USER MOD reduce.3.24.130724 H: found=0, std=0, add=1595, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1566 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: B1045 HIS : no HE2:sc= 0.396 K(o=1.7,f=-7.5!) USER MOD Set 1.2: B1075 CYS SG : rot 180:sc= 0 USER MOD Set 1.3: B1094 TYR OH : rot -30:sc= 1.33 USER MOD Set 2.1: B1085 LYS NZ :NH3+ 174:sc= -2.65! (180deg=-3.04!) USER MOD Set 2.2: B1088 THR OG1 : rot -12:sc= 0.333 USER MOD Set 3.1: B1048 MET CE :methyl -150:sc= -0.32 (180deg=-1.74!) USER MOD Set 3.2: B1061 ASN :FLIP amide:sc= 0 F(o=-2.8!,f=-0.32) USER MOD Set 4.1: B1018 HIS : no HD1:sc= -0.122 K(o=0.7,f=-0.31) USER MOD Set 4.2: B1102 SER OG : rot 76:sc= 0.823 USER MOD Set 5.1: A 928 THR OG1 : rot 180:sc= 0.322 USER MOD Set 5.2: A 939 SER OG : rot 92:sc= 0.311 USER MOD Set 6.1: A 926 HIS : no HD1:sc= 0.713 K(o=2.7,f=-7.9!) USER MOD Set 6.2: A 940 SER OG : rot 72:sc= 1.97 USER MOD Set 7.1: A 907 THR OG1 : rot 180:sc= 0 USER MOD Set 7.2: A 971 GLN : amide:sc= 0.124 K(o=0.12,f=-3.3!) USER MOD Single : A 904 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 909 SER OG : rot 180:sc= 0 USER MOD Single : A 915 THR OG1 : rot 102:sc= 1.08 USER MOD Single : A 918 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 921 GLN : amide:sc= 0.539 K(o=0.54,f=-6.6!) USER MOD Single : A 922 THR OG1 : rot 180:sc= 0 USER MOD Single : A 923 CYS SG : rot 180:sc= -0.0157 USER MOD Single : A 927 TYR OH : rot 178:sc= 1.24 USER MOD Single : A 930 MET CE :methyl 175:sc= 0 (180deg=-0.0279) USER MOD Single : A 935 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 936 LYS NZ :NH3+ -164:sc= 0.268 (180deg=0.186) USER MOD Single : A 944 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 945 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 948 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 950 MET CE :methyl -148:sc= -0.293 (180deg=-1.62!) USER MOD Single : A 953 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 954 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 966 GLN : amide:sc= 0.276 X(o=0.28,f=0) USER MOD Single : A 967 MET CE :methyl 136:sc= -0.0926 (180deg=-0.745) USER MOD Single : A 968 SER OG : rot -120:sc= 0.716 USER MOD Single : A 974 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 976 THR OG1 : rot 180:sc= 0 USER MOD Single : A 978 SER OG : rot -103:sc= 1.31 USER MOD Single : A 981 TYR OH : rot 180:sc= 0 USER MOD Single : A 983 TYR OH : rot 180:sc= 0 USER MOD Single : A 986 THR OG1 : rot 180:sc= 0 USER MOD Single : A 988 HIS :FLIP no HD1:sc= -1.35 F(o=-2.6!,f=-1.3) USER MOD Single : A 995 HIS : no HD1:sc= -0.339 X(o=-0.34,f=-0.53) USER MOD Single : A 997 THR OG1 : rot 180:sc= 0 USER MOD Single : A1006 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1014 HIS : no HD1:sc= -1.85! C(o=-1.9!,f=-4.7!) USER MOD Single : B1016 MET CE :methyl -151:sc= -2.14 (180deg=-4.44!) USER MOD Single : B1025 SER OG : rot -50:sc= 0.628 USER MOD Single : B1028 TYR OH : rot 180:sc= -0.799 USER MOD Single : B1033 ASN : amide:sc= 0.22 K(o=0.22,f=-3.8!) USER MOD Single : B1035 LYS NZ :NH3+ -148:sc= 0.756 (180deg=-1.11!) USER MOD Single : B1037 MET CE :methyl -154:sc= -2.29 (180deg=-3.71!) USER MOD Single : B1047 MET CE :methyl -114:sc= -2.63! (180deg=-4.96!) USER MOD Single : B1053 GLN : amide:sc= -0.299 X(o=-0.3,f=-0.073) USER MOD Single : B1054 THR OG1 : rot 180:sc= 0.479 USER MOD Single : B1056 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.151) USER MOD Single : B1058 THR OG1 : rot 76:sc= 0.722 USER MOD Single : B1059 SER OG : rot 180:sc= 0 USER MOD Single : B1062 GLN : amide:sc= -0.261 K(o=-0.26,f=-2.8!) USER MOD Single : B1064 TYR OH : rot 180:sc= 0 USER MOD Single : B1069 MET CE :methyl -178:sc= -1.43 (180deg=-1.52!) USER MOD Single : B1072 GLN : amide:sc= 0 X(o=0,f=-0.067) USER MOD Single : B1077 LYS NZ :NH3+ -115:sc= 0.342 (180deg=0) USER MOD Single : B1078 TYR OH : rot 180:sc= 0 USER MOD Single : B1079 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B1080 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1081 SER OG : rot -154:sc= 1.96 USER MOD Single : B1083 ASN :FLIP amide:sc= -1.24 F(o=-6.2!,f=-1.2) USER MOD Single : B1089 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.32) USER MOD Single : B1095 TYR OH : rot 167:sc= 0 USER MOD Single : B1096 HIS :FLIP no HD1:sc= -0.893 F(o=-3.3!,f=-0.89) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 902 -16.549 1.519 15.149 1.00 11.28 N ATOM 2 CA GLY A 902 -15.945 0.212 15.023 1.00 14.35 C ATOM 3 C GLY A 902 -15.986 -0.223 13.564 1.00 15.91 C ATOM 4 O GLY A 902 -15.886 0.637 12.668 1.00 16.11 O ATOM 0 HA2 GLY A 902 -14.915 0.239 15.377 1.00 14.35 H new ATOM 0 HA3 GLY A 902 -16.477 -0.509 15.644 1.00 14.35 H new ATOM 9 N VAL A 903 -16.134 -1.531 13.366 1.00 11.40 N ATOM 10 CA VAL A 903 -16.258 -2.149 12.059 1.00 7.65 C ATOM 11 C VAL A 903 -17.449 -3.106 12.146 1.00 18.43 C ATOM 12 O VAL A 903 -17.614 -3.882 13.095 1.00 15.55 O ATOM 13 CB VAL A 903 -14.922 -2.833 11.630 1.00 14.21 C ATOM 14 CG1 VAL A 903 -14.417 -3.886 12.613 1.00 16.55 C ATOM 15 CG2 VAL A 903 -15.023 -3.447 10.235 1.00 15.47 C ATOM 0 H VAL A 903 -16.171 -2.202 14.133 1.00 11.40 H new ATOM 0 HA VAL A 903 -16.445 -1.416 11.274 1.00 7.65 H new ATOM 0 HB VAL A 903 -14.191 -2.025 11.623 1.00 14.21 H new ATOM 0 HG11 VAL A 903 -13.485 -4.313 12.242 1.00 16.55 H new ATOM 0 HG12 VAL A 903 -14.242 -3.423 13.584 1.00 16.55 H new ATOM 0 HG13 VAL A 903 -15.162 -4.675 12.716 1.00 16.55 H new ATOM 0 HG21 VAL A 903 -14.073 -3.913 9.973 1.00 15.47 H new ATOM 0 HG22 VAL A 903 -15.812 -4.199 10.225 1.00 15.47 H new ATOM 0 HG23 VAL A 903 -15.256 -2.667 9.510 1.00 15.47 H new ATOM 25 N GLN A 904 -18.348 -2.974 11.193 1.00 9.33 N ATOM 26 CA GLN A 904 -19.493 -3.869 11.097 1.00 10.30 C ATOM 27 C GLN A 904 -19.185 -4.829 9.947 1.00 10.81 C ATOM 28 O GLN A 904 -18.748 -4.363 8.902 1.00 11.33 O ATOM 29 CB GLN A 904 -20.695 -3.014 10.796 1.00 13.36 C ATOM 30 CG GLN A 904 -21.981 -3.827 10.771 1.00 55.99 C ATOM 31 CD GLN A 904 -23.225 -3.033 10.394 1.00 68.84 C ATOM 32 OE1 GLN A 904 -23.254 -1.810 10.402 1.00 72.87 O ATOM 33 NE2 GLN A 904 -24.340 -3.658 10.051 1.00 57.49 N ATOM 0 H GLN A 904 -18.312 -2.255 10.470 1.00 9.33 H new ATOM 0 HA GLN A 904 -19.687 -4.438 12.006 1.00 10.30 H new ATOM 0 HB2 GLN A 904 -20.778 -2.228 11.546 1.00 13.36 H new ATOM 0 HB3 GLN A 904 -20.558 -2.522 9.833 1.00 13.36 H new ATOM 0 HG2 GLN A 904 -21.862 -4.649 10.065 1.00 55.99 H new ATOM 0 HG3 GLN A 904 -22.134 -4.272 11.754 1.00 55.99 H new ATOM 0 HE21 GLN A 904 -24.367 -4.677 10.029 1.00 57.49 H new ATOM 0 HE22 GLN A 904 -25.172 -3.120 9.809 1.00 57.49 H new ATOM 42 N VAL A 905 -19.354 -6.146 10.064 1.00 14.73 N ATOM 43 CA VAL A 905 -19.052 -7.096 8.998 1.00 15.13 C ATOM 44 C VAL A 905 -20.400 -7.686 8.591 1.00 14.25 C ATOM 45 O VAL A 905 -21.082 -8.304 9.408 1.00 16.89 O ATOM 46 CB VAL A 905 -18.075 -8.200 9.512 1.00 11.91 C ATOM 47 CG1 VAL A 905 -17.749 -9.222 8.443 1.00 13.25 C ATOM 48 CG2 VAL A 905 -16.783 -7.585 10.036 1.00 9.78 C ATOM 0 H VAL A 905 -19.709 -6.587 10.913 1.00 14.73 H new ATOM 0 HA VAL A 905 -18.556 -6.623 8.150 1.00 15.13 H new ATOM 0 HB VAL A 905 -18.589 -8.713 10.325 1.00 11.91 H new ATOM 0 HG11 VAL A 905 -17.066 -9.968 8.849 1.00 13.25 H new ATOM 0 HG12 VAL A 905 -18.667 -9.710 8.114 1.00 13.25 H new ATOM 0 HG13 VAL A 905 -17.279 -8.724 7.595 1.00 13.25 H new ATOM 0 HG21 VAL A 905 -16.120 -8.376 10.388 1.00 9.78 H new ATOM 0 HG22 VAL A 905 -16.293 -7.030 9.236 1.00 9.78 H new ATOM 0 HG23 VAL A 905 -17.010 -6.908 10.860 1.00 9.78 H new ATOM 58 N GLU A 906 -20.848 -7.473 7.370 1.00 8.60 N ATOM 59 CA GLU A 906 -22.091 -8.055 6.879 1.00 9.41 C ATOM 60 C GLU A 906 -21.765 -9.026 5.749 1.00 7.91 C ATOM 61 O GLU A 906 -21.075 -8.625 4.819 1.00 14.55 O ATOM 62 CB GLU A 906 -22.952 -6.954 6.339 1.00 9.26 C ATOM 63 CG GLU A 906 -23.452 -6.103 7.465 1.00 7.92 C ATOM 64 CD GLU A 906 -24.241 -4.923 6.941 1.00 28.31 C ATOM 65 OE1 GLU A 906 -23.638 -3.887 6.686 1.00 26.39 O ATOM 66 OE2 GLU A 906 -25.458 -5.041 6.795 1.00 39.66 O ATOM 0 H GLU A 906 -20.364 -6.892 6.686 1.00 8.60 H new ATOM 0 HA GLU A 906 -22.608 -8.578 7.683 1.00 9.41 H new ATOM 0 HB2 GLU A 906 -22.382 -6.346 5.636 1.00 9.26 H new ATOM 0 HB3 GLU A 906 -23.793 -7.375 5.788 1.00 9.26 H new ATOM 0 HG2 GLU A 906 -24.080 -6.700 8.127 1.00 7.92 H new ATOM 0 HG3 GLU A 906 -22.610 -5.748 8.059 1.00 7.92 H new ATOM 73 N THR A 907 -22.180 -10.291 5.769 1.00 11.40 N ATOM 74 CA THR A 907 -21.805 -11.282 4.764 1.00 9.56 C ATOM 75 C THR A 907 -22.422 -11.097 3.386 1.00 11.24 C ATOM 76 O THR A 907 -23.626 -10.893 3.287 1.00 13.61 O ATOM 77 CB THR A 907 -22.120 -12.642 5.334 1.00 14.22 C ATOM 78 OG1 THR A 907 -21.236 -12.762 6.431 1.00 18.55 O ATOM 79 CG2 THR A 907 -21.872 -13.800 4.389 1.00 18.19 C ATOM 0 H THR A 907 -22.795 -10.661 6.494 1.00 11.40 H new ATOM 0 HA THR A 907 -20.740 -11.158 4.568 1.00 9.56 H new ATOM 0 HB THR A 907 -23.182 -12.698 5.574 1.00 14.22 H new ATOM 0 HG1 THR A 907 -21.374 -13.628 6.869 1.00 18.55 H new ATOM 0 HG21 THR A 907 -22.127 -14.736 4.886 1.00 18.19 H new ATOM 0 HG22 THR A 907 -22.490 -13.682 3.499 1.00 18.19 H new ATOM 0 HG23 THR A 907 -20.821 -13.816 4.101 1.00 18.19 H new ATOM 87 N ILE A 908 -21.617 -11.098 2.321 1.00 10.07 N ATOM 88 CA ILE A 908 -22.148 -11.162 0.972 1.00 9.55 C ATOM 89 C ILE A 908 -22.235 -12.636 0.558 1.00 14.31 C ATOM 90 O ILE A 908 -23.239 -13.040 -0.023 1.00 15.11 O ATOM 91 CB ILE A 908 -21.289 -10.280 0.030 1.00 15.34 C ATOM 92 CG1 ILE A 908 -21.363 -8.820 0.473 1.00 8.63 C ATOM 93 CG2 ILE A 908 -21.694 -10.444 -1.441 1.00 4.62 C ATOM 94 CD1 ILE A 908 -20.272 -7.898 -0.120 1.00 11.85 C ATOM 0 H ILE A 908 -20.599 -11.055 2.374 1.00 10.07 H new ATOM 0 HA ILE A 908 -23.157 -10.755 0.911 1.00 9.55 H new ATOM 0 HB ILE A 908 -20.254 -10.614 0.103 1.00 15.34 H new ATOM 0 HG12 ILE A 908 -22.340 -8.423 0.199 1.00 8.63 H new ATOM 0 HG13 ILE A 908 -21.297 -8.783 1.560 1.00 8.63 H new ATOM 0 HG21 ILE A 908 -21.066 -9.808 -2.064 1.00 4.62 H new ATOM 0 HG22 ILE A 908 -21.566 -11.484 -1.740 1.00 4.62 H new ATOM 0 HG23 ILE A 908 -22.738 -10.157 -1.565 1.00 4.62 H new ATOM 0 HD11 ILE A 908 -20.410 -6.884 0.254 1.00 11.85 H new ATOM 0 HD12 ILE A 908 -19.288 -8.263 0.175 1.00 11.85 H new ATOM 0 HD13 ILE A 908 -20.348 -7.897 -1.207 1.00 11.85 H new ATOM 106 N SER A 909 -21.232 -13.474 0.829 1.00 16.77 N ATOM 107 CA SER A 909 -21.235 -14.906 0.529 1.00 22.81 C ATOM 108 C SER A 909 -20.465 -15.572 1.668 1.00 16.94 C ATOM 109 O SER A 909 -19.441 -15.044 2.124 1.00 11.53 O ATOM 110 CB SER A 909 -20.531 -15.226 -0.779 1.00 16.46 C ATOM 111 OG SER A 909 -20.785 -14.216 -1.741 1.00 42.67 O ATOM 0 H SER A 909 -20.369 -13.165 1.277 1.00 16.77 H new ATOM 0 HA SER A 909 -22.262 -15.258 0.434 1.00 22.81 H new ATOM 0 HB2 SER A 909 -19.458 -15.313 -0.609 1.00 16.46 H new ATOM 0 HB3 SER A 909 -20.873 -16.190 -1.156 1.00 16.46 H new ATOM 0 HG SER A 909 -20.323 -14.437 -2.577 1.00 42.67 H new ATOM 117 N PRO A 910 -20.942 -16.673 2.222 1.00 14.85 N ATOM 118 CA PRO A 910 -20.307 -17.333 3.335 1.00 16.28 C ATOM 119 C PRO A 910 -18.980 -18.004 3.004 1.00 15.80 C ATOM 120 O PRO A 910 -18.740 -18.479 1.903 1.00 16.79 O ATOM 121 CB PRO A 910 -21.383 -18.302 3.802 1.00 17.69 C ATOM 122 CG PRO A 910 -22.097 -18.669 2.531 1.00 20.98 C ATOM 123 CD PRO A 910 -22.210 -17.313 1.854 1.00 13.76 C ATOM 0 HA PRO A 910 -19.994 -16.631 4.108 1.00 16.28 H new ATOM 0 HB2 PRO A 910 -20.952 -19.177 4.288 1.00 17.69 H new ATOM 0 HB3 PRO A 910 -22.057 -17.838 4.522 1.00 17.69 H new ATOM 0 HG2 PRO A 910 -21.531 -19.382 1.932 1.00 20.98 H new ATOM 0 HG3 PRO A 910 -23.072 -19.116 2.721 1.00 20.98 H new ATOM 0 HD2 PRO A 910 -22.320 -17.406 0.774 1.00 13.76 H new ATOM 0 HD3 PRO A 910 -23.070 -16.749 2.215 1.00 13.76 H new ATOM 131 N GLY A 911 -18.070 -17.973 3.963 1.00 11.05 N ATOM 132 CA GLY A 911 -16.848 -18.728 3.861 1.00 12.34 C ATOM 133 C GLY A 911 -17.088 -20.124 4.393 1.00 16.73 C ATOM 134 O GLY A 911 -18.223 -20.563 4.582 1.00 24.91 O ATOM 0 H GLY A 911 -18.162 -17.429 4.821 1.00 11.05 H new ATOM 0 HA2 GLY A 911 -16.518 -18.772 2.823 1.00 12.34 H new ATOM 0 HA3 GLY A 911 -16.055 -18.240 4.428 1.00 12.34 H new ATOM 138 N ASP A 912 -16.017 -20.828 4.711 1.00 14.36 N ATOM 139 CA ASP A 912 -16.180 -22.180 5.222 1.00 28.85 C ATOM 140 C ASP A 912 -16.586 -22.270 6.691 1.00 27.10 C ATOM 141 O ASP A 912 -16.775 -23.370 7.205 1.00 20.65 O ATOM 142 CB ASP A 912 -14.920 -23.013 4.955 1.00 23.16 C ATOM 143 CG ASP A 912 -13.670 -22.708 5.769 1.00 17.74 C ATOM 144 OD1 ASP A 912 -13.664 -21.803 6.596 1.00 15.46 O ATOM 145 OD2 ASP A 912 -12.680 -23.398 5.562 1.00 19.20 O ATOM 0 H ASP A 912 -15.054 -20.502 4.629 1.00 14.36 H new ATOM 0 HA ASP A 912 -17.024 -22.594 4.670 1.00 28.85 H new ATOM 0 HB2 ASP A 912 -15.174 -24.061 5.115 1.00 23.16 H new ATOM 0 HB3 ASP A 912 -14.666 -22.904 3.901 1.00 23.16 H new ATOM 150 N GLY A 913 -16.571 -21.149 7.419 1.00 15.02 N ATOM 151 CA GLY A 913 -16.960 -21.113 8.825 1.00 19.67 C ATOM 152 C GLY A 913 -16.013 -21.856 9.760 1.00 16.55 C ATOM 153 O GLY A 913 -16.364 -22.121 10.901 1.00 15.65 O ATOM 0 H GLY A 913 -16.288 -20.243 7.046 1.00 15.02 H new ATOM 0 HA2 GLY A 913 -17.025 -20.073 9.145 1.00 19.67 H new ATOM 0 HA3 GLY A 913 -17.958 -21.540 8.924 1.00 19.67 H new ATOM 157 N ARG A 914 -14.801 -22.189 9.331 1.00 11.39 N ATOM 158 CA ARG A 914 -13.881 -22.996 10.103 1.00 11.95 C ATOM 159 C ARG A 914 -12.480 -22.434 10.090 1.00 10.82 C ATOM 160 O ARG A 914 -11.799 -22.439 11.117 1.00 19.47 O ATOM 161 CB ARG A 914 -13.766 -24.421 9.561 1.00 25.46 C ATOM 162 CG ARG A 914 -15.019 -25.252 9.687 1.00 42.88 C ATOM 163 CD ARG A 914 -14.571 -26.659 10.004 1.00 67.90 C ATOM 164 NE ARG A 914 -15.693 -27.490 10.422 1.00 80.80 N ATOM 165 CZ ARG A 914 -15.943 -27.792 11.712 1.00 94.75 C ATOM 166 NH1 ARG A 914 -15.238 -27.283 12.738 1.00 98.27 N ATOM 167 NH2 ARG A 914 -16.946 -28.632 11.993 1.00 90.34 N ATOM 0 H ARG A 914 -14.431 -21.900 8.426 1.00 11.39 H new ATOM 0 HA ARG A 914 -14.294 -22.994 11.112 1.00 11.95 H new ATOM 0 HB2 ARG A 914 -13.484 -24.372 8.509 1.00 25.46 H new ATOM 0 HB3 ARG A 914 -12.956 -24.929 10.085 1.00 25.46 H new ATOM 0 HG2 ARG A 914 -15.664 -24.864 10.475 1.00 42.88 H new ATOM 0 HG3 ARG A 914 -15.595 -25.228 8.762 1.00 42.88 H new ATOM 0 HD2 ARG A 914 -14.097 -27.099 9.126 1.00 67.90 H new ATOM 0 HD3 ARG A 914 -13.820 -26.635 10.793 1.00 67.90 H new ATOM 0 HE ARG A 914 -16.318 -27.860 9.706 1.00 80.80 H new ATOM 0 HH11 ARG A 914 -14.472 -26.634 12.558 1.00 98.27 H new ATOM 0 HH12 ARG A 914 -15.470 -27.545 13.696 1.00 98.27 H new ATOM 0 HH21 ARG A 914 -17.504 -29.030 11.238 1.00 90.34 H new ATOM 0 HH22 ARG A 914 -17.152 -28.874 12.962 1.00 90.34 H new ATOM 180 N THR A 915 -12.003 -21.978 8.930 1.00 16.37 N ATOM 181 CA THR A 915 -10.649 -21.483 8.737 1.00 20.68 C ATOM 182 C THR A 915 -10.575 -19.969 8.800 1.00 14.00 C ATOM 183 O THR A 915 -10.907 -19.264 7.839 1.00 12.73 O ATOM 184 CB THR A 915 -10.121 -21.991 7.356 1.00 17.19 C ATOM 185 OG1 THR A 915 -10.458 -23.368 7.257 1.00 20.12 O ATOM 186 CG2 THR A 915 -8.640 -21.831 7.242 1.00 14.89 C ATOM 0 H THR A 915 -12.566 -21.944 8.080 1.00 16.37 H new ATOM 0 HA THR A 915 -10.027 -21.863 9.547 1.00 20.68 H new ATOM 0 HB THR A 915 -10.574 -21.407 6.554 1.00 17.19 H new ATOM 0 HG1 THR A 915 -11.239 -23.473 6.674 1.00 20.12 H new ATOM 0 HG21 THR A 915 -8.309 -22.195 6.269 1.00 14.89 H new ATOM 0 HG22 THR A 915 -8.379 -20.778 7.344 1.00 14.89 H new ATOM 0 HG23 THR A 915 -8.150 -22.404 8.029 1.00 14.89 H new ATOM 194 N PHE A 916 -10.084 -19.491 9.927 1.00 12.81 N ATOM 195 CA PHE A 916 -10.019 -18.073 10.209 1.00 7.88 C ATOM 196 C PHE A 916 -8.564 -17.663 10.263 1.00 18.25 C ATOM 197 O PHE A 916 -7.780 -18.523 10.681 1.00 22.03 O ATOM 198 CB PHE A 916 -10.669 -17.788 11.576 1.00 11.94 C ATOM 199 CG PHE A 916 -12.180 -17.968 11.588 1.00 11.45 C ATOM 200 CD1 PHE A 916 -12.747 -19.218 11.831 1.00 9.87 C ATOM 201 CD2 PHE A 916 -12.997 -16.876 11.352 1.00 11.12 C ATOM 202 CE1 PHE A 916 -14.115 -19.381 11.819 1.00 7.22 C ATOM 203 CE2 PHE A 916 -14.371 -17.060 11.314 1.00 10.85 C ATOM 204 CZ PHE A 916 -14.927 -18.308 11.538 1.00 10.98 C ATOM 0 H PHE A 916 -9.718 -20.079 10.675 1.00 12.81 H new ATOM 0 HA PHE A 916 -10.546 -17.516 9.434 1.00 7.88 H new ATOM 0 HB2 PHE A 916 -10.228 -18.449 12.322 1.00 11.94 H new ATOM 0 HB3 PHE A 916 -10.432 -16.767 11.875 1.00 11.94 H new ATOM 0 HD1 PHE A 916 -12.109 -20.066 12.030 1.00 9.87 H new ATOM 0 HD2 PHE A 916 -12.571 -15.895 11.200 1.00 11.12 H new ATOM 0 HE1 PHE A 916 -14.548 -20.348 12.030 1.00 7.22 H new ATOM 0 HE2 PHE A 916 -15.016 -16.219 11.107 1.00 10.85 H new ATOM 0 HZ PHE A 916 -15.998 -18.438 11.492 1.00 10.98 H new ATOM 214 N PRO A 917 -8.139 -16.441 9.895 1.00 13.24 N ATOM 215 CA PRO A 917 -6.751 -16.012 9.970 1.00 16.94 C ATOM 216 C PRO A 917 -6.245 -16.029 11.406 1.00 27.68 C ATOM 217 O PRO A 917 -6.978 -15.799 12.379 1.00 18.36 O ATOM 218 CB PRO A 917 -6.781 -14.594 9.437 1.00 11.36 C ATOM 219 CG PRO A 917 -8.081 -14.426 8.711 1.00 13.31 C ATOM 220 CD PRO A 917 -8.997 -15.323 9.506 1.00 17.07 C ATOM 0 HA PRO A 917 -6.084 -16.667 9.409 1.00 16.94 H new ATOM 0 HB2 PRO A 917 -6.698 -13.874 10.251 1.00 11.36 H new ATOM 0 HB3 PRO A 917 -5.940 -14.416 8.767 1.00 11.36 H new ATOM 0 HG2 PRO A 917 -8.420 -13.390 8.714 1.00 13.31 H new ATOM 0 HG3 PRO A 917 -8.010 -14.735 7.668 1.00 13.31 H new ATOM 0 HD2 PRO A 917 -9.403 -14.809 10.377 1.00 17.07 H new ATOM 0 HD3 PRO A 917 -9.845 -15.658 8.909 1.00 17.07 H new ATOM 228 N LYS A 918 -4.969 -16.357 11.533 1.00 17.83 N ATOM 229 CA LYS A 918 -4.232 -16.239 12.767 1.00 24.33 C ATOM 230 C LYS A 918 -3.327 -15.005 12.601 1.00 27.42 C ATOM 231 O LYS A 918 -2.971 -14.562 11.500 1.00 25.81 O ATOM 232 CB LYS A 918 -3.431 -17.534 12.938 1.00 20.44 C ATOM 233 CG LYS A 918 -2.755 -17.715 14.279 1.00 73.40 C ATOM 234 CD LYS A 918 -1.758 -18.875 14.289 1.00 83.60 C ATOM 235 CE LYS A 918 -0.972 -18.811 15.606 1.00 79.68 C ATOM 236 NZ LYS A 918 -0.166 -19.997 15.847 1.00 88.66 N ATOM 0 H LYS A 918 -4.411 -16.720 10.760 1.00 17.83 H new ATOM 0 HA LYS A 918 -4.855 -16.109 13.652 1.00 24.33 H new ATOM 0 HB2 LYS A 918 -4.100 -18.378 12.772 1.00 20.44 H new ATOM 0 HB3 LYS A 918 -2.669 -17.574 12.159 1.00 20.44 H new ATOM 0 HG2 LYS A 918 -2.237 -16.794 14.547 1.00 73.40 H new ATOM 0 HG3 LYS A 918 -3.513 -17.887 15.043 1.00 73.40 H new ATOM 0 HD2 LYS A 918 -2.280 -19.828 14.203 1.00 83.60 H new ATOM 0 HD3 LYS A 918 -1.082 -18.804 13.437 1.00 83.60 H new ATOM 0 HE2 LYS A 918 -0.324 -17.935 15.593 1.00 79.68 H new ATOM 0 HE3 LYS A 918 -1.670 -18.679 16.433 1.00 79.68 H new ATOM 0 HZ1 LYS A 918 0.341 -19.895 16.750 1.00 88.66 H new ATOM 0 HZ2 LYS A 918 -0.783 -20.833 15.889 1.00 88.66 H new ATOM 0 HZ3 LYS A 918 0.522 -20.112 15.075 1.00 88.66 H new ATOM 249 N ARG A 919 -2.993 -14.385 13.733 1.00 23.19 N ATOM 250 CA ARG A 919 -2.005 -13.325 13.805 1.00 25.30 C ATOM 251 C ARG A 919 -0.715 -13.838 13.189 1.00 20.31 C ATOM 252 O ARG A 919 -0.280 -14.969 13.449 1.00 26.79 O ATOM 253 CB ARG A 919 -1.752 -13.038 15.279 1.00 36.42 C ATOM 254 CG ARG A 919 -1.846 -11.584 15.707 1.00 61.98 C ATOM 255 CD ARG A 919 -3.275 -11.057 15.689 1.00 70.36 C ATOM 256 NE ARG A 919 -4.153 -11.760 16.621 1.00 91.69 N ATOM 257 CZ ARG A 919 -5.490 -11.721 16.489 1.00 99.06 C ATOM 258 NH1 ARG A 919 -6.083 -11.104 15.459 1.00 87.08 N ATOM 259 NH2 ARG A 919 -6.263 -12.329 17.394 1.00 91.74 N ATOM 0 H ARG A 919 -3.411 -14.613 14.635 1.00 23.19 H new ATOM 0 HA ARG A 919 -2.345 -12.430 13.284 1.00 25.30 H new ATOM 0 HB2 ARG A 919 -2.466 -13.615 15.867 1.00 36.42 H new ATOM 0 HB3 ARG A 919 -0.758 -13.406 15.534 1.00 36.42 H new ATOM 0 HG2 ARG A 919 -1.437 -11.478 16.712 1.00 61.98 H new ATOM 0 HG3 ARG A 919 -1.230 -10.974 15.046 1.00 61.98 H new ATOM 0 HD2 ARG A 919 -3.268 -9.995 15.935 1.00 70.36 H new ATOM 0 HD3 ARG A 919 -3.677 -11.148 14.680 1.00 70.36 H new ATOM 0 HE ARG A 919 -3.743 -12.292 17.388 1.00 91.69 H new ATOM 0 HH11 ARG A 919 -5.517 -10.645 14.745 1.00 87.08 H new ATOM 0 HH12 ARG A 919 -7.100 -11.093 15.388 1.00 87.08 H new ATOM 0 HH21 ARG A 919 -5.838 -12.820 18.181 1.00 91.74 H new ATOM 0 HH22 ARG A 919 -7.278 -12.302 17.298 1.00 91.74 H new ATOM 272 N GLY A 920 -0.146 -13.017 12.328 1.00 28.49 N ATOM 273 CA GLY A 920 1.080 -13.388 11.661 1.00 22.19 C ATOM 274 C GLY A 920 0.834 -14.104 10.340 1.00 24.43 C ATOM 275 O GLY A 920 1.771 -14.215 9.548 1.00 27.40 O ATOM 0 H GLY A 920 -0.511 -12.098 12.078 1.00 28.49 H new ATOM 0 HA2 GLY A 920 1.676 -12.493 11.480 1.00 22.19 H new ATOM 0 HA3 GLY A 920 1.665 -14.033 12.316 1.00 22.19 H new ATOM 279 N GLN A 921 -0.370 -14.582 10.029 1.00 20.21 N ATOM 280 CA GLN A 921 -0.595 -15.171 8.720 1.00 22.26 C ATOM 281 C GLN A 921 -0.796 -14.080 7.697 1.00 19.19 C ATOM 282 O GLN A 921 -1.307 -12.998 8.026 1.00 24.35 O ATOM 283 CB GLN A 921 -1.839 -16.022 8.665 1.00 16.69 C ATOM 284 CG GLN A 921 -1.645 -17.308 9.393 1.00 32.77 C ATOM 285 CD GLN A 921 -2.767 -18.262 9.075 1.00 32.00 C ATOM 286 OE1 GLN A 921 -3.873 -18.176 9.609 1.00 30.66 O ATOM 287 NE2 GLN A 921 -2.506 -19.180 8.162 1.00 35.54 N ATOM 0 H GLN A 921 -1.180 -14.573 10.648 1.00 20.21 H new ATOM 0 HA GLN A 921 0.281 -15.786 8.516 1.00 22.26 H new ATOM 0 HB2 GLN A 921 -2.676 -15.476 9.102 1.00 16.69 H new ATOM 0 HB3 GLN A 921 -2.098 -16.225 7.626 1.00 16.69 H new ATOM 0 HG2 GLN A 921 -0.690 -17.752 9.112 1.00 32.77 H new ATOM 0 HG3 GLN A 921 -1.608 -17.124 10.467 1.00 32.77 H new ATOM 0 HE21 GLN A 921 -1.580 -19.227 7.737 1.00 35.54 H new ATOM 0 HE22 GLN A 921 -3.230 -19.842 7.882 1.00 35.54 H new ATOM 296 N THR A 922 -0.430 -14.413 6.465 1.00 12.61 N ATOM 297 CA THR A 922 -0.711 -13.597 5.300 1.00 14.09 C ATOM 298 C THR A 922 -2.117 -13.899 4.807 1.00 12.40 C ATOM 299 O THR A 922 -2.460 -15.031 4.450 1.00 17.06 O ATOM 300 CB THR A 922 0.327 -13.906 4.183 1.00 17.25 C ATOM 301 OG1 THR A 922 1.563 -13.527 4.783 1.00 23.17 O ATOM 302 CG2 THR A 922 0.123 -13.139 2.867 1.00 11.48 C ATOM 0 H THR A 922 0.078 -15.271 6.249 1.00 12.61 H new ATOM 0 HA THR A 922 -0.641 -12.541 5.562 1.00 14.09 H new ATOM 0 HB THR A 922 0.254 -14.950 3.877 1.00 17.25 H new ATOM 0 HG1 THR A 922 2.295 -13.686 4.152 1.00 23.17 H new ATOM 0 HG21 THR A 922 0.897 -13.425 2.155 1.00 11.48 H new ATOM 0 HG22 THR A 922 -0.857 -13.379 2.454 1.00 11.48 H new ATOM 0 HG23 THR A 922 0.183 -12.067 3.057 1.00 11.48 H new ATOM 310 N CYS A 923 -2.949 -12.875 4.783 1.00 13.20 N ATOM 311 CA CYS A 923 -4.275 -12.988 4.184 1.00 13.95 C ATOM 312 C CYS A 923 -4.172 -12.520 2.739 1.00 13.08 C ATOM 313 O CYS A 923 -3.527 -11.478 2.460 1.00 15.66 O ATOM 314 CB CYS A 923 -5.223 -12.073 4.935 1.00 10.31 C ATOM 315 SG CYS A 923 -5.195 -12.500 6.686 1.00 17.72 S ATOM 0 H CYS A 923 -2.735 -11.955 5.169 1.00 13.20 H new ATOM 0 HA CYS A 923 -4.640 -14.014 4.229 1.00 13.95 H new ATOM 0 HB2 CYS A 923 -4.929 -11.033 4.797 1.00 10.31 H new ATOM 0 HB3 CYS A 923 -6.234 -12.173 4.540 1.00 10.31 H new ATOM 0 HG CYS A 923 -6.004 -11.718 7.336 1.00 17.72 H new ATOM 321 N VAL A 924 -4.790 -13.286 1.830 1.00 11.74 N ATOM 322 CA VAL A 924 -4.835 -12.937 0.410 1.00 8.67 C ATOM 323 C VAL A 924 -6.284 -12.571 0.101 1.00 9.34 C ATOM 324 O VAL A 924 -7.185 -13.392 0.287 1.00 13.93 O ATOM 325 CB VAL A 924 -4.386 -14.115 -0.484 1.00 12.47 C ATOM 326 CG1 VAL A 924 -4.178 -13.644 -1.920 1.00 14.36 C ATOM 327 CG2 VAL A 924 -3.101 -14.697 0.037 1.00 13.59 C ATOM 0 H VAL A 924 -5.268 -14.157 2.059 1.00 11.74 H new ATOM 0 HA VAL A 924 -4.154 -12.112 0.204 1.00 8.67 H new ATOM 0 HB VAL A 924 -5.166 -14.876 -0.466 1.00 12.47 H new ATOM 0 HG11 VAL A 924 -3.862 -14.485 -2.537 1.00 14.36 H new ATOM 0 HG12 VAL A 924 -5.112 -13.240 -2.309 1.00 14.36 H new ATOM 0 HG13 VAL A 924 -3.411 -12.870 -1.942 1.00 14.36 H new ATOM 0 HG21 VAL A 924 -2.793 -15.526 -0.600 1.00 13.59 H new ATOM 0 HG22 VAL A 924 -2.327 -13.930 0.034 1.00 13.59 H new ATOM 0 HG23 VAL A 924 -3.251 -15.057 1.055 1.00 13.59 H new ATOM 337 N VAL A 925 -6.543 -11.330 -0.324 1.00 9.59 N ATOM 338 CA VAL A 925 -7.903 -10.820 -0.460 1.00 9.14 C ATOM 339 C VAL A 925 -8.119 -10.109 -1.785 1.00 10.95 C ATOM 340 O VAL A 925 -7.159 -9.648 -2.409 1.00 11.27 O ATOM 341 CB VAL A 925 -8.285 -9.802 0.641 1.00 8.47 C ATOM 342 CG1 VAL A 925 -8.150 -10.426 2.024 1.00 9.52 C ATOM 343 CG2 VAL A 925 -7.523 -8.480 0.544 1.00 8.56 C ATOM 0 H VAL A 925 -5.819 -10.659 -0.581 1.00 9.59 H new ATOM 0 HA VAL A 925 -8.526 -11.711 -0.383 1.00 9.14 H new ATOM 0 HB VAL A 925 -9.332 -9.547 0.474 1.00 8.47 H new ATOM 0 HG11 VAL A 925 -8.424 -9.692 2.782 1.00 9.52 H new ATOM 0 HG12 VAL A 925 -8.811 -11.290 2.100 1.00 9.52 H new ATOM 0 HG13 VAL A 925 -7.119 -10.743 2.181 1.00 9.52 H new ATOM 0 HG21 VAL A 925 -7.842 -7.816 1.347 1.00 8.56 H new ATOM 0 HG22 VAL A 925 -6.453 -8.669 0.633 1.00 8.56 H new ATOM 0 HG23 VAL A 925 -7.729 -8.011 -0.418 1.00 8.56 H new ATOM 353 N HIS A 926 -9.364 -10.003 -2.240 1.00 9.36 N ATOM 354 CA HIS A 926 -9.716 -8.981 -3.214 1.00 9.60 C ATOM 355 C HIS A 926 -10.567 -7.943 -2.525 1.00 5.10 C ATOM 356 O HIS A 926 -11.347 -8.304 -1.642 1.00 9.82 O ATOM 357 CB HIS A 926 -10.488 -9.525 -4.404 1.00 10.47 C ATOM 358 CG HIS A 926 -9.572 -9.783 -5.587 1.00 16.45 C ATOM 359 ND1 HIS A 926 -8.708 -8.873 -6.019 1.00 14.62 N ATOM 360 CD2 HIS A 926 -9.591 -10.918 -6.343 1.00 17.08 C ATOM 361 CE1 HIS A 926 -8.179 -9.434 -7.089 1.00 20.93 C ATOM 362 NE2 HIS A 926 -8.715 -10.631 -7.275 1.00 20.18 N ATOM 0 H HIS A 926 -10.136 -10.605 -1.953 1.00 9.36 H new ATOM 0 HA HIS A 926 -8.785 -8.563 -3.598 1.00 9.60 H new ATOM 0 HB2 HIS A 926 -10.990 -10.451 -4.122 1.00 10.47 H new ATOM 0 HB3 HIS A 926 -11.265 -8.816 -4.691 1.00 10.47 H new ATOM 0 HD2 HIS A 926 -10.174 -11.817 -6.209 1.00 17.08 H new ATOM 0 HE1 HIS A 926 -7.424 -8.986 -7.718 1.00 20.93 H new ATOM 0 HE2 HIS A 926 -8.476 -11.252 -8.048 1.00 20.18 H new ATOM 370 N TYR A 927 -10.423 -6.667 -2.885 1.00 8.15 N ATOM 371 CA TYR A 927 -11.226 -5.623 -2.287 1.00 5.33 C ATOM 372 C TYR A 927 -11.603 -4.536 -3.285 1.00 10.06 C ATOM 373 O TYR A 927 -10.944 -4.346 -4.310 1.00 9.71 O ATOM 374 CB TYR A 927 -10.531 -5.009 -1.049 1.00 6.71 C ATOM 375 CG TYR A 927 -9.360 -4.083 -1.375 1.00 6.72 C ATOM 376 CD1 TYR A 927 -8.105 -4.644 -1.487 1.00 14.55 C ATOM 377 CD2 TYR A 927 -9.558 -2.720 -1.579 1.00 5.79 C ATOM 378 CE1 TYR A 927 -7.036 -3.843 -1.819 1.00 8.62 C ATOM 379 CE2 TYR A 927 -8.494 -1.912 -1.914 1.00 13.96 C ATOM 380 CZ TYR A 927 -7.237 -2.496 -2.038 1.00 13.12 C ATOM 381 OH TYR A 927 -6.153 -1.735 -2.389 1.00 11.19 O ATOM 0 H TYR A 927 -9.758 -6.342 -3.586 1.00 8.15 H new ATOM 0 HA TYR A 927 -12.151 -6.098 -1.959 1.00 5.33 H new ATOM 0 HB2 TYR A 927 -11.269 -4.451 -0.473 1.00 6.71 H new ATOM 0 HB3 TYR A 927 -10.172 -5.817 -0.411 1.00 6.71 H new ATOM 0 HD1 TYR A 927 -7.963 -5.701 -1.316 1.00 14.55 H new ATOM 0 HD2 TYR A 927 -10.546 -2.296 -1.475 1.00 5.79 H new ATOM 0 HE1 TYR A 927 -6.046 -4.266 -1.907 1.00 8.62 H new ATOM 0 HE2 TYR A 927 -8.632 -0.853 -2.076 1.00 13.96 H new ATOM 0 HH TYR A 927 -6.439 -0.811 -2.546 1.00 11.19 H new ATOM 391 N THR A 928 -12.710 -3.861 -2.965 1.00 12.99 N ATOM 392 CA THR A 928 -13.163 -2.602 -3.557 1.00 7.71 C ATOM 393 C THR A 928 -13.441 -1.705 -2.356 1.00 11.95 C ATOM 394 O THR A 928 -14.077 -2.144 -1.392 1.00 11.60 O ATOM 395 CB THR A 928 -14.450 -2.798 -4.403 1.00 11.34 C ATOM 396 OG1 THR A 928 -14.032 -3.660 -5.446 1.00 14.19 O ATOM 397 CG2 THR A 928 -15.104 -1.514 -4.893 1.00 11.50 C ATOM 0 H THR A 928 -13.349 -4.198 -2.245 1.00 12.99 H new ATOM 0 HA THR A 928 -12.424 -2.182 -4.239 1.00 7.71 H new ATOM 0 HB THR A 928 -15.259 -3.219 -3.805 1.00 11.34 H new ATOM 0 HG1 THR A 928 -14.789 -3.845 -6.040 1.00 14.19 H new ATOM 0 HG21 THR A 928 -15.994 -1.757 -5.473 1.00 11.50 H new ATOM 0 HG22 THR A 928 -15.385 -0.900 -4.038 1.00 11.50 H new ATOM 0 HG23 THR A 928 -14.402 -0.964 -5.519 1.00 11.50 H new ATOM 405 N GLY A 929 -12.948 -0.474 -2.378 1.00 8.64 N ATOM 406 CA GLY A 929 -13.194 0.487 -1.328 1.00 9.01 C ATOM 407 C GLY A 929 -13.954 1.690 -1.875 1.00 15.91 C ATOM 408 O GLY A 929 -13.691 2.163 -2.978 1.00 10.99 O ATOM 0 H GLY A 929 -12.363 -0.118 -3.134 1.00 8.64 H new ATOM 0 HA2 GLY A 929 -13.767 0.021 -0.527 1.00 9.01 H new ATOM 0 HA3 GLY A 929 -12.248 0.813 -0.896 1.00 9.01 H new ATOM 412 N MET A 930 -14.877 2.220 -1.088 1.00 12.93 N ATOM 413 CA MET A 930 -15.588 3.443 -1.423 1.00 11.46 C ATOM 414 C MET A 930 -15.891 4.217 -0.148 1.00 8.02 C ATOM 415 O MET A 930 -15.846 3.682 0.972 1.00 12.78 O ATOM 416 CB MET A 930 -16.879 3.139 -2.212 1.00 12.38 C ATOM 417 CG MET A 930 -17.960 2.486 -1.411 1.00 17.40 C ATOM 418 SD MET A 930 -19.438 1.996 -2.321 1.00 21.98 S ATOM 419 CE MET A 930 -20.418 3.251 -1.563 1.00 33.26 C ATOM 0 H MET A 930 -15.155 1.812 -0.195 1.00 12.93 H new ATOM 0 HA MET A 930 -14.956 4.055 -2.067 1.00 11.46 H new ATOM 0 HB2 MET A 930 -17.264 4.071 -2.626 1.00 12.38 H new ATOM 0 HB3 MET A 930 -16.630 2.495 -3.055 1.00 12.38 H new ATOM 0 HG2 MET A 930 -17.544 1.600 -0.931 1.00 17.40 H new ATOM 0 HG3 MET A 930 -18.258 3.169 -0.616 1.00 17.40 H new ATOM 0 HE1 MET A 930 -21.412 3.255 -2.009 1.00 33.26 H new ATOM 0 HE2 MET A 930 -20.501 3.052 -0.494 1.00 33.26 H new ATOM 0 HE3 MET A 930 -19.947 4.222 -1.716 1.00 33.26 H new ATOM 429 N LEU A 931 -16.097 5.520 -0.313 1.00 16.97 N ATOM 430 CA LEU A 931 -16.540 6.374 0.787 1.00 14.92 C ATOM 431 C LEU A 931 -18.025 6.083 1.020 1.00 20.11 C ATOM 432 O LEU A 931 -18.713 5.822 0.027 1.00 15.50 O ATOM 433 CB LEU A 931 -16.330 7.823 0.374 1.00 16.10 C ATOM 434 CG LEU A 931 -14.915 8.328 0.034 1.00 20.40 C ATOM 435 CD1 LEU A 931 -15.013 9.762 -0.459 1.00 36.95 C ATOM 436 CD2 LEU A 931 -14.042 8.298 1.265 1.00 22.00 C ATOM 0 H LEU A 931 -15.964 6.009 -1.198 1.00 16.97 H new ATOM 0 HA LEU A 931 -15.983 6.187 1.705 1.00 14.92 H new ATOM 0 HB2 LEU A 931 -16.958 8.006 -0.498 1.00 16.10 H new ATOM 0 HB3 LEU A 931 -16.713 8.449 1.180 1.00 16.10 H new ATOM 0 HG LEU A 931 -14.479 7.687 -0.732 1.00 20.40 H new ATOM 0 HD11 LEU A 931 -14.017 10.132 -0.703 1.00 36.95 H new ATOM 0 HD12 LEU A 931 -15.642 9.799 -1.348 1.00 36.95 H new ATOM 0 HD13 LEU A 931 -15.450 10.386 0.321 1.00 36.95 H new ATOM 0 HD21 LEU A 931 -13.044 8.657 1.012 1.00 22.00 H new ATOM 0 HD22 LEU A 931 -14.474 8.939 2.033 1.00 22.00 H new ATOM 0 HD23 LEU A 931 -13.976 7.276 1.639 1.00 22.00 H new ATOM 448 N GLU A 932 -18.534 6.065 2.264 1.00 19.84 N ATOM 449 CA GLU A 932 -19.941 5.774 2.540 1.00 30.77 C ATOM 450 C GLU A 932 -20.819 6.730 1.756 1.00 23.77 C ATOM 451 O GLU A 932 -20.668 7.939 1.881 1.00 40.64 O ATOM 452 CB GLU A 932 -20.306 5.927 4.007 1.00 21.80 C ATOM 453 CG GLU A 932 -21.745 5.449 4.245 1.00 32.10 C ATOM 454 CD GLU A 932 -22.090 5.026 5.673 1.00 69.47 C ATOM 455 OE1 GLU A 932 -22.244 5.859 6.561 1.00 72.56 O ATOM 456 OE2 GLU A 932 -22.149 3.824 5.919 1.00 61.02 O ATOM 0 H GLU A 932 -17.980 6.252 3.100 1.00 19.84 H new ATOM 0 HA GLU A 932 -20.100 4.735 2.250 1.00 30.77 H new ATOM 0 HB2 GLU A 932 -19.616 5.350 4.623 1.00 21.80 H new ATOM 0 HB3 GLU A 932 -20.207 6.970 4.308 1.00 21.80 H new ATOM 0 HG2 GLU A 932 -22.424 6.249 3.951 1.00 32.10 H new ATOM 0 HG3 GLU A 932 -21.940 4.606 3.582 1.00 32.10 H new ATOM 463 N ASP A 933 -21.658 6.142 0.896 1.00 31.32 N ATOM 464 CA ASP A 933 -22.476 6.872 -0.072 1.00 55.76 C ATOM 465 C ASP A 933 -21.737 7.907 -0.916 1.00 36.62 C ATOM 466 O ASP A 933 -22.165 9.039 -1.167 1.00 49.81 O ATOM 467 CB ASP A 933 -23.751 7.424 0.584 1.00 57.01 C ATOM 468 CG ASP A 933 -24.644 6.313 1.131 1.00 64.95 C ATOM 469 OD1 ASP A 933 -24.773 5.261 0.494 1.00 71.74 O ATOM 470 OD2 ASP A 933 -25.208 6.498 2.210 1.00 71.59 O ATOM 0 H ASP A 933 -21.788 5.131 0.854 1.00 31.32 H new ATOM 0 HA ASP A 933 -22.771 6.128 -0.812 1.00 55.76 H new ATOM 0 HB2 ASP A 933 -23.478 8.100 1.394 1.00 57.01 H new ATOM 0 HB3 ASP A 933 -24.309 8.010 -0.146 1.00 57.01 H new ATOM 475 N GLY A 934 -20.592 7.430 -1.388 1.00 48.70 N ATOM 476 CA GLY A 934 -19.679 8.254 -2.133 1.00 34.41 C ATOM 477 C GLY A 934 -18.909 7.427 -3.156 1.00 34.23 C ATOM 478 O GLY A 934 -19.303 6.341 -3.604 1.00 27.91 O ATOM 0 H GLY A 934 -20.281 6.467 -1.261 1.00 48.70 H new ATOM 0 HA2 GLY A 934 -20.229 9.046 -2.640 1.00 34.41 H new ATOM 0 HA3 GLY A 934 -18.980 8.738 -1.451 1.00 34.41 H new ATOM 482 N LYS A 935 -17.751 8.010 -3.463 1.00 30.73 N ATOM 483 CA LYS A 935 -16.908 7.600 -4.569 1.00 29.07 C ATOM 484 C LYS A 935 -16.198 6.284 -4.250 1.00 15.38 C ATOM 485 O LYS A 935 -15.733 6.098 -3.117 1.00 17.31 O ATOM 486 CB LYS A 935 -15.912 8.746 -4.735 1.00 28.79 C ATOM 487 CG LYS A 935 -15.351 8.987 -6.120 1.00 59.76 C ATOM 488 CD LYS A 935 -14.744 10.377 -6.071 1.00 72.83 C ATOM 489 CE LYS A 935 -14.071 10.751 -7.386 1.00 77.19 C ATOM 490 NZ LYS A 935 -13.453 12.067 -7.290 1.00 83.47 N ATOM 0 H LYS A 935 -17.371 8.796 -2.935 1.00 30.73 H new ATOM 0 HA LYS A 935 -17.474 7.418 -5.482 1.00 29.07 H new ATOM 0 HB2 LYS A 935 -16.397 9.664 -4.404 1.00 28.79 H new ATOM 0 HB3 LYS A 935 -15.076 8.566 -4.060 1.00 28.79 H new ATOM 0 HG2 LYS A 935 -14.600 8.239 -6.376 1.00 59.76 H new ATOM 0 HG3 LYS A 935 -16.133 8.926 -6.877 1.00 59.76 H new ATOM 0 HD2 LYS A 935 -15.522 11.105 -5.842 1.00 72.83 H new ATOM 0 HD3 LYS A 935 -14.014 10.426 -5.263 1.00 72.83 H new ATOM 0 HE2 LYS A 935 -13.316 10.006 -7.639 1.00 77.19 H new ATOM 0 HE3 LYS A 935 -14.806 10.746 -8.191 1.00 77.19 H new ATOM 0 HZ1 LYS A 935 -13.000 12.304 -8.195 1.00 83.47 H new ATOM 0 HZ2 LYS A 935 -14.181 12.777 -7.070 1.00 83.47 H new ATOM 0 HZ3 LYS A 935 -12.737 12.060 -6.536 1.00 83.47 H new ATOM 503 N LYS A 936 -16.160 5.344 -5.199 1.00 19.66 N ATOM 504 CA LYS A 936 -15.174 4.267 -5.160 1.00 18.14 C ATOM 505 C LYS A 936 -13.793 4.874 -5.371 1.00 23.43 C ATOM 506 O LYS A 936 -13.580 5.669 -6.283 1.00 34.44 O ATOM 507 CB LYS A 936 -15.471 3.245 -6.223 1.00 14.74 C ATOM 508 CG LYS A 936 -14.344 2.241 -6.451 1.00 41.82 C ATOM 509 CD LYS A 936 -14.538 1.613 -7.830 1.00 73.09 C ATOM 510 CE LYS A 936 -13.409 0.697 -8.265 1.00 53.04 C ATOM 511 NZ LYS A 936 -12.310 1.500 -8.755 1.00 53.35 N ATOM 0 H LYS A 936 -16.796 5.309 -5.996 1.00 19.66 H new ATOM 0 HA LYS A 936 -15.212 3.762 -4.195 1.00 18.14 H new ATOM 0 HB2 LYS A 936 -16.376 2.703 -5.949 1.00 14.74 H new ATOM 0 HB3 LYS A 936 -15.679 3.761 -7.160 1.00 14.74 H new ATOM 0 HG2 LYS A 936 -13.375 2.737 -6.392 1.00 41.82 H new ATOM 0 HG3 LYS A 936 -14.357 1.473 -5.678 1.00 41.82 H new ATOM 0 HD2 LYS A 936 -15.470 1.047 -7.831 1.00 73.09 H new ATOM 0 HD3 LYS A 936 -14.648 2.409 -8.566 1.00 73.09 H new ATOM 0 HE2 LYS A 936 -13.081 0.081 -7.428 1.00 53.04 H new ATOM 0 HE3 LYS A 936 -13.755 0.018 -9.044 1.00 53.04 H new ATOM 0 HZ1 LYS A 936 -11.656 0.900 -9.297 1.00 53.35 H new ATOM 0 HZ2 LYS A 936 -12.678 2.254 -9.369 1.00 53.35 H new ATOM 0 HZ3 LYS A 936 -11.805 1.924 -7.951 1.00 53.35 H new ATOM 524 N PHE A 937 -12.868 4.528 -4.487 1.00 20.64 N ATOM 525 CA PHE A 937 -11.542 5.089 -4.565 1.00 13.73 C ATOM 526 C PHE A 937 -10.511 4.016 -4.903 1.00 20.97 C ATOM 527 O PHE A 937 -9.403 4.370 -5.300 1.00 19.29 O ATOM 528 CB PHE A 937 -11.175 5.865 -3.269 1.00 11.07 C ATOM 529 CG PHE A 937 -11.203 5.063 -1.981 1.00 14.52 C ATOM 530 CD1 PHE A 937 -10.182 4.179 -1.660 1.00 14.79 C ATOM 531 CD2 PHE A 937 -12.295 5.201 -1.143 1.00 15.57 C ATOM 532 CE1 PHE A 937 -10.291 3.407 -0.514 1.00 9.39 C ATOM 533 CE2 PHE A 937 -12.382 4.436 0.002 1.00 12.97 C ATOM 534 CZ PHE A 937 -11.393 3.529 0.309 1.00 9.22 C ATOM 0 H PHE A 937 -13.015 3.871 -3.721 1.00 20.64 H new ATOM 0 HA PHE A 937 -11.532 5.814 -5.379 1.00 13.73 H new ATOM 0 HB2 PHE A 937 -10.176 6.284 -3.391 1.00 11.07 H new ATOM 0 HB3 PHE A 937 -11.862 6.705 -3.165 1.00 11.07 H new ATOM 0 HD1 PHE A 937 -9.313 4.094 -2.296 1.00 14.79 H new ATOM 0 HD2 PHE A 937 -13.077 5.906 -1.384 1.00 15.57 H new ATOM 0 HE1 PHE A 937 -9.509 2.706 -0.263 1.00 9.39 H new ATOM 0 HE2 PHE A 937 -13.230 4.549 0.661 1.00 12.97 H new ATOM 0 HZ PHE A 937 -11.479 2.914 1.192 1.00 9.22 H new ATOM 544 N ASP A 938 -10.775 2.704 -4.740 1.00 16.37 N ATOM 545 CA ASP A 938 -9.774 1.681 -5.058 1.00 22.26 C ATOM 546 C ASP A 938 -10.367 0.286 -5.226 1.00 19.09 C ATOM 547 O ASP A 938 -11.422 0.002 -4.660 1.00 11.13 O ATOM 548 CB ASP A 938 -8.680 1.658 -3.982 1.00 10.58 C ATOM 549 CG ASP A 938 -7.417 0.893 -4.351 1.00 13.87 C ATOM 550 OD1 ASP A 938 -7.165 0.645 -5.521 1.00 20.82 O ATOM 551 OD2 ASP A 938 -6.668 0.537 -3.458 1.00 16.84 O ATOM 0 H ASP A 938 -11.662 2.337 -4.395 1.00 16.37 H new ATOM 0 HA ASP A 938 -9.346 1.958 -6.022 1.00 22.26 H new ATOM 0 HB2 ASP A 938 -8.406 2.686 -3.745 1.00 10.58 H new ATOM 0 HB3 ASP A 938 -9.096 1.222 -3.074 1.00 10.58 H new ATOM 556 N SER A 939 -9.767 -0.591 -6.029 1.00 12.66 N ATOM 557 CA SER A 939 -10.194 -1.955 -6.141 1.00 17.76 C ATOM 558 C SER A 939 -9.003 -2.741 -6.628 1.00 19.03 C ATOM 559 O SER A 939 -8.422 -2.402 -7.656 1.00 23.31 O ATOM 560 CB SER A 939 -11.266 -2.086 -7.193 1.00 15.16 C ATOM 561 OG SER A 939 -11.672 -3.429 -7.361 1.00 19.65 O ATOM 0 H SER A 939 -8.967 -0.358 -6.618 1.00 12.66 H new ATOM 0 HA SER A 939 -10.577 -2.304 -5.182 1.00 17.76 H new ATOM 0 HB2 SER A 939 -12.126 -1.478 -6.913 1.00 15.16 H new ATOM 0 HB3 SER A 939 -10.895 -1.697 -8.141 1.00 15.16 H new ATOM 0 HG SER A 939 -12.438 -3.614 -6.779 1.00 19.65 H new ATOM 567 N SER A 940 -8.675 -3.824 -5.941 1.00 12.37 N ATOM 568 CA SER A 940 -7.653 -4.715 -6.434 1.00 14.57 C ATOM 569 C SER A 940 -8.153 -5.526 -7.622 1.00 15.72 C ATOM 570 O SER A 940 -7.367 -6.070 -8.393 1.00 19.07 O ATOM 571 CB SER A 940 -7.211 -5.615 -5.299 1.00 10.13 C ATOM 572 OG SER A 940 -8.278 -6.407 -4.816 1.00 13.17 O ATOM 0 H SER A 940 -9.098 -4.099 -5.054 1.00 12.37 H new ATOM 0 HA SER A 940 -6.802 -4.133 -6.789 1.00 14.57 H new ATOM 0 HB2 SER A 940 -6.403 -6.262 -5.641 1.00 10.13 H new ATOM 0 HB3 SER A 940 -6.812 -5.008 -4.487 1.00 10.13 H new ATOM 0 HG SER A 940 -8.496 -7.099 -5.475 1.00 13.17 H new ATOM 578 N ARG A 941 -9.470 -5.646 -7.797 1.00 18.89 N ATOM 579 CA ARG A 941 -10.042 -6.441 -8.871 1.00 15.31 C ATOM 580 C ARG A 941 -9.690 -5.855 -10.227 1.00 31.13 C ATOM 581 O ARG A 941 -9.285 -6.598 -11.110 1.00 36.87 O ATOM 582 CB ARG A 941 -11.557 -6.579 -8.702 1.00 30.45 C ATOM 583 CG ARG A 941 -11.922 -7.455 -7.511 1.00 26.49 C ATOM 584 CD ARG A 941 -13.435 -7.559 -7.269 1.00 36.88 C ATOM 585 NE ARG A 941 -13.709 -8.348 -6.070 1.00 30.75 N ATOM 586 CZ ARG A 941 -13.816 -9.685 -6.099 1.00 50.14 C ATOM 587 NH1 ARG A 941 -13.650 -10.386 -7.222 1.00 35.76 N ATOM 588 NH2 ARG A 941 -14.053 -10.357 -4.973 1.00 25.34 N ATOM 0 H ARG A 941 -10.162 -5.195 -7.199 1.00 18.89 H new ATOM 0 HA ARG A 941 -9.610 -7.440 -8.819 1.00 15.31 H new ATOM 0 HB2 ARG A 941 -11.999 -5.591 -8.574 1.00 30.45 H new ATOM 0 HB3 ARG A 941 -11.986 -7.004 -9.609 1.00 30.45 H new ATOM 0 HG2 ARG A 941 -11.517 -8.455 -7.668 1.00 26.49 H new ATOM 0 HG3 ARG A 941 -11.445 -7.055 -6.616 1.00 26.49 H new ATOM 0 HD2 ARG A 941 -13.861 -6.562 -7.160 1.00 36.88 H new ATOM 0 HD3 ARG A 941 -13.916 -8.019 -8.132 1.00 36.88 H new ATOM 0 HE ARG A 941 -13.823 -7.865 -5.179 1.00 30.75 H new ATOM 0 HH11 ARG A 941 -13.434 -9.906 -8.096 1.00 35.76 H new ATOM 0 HH12 ARG A 941 -13.739 -11.402 -7.207 1.00 35.76 H new ATOM 0 HH21 ARG A 941 -14.153 -9.855 -4.091 1.00 25.34 H new ATOM 0 HH22 ARG A 941 -14.135 -11.374 -4.993 1.00 25.34 H new ATOM 601 N ASP A 942 -9.748 -4.520 -10.342 1.00 32.90 N ATOM 602 CA ASP A 942 -9.343 -3.750 -11.530 1.00 42.46 C ATOM 603 C ASP A 942 -7.939 -4.108 -12.002 1.00 49.35 C ATOM 604 O ASP A 942 -7.602 -4.182 -13.186 1.00 52.42 O ATOM 605 CB ASP A 942 -9.241 -2.223 -11.242 1.00 58.24 C ATOM 606 CG ASP A 942 -10.478 -1.366 -10.954 1.00 77.12 C ATOM 607 OD1 ASP A 942 -11.604 -1.765 -11.274 1.00 72.34 O ATOM 608 OD2 ASP A 942 -10.294 -0.269 -10.414 1.00 77.19 O ATOM 0 H ASP A 942 -10.089 -3.926 -9.586 1.00 32.90 H new ATOM 0 HA ASP A 942 -10.111 -3.990 -12.266 1.00 42.46 H new ATOM 0 HB2 ASP A 942 -8.574 -2.108 -10.388 1.00 58.24 H new ATOM 0 HB3 ASP A 942 -8.741 -1.774 -12.100 1.00 58.24 H new ATOM 613 N ARG A 943 -7.107 -4.254 -10.979 1.00 55.02 N ATOM 614 CA ARG A 943 -5.699 -4.484 -11.160 1.00 31.32 C ATOM 615 C ARG A 943 -5.380 -5.936 -11.456 1.00 32.97 C ATOM 616 O ARG A 943 -4.221 -6.284 -11.705 1.00 39.40 O ATOM 617 CB ARG A 943 -4.979 -4.074 -9.896 1.00 33.76 C ATOM 618 CG ARG A 943 -4.759 -2.592 -9.790 1.00 43.44 C ATOM 619 CD ARG A 943 -3.678 -2.414 -8.732 1.00 55.11 C ATOM 620 NE ARG A 943 -4.154 -2.753 -7.399 1.00 68.77 N ATOM 621 CZ ARG A 943 -4.968 -1.935 -6.718 1.00 34.61 C ATOM 622 NH1 ARG A 943 -5.462 -0.827 -7.280 1.00 29.77 N ATOM 623 NH2 ARG A 943 -5.292 -2.234 -5.460 1.00 50.73 N ATOM 0 H ARG A 943 -7.400 -4.214 -10.003 1.00 55.02 H new ATOM 0 HA ARG A 943 -5.372 -3.895 -12.017 1.00 31.32 H new ATOM 0 HB2 ARG A 943 -5.554 -4.411 -9.033 1.00 33.76 H new ATOM 0 HB3 ARG A 943 -4.015 -4.581 -9.855 1.00 33.76 H new ATOM 0 HG2 ARG A 943 -4.445 -2.173 -10.746 1.00 43.44 H new ATOM 0 HG3 ARG A 943 -5.677 -2.079 -9.503 1.00 43.44 H new ATOM 0 HD2 ARG A 943 -2.822 -3.041 -8.981 1.00 55.11 H new ATOM 0 HD3 ARG A 943 -3.330 -1.381 -8.740 1.00 55.11 H new ATOM 0 HE ARG A 943 -3.861 -3.633 -6.974 1.00 68.77 H new ATOM 0 HH11 ARG A 943 -5.221 -0.592 -8.243 1.00 29.77 H new ATOM 0 HH12 ARG A 943 -6.080 -0.216 -6.746 1.00 29.77 H new ATOM 0 HH21 ARG A 943 -4.921 -3.079 -5.025 1.00 50.73 H new ATOM 0 HH22 ARG A 943 -5.911 -1.618 -4.933 1.00 50.73 H new ATOM 636 N ASN A 944 -6.390 -6.809 -11.349 1.00 23.56 N ATOM 637 CA ASN A 944 -6.257 -8.236 -11.593 1.00 42.03 C ATOM 638 C ASN A 944 -5.235 -8.873 -10.645 1.00 70.45 C ATOM 639 O ASN A 944 -4.841 -10.027 -10.843 1.00 92.53 O ATOM 640 CB ASN A 944 -5.908 -8.534 -13.081 1.00 61.12 C ATOM 641 CG ASN A 944 -6.843 -7.937 -14.139 1.00 61.70 C ATOM 642 OD1 ASN A 944 -8.040 -8.196 -14.191 1.00 55.55 O ATOM 643 ND2 ASN A 944 -6.360 -7.107 -15.055 1.00 33.11 N ATOM 0 H ASN A 944 -7.335 -6.530 -11.086 1.00 23.56 H new ATOM 0 HA ASN A 944 -7.226 -8.690 -11.388 1.00 42.03 H new ATOM 0 HB2 ASN A 944 -4.899 -8.169 -13.274 1.00 61.12 H new ATOM 0 HB3 ASN A 944 -5.887 -9.615 -13.216 1.00 61.12 H new ATOM 0 HD21 ASN A 944 -6.979 -6.713 -15.764 1.00 33.11 H new ATOM 0 HD22 ASN A 944 -5.370 -6.863 -15.050 1.00 33.11 H new ATOM 650 N LYS A 945 -4.807 -8.184 -9.572 1.00 58.24 N ATOM 651 CA LYS A 945 -3.818 -8.714 -8.641 1.00 52.71 C ATOM 652 C LYS A 945 -4.416 -8.658 -7.223 1.00 19.74 C ATOM 653 O LYS A 945 -4.994 -7.626 -6.850 1.00 30.95 O ATOM 654 CB LYS A 945 -2.495 -7.925 -8.725 1.00 56.69 C ATOM 655 CG LYS A 945 -1.395 -8.626 -7.922 1.00 79.88 C ATOM 656 CD LYS A 945 -0.060 -7.904 -7.750 1.00 81.56 C ATOM 657 CE LYS A 945 0.703 -8.775 -6.748 1.00 84.21 C ATOM 658 NZ LYS A 945 2.034 -8.275 -6.457 1.00 86.18 N ATOM 0 H LYS A 945 -5.140 -7.250 -9.334 1.00 58.24 H new ATOM 0 HA LYS A 945 -3.581 -9.746 -8.899 1.00 52.71 H new ATOM 0 HB2 LYS A 945 -2.188 -7.830 -9.766 1.00 56.69 H new ATOM 0 HB3 LYS A 945 -2.643 -6.915 -8.343 1.00 56.69 H new ATOM 0 HG2 LYS A 945 -1.790 -8.837 -6.928 1.00 79.88 H new ATOM 0 HG3 LYS A 945 -1.196 -9.587 -8.397 1.00 79.88 H new ATOM 0 HD2 LYS A 945 0.475 -7.822 -8.696 1.00 81.56 H new ATOM 0 HD3 LYS A 945 -0.199 -6.891 -7.374 1.00 81.56 H new ATOM 0 HE2 LYS A 945 0.133 -8.836 -5.821 1.00 84.21 H new ATOM 0 HE3 LYS A 945 0.780 -9.789 -7.142 1.00 84.21 H new ATOM 0 HZ1 LYS A 945 2.500 -8.906 -5.774 1.00 86.18 H new ATOM 0 HZ2 LYS A 945 2.592 -8.242 -7.334 1.00 86.18 H new ATOM 0 HZ3 LYS A 945 1.965 -7.319 -6.054 1.00 86.18 H new ATOM 671 N PRO A 946 -4.403 -9.750 -6.428 1.00 32.57 N ATOM 672 CA PRO A 946 -4.907 -9.761 -5.068 1.00 16.22 C ATOM 673 C PRO A 946 -3.896 -9.050 -4.196 1.00 14.54 C ATOM 674 O PRO A 946 -2.682 -9.053 -4.459 1.00 16.32 O ATOM 675 CB PRO A 946 -4.987 -11.248 -4.710 1.00 14.02 C ATOM 676 CG PRO A 946 -5.011 -11.934 -6.046 