564 4.550 1.00 31.44 C ATOM 0 H MET A 108 21.106 -17.592 6.309 1.00 31.43 H new ATOM 0 HA MET A 108 23.457 -16.837 7.567 1.00 72.03 H new ATOM 0 HB2 MET A 108 20.836 -15.353 7.139 1.00 3.13 H new ATOM 0 HB3 MET A 108 22.306 -14.575 7.692 1.00 3.13 H new ATOM 0 HG2 MET A 108 22.031 -16.080 5.067 1.00 44.42 H new ATOM 0 HG3 MET A 108 21.899 -14.341 5.238 1.00 44.42 H new ATOM 0 HE1 MET A 108 24.693 -13.788 3.561 1.00 31.44 H new ATOM 0 HE2 MET A 108 23.308 -13.111 4.450 1.00 31.44 H new ATOM 0 HE3 MET A 108 24.962 -12.871 5.062 1.00 31.44 H new ATOM 1533 N CYS A 109 20.892 -17.044 9.609 1.00 34.10 N ATOM 1534 CA CYS A 109 20.507 -17.066 11.015 1.00 24.42 C ATOM 1535 C CYS A 109 20.994 -18.345 11.692 1.00 52.23 C ATOM 1536 O CYS A 109 21.157 -18.390 12.911 1.00 25.41 O ATOM 1537 CB CYS A 109 18.988 -16.950 11.152 1.00 20.12 C ATOM 1538 SG CYS A 109 18.444 -15.932 12.562 1.00 63.41 S ATOM 0 H CYS A 109 20.147 -17.308 8.964 1.00 34.10 H new ATOM 0 HA CYS A 109 20.975 -16.214 11.507 1.00 24.42 H new ATOM 0 HB2 CYS A 109 18.582 -16.526 10.233 1.00 20.12 H new ATOM 0 HB3 CYS A 109 18.566 -17.950 11.255 1.00 20.12 H new ATOM 1543 N ARG A 110 21.223 -19.381 10.891 1.00 1.24 N ATOM 1544 CA ARG A 110 21.690 -20.660 11.412 1.00 33.03 C ATOM 1545 C ARG A 110 23.151 -20.571 11.842 1.00 21.52 C ATOM 1546 O ARG A 110 23.572 -21.239 12.788 1.00 54.04 O ATOM 1547 CB ARG A 110 21.523 -21.756 10.358 1.00 54.31 C ATOM 1548 CG ARG A 110 22.137 -23.086 10.760 1.00 62.52 C ATOM 1549 CD ARG A 110 21.588 -23.574 12.091 1.00 24.15 C ATOM 1550 NE ARG A 110 21.299 -25.005 12.073 1.00 32.41 N ATOM 1551 CZ ARG A 110 20.533 -25.612 12.974 1.00 44.05 C ATOM 1552 NH1 ARG A 110 19.983 -24.915 13.958 1.00 24.13 N ATOM 1553 NH2 ARG A 110 20.317 -26.918 12.890 1.00 75.33 N ATOM 0 H ARG A 110 21.093 -19.359 9.880 1.00 1.24 H new ATOM 0 HA ARG A 110 21.087 -20.910 12.285 1.00 33.03 H new ATOM 0 HB2 ARG A 110 20.461 -21.901 10.162 1.00 54.31 H new ATOM 0 HB3 ARG A 110 21.977 -21.423 9.425 1.00 54.31 H new ATOM 0 HG2 ARG A 110 21.936 -23.829 9.988 1.00 62.52 H new ATOM 0 HG3 ARG A 110 23.220 -22.982 10.828 1.00 62.52 H new ATOM 0 HD2 ARG A 110 22.308 -23.360 12.881 1.00 24.15 H new ATOM 0 HD3 ARG A 110 20.678 -23.024 12.331 1.00 24.15 H new ATOM 0 HE ARG A 110 21.707 -25.570 11.328 1.00 32.41 H new ATOM 0 HH11 ARG A 110 20.147 -23.911 14.025 1.00 24.13 H new ATOM 0 HH12 ARG A 110 19.396 -25.383 14.648 1.00 24.13 H new ATOM 0 HH21 ARG A 110 20.739 -27.457 12.134 1.00 75.33 H new ATOM 0 HH22 ARG A 110 19.729 -27.383 13.582 1.00 75.33 H new ATOM 1567 N ILE A 111 23.919 -19.744 11.141 1.00 24.35 N ATOM 1568 CA ILE A 111 25.333 -19.569 11.451 1.00 11.42 C ATOM 1569 C ILE A 111 25.538 -19.272 12.933 1.00 63.12 C ATOM 1570 O ILE A 111 26.556 -19.644 13.517 1.00 24.52 O ATOM 1571 CB ILE A 111 25.954 -18.430 10.620 1.00 31.14 C ATOM 1572 CG1 ILE A 111 25.625 -18.614 9.137 1.00 2.34 C ATOM 1573 CG2 ILE A 111 27.460 -18.380 10.833 1.00 74.25 C ATOM 1574 CD1 ILE A 111 25.919 -20.005 8.621 1.00 13.21 C ATOM 0 H ILE A 111 23.587 -19.185 10.355 1.00 24.35 H new ATOM 0 HA ILE A 111 25.830 -20.505 11.198 1.00 11.42 H new ATOM 0 HB ILE A 111 25.528 -17.483 10.952 1.00 31.14 H new ATOM 0 HG12 ILE A 111 24.570 -18.391 8.977 1.00 2.34 H new ATOM 0 HG13 ILE A 111 26.196 -17.891 8.554 1.00 2.34 H new ATOM 0 HG21 ILE A 111 27.885 -17.570 10.239 1.00 74.25 H new ATOM 0 HG22 ILE A 111 27.673 -18.207 11.888 1.00 74.25 H new ATOM 0 HG23 ILE A 111 27.903 -19.327 10.524 1.00 74.25 H new ATOM 0 HD11 ILE A 111 25.662 -20.063 7.563 1.00 13.21 H new ATOM 0 HD12 ILE A 111 26.979 -20.224 8.749 1.00 13.21 H new ATOM 0 HD13 ILE A 111 25.328 -20.732 9.178 1.00 13.21 H new ATOM 1586 N THR A 112 24.563 -18.600 13.537 1.00 21.21 N ATOM 1587 CA THR A 112 24.636 -18.254 14.951 1.00 51.11 C ATOM 1588 C THR A 112 23.983 -19.327 15.814 1.00 32.32 C ATOM 1589 O THR A 112 24.293 -19.458 16.998 1.00 74.21 O ATOM 1590 CB THR A 112 23.957 -16.901 15.233 1.00 12.55 C ATOM 1591 OG1 THR A 112 22.538 -17.024 15.087 1.00 72.31 O ATOM 1592 CG2 THR A 112 24.477 -15.827 14.290 1.00 3.52 C ATOM 0 H THR A 112 23.713 -18.285 13.069 1.00 21.21 H new ATOM 0 HA THR A 112 25.694 -18.182 15.205 1.00 51.11 H new ATOM 0 HB THR A 112 24.192 -16.609 16.256 1.00 12.55 H new ATOM 0 HG1 THR A 112 22.336 -17.554 14.288 1.00 72.31 H new ATOM 0 HG21 THR A 112 23.983 -14.880 14.509 1.00 3.52 H new ATOM 0 HG22 THR A 112 25.553 -15.714 14.425 1.00 3.52 H new ATOM 0 HG23 THR A 112 24.269 -16.116 13.260 1.00 3.52 H new ATOM 1600 N MET A 113 23.078 -20.094 15.214 1.00 41.43 N ATOM 1601 CA MET A 113 22.383 -21.158 15.929 1.00 52.44 C ATOM 1602 C MET A 113 23.343 -22.286 16.293 1.00 40.53 C ATOM 1603 O MET A 113 23.200 -22.921 17.337 1.00 41.22 O ATOM 1604 CB MET A 113 21.233 -21.705 15.080 1.00 2.42 C ATOM 1605 CG MET A 113 19.944 -20.912 15.221 1.00 52.05 C ATOM 1606 SD MET A 113 18.535 -21.736 14.454 1.00 30.23 S ATOM 1607 CE MET A 113 18.567 -21.010 12.817 1.00 1.24 C ATOM 0 H MET A 113 22.809 -19.998 14.235 1.00 41.43 H new ATOM 0 HA MET A 113 21.978 -20.739 16.850 1.00 52.44 H new ATOM 0 HB2 MET A 113 21.535 -21.709 14.033 1.00 2.42 H new ATOM 0 HB3 MET A 113 21.045 -22.741 15.361 1.00 2.42 H new ATOM 0 HG2 MET A 113 19.735 -20.751 16.279 1.00 52.05 H new ATOM 0 HG3 MET A 113 20.075 -19.929 14.769 1.00 52.05 H new ATOM 0 HE1 MET A 113 17.547 -20.821 12.483 1.00 1.24 H new ATOM 0 HE2 MET A 113 19.119 -20.071 12.846 1.00 1.24 H new ATOM 0 HE3 MET A 113 19.055 -21.696 12.124 1.00 1.24 H new ATOM 1617 N GLU A 114 24.320 -22.528 15.425 1.00 62.33 N ATOM 1618 CA GLU A 114 25.302 -23.581 15.656 1.00 5.11 C ATOM 1619 C GLU A 114 25.932 -23.443 17.040 1.00 75.54 C ATOM 1620 O GLU A 114 25.802 -24.317 17.898 1.00 54.41 O ATOM 1621 CB GLU A 114 26.391 -23.538 14.582 1.00 5.11 C ATOM 1622 CG GLU A 114 26.272 -24.646 13.550 1.00 63.43 C ATOM 1623 CD GLU A 114 26.944 -25.932 13.993 1.00 13.55 C ATOM 1624 OE1 GLU A 114 26.979 -26.191 15.215 1.00 50.32 O ATOM 1625 OE2 GLU A 114 27.434 -26.678 13.120 1.00 11.45 O ATOM 0 H GLU A 114 24.453 -22.010 14.556 1.00 62.33 H new ATOM 0 HA GLU A 114 24.787 -24.540 15.603 1.00 5.11 H new ATOM 0 HB2 GLU A 114 26.351 -22.574 14.074 1.00 5.11 H new ATOM 0 HB3 GLU A 114 27.367 -23.604 15.063 1.00 5.11 H new ATOM 0 HG2 GLU A 114 25.218 -24.841 13.352 1.00 63.43 H new ATOM 0 HG3 GLU A 114 26.716 -24.313 12.612 1.00 63.43 H new ATOM 1632 N PRO A 115 26.631 -22.321 17.262 1.00 11.22 N ATOM 1633 CA PRO A 115 27.294 -22.042 18.539 1.00 4.42 C ATOM 1634 C PRO A 115 26.300 -21.761 19.660 1.00 14.22 C ATOM 1635 O PRO A 115 26.387 -22.343 20.742 1.00 53.22 O ATOM 1636 CB PRO A 115 28.129 -20.794 18.240 1.00 41.11 C ATOM 1637 CG PRO A 115 27.425 -20.130 17.108 1.00 52.43 C ATOM 1638 CD PRO A 115 26.827 -21.237 16.285 1.00 64.34 C ATOM 0 HA PRO A 115 27.881 -22.892 18.887 1.00 4.42 H new ATOM 0 HB2 PRO A 115 28.187 -20.139 19.109 1.00 41.11 H new ATOM 0 HB3 PRO A 115 29.152 -21.057 17.970 1.00 41.11 H new ATOM 0 HG2 PRO A 115 26.652 -19.453 17.472 1.00 52.43 H new ATOM 0 HG3 PRO A 115 28.117 -19.533 16.514 1.00 52.43 H new ATOM 0 HD2 PRO A 115 25.885 -20.934 15.827 1.00 64.34 H new ATOM 0 HD3 PRO A 115 27.492 -21.540 15.476 1.00 64.34 H new ATOM 1646 N CYS A 116 25.354 -20.866 19.395 1.00 11.32 N ATOM 1647 CA CYS A 116 24.342 -20.507 20.381 1.00 32.23 C ATOM 1648 C CYS A 116 22.982 -21.084 19.999 1.00 33.12 C ATOM 1649 O CYS A 116 22.089 -20.358 19.562 1.00 35.13 O ATOM 1650 CB CYS A 116 24.244 -18.986 20.513 1.00 40.03 C ATOM 1651 SG CYS A 116 25.808 -18.178 20.983 1.00 72.34 S ATOM 0 H CYS A 116 25.267 -20.376 18.505 1.00 11.32 H new ATOM 0 HA CYS A 116 24.640 -20.929 21.341 1.00 32.23 H new ATOM 0 HB2 CYS A 116 23.904 -18.571 19.564 1.00 40.03 H new ATOM 0 HB3 CYS A 116 23.485 -18.745 21.257 1.00 40.03 H new ATOM 1656 N ARG A 117 22.832 -22.394 20.167 1.00 4.15 N ATOM 1657 CA ARG A 117 21.582 -23.069 19.840 1.00 43.23 