1.00 31.07 C ATOM 677 CD PRO A 946 -3.994 -11.098 -6.802 1.00 32.99 C ATOM 0 HA PRO A 946 -5.871 -9.268 -4.941 1.00 16.22 H new ATOM 0 HB2 PRO A 946 -4.131 -11.563 -4.113 1.00 14.02 H new ATOM 0 HB3 PRO A 946 -5.881 -11.472 -4.128 1.00 14.02 H new ATOM 0 HG2 PRO A 946 -4.719 -12.982 -5.980 1.00 31.07 H new ATOM 0 HG3 PRO A 946 -5.997 -11.906 -6.509 1.00 31.07 H new ATOM 0 HD2 PRO A 946 -2.971 -11.318 -6.496 1.00 32.99 H new ATOM 0 HD3 PRO A 946 -4.046 -11.260 -7.879 1.00 32.99 H new ATOM 685 N PHE A 947 -4.460 -8.494 -3.126 1.00 10.29 N ATOM 686 CA PHE A 947 -3.723 -7.753 -2.138 1.00 9.03 C ATOM 687 C PHE A 947 -3.390 -8.732 -1.031 1.00 8.52 C ATOM 688 O PHE A 947 -4.213 -9.576 -0.661 1.00 11.40 O ATOM 689 CB PHE A 947 -4.580 -6.589 -1.614 1.00 8.19 C ATOM 690 CG PHE A 947 -4.020 -5.810 -0.428 1.00 9.99 C ATOM 691 CD1 PHE A 947 -3.069 -4.829 -0.628 1.00 20.12 C ATOM 692 CD2 PHE A 947 -4.504 -6.041 0.853 1.00 13.29 C ATOM 693 CE1 PHE A 947 -2.614 -4.083 0.450 1.00 21.39 C ATOM 694 CE2 PHE A 947 -4.043 -5.280 1.916 1.00 10.10 C ATOM 695 CZ PHE A 947 -3.095 -4.314 1.719 1.00 10.55 C ATOM 0 H PHE A 947 -5.459 -8.554 -2.930 1.00 10.29 H new ATOM 0 HA PHE A 947 -2.812 -7.319 -2.550 1.00 9.03 H new ATOM 0 HB2 PHE A 947 -4.744 -5.890 -2.434 1.00 8.19 H new ATOM 0 HB3 PHE A 947 -5.556 -6.984 -1.332 1.00 8.19 H new ATOM 0 HD1 PHE A 947 -2.681 -4.643 -1.619 1.00 20.12 H new ATOM 0 HD2 PHE A 947 -5.240 -6.814 1.021 1.00 13.29 H new ATOM 0 HE1 PHE A 947 -1.874 -3.312 0.292 1.00 21.39 H new ATOM 0 HE2 PHE A 947 -4.435 -5.451 2.907 1.00 10.10 H new ATOM 0 HZ PHE A 947 -2.726 -3.736 2.554 1.00 10.55 H new ATOM 705 N LYS A 948 -2.182 -8.631 -0.477 1.00 9.33 N ATOM 706 CA LYS A 948 -1.791 -9.498 0.613 1.00 7.21 C ATOM 707 C LYS A 948 -1.302 -8.596 1.725 1.00 12.96 C ATOM 708 O LYS A 948 -0.672 -7.551 1.486 1.00 14.92 O ATOM 709 CB LYS A 948 -0.646 -10.403 0.206 1.00 12.42 C ATOM 710 CG LYS A 948 -0.950 -11.233 -1.002 1.00 15.45 C ATOM 711 CD LYS A 948 0.176 -12.201 -1.198 1.00 22.52 C ATOM 712 CE LYS A 948 -0.096 -12.868 -2.526 1.00 20.02 C ATOM 713 NZ LYS A 948 0.917 -13.877 -2.744 1.00 31.31 N ATOM 0 H LYS A 948 -1.470 -7.961 -0.768 1.00 9.33 H new ATOM 0 HA LYS A 948 -2.634 -10.121 0.912 1.00 7.21 H new ATOM 0 HB2 LYS A 948 0.236 -9.795 0.008 1.00 12.42 H new ATOM 0 HB3 LYS A 948 -0.399 -11.062 1.038 1.00 12.42 H new ATOM 0 HG2 LYS A 948 -1.891 -11.766 -0.870 1.00 15.45 H new ATOM 0 HG3 LYS A 948 -1.064 -10.598 -1.881 1.00 15.45 H new ATOM 0 HD2 LYS A 948 1.138 -11.689 -1.205 1.00 22.52 H new ATOM 0 HD3 LYS A 948 0.211 -12.932 -0.391 1.00 22.52 H new ATOM 0 HE2 LYS A 948 -1.088 -13.320 -2.528 1.00 20.02 H new ATOM 0 HE3 LYS A 948 -0.079 -12.133 -3.331 1.00 20.02 H new ATOM 0 HZ1 LYS A 948 0.747 -14.349 -3.655 1.00 31.31 H new ATOM 0 HZ2 LYS A 948 1.856 -13.430 -2.756 1.00 31.31 H new ATOM 0 HZ3 LYS A 948 0.878 -14.579 -1.978 1.00 31.31 H new ATOM 726 N PHE A 949 -1.642 -8.979 2.945 1.00 18.97 N ATOM 727 CA PHE A 949 -1.114 -8.303 4.116 1.00 24.29 C ATOM 728 C PHE A 949 -0.996 -9.314 5.246 1.00 15.17 C ATOM 729 O PHE A 949 -1.685 -10.345 5.283 1.00 14.27 O ATOM 730 CB PHE A 949 -1.983 -7.116 4.540 1.00 8.79 C ATOM 731 CG PHE A 949 -3.290 -7.541 5.196 1.00 8.83 C ATOM 732 CD1 PHE A 949 -4.352 -7.958 4.419 1.00 12.25 C ATOM 733 CD2 PHE A 949 -3.404 -7.463 6.581 1.00 15.63 C ATOM 734 CE1 PHE A 949 -5.544 -8.280 5.046 1.00 16.62 C ATOM 735 CE2 PHE A 949 -4.583 -7.803 7.196 1.00 15.50 C ATOM 736 CZ PHE A 949 -5.661 -8.212 6.425 1.00 14.07 C ATOM 0 H PHE A 949 -2.278 -9.750 3.149 1.00 18.97 H new ATOM 0 HA PHE A 949 -0.133 -7.895 3.871 1.00 24.29 H new ATOM 0 HB2 PHE A 949 -1.421 -6.491 5.234 1.00 8.79 H new ATOM 0 HB3 PHE A 949 -2.204 -6.504 3.666 1.00 8.79 H new ATOM 0 HD1 PHE A 949 -4.255 -8.032 3.346 1.00 12.25 H new ATOM 0 HD2 PHE A 949 -2.563 -7.134 7.173 1.00 15.63 H new ATOM 0 HE1 PHE A 949 -6.393 -8.588 4.453 1.00 16.62 H new ATOM 0 HE2 PHE A 949 -4.671 -7.752 8.271 1.00 15.50 H new ATOM 0 HZ PHE A 949 -6.594 -8.478 6.900 1.00 14.07 H new ATOM 746 N MET A 950 -0.154 -8.994 6.214 1.00 11.11 N ATOM 747 CA MET A 950 0.045 -9.889 7.337 1.00 13.52 C ATOM 748 C MET A 950 -0.779 -9.382 8.504 1.00 17.48 C ATOM 749 O MET A 950 -0.677 -8.221 8.938 1.00 14.22 O ATOM 750 CB MET A 950 1.521 -9.903 7.679 1.00 15.86 C ATOM 751 CG MET A 950 1.914 -11.207 8.310 1.00 52.57 C ATOM 752 SD MET A 950 3.671 -11.205 8.707 1.00 50.59 S ATOM 753 CE MET A 950 4.249 -11.183 7.037 1.00 35.23 C ATOM 0 H MET A 950 0.394 -8.134 6.245 1.00 11.11 H new ATOM 0 HA MET A 950 -0.271 -10.905 7.099 1.00 13.52 H new ATOM 0 HB2 MET A 950 2.109 -9.740 6.776 1.00 15.86 H new ATOM 0 HB3 MET A 950 1.748 -9.082 8.360 1.00 15.86 H new ATOM 0 HG2 MET A 950 1.330 -11.371 9.215 1.00 52.57 H new ATOM 0 HG3 MET A 950 1.688 -12.030 7.631 1.00 52.57 H new ATOM 0 HE1 MET A 950 5.193 -11.723 6.972 1.00 35.23 H new ATOM 0 HE2 MET A 950 3.512 -11.660 6.391 1.00 35.23 H new ATOM 0 HE3 MET A 950 4.398 -10.152 6.717 1.00 35.23 H new ATOM 763 N LEU A 951 -1.628 -10.276 8.993 1.00 12.57 N ATOM 764 CA LEU A 951 -2.547 -9.934 10.043 1.00 14.16 C ATOM 765 C LEU A 951 -1.760 -9.714 11.317 1.00 18.48 C ATOM 766 O LEU A 951 -0.795 -10.413 11.597 1.00 23.65 O ATOM 767 CB LEU A 951 -3.578 -11.026 10.248 1.00 11.95 C ATOM 768 CG LEU A 951 -4.722 -10.666 11.190 1.00 23.71 C ATOM 769 CD1 LEU A 951 -5.730 -9.758 10.528 1.00 21.03 C ATOM 770 CD2 LEU A 951 -5.422 -11.906 11.631 1.00 23.88 C ATOM 0 H LEU A 951 -1.691 -11.242 8.671 1.00 12.57 H new ATOM 0 HA LEU A 951 -3.083 -9.025 9.768 1.00 14.16 H new ATOM 0 HB2 LEU A 951 -3.997 -11.295 9.279 1.00 11.95 H new ATOM 0 HB3 LEU A 951 -3.074 -11.912 10.635 1.00 11.95 H new ATOM 0 HG LEU A 951 -4.288 -10.143 12.042 1.00 23.71 H new ATOM 0 HD11 LEU A 951 -6.528 -9.526 11.233 1.00 21.03 H new ATOM 0 HD12 LEU A 951 -5.240 -8.835 10.218 1.00 21.03 H new ATOM 0 HD13 LEU A 951 -6.151 -10.257 9.655 1.00 21.03 H new ATOM 0 HD21 LEU A 951 -6.238 -11.643 12.304 1.00 23.88 H new ATOM 0 HD22 LEU A 951 -5.822 -12.427 10.761 1.00 23.88 H new ATOM 0 HD23 LEU A 951 -4.718 -12.556 12.151 1.00 23.88 H new ATOM 782 N GLY A 952 -2.121 -8.664 12.043 1.00 16.43 N ATOM 783 CA GLY A 952 -1.553 -8.403 13.345 1.00 25.36 C ATOM 784 C GLY A 952 -0.302 -7.539 13.332 1.00 37.86 C ATOM 785 O GLY A 952 0.129 -7.142 14.412 1.00 41.17 O ATOM 0 H GLY A 952 -2.812 -7.977 11.742 1.00 16.43 H new ATOM 0 HA2 GLY A 952 -2.307 -7.917 13.964 1.00 25.36 H new ATOM 0 HA3 GLY A 952 -1.316 -9.355 13.820 1.00 25.36 H new ATOM 789 N LYS A 953 0.274 -7.164 12.183 1.00 23.52 N ATOM 790 CA LYS A 953 1.497 -6.356 12.141 1.00 16.40 C ATOM 791 C LYS A 953 1.275 -4.854 12.042 1.00 17.66 C ATOM 792 O LYS A 953 2.205 -4.113 11.746 1.00 25.35 O ATOM 793 CB LYS A 953 2.300 -6.761 10.917 1.00 17.13 C ATOM 794 CG LYS A 953 2.598 -8.245 10.877 1.00 34.16 C ATOM 795 CD LYS A 953 3.423 -8.743 12.058 1.00 39.60 C ATOM 796 CE LYS A 953 4.914 -8.821 11.726 1.00 79.21 C ATOM 797 NZ LYS A 953 5.681 -9.474 12.782 1.00 68.49 N ATOM 0 H LYS A 953 -0.092 -7.410 11.263 1.00 23.52 H new ATOM 0 HA LYS A 953 2.004 -6.546 13.087 1.00 16.40 H new ATOM 0 HB2 LYS A 953 1.751 -6.481 10.018 1.00 17.13 H new ATOM 0 HB3 LYS A 953 3.238 -6.206 10.903 1.00 17.13 H new ATOM 0 HG2 LYS A 953 1.657 -8.794 10.847 1.00 34.16 H new ATOM 0 HG3 LYS A 953 3.130 -8.474 9.953 1.00 34.16 H new ATOM 0 HD2 LYS A 953 3.276 -8.078 12.909 1.00 39.60 H new ATOM 0 HD3 LYS A 953 3.067 -9.728 12.359 1.00 39.60 H new ATOM 0 HE2 LYS A 953 5.048 -9.366 10.792 1.00 79.21 H new ATOM 0 HE3 LYS A 953 5.302 -7.815 11.567 1.00 79.21 H new ATOM 0 HZ1 LYS A 953 6.685 -9.504 12.514 1.00 68.49 H new ATOM 0 HZ2 LYS A 953 5.575 -8.940 13.668 1.00 68.49 H new ATOM 0 HZ3 LYS A 953 5.330 -10.443 12.918 1.00 68.49 H new ATOM 810 N GLN A 954 0.026 -4.383 12.204 1.00 25.80 N ATOM 811 CA GLN A 954 -0.357 -2.992 11.949 1.00 26.19 C ATOM 812 C GLN A 954 0.038 -2.401 10.581 1.00 17.56 C ATOM 813 O GLN A 954 0.300 -1.216 10.396 1.00 17.09 O ATOM 814 CB GLN A 954 0.099 -2.085 13.087 1.00 41.87 C ATOM 815 CG GLN A 954 -0.654 -2.259 14.388 1.00 26.68 C ATOM 816 CD GLN A 954 -0.164 -1.245 15.418 1.00 64.57 C ATOM 817 OE1 GLN A 954 1.035 -1.026 15.605 1.00 59.44 O ATOM 818 NE2 GLN A 954 -1.092 -0.589 16.098 1.00 66.86 N ATOM 0 H GLN A 954 -0.749 -4.966 12.519 1.00 25.80 H new ATOM 0 HA GLN A 954 -1.445 -3.030 11.905 1.00 26.19 H new ATOM 0 HB2 GLN A 954 1.158 -2.264 13.272 1.00 41.87 H new ATOM 0 HB3 GLN A 954 0.003 -1.048 12.765 1.00 41.87 H new ATOM 0 HG2 GLN A 954 -1.723 -2.129 14.219 1.00 26.68 H new ATOM 0 HG3 GLN A 954 -0.512 -3.271 14.767 1.00 26.68 H new ATOM 0 HE21 GLN A 954 -2.079 -0.783 15.931 1.00 66.86 H new ATOM 0 HE22 GLN A 954 -0.819 0.110 16.789 1.00 66.86 H new ATOM 827 N GLU A 955 0.010 -3.258 9.564 1.00 12.54 N ATOM 828 CA GLU A 955 0.227 -2.813 8.199 1.00 13.97 C ATOM 829 C GLU A 955 -0.970 -2.062 7.634 1.00 12.18 C ATOM 830 O GLU A 955 -0.817 -1.201 6.769 1.00 12.93 O ATOM 831 CB GLU A 955 0.521 -4.013 7.338 1.00 13.36 C ATOM 832 CG GLU A 955 1.783 -4.748 7.762 1.00 13.00 C ATOM 833 CD GLU A 955 2.156 -5.929 6.873 1.00 21.07 C ATOM 834 OE1 GLU A 955 1.394 -6.331 5.990 1.00 22.75 O ATOM 835 OE2 GLU A 955 3.234 -6.468 7.054 1.00 26.18 O ATOM 0 H GLU A 955 -0.160 -4.259 9.663 1.00 12.54 H new ATOM 0 HA GLU A 955 1.069 -2.120 8.202 1.00 13.97 H new ATOM 0 HB2 GLU A 955 -0.325 -4.699 7.379 1.00 13.36 H new ATOM 0 HB3 GLU A 955 0.623 -3.694 6.301 1.00 13.36 H new ATOM 0 HG2 GLU A 955 2.613 -4.042 7.773 1.00 13.00 H new ATOM 0 HG3 GLU A 955 1.654 -5.105 8.784 1.00 13.00 H new ATOM 842 N VAL A 956 -2.178 -2.405 8.107 1.00 11.28 N ATOM 843 CA VAL A 956 -3.403 -1.841 7.570 1.00 5.68 C ATOM 844 C VAL A 956 -4.228 -1.195 8.684 1.00 9.59 C ATOM 845 O VAL A 956 -3.981 -1.399 9.879 1.00 13.30 O ATOM 846 CB VAL A 956 -4.199 -2.932 6.805 1.00 8.42 C ATOM 847 CG1 VAL A 956 -3.460 -3.334 5.522 1.00 5.29 C ATOM 848 CG2 VAL A 956 -4.535 -4.136 7.731 1.00 10.91 C ATOM 0 H VAL A 956 -2.321 -3.074 8.864 1.00 11.28 H new ATOM 0 HA VAL A 956 -3.158 -1.054 6.857 1.00 5.68 H new ATOM 0 HB VAL A 956 -5.160 -2.521 6.494 1.00 8.42 H new ATOM 0 HG11 VAL A 956 -4.032 -4.100 4.998 1.00 5.29 H new ATOM 0 HG12 VAL A 956 -3.347 -2.461 4.879 1.00 5.29 H new ATOM 0 HG13 VAL A 956 -2.476 -3.727 5.777 1.00 5.29 H new ATOM 0 HG21 VAL A 956 -5.093 -4.884 7.167 1.00 10.91 H new ATOM 0 HG22 VAL A 956 -3.611 -4.577 8.104 1.00 10.91 H new ATOM 0 HG23 VAL A 956 -5.137 -3.792 8.572 1.00 10.91 H new ATOM 858 N ILE A 957 -5.237 -0.425 8.297 1.00 6.13 N ATOM 859 CA ILE A 957 -6.122 0.234 9.242 1.00 11.35 C ATOM 860 C ILE A 957 -6.805 -0.743 10.180 1.00 11.05 C ATOM 861 O ILE A 957 -7.035 -1.916 9.854 1.00 10.94 O ATOM 862 CB ILE A 957 -7.159 1.143 8.530 1.00 9.45 C ATOM 863 CG1 ILE A 957 -8.055 0.349 7.551 1.00 5.31 C ATOM 864 CG2 ILE A 957 -6.420 2.313 7.873 1.00 8.84 C ATOM 865 CD1 ILE A 957 -9.176 1.135 6.892 1.00 7.74 C ATOM 0 H ILE A 957 -5.463 -0.241 7.319 1.00 6.13 H new ATOM 0 HA ILE A 957 -5.486 0.873 9.855 1.00 11.35 H new ATOM 0 HB ILE A 957 -7.854 1.551 9.264 1.00 9.45 H new ATOM 0 HG12 ILE A 957 -7.423 -0.070 6.769 1.00 5.31 H new ATOM 0 HG13 ILE A 957 -8.494 -0.491 8.090 1.00 5.31 H new ATOM 0 HG21 ILE A 957 -7.138 2.960 7.369 1.00 8.84 H new ATOM 0 HG22 ILE A 957 -5.891 2.884 8.636 1.00 8.84 H new ATOM 0 HG23 ILE A 957 -5.704 1.929 7.146 1.00 8.84 H new ATOM 0 HD11 ILE A 957 -9.738 0.479 6.227 1.00 7.74 H new ATOM 0 HD12 ILE A 957 -9.842 1.532 7.659 1.00 7.74 H new ATOM 0 HD13 ILE A 957 -8.753 1.959 6.317 1.00 7.74 H new ATOM 877 N ARG A 958 -7.169 -0.246 11.361 1.00 8.31 N ATOM 878 CA ARG A 958 -7.703 -1.073 12.422 1.00 9.12 C ATOM 879 C ARG A 958 -8.953 -1.873 12.062 1.00 9.73 C ATOM 880 O ARG A 958 -9.130 -3.038 12.441 1.00 11.55 O ATOM 881 CB ARG A 958 -7.979 -0.153 13.587 1.00 13.65 C ATOM 882 CG ARG A 958 -8.402 -0.896 14.815 1.00 13.35 C ATOM 883 CD ARG A 958 -8.544 0.064 15.987 1.00 27.70 C ATOM 884 NE ARG A 958 -8.967 -0.742 17.125 1.00 32.60 N ATOM 885 CZ ARG A 958 -9.201 -0.257 18.355 1.00 63.58 C ATOM 886 NH1 ARG A 958 -9.039 1.030 18.662 1.00 64.64 N ATOM 887 NH2 ARG A 958 -9.563 -1.092 19.327 1.00 55.48 N ATOM 0 H ARG A 958 -7.099 0.743 11.601 1.00 8.31 H new ATOM 0 HA ARG A 958 -6.964 -1.840 12.652 1.00 9.12 H new ATOM 0 HB2 ARG A 958 -7.083 0.427 13.808 1.00 13.65 H new ATOM 0 HB3 ARG A 958 -8.758 0.557 13.309 1.00 13.65 H new ATOM 0 HG2 ARG A 958 -9.350 -1.403 14.634 1.00 13.35 H new ATOM 0 HG3 ARG A 958 -7.669 -1.667 15.053 1.00 13.35 H new ATOM 0 HD2 ARG A 958 -7.599 0.566 16.195 1.00 27.70 H new ATOM 0 HD3 ARG A 958 -9.276 0.841 15.767 1.00 27.70 H new ATOM 0 HE ARG A 958 -9.094 -1.743 16.977 1.00 32.60 H new ATOM 0 HH11 ARG A 958 -8.726 1.689 17.949 1.00 64.64 H new ATOM 0 HH12 ARG A 958 -9.228 1.356 19.610 1.00 64.64 H new ATOM 0 HH21 ARG A 958 -9.660 -2.089 19.133 1.00 55.48 H new ATOM 0 HH22 ARG A 958 -9.743 -0.735 20.265 1.00 55.48 H new ATOM 900 N GLY A 959 -9.833 -1.243 11.288 1.00 9.85 N ATOM 901 CA GLY A 959 -11.041 -1.886 10.822 1.00 11.31 C ATOM 902 C GLY A 959 -10.792 -3.113 9.962 1.00 11.34 C ATOM 903 O GLY A 959 -11.618 -4.029 9.978 1.00 12.57 O ATOM 0 H GLY A 959 -9.723 -0.279 10.972 1.00 9.85 H new ATOM 0 HA2 GLY A 959 -11.643 -2.174 11.684 1.00 11.31 H new ATOM 0 HA3 GLY A 959 -11.627 -1.166 10.250 1.00 11.31 H new ATOM 907 N TRP A 960 -9.683 -3.126 9.204 1.00 9.25 N ATOM 908 CA TRP A 960 -9.302 -4.288 8.443 1.00 5.89 C ATOM 909 C TRP A 960 -8.728 -5.313 9.382 1.00 11.62 C ATOM 910 O TRP A 960 -9.080 -6.478 9.255 1.00 10.65 O ATOM 911 CB TRP A 960 -8.273 -4.002 7.358 1.00 2.00 C ATOM 912 CG TRP A 960 -8.917 -3.710 6.014 1.00 7.15 C ATOM 913 CD1 TRP A 960 -9.791 -2.669 5.819 1.00 9.09 C ATOM 914 CD2 TRP A 960 -8.671 -4.400 4.854 1.00 12.44 C ATOM 915 NE1 TRP A 960 -10.074 -2.714 4.537 1.00 14.82 N ATOM 916 CE2 TRP A 960 -9.425 -3.711 3.923 1.00 9.06 C ATOM 917 CE3 TRP A 960 -7.883 -5.462 4.456 1.00 10.43 C ATOM 918 CZ2 TRP A 960 -9.391 -4.043 2.575 1.00 6.28 C ATOM 919 CZ3 TRP A 960 -7.840 -5.789 3.117 1.00 12.15 C ATOM 920 CH2 TRP A 960 -8.586 -5.094 2.184 1.00 8.16 C ATOM 0 H TRP A 960 -9.045 -2.335 9.114 1.00 9.25 H new ATOM 0 HA TRP A 960 -10.203 -4.644 7.943 1.00 5.89 H new ATOM 0 HB2 TRP A 960 -7.660 -3.152 7.657 1.00 2.00 H new ATOM 0 HB3 TRP A 960 -7.605 -4.858 7.260 1.00 2.00 H new ATOM 0 HD1 TRP A 960 -10.162 -1.970 6.554 1.00 9.09 H new ATOM 0 HE1 TRP A 960 -10.710 -2.069 4.067 1.00 14.82 H new ATOM 0 HE3 TRP A 960 -7.312 -6.025 5.179 1.00 10.43 H new ATOM 0 HZ2 TRP A 960 -9.978 -3.494 1.853 1.00 6.28 H new ATOM 0 HZ3 TRP A 960 -7.211 -6.604 2.791 1.00 12.15 H new ATOM 0 HH2 TRP A 960 -8.539 -5.375 1.142 1.00 8.16 H new ATOM 931 N GLU A 961 -7.874 -4.927 10.342 1.00 10.64 N ATOM 932 CA GLU A 961 -7.303 -5.869 11.292 1.00 10.98 C ATOM 933 C GLU A 961 -8.381 -6.627 12.065 1.00 15.13 C ATOM 934 O GLU A 961 -8.338 -7.849 12.210 1.00 18.15 O ATOM 935 CB GLU A 961 -6.395 -5.145 12.287 1.00 10.74 C ATOM 936 CG GLU A 961 -5.115 -4.495 11.765 1.00 19.92 C ATOM 937 CD GLU A 961 -3.922 -5.433 11.647 1.00 18.76 C ATOM 938 OE1 GLU A 961 -3.977 -6.391 10.892 1.00 32.83 O ATOM 939 OE2 GLU A 961 -2.933 -5.200 12.324 1.00 44.50 O ATOM 0 H GLU A 961 -7.568 -3.963 10.474 1.00 10.64 H new ATOM 0 HA GLU A 961 -6.723 -6.588 10.713 1.00 10.98 H new ATOM 0 HB2 GLU A 961 -6.987 -4.369 12.772 1.00 10.74 H new ATOM 0 HB3 GLU A 961 -6.113 -5.860 13.059 1.00 10.74 H new ATOM 0 HG2 GLU A 961 -5.318 -4.063 10.785 1.00 19.92 H new ATOM 0 HG3 GLU A 961 -4.847 -3.671 12.427 1.00 19.92 H new ATOM 946 N GLU A 962 -9.384 -5.912 12.551 1.00 9.75 N ATOM 947 CA GLU A 962 -10.479 -6.543 13.262 1.00 11.54 C ATOM 948 C GLU A 962 -11.515 -7.177 12.363 1.00 8.40 C ATOM 949 O GLU A 962 -12.110 -8.195 12.722 1.00 11.35 O ATOM 950 CB GLU A 962 -11.159 -5.531 14.169 1.00 11.79 C ATOM 951 CG GLU A 962 -10.202 -5.316 15.341 1.00 44.46 C ATOM 952 CD GLU A 962 -10.571 -4.284 16.394 1.00 52.63 C ATOM 953 OE1 GLU A 962 -11.739 -3.948 16.587 1.00 26.54 O ATOM 954 OE2 GLU A 962 -9.654 -3.828 17.061 1.00 28.84 O ATOM 0 H GLU A 962 -9.460 -4.898 12.465 1.00 9.75 H new ATOM 0 HA GLU A 962 -10.031 -7.351 13.841 1.00 11.54 H new ATOM 0 HB2 GLU A 962 -11.347 -4.596 13.641 1.00 11.79 H new ATOM 0 HB3 GLU A 962 -12.124 -5.902 14.515 1.00 11.79 H new ATOM 0 HG2 GLU A 962 -10.074 -6.274 15.845 1.00 44.46 H new ATOM 0 HG3 GLU A 962 -9.231 -5.039 14.931 1.00 44.46 H new ATOM 961 N GLY A 963 -11.757 -6.580 11.208 1.00 6.34 N ATOM 962 CA GLY A 963 -12.762 -7.062 10.282 1.00 11.76 C ATOM 963 C GLY A 963 -12.362 -8.382 9.667 1.00 14.21 C ATOM 964 O GLY A 963 -13.099 -9.367 9.758 1.00 11.00 O ATOM 0 H GLY A 963 -11.261 -5.748 10.888 1.00 6.34 H new ATOM 0 HA2 GLY A 963 -13.713 -7.175 10.803 1.00 11.76 H new ATOM 0 HA3 GLY A 963 -12.916 -6.324 9.494 1.00 11.76 H new ATOM 968 N VAL A 964 -11.157 -8.433 9.085 1.00 12.36 N ATOM 969 CA VAL A 964 -10.693 -9.632 8.406 1.00 8.38 C ATOM 970 C VAL A 964 -10.449 -10.793 9.373 1.00 10.73 C ATOM 971 O VAL A 964 -10.721 -11.943 9.029 1.00 11.09 O ATOM 972 CB VAL A 964 -9.495 -9.304 7.470 1.00 10.46 C ATOM 973 CG1 VAL A 964 -8.919 -10.563 6.825 1.00 7.10 C ATOM 974 CG2 VAL A 964 -9.936 -8.303 6.385 1.00 13.30 C ATOM 0 H VAL A 964 -10.494 -7.658 9.075 1.00 12.36 H new ATOM 0 HA VAL A 964 -11.490 -9.994 7.757 1.00 8.38 H new ATOM 0 HB VAL A 964 -8.708 -8.857 8.078 1.00 10.46 H new ATOM 0 HG11 VAL A 964 -8.084 -10.291 6.179 1.00 7.10 H new ATOM 0 HG12 VAL A 964 -8.570 -11.243 7.602 1.00 7.10 H new ATOM 0 HG13 VAL A 964 -9.691 -11.054 6.233 1.00 7.10 H new ATOM 0 HG21 VAL A 964 -9.092 -8.078 5.733 1.00 13.30 H new ATOM 0 HG22 VAL A 964 -10.744 -8.737 5.796 1.00 13.30 H new ATOM 0 HG23 VAL A 964 -10.285 -7.385 6.857 1.00 13.30 H new ATOM 984 N ALA A 965 -10.012 -10.519 10.612 1.00 8.64 N ATOM 985 CA ALA A 965 -9.858 -11.554 11.612 1.00 5.07 C ATOM 986 C ALA A 965 -11.104 -12.387 11.917 1.00 10.97 C ATOM 987 O ALA A 965 -11.006 -13.545 12.349 1.00 11.35 O ATOM 988 CB ALA A 965 -9.401 -10.915 12.911 1.00 9.58 C ATOM 0 H ALA A 965 -9.762 -9.584 10.933 1.00 8.64 H new ATOM 0 HA ALA A 965 -9.132 -12.246 11.186 1.00 5.07 H new ATOM 0 HB1 ALA A 965 -9.281 -11.685 13.673 1.00 9.58 H new ATOM 0 HB2 ALA A 965 -8.448 -10.410 12.753 1.00 9.58 H new ATOM 0 HB3 ALA A 965 -10.145 -10.190 13.241 1.00 9.58 H new ATOM 994 N GLN A 966 -12.307 -11.851 11.682 1.00 8.60 N ATOM 995 CA GLN A 966 -13.497 -12.645 11.954 1.00 3.86 C ATOM 996 C GLN A 966 -14.056 -13.273 10.687 1.00 7.84 C ATOM 997 O GLN A 966 -15.185 -13.769 10.678 1.00 13.14 O ATOM 998 CB GLN A 966 -14.514 -11.834 12.733 1.00 14.43 C ATOM 999 CG GLN A 966 -14.877 -10.549 12.059 1.00 9.21 C ATOM 1000 CD GLN A 966 -15.702 -9.629 12.927 1.00 18.89 C ATOM 1001 OE1 GLN A 966 -16.922 -9.771 13.037 1.00 16.81 O ATOM 1002 NE2 GLN A 966 -15.079 -8.636 13.543 1.00 16.04 N ATOM 0 H GLN A 966 -12.475 -10.912 11.320 1.00 8.60 H new ATOM 0 HA GLN A 966 -13.219 -13.485 12.591 1.00 3.86 H new ATOM 0 HB2 GLN A 966 -15.415 -12.431 12.874 1.00 14.43 H new ATOM 0 HB3 GLN A 966 -14.116 -11.618 13.724 1.00 14.43 H new ATOM 0 HG2 GLN A 966 -13.964 -10.033 11.761 1.00 9.21 H new ATOM 0 HG3 GLN A 966 -15.431 -10.770 11.147 1.00 9.21 H new ATOM 0 HE21 GLN A 966 -14.069 -8.528 13.445 1.00 16.04 H new ATOM 0 HE22 GLN A 966 -15.609 -7.979 14.116 1.00 16.04 H new ATOM 1011 N MET A 967 -13.289 -13.265 9.596 1.00 12.58 N ATOM 1012 CA MET A 967 -13.770 -13.838 8.364 1.00 9.01 C ATOM 1013 C MET A 967 -13.112 -15.196 8.207 1.00 5.22 C ATOM 1014 O MET A 967 -11.984 -15.426 8.638 1.00 11.06 O ATOM 1015 CB MET A 967 -13.458 -12.924 7.183 1.00 8.72 C ATOM 1016 CG MET A 967 -14.292 -11.642 7.102 1.00 14.13 C ATOM 1017 SD MET A 967 -13.716 -10.583 5.755 1.00 13.76 S ATOM 1018 CE MET A 967 -14.379 -11.573 4.441 1.00 11.06 C ATOM 0 H MET A 967 -12.349 -12.872 9.551 1.00 12.58 H new ATOM 0 HA MET A 967 -14.854 -13.951 8.389 1.00 9.01 H new ATOM 0 HB2 MET A 967 -12.404 -12.649 7.228 1.00 8.72 H new ATOM 0 HB3 MET A 967 -13.601 -13.488 6.262 1.00 8.72 H new ATOM 0 HG2 MET A 967 -15.341 -11.895 6.948 1.00 14.13 H new ATOM 0 HG3 MET A 967 -14.229 -11.102 8.047 1.00 14.13 H new ATOM 0 HE1 MET A 967 -14.859 -10.927 3.705 1.00 11.06 H new ATOM 0 HE2 MET A 967 -13.573 -12.131 3.964 1.00 11.06 H new ATOM 0 HE3 MET A 967 -15.113 -12.270 4.845 1.00 11.06 H new ATOM 1028 N SER A 968 -13.842 -16.124 7.604 1.00 8.79 N ATOM 1029 CA SER A 968 -13.240 -17.392 7.255 1.00 11.09 C ATOM 1030 C SER A 968 -12.876 -17.476 5.771 1.00 15.47 C ATOM 1031 O SER A 968 -13.403 -16.689 4.967 1.00 12.61 O ATOM 1032 CB SER A 968 -14.122 -18.532 7.701 1.00 8.47 C ATOM 1033 OG SER A 968 -15.448 -18.544 7.210 1.00 11.08 O ATOM 0 H SER A 968 -14.826 -16.023 7.354 1.00 8.79 H new ATOM 0 HA SER A 968 -12.295 -17.474 7.791 1.00 11.09 H new ATOM 0 HB2 SER A 968 -13.643 -19.466 7.408 1.00 8.47 H new ATOM 0 HB3 SER A 968 -14.163 -18.523 8.790 1.00 8.47 H new ATOM 0 HG SER A 968 -16.076 -18.507 7.962 1.00 11.08 H new ATOM 1039 N VAL A 969 -12.017 -18.429 5.376 1.00 13.66 N ATOM 1040 CA VAL A 969 -11.581 -18.553 3.999 1.00 10.45 C ATOM 1041 C VAL A 969 -12.778 -18.765 3.099 1.00 6.70 C ATOM 1042 O VAL A 969 -13.637 -19.584 3.432 1.00 10.56 O ATOM 1043 CB VAL A 969 -10.529 -19.678 3.854 1.00 22.97 C ATOM 1044 CG1 VAL A 969 -10.078 -19.921 2.406 1.00 11.78 C ATOM 1045 CG2 VAL A 969 -9.308 -19.297 4.648 1.00 13.49 C ATOM 0 H VAL A 969 -11.615 -19.124 6.005 1.00 13.66 H new ATOM 0 HA VAL A 969 -11.094 -17.628 3.690 1.00 10.45 H new ATOM 0 HB VAL A 969 -11.002 -20.593 4.212 1.00 22.97 H new ATOM 0 HG11 VAL A 969 -9.341 -20.723 2.384 1.00 11.78 H new ATOM 0 HG12 VAL A 969 -10.939 -20.203 1.799 1.00 11.78 H new ATOM 0 HG13 VAL A 969 -9.634 -19.010 2.005 1.00 11.78 H new ATOM 0 HG21 VAL A 969 -8.556 -20.080 4.557 1.00 13.49 H new ATOM 0 HG22 VAL A 969 -8.904 -18.359 4.267 1.00 13.49 H new ATOM 0 HG23 VAL A 969 -9.579 -19.175 5.697 1.00 13.49 H new ATOM 1055 N GLY A 970 -12.858 -17.987 2.026 1.00 12.27 N ATOM 1056 CA GLY A 970 -13.923 -18.059 1.039 1.00 12.60 C ATOM 1057 C GLY A 970 -15.005 -17.001 1.247 1.00 16.68 C ATOM 1058 O GLY A 970 -15.819 -16.755 0.357 1.00 12.60 O ATOM 0 H GLY A 970 -12.164 -17.270 1.815 1.00 12.27 H new ATOM 0 HA2 GLY A 970 -13.496 -17.942 0.043 1.00 12.60 H new ATOM 0 HA3 GLY A 970 -14.379 -19.048 1.076 1.00 12.60 H new ATOM 1062 N GLN A 971 -15.031 -16.361 2.421 1.00 9.90 N ATOM 1063 CA GLN A 971 -16.089 -15.450 2.731 1.00 5.02 C ATOM 1064 C GLN A 971 -15.901 -14.166 1.939 1.00 8.32 C ATOM 1065 O GLN A 971 -14.779 -13.692 1.770 1.00 13.62 O ATOM 1066 CB GLN A 971 -16.057 -15.147 4.204 1.00 2.98 C ATOM 1067 CG GLN A 971 -17.284 -14.359 4.673 1.00 6.45 C ATOM 1068 CD GLN A 971 -17.311 -14.177 6.171 1.00 11.80 C ATOM 1069 OE1 GLN A 971 -16.644 -14.909 6.904 1.00 16.00 O ATOM 1070 NE2 GLN A 971 -18.085 -13.269 6.733 1.00 12.64 N ATOM 0 H GLN A 971 -14.329 -16.469 3.153 1.00 9.90 H new ATOM 0 HA GLN A 971 -17.049 -15.894 2.469 1.00 5.02 H new ATOM 0 HB2 GLN A 971 -15.996 -16.082 4.762 1.00 2.98 H new ATOM 0 HB3 GLN A 971 -15.156 -14.579 4.434 1.00 2.98 H new ATOM 0 HG2 GLN A 971 -17.291 -13.382 4.191 1.00 6.45 H new ATOM 0 HG3 GLN A 971 -18.189 -14.878 4.356 1.00 6.45 H new ATOM 0 HE21 GLN A 971 -18.649 -12.649 6.152 1.00 12.64 H new ATOM 0 HE22 GLN A 971 -18.120 -13.187 7.749 1.00 12.64 H new ATOM 1079 N ARG A 972 -17.006 -13.564 1.513 1.00 8.72 N ATOM 1080 CA ARG A 972 -17.008 -12.225 0.958 1.00 6.13 C ATOM 1081 C ARG A 972 -17.879 -11.390 1.883 1.00 11.97 C ATOM 1082 O ARG A 972 -18.998 -11.810 2.206 1.00 9.70 O ATOM 1083 CB ARG A 972 -17.541 -12.264 -0.477 1.00 4.08 C ATOM 1084 CG ARG A 972 -17.449 -10.918 -1.111 1.00 5.95 C ATOM 1085 CD ARG A 972 -17.729 -11.072 -2.599 1.00 15.19 C ATOM 1086 NE ARG A 972 -17.824 -9.768 -3.252 1.00 14.21 N ATOM 1087 CZ ARG A 972 -18.112 -9.611 -4.550 1.00 19.71 C ATOM 1088 NH1 ARG A 972 -18.395 -10.640 -5.335 1.00 19.34 N ATOM 1089 NH2 ARG A 972 -18.123 -8.400 -5.087 1.00 14.73 N ATOM 0 H ARG A 972 -17.928 -13.998 1.545 1.00 8.72 H new ATOM 0 HA ARG A 972 -16.010 -11.791 0.899 1.00 6.13 H new ATOM 0 HB2 ARG A 972 -16.972 -12.986 -1.062 1.00 4.08 H new ATOM 0 HB3 ARG A 972 -18.578 -12.601 -0.476 1.00 4.08 H new ATOM 0 HG2 ARG A 972 -18.167 -10.235 -0.658 1.00 5.95 H new ATOM 0 HG3 ARG A 972 -16.459 -10.490 -0.953 1.00 5.95 H new ATOM 0 HD2 ARG A 972 -16.936 -11.658 -3.063 1.00 15.19 H new ATOM 0 HD3 ARG A 972 -18.658 -11.623 -2.743 1.00 15.19 H new ATOM 0 HE ARG A 972 -17.662 -8.933 -2.689 1.00 14.21 H new ATOM 0 HH11 ARG A 972 -18.398 -11.586 -4.954 1.00 19.34 H new ATOM 0 HH12 ARG A 972 -18.610 -10.486 -6.320 1.00 19.34 H new ATOM 0 HH21 ARG A 972 -17.912 -7.585 -4.511 1.00 14.73 H new ATOM 0 HH22 ARG A 972 -18.343 -8.283 -6.076 1.00 14.73 H new ATOM 1102 N ALA A 973 -17.424 -10.223 2.330 1.00 7.24 N ATOM 1103 CA ALA A 973 -18.166 -9.405 3.274 1.00 11.91 C ATOM 1104 C ALA A 973 -18.080 -7.908 2.985 1.00 8.84 C ATOM 1105 O ALA A 973 -17.154 -7.414 2.353 1.00 8.80 O ATOM 1106 CB ALA A 973 -17.639 -9.677 4.679 1.00 10.80 C ATOM 0 H ALA A 973 -16.531 -9.821 2.046 1.00 7.24 H new ATOM 0 HA ALA A 973 -19.216 -9.680 3.179 1.00 11.91 H new ATOM 0 HB1 ALA A 973 -18.188 -9.069 5.398 1.00 10.80 H new ATOM 0 HB2 ALA A 973 -17.772 -10.732 4.920 1.00 10.80 H new ATOM 0 HB3 ALA A 973 -16.579 -9.425 4.725 1.00 10.80 H new ATOM 1112 N LYS A 974 -19.115 -7.179 3.378 1.00 7.18 N ATOM 1113 CA LYS A 974 -19.125 -5.737 3.357 1.00 6.47 C ATOM 1114 C LYS A 974 -18.666 -5.337 4.762 1.00 8.25 C ATOM 1115 O LYS A 974 -19.245 -5.755 5.771 1.00 10.41 O ATOM 1116 CB LYS A 974 -20.540 -5.272 3.109 1.00 7.24 C ATOM 1117 CG LYS A 974 -20.691 -3.790 3.174 1.00 10.08 C ATOM 1118 CD LYS A 974 -22.166 -3.633 3.338 1.00 20.02 C ATOM 1119 CE LYS A 974 -22.470 -2.271 3.878 1.00 40.73 C ATOM 1120 NZ LYS A 974 -22.969 -1.426 2.829 1.00 23.83 N ATOM 0 H LYS A 974 -19.983 -7.588 3.725 1.00 7.18 H new ATOM 0 HA LYS A 974 -18.490 -5.303 2.584 1.00 6.47 H new ATOM 0 HB2 LYS A 974 -20.864 -5.621 2.128 1.00 7.24 H new ATOM 0 HB3 LYS A 974 -21.201 -5.731 3.845 1.00 7.24 H new ATOM 0 HG2 LYS A 974 -20.140 -3.360 4.011 1.00 10.08 H new ATOM 0 HG3 LYS A 974 -20.327 -3.303 2.269 1.00 10.08 H new ATOM 0 HD2 LYS A 974 -22.666 -3.775 2.380 1.00 20.02 H new ATOM 0 HD3 LYS A 974 -22.550 -4.397 4.014 1.00 20.02 H new ATOM 0 HE2 LYS A 974 -23.206 -2.344 4.678 1.00 40.73 H new ATOM 0 HE3 LYS A 974 -21.571 -1.834 4.311 1.00 40.73 H new ATOM 0 HZ1 LYS A 974 -23.177 -0.482 3.213 1.00 23.83 H new ATOM 0 HZ2 LYS A 974 -22.253 -1.344 2.079 1.00 23.83 H new ATOM 0 HZ3 LYS A 974 -23.838 -1.839 2.434 1.00 23.83 H new ATOM 1133 N LEU A 975 -17.578 -4.572 4.821 1.00 7.63 N ATOM 1134 CA LEU A 975 -17.055 -4.019 6.067 1.00 6.00 C ATOM 1135 C LEU A 975 -17.399 -2.550 6.120 1.00 8.48 C ATOM 1136 O LEU A 975 -16.990 -1.831 5.216 1.00 11.64 O ATOM 1137 CB LEU A 975 -15.529 -4.181 6.160 1.00 7.28 C ATOM 1138 CG LEU A 975 -14.901 -5.468 6.653 1.00 10.30 C ATOM 1139 CD1 LEU A 975 -15.219 -6.647 5.775 1.00 26.74 C ATOM 1140 CD2 LEU A 975 -13.397 -5.287 6.624 1.00 11.53 C ATOM 0 H LEU A 975 -17.031 -4.317 3.999 1.00 7.63 H new ATOM 0 HA LEU A 975 -17.503 -4.558 6.902 1.00 6.00 H new ATOM 0 HB2 LEU A 975 -15.129 -3.994 5.164 1.00 7.28 H new ATOM 0 HB3 LEU A 975 -15.164 -3.382 6.805 1.00 7.28 H new ATOM 0 HG LEU A 975 -15.295 -5.667 7.650 1.00 10.30 H new ATOM 0 HD11 LEU A 975 -14.742 -7.540 6.178 1.00 26.74 H new ATOM 0 HD12 LEU A 975 -16.298 -6.795 5.742 1.00 26.74 H new ATOM 0 HD13 LEU A 975 -14.847 -6.461 4.767 1.00 26.74 H new ATOM 0 HD21 LEU A 975 -12.914 -6.199 6.974 1.00 11.53 H new ATOM 0 HD22 LEU A 975 -13.076 -5.075 5.604 1.00 11.53 H new ATOM 0 HD23 LEU A 975 -13.118 -4.457 7.272 1.00 11.53 H new ATOM 1152 N THR A 976 -18.148 -2.049 7.097 1.00 8.68 N ATOM 1153 CA THR A 976 -18.365 -0.611 7.248 1.00 12.38 C ATOM 1154 C THR A 976 -17.499 -0.139 8.411 1.00 12.11 C ATOM 1155 O THR A 976 -17.593 -0.679 9.518 1.00 11.11 O ATOM 1156 CB THR A 976 -19.822 -0.300 7.558 1.00 10.07 C ATOM 1157 OG1 THR A 976 -20.556 -0.934 6.518 1.00 11.55 O ATOM 1158 CG2 THR A 976 -20.072 1.212 7.597 1.00 13.86 C ATOM 0 H THR A 976 -18.618 -2.619 7.800 1.00 8.68 H new ATOM 0 HA THR A 976 -18.105 -0.105 6.318 1.00 12.38 H new ATOM 0 HB THR A 976 -20.123 -0.663 8.541 1.00 10.07 H new ATOM 0 HG1 THR A 976 -21.514 -0.778 6.652 1.00 11.55 H new ATOM 0 HG21 THR A 976 -21.122 1.402 7.821 1.00 13.86 H new ATOM 0 HG22 THR A 976 -19.449 1.664 8.369 1.00 13.86 H new ATOM 0 HG23 THR A 976 -19.823 1.647 6.629 1.00 13.86 H new ATOM 1166 N ILE A 977 -16.631 0.840 8.191 1.00 8.14 N ATOM 1167 CA ILE A 977 -15.593 1.176 9.134 1.00 7.06 C ATOM 1168 C ILE A 977 -15.755 2.655 9.485 1.00 9.06 C ATOM 1169 O ILE A 977 -15.715 3.566 8.645 1.00 11.09 O ATOM 1170 CB ILE A 977 -14.219 0.882 8.470 1.00 8.36 C ATOM 1171 CG1 ILE A 977 -14.064 -0.564 8.059 1.00 10.32 C ATOM 1172 CG2 ILE A 977 -13.096 1.276 9.406 1.00 7.99 C ATOM 1173 CD1 ILE A 977 -12.852 -0.839 7.155 1.00 10.56 C ATOM 0 H ILE A 977 -16.634 1.419 7.351 1.00 8.14 H new ATOM 0 HA ILE A 977 -15.656 0.589 10.050 1.00 7.06 H new ATOM 0 HB ILE A 977 -14.172 1.479 7.559 1.00 8.36 H new ATOM 0 HG12 ILE A 977 -13.980 -1.177 8.956 1.00 10.32 H new ATOM 0 HG13 ILE A 977 -14.969 -0.881 7.540 1.00 10.32 H new ATOM 0 HG21 ILE A 977 -12.137 1.066 8.932 1.00 7.99 H new ATOM 0 HG22 ILE A 977 -13.165 2.341 9.630 1.00 7.99 H new ATOM 0 HG23 ILE A 977 -13.176 0.705 10.331 1.00 7.99 H new ATOM 0 HD11 ILE A 977 -12.816 -1.900 6.908 1.00 10.56 H new ATOM 0 HD12 ILE A 977 -12.942 -0.256 6.239 1.00 10.56 H new ATOM 0 HD13 ILE A 977 -11.938 -0.557 7.677 1.00 10.56 H new ATOM 1185 N SER A 978 -15.865 2.905 10.783 1.00 8.81 N ATOM 1186 CA SER A 978 -16.031 4.269 11.255 1.00 7.83 C ATOM 1187 C SER A 978 -14.705 4.989 11.118 1.00 7.30 C ATOM 1188 O SER A 978 -13.689 4.302 11.180 1.00 11.14 O ATOM 1189 CB SER A 978 -16.508 4.258 12.715 1.00 8.20 C ATOM 1190 OG SER A 978 -15.654 3.513 13.594 1.00 15.98 O ATOM 0 H SER A 978 -15.843 2.194 11.514 1.00 8.81 H new ATOM 0 HA SER A 978 -16.783 4.790 10.662 1.00 7.83 H new ATOM 0 HB2 SER A 978 -16.577 5.285 13.073 1.00 8.20 H new ATOM 0 HB3 SER A 978 -17.513 3.838 12.757 1.00 8.20 H new ATOM 0 HG SER A 978 -16.066 2.646 13.794 1.00 15.98 H new ATOM 1196 N PRO A 979 -14.608 6.312 11.061 1.00 11.54 N ATOM 1197 CA PRO A 979 -13.371 7.053 10.839 1.00 7.44 C ATOM 1198 C PRO A 979 -12.314 6.736 11.863 1.00 8.77 C ATOM 1199 O PRO A 979 -11.147 6.700 11.507 1.00 14.50 O ATOM 1200 CB PRO A 979 -13.751 8.484 11.032 1.00 14.11 C ATOM 1201 CG PRO A 979 -15.185 8.517 10.646 1.00 16.36 C ATOM 1202 CD PRO A 979 -15.735 7.218 11.182 1.00 16.21 C ATOM 0 HA PRO A 979 -12.963 6.808 9.858 1.00 7.44 H new ATOM 0 HB2 PRO A 979 -13.606 8.802 12.064 1.00 14.11 H new ATOM 0 HB3 PRO A 979 -13.152 9.146 10.407 1.00 14.11 H new ATOM 0 HG2 PRO A 979 -15.696 9.377 11.080 1.00 16.36 H new ATOM 0 HG3 PRO A 979 -15.306 8.586 9.565 1.00 16.36 H new ATOM 0 HD2 PRO A 979 -16.065 7.316 12.216 1.00 16.21 H new ATOM 0 HD3 PRO A 979 -16.593 6.874 10.605 1.00 16.21 H new ATOM 1210 N ASP A 980 -12.675 6.514 13.122 1.00 10.39 N ATOM 1211 CA ASP A 980 -11.704 6.168 14.134 1.00 11.10 C ATOM 1212 C ASP A 980 -11.073 4.795 13.950 1.00 20.89 C ATOM 1213 O ASP A 980 -10.055 4.505 14.561 1.00 18.96 O ATOM 1214 CB ASP A 980 -12.274 6.320 15.539 1.00 10.92 C ATOM 1215 CG ASP A 980 -13.428 5.405 15.894 1.00 22.06 C ATOM 1216 OD1 ASP A 980 -14.400 5.391 15.154 1.00 22.96 O ATOM 1217 OD2 ASP A 980 -13.359 4.722 16.912 1.00 25.87 O ATOM 0 H ASP A 980 -13.636 6.569 13.459 1.00 10.39 H new ATOM 0 HA ASP A 980 -10.896 6.888 14.005 1.00 11.10 H new ATOM 0 HB2 ASP A 980 -11.470 6.151 16.255 1.00 10.92 H new ATOM 0 HB3 ASP A 980 -12.603 7.351 15.666 1.00 10.92 H new ATOM 1222 N TYR A 981 -11.651 3.932 13.116 1.00 15.31 N ATOM 1223 CA TYR A 981 -11.049 2.640 12.783 1.00 10.00 C ATOM 1224 C TYR A 981 -10.407 2.671 11.400 1.00 10.44 C ATOM 1225 O TYR A 981 -9.952 1.647 10.882 1.00 9.56 O ATOM 1226 CB TYR A 981 -12.109 1.555 12.849 1.00 12.34 C ATOM 1227 CG TYR A 981 -12.250 0.964 14.235 1.00 12.21 C ATOM 1228 CD1 TYR A 981 -12.461 1.801 15.303 1.00 19.81 C ATOM 1229 CD2 TYR A 981 -12.124 -0.401 14.421 1.00 9.98 C ATOM 1230 CE1 TYR A 981 -12.553 1.280 16.573 1.00 32.48 C ATOM 1231 CE2 TYR A 981 -12.240 -0.930 15.691 1.00 13.63 C ATOM 1232 CZ TYR A 981 -12.478 -0.083 16.752 1.00 40.19 C ATOM 1233 OH TYR A 981 -12.700 -0.597 18.013 1.00 35.14 O ATOM 0 H TYR A 981 -12.544 4.106 12.654 1.00 15.31 H new ATOM 0 HA TYR A 981 -10.264 2.425 13.508 1.00 10.00 H new ATOM 0 HB2 TYR A 981 -13.067 1.969 12.535 1.00 12.34 H new ATOM 0 HB3 TYR A 981 -11.857 0.763 12.144 1.00 12.34 H new ATOM 0 HD1 TYR A 981 -12.554 2.865 15.146 1.00 19.81 H new ATOM 0 HD2 TYR A 981 -11.936 -1.049 13.578 1.00 9.98 H new ATOM 0 HE1 TYR A 981 -12.683 1.935 17.422 1.00 32.48 H new ATOM 0 HE2 TYR A 981 -12.145 -1.994 15.851 1.00 13.63 H new ATOM 0 HH TYR A 981 -12.615 -1.573 17.988 1.00 35.14 H new ATOM 1243 N ALA A 982 -10.354 3.853 10.786 1.00 9.86 N ATOM 1244 CA ALA A 982 -9.889 4.051 9.433 1.00 6.99 C ATOM 1245 C ALA A 982 -8.892 5.224 9.507 1.00 13.78 C ATOM 1246 O ALA A 982 -7.901 5.118 10.218 1.00 14.63 O ATOM 1247 CB ALA A 982 -11.098 4.402 8.600 1.00 4.72 C ATOM 0 H ALA A 982 -10.645 4.719 11.239 1.00 9.86 H new ATOM 0 HA ALA A 982 -9.405 3.180 8.992 1.00 6.99 H new ATOM 0 HB1 ALA A 982 -10.793 4.561 7.566 1.00 4.72 H new ATOM 0 HB2 ALA A 982 -11.820 3.586 8.644 1.00 4.72 H new ATOM 0 HB3 ALA A 982 -11.555 5.312 8.988 1.00 4.72 H new ATOM 1253 N TYR A 983 -9.063 6.378 8.882 1.00 10.57 N ATOM 1254 CA TYR A 983 -8.071 7.442 8.858 1.00 7.88 C ATOM 1255 C TYR A 983 -8.400 8.638 9.724 1.00 9.94 C ATOM 1256 O TYR A 983 -7.677 9.641 9.692 1.00 11.53 O ATOM 1257 CB TYR A 983 -7.858 7.880 7.393 1.00 8.60 C ATOM 1258 CG TYR A 983 -7.327 6.767 6.485 1.00 11.16 C ATOM 1259 CD1 TYR A 983 -5.993 6.385 6.559 1.00 10.94 C ATOM 1260 CD2 TYR A 983 -8.201 6.093 5.652 1.00 6.14 C ATOM 1261 CE1 TYR A 983 -5.536 5.290 5.836 1.00 14.49 C ATOM 1262 CE2 TYR A 983 -7.750 5.002 4.918 1.00 13.98 C ATOM 1263 CZ TYR A 983 -6.420 4.616 5.020 1.00 14.00 C ATOM 1264 OH TYR A 983 -5.968 3.557 4.284 1.00 10.90 O ATOM 0 H TYR A 983 -9.913 6.606 8.366 1.00 10.57 H new ATOM 0 HA TYR A 983 -7.158 7.031 9.290 1.00 7.88 H new ATOM 0 HB2 TYR A 983 -8.804 8.243 6.991 1.00 8.60 H new ATOM 0 HB3 TYR A 983 -7.160 8.717 7.372 1.00 8.60 H new ATOM 0 HD1 TYR A 983 -5.308 6.942 7.181 1.00 10.94 H new ATOM 0 HD2 TYR A 983 -9.229 6.413 5.572 1.00 6.14 H new ATOM 0 HE1 TYR A 983 -4.507 4.972 5.912 1.00 14.49 H new ATOM 0 HE2 TYR A 983 -8.427 4.460 4.275 1.00 13.98 H new ATOM 0 HH TYR A 983 -6.707 3.184 3.760 1.00 10.90 H new ATOM 1274 N GLY A 984 -9.514 8.606 10.464 1.00 8.29 N ATOM 1275 CA GLY A 984 -9.752 9.561 11.534 1.00 13.72 C ATOM 1276 C GLY A 984 -9.894 11.000 11.097 1.00 9.49 C ATOM 1277 O GLY A 984 -10.366 11.299 10.008 1.00 10.37 O ATOM 0 H GLY A 984 -10.262 7.925 10.335 1.00 8.29 H new ATOM 0 HA2 GLY A 984 -10.658 9.269 12.064 1.00 13.72 H new ATOM 0 HA3 GLY A 984 -8.930 9.495 12.247 1.00 13.72 H new ATOM 1281 N ALA A 985 -9.445 11.918 11.941 1.00 11.50 N ATOM 1282 CA ALA A 985 -9.709 13.311 11.650 1.00 14.29 C ATOM 1283 C ALA A 985 -8.742 13.872 10.627 1.00 19.90 C ATOM 1284 O ALA A 985 -8.950 14.935 10.074 1.00 19.35 O ATOM 1285 CB ALA A 985 -9.628 14.105 12.931 1.00 13.93 C ATOM 0 H ALA A 985 -8.919 11.733 12.795 1.00 11.50 H new ATOM 0 HA ALA A 985 -10.708 13.387 11.222 1.00 14.29 H new ATOM 0 HB1 ALA A 985 -9.826 15.156 12.721 1.00 13.93 H new ATOM 0 HB2 ALA A 985 -10.368 13.731 13.638 1.00 13.93 H new ATOM 0 HB3 ALA A 985 -8.631 14.002 13.360 1.00 13.93 H new ATOM 1291 N THR A 986 -7.690 13.157 10.296 1.00 11.93 N ATOM 1292 CA THR A 986 -6.700 13.646 9.355 1.00 26.11 C ATOM 1293 C THR A 986 -6.983 13.182 7.938 1.00 19.04 C ATOM 1294 O THR A 986 -6.646 13.886 6.984 1.00 18.38 O ATOM 1295 CB THR A 986 -5.259 13.303 9.853 1.00 18.88 C ATOM 1296 OG1 THR A 986 -4.486 12.751 8.806 1.00 46.16 O ATOM 1297 CG2 THR A 986 -5.191 12.417 11.095 1.00 35.65 C ATOM 0 H THR A 986 -7.495 12.227 10.667 1.00 11.93 H new ATOM 0 HA THR A 986 -6.767 14.733 9.313 1.00 26.11 H new ATOM 0 HB THR A 986 -4.838 14.259 10.166 1.00 18.88 H new ATOM 0 HG1 THR A 986 -3.587 12.544 9.137 1.00 46.16 H new ATOM 0 HG21 THR A 986 -4.148 12.238 11.358 1.00 35.65 H new ATOM 0 HG22 THR A 986 -5.694 12.914 11.924 1.00 35.65 H new ATOM 0 HG23 THR A 986 -5.682 11.465 10.890 1.00 35.65 H new ATOM 1305 N GLY A 987 -7.542 11.975 7.800 1.00 14.37 N ATOM 1306 CA GLY A 987 -7.800 11.409 6.496 1.00 8.67 C ATOM 1307 C GLY A 987 -6.484 10.867 5.926 1.00 8.93 C ATOM 1308 O GLY A 987 -5.463 10.713 6.609 1.00 15.03 O ATOM 0 H GLY A 987 -7.820 11.381 8.582 1.00 14.37 H new ATOM 0 HA2 GLY A 987 -8.537 10.610 6.570 1.00 8.67 H new ATOM 0 HA3 GLY A 987 -8.216 12.166 5.831 1.00 8.67 H new ATOM 1312 N HIS A 988 -6.524 10.513 4.649 1.00 11.92 N ATOM 1313 CA HIS A 988 -5.364 10.012 3.963 1.00 13.18 C ATOM 1314 C HIS A 988 -5.149 11.006 2.842 1.00 8.36 C ATOM 1315 O HIS A 988 -5.954 11.060 1.902 1.00 12.76 O ATOM 1316 CB HIS A 988 -5.644 8.628 3.397 1.00 12.71 C ATOM 1317 CG HIS A 988 -4.393 8.058 2.730 1.00 10.84 C ATOM 1318 ND1 HIS A 988 -4.243 7.943 1.374 1.00 16.17 N flip ATOM 1319 CD2 HIS A 988 -3.267 7.647 3.312 1.00 11.90 C flip ATOM 1320 CE1 HIS A 988 -3.044 7.479 1.202 1.00 10.11 C flip ATOM 1321 NE2 HIS A 988 -2.432 7.304 2.351 1.00 16.02 N flip ATOM 0 H HIS A 988 -7.362 10.568 4.071 1.00 11.92 H new ATOM 0 HA HIS A 988 -4.495 9.914 4.614 1.00 13.18 H new ATOM 0 HB2 HIS A 988 -5.973 7.962 4.195 1.00 12.71 H new ATOM 0 HB3 HIS A 988 -6.456 8.683 2.672 1.00 12.71 H new ATOM 0 HD2 HIS A 988 -3.074 7.603 4.374 1.00 11.90 H new ATOM 0 HE1 HIS A 988 -2.606 7.264 0.239 1.00 10.11 H new ATOM 0 HE2 HIS A 988 -1.479 6.963 2.477 1.00 16.02 H new ATOM 1329 N PRO A 989 -4.087 11.809 2.909 1.00 20.43 N ATOM 1330 CA PRO A 989 -3.851 12.951 2.027 1.00 40.00 C ATOM 1331 C PRO A 989 -4.037 12.666 0.551 1.00 16.70 C ATOM 1332 O PRO A 989 -3.554 11.663 0.025 1.00 31.15 O ATOM 1333 CB PRO A 989 -2.423 13.322 2.339 1.00 47.23 C ATOM 1334 CG PRO A 989 -1.807 12.071 2.924 1.00 43.23 C ATOM 1335 CD PRO A 989 -2.951 11.612 3.803 1.00 45.60 C ATOM 0 HA PRO A 989 -4.577 13.744 2.207 1.00 40.00 H new ATOM 0 HB2 PRO A 989 -1.893 13.639 1.441 1.00 47.23 H new ATOM 0 HB3 PRO A 989 -2.377 14.151 3.045 1.00 47.23 H new ATOM 0 HG2 PRO A 989 -1.545 11.338 2.161 1.00 43.23 H new ATOM 0 HG3 PRO A 989 -0.900 12.278 3.492 1.00 43.23 H new ATOM 0 HD2 PRO A 989 -2.843 10.572 4.110 1.00 45.60 H new ATOM 0 HD3 PRO A 989 -3.035 12.206 4.713 1.00 45.60 H new ATOM 1343 N GLY A 990 -4.860 13.498 -0.060 1.00 17.71 N ATOM 1344 CA GLY A 990 -5.135 13.387 -1.466 1.00 14.18 C ATOM 1345 C GLY A 990 -6.280 12.457 -1.763 1.00 19.36 C ATOM 1346 O GLY A 990 -6.866 12.563 -2.829 1.00 25.36 O ATOM 0 H GLY A 990 -5.349 14.261 0.407 1.00 17.71 H new ATOM 0 HA2 GLY A 990 -5.362 14.375 -1.867 1.00 14.18 H new ATOM 0 HA3 GLY A 990 -4.242 13.032 -1.980 1.00 14.18 H new ATOM 1350 N ILE A 991 -6.661 11.537 -0.873 1.00 19.64 N ATOM 1351 CA ILE A 991 -7.574 10.463 -1.243 1.00 16.74 C ATOM 1352 C ILE A 991 -8.765 10.462 -0.277 1.00 14.30 C ATOM 1353 O ILE A 991 -9.912 10.576 -0.698 1.00 16.09 O ATOM 1354 CB ILE A 991 -6.828 9.089 -1.250 1.00 18.90 C ATOM 1355 CG1 ILE A 991 -5.547 9.116 -2.105 1.00 20.70 C ATOM 1356 CG2 ILE A 991 -7.776 8.000 -1.735 1.00 14.95 C ATOM 1357 CD1 ILE A 991 -4.631 7.869 -2.069 1.00 13.02 C ATOM 0 H ILE A 991 -6.353 11.517 0.099 1.00 19.64 H new ATOM 0 HA ILE A 991 -7.950 10.627 -2.253 1.00 16.74 H new ATOM 0 HB ILE A 991 -6.513 8.876 -0.228 1.00 18.90 H new ATOM 0 HG12 ILE A 991 -5.839 9.288 -3.141 1.00 20.70 H new ATOM 0 HG13 ILE A 991 -4.954 9.976 -1.794 1.00 20.70 H new ATOM 0 HG21 ILE A 991 -7.257 7.042 -1.740 1.00 14.95 H new ATOM 0 HG22 ILE A 991 -8.636 7.943 -1.068 1.00 14.95 H new ATOM 0 HG23 ILE A 991 -8.114 8.235 -2.744 1.00 14.95 H new ATOM 0 HD11 ILE A 991 -3.770 8.031 -2.717 1.00 13.02 H new ATOM 0 HD12 ILE A 991 -4.289 7.698 -1.048 1.00 13.02 H new ATOM 0 HD13 ILE A 991 -5.188 6.999 -2.416 1.00 13.02 H new ATOM 1369 N ILE A 992 -8.561 10.348 1.041 1.00 20.63 N ATOM 1370 CA ILE A 992 -9.675 10.147 1.974 1.00 9.02 C ATOM 1371 C ILE A 992 -9.749 11.425 2.800 1.00 10.99 C ATOM 1372 O ILE A 992 -8.730 11.794 3.390 1.00 8.91 O ATOM 1373 CB ILE A 992 -9.421 8.915 2.888 1.00 13.49 C ATOM 1374 CG1 ILE A 992 -9.161 7.604 2.144 1.00 15.53 C ATOM 1375 CG2 ILE A 992 -10.516 8.731 3.907 1.00 11.43 C ATOM 1376 CD1 ILE A 992 -10.234 7.122 1.202 1.00 11.48 C ATOM 0 H ILE A 992 -7.642 10.391 1.482 1.00 20.63 H new ATOM 0 HA ILE A 992 -10.609 9.951 1.447 1.00 9.02 H new ATOM 0 HB ILE A 992 -8.491 9.156 3.402 1.00 13.49 H new ATOM 0 HG12 ILE A 992 -8.238 7.716 1.576 1.00 15.53 H new ATOM 0 HG13 ILE A 992 -8.987 6.824 2.885 1.00 15.53 H new ATOM 0 HG21 ILE A 992 -10.297 7.859 4.523 1.00 11.43 H new ATOM 0 HG22 ILE A 992 -10.577 9.616 4.540 1.00 11.43 H new ATOM 0 HG23 ILE A 992 -11.468 8.584 3.396 1.00 11.43 H new ATOM 0 HD11 ILE A 992 -9.921 6.184 0.743 1.00 11.48 H new ATOM 0 HD12 ILE A 992 -11.160 6.963 1.755 1.00 11.48 H new ATOM 0 HD13 ILE A 992 -10.399 7.869 0.426 1.00 11.48 H new ATOM 1388 N PRO A 993 -10.898 12.119 2.861 1.00 14.31 N ATOM 1389 CA PRO A 993 -11.102 13.326 3.675 1.00 8.63 C ATOM 1390 C PRO A 993 -11.125 13.016 5.186 1.00 11.44 C ATOM 1391 O PRO A 993 -11.340 11.853 5.578 1.00 9.68 O ATOM 1392 CB PRO A 993 -12.519 13.789 3.240 1.00 13.25 C ATOM 1393 CG PRO A 993 -12.973 12.926 2.095 1.00 14.48 C ATOM 1394 CD PRO A 993 -12.172 11.663 2.282 1.00 23.63 C ATOM 0 HA PRO A 993 -10.306 14.056 3.528 1.00 8.63 H new ATOM 0 HB2 PRO A 993 -13.216 13.709 4.074 1.00 13.25 H new ATOM 0 HB3 PRO A 993 -12.500 14.837 2.940 1.00 13.25 H new ATOM 0 HG2 PRO A 993 -14.045 12.733 2.136 1.00 14.48 H new ATOM 0 HG3 PRO A 993 -12.769 13.394 1.132 1.00 14.48 H new ATOM 0 HD2 PRO A 993 -12.682 10.964 2.945 1.00 23.63 H new ATOM 0 HD3 PRO A 993 -12.016 11.148 1.334 1.00 23.63 H new ATOM 1402 N PRO A 994 -10.956 14.018 6.079 1.00 17.49 N ATOM 1403 CA PRO A 994 -11.198 13.881 7.506 1.00 10.43 C ATOM 1404 C PRO A 994 -12.598 13.334 7.753 1.00 8.59 C ATOM 1405 O PRO A 994 -13.574 13.637 7.056 1.00 9.95 O ATOM 1406 CB PRO A 994 -11.106 15.319 7.995 1.00 9.89 C ATOM 1407 CG PRO A 994 -10.058 15.933 7.117 1.00 12.29 C ATOM 1408 CD PRO A 994 -10.524 15.386 5.772 1.00 16.81 C ATOM 0 HA PRO A 994 -10.506 13.201 8.004 1.00 10.43 H new ATOM 0 HB2 PRO A 994 -12.061 15.836 7.898 1.00 9.89 H new ATOM 0 HB3 PRO A 994 -10.823 15.366 9.047 1.00 9.89 H new ATOM 0 HG2 PRO A 994 -10.064 17.022 7.153 1.00 12.29 H new ATOM 0 HG3 PRO A 994 -9.050 15.611 7.376 1.00 12.29 H new ATOM 0 HD2 PRO A 994 -11.340 15.980 5.360 1.00 16.81 H new ATOM 0 HD3 PRO A 994 -9.720 15.396 5.036 1.00 16.81 H new ATOM 1416 N HIS A 995 -12.647 12.482 8.781 1.00 7.49 N ATOM 1417 CA HIS A 995 -13.902 11.967 9.304 1.00 11.47 C ATOM 1418 C HIS A 995 -14.690 11.191 8.249 1.00 10.68 C ATOM 1419 O HIS A 995 -15.918 11.249 8.266 1.00 12.00 O ATOM 1420 CB HIS A 995 -14.740 13.135 9.878 1.00 13.33 C ATOM 1421 CG HIS A 995 -15.874 12.671 10.761 1.00 12.75 C ATOM 1422 ND1 HIS A 995 -17.180 12.689 10.511 1.00 23.48 N ATOM 1423 CD2 HIS A 995 -15.684 12.138 12.013 1.00 20.24 C ATOM 1424 CE1 HIS A 995 -17.801 12.208 11.565 1.00 16.30 C ATOM 1425 NE2 HIS A 995 -16.887 11.883 12.458 1.00 28.26 N ATOM 0 H HIS A 995 -11.820 12.136 9.267 1.00 7.49 H new ATOM 0 HA HIS A 995 -13.674 11.261 10.102 1.00 11.47 H new ATOM 0 HB2 HIS A 995 -14.088 13.795 10.450 1.00 13.33 H new ATOM 0 HB3 HIS A 995 -15.145 13.723 9.054 1.00 13.33 H new ATOM 0 HD2 HIS A 995 -14.746 11.967 12.519 1.00 20.24 H new ATOM 0 HE1 HIS A 995 -18.869 12.099 11.679 1.00 16.30 H new ATOM 0 HE2 HIS A 995 -17.091 11.485 13.375 1.00 28.26 H new ATOM 1433 N ALA A 996 -14.049 10.423 7.362 1.00 5.88 N ATOM 