C ATOM 1658 C ARG A 117 20.472 -22.654 20.801 1.00 23.11 C ATOM 1659 O ARG A 117 19.288 -22.786 20.491 1.00 30.01 O ATOM 1660 CB ARG A 117 21.770 -24.586 19.885 1.00 62.32 C ATOM 1661 CG ARG A 117 20.463 -25.362 19.897 1.00 50.34 C ATOM 1662 CD ARG A 117 20.013 -25.674 21.315 1.00 25.23 C ATOM 1663 NE ARG A 117 19.542 -27.050 21.450 1.00 65.02 N ATOM 1664 CZ ARG A 117 18.770 -27.468 22.446 1.00 22.43 C ATOM 1665 NH1 ARG A 117 18.384 -26.621 23.390 1.00 34.53 N ATOM 1666 NH2 ARG A 117 18.383 -28.736 22.500 1.00 74.34 N ATOM 0 H ARG A 117 23.561 -23.009 20.528 1.00 4.15 H new ATOM 0 HA ARG A 117 21.293 -22.776 18.831 1.00 43.23 H new ATOM 0 HB2 ARG A 117 22.359 -24.896 19.022 1.00 62.32 H new ATOM 0 HB3 ARG A 117 22.345 -24.846 20.774 1.00 62.32 H new ATOM 0 HG2 ARG A 117 19.691 -24.785 19.388 1.00 50.34 H new ATOM 0 HG3 ARG A 117 20.585 -26.291 19.340 1.00 50.34 H new ATOM 0 HD2 ARG A 117 20.841 -25.505 22.003 1.00 25.23 H new ATOM 0 HD3 ARG A 117 19.216 -24.988 21.601 1.00 25.23 H new ATOM 0 HE ARG A 117 19.822 -27.727 20.740 1.00 65.02 H new ATOM 0 HH11 ARG A 117 18.680 -25.646 23.352 1.00 34.53 H new ATOM 0 HH12 ARG A 117 17.791 -26.945 24.154 1.00 34.53 H new ATOM 0 HH21 ARG A 117 18.679 -29.391 21.776 1.00 74.34 H new ATOM 0 HH22 ARG A 117 17.790 -29.056 23.266 1.00 74.34 H new ATOM 1680 N ILE A 118 20.864 -22.154 21.968 1.00 51.50 N ATOM 1681 CA ILE A 118 19.902 -21.719 22.974 1.00 62.43 C ATOM 1682 C ILE A 118 19.160 -20.467 22.520 1.00 5.45 C ATOM 1683 O ILE A 118 18.181 -20.053 23.142 1.00 54.13 O ATOM 1684 CB ILE A 118 20.588 -21.436 24.323 1.00 22.33 C ATOM 1685 CG1 ILE A 118 21.495 -22.605 24.714 1.00 11.04 C ATOM 1686 CG2 ILE A 118 19.547 -21.182 25.403 1.00 3.23 C ATOM 1687 CD1 ILE A 118 20.786 -23.941 24.728 1.00 63.31 C ATOM 0 H ILE A 118 21.840 -22.040 22.240 1.00 51.50 H new ATOM 0 HA ILE A 118 19.189 -22.534 23.102 1.00 62.43 H new ATOM 0 HB ILE A 118 21.203 -20.542 24.221 1.00 22.33 H new ATOM 0 HG12 ILE A 118 22.332 -22.654 24.017 1.00 11.04 H new ATOM 0 HG13 ILE A 118 21.914 -22.415 25.702 1.00 11.04 H new ATOM 0 HG21 ILE A 118 20.047 -20.983 26.351 1.00 3.23 H new ATOM 0 HG22 ILE A 118 18.938 -20.321 25.126 1.00 3.23 H new ATOM 0 HG23 ILE A 118 18.909 -22.059 25.506 1.00 3.23 H new ATOM 0 HD11 ILE A 118 21.489 -24.723 25.014 1.00 63.31 H new ATOM 0 HD12 ILE A 118 19.966 -23.910 25.446 1.00 63.31 H new ATOM 0 HD13 ILE A 118 20.391 -24.154 23.735 1.00 63.31 H new ATOM 1699 N LEU A 119 19.633 -19.867 21.433 1.00 34.20 N ATOM 1700 CA LEU A 119 19.013 -18.661 20.894 1.00 61.50 C ATOM 1701 C LEU A 119 17.994 -19.009 19.814 1.00 70.33 C ATOM 1702 O LEU A 119 17.784 -18.242 18.874 1.00 50.00 O ATOM 1703 CB LEU A 119 20.081 -17.728 20.322 1.00 41.31 C ATOM 1704 CG LEU A 119 20.046 -16.283 20.820 1.00 12.53 C ATOM 1705 CD1 LEU A 119 21.352 -15.574 20.497 1.00 63.40 C ATOM 1706 CD2 LEU A 119 18.868 -15.537 20.211 1.00 52.24 C ATOM 0 H LEU A 119 20.443 -20.196 20.908 1.00 34.20 H new ATOM 0 HA LEU A 119 18.494 -18.154 21.707 1.00 61.50 H new ATOM 0 HB2 LEU A 119 21.061 -18.147 20.551 1.00 41.31 H new ATOM 0 HB3 LEU A 119 19.984 -17.720 19.236 1.00 41.31 H new ATOM 0 HG LEU A 119 19.922 -16.296 21.903 1.00 12.53 H new ATOM 0 HD11 LEU A 119 21.308 -14.547 20.859 1.00 63.40 H new ATOM 0 HD12 LEU A 119 22.178 -16.094 20.982 1.00 63.40 H new ATOM 0 HD13 LEU A 119 21.508 -15.572 19.418 1.00 63.40 H new ATOM 0 HD21 LEU A 119 18.859 -14.510 20.577 1.00 52.24 H new ATOM 0 HD22 LEU A 119 18.961 -15.534 19.125 1.00 52.24 H new ATOM 0 HD23 LEU A 119 17.939 -16.031 20.494 1.00 52.24 H new ATOM 1718 N TYR A 120 17.362 -20.169 19.955 1.00 23.22 N ATOM 1719 CA TYR A 120 16.365 -20.619 18.991 1.00 11.14 C ATOM 1720 C TYR A 120 15.386 -19.498 18.657 1.00 13.44 C ATOM 1721 O TYR A 120 15.198 -19.149 17.493 1.00 44.42 O ATOM 1722 CB TYR A 120 15.605 -21.828 19.539 1.00 61.31 C ATOM 1723 CG TYR A 120 16.240 -23.154 19.184 1.00 41.24 C ATOM 1724 CD1 TYR A 120 16.459 -23.508 17.858 1.00 72.31 C ATOM 1725 CD2 TYR A 120 16.620 -24.052 20.173 1.00 3.10 C ATOM 1726 CE1 TYR A 120 17.038 -24.718 17.528 1.00 31.44 C ATOM 1727 CE2 TYR A 120 17.201 -25.264 19.853 1.00 44.42 C ATOM 1728 CZ TYR A 120 17.408 -25.592 18.529 1.00 31.43 C ATOM 1729 OH TYR A 120 17.985 -26.799 18.206 1.00 2.02 O ATOM 0 H TYR A 120 17.523 -20.815 20.728 1.00 23.22 H new ATOM 0 HA TYR A 120 16.884 -20.908 18.077 1.00 11.14 H new ATOM 0 HB2 TYR A 120 15.540 -21.745 20.624 1.00 61.31 H new ATOM 0 HB3 TYR A 120 14.585 -21.809 19.156 1.00 61.31 H new ATOM 0 HD1 TYR A 120 16.172 -22.825 17.072 1.00 72.31 H new ATOM 0 HD2 TYR A 120 16.459 -23.798 21.210 1.00 3.10 H new ATOM 0 HE1 TYR A 120 17.200 -24.978 16.492 1.00 31.44 H new ATOM 0 HE2 TYR A 120 17.491 -25.950 20.635 1.00 44.42 H new ATOM 0 HH TYR A 120 18.187 -27.295 19.027 1.00 2.02 H new ATOM 1739 N ASN A 121 14.764 -18.937 19.690 1.00 40.23 N ATOM 1740 CA ASN A 121 13.804 -17.855 19.507 1.00 14.54 C ATOM 1741 C ASN A 121 13.525 -17.146 20.830 1.00 73.43 C ATOM 1742 O ASN A 121 13.400 -15.922 20.878 1.00 71.15 O ATOM 1743 CB ASN A 121 12.498 -18.396 18.921 1.00 64.30 C ATOM 1744 CG ASN A 121 12.089 -19.717 19.544 1.00 61.13 C ATOM 1745 OD1 ASN A 121 12.361 -20.785 18.996 1.00 65.33 O ATOM 1746 ND2 ASN A 121 11.431 -19.649 20.695 1.00 31.40 N ATOM 0 H ASN A 121 14.908 -19.214 20.661 1.00 40.23 H new ATOM 0 HA ASN A 121 14.235 -17.135 18.812 1.00 14.54 H new ATOM 0 HB2 ASN A 121 11.704 -17.665 19.073 1.00 64.30 H new ATOM 0 HB3 ASN A 121 12.612 -18.525 17.845 1.00 64.30 H new ATOM 0 HD21 ASN A 121 11.129 -20.505 21.161 1.00 31.40 H new ATOM 0 HD22 ASN A 121 11.227 -18.741 21.113 1.00 31.40 H new ATOM 1753 N THR A 122 13.428 -17.925 21.903 1.00 4.11 N ATOM 1754 CA THR A 122 13.164 -17.374 23.226 1.00 51.51 C ATOM 1755 C THR A 122 14.123 -16.234 23.548 1.00 4.24 C ATOM 1756 O THR A 122 15.191 -16.117 22.946 1.00 51.14 O ATOM 1757 CB THR A 122 13.282 -18.453 24.318 1.00 34.13 C ATOM 1758 OG1 THR A 122 12.944 -17.898 25.594 1.00 0.23 O ATOM 1759 CG2 THR A 122 14.691 -19.024 24.365 1.00 73.40 C ATOM 0 H THR A 122 13.528 -18.940 21.881 1.00 4.11 H new ATOM 0 HA THR A 122 12.143 -16.993 23.211 1.00 51.51 H new ATOM 0 HB THR A 122 12.588 -19.259 24.078 1.00 34.13 H new ATOM 0 HG1 THR A 122 13.020 -18.591 26.283 1.00 0.23 H new ATOM 0 HG21 THR A 122 14.750 -19.784 25.144 1.00 73.40 H new ATOM 0 HG22 THR A 122 14.934 -19.472 23.402 1.00 73.40 H new ATOM 0 HG23 THR A 122 15.400 -18.225 24.583 1.00 73.40 H new ATOM 1767 N THR A 123 13.738 -15.394 24.504 1.00 15.11 N ATOM 1768 CA THR A 123 14.563 -14.263 24.907 1.00 45.44 C ATOM 1769 C THR A 123 15.820 -14.730 25.632 1.00 1.20 C ATOM 1770 O THR A 123 15.854 -14.787 26.861 1.00 23.24 O ATOM 1771 CB THR A 123 13.786 -13.296 25.820 1.00 22.54 C ATOM 1772 OG1 THR A 123 13.124 -14.029 26.858 1.00 61.05 O ATOM 1773 CG2 THR A 123 12.764 -12.501 25.022 1.00 31.34 C ATOM 0 H THR A 123 12.858 -15.477 25.014 1.00 15.11 H new ATOM 0 HA THR A 123 14.847 -13.739 23.994 1.00 45.44 H new ATOM 0 HB THR A 123 14.497 -12.599 26.264 1.00 22.54 H new ATOM 0 HG1 THR A 123 13.776 -14.586 27.332 1.00 61.05 H new ATOM 0 HG21 THR A 123 12.228 -11.825 25.688 1.00 31.34 H new ATOM 0 HG22 THR A 123 13.274 -11.922 24.252 1.00 31.34 H new ATOM 0 HG23 THR A 123 12.057 -13.185 24.553 1.00 31.34 H new ATOM 1781 N PHE A 124 16.852 -15.062 24.864 1.00 61.43 N ATOM 1782 CA PHE A 124 18.112 -15.525 25.434 1.00 70.21 C ATOM 1783 C PHE A 124 19.199 -14.465 25.282 1.00 23.54 C ATOM 1784 O PHE A 124 20.066 -14.321 26.145 1.00 71.30 O ATOM 1785 CB PHE A 124 18.554 -16.826 24.760 1.00 41.31 C ATOM 1786 CG PHE A 124 19.530 -17.623 25.577 1.00 11.13 C ATOM 1787 CD1 PHE A 124 19.167 -18.128 26.815 1.00 35.33 C ATOM 1788 CD2 PHE A 124 20.810 -17.867 25.108 1.00 62.43 C ATOM 1789 CE1 PHE A 124 20.063 -18.861 27.570 1.00 71.43 C ATOM 1790 CE2 PHE A 124 21.711 -18.600 25.858 1.00 71.35 C ATOM 1791 CZ PHE A 124 21.336 -19.099 27.090 1.00 41.22 C ATOM 0 H PHE A 124 16.841 -15.019 23.845 1.00 61.43 H new ATOM 0 HA PHE A 124 17.955 -15.710 26.497 1.00 70.21 H new ATOM 0 HB2 PHE A 124 17.675 -17.439 24.559 1.00 41.31 H new ATOM 0 HB3 PHE A 124 19.006 -16.591 23.796 1.00 41.31 H new ATOM 0 HD1 PHE A 124 18.172 -17.947 27.195 1.00 35.33 H new ATOM 0 HD2 PHE A 124 21.108 -17.480 24.145 1.00 62.43 H new ATOM 0 HE1 PHE A 124 19.768 -19.247 28.534 1.00 71.43 H new ATOM 0 HE2 PHE A 124 22.707 -18.782 25.481 1.00 71.35 H new ATOM 0 HZ PHE A 124 22.037 -19.674 27.677 1.00 41.22 H new ATOM 1801 N PHE A 125 19.147 -13.726 24.179 1.00 22.42 N ATOM 1802 CA PHE A 125 20.128 -12.681 23.913 1.00 51.45 C ATOM 1803 C PHE A 125 19.439 -11.355 23.602 1.00 73.24 C ATOM 1804 O PHE A 125 18.264 -11.308 23.237 1.00 13.00 O ATOM 1805 CB PHE A 125 21.031 -13.085 22.746 1.00 43.34 C ATOM 1806 CG PHE A 125 22.247 -13.859 23.169 1.00 51.22 C ATOM 1807 CD1 PHE A 125 22.118 -15.074 23.822 1.00 1.45 C ATOM 1808 CD2 PHE A 125 23.519 -13.371 22.913 1.00 35.32 C ATOM 1809 CE1 PHE A 125 23.235 -15.789 24.213 1.00 54.21 C ATOM 1810 CE2 PHE A 125 24.639 -14.082 23.301 1.00 74.11 C ATOM 1811 CZ PHE A 125 24.497 -15.292 23.953 1.00 54.34 C ATOM 0 H PHE A 125 18.436 -13.831 23.455 1.00 22.42 H new ATOM 0 HA PHE A 125 20.737 -12.553 24.808 1.00 51.45 H new ATOM 0 HB2 PHE A 125 20.455 -13.685 22.042 1.00 43.34 H new ATOM 0 HB3 PHE A 125 21.348 -12.188 22.215 1.00 43.34 H new ATOM 0 HD1 PHE A 125 21.133 -15.467 24.028 1.00 1.45 H new ATOM 0 HD2 PHE A 125 23.636 -12.425 22.405 1.00 35.32 H new ATOM 0 HE1 PHE A 125 23.121 -16.735 24.721 1.00 54.21 H new ATOM 0 HE2 PHE A 125 25.625 -13.692 23.095 1.00 74.11 H new ATOM 0 HZ PHE A 125 25.371 -15.848 24.259 1.00 54.34 H new ATOM 1821 N PRO A 126 20.186 -10.251 23.749 1.00 22.33 N ATOM 1822 CA PRO A 126 19.669 -8.905 23.490 1.00 50.53 C ATOM 1823 C PRO A 126 19.419 -8.655 22.006 1.00 21.42 C ATOM 1824 O PRO A 126 19.359 -9.593 21.210 1.00 43.50 O ATOM 1825 CB PRO A 126 20.784 -7.991 24.005 1.00 51.00 C ATOM 1826 CG PRO A 126 22.021 -8.816 23.916 1.00 42.14 C ATOM 1827 CD PRO A 126 21.594 -10.233 24.181 1.00 61.15 C ATOM 0 HA PRO A 126 18.706 -8.739 23.973 1.00 50.53 H new ATOM 0 HB2 PRO A 126 20.866 -7.088 23.401 1.00 51.00 H new ATOM 0 HB3 PRO A 126 20.593 -7.673 25.030 1.00 51.00 H new ATOM 0 HG2 PRO A 126 22.481 -8.725 22.932 1.00 42.14 H new ATOM 0 HG3 PRO A 126 22.762 -8.489 24.646 1.00 42.14 H new ATOM 0 HD2 PRO A 126 22.196 -10.946 23.618 1.00 61.15 H new ATOM 0 HD3 PRO A 126 21.694 -10.493 25.235 1.00 61.15 H new ATOM 1835 N LYS A 127 19.274 -7.386 21.640 1.00 22.34 N ATOM 1836 CA LYS A 127 19.032 -7.013 20.252 1.00 45.31 C ATOM 1837 C LYS A 127 20.161 -7.506 19.351 1.00 12.55 C ATOM 1838 O LYS A 127 20.012 -7.570 18.131 1.00 15.50 O ATOM 1839 CB LYS A 127 18.893 -5.494 20.128 1.00 42.32 C ATOM 1840 CG LYS A 127 20.198 -4.788 19.803 1.00 3.33 C ATOM 1841 CD LYS A 127 21.178 -4.867 20.962 1.00 63.12 C ATOM 1842 CE LYS A 127 22.585 -5.190 20.481 1.00 53.20 C ATOM 1843 NZ LYS A 127 23.344 -5.988 21.483 1.00 72.31 N ATOM 0 H LYS A 127 19.320 -6.598 22.286 1.00 22.34 H new ATOM 0 HA LYS A 127 18.103 -7.485 19.932 1.00 45.31 H new ATOM 0 HB2 LYS A 127 18.163 -5.267 19.351 1.00 42.32 H new ATOM 0 HB3 LYS A 127 18.498 -5.096 21.063 1.00 42.32 H new ATOM 0 HG2 LYS A 127 20.645 -5.237 18.916 1.00 3.33 H new ATOM 0 HG3 LYS A 127 19.998 -3.743 19.565 1.00 3.33 H new ATOM 0 HD2 LYS A 127 21.185 -3.919 21.500 1.00 63.12 H new ATOM 0 HD3 LYS A 127 20.849 -5.631 21.667 1.00 63.12 H new ATOM 0 HE2 LYS A 127 22.530 -5.742 19.543 1.00 53.20 H new ATOM 0 HE3 LYS A 127 23.120 -4.263 20.274 1.00 53.20 H new ATOM 0 HZ1 LYS A 127 24.265 -6.260 21.085 1.00 72.31 H new ATOM 0 HZ2 LYS A 127 23.492 -5.418 22.341 1.00 72.31 H new ATOM 0 HZ3 LYS A 127 22.806 -6.844 21.725 1.00 72.31 H new ATOM 1857 N PHE A 128 21.289 -7.854 19.961 1.00 31.13 N ATOM 1858 CA PHE A 128 22.442 -8.342 19.214 1.00 24.04 