1434 CA ALA A 996 -14.802 9.622 6.423 1.00 6.75 C ATOM 1435 C ALA A 996 -15.076 8.206 6.942 1.00 16.10 C ATOM 1436 O ALA A 996 -14.197 7.545 7.521 1.00 13.72 O ATOM 1437 CB ALA A 996 -14.066 9.495 5.092 1.00 7.08 C ATOM 0 H ALA A 996 -13.035 10.347 7.283 1.00 5.88 H new ATOM 0 HA ALA A 996 -15.750 10.143 6.290 1.00 6.75 H new ATOM 0 HB1 ALA A 996 -14.656 8.887 4.406 1.00 7.08 H new ATOM 0 HB2 ALA A 996 -13.917 10.486 4.663 1.00 7.08 H new ATOM 0 HB3 ALA A 996 -13.098 9.021 5.255 1.00 7.08 H new ATOM 1443 N THR A 997 -16.338 7.766 6.797 1.00 11.69 N ATOM 1444 CA THR A 997 -16.736 6.375 6.980 1.00 10.07 C ATOM 1445 C THR A 997 -16.420 5.614 5.669 1.00 7.93 C ATOM 1446 O THR A 997 -16.730 6.105 4.574 1.00 13.22 O ATOM 1447 CB THR A 997 -18.259 6.278 7.380 1.00 15.74 C ATOM 1448 OG1 THR A 997 -18.424 6.965 8.624 1.00 14.12 O ATOM 1449 CG2 THR A 997 -18.768 4.835 7.525 1.00 11.48 C ATOM 0 H THR A 997 -17.113 8.380 6.546 1.00 11.69 H new ATOM 0 HA THR A 997 -16.180 5.918 7.799 1.00 10.07 H new ATOM 0 HB THR A 997 -18.845 6.727 6.578 1.00 15.74 H new ATOM 0 HG1 THR A 997 -19.364 6.923 8.899 1.00 14.12 H new ATOM 0 HG21 THR A 997 -19.822 4.847 7.801 1.00 11.48 H new ATOM 0 HG22 THR A 997 -18.647 4.310 6.578 1.00 11.48 H new ATOM 0 HG23 THR A 997 -18.196 4.323 8.299 1.00 11.48 H new ATOM 1457 N LEU A 998 -15.786 4.436 5.762 1.00 11.13 N ATOM 1458 CA LEU A 998 -15.333 3.696 4.592 1.00 12.13 C ATOM 1459 C LEU A 998 -16.135 2.415 4.519 1.00 8.98 C ATOM 1460 O LEU A 998 -16.419 1.779 5.533 1.00 7.48 O ATOM 1461 CB LEU A 998 -13.816 3.333 4.646 1.00 5.98 C ATOM 1462 CG LEU A 998 -12.818 4.461 4.881 1.00 14.61 C ATOM 1463 CD1 LEU A 998 -11.376 3.954 4.818 1.00 10.49 C ATOM 1464 CD2 LEU A 998 -13.064 5.601 3.904 1.00 10.50 C ATOM 0 H LEU A 998 -15.577 3.978 6.649 1.00 11.13 H new ATOM 0 HA LEU A 998 -15.478 4.329 3.717 1.00 12.13 H new ATOM 0 HB2 LEU A 998 -13.677 2.595 5.436 1.00 5.98 H new ATOM 0 HB3 LEU A 998 -13.555 2.847 3.706 1.00 5.98 H new ATOM 0 HG LEU A 998 -12.970 4.848 5.888 1.00 14.61 H new ATOM 0 HD11 LEU A 998 -10.691 4.784 4.990 1.00 10.49 H new ATOM 0 HD12 LEU A 998 -11.224 3.193 5.584 1.00 10.49 H new ATOM 0 HD13 LEU A 998 -11.185 3.523 3.835 1.00 10.49 H new ATOM 0 HD21 LEU A 998 -12.343 6.398 4.086 1.00 10.50 H new ATOM 0 HD22 LEU A 998 -12.952 5.236 2.883 1.00 10.50 H new ATOM 0 HD23 LEU A 998 -14.074 5.987 4.042 1.00 10.50 H new ATOM 1476 N VAL A 999 -16.514 2.044 3.309 1.00 9.66 N ATOM 1477 CA VAL A 999 -17.080 0.730 3.108 1.00 9.32 C ATOM 1478 C VAL A 999 -16.204 -0.046 2.126 1.00 8.48 C ATOM 1479 O VAL A 999 -15.777 0.459 1.093 1.00 8.62 O ATOM 1480 CB VAL A 999 -18.614 0.724 2.782 1.00 9.81 C ATOM 1481 CG1 VAL A 999 -19.361 1.799 3.560 1.00 2.00 C ATOM 1482 CG2 VAL A 999 -18.998 0.747 1.341 1.00 14.46 C ATOM 0 H VAL A 999 -16.441 2.621 2.471 1.00 9.66 H new ATOM 0 HA VAL A 999 -17.063 0.198 4.059 1.00 9.32 H new ATOM 0 HB VAL A 999 -18.928 -0.264 3.119 1.00 9.81 H new ATOM 0 HG11 VAL A 999 -20.420 1.762 3.306 1.00 2.00 H new ATOM 0 HG12 VAL A 999 -19.238 1.626 4.629 1.00 2.00 H new ATOM 0 HG13 VAL A 999 -18.960 2.779 3.302 1.00 2.00 H new ATOM 0 HG21 VAL A 999 -20.084 0.740 1.254 1.00 14.46 H new ATOM 0 HG22 VAL A 999 -18.602 1.648 0.873 1.00 14.46 H new ATOM 0 HG23 VAL A 999 -18.588 -0.131 0.841 1.00 14.46 H new ATOM 1492 N PHE A1000 -15.825 -1.251 2.545 1.00 12.47 N ATOM 1493 CA PHE A1000 -15.040 -2.154 1.719 1.00 11.83 C ATOM 1494 C PHE A1000 -15.809 -3.435 1.430 1.00 11.96 C ATOM 1495 O PHE A1000 -16.466 -4.000 2.307 1.00 14.60 O ATOM 1496 CB PHE A1000 -13.696 -2.529 2.366 1.00 9.84 C ATOM 1497 CG PHE A1000 -12.661 -1.412 2.368 1.00 12.64 C ATOM 1498 CD1 PHE A1000 -12.647 -0.483 3.408 1.00 11.18 C ATOM 1499 CD2 PHE A1000 -11.675 -1.372 1.372 1.00 9.23 C ATOM 1500 CE1 PHE A1000 -11.626 0.453 3.477 1.00 9.63 C ATOM 1501 CE2 PHE A1000 -10.680 -0.422 1.454 1.00 8.47 C ATOM 1502 CZ PHE A1000 -10.648 0.485 2.500 1.00 10.83 C ATOM 0 H PHE A1000 -16.055 -1.625 3.466 1.00 12.47 H new ATOM 0 HA PHE A1000 -14.841 -1.615 0.793 1.00 11.83 H new ATOM 0 HB2 PHE A1000 -13.877 -2.841 3.395 1.00 9.84 H new ATOM 0 HB3 PHE A1000 -13.282 -3.389 1.840 1.00 9.84 H new ATOM 0 HD1 PHE A1000 -13.427 -0.492 4.155 1.00 11.18 H new ATOM 0 HD2 PHE A1000 -11.695 -2.075 0.553 1.00 9.23 H new ATOM 0 HE1 PHE A1000 -11.595 1.158 4.295 1.00 9.63 H new ATOM 0 HE2 PHE A1000 -9.915 -0.384 0.692 1.00 8.47 H new ATOM 0 HZ PHE A1000 -9.857 1.219 2.553 1.00 10.83 H new ATOM 1512 N ASP A1001 -15.691 -3.912 0.204 1.00 6.70 N ATOM 1513 CA ASP A1001 -16.110 -5.263 -0.155 1.00 7.98 C ATOM 1514 C ASP A1001 -14.834 -6.110 -0.134 1.00 7.35 C ATOM 1515 O ASP A1001 -13.922 -5.820 -0.898 1.00 12.17 O ATOM 1516 CB ASP A1001 -16.761 -5.136 -1.536 1.00 10.14 C ATOM 1517 CG ASP A1001 -17.113 -6.374 -2.317 1.00 9.95 C ATOM 1518 OD1 ASP A1001 -16.808 -7.486 -1.904 1.00 11.11 O ATOM 1519 OD2 ASP A1001 -17.668 -6.197 -3.387 1.00 15.34 O ATOM 0 H ASP A1001 -15.303 -3.378 -0.573 1.00 6.70 H new ATOM 0 HA ASP A1001 -16.832 -5.736 0.511 1.00 7.98 H new ATOM 0 HB2 ASP A1001 -17.678 -4.560 -1.411 1.00 10.14 H new ATOM 0 HB3 ASP A1001 -16.092 -4.540 -2.157 1.00 10.14 H new ATOM 1524 N VAL A1002 -14.706 -7.115 0.730 1.00 5.55 N ATOM 1525 CA VAL A1002 -13.491 -7.862 0.918 1.00 7.61 C ATOM 1526 C VAL A1002 -13.827 -9.331 0.768 1.00 8.52 C ATOM 1527 O VAL A1002 -14.777 -9.844 1.364 1.00 9.25 O ATOM 1528 CB VAL A1002 -12.870 -7.624 2.316 1.00 7.15 C ATOM 1529 CG1 VAL A1002 -11.577 -8.414 2.452 1.00 15.13 C ATOM 1530 CG2 VAL A1002 -12.560 -6.165 2.544 1.00 7.68 C ATOM 0 H VAL A1002 -15.470 -7.430 1.327 1.00 5.55 H new ATOM 0 HA VAL A1002 -12.760 -7.536 0.178 1.00 7.61 H new ATOM 0 HB VAL A1002 -13.600 -7.952 3.056 1.00 7.15 H new ATOM 0 HG11 VAL A1002 -11.147 -8.241 3.438 1.00 15.13 H new ATOM 0 HG12 VAL A1002 -11.785 -9.477 2.328 1.00 15.13 H new ATOM 0 HG13 VAL A1002 -10.871 -8.091 1.687 1.00 15.13 H new ATOM 0 HG21 VAL A1002 -12.126 -6.036 3.535 1.00 7.68 H new ATOM 0 HG22 VAL A1002 -11.852 -5.821 1.790 1.00 7.68 H new ATOM 0 HG23 VAL A1002 -13.478 -5.582 2.472 1.00 7.68 H new ATOM 1540 N GLU A1003 -13.034 -10.014 -0.045 1.00 7.96 N ATOM 1541 CA GLU A1003 -13.189 -11.442 -0.236 1.00 9.92 C ATOM 1542 C GLU A1003 -11.913 -12.127 0.238 1.00 13.06 C ATOM 1543 O GLU A1003 -10.826 -11.859 -0.299 1.00 12.50 O ATOM 1544 CB GLU A1003 -13.483 -11.734 -1.685 1.00 5.36 C ATOM 1545 CG GLU A1003 -13.756 -13.229 -1.813 1.00 13.32 C ATOM 1546 CD GLU A1003 -14.022 -13.803 -3.217 1.00 26.98 C ATOM 1547 OE1 GLU A1003 -13.884 -13.090 -4.207 1.00 18.82 O ATOM 1548 OE2 GLU A1003 -14.357 -14.988 -3.312 1.00 35.49 O ATOM 0 H GLU A1003 -12.275 -9.597 -0.583 1.00 7.96 H new ATOM 0 HA GLU A1003 -14.028 -11.825 0.345 1.00 9.92 H new ATOM 0 HB2 GLU A1003 -14.344 -11.158 -2.024 1.00 5.36 H new ATOM 0 HB3 GLU A1003 -12.640 -11.445 -2.312 1.00 5.36 H new ATOM 0 HG2 GLU A1003 -12.902 -13.760 -1.392 1.00 13.32 H new ATOM 0 HG3 GLU A1003 -14.618 -13.465 -1.188 1.00 13.32 H new ATOM 1555 N LEU A1004 -11.984 -12.992 1.253 1.00 10.24 N ATOM 1556 CA LEU A1004 -10.789 -13.658 1.764 1.00 17.35 C ATOM 1557 C LEU A1004 -10.545 -14.917 0.927 1.00 16.77 C ATOM 1558 O LEU A1004 -11.193 -15.964 1.075 1.00 10.58 O ATOM 1559 CB LEU A1004 -10.892 -14.008 3.264 1.00 6.83 C ATOM 1560 CG LEU A1004 -9.725 -14.712 3.933 1.00 6.78 C ATOM 1561 CD1 LEU A1004 -8.397 -13.966 3.741 1.00 9.81 C ATOM 1562 CD2 LEU A1004 -10.082 -14.921 5.392 1.00 7.93 C ATOM 0 H LEU A1004 -12.849 -13.244 1.732 1.00 10.24 H new ATOM 0 HA LEU A1004 -9.948 -12.971 1.677 1.00 17.35 H new ATOM 0 HB2 LEU A1004 -11.073 -13.081 3.807 1.00 6.83 H new ATOM 0 HB3 LEU A1004 -11.775 -14.633 3.397 1.00 6.83 H new ATOM 0 HG LEU A1004 -9.559 -15.680 3.460 1.00 6.78 H new ATOM 0 HD11 LEU A1004 -7.597 -14.513 4.239 1.00 9.81 H new ATOM 0 HD12 LEU A1004 -8.174 -13.887 2.677 1.00 9.81 H new ATOM 0 HD13 LEU A1004 -8.475 -12.967 4.170 1.00 9.81 H new ATOM 0 HD21 LEU A1004 -9.260 -15.426 5.899 1.00 7.93 H new ATOM 0 HD22 LEU A1004 -10.261 -13.955 5.865 1.00 7.93 H new ATOM 0 HD23 LEU A1004 -10.982 -15.532 5.462 1.00 7.93 H new ATOM 1574 N LEU A1005 -9.571 -14.776 0.035 1.00 12.27 N ATOM 1575 CA LEU A1005 -9.241 -15.831 -0.913 1.00 19.13 C ATOM 1576 C LEU A1005 -8.486 -17.030 -0.312 1.00 26.84 C ATOM 1577 O LEU A1005 -8.815 -18.194 -0.575 1.00 20.98 O ATOM 1578 CB LEU A1005 -8.430 -15.226 -2.065 1.00 11.01 C ATOM 1579 CG LEU A1005 -8.987 -14.088 -2.892 1.00 13.52 C ATOM 1580 CD1 LEU A1005 -7.893 -13.513 -3.790 1.00 15.82 C ATOM 1581 CD2 LEU A1005 -10.203 -14.564 -3.651 1.00 17.08 C ATOM 0 H LEU A1005 -8.995 -13.938 -0.051 1.00 12.27 H new ATOM 0 HA LEU A1005 -10.191 -16.238 -1.260 1.00 19.13 H new ATOM 0 HB2 LEU A1005 -7.484 -14.883 -1.645 1.00 11.01 H new ATOM 0 HB3 LEU A1005 -8.197 -16.038 -2.754 1.00 11.01 H new ATOM 0 HG LEU A1005 -9.317 -13.272 -2.250 1.00 13.52 H new ATOM 0 HD11 LEU A1005 -8.301 -12.694 -4.382 1.00 15.82 H new ATOM 0 HD12 LEU A1005 -7.074 -13.142 -3.174 1.00 15.82 H new ATOM 0 HD13 LEU A1005 -7.522 -14.292 -4.456 1.00 15.82 H new ATOM 0 HD21 LEU A1005 -10.604 -13.744 -4.247 1.00 17.08 H new ATOM 0 HD22 LEU A1005 -9.922 -15.387 -4.309 1.00 17.08 H new ATOM 0 HD23 LEU A1005 -10.961 -14.905 -2.946 1.00 17.08 H new ATOM 1593 N LYS A1006 -7.455 -16.778 0.504 1.00 17.27 N ATOM 1594 CA LYS A1006 -6.455 -17.783 0.843 1.00 22.31 C ATOM 1595 C LYS A1006 -5.632 -17.222 1.990 1.00 15.60 C ATOM 1596 O LYS A1006 -5.517 -16.002 2.170 1.00 15.20 O ATOM 1597 CB LYS A1006 -5.574 -17.924 -0.419 1.00 19.05 C ATOM 1598 CG LYS A1006 -4.299 -18.707 -0.420 1.00 31.96 C ATOM 1599 CD LYS A1006 -3.748 -18.626 -1.835 1.00 34.16 C ATOM 1600 CE LYS A1006 -2.550 -19.575 -1.939 1.00 71.57 C ATOM 1601 NZ LYS A1006 -2.043 -19.684 -3.298 1.00 74.94 N ATOM 0 H LYS A1006 -7.296 -15.872 0.944 1.00 17.27 H new ATOM 0 HA LYS A1006 -6.878 -18.744 1.135 1.00 22.31 H new ATOM 0 HB2 LYS A1006 -6.206 -18.355 -1.196 1.00 19.05 H new ATOM 0 HB3 LYS A1006 -5.321 -16.913 -0.738 1.00 19.05 H new ATOM 0 HG2 LYS A1006 -3.589 -18.295 0.297 1.00 31.96 H new ATOM 0 HG3 LYS A1006 -4.479 -19.743 -0.132 1.00 31.96 H new ATOM 0 HD2 LYS A1006 -4.516 -18.903 -2.558 1.00 34.16 H new ATOM 0 HD3 LYS A1006 -3.445 -17.605 -2.067 1.00 34.16 H new ATOM 0 HE2 LYS A1006 -1.753 -19.222 -1.284 1.00 71.57 H new ATOM 0 HE3 LYS A1006 -2.841 -20.563 -1.583 1.00 71.57 H new ATOM 0 HZ1 LYS A1006 -1.234 -20.337 -3.315 1.00 74.94 H new ATOM 0 HZ2 LYS A1006 -2.793 -20.046 -3.920 1.00 74.94 H new ATOM 0 HZ3 LYS A1006 -1.739 -18.747 -3.631 1.00 74.94 H new ATOM 1614 N LEU A1007 -5.066 -18.124 2.776 1.00 14.99 N ATOM 1615 CA LEU A1007 -4.122 -17.776 3.807 1.00 11.65 C ATOM 1616 C LEU A1007 -2.782 -18.398 3.416 1.00 14.03 C ATOM 1617 O LEU A1007 -2.759 -19.499 2.871 1.00 28.26 O ATOM 1618 CB LEU A1007 -4.619 -18.342 5.132 1.00 18.89 C ATOM 1619 CG LEU A1007 -5.897 -17.776 5.728 1.00 13.45 C ATOM 1620 CD1 LEU A1007 -6.230 -18.540 6.989 1.00 18.28 C ATOM 1621 CD2 LEU A1007 -5.712 -16.277 6.058 1.00 27.57 C ATOM 0 H LEU A1007 -5.255 -19.124 2.710 1.00 14.99 H new ATOM 0 HA LEU A1007 -4.011 -16.697 3.915 1.00 11.65 H new ATOM 0 HB2 LEU A1007 -4.761 -19.415 5.002 1.00 18.89 H new ATOM 0 HB3 LEU A1007 -3.825 -18.212 5.867 1.00 18.89 H new ATOM 0 HG LEU A1007 -6.710 -17.877 5.009 1.00 13.45 H new ATOM 0 HD11 LEU A1007 -7.146 -18.141 7.425 1.00 18.28 H new ATOM 0 HD12 LEU A1007 -6.371 -19.594 6.749 1.00 18.28 H new ATOM 0 HD13 LEU A1007 -5.413 -18.436 7.704 1.00 18.28 H new ATOM 0 HD21 LEU A1007 -6.634 -15.882 6.484 1.00 27.57 H new ATOM 0 HD22 LEU A1007 -4.901 -16.160 6.776 1.00 27.57 H new ATOM 0 HD23 LEU A1007 -5.471 -15.731 5.146 1.00 27.57 H new ATOM 1633 N GLU A1008 -1.684 -17.686 3.631 1.00 20.68 N ATOM 1634 CA GLU A1008 -0.337 -18.206 3.481 1.00 17.07 C ATOM 1635 C GLU A1008 0.446 -17.896 4.772 1.00 21.33 C ATOM 1636 O GLU A1008 -0.099 -17.295 5.704 1.00 47.95 O ATOM 1637 CB GLU A1008 0.334 -17.527 2.320 1.00 24.97 C ATOM 1638 CG GLU A1008 -0.475 -17.656 1.056 1.00 20.19 C ATOM 1639 CD GLU A1008 0.036 -16.865 -0.127 1.00 30.01 C ATOM 1640 OE1 GLU A1008 0.903 -15.995 0.009 1.00 31.02 O ATOM 1641 OE2 GLU A1008 -0.466 -17.126 -1.215 1.00 46.48 O ATOM 1642 OXT GLU A1008 1.606 -18.288 4.868 1.00 62.18 O ATOM 0 H GLU A1008 -1.709 -16.708 3.921 1.00 20.68 H new ATOM 0 HA GLU A1008 -0.365 -19.281 3.302 1.00 17.07 H new ATOM 0 HB2 GLU A1008 0.482 -16.472 2.551 1.00 24.97 H new ATOM 0 HB3 GLU A1008 1.322 -17.961 2.166 1.00 24.97 H new ATOM 0 HG2 GLU A1008 -0.515 -18.709 0.777 1.00 20.19 H new ATOM 0 HG3 GLU A1008 -1.498 -17.343 1.266 1.00 20.19 H new ATOM 1650 N VAL B1009 31.378 -1.927 2.508 1.00 55.78 N ATOM 1651 CA VAL B1009 29.832 -2.077 2.414 1.00 47.95 C ATOM 1652 C VAL B1009 29.314 -2.856 1.197 1.00 38.32 C ATOM 1653 O VAL B1009 29.542 -2.554 0.004 1.00 41.50 O ATOM 1654 CB VAL B1009 29.088 -0.795 2.584 1.00 47.66 C ATOM 1655 CG1 VAL B1009 27.679 -0.582 2.051 1.00 35.15 C ATOM 1656 CG2 VAL B1009 29.064 -0.415 4.099 1.00 73.77 C ATOM 0 HA VAL B1009 29.612 -2.703 3.278 1.00 47.95 H new ATOM 0 HB VAL B1009 29.674 -0.165 1.915 1.00 47.66 H new ATOM 0 HG11 VAL B1009 27.346 0.427 2.295 1.00 35.15 H new ATOM 0 HG12 VAL B1009 27.676 -0.713 0.969 1.00 35.15 H new ATOM 0 HG13 VAL B1009 27.004 -1.307 2.507 1.00 35.15 H new ATOM 0 HG21 VAL B1009 28.522 0.521 4.231 1.00 73.77 H new ATOM 0 HG22 VAL B1009 28.568 -1.204 4.664 1.00 73.77 H new ATOM 0 HG23 VAL B1009 30.085 -0.297 4.461 1.00 73.77 H new ATOM 1667 N ALA B1010 28.765 -3.967 1.524 1.00 32.34 N ATOM 1668 CA ALA B1010 28.306 -5.015 0.570 1.00 35.30 C ATOM 1669 C ALA B1010 26.759 -5.101 0.877 1.00 32.41 C ATOM 1670 O ALA B1010 26.379 -5.380 2.005 1.00 27.72 O ATOM 1671 CB ALA B1010 28.930 -6.347 0.829 1.00 32.01 C ATOM 0 H ALA B1010 28.597 -4.222 2.497 1.00 32.34 H new ATOM 0 HA ALA B1010 28.565 -4.767 -0.459 1.00 35.30 H new ATOM 0 HB1 ALA B1010 28.558 -7.070 0.103 1.00 32.01 H new ATOM 0 HB2 ALA B1010 30.013 -6.265 0.738 1.00 32.01 H new ATOM 0 HB3 ALA B1010 28.675 -6.679 1.835 1.00 32.01 H new ATOM 1677 N ILE B1011 25.955 -4.681 -0.143 1.00 29.15 N ATOM 1678 CA ILE B1011 24.537 -4.941 0.192 1.00 28.07 C ATOM 1679 C ILE B1011 23.720 -5.148 -1.102 1.00 24.12 C ATOM 1680 O ILE B1011 24.208 -4.585 -2.116 1.00 28.44 O ATOM 1681 CB ILE B1011 23.933 -3.751 0.964 1.00 34.10 C ATOM 1682 CG1 ILE B1011 22.507 -3.991 1.412 1.00 37.23 C ATOM 1683 CG2 ILE B1011 24.058 -2.494 0.082 1.00 37.64 C ATOM 1684 CD1 ILE B1011 22.053 -2.772 2.295 1.00 39.45 C ATOM 0 H ILE B1011 26.198 -4.246 -1.033 1.00 29.15 H new ATOM 0 HA ILE B1011 24.496 -5.836 0.812 1.00 28.07 H new ATOM 0 HB ILE B1011 24.492 -3.615 1.890 1.00 34.10 H new ATOM 0 HG12 ILE B1011 21.851 -4.099 0.548 1.00 37.23 H new ATOM 0 HG13 ILE B1011 22.439 -4.918 1.981 1.00 37.23 H new ATOM 0 HG21 ILE B1011 23.637 -1.637 0.608 1.00 37.64 H new ATOM 0 HG22 ILE B1011 25.109 -2.305 -0.135 1.00 37.64 H new ATOM 0 HG23 ILE B1011 23.517 -2.649 -0.851 1.00 37.64 H new ATOM 0 HD11 ILE B1011 21.027 -2.926 2.628 1.00 39.45 H new ATOM 0 HD12 ILE B1011 22.707 -2.688 3.163 1.00 39.45 H new ATOM 0 HD13 ILE B1011 22.110 -1.856 1.707 1.00 39.45 H new ATOM 1696 N LEU B1012 22.772 -6.084 -1.088 1.00 26.46 N ATOM 1697 CA LEU B1012 22.147 -6.353 -2.388 1.00 29.84 C ATOM 1698 C LEU B1012 21.202 -5.184 -2.734 1.00 32.46 C ATOM 1699 O LEU B1012 20.574 -4.641 -1.790 1.00 27.89 O ATOM 1700 CB LEU B1012 21.270 -7.612 -2.143 1.00 27.16 C ATOM 1701 CG LEU B1012 22.085 -8.966 -1.965 1.00 37.34 C ATOM 1702 CD1 LEU B1012 21.001 -10.093 -1.926 1.00 43.73 C ATOM 1703 CD2 LEU B1012 22.924 -9.037 -3.202 1.00 33.05 C ATOM 0 H LEU B1012 22.443 -6.621 -0.285 1.00 26.46 H new ATOM 0 HA LEU B1012 22.879 -6.480 -3.186 1.00 29.84 H new ATOM 0 HB2 LEU B1012 20.665 -7.448 -1.251 1.00 27.16 H new ATOM 0 HB3 LEU B1012 20.581 -7.726 -2.980 1.00 27.16 H new ATOM 0 HG LEU B1012 22.712 -9.047 -1.077 1.00 37.34 H new ATOM 0 HD11 LEU B1012 21.487 -11.061 -1.805 1.00 43.73 H new ATOM 0 HD12 LEU B1012 20.325 -9.919 -1.089 1.00 43.73 H new ATOM 0 HD13 LEU B1012 20.435 -10.085 -2.857 1.00 43.73 H new ATOM 0 HD21 LEU B1012 23.530 -9.942 -3.179 1.00 33.05 H new ATOM 0 HD22 LEU B1012 22.278 -9.055 -4.079 1.00 33.05 H new ATOM 0 HD23 LEU B1012 23.576 -8.165 -3.250 1.00 33.05 H new ATOM 1715 N TRP B1013 20.982 -4.969 -4.049 1.00 30.48 N ATOM 1716 CA TRP B1013 20.154 -3.830 -4.425 1.00 28.61 C ATOM 1717 C TRP B1013 18.706 -4.088 -3.930 1.00 31.55 C ATOM 1718 O TRP B1013 18.067 -3.087 -3.574 1.00 28.32 O ATOM 1719 CB TRP B1013 20.219 -3.676 -5.908 1.00 25.52 C ATOM 1720 CG TRP B1013 21.366 -2.873 -6.433 1.00 24.89 C ATOM 1721 CD1 TRP B1013 22.454 -2.393 -5.748 1.00 29.93 C ATOM 1722 CD2 TRP B1013 21.476 -2.454 -7.793 1.00 30.62 C ATOM 1723 NE1 TRP B1013 23.219 -1.700 -6.631 1.00 28.47 N ATOM 1724 CE2 TRP B1013 22.689 -1.699 -7.885 1.00 28.20 C ATOM 1725 CE3 TRP B1013 20.706 -2.604 -8.933 1.00 27.92 C ATOM 1726 CZ2 TRP B1013 23.069 -1.149 -9.084 1.00 26.49 C ATOM 1727 CZ3 TRP B1013 21.021 -2.005 -10.157 1.00 32.63 C ATOM 1728 CH2 TRP B1013 22.244 -1.301 -10.148 1.00 34.48 C ATOM 0 H TRP B1013 21.345 -5.535 -4.816 1.00 30.48 H new ATOM 0 HA TRP B1013 20.506 -2.905 -3.969 1.00 28.61 H new ATOM 0 HB2 TRP B1013 20.261 -4.669 -6.355 1.00 25.52 H new ATOM 0 HB3 TRP B1013 19.292 -3.213 -6.247 1.00 25.52 H new ATOM 0 HD1 TRP B1013 22.664 -2.539 -4.699 1.00 29.93 H new ATOM 0 HE1 TRP B1013 24.091 -1.233 -6.383 1.00 28.47 H new ATOM 0 HE3 TRP B1013 19.817 -3.214 -8.875 1.00 27.92 H new ATOM 0 HZ2 TRP B1013 24.000 -0.610 -9.177 1.00 26.49 H new ATOM 0 HZ3 TRP B1013 20.387 -2.075 -11.028 1.00 32.63 H new ATOM 0 HH2 TRP B1013 22.551 -0.841 -11.075 1.00 34.48 H new ATOM 1739 N HIS B1014 18.203 -5.268 -3.815 1.00 31.17 N ATOM 1740 CA HIS B1014 16.948 -5.699 -3.264 1.00 37.99 C ATOM 1741 C HIS B1014 16.803 -5.135 -1.828 1.00 39.12 C ATOM 1742 O HIS B1014 15.831 -4.466 -1.427 1.00 30.45 O ATOM 1743 CB HIS B1014 16.786 -7.267 -3.373 1.00 47.52 C ATOM 1744 CG HIS B1014 17.343 -7.869 -4.675 1.00 53.71 C ATOM 1745 ND1 HIS B1014 18.707 -7.892 -5.155 1.00 38.38 N ATOM 1746 CD2 HIS B1014 16.613 -8.515 -5.625 1.00 45.77 C ATOM 1747 CE1 HIS B1014 18.709 -8.443 -6.355 1.00 41.51 C ATOM 1748 NE2 HIS B1014 17.469 -8.855 -6.673 1.00 50.21 N ATOM 0 H HIS B1014 18.733 -6.072 -4.151 1.00 31.17 H new ATOM 0 HA HIS B1014 16.118 -5.297 -3.845 1.00 37.99 H new ATOM 0 HB2 HIS B1014 17.289 -7.733 -2.526 1.00 47.52 H new ATOM 0 HB3 HIS B1014 15.728 -7.518 -3.293 1.00 47.52 H new ATOM 0 HD2 HIS B1014 15.555 -8.727 -5.576 1.00 45.77 H new ATOM 0 HE1 HIS B1014 19.578 -8.547 -6.988 1.00 41.51 H new ATOM 0 HE2 HIS B1014 17.200 -9.334 -7.533 1.00 50.21 H new ATOM 1756 N GLU B1015 17.905 -5.292 -1.020 1.00 29.95 N ATOM 1757 CA GLU B1015 17.871 -4.895 0.378 1.00 29.07 C ATOM 1758 C GLU B1015 17.880 -3.375 0.486 1.00 27.70 C ATOM 1759 O GLU B1015 17.312 -2.766 1.410 1.00 29.32 O ATOM 1760 CB GLU B1015 18.975 -5.469 1.303 1.00 33.99 C ATOM 1761 CG GLU B1015 18.793 -7.005 1.178 1.00 58.48 C ATOM 1762 CD GLU B1015 19.720 -7.771 2.092 1.00 63.11 C ATOM 1763 OE1 GLU B1015 20.270 -7.119 3.024 1.00 50.43 O ATOM 1764 OE2 GLU B1015 19.842 -8.964 1.704 1.00 56.68 O ATOM 0 H GLU B1015 18.794 -5.684 -1.331 1.00 29.95 H new ATOM 0 HA GLU B1015 16.945 -5.337 0.745 1.00 29.07 H new ATOM 0 HB2 GLU B1015 19.969 -5.156 0.983 1.00 33.99 H new ATOM 0 HB3 GLU B1015 18.850 -5.133 2.332 1.00 33.99 H new ATOM 0 HG2 GLU B1015 17.761 -7.266 1.411 1.00 58.48 H new ATOM 0 HG3 GLU B1015 18.973 -7.307 0.146 1.00 58.48 H new ATOM 1771 N MET B1016 18.741 -2.810 -0.419 1.00 28.27 N ATOM 1772 CA MET B1016 19.011 -1.296 -0.111 1.00 29.14 C ATOM 1773 C MET B1016 17.666 -0.611 -0.478 1.00 23.44 C ATOM 1774 O MET B1016 17.291 0.383 0.250 1.00 24.65 O ATOM 1775 CB MET B1016 19.933 -0.894 -1.196 1.00 22.59 C ATOM 1776 CG MET B1016 20.460 0.452 -1.434 1.00 37.61 C ATOM 1777 SD MET B1016 21.405 0.310 -3.014 1.00 48.70 S ATOM 1778 CE MET B1016 22.665 -0.786 -2.367 1.00 30.31 C ATOM 0 H MET B1016 19.198 -3.240 -1.223 1.00 28.27 H new ATOM 0 HA MET B1016 19.369 -1.078 0.895 1.00 29.14 H new ATOM 0 HB2 MET B1016 20.808 -1.536 -1.089 1.00 22.59 H new ATOM 0 HB3 MET B1016 19.437 -1.182 -2.123 1.00 22.59 H new ATOM 0 HG2 MET B1016 19.656 1.183 -1.517 1.00 37.61 H new ATOM 0 HG3 MET B1016 21.103 0.777 -0.616 1.00 37.61 H new ATOM 0 HE1 MET B1016 23.597 -0.630 -2.910 1.00 30.31 H new ATOM 0 HE2 MET B1016 22.822 -0.575 -1.309 1.00 30.31 H new ATOM 0 HE3 MET B1016 22.344 -1.821 -2.487 1.00 30.31 H new ATOM 1788 N TRP B1017 16.999 -1.034 -1.600 1.00 22.91 N ATOM 1789 CA TRP B1017 15.693 -0.444 -1.903 1.00 27.38 C ATOM 1790 C TRP B1017 14.578 -0.757 -0.893 1.00 26.92 C ATOM 1791 O TRP B1017 13.761 0.109 -0.664 1.00 21.58 O ATOM 1792 CB TRP B1017 15.334 -0.886 -3.318 1.00 21.56 C ATOM 1793 CG TRP B1017 15.973 -0.043 -4.361 1.00 21.88 C ATOM 1794 CD1 TRP B1017 16.961 -0.399 -5.229 1.00 23.32 C ATOM 1795 CD2 TRP B1017 15.600 1.323 -4.759 1.00 22.16 C ATOM 1796 NE1 TRP B1017 17.303 0.605 -6.108 1.00 25.53 N ATOM 1797 CE2 TRP B1017 16.447 1.665 -5.802 1.00 20.99 C ATOM 1798 CE3 TRP B1017 14.695 2.256 -4.254 1.00 29.05 C ATOM 1799 CZ2 TRP B1017 16.404 2.940 -6.451 1.00 27.37 C ATOM 1800 CZ3 TRP B1017 14.618 3.527 -4.897 1.00 27.36 C ATOM 1801 CH2 TRP B1017 15.513 3.827 -5.932 1.00 25.33 C ATOM 0 H TRP B1017 17.334 -1.737 -2.259 1.00 22.91 H new ATOM 0 HA TRP B1017 15.777 0.640 -1.826 1.00 27.38 H new ATOM 0 HB2 TRP B1017 15.638 -1.923 -3.458 1.00 21.56 H new ATOM 0 HB3 TRP B1017 14.252 -0.852 -3.441 1.00 21.56 H new ATOM 0 HD1 TRP B1017 17.430 -1.372 -5.228 1.00 23.32 H new ATOM 0 HE1 TRP B1017 18.026 0.580 -6.827 1.00 25.53 H new ATOM 0 HE3 TRP B1017 14.072 2.024 -3.403 1.00 29.05 H new ATOM 0 HZ2 TRP B1017 17.035 3.181 -7.294 1.00 27.37 H new ATOM 0 HZ3 TRP B1017 13.877 4.250 -4.589 1.00 27.36 H new ATOM 0 HH2 TRP B1017 15.494 4.825 -6.344 1.00 25.33 H new ATOM 1812 N HIS B1018 14.512 -1.991 -0.308 1.00 22.92 N ATOM 1813 CA HIS B1018 13.406 -2.299 0.578 1.00 27.51 C ATOM 1814 C HIS B1018 13.545 -1.391 1.793 1.00 28.35 C ATOM 1815 O HIS B1018 12.571 -0.668 2.208 1.00 26.69 O ATOM 1816 CB HIS B1018 13.475 -3.780 0.954 1.00 28.26 C ATOM 1817 CG HIS B1018 12.360 -4.205 1.807 1.00 28.54 C ATOM 1818 ND1 HIS B1018 12.370 -3.943 3.175 1.00 35.10 N ATOM 1819 CD2 HIS B1018 11.189 -4.803 1.483 1.00 30.04 C ATOM 1820 CE1 HIS B1018 11.203 -4.416 3.670 1.00 35.04 C ATOM 1821 NE2 HIS B1018 10.512 -4.911 2.689 1.00 29.01 N ATOM 0 H HIS B1018 15.191 -2.741 -0.441 1.00 22.92 H new ATOM 0 HA HIS B1018 12.436 -2.127 0.111 1.00 27.51 H new ATOM 0 HB2 HIS B1018 13.479 -4.381 0.044 1.00 28.26 H new ATOM 0 HB3 HIS B1018 14.415 -3.975 1.470 1.00 28.26 H new ATOM 0 HD2 HIS B1018 10.857 -5.123 0.506 1.00 30.04 H new ATOM 0 HE1 HIS B1018 10.898 -4.387 4.706 1.00 35.04 H new ATOM 0 HE2 HIS B1018 9.587 -5.327 2.792 1.00 29.01 H new ATOM 1829 N GLU B1019 14.771 -1.308 2.343 1.00 25.68 N ATOM 1830 CA GLU B1019 14.983 -0.458 3.473 1.00 28.28 C ATOM 1831 C GLU B1019 14.828 1.013 3.178 1.00 26.75 C ATOM 1832 O GLU B1019 14.275 1.798 4.018 1.00 27.93 O ATOM 1833 CB GLU B1019 16.523 -0.682 3.799 1.00 28.52 C ATOM 1834 CG GLU B1019 16.947 -0.646 5.217 1.00 51.89 C ATOM 1835 CD GLU B1019 18.436 -1.097 5.084 1.00 61.75 C ATOM 1836 OE1 GLU B1019 18.642 -2.330 4.926 1.00 60.11 O ATOM 1837 OE2 GLU B1019 19.191 -0.086 5.057 1.00 46.25 O ATOM 0 H GLU B1019 15.594 -1.814 2.016 1.00 25.68 H new ATOM 0 HA GLU B1019 14.264 -0.699 4.256 1.00 28.28 H new ATOM 0 HB2 GLU B1019 16.814 -1.649 3.388 1.00 28.52 H new ATOM 0 HB3 GLU B1019 17.092 0.077 3.261 1.00 28.52 H new ATOM 0 HG2 GLU B1019 16.853 0.349 5.652 1.00 51.89 H new ATOM 0 HG3 GLU B1019 16.364 -1.323 5.841 1.00 51.89 H new ATOM 1844 N GLY B1020 15.341 1.483 2.034 1.00 22.29 N ATOM 1845 CA GLY B1020 15.287 2.860 1.641 1.00 29.17 C ATOM 1846 C GLY B1020 13.822 3.360 1.402 1.00 25.38 C ATOM 1847 O GLY B1020 13.522 4.377 1.925 1.00 25.64 O ATOM 0 H GLY B1020 15.812 0.887 1.354 1.00 22.29 H new ATOM 0 HA2 GLY B1020 15.755 3.473 2.411 1.00 29.17 H new ATOM 0 HA3 GLY B1020 15.867 2.997 0.729 1.00 29.17 H new ATOM 1851 N LEU B1021 12.978 2.558 0.702 1.00 21.57 N ATOM 1852 CA LEU B1021 11.565 2.917 0.429 1.00 25.27 C ATOM 1853 C LEU B1021 10.825 2.993 1.745 1.00 22.07 C ATOM 1854 O LEU B1021 10.035 3.985 1.955 1.00 23.49 O ATOM 1855 CB LEU B1021 10.973 1.876 -0.591 1.00 20.24 C ATOM 1856 CG LEU B1021 11.579 1.994 -2.000 1.00 20.64 C ATOM 1857 CD1 LEU B1021 10.946 0.915 -2.935 1.00 21.71 C ATOM 1858 CD2 LEU B1021 11.469 3.485 -2.600 1.00 24.29 C ATOM 0 H LEU B1021 13.255 1.655 0.316 1.00 21.57 H new ATOM 0 HA LEU B1021 11.465 3.897 -0.037 1.00 25.27 H new ATOM 0 HB2 LEU B1021 11.145 0.868 -0.212 1.00 20.24 H new ATOM 0 HB3 LEU B1021 9.894 2.013 -0.654 1.00 20.24 H new ATOM 0 HG LEU B1021 12.649 1.799 -1.932 1.00 20.64 H new ATOM 0 HD11 LEU B1021 11.377 1.000 -3.933 1.00 21.71 H new ATOM 0 HD12 LEU B1021 11.151 -0.078 -2.535 1.00 21.71 H new ATOM 0 HD13 LEU B1021 9.868 1.069 -2.991 1.00 21.71 H new ATOM 0 HD21 LEU B1021 11.912 3.510 -3.596 1.00 24.29 H new ATOM 0 HD22 LEU B1021 10.420 3.776 -2.662 1.00 24.29 H new ATOM 0 HD23 LEU B1021 12.000 4.179 -1.949 1.00 24.29 H new ATOM 1870 N GLU B1022 10.990 2.090 2.658 1.00 21.84 N ATOM 1871 CA GLU B1022 10.394 2.013 3.951 1.00 28.54 C ATOM 1872 C GLU B1022 10.718 3.275 4.728 1.00 32.36 C ATOM 1873 O GLU B1022 9.758 3.957 5.155 1.00 32.09 O ATOM 1874 CB GLU B1022 10.649 0.723 4.697 1.00 30.50 C ATOM 1875 CG GLU B1022 9.848 0.655 6.019 1.00 37.12 C ATOM 1876 CD GLU B1022 9.746 -0.739 6.564 1.00 42.82 C ATOM 1877 OE1 GLU B1022 10.728 -1.473 6.563 1.00 49.28 O ATOM 1878 OE2 GLU B1022 8.689 -1.129 7.083 1.00 45.55 O ATOM 0 H GLU B1022 11.616 1.301 2.495 1.00 21.84 H new ATOM 0 HA GLU B1022 9.313 1.969 3.818 1.00 28.54 H new ATOM 0 HB2 GLU B1022 10.378 -0.122 4.064 1.00 30.50 H new ATOM 0 HB3 GLU B1022 11.714 0.632 4.912 1.00 30.50 H new ATOM 0 HG2 GLU B1022 10.324 1.297 6.761 1.00 37.12 H new ATOM 0 HG3 GLU B1022 8.846 1.050 5.852 1.00 37.12 H new ATOM 1885 N GLU B1023 12.027 3.686 4.721 1.00 25.11 N ATOM 1886 CA GLU B1023 12.465 4.806 5.474 1.00 33.65 C ATOM 1887 C GLU B1023 11.942 6.142 4.824 1.00 29.68 C ATOM 1888 O GLU B1023 11.404 6.954 5.503 1.00 24.46 O ATOM 1889 CB GLU B1023 14.026 4.836 5.521 1.00 30.85 C ATOM 1890 CG GLU B1023 14.463 6.064 6.346 1.00 49.55 C ATOM 1891 CD GLU B1023 13.831 6.248 7.724 1.00 58.72 C ATOM 1892 OE1 GLU B1023 13.244 5.401 8.437 1.00 55.47 O ATOM 1893 OE2 GLU B1023 13.899 7.388 8.236 1.00 58.21 O ATOM 0 H GLU B1023 12.764 3.226 4.186 1.00 25.11 H new ATOM 0 HA GLU B1023 12.068 4.720 6.485 1.00 33.65 H new ATOM 0 HB2 GLU B1023 14.410 3.920 5.971 1.00 30.85 H new ATOM 0 HB3 GLU B1023 14.435 4.891 4.512 1.00 30.85 H new ATOM 0 HG2 GLU B1023 15.544 6.015 6.476 1.00 49.55 H new ATOM 0 HG3 GLU B1023 14.253 6.957 5.757 1.00 49.55 H new ATOM 1900 N ALA B1024 12.013 6.239 3.523 1.00 22.54 N ATOM 1901 CA ALA B1024 11.601 7.426 2.800 1.00 21.36 C ATOM 1902 C ALA B1024 10.051 7.588 2.987 1.00 26.56 C ATOM 1903 O ALA B1024 9.625 8.709 3.097 1.00 25.95 O ATOM 1904 CB ALA B1024 11.879 7.349 1.340 1.00 18.38 C ATOM 0 H ALA B1024 12.362 5.491 2.923 1.00 22.54 H new ATOM 0 HA ALA B1024 12.168 8.268 3.198 1.00 21.36 H new ATOM 0 HB1 ALA B1024 11.547 8.268 0.857 1.00 18.38 H new ATOM 0 HB2 ALA B1024 12.950 7.221 1.180 1.00 18.38 H new ATOM 0 HB3 ALA B1024 11.344 6.501 0.912 1.00 18.38 H new ATOM 1910 N SER B1025 9.312 6.490 2.835 1.00 25.32 N ATOM 1911 CA SER B1025 7.857 6.607 3.142 1.00 24.39 C ATOM 1912 C SER B1025 7.528 7.015 4.543 1.00 29.24 C ATOM 1913 O SER B1025 6.534 7.749 4.752 1.00 29.49 O ATOM 1914 CB SER B1025 7.164 5.254 2.682 1.00 23.79 C ATOM 1915 OG SER B1025 7.217 4.377 3.779 1.00 28.57 O ATOM 0 H SER B1025 9.643 5.575 2.529 1.00 25.32 H new ATOM 0 HA SER B1025 7.450 7.447 2.579 1.00 24.39 H new ATOM 0 HB2 SER B1025 6.132 5.432 2.379 1.00 23.79 H new ATOM 0 HB3 SER B1025 7.680 4.828 1.822 1.00 23.79 H new ATOM 0 HG SER B1025 8.132 4.344 4.127 1.00 28.57 H new ATOM 1921 N ARG B1026 8.359 6.524 5.551 1.00 24.86 N ATOM 1922 CA ARG B1026 8.118 7.029 6.926 1.00 27.68 C ATOM 1923 C ARG B1026 8.333 8.482 7.095 1.00 32.33 C ATOM 1924 O ARG B1026 7.474 9.231 7.711 1.00 32.10 O ATOM 1925 CB ARG B1026 9.020 6.220 7.880 1.00 28.55 C ATOM 1926 CG ARG B1026 8.633 6.319 9.337 1.00 49.24 C ATOM 1927 CD ARG B1026 9.892 6.219 10.251 1.00 58.27 C ATOM 1928 NE ARG B1026 10.502 7.544 10.160 1.00 73.84 N ATOM 1929 CZ ARG B1026 11.719 7.926 10.460 1.00 82.46 C ATOM 1930 NH1 ARG B1026 12.624 7.091 10.934 1.00 86.67 N ATOM 1931 NH2 ARG B1026 11.998 9.204 10.261 1.00 79.93 N ATOM 0 H ARG B1026 9.117 5.851 5.437 1.00 24.86 H new ATOM 0 HA ARG B1026 7.061 6.889 7.155 1.00 27.68 H new ATOM 0 HB2 ARG B1026 8.997 5.172 7.581 1.00 28.55 H new ATOM 0 HB3 ARG B1026 10.049 6.562 7.766 1.00 28.55 H new ATOM 0 HG2 ARG B1026 8.120 7.264 9.519 1.00 49.24 H new ATOM 0 HG3 ARG B1026 7.932 5.522 9.587 1.00 49.24 H new ATOM 0 HD2 ARG B1026 9.621 5.974 11.278 1.00 58.27 H new ATOM 0 HD3 ARG B1026 10.574 5.441 9.907 1.00 58.27 H new ATOM 0 HE ARG B1026 9.889 8.281 9.811 1.00 73.84 H new ATOM 0 HH11 ARG B1026 12.386 6.110 11.079 1.00 86.67 H new ATOM 0 HH12 ARG B1026 13.561 7.427 11.156 1.00 86.67 H new ATOM 0 HH21 ARG B1026 11.282 9.831 9.893 1.00 79.93 H new ATOM 0 HH22 ARG B1026 12.929 9.562 10.476 1.00 79.93 H new ATOM 1944 N LEU B1027 9.418 9.049 6.542 1.00 27.73 N ATOM 1945 CA LEU B1027 9.658 10.463 6.579 1.00 28.96 C ATOM 1946 C LEU B1027 8.595 11.294 5.913 1.00 32.60 C ATOM 1947 O LEU B1027 8.164 12.267 6.518 1.00 29.09 O ATOM 1948 CB LEU B1027 11.063 10.702 5.800 1.00 23.76 C ATOM 1949 CG LEU B1027 12.290 10.133 6.593 1.00 33.63 C ATOM 1950 CD1 LEU B1027 13.625 10.177 5.664 1.00 37.87 C ATOM 1951 CD2 LEU B1027 12.505 10.950 7.845 1.00 30.72 C ATOM 0 H LEU B1027 10.144 8.519 6.060 1.00 27.73 H new ATOM 0 HA LEU B1027 9.668 10.778 7.622 1.00 28.96 H new ATOM 0 HB2 LEU B1027 11.017 10.229 4.819 1.00 23.76 H new ATOM 0 HB3 LEU B1027 11.205 11.770 5.632 1.00 23.76 H new ATOM 0 HG LEU B1027 12.090 9.098 6.869 1.00 33.63 H new ATOM 0 HD11 LEU B1027 14.471 9.780 6.224 1.00 37.87 H new ATOM 0 HD12 LEU B1027 13.466 9.574 4.770 1.00 37.87 H new ATOM 0 HD13 LEU B1027 13.833 11.207 5.374 1.00 37.87 H new ATOM 0 HD21 LEU B1027 13.358 10.554 8.396 1.00 30.72 H new ATOM 0 HD22 LEU B1027 12.698 11.988 7.574 1.00 30.72 H new ATOM 0 HD23 LEU B1027 11.614 10.899 8.470 1.00 30.72 H new ATOM 1963 N TYR B1028 8.088 10.809 4.740 1.00 25.73 N ATOM 1964 CA TYR B1028 7.166 11.573 3.952 1.00 27.53 C ATOM 1965 C TYR B1028 5.721 11.384 4.601 1.00 30.66 C ATOM 1966 O TYR B1028 5.202 12.357 5.032 1.00 30.46 O ATOM 1967 CB TYR B1028 7.093 11.148 2.489 1.00 24.78 C ATOM 1968 CG TYR B1028 6.032 11.883 1.657 1.00 21.88 C ATOM 1969 CD1 TYR B1028 5.932 13.269 1.650 1.00 31.57 C ATOM 1970 CD2 TYR B1028 5.066 11.176 1.013 1.00 30.90 C ATOM 1971 CE1 TYR B1028 4.932 13.905 0.894 1.00 36.71 C ATOM 1972 CE2 TYR B1028 4.073 11.795 0.230 1.00 33.73 C ATOM 1973 CZ TYR B1028 4.045 13.150 0.198 1.00 39.32 C ATOM 1974 OH TYR B1028 3.023 13.712 -0.561 1.00 34.18 O ATOM 0 H TYR B1028 8.321 9.895 4.351 1.00 25.73 H new ATOM 0 HA TYR B1028 7.511 12.607 3.955 1.00 27.53 H new ATOM 0 HB2 TYR B1028 8.069 11.307 2.030 1.00 24.78 H new ATOM 0 HB3 TYR B1028 6.891 10.078 2.446 1.00 24.78 H new ATOM 0 HD1 TYR B1028 6.626 13.861 2.228 1.00 31.57 H new ATOM 0 HD2 TYR B1028 5.060 10.100 1.105 1.00 30.90 H new ATOM 0 HE1 TYR B1028 4.870 14.983 0.867 1.00 36.71 H new ATOM 0 HE2 TYR B1028 3.357 11.209 -0.327 1.00 33.73 H new ATOM 0 HH TYR B1028 2.498 12.999 -0.982 1.00 34.18 H new ATOM 1984 N PHE B1029 5.212 10.193 4.640 1.00 26.10 N ATOM 1985 CA PHE B1029 3.799 9.991 5.126 1.00 31.74 C ATOM 1986 C PHE B1029 3.587 10.131 6.609 1.00 33.66 C ATOM 1987 O PHE B1029 2.588 10.724 7.028 1.00 37.26 O ATOM 1988 CB PHE B1029 3.308 8.591 4.684 1.00 22.79 C ATOM 1989 CG PHE B1029 3.163 8.524 3.170 1.00 27.97 C ATOM 1990 CD1 PHE B1029 2.201 9.178 2.505 1.00 25.80 C ATOM 1991 CD2 PHE B1029 4.061 7.746 2.446 1.00 32.81 C ATOM 1992 CE1 PHE B1029 2.113 9.076 1.176 1.00 27.65 C ATOM 1993 CE2 PHE B1029 3.926 7.582 1.059 1.00 22.41 C ATOM 1994 CZ PHE B1029 3.029 8.338 0.347 1.00 26.90 C ATOM 0 H PHE B1029 5.700 9.342 4.360 1.00 26.10 H new ATOM 0 HA PHE B1029 3.226 10.801 4.674 1.00 31.74 H new ATOM 0 HB2 PHE B1029 4.012 7.830 5.021 1.00 22.79 H new ATOM 0 HB3 PHE B1029 2.351 8.370 5.156 1.00 22.79 H new ATOM 0 HD1 PHE B1029 1.494 9.790 3.046 1.00 25.80 H new ATOM 0 HD2 PHE B1029 4.876 7.260 2.961 1.00 32.81 H new ATOM 0 HE1 PHE B1029 1.295 9.585 0.688 1.00 27.65 H new ATOM 0 HE2 PHE B1029 4.535 6.852 0.546 1.00 22.41 H new ATOM 0 HZ PHE B1029 3.012 8.376 -0.732 1.00 26.90 H new ATOM 2004 N GLY B1030 4.535 9.663 7.428 1.00 28.53 N ATOM 2005 CA GLY B1030 4.505 9.687 8.836 1.00 40.11 C ATOM 2006 C GLY B1030 4.941 11.079 9.326 1.00 50.14 C ATOM 2007 O GLY B1030 4.245 11.677 10.131 1.00 40.04 O ATOM 0 H GLY B1030 5.388 9.235 7.068 1.00 28.53 H new ATOM 0 HA2 GLY B1030 3.501 9.460 9.194 1.00 40.11 H new ATOM 0 HA3 GLY B1030 5.168 8.922 9.239 1.00 40.11 H new ATOM 2011 N GLU B1031 6.107 11.548 8.865 1.00 44.72 N ATOM 2012 CA GLU B1031 6.630 12.816 9.381 1.00 34.76 C ATOM 2013 C GLU B1031 6.320 14.096 8.637 1.00 37.33 C ATOM 2014 O GLU B1031 6.763 15.189 9.034 1.00 38.14 O ATOM 2015 CB GLU B1031 8.151 12.586 9.654 1.00 36.33 C ATOM 2016 CG GLU B1031 8.242 11.497 10.735 1.00 48.23 C ATOM 2017 CD GLU B1031 9.578 10.879 11.018 1.00 75.08 C ATOM 2018 OE1 GLU B1031 10.687 11.453 10.917 1.00 70.65 O ATOM 2019 OE2 GLU B1031 9.524 9.671 11.379 1.00 83.84 O ATOM 0 H GLU B1031 6.687 11.089 8.163 1.00 44.72 H new ATOM 0 HA GLU B1031 6.071 13.042 10.289 1.00 34.76 H new ATOM 0 HB2 GLU B1031 8.665 12.274 8.745 1.00 36.33 H new ATOM 0 HB3 GLU B1031 8.628 13.507 9.990 1.00 36.33 H new ATOM 0 HG2 GLU B1031 7.870 11.923 11.667 1.00 48.23 H new ATOM 0 HG3 GLU B1031 7.558 10.695 10.456 1.00 48.23 H new ATOM 2026 N ARG B1032 5.689 13.985 7.460 1.00 27.42 N ATOM 2027 CA ARG B1032 5.482 15.082 6.554 1.00 37.52 C ATOM 2028 C ARG B1032 6.846 15.744 6.191 1.00 44.40 C ATOM 2029 O ARG B1032 6.856 16.973 5.988 1.00 36.05 O ATOM 2030 CB ARG B1032 4.582 16.132 7.197 1.00 40.27 C ATOM 2031 CG ARG B1032 3.066 15.847 6.920 1.00 44.53 C ATOM 2032 CD ARG B1032 2.658 14.599 7.674 1.00 46.61 C ATOM 2033 NE ARG B1032 1.180 14.568 7.628 1.00 54.12 N ATOM 2034 CZ ARG B1032 0.411 13.835 8.401 1.00 55.11 C ATOM 2035 NH1 ARG B1032 1.031 13.048 9.282 1.00 44.28 N ATOM 2036 NH2 ARG B1032 -0.940 13.929 8.285 1.00 49.75 N ATOM 0 H ARG B1032 5.306 13.103 7.120 1.00 27.42 H new ATOM 0 HA ARG B1032 5.009 14.696 5.651 1.00 37.52 H new ATOM 0 HB2 ARG B1032 4.758 16.152 8.273 1.00 40.27 H new ATOM 0 HB3 ARG B1032 4.843 17.118 6.813 1.00 40.27 H new ATOM 0 HG2 ARG B1032 2.459 16.695 7.237 1.00 44.53 H new ATOM 0 HG3 ARG B1032 2.896 15.715 5.851 1.00 44.53 H new ATOM 0 HD2 ARG B1032 3.083 13.707 7.213 1.00 46.61 H new ATOM 0 HD3 ARG B1032 3.017 14.628 8.703 1.00 46.61 H new ATOM 0 HE ARG B1032 0.720 15.164 6.940 1.00 54.12 H new ATOM 0 HH11 ARG B1032 2.050 13.038 9.329 1.00 44.28 H new ATOM 0 HH12 ARG B1032 0.486 12.456 9.909 1.00 44.28 H new ATOM 0 HH21 ARG B1032 -1.350 14.565 7.601 1.00 49.75 H new ATOM 0 HH22 ARG B1032 -1.544 13.363 8.882 1.00 49.75 H new ATOM 2049 N ASN B1033 7.924 14.955 6.132 1.00 32.98 N ATOM 2050 CA ASN B1033 9.204 15.545 5.801 1.00 30.01 C ATOM 2051 C ASN B1033 9.649 15.185 4.385 1.00 28.30 C ATOM 2052 O ASN B1033 10.255 14.130 4.212 1.00 28.58 O ATOM 2053 CB ASN B1033 10.210 15.014 6.853 1.00 34.24 C ATOM 2054 CG ASN B1033 11.603 15.538 6.670 1.00 28.67 C ATOM 2055 OD1 ASN B1033 11.913 16.346 5.809 1.00 30.31 O ATOM 2056 ND2 ASN B1033 12.529 15.082 7.474 1.00 32.53 N ATOM 0 H ASN B1033 7.930 13.949 6.303 1.00 32.98 H new ATOM 0 HA ASN B1033 9.142 16.633 5.823 1.00 30.01 H new ATOM 0 HB2 ASN B1033 9.857 15.283 7.849 1.00 34.24 H new ATOM 0 HB3 ASN B1033 10.231 13.925 6.806 1.00 34.24 H new ATOM 0 HD21 ASN B1033 13.492 15.402 7.376 1.00 32.53 H new ATOM 0 HD22 ASN B1033 12.287 14.406 8.199 1.00 32.53 H new ATOM 2063 N VAL B1034 9.353 16.011 3.374 1.00 21.42 N ATOM 2064 CA VAL B1034 9.614 15.774 1.998 1.00 29.25 C ATOM 2065 C VAL B1034 11.133 15.927 1.794 1.00 31.35 C ATOM 2066 O VAL B1034 11.770 15.139 1.083 1.00 26.94 O ATOM 2067 CB VAL B1034 8.835 16.704 1.060 1.00 28.30 C ATOM 2068 CG1 VAL B1034 9.238 16.378 -0.389 1.00 28.68 C ATOM 2069 CG2 VAL B1034 7.298 16.553 1.144 1.00 33.92 C ATOM 0 H VAL B1034 8.898 16.910 3.533 1.00 21.42 H new ATOM 0 HA VAL B1034 9.275 14.771 1.740 1.00 29.25 H new ATOM 0 HB VAL B1034 9.083 17.720 1.366 1.00 28.30 H new ATOM 0 HG11 VAL B1034 8.694 17.029 -1.073 1.00 28.68 H new ATOM 0 HG12 VAL B1034 10.309 16.535 -0.513 1.00 28.68 H new ATOM 0 HG13 VAL B1034 8.996 15.338 -0.609 1.00 28.68 H new ATOM 0 HG21 VAL B1034 6.826 17.247 0.449 1.00 33.92 H new ATOM 0 HG22 VAL B1034 7.018 15.532 0.884 1.00 33.92 H new ATOM 0 HG23 VAL B1034 6.966 16.773 2.158 1.00 33.92 H new ATOM 2079 N LYS B1035 11.752 16.960 2.423 1.00 28.97 N ATOM 2080 CA LYS B1035 13.229 17.047 2.241 1.00 29.39 C ATOM 2081 C LYS B1035 13.932 15.749 2.616 1.00 25.02 C ATOM 2082 O LYS B1035 14.818 15.246 1.845 1.00 24.37 O ATOM 2083 CB LYS B1035 13.607 18.250 3.142 1.00 34.34 C ATOM 2084 CG LYS B1035 15.043 18.313 3.489 1.00 57.87 C ATOM 2085 CD LYS B1035 15.460 19.646 4.139 1.00 70.51 C ATOM 2086 CE LYS B1035 16.900 19.473 4.673 1.00 74.08 C ATOM 2087 NZ LYS B1035 16.957 18.312 5.621 1.00 55.94 N ATOM 0 H LYS B1035 11.312 17.676 3.002 1.00 28.97 H new ATOM 0 HA LYS B1035 13.540 17.193 1.207 1.00 29.39 H new ATOM 0 HB2 LYS B1035 13.325 19.173 2.635 1.00 34.34 H new ATOM 0 HB3 LYS B1035 13.023 18.200 4.061 1.00 34.34 H new ATOM 0 HG2 LYS B1035 15.280 17.496 4.170 1.00 57.87 H new ATOM 0 HG3 LYS B1035 15.634 18.157 2.586 1.00 57.87 H new ATOM 0 HD2 LYS B1035 15.416 20.457 3.412 1.00 70.51 H new ATOM 0 HD3 LYS B1035 14.779 19.907 4.950 1.00 70.51 H new ATOM 0 HE2 LYS B1035 17.588 19.310 3.843 1.00 74.08 H new ATOM 0 HE3 LYS B1035 17.221 20.383 5.179 1.00 74.08 H new ATOM 0 HZ1 LYS B1035 17.674 18.495 6.352 1.00 55.94 H new ATOM 0 HZ2 LYS B1035 16.028 18.185 6.071 1.00 55.94 H new ATOM 0 HZ3 LYS B1035 17.209 17.449 5.098 1.00 55.94 H new ATOM 2100 N GLY B1036 13.549 15.115 3.692 1.00 21.73 N ATOM 2101 CA GLY B1036 14.226 13.917 4.268 1.00 26.20 C ATOM 2102 C GLY B1036 13.943 12.719 3.295 1.00 26.89 C ATOM 2103 O GLY B1036 14.722 12.026 2.934 1.00 26.53 O ATOM 0 H GLY B1036 12.733 15.405 4.231 1.00 21.73 H new ATOM 0 HA2 GLY B1036 15.298 14.089 4.366 1.00 26.20 H new ATOM 0 HA3 GLY B1036 13.845 13.701 5.266 1.00 26.20 H new ATOM 2107 N MET B1037 12.675 12.599 2.796 1.00 23.74 N ATOM 2108 CA MET B1037 12.343 11.621 1.761 1.00 31.12 C ATOM 2109 C MET B1037 13.147 11.684 0.517 1.00 27.02 C ATOM 2110 O MET B1037 13.745 10.623 0.112 1.00 30.28 O ATOM 2111 CB MET B1037 10.867 11.905 1.234 1.00 20.92 C ATOM 2112 CG MET B1037 10.446 10.868 0.185 1.00 17.75 C ATOM 2113 SD MET B1037 8.876 11.582 -0.627 1.00 22.16 S ATOM 2114 CE MET B1037 9.719 12.686 -1.725 1.00 28.31 C ATOM 0 H MET B1037 11.887 13.170 3.103 1.00 23.74 H new ATOM 0 HA MET B1037 12.512 10.665 2.257 1.00 31.12 H new ATOM 0 HB2 MET B1037 10.169 11.885 2.071 1.00 20.92 H new ATOM 0 HB3 MET B1037 10.818 12.905 0.802 1.00 20.92 H new ATOM 0 HG2 MET B1037 11.234 10.712 -0.552 1.00 17.75 H new ATOM 0 HG3 MET B1037 10.245 9.901 0.646 1.00 17.75 H new ATOM 0 HE1 MET B1037 9.066 13.523 -1.972 1.00 28.31 H new ATOM 0 HE2 MET B1037 10.622 13.061 -1.242 1.00 28.31 H new ATOM 0 HE3 MET B1037 9.989 12.155 -2.638 1.00 28.31 H new ATOM 2124 N PHE B1038 13.459 12.886 0.003 1.00 23.23 N ATOM 2125 CA PHE B1038 14.393 13.048 -1.153 1.00 23.37 C ATOM 2126 C PHE B1038 15.822 12.639 -0.801 1.00 19.82 C ATOM 2127 O PHE B1038 16.481 12.228 -1.716 1.00 24.89 O ATOM 2128 CB PHE B1038 14.362 14.511 -1.639 1.00 21.04 C ATOM 2129 CG PHE B1038 13.121 14.907 -2.403 1.00 28.24 C ATOM 2130 CD1 PHE B1038 12.452 14.056 -3.260 1.00 36.80 C ATOM 2131 CD2 PHE B1038 12.683 16.245 -2.323 1.00 31.97 C ATOM 2132 CE1 PHE B1038 11.306 14.485 -3.948 1.00 34.35 C ATOM 2133 CE2 PHE B1038 11.556 16.680 -2.985 1.00 30.03 C ATOM 2134 CZ PHE B1038 10.931 15.808 -3.841 1.00 30.98 C ATOM 0 H PHE B1038 13.085 13.765 0.360 1.00 23.23 H new ATOM 0 HA PHE B1038 14.057 12.385 -1.950 1.00 23.37 H new ATOM 0 HB2 PHE B1038 14.462 15.167 -0.774 1.00 21.04 H new ATOM 0 HB3 PHE B1038 15.231 14.685 -2.273 1.00 21.04 H new ATOM 0 HD1 PHE B1038 12.814 13.049 -3.403 1.00 36.80 H new ATOM 0 HD2 PHE B1038 13.246 16.948 -1.727 1.00 31.97 H new ATOM 0 HE1 PHE B1038 10.731 13.795 -4.547 1.00 34.35 H new ATOM 0 HE2 PHE B1038 11.175 17.679 -2.835 1.00 30.03 H new ATOM 0 HZ PHE B1038 10.117 16.170 -4.452 1.00 30.98 H new ATOM 2144 N GLU B1039 16.228 13.135 0.428 1.00 27.28 N ATOM 2145 CA GLU B1039 17.550 12.834 0.805 1.00 24.10 C ATOM 2146 C GLU B1039 17.793 11.298 0.768 1.00 25.72 C ATOM 2147 O GLU B1039 18.911 10.898 0.455 1.00 26.95 O ATOM 2148 CB GLU B1039 17.957 13.279 2.249 1.00 32.60 C ATOM 2149 CG GLU B1039 17.686 14.799 2.365 1.00 41.53 C ATOM 2150 CD GLU B1039 17.975 15.303 3.783 1.00 55.15 C ATOM 2151 OE1 GLU B1039 18.628 14.466 4.514 1.00 47.83 O ATOM 2152 OE2 GLU B1039 17.580 16.484 3.979 1.00 46.42 O ATOM 0 H GLU B1039 15.672 13.690 1.079 1.00 27.28 H new ATOM 0 HA GLU B1039 18.147 13.393 0.084 1.00 24.10 H new ATOM 0 HB2 GLU B1039 17.383 12.730 2.995 1.00 32.60 H new ATOM 0 HB3 GLU B1039 19.009 13.063 2.434 1.00 32.60 H new ATOM 0 HG2 GLU B1039 18.308 15.338 1.650 1.00 41.53 H new ATOM 0 HG3 GLU B1039 16.648 15.008 2.106 1.00 41.53 H new ATOM 2159 N VAL B1040 16.834 10.557 1.238 1.00 28.07 N ATOM 2160 CA VAL B1040 16.912 9.112 1.190 1.00 26.16 C ATOM 2161 C VAL B1040 16.876 8.553 -0.216 1.00 28.85 C ATOM 2162 O VAL B1040 17.677 7.650 -0.462 1.00 25.29 O ATOM 2163 CB VAL B1040 15.805 8.438 2.057 1.00 25.52 C ATOM 2164 CG1 VAL B1040 15.844 6.911 1.816 1.00 28.18 C ATOM 2165 CG2 VAL B1040 16.015 8.733 3.562 1.00 24.86 C ATOM 0 H VAL B1040 15.982 10.923 1.662 1.00 28.07 H new ATOM 0 HA VAL B1040 17.888 8.869 1.611 1.00 26.16 H new ATOM 0 HB VAL B1040 14.836 8.844 1.767 1.00 25.52 H new ATOM 0 HG11 VAL B1040 15.074 6.428 2.417 1.00 28.18 H new ATOM 0 HG12 VAL B1040 15.663 6.704 0.761 1.00 28.18 H new ATOM 0 HG13 VAL B1040 16.822 6.523 2.099 1.00 28.18 H new ATOM 0 HG21 VAL B1040 15.228 8.250 4.141 1.00 24.86 H new ATOM 0 HG22 VAL B1040 16.985 8.348 3.876 1.00 24.86 H new ATOM 0 HG23 VAL B1040 15.980 9.809 3.730 1.00 24.86 H new ATOM 2175 N LEU B1041 15.949 8.952 -1.089 1.00 24.93 N ATOM 2176 CA LEU B1041 15.734 8.361 -2.400 1.00 26.02 C ATOM 2177 C LEU B1041 16.814 8.808 -3.393 1.00 26.82 C ATOM 2178 O LEU B1041 17.138 8.033 -4.301 1.00 26.21 O ATOM 2179 CB LEU B1041 14.342 8.928 -2.949 1.00 24.94 C ATOM 2180 CG LEU B1041 13.062 8.379 -2.238 1.00 26.15 C ATOM 2181 CD1 LEU B1041 11.887 9.231 -2.795 1.00 27.22 C ATOM 2182 CD2 LEU B1041 12.880 6.885 -2.509 1.00 32.61 C ATOM 0 H LEU B1041 15.309 9.721 -0.891 1.00 24.93 H new ATOM 0 HA LEU B1041 15.752 7.275 -2.308 1.00 26.02 H new ATOM 0 HB2 LEU B1041 14.350 10.014 -2.856 1.00 24.94 H new ATOM 0 HB3 LEU B1041 14.271 8.700 -4.013 1.00 24.94 H new ATOM 0 HG LEU B1041 13.124 8.464 -1.153 1.00 26.15 H new ATOM 0 HD11 LEU B1041 10.952 8.903 -2.341 1.00 27.22 H new ATOM 0 HD12 LEU B1041 12.056 10.282 -2.559 1.00 27.22 H new ATOM 0 HD13 LEU B1041 11.828 9.107 -3.876 1.00 27.22 H new ATOM 0 HD21 LEU B1041 11.982 6.530 -2.003 1.00 32.61 H new ATOM 0 HD22 LEU B1041 12.781 6.719 -3.582 1.00 32.61 H new ATOM 0 HD23 LEU B1041 13.747 6.339 -2.136 1.00 32.61 H new ATOM 2194 N GLU B1042 17.449 9.990 -3.251 1.00 25.64 N ATOM 2195 CA GLU B1042 18.378 10.407 -4.362 1.00 31.50 C ATOM 2196 C GLU B1042 19.592 9.502 -4.591 1.00 29.94 C ATOM 2197 O GLU B1042 19.897 9.127 -5.744 1.00 25.01 O ATOM 2198 CB GLU B1042 18.793 11.915 -4.096 