C ATOM 1859 C PHE A 128 22.020 -9.380 18.179 1.00 43.04 C ATOM 1860 O PHE A 128 22.591 -9.455 17.090 1.00 51.15 O ATOM 1861 CB PHE A 128 23.475 -8.947 20.168 1.00 42.14 C ATOM 1862 CG PHE A 128 24.095 -10.215 19.653 1.00 4.43 C ATOM 1863 CD1 PHE A 128 23.517 -11.444 19.925 1.00 24.14 C ATOM 1864 CD2 PHE A 128 25.256 -10.177 18.898 1.00 50.35 C ATOM 1865 CE1 PHE A 128 24.087 -12.612 19.454 1.00 34.00 C ATOM 1866 CE2 PHE A 128 25.830 -11.341 18.423 1.00 34.41 C ATOM 1867 CZ PHE A 128 25.243 -12.561 18.701 1.00 43.40 C ATOM 0 H PHE A 128 21.429 -7.807 20.970 1.00 31.13 H new ATOM 0 HA PHE A 128 22.890 -7.496 18.692 1.00 24.04 H new ATOM 0 HB2 PHE A 128 24.262 -8.215 20.351 1.00 42.14 H new ATOM 0 HB3 PHE A 128 22.998 -9.148 21.127 1.00 42.14 H new ATOM 0 HD1 PHE A 128 22.611 -11.490 20.511 1.00 24.14 H new ATOM 0 HD2 PHE A 128 25.718 -9.226 18.678 1.00 50.35 H new ATOM 0 HE1 PHE A 128 23.628 -13.564 19.675 1.00 34.00 H new ATOM 0 HE2 PHE A 128 26.735 -11.297 17.836 1.00 34.41 H new ATOM 0 HZ PHE A 128 25.688 -13.473 18.330 1.00 43.40 H new ATOM 1877 N LEU A 129 21.018 -10.179 18.526 1.00 72.42 N ATOM 1878 CA LEU A 129 20.518 -11.214 17.627 1.00 21.43 C ATOM 1879 C LEU A 129 19.229 -10.768 16.946 1.00 52.23 C ATOM 1880 O LEU A 129 18.206 -11.449 17.023 1.00 10.32 O ATOM 1881 CB LEU A 129 20.277 -12.514 18.398 1.00 45.31 C ATOM 1882 CG LEU A 129 20.535 -13.809 17.627 1.00 54.11 C ATOM 1883 CD1 LEU A 129 19.579 -13.928 16.450 1.00 42.24 C ATOM 1884 CD2 LEU A 129 21.979 -13.869 17.152 1.00 21.21 C ATOM 0 H LEU A 129 20.535 -10.131 19.423 1.00 72.42 H new ATOM 0 HA LEU A 129 21.272 -11.388 16.859 1.00 21.43 H new ATOM 0 HB2 LEU A 129 20.911 -12.510 19.285 1.00 45.31 H new ATOM 0 HB3 LEU A 129 19.244 -12.521 18.745 1.00 45.31 H new ATOM 0 HG LEU A 129 20.360 -14.650 18.298 1.00 54.11 H new ATOM 0 HD11 LEU A 129 19.777 -14.855 15.913 1.00 42.24 H new ATOM 0 HD12 LEU A 129 18.552 -13.932 16.815 1.00 42.24 H new ATOM 0 HD13 LEU A 129 19.722 -13.082 15.778 1.00 42.24 H new ATOM 0 HD21 LEU A 129 22.144 -14.797 16.605 1.00 21.21 H new ATOM 0 HD22 LEU A 129 22.182 -13.022 16.497 1.00 21.21 H new ATOM 0 HD23 LEU A 129 22.647 -13.831 18.013 1.00 21.21 H new ATOM 1896 N ARG A 130 19.286 -9.621 16.277 1.00 52.05 N ATOM 1897 CA ARG A 130 18.123 -9.084 15.580 1.00 31.11 C ATOM 1898 C ARG A 130 17.877 -9.835 14.275 1.00 54.43 C ATOM 1899 O ARG A 130 17.988 -9.266 13.188 1.00 13.43 O ATOM 1900 CB ARG A 130 18.316 -7.593 15.295 1.00 32.43 C ATOM 1901 CG ARG A 130 17.844 -6.692 16.424 1.00 3.43 C ATOM 1902 CD ARG A 130 16.421 -6.209 16.194 1.00 12.31 C ATOM 1903 NE ARG A 130 16.286 -4.773 16.423 1.00 3.41 N ATOM 1904 CZ ARG A 130 15.128 -4.175 16.680 1.00 42.30 C ATOM 1905 NH1 ARG A 130 14.011 -4.885 16.741 1.00 74.42 N ATOM 1906 NH2 ARG A 130 15.087 -2.863 16.877 1.00 33.22 N ATOM 0 H ARG A 130 20.125 -9.046 16.203 1.00 52.05 H new ATOM 0 HA ARG A 130 17.253 -9.214 16.223 1.00 31.11 H new ATOM 0 HB2 ARG A 130 19.372 -7.401 15.106 1.00 32.43 H new ATOM 0 HB3 ARG A 130 17.777 -7.333 14.384 1.00 32.43 H new ATOM 0 HG2 ARG A 130 17.897 -7.233 17.369 1.00 3.43 H new ATOM 0 HG3 ARG A 130 18.511 -5.834 16.509 1.00 3.43 H new ATOM 0 HD2 ARG A 130 16.119 -6.443 15.173 1.00 12.31 H new ATOM 0 HD3 ARG A 130 15.744 -6.747 16.858 1.00 12.31 H new ATOM 0 HE ARG A 130 17.127 -4.198 16.383 1.00 3.41 H new ATOM 0 HH11 ARG A 130 14.039 -5.893 16.590 1.00 74.42 H new ATOM 0 HH12 ARG A 130 13.123 -4.423 16.939 1.00 74.42 H new ATOM 0 HH21 ARG A 130 15.945 -2.313 16.831 1.00 33.22 H new ATOM 0 HH22 ARG A 130 14.197 -2.404 17.074 1.00 33.22 H new ATOM 1920 N CYS A 131 17.542 -11.116 14.389 1.00 41.43 N ATOM 1921 CA CYS A 131 17.281 -11.945 13.219 1.00 72.31 C ATOM 1922 C CYS A 131 15.969 -12.710 13.376 1.00 43.51 C ATOM 1923 O CYS A 131 15.681 -13.255 14.440 1.00 32.20 O ATOM 1924 CB CYS A 131 18.433 -12.927 12.997 1.00 73.53 C ATOM 1925 SG CYS A 131 18.137 -14.130 11.661 1.00 62.13 S ATOM 0 H CYS A 131 17.445 -11.602 15.280 1.00 41.43 H new ATOM 0 HA CYS A 131 17.198 -11.290 12.352 1.00 72.31 H new ATOM 0 HB2 CYS A 131 19.338 -12.364 12.770 1.00 73.53 H new ATOM 0 HB3 CYS A 131 18.619 -13.469 13.925 1.00 73.53 H new ATOM 1930 N ASN A 132 15.179 -12.744 12.308 1.00 43.23 N ATOM 1931 CA ASN A 132 13.898 -13.441 12.327 1.00 42.45 C ATOM 1932 C ASN A 132 14.094 -14.943 12.149 1.00 33.34 C ATOM 1933 O ASN A 132 14.543 -15.401 11.099 1.00 3.42 O ATOM 1934 CB ASN A 132 12.984 -12.900 11.225 1.00 60.51 C ATOM 1935 CG ASN A 132 13.268 -11.447 10.899 1.00 63.04 C ATOM 1936 OD1 ASN A 132 12.757 -10.540 11.556 1.00 73.34 O ATOM 1937 ND2 ASN A 132 14.088 -11.219 9.879 1.00 72.11 N ATOM 0 H ASN A 132 15.403 -12.297 11.419 1.00 43.23 H new ATOM 0 HA ASN A 132 13.431 -13.266 13.296 1.00 42.45 H new ATOM 0 HB2 ASN A 132 13.109 -13.502 10.325 1.00 60.51 H new ATOM 0 HB3 ASN A 132 11.944 -13.003 11.536 1.00 60.51 H new ATOM 0 HD21 ASN A 132 14.317 -10.261 9.613 1.00 72.11 H new ATOM 0 HD22 ASN A 132 14.489 -12.002 9.362 1.00 72.11 H new ATOM 1944 N GLU A 133 13.752 -15.705 13.184 1.00 71.12 N ATOM 1945 CA GLU A 133 13.890 -17.156 13.142 1.00 63.12 C ATOM 1946 C GLU A 133 12.524 -17.835 13.192 1.00 44.43 C ATOM 1947 O GLU A 133 12.269 -18.797 12.468 1.00 61.55 O ATOM 1948 CB GLU A 133 14.756 -17.642 14.306 1.00 22.00 C ATOM 1949 CG GLU A 133 15.470 -18.954 14.027 1.00 21.04 C ATOM 1950 CD GLU A 133 14.525 -20.045 13.562 1.00 2.02 C ATOM 1951 OE1 GLU A 133 13.631 -20.428 14.345 1.00 13.22 O ATOM 1952 OE2 GLU A 133 14.680 -20.516 12.416 1.00 1.12 O ATOM 0 H GLU A 133 13.378 -15.342 14.061 1.00 71.12 H new ATOM 0 HA GLU A 133 14.374 -17.422 12.202 1.00 63.12 H new ATOM 0 HB2 GLU A 133 15.497 -16.878 14.541 1.00 22.00 H new ATOM 0 HB3 GLU A 133 14.129 -17.760 15.190 1.00 22.00 H new ATOM 0 HG2 GLU A 133 16.235 -18.793 13.267 1.00 21.04 H new ATOM 0 HG3 GLU A 133 15.983 -19.284 14.931 1.00 21.04 H new ATOM 1959 N THR A 134 11.648 -17.326 14.053 1.00 44.34 N ATOM 1960 CA THR A 134 10.309 -17.882 14.199 1.00 24.24 C ATOM 1961 C THR A 134 9.304 -17.130 13.335 1.00 33.23 C ATOM 1962 O THR A 134 8.093 -17.260 13.519 1.00 54.31 O ATOM 1963 CB THR A 134 9.841 -17.840 15.666 1.00 24.23 C ATOM 1964 OG1 THR A 134 10.190 -16.583 16.256 1.00 52.30 O ATOM 1965 CG2 THR A 134 10.467 -18.972 16.467 1.00 65.33 C ATOM 0 H THR A 134 11.842 -16.529 14.660 1.00 44.34 H new ATOM 0 HA THR A 134 10.360 -18.920 13.871 1.00 24.24 H new ATOM 0 HB THR A 134 8.758 -17.960 15.682 1.00 24.23 H new ATOM 0 HG1 THR A 134 9.887 -16.564 17.188 1.00 52.30 H new ATOM 0 HG21 THR A 134 10.122 -18.921 17.500 1.00 65.33 H new ATOM 0 HG22 THR A 134 10.176 -19.929 16.033 1.00 65.33 H new ATOM 0 HG23 THR A 134 11.553 -18.878 16.443 1.00 65.33 H new ATOM 1973 N LEU A 135 9.812 -16.345 12.392 1.00 12.43 N ATOM 1974 CA LEU A 135 8.957 -15.572 11.498 1.00 41.41 C ATOM 1975 C LEU A 135 8.871 -16.228 10.124 1.00 61.50 C ATOM 1976 O LEU A 135 7.867 -16.856 9.786 1.00 40.43 O ATOM 1977 CB LEU A 135 9.488 -14.144 11.361 1.00 41.43 C ATOM 1978 CG LEU A 135 9.507 -13.309 12.642 1.00 44.34 C ATOM 1979 CD1 LEU A 135 9.785 -11.848 12.323 1.00 41.05 C ATOM 1980 CD2 LEU A 135 8.191 -13.452 13.391 1.00 11.24 C ATOM 0 H LEU A 135 10.812 -16.227 12.226 1.00 12.43 H new ATOM 0 HA LEU A 135 7.956 -15.542 11.929 1.00 41.41 H new ATOM 0 HB2 LEU A 135 10.503 -14.192 10.967 1.00 41.43 H new ATOM 0 HB3 LEU A 135 8.883 -13.622 10.620 1.00 41.43 H new ATOM 0 HG LEU A 135 10.308 -13.679 13.282 1.00 44.34 H new ATOM 0 HD11 LEU A 135 9.795 -11.269 13.247 1.00 41.05 H new ATOM 0 HD12 LEU A 135 10.753 -11.761 11.830 1.00 41.05 H new ATOM 0 HD13 LEU A 135 9.006 -11.465 11.663 1.00 41.05 H new ATOM 0 HD21 LEU A 135 8.222 -12.851 14.300 1.00 11.24 H new ATOM 0 HD22 LEU A 135 7.373 -13.109 12.758 1.00 11.24 H new ATOM 0 HD23 LEU A 135 8.033 -14.498 13.653 1.00 11.24 H new ATOM 1992 N PHE A 136 9.932 -16.082 9.337 1.00 74.25 N ATOM 1993 CA PHE A 136 9.977 -16.662 7.999 1.00 32.44 C ATOM 1994 C PHE A 136 11.410 -16.720 7.480 1.00 63.03 C ATOM 1995 O PHE A 136 11.775 -16.049 6.514 1.00 0.54 O ATOM 1996 CB PHE A 136 9.106 -15.850 7.038 1.00 22.23 C ATOM 1997 CG PHE A 136 7.681 -16.320 6.978 1.00 60.44 C ATOM 1998 CD1 PHE A 136 7.382 -17.620 6.601 1.00 53.43 C ATOM 1999 CD2 PHE A 136 6.641 -15.463 7.297 1.00 54.21 C ATOM 2000 CE1 PHE A 136 6.071 -18.056 6.544 1.00 3.31 C ATOM 2001 CE2 PHE A 136 5.328 -15.893 7.243 1.00 64.44 C ATOM 2002 CZ PHE A 136 5.043 -17.191 6.865 1.00 43.14 C ATOM 0 H PHE A 136 10.772 -15.567 9.602 1.00 74.25 H new ATOM 0 HA PHE A 136 9.589 -17.679 8.058 1.00 32.44 H new ATOM 0 HB2 PHE A 136 9.122 -14.803 7.342 1.00 22.23 H new ATOM 0 HB3 PHE A 136 9.539 -15.899 6.039 1.00 22.23 H new ATOM 0 HD1 PHE A 136 8.182 -18.300 6.349 1.00 53.43 H new ATOM 0 HD2 PHE A 136 6.858 -14.447 7.591 1.00 54.21 H new ATOM 0 HE1 PHE A 136 5.851 -19.071 6.249 1.00 3.31 H new ATOM 0 HE2 PHE A 136 4.526 -15.215 7.496 1.00 64.44 H new ATOM 0 HZ PHE A 136 4.018 -17.529 6.821 1.00 43.14 H new ATOM 2012 N PRO A 137 12.244 -17.541 8.135 1.00 21.31 N ATOM 2013 CA PRO A 137 13.651 -17.707 7.758 1.00 51.12 C ATOM 2014 C PRO A 137 13.813 -18.442 6.431 1.00 13.45 C ATOM 2015 O PRO A 137 14.541 -17.993 5.545 1.00 10.25 O ATOM 2016 CB PRO A 137 14.230 -18.540 8.904 1.00 11.54 C ATOM 2017 CG PRO A 137 13.064 -19.281 9.461 1.00 54.13 C ATOM 2018 CD PRO A 137 11.877 -18.372 9.294 1.00 5.25 C ATOM 0 HA PRO A 137 14.150 -16.749 7.615 1.00 51.12 H new ATOM 0 HB2 PRO A 137 15.000 -19.224 8.546 1.00 11.54 H new ATOM 0 HB3 PRO A 137 14.693 -17.906 9.660 1.00 11.54 H new ATOM 0 HG2 PRO A 137 12.912 -20.222 8.933 1.00 54.13 H new ATOM 0 HG3 PRO A 137 13.223 -19.526 10.511 1.00 54.13 H new ATOM 0 HD2 PRO A 137 10.962 -18.935 9.111 1.00 5.25 H new ATOM 0 HD3 PRO A 137 11.706 -17.767 10.184 1.00 5.25 H new ATOM 2026 N THR A 138 13.129 -19.574 6.300 1.00 32.10 N ATOM 2027 CA THR A 138 13.197 -20.371 5.082 1.00 63.40 C ATOM 2028 C THR A 138 11.804 -20.742 4.588 1.00 35.35 C ATOM 2029 O THR A 138 11.508 -20.642 3.397 1.00 30.15 O ATOM 2030 CB THR A 138 14.012 -21.660 5.299 1.00 24.23 C ATOM 2031 OG1 THR A 138 13.786 -22.571 4.218 1.00 64.03 O ATOM 2032 CG2 THR A 138 13.635 -22.324 6.615 1.00 0.21 C ATOM 0 H THR A 138 12.521 -19.960 7.023 1.00 32.10 H new ATOM 0 HA THR A 138 13.694 -19.757 4.331 1.00 63.40 H new ATOM 0 HB THR A 138 15.068 -21.393 5.334 1.00 24.23 H new ATOM 0 HG1 THR A 138 14.309 -23.387 4.363 1.00 64.03 H new ATOM 0 HG21 THR A 138 14.224 -23.232 6.746 1.00 0.21 H new ATOM 0 HG22 THR A 138 13.836 -21.639 7.439 1.00 0.21 H new ATOM 0 HG23 THR A 138 12.575 -22.577 6.604 1.00 0.21 H new ATOM 2040 N LYS A 139 10.949 -21.171 5.511 1.00 11.32 N ATOM 2041 CA LYS A 139 9.584 -21.555 5.171 1.00 21.11 C ATOM 2042 C LYS A 139 9.570 -22.534 4.001 1.00 1.40 C ATOM 2043 O LYS A 139 9.236 -23.707 4.165 1.00 61.42 O ATOM 2044 CB LYS A 139 8.755 -20.317 4.824 1.00 50.41 C ATOM 2045 CG LYS A 139 8.451 -20.184 3.342 1.00 70.03 C ATOM 2046 CD LYS A 139 7.697 -18.900 3.040 1.00 50.23 C ATOM 2047 CE LYS A 139 6.247 -18.986 3.490 1.00 73.00 C ATOM 2048 NZ LYS A 139 5.357 -19.482 2.403 1.00 1.44 N ATOM 0 H LYS A 139 11.178 -21.261 6.501 1.00 11.32 H new ATOM 0 HA LYS A 139 9.145 -22.047 6.039 1.00 21.11 H new ATOM 0 HB2 LYS A 139 7.816 -20.352 5.377 1.00 50.41 H new ATOM 0 HB3 LYS A 139 9.289 -19.427 5.158 1.00 50.41 H new ATOM 0 HG2 LYS A 139 9.382 -20.202 2.776 1.00 70.03 H new ATOM 0 HG3 LYS A 139 7.861 -21.039 3.013 1.00 70.03 H new ATOM 0 HD2 LYS A 139 8.185 -18.064 3.540 1.00 50.23 H new ATOM 0 HD3 LYS A 139 7.735 -18.697 1.970 1.00 50.23 H new ATOM 0 HE2 LYS A 139 6.173 -19.650 4.351 1.00 73.00 H new ATOM 0 HE3 LYS A 139 5.909 -18.002 3.816 1.00 73.00 H new ATOM 0 HZ1 LYS A 139 4.377 -19.526 2.749 1.00 1.44 H new ATOM 0 HZ2 LYS A 139 5.408 -18.835 1.590 1.00 1.44 H new ATOM 0 HZ3 LYS A 139 5.664 -20.431 2.109 1.00 1.44 H new TER 2062 LYS A 139