1.00 31.32 C ATOM 2199 CG GLU B1042 19.850 12.375 -5.102 1.00 57.17 C ATOM 2200 CD GLU B1042 20.162 13.853 -4.950 1.00 74.98 C ATOM 2201 OE1 GLU B1042 20.402 14.340 -3.820 1.00 73.80 O ATOM 2202 OE2 GLU B1042 20.161 14.541 -6.000 1.00 77.99 O ATOM 0 H GLU B1042 17.362 10.632 -2.463 1.00 25.64 H new ATOM 0 HA GLU B1042 17.834 10.304 -5.301 1.00 31.50 H new ATOM 0 HB2 GLU B1042 17.914 12.556 -4.167 1.00 31.32 H new ATOM 0 HB3 GLU B1042 19.181 12.016 -3.082 1.00 31.32 H new ATOM 0 HG2 GLU B1042 20.762 11.794 -4.963 1.00 57.17 H new ATOM 0 HG3 GLU B1042 19.498 12.179 -6.115 1.00 57.17 H new ATOM 2209 N PRO B1043 20.272 8.974 -3.544 1.00 29.79 N ATOM 2210 CA PRO B1043 21.425 8.119 -3.681 1.00 36.42 C ATOM 2211 C PRO B1043 21.013 6.729 -4.197 1.00 33.29 C ATOM 2212 O PRO B1043 21.755 6.055 -4.857 1.00 30.38 O ATOM 2213 CB PRO B1043 22.069 8.006 -2.307 1.00 34.61 C ATOM 2214 CG PRO B1043 21.003 8.371 -1.331 1.00 37.50 C ATOM 2215 CD PRO B1043 20.070 9.283 -2.122 1.00 31.71 C ATOM 0 HA PRO B1043 22.126 8.538 -4.403 1.00 36.42 H new ATOM 0 HB2 PRO B1043 22.434 6.995 -2.128 1.00 34.61 H new ATOM 0 HB3 PRO B1043 22.925 8.675 -2.220 1.00 34.61 H new ATOM 0 HG2 PRO B1043 20.480 7.488 -0.963 1.00 37.50 H new ATOM 0 HG3 PRO B1043 21.417 8.882 -0.461 1.00 37.50 H new ATOM 0 HD2 PRO B1043 19.032 9.116 -1.835 1.00 31.71 H new ATOM 0 HD3 PRO B1043 20.292 10.331 -1.920 1.00 31.71 H new ATOM 2223 N LEU B1044 19.698 6.350 -3.874 1.00 27.43 N ATOM 2224 CA LEU B1044 19.299 5.060 -4.432 1.00 28.58 C ATOM 2225 C LEU B1044 19.161 5.125 -5.928 1.00 29.19 C ATOM 2226 O LEU B1044 19.670 4.198 -6.662 1.00 28.66 O ATOM 2227 CB LEU B1044 17.969 4.579 -3.787 1.00 26.19 C ATOM 2228 CG LEU B1044 18.168 4.426 -2.256 1.00 31.45 C ATOM 2229 CD1 LEU B1044 16.864 4.215 -1.448 1.00 30.59 C ATOM 2230 CD2 LEU B1044 18.991 3.195 -1.935 1.00 38.03 C ATOM 0 H LEU B1044 19.018 6.862 -3.312 1.00 27.43 H new ATOM 0 HA LEU B1044 20.085 4.341 -4.201 1.00 28.58 H new ATOM 0 HB2 LEU B1044 17.172 5.294 -3.992 1.00 26.19 H new ATOM 0 HB3 LEU B1044 17.663 3.628 -4.223 1.00 26.19 H new ATOM 0 HG LEU B1044 18.641 5.367 -1.976 1.00 31.45 H new ATOM 0 HD11 LEU B1044 17.104 4.119 -0.389 1.00 30.59 H new ATOM 0 HD12 LEU B1044 16.203 5.069 -1.594 1.00 30.59 H new ATOM 0 HD13 LEU B1044 16.366 3.308 -1.791 1.00 30.59 H new ATOM 0 HD21 LEU B1044 19.115 3.112 -0.855 1.00 38.03 H new ATOM 0 HD22 LEU B1044 18.481 2.308 -2.311 1.00 38.03 H new ATOM 0 HD23 LEU B1044 19.970 3.278 -2.407 1.00 38.03 H new ATOM 2242 N HIS B1045 18.472 6.177 -6.403 1.00 23.52 N ATOM 2243 CA HIS B1045 18.411 6.329 -7.828 1.00 23.47 C ATOM 2244 C HIS B1045 19.832 6.509 -8.464 1.00 24.08 C ATOM 2245 O HIS B1045 20.121 6.067 -9.577 1.00 28.46 O ATOM 2246 CB HIS B1045 17.525 7.517 -8.247 1.00 20.28 C ATOM 2247 CG HIS B1045 16.044 7.115 -8.011 1.00 24.83 C ATOM 2248 ND1 HIS B1045 15.351 6.254 -8.844 1.00 20.63 N ATOM 2249 CD2 HIS B1045 15.213 7.614 -7.058 1.00 24.26 C ATOM 2250 CE1 HIS B1045 14.092 6.165 -8.356 1.00 21.91 C ATOM 2251 NE2 HIS B1045 13.983 6.959 -7.279 1.00 22.72 N ATOM 0 H HIS B1045 17.986 6.881 -5.848 1.00 23.52 H new ATOM 0 HA HIS B1045 17.968 5.406 -8.201 1.00 23.47 H new ATOM 0 HB2 HIS B1045 17.777 8.404 -7.666 1.00 20.28 H new ATOM 0 HB3 HIS B1045 17.690 7.765 -9.295 1.00 20.28 H new ATOM 0 HD1 HIS B1045 15.719 5.778 -9.668 1.00 20.63 H new ATOM 0 HD2 HIS B1045 15.443 8.348 -6.300 1.00 24.26 H new ATOM 0 HE1 HIS B1045 13.302 5.554 -8.767 1.00 21.91 H new ATOM 2259 N ALA B1046 20.642 7.224 -7.790 1.00 29.28 N ATOM 2260 CA ALA B1046 22.020 7.510 -8.422 1.00 33.73 C ATOM 2261 C ALA B1046 22.765 6.210 -8.548 1.00 28.26 C ATOM 2262 O ALA B1046 23.531 6.131 -9.533 1.00 30.49 O ATOM 2263 CB ALA B1046 22.790 8.497 -7.599 1.00 31.39 C ATOM 0 H ALA B1046 20.469 7.628 -6.870 1.00 29.28 H new ATOM 0 HA ALA B1046 21.889 7.952 -9.410 1.00 33.73 H new ATOM 0 HB1 ALA B1046 23.758 8.683 -8.065 1.00 31.39 H new ATOM 0 HB2 ALA B1046 22.233 9.432 -7.536 1.00 31.39 H new ATOM 0 HB3 ALA B1046 22.941 8.096 -6.597 1.00 31.39 H new ATOM 2269 N MET B1047 22.623 5.298 -7.599 1.00 26.84 N ATOM 2270 CA MET B1047 23.197 3.953 -7.936 1.00 33.09 C ATOM 2271 C MET B1047 22.594 3.272 -9.103 1.00 37.31 C ATOM 2272 O MET B1047 23.358 2.693 -9.933 1.00 42.38 O ATOM 2273 CB MET B1047 23.222 3.373 -6.564 1.00 42.35 C ATOM 2274 CG MET B1047 23.670 1.896 -6.485 1.00 65.63 C ATOM 2275 SD MET B1047 22.728 1.353 -5.049 1.00 79.24 S ATOM 2276 CE MET B1047 21.131 0.996 -5.827 1.00 83.57 C ATOM 0 H MET B1047 22.177 5.411 -6.689 1.00 26.84 H new ATOM 0 HA MET B1047 24.185 3.893 -8.392 1.00 33.09 H new ATOM 0 HB2 MET B1047 23.889 3.973 -5.945 1.00 42.35 H new ATOM 0 HB3 MET B1047 22.225 3.458 -6.132 1.00 42.35 H new ATOM 0 HG2 MET B1047 23.416 1.336 -7.385 1.00 65.63 H new ATOM 0 HG3 MET B1047 24.745 1.795 -6.339 1.00 65.63 H new ATOM 0 HE1 MET B1047 20.382 1.696 -5.457 1.00 83.57 H new ATOM 0 HE2 MET B1047 21.222 1.100 -6.908 1.00 83.57 H new ATOM 0 HE3 MET B1047 20.828 -0.022 -5.584 1.00 83.57 H new ATOM 2286 N MET B1048 21.295 3.210 -9.367 1.00 33.07 N ATOM 2287 CA MET B1048 20.777 2.654 -10.603 1.00 33.61 C ATOM 2288 C MET B1048 21.398 3.389 -11.792 1.00 45.57 C ATOM 2289 O MET B1048 21.751 2.731 -12.756 1.00 37.65 O ATOM 2290 CB MET B1048 19.262 2.645 -10.792 1.00 30.88 C ATOM 2291 CG MET B1048 18.617 2.323 -9.455 1.00 26.56 C ATOM 2292 SD MET B1048 18.974 0.600 -9.027 1.00 30.91 S ATOM 2293 CE MET B1048 18.050 -0.175 -10.354 1.00 30.17 C ATOM 0 H MET B1048 20.574 3.545 -8.728 1.00 33.07 H new ATOM 0 HA MET B1048 21.058 1.603 -10.543 1.00 33.61 H new ATOM 0 HB2 MET B1048 18.919 3.614 -11.156 1.00 30.88 H new ATOM 0 HB3 MET B1048 18.977 1.905 -11.539 1.00 30.88 H new ATOM 0 HG2 MET B1048 19.000 2.990 -8.682 1.00 26.56 H new ATOM 0 HG3 MET B1048 17.540 2.482 -9.509 1.00 26.56 H new ATOM 0 HE1 MET B1048 17.684 -1.147 -10.023 1.00 30.17 H new ATOM 0 HE2 MET B1048 17.205 0.457 -10.627 1.00 30.17 H new ATOM 0 HE3 MET B1048 18.699 -0.307 -11.220 1.00 30.17 H new ATOM 2303 N GLU B1049 21.457 4.728 -11.713 1.00 40.66 N ATOM 2304 CA GLU B1049 22.067 5.474 -12.821 1.00 54.52 C ATOM 2305 C GLU B1049 23.463 4.969 -13.179 1.00 44.61 C ATOM 2306 O GLU B1049 23.858 4.877 -14.368 1.00 44.95 O ATOM 2307 CB GLU B1049 22.117 6.981 -12.514 1.00 59.48 C ATOM 2308 CG GLU B1049 23.169 7.773 -13.270 1.00 66.34 C ATOM 2309 CD GLU B1049 23.401 9.189 -12.783 1.00 74.83 C ATOM 2310 OE1 GLU B1049 22.850 9.676 -11.775 1.00 59.47 O ATOM 2311 OE2 GLU B1049 24.191 9.872 -13.480 1.00 75.24 O ATOM 0 H GLU B1049 21.110 5.291 -10.937 1.00 40.66 H new ATOM 0 HA GLU B1049 21.427 5.305 -13.687 1.00 54.52 H new ATOM 0 HB2 GLU B1049 21.139 7.410 -12.733 1.00 59.48 H new ATOM 0 HB3 GLU B1049 22.290 7.110 -11.446 1.00 59.48 H new ATOM 0 HG2 GLU B1049 24.113 7.231 -13.217 1.00 66.34 H new ATOM 0 HG3 GLU B1049 22.882 7.812 -14.321 1.00 66.34 H new ATOM 2318 N ARG B1050 24.244 4.645 -12.185 1.00 41.00 N ATOM 2319 CA ARG B1050 25.594 4.148 -12.516 1.00 58.65 C ATOM 2320 C ARG B1050 25.522 2.822 -13.260 1.00 58.19 C ATOM 2321 O ARG B1050 26.505 2.542 -13.912 1.00 56.57 O ATOM 2322 CB ARG B1050 26.500 3.907 -11.325 1.00 69.46 C ATOM 2323 CG ARG B1050 26.288 4.663 -10.064 1.00 82.62 C ATOM 2324 CD ARG B1050 27.244 5.775 -9.710 1.00 88.40 C ATOM 2325 NE ARG B1050 26.819 7.078 -10.239 1.00 91.25 N ATOM 2326 CZ ARG B1050 27.075 7.444 -11.500 1.00 82.38 C ATOM 2327 NH1 ARG B1050 27.741 6.568 -12.265 1.00 72.14 N ATOM 2328 NH2 ARG B1050 26.675 8.640 -11.943 1.00 73.14 N ATOM 0 H ARG B1050 24.011 4.702 -11.194 1.00 41.00 H new ATOM 0 HA ARG B1050 26.016 4.951 -13.120 1.00 58.65 H new ATOM 0 HB2 ARG B1050 26.439 2.846 -11.081 1.00 69.46 H new ATOM 0 HB3 ARG B1050 27.522 4.101 -11.651 1.00 69.46 H new ATOM 0 HG2 ARG B1050 25.286 5.090 -10.100 1.00 82.62 H new ATOM 0 HG3 ARG B1050 26.299 3.945 -9.244 1.00 82.62 H new ATOM 0 HD2 ARG B1050 27.334 5.840 -8.626 1.00 88.40 H new ATOM 0 HD3 ARG B1050 28.234 5.535 -10.098 1.00 88.40 H new ATOM 0 HE ARG B1050 26.315 7.721 -9.628 1.00 91.25 H new ATOM 0 HH11 ARG B1050 28.029 5.669 -11.879 1.00 72.14 H new ATOM 0 HH12 ARG B1050 27.960 6.800 -13.234 1.00 72.14 H new ATOM 0 HH21 ARG B1050 26.175 9.274 -11.320 1.00 73.14 H new ATOM 0 HH22 ARG B1050 26.870 8.919 -12.904 1.00 73.14 H new ATOM 2341 N GLY B1051 24.563 1.940 -13.024 1.00 53.21 N ATOM 2342 CA GLY B1051 24.445 0.700 -13.791 1.00 37.28 C ATOM 2343 C GLY B1051 24.751 -0.529 -12.963 1.00 40.40 C ATOM 2344 O GLY B1051 25.493 -0.431 -11.986 1.00 34.42 O ATOM 0 H GLY B1051 23.850 2.057 -12.304 1.00 53.21 H new ATOM 0 HA2 GLY B1051 23.435 0.620 -14.193 1.00 37.28 H new ATOM 0 HA3 GLY B1051 25.124 0.738 -14.643 1.00 37.28 H new ATOM 2348 N PRO B1052 24.200 -1.723 -13.256 1.00 38.93 N ATOM 2349 CA PRO B1052 24.446 -2.901 -12.506 1.00 35.44 C ATOM 2350 C PRO B1052 25.862 -3.420 -12.715 1.00 33.67 C ATOM 2351 O PRO B1052 26.425 -3.311 -13.824 1.00 38.07 O ATOM 2352 CB PRO B1052 23.345 -3.863 -13.131 1.00 33.50 C ATOM 2353 CG PRO B1052 23.110 -3.401 -14.513 1.00 33.70 C ATOM 2354 CD PRO B1052 23.385 -1.936 -14.512 1.00 40.63 C ATOM 0 HA PRO B1052 24.381 -2.783 -11.424 1.00 35.44 H new ATOM 0 HB2 PRO B1052 23.686 -4.898 -13.122 1.00 33.50 H new ATOM 0 HB3 PRO B1052 22.424 -3.826 -12.549 1.00 33.50 H new ATOM 0 HG2 PRO B1052 23.764 -3.920 -15.214 1.00 33.70 H new ATOM 0 HG3 PRO B1052 22.085 -3.605 -14.823 1.00 33.70 H new ATOM 0 HD2 PRO B1052 23.935 -1.632 -15.402 1.00 40.63 H new ATOM 0 HD3 PRO B1052 22.462 -1.356 -14.494 1.00 40.63 H new ATOM 2362 N GLN B1053 26.542 -3.923 -11.737 1.00 34.06 N ATOM 2363 CA GLN B1053 27.856 -4.536 -11.878 1.00 49.45 C ATOM 2364 C GLN B1053 27.961 -5.997 -11.388 1.00 44.74 C ATOM 2365 O GLN B1053 28.956 -6.549 -11.308 1.00 43.81 O ATOM 2366 CB GLN B1053 28.850 -3.818 -10.969 1.00 63.12 C ATOM 2367 CG GLN B1053 28.915 -2.325 -11.108 1.00 76.62 C ATOM 2368 CD GLN B1053 30.207 -1.843 -10.412 1.00 73.24 C ATOM 2369 OE1 GLN B1053 30.528 -2.245 -9.289 1.00 57.39 O ATOM 2370 NE2 GLN B1053 30.736 -1.019 -11.297 1.00 55.29 N ATOM 0 H GLN B1053 26.200 -3.927 -10.776 1.00 34.06 H new ATOM 0 HA GLN B1053 28.050 -4.478 -12.949 1.00 49.45 H new ATOM 0 HB2 GLN B1053 28.602 -4.055 -9.935 1.00 63.12 H new ATOM 0 HB3 GLN B1053 29.844 -4.224 -11.160 1.00 63.12 H new ATOM 0 HG2 GLN B1053 28.918 -2.039 -12.160 1.00 76.62 H new ATOM 0 HG3 GLN B1053 28.040 -1.860 -10.654 1.00 76.62 H new ATOM 0 HE21 GLN B1053 30.259 -0.847 -12.182 1.00 55.29 H new ATOM 0 HE22 GLN B1053 31.621 -0.554 -11.096 1.00 55.29 H new ATOM 2379 N THR B1054 26.823 -6.565 -10.899 1.00 32.28 N ATOM 2380 CA THR B1054 26.761 -7.980 -10.614 1.00 26.85 C ATOM 2381 C THR B1054 25.579 -8.641 -11.322 1.00 29.46 C ATOM 2382 O THR B1054 24.647 -7.976 -11.906 1.00 29.63 O ATOM 2383 CB THR B1054 26.686 -8.430 -9.174 1.00 29.96 C ATOM 2384 OG1 THR B1054 25.342 -7.881 -8.641 1.00 28.42 O ATOM 2385 CG2 THR B1054 27.734 -7.767 -8.212 1.00 36.06 C ATOM 0 H THR B1054 25.963 -6.053 -10.705 1.00 32.28 H new ATOM 0 HA THR B1054 27.739 -8.292 -10.981 1.00 26.85 H new ATOM 0 HB THR B1054 26.838 -9.509 -9.178 1.00 29.96 H new ATOM 0 HG1 THR B1054 25.231 -8.142 -7.703 1.00 28.42 H new ATOM 0 HG21 THR B1054 27.598 -8.155 -7.203 1.00 36.06 H new ATOM 0 HG22 THR B1054 28.742 -7.998 -8.557 1.00 36.06 H new ATOM 0 HG23 THR B1054 27.591 -6.686 -8.207 1.00 36.06 H new ATOM 2393 N LEU B1055 25.609 -9.957 -11.425 1.00 30.80 N ATOM 2394 CA LEU B1055 24.408 -10.664 -12.026 1.00 30.52 C ATOM 2395 C LEU B1055 23.127 -10.306 -11.188 1.00 26.19 C ATOM 2396 O LEU B1055 22.085 -10.089 -11.811 1.00 27.61 O ATOM 2397 CB LEU B1055 24.557 -12.179 -11.968 1.00 29.93 C ATOM 2398 CG LEU B1055 25.697 -12.756 -12.864 1.00 31.93 C ATOM 2399 CD1 LEU B1055 25.968 -14.219 -12.591 1.00 38.60 C ATOM 2400 CD2 LEU B1055 25.461 -12.444 -14.306 1.00 38.70 C ATOM 0 H LEU B1055 26.380 -10.558 -11.133 1.00 30.80 H new ATOM 0 HA LEU B1055 24.328 -10.341 -13.064 1.00 30.52 H new ATOM 0 HB2 LEU B1055 24.741 -12.473 -10.935 1.00 29.93 H new ATOM 0 HB3 LEU B1055 23.613 -12.635 -12.266 1.00 29.93 H new ATOM 0 HG LEU B1055 26.622 -12.249 -12.589 1.00 31.93 H new ATOM 0 HD11 LEU B1055 26.770 -14.568 -13.242 1.00 38.60 H new ATOM 0 HD12 LEU B1055 26.265 -14.346 -11.550 1.00 38.60 H new ATOM 0 HD13 LEU B1055 25.065 -14.799 -12.784 1.00 38.60 H new ATOM 0 HD21 LEU B1055 26.272 -12.859 -14.905 1.00 38.70 H new ATOM 0 HD22 LEU B1055 24.515 -12.882 -14.623 1.00 38.70 H new ATOM 0 HD23 LEU B1055 25.425 -11.363 -14.443 1.00 38.70 H new ATOM 2412 N LYS B1056 23.161 -10.329 -9.868 1.00 30.18 N ATOM 2413 CA LYS B1056 22.079 -10.018 -8.959 1.00 25.81 C ATOM 2414 C LYS B1056 21.660 -8.542 -9.090 1.00 34.09 C ATOM 2415 O LYS B1056 20.403 -8.205 -9.062 1.00 28.99 O ATOM 2416 CB LYS B1056 22.252 -10.318 -7.522 1.00 27.86 C ATOM 2417 CG LYS B1056 22.081 -11.836 -7.280 1.00 35.57 C ATOM 2418 CD LYS B1056 22.126 -11.896 -5.699 1.00 35.29 C ATOM 2419 CE LYS B1056 22.116 -13.362 -5.201 1.00 43.54 C ATOM 2420 NZ LYS B1056 23.515 -13.922 -5.537 1.00 50.36 N ATOM 0 H LYS B1056 24.012 -10.586 -9.368 1.00 30.18 H new ATOM 0 HA LYS B1056 21.313 -10.717 -9.294 1.00 25.81 H new ATOM 0 HB2 LYS B1056 23.239 -9.996 -7.190 1.00 27.86 H new ATOM 0 HB3 LYS B1056 21.521 -9.762 -6.934 1.00 27.86 H new ATOM 0 HG2 LYS B1056 21.140 -12.214 -7.681 1.00 35.57 H new ATOM 0 HG3 LYS B1056 22.880 -12.419 -7.738 1.00 35.57 H new ATOM 0 HD2 LYS B1056 23.022 -11.391 -5.337 1.00 35.29 H new ATOM 0 HD3 LYS B1056 21.270 -11.362 -5.286 1.00 35.29 H new ATOM 0 HE2 LYS B1056 21.921 -13.411 -4.130 1.00 43.54 H new ATOM 0 HE3 LYS B1056 21.334 -13.939 -5.694 1.00 43.54 H new ATOM 0 HZ1 LYS B1056 23.415 -14.786 -6.108 1.00 50.36 H new ATOM 0 HZ2 LYS B1056 24.053 -13.212 -6.074 1.00 50.36 H new ATOM 0 HZ3 LYS B1056 24.020 -14.146 -4.656 1.00 50.36 H new ATOM 2433 N GLU B1057 22.573 -7.696 -9.393 1.00 31.26 N ATOM 2434 CA GLU B1057 22.232 -6.266 -9.604 1.00 27.38 C ATOM 2435 C GLU B1057 21.496 -6.165 -10.940 1.00 28.95 C ATOM 2436 O GLU B1057 20.600 -5.407 -11.173 1.00 23.82 O ATOM 2437 CB GLU B1057 23.413 -5.263 -9.555 1.00 23.90 C ATOM 2438 CG GLU B1057 23.906 -5.068 -8.078 1.00 23.72 C ATOM 2439 CD GLU B1057 25.232 -4.331 -8.056 1.00 33.39 C ATOM 2440 OE1 GLU B1057 25.724 -3.908 -9.153 1.00 32.77 O ATOM 2441 OE2 GLU B1057 25.714 -4.151 -6.907 1.00 25.04 O ATOM 0 H GLU B1057 23.560 -7.926 -9.508 1.00 31.26 H new ATOM 0 HA GLU B1057 21.615 -5.964 -8.757 1.00 27.38 H new ATOM 0 HB2 GLU B1057 24.233 -5.627 -10.174 1.00 23.90 H new ATOM 0 HB3 GLU B1057 23.102 -4.305 -9.970 1.00 23.90 H new ATOM 0 HG2 GLU B1057 23.162 -4.509 -7.511 1.00 23.72 H new ATOM 0 HG3 GLU B1057 24.014 -6.038 -7.593 1.00 23.72 H new ATOM 2448 N THR B1058 22.015 -6.998 -11.911 1.00 25.96 N ATOM 2449 CA THR B1058 21.463 -6.895 -13.284 1.00 30.59 C ATOM 2450 C THR B1058 19.985 -7.415 -13.291 1.00 22.07 C ATOM 2451 O THR B1058 19.151 -6.862 -13.997 1.00 24.50 O ATOM 2452 CB THR B1058 22.254 -7.790 -14.270 1.00 39.10 C ATOM 2453 OG1 THR B1058 23.543 -7.154 -14.432 1.00 35.61 O ATOM 2454 CG2 THR B1058 21.648 -8.014 -15.673 1.00 25.50 C ATOM 0 H THR B1058 22.753 -7.688 -11.774 1.00 25.96 H new ATOM 0 HA THR B1058 21.528 -5.850 -13.588 1.00 30.59 H new ATOM 0 HB THR B1058 22.268 -8.788 -13.831 1.00 39.10 H new ATOM 0 HG1 THR B1058 24.093 -7.323 -13.639 1.00 35.61 H new ATOM 0 HG21 THR B1058 22.307 -8.659 -16.255 1.00 25.50 H new ATOM 0 HG22 THR B1058 20.671 -8.487 -15.576 1.00 25.50 H new ATOM 0 HG23 THR B1058 21.538 -7.055 -16.179 1.00 25.50 H new ATOM 2462 N SER B1059 19.791 -8.489 -12.570 1.00 21.62 N ATOM 2463 CA SER B1059 18.383 -9.073 -12.651 1.00 32.16 C ATOM 2464 C SER B1059 17.465 -8.118 -11.837 1.00 31.57 C ATOM 2465 O SER B1059 16.345 -7.945 -12.272 1.00 22.99 O ATOM 2466 CB SER B1059 18.384 -10.517 -12.216 1.00 27.19 C ATOM 2467 OG SER B1059 18.808 -10.584 -10.856 1.00 27.33 O ATOM 0 H SER B1059 20.467 -8.966 -11.973 1.00 21.62 H new ATOM 0 HA SER B1059 17.992 -9.119 -13.667 1.00 32.16 H new ATOM 0 HB2 SER B1059 17.387 -10.945 -12.323 1.00 27.19 H new ATOM 0 HB3 SER B1059 19.051 -11.102 -12.849 1.00 27.19 H new ATOM 0 HG SER B1059 18.812 -11.518 -10.560 1.00 27.33 H new ATOM 2473 N PHE B1060 17.927 -7.503 -10.732 1.00 18.78 N ATOM 2474 CA PHE B1060 17.097 -6.508 -10.043 1.00 25.58 C ATOM 2475 C PHE B1060 16.804 -5.331 -10.992 1.00 26.82 C ATOM 2476 O PHE B1060 15.634 -4.941 -11.145 1.00 23.37 O ATOM 2477 CB PHE B1060 17.797 -6.036 -8.771 1.00 23.09 C ATOM 2478 CG PHE B1060 16.989 -4.947 -8.079 1.00 27.61 C ATOM 2479 CD1 PHE B1060 17.014 -3.618 -8.490 1.00 28.42 C ATOM 2480 CD2 PHE B1060 16.217 -5.311 -7.000 1.00 31.86 C ATOM 2481 CE1 PHE B1060 16.241 -2.678 -7.798 1.00 25.68 C ATOM 2482 CE2 PHE B1060 15.465 -4.399 -6.263 1.00 31.35 C ATOM 2483 CZ PHE B1060 15.487 -3.080 -6.714 1.00 27.08 C ATOM 0 H PHE B1060 18.841 -7.672 -10.311 1.00 18.78 H new ATOM 0 HA PHE B1060 16.147 -6.958 -9.755 1.00 25.58 H new ATOM 0 HB2 PHE B1060 17.935 -6.878 -8.093 1.00 23.09 H new ATOM 0 HB3 PHE B1060 18.790 -5.658 -9.016 1.00 23.09 H new ATOM 0 HD1 PHE B1060 17.621 -3.316 -9.331 1.00 28.42 H new ATOM 0 HD2 PHE B1060 16.193 -6.351 -6.711 1.00 31.86 H new ATOM 0 HE1 PHE B1060 16.235 -1.644 -8.111 1.00 25.68 H new ATOM 0 HE2 PHE B1060 14.898 -4.696 -5.393 1.00 31.35 H new ATOM 0 HZ PHE B1060 14.891 -2.344 -6.195 1.00 27.08 H new ATOM 2493 N ASN B1061 17.819 -4.867 -11.718 1.00 21.57 N ATOM 2494 CA ASN B1061 17.585 -3.775 -12.682 1.00 27.76 C ATOM 2495 C ASN B1061 16.670 -4.199 -13.796 1.00 24.44 C ATOM 2496 O ASN B1061 15.771 -3.405 -14.172 1.00 23.06 O ATOM 2497 CB ASN B1061 18.995 -3.402 -13.310 1.00 27.28 C ATOM 2498 CG ASN B1061 18.947 -2.237 -14.226 1.00 27.95 C ATOM 2499 OD1 ASN B1061 18.454 -1.115 -13.666 1.00 38.09 O flip ATOM 2500 ND2 ASN B1061 19.305 -2.288 -15.395 1.00 24.03 N flip ATOM 0 H ASN B1061 18.779 -5.209 -11.668 1.00 21.57 H new ATOM 0 HA ASN B1061 17.118 -2.935 -12.167 1.00 27.76 H new ATOM 0 HB2 ASN B1061 19.698 -3.191 -12.504 1.00 27.28 H new ATOM 0 HB3 ASN B1061 19.381 -4.265 -13.853 1.00 27.28 H new ATOM 0 HD21 ASN B1061 19.673 -3.159 -15.778 1.00 24.03 H new ATOM 0 HD22 ASN B1061 19.236 -1.460 -15.986 1.00 24.03 H new ATOM 2507 N GLN B1062 16.814 -5.404 -14.360 1.00 25.16 N ATOM 2508 CA GLN B1062 15.811 -5.903 -15.326 1.00 26.91 C ATOM 2509 C GLN B1062 14.296 -5.905 -14.809 1.00 21.48 C ATOM 2510 O GLN B1062 13.420 -5.493 -15.608 1.00 22.58 O ATOM 2511 CB GLN B1062 16.203 -7.315 -15.704 1.00 28.08 C ATOM 2512 CG GLN B1062 17.526 -7.256 -16.577 1.00 27.17 C ATOM 2513 CD GLN B1062 18.028 -8.668 -16.770 1.00 26.06 C ATOM 2514 OE1 GLN B1062 17.764 -9.559 -16.023 1.00 22.89 O ATOM 2515 NE2 GLN B1062 18.887 -8.848 -17.794 1.00 26.66 N ATOM 0 H GLN B1062 17.589 -6.041 -14.176 1.00 25.16 H new ATOM 0 HA GLN B1062 15.822 -5.211 -16.168 1.00 26.91 H new ATOM 0 HB2 GLN B1062 16.367 -7.915 -14.809 1.00 28.08 H new ATOM 0 HB3 GLN B1062 15.400 -7.793 -16.265 1.00 28.08 H new ATOM 0 HG2 GLN B1062 17.325 -6.789 -17.541 1.00 27.17 H new ATOM 0 HG3 GLN B1062 18.282 -6.648 -16.080 1.00 27.17 H new ATOM 0 HE21 GLN B1062 19.100 -8.074 -18.423 1.00 26.66 H new ATOM 0 HE22 GLN B1062 19.323 -9.758 -17.940 1.00 26.66 H new ATOM 2524 N ALA B1063 14.116 -6.364 -13.567 1.00 16.15 N ATOM 2525 CA ALA B1063 12.725 -6.444 -13.093 1.00 24.35 C ATOM 2526 C ALA B1063 12.167 -5.102 -12.644 1.00 28.68 C ATOM 2527 O ALA B1063 10.970 -4.955 -12.775 1.00 28.65 O ATOM 2528 CB ALA B1063 12.557 -7.389 -11.877 1.00 22.38 C ATOM 0 H ALA B1063 14.843 -6.663 -12.917 1.00 16.15 H new ATOM 0 HA ALA B1063 12.186 -6.819 -13.963 1.00 24.35 H new ATOM 0 HB1 ALA B1063 11.511 -7.407 -11.572 1.00 22.38 H new ATOM 0 HB2 ALA B1063 12.873 -8.395 -12.152 1.00 22.38 H new ATOM 0 HB3 ALA B1063 13.170 -7.030 -11.050 1.00 22.38 H new ATOM 2534 N TYR B1064 12.971 -4.265 -11.971 1.00 18.77 N ATOM 2535 CA TYR B1064 12.416 -3.052 -11.350 1.00 22.48 C ATOM 2536 C TYR B1064 13.010 -1.779 -11.947 1.00 24.94 C ATOM 2537 O TYR B1064 12.468 -0.720 -11.479 1.00 27.28 O ATOM 2538 CB TYR B1064 12.688 -3.089 -9.834 1.00 20.80 C ATOM 2539 CG TYR B1064 12.276 -4.400 -9.141 1.00 24.03 C ATOM 2540 CD1 TYR B1064 10.949 -4.748 -9.104 1.00 33.03 C ATOM 2541 CD2 TYR B1064 13.205 -5.253 -8.562 1.00 22.51 C ATOM 2542 CE1 TYR B1064 10.541 -5.933 -8.497 1.00 42.11 C ATOM 2543 CE2 TYR B1064 12.827 -6.410 -7.929 1.00 35.61 C ATOM 2544 CZ TYR B1064 11.484 -6.754 -7.885 1.00 36.92 C ATOM 2545 OH TYR B1064 11.052 -7.862 -7.260 1.00 40.05 O ATOM 0 H TYR B1064 13.974 -4.397 -11.845 1.00 18.77 H new ATOM 0 HA TYR B1064 11.344 -3.036 -11.544 1.00 22.48 H new ATOM 0 HB2 TYR B1064 13.752 -2.923 -9.665 1.00 20.80 H new ATOM 0 HB3 TYR B1064 12.157 -2.262 -9.363 1.00 20.80 H new ATOM 0 HD1 TYR B1064 10.213 -4.096 -9.551 1.00 33.03 H new ATOM 0 HD2 TYR B1064 14.254 -4.999 -8.611 1.00 22.51 H new ATOM 0 HE1 TYR B1064 9.498 -6.214 -8.501 1.00 42.11 H new ATOM 0 HE2 TYR B1064 13.568 -7.047 -7.469 1.00 35.61 H new ATOM 0 HH TYR B1064 11.817 -8.342 -6.879 1.00 40.05 H new ATOM 2555 N GLY B1065 13.892 -1.813 -12.921 1.00 25.66 N ATOM 2556 CA GLY B1065 14.651 -0.566 -13.270 1.00 31.31 C ATOM 2557 C GLY B1065 13.650 0.478 -13.840 1.00 26.23 C ATOM 2558 O GLY B1065 13.679 1.602 -13.519 1.00 27.22 O ATOM 0 H GLY B1065 14.117 -2.635 -13.481 1.00 25.66 H new ATOM 0 HA2 GLY B1065 15.152 -0.168 -12.387 1.00 31.31 H new ATOM 0 HA3 GLY B1065 15.426 -0.787 -14.004 1.00 31.31 H new ATOM 2562 N ARG B1066 12.863 -0.024 -14.830 1.00 24.00 N ATOM 2563 CA ARG B1066 11.928 0.892 -15.484 1.00 33.59 C ATOM 2564 C ARG B1066 10.918 1.495 -14.500 1.00 28.65 C ATOM 2565 O ARG B1066 10.624 2.714 -14.584 1.00 25.91 O ATOM 2566 CB ARG B1066 11.158 0.005 -16.516 1.00 39.88 C ATOM 2567 CG ARG B1066 10.502 0.880 -17.575 1.00 42.73 C ATOM 2568 CD ARG B1066 9.140 0.256 -17.881 1.00 65.87 C ATOM 2569 NE ARG B1066 9.113 -0.272 -19.257 1.00 81.83 N ATOM 2570 CZ ARG B1066 8.819 0.532 -20.297 1.00 83.92 C ATOM 2571 NH1 ARG B1066 8.560 1.821 -20.051 1.00 88.51 N ATOM 2572 NH2 ARG B1066 8.771 0.126 -21.564 1.00 56.11 N ATOM 0 H ARG B1066 12.861 -0.988 -15.165 1.00 24.00 H new ATOM 0 HA ARG B1066 12.464 1.729 -15.932 1.00 33.59 H new ATOM 0 HB2 ARG B1066 11.846 -0.696 -16.988 1.00 39.88 H new ATOM 0 HB3 ARG B1066 10.400 -0.588 -16.003 1.00 39.88 H new ATOM 0 HG2 ARG B1066 10.387 1.902 -17.215 1.00 42.73 H new ATOM 0 HG3 ARG B1066 11.117 0.926 -18.474 1.00 42.73 H new ATOM 0 HD2 ARG B1066 8.933 -0.546 -17.173 1.00 65.87 H new ATOM 0 HD3 ARG B1066 8.355 1.002 -17.756 1.00 65.87 H new ATOM 0 HE ARG B1066 9.319 -1.257 -19.423 1.00 81.83 H new ATOM 0 HH11 ARG B1066 8.588 2.173 -19.094 1.00 88.51 H new ATOM 0 HH12 ARG B1066 8.335 2.452 -20.820 1.00 88.51 H new ATOM 0 HH21 ARG B1066 8.964 -0.849 -21.795 1.00 56.11 H new ATOM 0 HH22 ARG B1066 8.541 0.790 -22.304 1.00 56.11 H new ATOM 2585 N ASP B1067 10.305 0.703 -13.597 1.00 24.59 N ATOM 2586 CA ASP B1067 9.369 1.295 -12.623 1.00 26.07 C ATOM 2587 C ASP B1067 10.072 2.355 -11.780 1.00 28.62 C ATOM 2588 O ASP B1067 9.408 3.380 -11.425 1.00 24.73 O ATOM 2589 CB ASP B1067 8.728 0.266 -11.657 1.00 23.94 C ATOM 2590 CG ASP B1067 7.757 -0.618 -12.392 1.00 31.94 C ATOM 2591 OD1 ASP B1067 7.204 -0.282 -13.453 1.00 32.44 O ATOM 2592 OD2 ASP B1067 7.471 -1.739 -11.945 1.00 40.94 O ATOM 0 H ASP B1067 10.433 -0.306 -13.522 1.00 24.59 H new ATOM 0 HA ASP B1067 8.571 1.729 -13.226 1.00 26.07 H new ATOM 0 HB2 ASP B1067 9.506 -0.343 -11.197 1.00 23.94 H new ATOM 0 HB3 ASP B1067 8.214 0.788 -10.850 1.00 23.94 H new ATOM 2597 N LEU B1068 11.314 2.026 -11.322 1.00 25.06 N ATOM 2598 CA LEU B1068 11.969 2.996 -10.452 1.00 24.71 C ATOM 2599 C LEU B1068 12.332 4.258 -11.217 1.00 22.10 C ATOM 2600 O LEU B1068 12.113 5.407 -10.728 1.00 22.09 O ATOM 2601 CB LEU B1068 13.247 2.249 -9.767 1.00 24.19 C ATOM 2602 CG LEU B1068 12.925 1.261 -8.699 1.00 23.08 C ATOM 2603 CD1 LEU B1068 14.203 0.434 -8.295 1.00 22.35 C ATOM 2604 CD2 LEU B1068 12.365 1.924 -7.395 1.00 22.34 C ATOM 0 H LEU B1068 11.830 1.170 -11.527 1.00 25.06 H new ATOM 0 HA LEU B1068 11.302 3.337 -9.660 1.00 24.71 H new ATOM 0 HB2 LEU B1068 13.808 1.739 -10.550 1.00 24.19 H new ATOM 0 HB3 LEU B1068 13.905 3.009 -9.346 1.00 24.19 H new ATOM 0 HG LEU B1068 12.156 0.617 -9.126 1.00 23.08 H new ATOM 0 HD11 LEU B1068 13.942 -0.280 -7.514 1.00 22.35 H new ATOM 0 HD12 LEU B1068 14.580 -0.102 -9.166 1.00 22.35 H new ATOM 0 HD13 LEU B1068 14.973 1.111 -7.925 1.00 22.35 H new ATOM 0 HD21 LEU B1068 12.151 1.151 -6.657 1.00 22.34 H new ATOM 0 HD22 LEU B1068 13.105 2.615 -6.992 1.00 22.34 H new ATOM 0 HD23 LEU B1068 11.449 2.468 -7.628 1.00 22.34 H new ATOM 2616 N MET B1069 12.755 4.120 -12.488 1.00 24.25 N ATOM 2617 CA MET B1069 13.031 5.290 -13.315 1.00 27.46 C ATOM 2618 C MET B1069 11.721 6.115 -13.487 1.00 30.20 C ATOM 2619 O MET B1069 11.795 7.318 -13.424 1.00 25.31 O ATOM 2620 CB MET B1069 13.534 5.072 -14.724 1.00 31.98 C ATOM 2621 CG MET B1069 14.971 4.449 -14.767 1.00 41.53 C ATOM 2622 SD MET B1069 15.618 4.476 -16.427 1.00 63.84 S ATOM 2623 CE MET B1069 14.426 5.539 -17.290 1.00 43.52 C ATOM 0 H MET B1069 12.908 3.224 -12.950 1.00 24.25 H new ATOM 0 HA MET B1069 13.839 5.772 -12.764 1.00 27.46 H new ATOM 0 HB2 MET B1069 12.843 4.417 -15.254 1.00 31.98 H new ATOM 0 HB3 MET B1069 13.540 6.024 -15.254 1.00 31.98 H new ATOM 0 HG2 MET B1069 15.634 5.005 -14.104 1.00 41.53 H new ATOM 0 HG3 MET B1069 14.939 3.423 -14.400 1.00 41.53 H new ATOM 0 HE1 MET B1069 14.696 5.608 -18.344 1.00 43.52 H new ATOM 0 HE2 MET B1069 13.427 5.114 -17.199 1.00 43.52 H new ATOM 0 HE3 MET B1069 14.439 6.535 -16.846 1.00 43.52 H new ATOM 2633 N GLU B1070 10.613 5.491 -13.785 1.00 26.59 N ATOM 2634 CA GLU B1070 9.303 6.194 -13.815 1.00 32.45 C ATOM 2635 C GLU B1070 8.936 6.847 -12.477 1.00 28.89 C ATOM 2636 O GLU B1070 8.489 8.029 -12.507 1.00 25.30 O ATOM 2637 CB GLU B1070 8.151 5.247 -14.288 1.00 32.40 C ATOM 2638 CG GLU B1070 6.889 6.112 -14.573 1.00 35.28 C ATOM 2639 CD GLU B1070 5.634 5.331 -14.941 1.00 46.34 C ATOM 2640 OE1 GLU B1070 5.682 4.124 -15.258 1.00 31.57 O ATOM 2641 OE2 GLU B1070 4.551 5.981 -14.902 1.00 41.87 O ATOM 0 H GLU B1070 10.563 4.498 -14.014 1.00 26.59 H new ATOM 0 HA GLU B1070 9.420 6.997 -14.542 1.00 32.45 H new ATOM 0 HB2 GLU B1070 8.450 4.705 -15.185 1.00 32.40 H new ATOM 0 HB3 GLU B1070 7.935 4.501 -13.523 1.00 32.40 H new ATOM 0 HG2 GLU B1070 6.676 6.716 -13.691 1.00 35.28 H new ATOM 0 HG3 GLU B1070 7.118 6.803 -15.384 1.00 35.28 H new ATOM 2648 N ALA B1071 9.166 6.197 -11.330 1.00 24.67 N ATOM 2649 CA ALA B1071 8.871 6.862 -10.030 1.00 25.05 C ATOM 2650 C ALA B1071 9.741 8.126 -9.931 1.00 30.52 C ATOM 2651 O ALA B1071 9.266 9.137 -9.474 1.00 25.97 O ATOM 2652 CB ALA B1071 9.095 5.997 -8.796 1.00 21.85 C ATOM 0 H ALA B1071 9.540 5.250 -11.260 1.00 24.67 H new ATOM 0 HA ALA B1071 7.804 7.087 -10.032 1.00 25.05 H new ATOM 0 HB1 ALA B1071 8.853 6.570 -7.901 1.00 21.85 H new ATOM 0 HB2 ALA B1071 8.454 5.117 -8.847 1.00 21.85 H new ATOM 0 HB3 ALA B1071 10.138 5.684 -8.755 1.00 21.85 H new ATOM 2658 N GLN B1072 11.070 8.026 -10.276 1.00 27.98 N ATOM 2659 CA GLN B1072 11.851 9.226 -10.343 1.00 31.46 C ATOM 2660 C GLN B1072 11.330 10.283 -11.325 1.00 29.40 C ATOM 2661 O GLN B1072 11.439 11.477 -10.939 1.00 32.33 O ATOM 2662 CB GLN B1072 13.376 8.847 -10.581 1.00 29.71 C ATOM 2663 CG GLN B1072 14.194 9.999 -11.044 1.00 44.03 C ATOM 2664 CD GLN B1072 15.616 9.566 -11.409 1.00 44.92 C ATOM 2665 OE1 GLN B1072 16.378 9.756 -10.451 1.00 43.36 O ATOM 2666 NE2 GLN B1072 15.769 9.082 -12.654 1.00 46.04 N ATOM 0 H GLN B1072 11.563 7.160 -10.493 1.00 27.98 H new ATOM 0 HA GLN B1072 11.754 9.727 -9.380 1.00 31.46 H new ATOM 0 HB2 GLN B1072 13.797 8.458 -9.654 1.00 29.71 H new ATOM 0 HB3 GLN B1072 13.435 8.046 -11.318 1.00 29.71 H new ATOM 0 HG2 GLN B1072 13.719 10.459 -11.910 1.00 44.03 H new ATOM 0 HG3 GLN B1072 14.233 10.757 -10.262 1.00 44.03 H new ATOM 0 HE21 GLN B1072 14.966 9.021 -13.280 1.00 46.04 H new ATOM 0 HE22 GLN B1072 16.688 8.776 -12.973 1.00 46.04 H new ATOM 2675 N GLU B1073 10.793 9.964 -12.538 1.00 29.81 N ATOM 2676 CA GLU B1073 10.264 11.022 -13.366 1.00 28.55 C ATOM 2677 C GLU B1073 9.075 11.714 -12.651 1.00 31.52 C ATOM 2678 O GLU B1073 9.008 12.946 -12.747 1.00 32.30 O ATOM 2679 CB GLU B1073 9.808 10.609 -14.785 1.00 35.50 C ATOM 2680 CG GLU B1073 10.996 9.900 -15.484 1.00 49.36 C ATOM 2681 CD GLU B1073 10.417 9.107 -16.669 1.00 71.21 C ATOM 2682 OE1 GLU B1073 9.511 9.607 -17.400 1.00 79.10 O ATOM 2683 OE2 GLU B1073 10.789 7.943 -16.935 1.00 66.55 O ATOM 0 H GLU B1073 10.728 9.023 -12.926 1.00 29.81 H new ATOM 0 HA GLU B1073 11.110 11.695 -13.508 1.00 28.55 H new ATOM 0 HB2 GLU B1073 8.947 9.943 -14.730 1.00 35.50 H new ATOM 0 HB3 GLU B1073 9.498 11.485 -15.355 1.00 35.50 H new ATOM 0 HG2 GLU B1073 11.730 10.628 -15.830 1.00 49.36 H new ATOM 0 HG3 GLU B1073 11.510 9.235 -14.790 1.00 49.36 H new ATOM 2690 N TRP B1074 8.188 10.964 -12.013 1.00 25.31 N ATOM 2691 CA TRP B1074 7.108 11.638 -11.266 1.00 29.34 C ATOM 2692 C TRP B1074 7.659 12.565 -10.178 1.00 24.97 C ATOM 2693 O TRP B1074 7.073 13.664 -9.967 1.00 29.02 O ATOM 2694 CB TRP B1074 6.168 10.637 -10.581 1.00 29.08 C ATOM 2695 CG TRP B1074 5.283 9.964 -11.626 1.00 31.63 C ATOM 2696 CD1 TRP B1074 5.356 8.725 -12.148 1.00 32.73 C ATOM 2697 CD2 TRP B1074 4.142 10.575 -12.294 1.00 32.10 C ATOM 2698 NE1 TRP B1074 4.403 8.499 -13.121 1.00 45.28 N ATOM 2699 CE2 TRP B1074 3.667 9.645 -13.200 1.00 37.62 C ATOM 2700 CE3 TRP B1074 3.572 11.850 -12.174 1.00 30.63 C ATOM 2701 CZ2 TRP B1074 2.538 9.878 -14.037 1.00 33.74 C ATOM 2702 CZ3 TRP B1074 2.463 12.119 -12.977 1.00 33.47 C ATOM 2703 CH2 TRP B1074 2.032 11.129 -13.831 1.00 32.36 C ATOM 0 H TRP B1074 8.180 9.944 -11.988 1.00 25.31 H new ATOM 0 HA TRP B1074 6.560 12.215 -12.011 1.00 29.34 H new ATOM 0 HB2 TRP B1074 6.749 9.887 -10.045 1.00 29.08 H new ATOM 0 HB3 TRP B1074 5.551 11.149 -9.843 1.00 29.08 H new ATOM 0 HD1 TRP B1074 6.082 7.987 -11.839 1.00 32.73 H new ATOM 0 HE1 TRP B1074 4.275 7.648 -13.669 1.00 45.28 H new ATOM 0 HE3 TRP B1074 3.971 12.588 -11.494 1.00 30.63 H new ATOM 0 HZ2 TRP B1074 2.137 9.162 -14.739 1.00 33.74 H new ATOM 0 HZ3 TRP B1074 1.959 13.073 -12.930 1.00 33.47 H new ATOM 0 HH2 TRP B1074 1.166 11.379 -14.426 1.00 32.36 H new ATOM 2714 N CYS B1075 8.654 12.002 -9.405 1.00 24.04 N ATOM 2715 CA CYS B1075 9.211 12.935 -8.374 1.00 30.36 C ATOM 2716 C CYS B1075 9.746 14.224 -9.024 1.00 30.86 C ATOM 2717 O CYS B1075 9.644 15.327 -8.492 1.00 30.76 O ATOM 2718 CB CYS B1075 10.371 12.340 -7.559 1.00 33.50 C ATOM 2719 SG CYS B1075 9.894 11.164 -6.290 1.00 37.28 S ATOM 0 H CYS B1075 9.035 11.057 -9.458 1.00 24.04 H new ATOM 0 HA CYS B1075 8.372 13.133 -7.707 1.00 30.36 H new ATOM 0 HB2 CYS B1075 11.061 11.849 -8.245 1.00 33.50 H new ATOM 0 HB3 CYS B1075 10.918 13.156 -7.087 1.00 33.50 H new ATOM 0 HG CYS B1075 10.956 10.733 -5.676 1.00 37.28 H new ATOM 2725 N ARG B1076 10.511 14.074 -10.132 1.00 28.17 N ATOM 2726 CA ARG B1076 11.033 15.248 -10.813 1.00 33.87 C ATOM 2727 C ARG B1076 9.855 16.106 -11.324 1.00 38.57 C ATOM 2728 O ARG B1076 10.039 17.362 -11.362 1.00 30.79 O ATOM 2729 CB ARG B1076 11.962 14.914 -11.960 1.00 20.09 C ATOM 2730 CG ARG B1076 13.191 14.095 -11.502 1.00 21.48 C ATOM 2731 CD ARG B1076 13.942 13.926 -12.815 1.00 34.52 C ATOM 2732 NE ARG B1076 15.165 13.272 -12.819 1.00 39.03 N ATOM 2733 CZ ARG B1076 16.322 13.093 -12.273 1.00 45.73 C ATOM 2734 NH1 ARG B1076 16.654 13.756 -11.171 1.00 36.10 N ATOM 2735 NH2 ARG B1076 17.221 12.226 -12.812 1.00 41.28 N ATOM 0 H ARG B1076 10.765 13.179 -10.550 1.00 28.17 H new ATOM 0 HA ARG B1076 11.628 15.801 -10.086 1.00 33.87 H new ATOM 0 HB2 ARG B1076 11.414 14.351 -12.716 1.00 20.09 H new ATOM 0 HB3 ARG B1076 12.299 15.837 -12.432 1.00 20.09 H new ATOM 0 HG2 ARG B1076 13.783 14.624 -10.755 1.00 21.48 H new ATOM 0 HG3 ARG B1076 12.907 13.138 -11.064 1.00 21.48 H new ATOM 0 HD2 ARG B1076 13.284 13.394 -13.502 1.00 34.52 H new ATOM 0 HD3 ARG B1076 14.101 14.921 -13.231 1.00 34.52 H new ATOM 0 HE ARG B1076 15.139 12.644 -13.622 1.00 39.03 H new ATOM 0 HH11 ARG B1076 15.994 14.411 -10.751 1.00 36.10 H new ATOM 0 HH12 ARG B1076 17.569 13.610 -10.744 1.00 36.10 H new ATOM 0 HH21 ARG B1076 16.985 11.707 -13.658 1.00 41.28 H new ATOM 0 HH22 ARG B1076 18.131 12.095 -12.370 1.00 41.28 H new ATOM 2748 N LYS B1077 8.709 15.505 -11.712 1.00 30.96 N ATOM 2749 CA LYS B1077 7.596 16.325 -12.102 1.00 36.67 C ATOM 2750 C LYS B1077 7.091 17.243 -10.991 1.00 29.89 C ATOM 2751 O LYS B1077 6.747 18.442 -11.160 1.00 29.10 O ATOM 2752 CB LYS B1077 6.364 15.557 -12.673 1.00 40.81 C ATOM 2753 CG LYS B1077 6.544 14.955 -14.052 1.00 56.13 C ATOM 2754 CD LYS B1077 5.324 14.135 -14.469 1.00 67.13 C ATOM 2755 CE LYS B1077 5.590 13.242 -15.667 1.00 72.23 C ATOM 2756 NZ LYS B1077 4.740 12.016 -15.765 1.00 68.67 N ATOM 0 H LYS B1077 8.555 14.498 -11.756 1.00 30.96 H new ATOM 0 HA LYS B1077 8.036 16.913 -12.908 1.00 36.67 H new ATOM 0 HB2 LYS B1077 6.104 14.757 -11.979 1.00 40.81 H new ATOM 0 HB3 LYS B1077 5.516 16.241 -12.703 1.00 40.81 H new ATOM 0 HG2 LYS B1077 6.715 15.750 -14.778 1.00 56.13 H new ATOM 0 HG3 LYS B1077 7.430 14.320 -14.060 1.00 56.13 H new ATOM 0 HD2 LYS B1077 5.002 13.520 -13.629 1.00 67.13 H new ATOM 0 HD3 LYS B1077 4.501 14.811 -14.702 1.00 67.13 H new ATOM 0 HE2 LYS B1077 5.451 13.831 -16.574 1.00 72.23 H new ATOM 0 HE3 LYS B1077 6.636 12.935 -15.643 1.00 72.23 H new ATOM 0 HZ1 LYS B1077 5.337 11.171 -15.666 1.00 68.67 H new ATOM 0 HZ2 LYS B1077 4.027 12.027 -15.008 1.00 68.67 H new ATOM 0 HZ3 LYS B1077 4.264 11.997 -16.689 1.00 68.67 H new ATOM 2769 N TYR B1078 7.040 16.663 -9.818 1.00 25.55 N ATOM 2770 CA TYR B1078 6.660 17.349 -8.613 1.00 28.53 C ATOM 2771 C TYR B1078 7.615 18.544 -8.235 1.00 34.96 C ATOM 2772 O TYR B1078 7.164 19.586 -7.754 1.00 27.20 O ATOM 2773 CB TYR B1078 6.654 16.348 -7.442 1.00 23.32 C ATOM 2774 CG TYR B1078 6.455 17.095 -6.135 1.00 29.49 C ATOM 2775 CD1 TYR B1078 5.257 17.665 -5.850 1.00 30.94 C ATOM 2776 CD2 TYR B1078 7.520 17.225 -5.211 1.00 26.19 C ATOM 2777 CE1 TYR B1078 5.060 18.310 -4.656 1.00 32.09 C ATOM 2778 CE2 TYR B1078 7.367 17.939 -4.064 1.00 22.52 C ATOM 2779 CZ TYR B1078 6.152 18.436 -3.763 1.00 29.67 C ATOM 2780 OH TYR B1078 5.904 19.139 -2.584 1.00 31.66 O ATOM 0 H TYR B1078 7.267 15.679 -9.673 1.00 25.55 H new ATOM 0 HA TYR B1078 5.671 17.769 -8.798 1.00 28.53 H new ATOM 0 HB2 TYR B1078 5.858 15.617 -7.580 1.00 23.32 H new ATOM 0 HB3 TYR B1078 7.593 15.796 -7.418 1.00 23.32 H new ATOM 0 HD1 TYR B1078 4.453 17.610 -6.569 1.00 30.94 H new ATOM 0 HD2 TYR B1078 8.467 16.750 -5.420 1.00 26.19 H new ATOM 0 HE1 TYR B1078 4.091 18.714 -4.402 1.00 32.09 H new ATOM 0 HE2 TYR B1078 8.206 18.105 -3.405 1.00 22.52 H new ATOM 0 HH TYR B1078 6.720 19.166 -2.041 1.00 31.66 H new ATOM 2790 N MET B1079 8.886 18.247 -8.467 1.00 25.60 N ATOM 2791 CA MET B1079 9.888 19.304 -8.166 1.00 29.79 C ATOM 2792 C MET B1079 9.510 20.535 -8.926 1.00 28.65 C ATOM 2793 O MET B1079 9.569 21.649 -8.383 1.00 35.02 O ATOM 2794 CB MET B1079 11.287 18.728 -8.476 1.00 28.97 C ATOM 2795 CG MET B1079 11.567 17.497 -7.535 1.00 35.17 C ATOM 2796 SD MET B1079 13.210 16.872 -7.963 1.00 35.60 S ATOM 2797 CE MET B1079 13.668 15.951 -6.487 1.00 46.80 C ATOM 0 H MET B1079 9.245 17.365 -8.832 1.00 25.60 H new ATOM 0 HA MET B1079 9.912 19.603 -7.118 1.00 29.79 H new ATOM 0 HB2 MET B1079 11.343 18.421 -9.520 1.00 28.97 H new ATOM 0 HB3 MET B1079 12.049 19.494 -8.328 1.00 28.97 H new ATOM 0 HG2 MET B1079 11.528 17.795 -6.487 1.00 35.17 H new ATOM 0 HG3 MET B1079 10.811 16.724 -7.675 1.00 35.17 H new ATOM 0 HE1 MET B1079 14.659 15.517 -6.622 1.00 46.80 H new ATOM 0 HE2 MET B1079 13.680 16.622 -5.628 1.00 46.80 H new ATOM 0 HE3 MET B1079 12.943 15.155 -6.315 1.00 46.80 H new ATOM 2807 N LYS B1080 9.104 20.382 -10.152 1.00 27.73 N ATOM 2808 CA LYS B1080 8.848 21.534 -10.988 1.00 39.13 C ATOM 2809 C LYS B1080 7.372 21.958 -10.803 1.00 39.79 C ATOM 2810 O LYS B1080 7.067 23.153 -10.856 1.00 37.31 O ATOM 2811 CB LYS B1080 9.069 21.256 -12.480 1.00 38.35 C ATOM 2812 CG LYS B1080 10.515 21.417 -12.943 1.00 50.34 C ATOM 2813 CD LYS B1080 10.609 20.797 -14.326 1.00 62.58 C ATOM 2814 CE LYS B1080 12.020 20.648 -14.861 1.00 65.49 C ATOM 2815 NZ LYS B1080 12.001 21.152 -16.279 1.00 70.07 N ATOM 0 H LYS B1080 8.942 19.480 -10.600 1.00 27.73 H new ATOM 0 HA LYS B1080 9.548 22.312 -10.684 1.00 39.13 H new ATOM 0 HB2 LYS B1080 8.740 20.240 -12.701 1.00 38.35 H new ATOM 0 HB3 LYS B1080 8.437 21.929 -13.060 1.00 38.35 H new ATOM 0 HG2 LYS B1080 10.796 22.470 -12.972 1.00 50.34 H new ATOM 0 HG3 LYS B1080 11.199 20.924 -12.252 1.00 50.34 H new ATOM 0 HD2 LYS B1080 10.139 19.814 -14.301 1.00 62.58 H new ATOM 0 HD3 LYS B1080 10.034 21.407 -15.022 1.00 62.58 H new ATOM 0 HE2 LYS B1080 12.725 21.219 -14.257 1.00 65.49 H new ATOM 0 HE3 LYS B1080 12.340 19.607 -14.825 1.00 65.49 H new ATOM 0 HZ1 LYS B1080 12.953 21.069 -16.690 1.00 70.07 H new ATOM 0 HZ2 LYS B1080 11.332 20.587 -16.839 1.00 70.07 H new ATOM 0 HZ3 LYS B1080 11.705 22.149 -16.289 1.00 70.07 H new ATOM 2828 N SER B1081 6.402 21.111 -10.697 1.00 33.24 N ATOM 2829 CA SER B1081 4.997 21.478 -10.556 1.00 39.42 C ATOM 2830 C SER B1081 4.586 21.964 -9.182 1.00 31.69 C ATOM 2831 O SER B1081 3.679 22.749 -9.041 1.00 36.96 O ATOM 2832 CB SER B1081 4.034 20.321 -10.900 1.00 41.74 C ATOM 2833 OG SER B1081 3.988 19.425 -9.789 1.00 30.34 O ATOM 0 H SER B1081 6.552 20.102 -10.704 1.00 33.24 H new ATOM 0 HA SER B1081 4.915 22.300 -11.267 1.00 39.42 H new ATOM 0 HB2 SER B1081 3.038 20.708 -11.116 1.00 41.74 H new ATOM 0 HB3 SER B1081 4.374 19.799 -11.794 1.00 41.74 H new ATOM 0 HG SER B1081 3.743 18.529 -10.101 1.00 30.34 H new ATOM 2839 N GLY B1082 5.088 21.512 -8.053 1.00 23.51 N ATOM 2840 CA GLY B1082 4.543 21.803 -6.694 1.00 26.17 C ATOM 2841 C GLY B1082 3.202 21.056 -6.458 1.00 27.23 C ATOM 2842 O GLY B1082 2.739 21.288 -5.331 1.00 28.20 O ATOM 0 H GLY B1082 5.912 20.911 -8.027 1.00 23.51 H new ATOM 0 HA2 GLY B1082 5.268 21.504 -5.937 1.00 26.17 H new ATOM 0 HA3 GLY B1082 4.390 22.876 -6.582 1.00 26.17 H new ATOM 2846 N ASN B1083 2.866 20.079 -7.264 1.00 28.47 N ATOM 2847 CA ASN B1083 1.529 19.445 -7.044 1.00 31.50 C ATOM 2848 C ASN B1083 1.710 18.082 -6.345 1.00 24.86 C ATOM 2849 O ASN B1083 2.228 17.236 -7.074 1.00 29.26 O ATOM 2850 CB ASN B1083 0.947 19.188 -8.453 1.00 32.23 C ATOM 2851 CG ASN B1083 -0.397 18.474 -8.297 1.00 47.09 C ATOM 2852 OD1 ASN B1083 -0.948 18.176 -7.112 1.00 61.40 O flip ATOM 2853 ND2 ASN B1083 -0.977 18.179 -9.348 1.00 32.97 N flip ATOM 0 H ASN B1083 3.428 19.707 -8.029 1.00 28.47 H new ATOM 0 HA ASN B1083 0.887 20.078 -6.432 1.00 31.50 H new ATOM 0 HB2 ASN B1083 0.817 20.129 -8.987 1.00 32.23 H new ATOM 0 HB3 ASN B1083 1.634 18.580 -9.042 1.00 32.23 H new ATOM 0 HD21 ASN B1083 -0.552 18.409 -10.247 1.00 32.97 H new ATOM 0 HD22 ASN B1083 -1.880 17.706 -9.317 1.00 32.97 H new ATOM 2860 N VAL B1084 1.355 17.837 -5.115 1.00 24.49 N ATOM 2861 CA VAL B1084 1.499 16.617 -4.382 1.00 31.48 C ATOM 2862 C VAL B1084 0.952 15.395 -5.058 1.00 35.06 C ATOM 2863 O VAL B1084 1.486 14.217 -4.813 1.00 28.00 O ATOM 2864 CB VAL B1084 1.097 16.701 -2.917 1.00 41.03 C ATOM 2865 CG1 VAL B1084 -0.323 17.131 -2.552 1.00 42.68 C ATOM 2866 CG2 VAL B1084 1.107 15.310 -2.230 1.00 42.78 C ATOM 0 H VAL B1084 0.914 18.561 -4.548 1.00 24.49 H new ATOM 0 HA VAL B1084 2.580 16.479 -4.382 1.00 31.48 H new ATOM 0 HB VAL B1084 1.829 17.446 -2.605 1.00 41.03 H new ATOM 0 HG11 VAL B1084 -0.434 17.135 -1.468 1.00 42.68 H new ATOM 0 HG12 VAL B1084 -0.511 18.132 -2.940 1.00 42.68 H new ATOM 0 HG13 VAL B1084 -1.038 16.433 -2.987 1.00 42.68 H new ATOM 0 HG21 VAL B1084 0.814 15.418 -1.186 1.00 42.78 H new ATOM 0 HG22 VAL B1084 0.405 14.648 -2.738 1.00 42.78 H new ATOM 0 HG23 VAL B1084 2.109 14.885 -2.283 1.00 42.78 H new ATOM 2876 N LYS B1085 -0.038 15.423 -5.949 1.00 36.65 N ATOM 2877 CA LYS B1085 -0.510 14.354 -6.762 1.00 43.95 C ATOM 2878 C LYS B1085 0.572 13.746 -7.666 1.00 39.26 C ATOM 2879 O LYS B1085 0.558 12.528 -7.836 1.00 30.10 O ATOM 2880 CB LYS B1085 -1.651 14.951 -7.639 1.00 46.38 C ATOM 2881 CG LYS B1085 -3.032 14.627 -7.132 1.00 63.88 C ATOM 2882 CD LYS B1085 -3.236 14.750 -5.640 1.00 67.12 C ATOM 2883 CE LYS B1085 -3.828 13.482 -5.023 1.00 73.61 C ATOM 2884 NZ LYS B1085 -2.824 12.500 -4.526 1.00 53.02 N ATOM 0 H LYS B1085 -0.563 16.281 -6.119 1.00 36.65 H new ATOM 0 HA LYS B1085 -0.846 13.539 -6.121 1.00 43.95 H new ATOM 0 HB2 LYS B1085 -1.534 16.034 -7.685 1.00 46.38 H new ATOM 0 HB3 LYS B1085 -1.549 14.576 -8.657 1.00 46.38 H new ATOM 0 HG2 LYS B1085 -3.744 15.284 -7.631 1.00 63.88 H new ATOM 0 HG3 LYS B1085 -3.277 13.607 -7.429 1.00 63.88 H new ATOM 0 HD2 LYS B1085 -2.281 14.971 -5.163 1.00 67.12 H new ATOM 0 HD3 LYS B1085 -3.897 15.592 -5.435 1.00 67.12 H new ATOM 0 HE2 LYS B1085 -4.477 13.767 -4.195 1.00 73.61 H new ATOM 0 HE3 LYS B1085 -4.457 12.992 -5.767 1.00 73.61 H new ATOM 0 HZ1 LYS B1085 -3.311 11.723 -4.035 1.00 53.02 H new ATOM 0 HZ2 LYS B1085 -2.285 12.118 -5.329 1.00 53.02 H new ATOM 0 HZ3 LYS B1085 -2.174 12.972 -3.866 1.00 53.02 H new ATOM 2897 N ASP B1086 1.538 14.620 -8.084 1.00 29.91 N ATOM 2898 CA ASP B1086 2.638 14.019 -8.841 1.00 32.59 C ATOM 2899 C ASP B1086 3.503 13.130 -7.896 1.00 28.82 C ATOM 2900 O ASP B1086 4.003 12.063 -8.358 1.00 29.78 O ATOM 2901 CB ASP B1086 3.539 15.078 -9.430 1.00 27.24 C ATOM 2902 CG ASP B1086 2.916 15.857 -10.622 1.00 40.58 C ATOM 2903 OD1 ASP B1086 2.074 15.232 -11.296 1.00 36.44 O ATOM 2904 OD2 ASP B1086 3.286 16.987 -10.923 1.00 33.80 O ATOM 0 H ASP B1086 1.570 15.627 -7.926 1.00 29.91 H new ATOM 0 HA ASP B1086 2.200 13.426 -9.644 1.00 32.59 H new ATOM 0 HB2 ASP B1086 3.806 15.788 -8.647 1.00 27.24 H new ATOM 0 HB3 ASP B1086 4.464 14.607 -9.763 1.00 27.24 H new ATOM 2909 N LEU B1087 3.710 13.523 -6.637 1.00 24.01 N ATOM 2910 CA LEU B1087 4.480 12.651 -5.757 1.00 29.75 C ATOM 2911 C LEU B1087 3.697 11.450 -5.345 1.00 34.01 C ATOM 2912 O LEU B1087 4.293 10.305 -5.279 1.00 25.84 O ATOM 2913 CB LEU B1087 5.011 13.576 -4.678 1.00 33.91 C ATOM 2914 CG LEU B1087 5.890 13.200 -3.560 1.00 43.18 C ATOM 2915 CD1 LEU B1087 7.220 12.691 -4.241 1.00 38.01 C ATOM 2916 CD2 LEU B1087 6.089 14.389 -2.642 1.00 31.84 C ATOM 0 H LEU B1087 3.374 14.393 -6.223 1.00 24.01 H new ATOM 0 HA LEU B1087 5.335 12.162 -6.224 1.00 29.75 H new ATOM 0 HB2 LEU B1087 5.536 14.372 -5.207 1.00 33.91 H new ATOM 0 HB3 LEU B1087 4.130 14.025 -4.219 1.00 33.91 H new ATOM 0 HG LEU B1087 5.480 12.418 -2.922 1.00 43.18 H new ATOM 0 HD11 LEU B1087 7.931 12.390 -3.471 1.00 38.01 H new ATOM 0 HD12 LEU B1087 6.997 11.838 -4.882 1.00 38.01 H new ATOM 0 HD13 LEU B1087 7.652 13.493 -4.840 1.00 38.01 H new ATOM 0 HD21 LEU B1087 6.741 14.106 -1.816 1.00 31.84 H new ATOM 0 HD22 LEU B1087 6.545 15.207 -3.200 1.00 31.84 H new ATOM 0 HD23 LEU B1087 5.124 14.711 -2.249 1.00 31.84 H new ATOM 2928 N THR B1088 2.344 11.619 -5.313 1.00 28.08 N ATOM 2929 CA THR B1088 1.656 10.301 -4.897 1.00 33.21 C ATOM 2930 C THR B1088 1.954 9.341 -5.976 1.00 25.04 C ATOM 2931 O THR B1088 1.845 8.104 -5.725 1.00 26.90 O ATOM 2932 CB THR B1088 0.134 10.507 -4.668 1.00 44.02 C ATOM 2933 OG1 THR B1088 -0.337 11.183 -5.807 1.00 42.86 O ATOM 2934 CG2 THR B1088 -0.165 11.456 -3.520 1.00 37.49 C ATOM 0 H THR B1088 1.782 12.446 -5.515 1.00 28.08 H new ATOM 0 HA THR B1088 2.027 9.926 -3.943 1.00 33.21 H new ATOM 0 HB THR B1088 -0.314 9.534 -4.466 1.00 44.02 H new ATOM 0 HG1 THR B1088 0.424 11.502 -6.336 1.00 42.86 H new ATOM 0 HG21 THR B1088 -1.244 11.562 -3.407 1.00 37.49 H new ATOM 0 HG22 THR B1088 0.259 11.057 -2.598 1.00 37.49 H new ATOM 0 HG23 THR B1088 0.275 12.431 -3.730 1.00 37.49 H new ATOM 2942 N GLN B1089 1.901 9.803 -7.278 1.00 21.03 N ATOM 2943 CA GLN B1089 2.010 8.815 -8.432 1.00 26.17 C ATOM 2944 C GLN B1089 3.366 8.047 -8.348 1.00 29.92 C ATOM 2945 O GLN B1089 3.615 6.827 -8.624 1.00 25.25 O ATOM 2946 CB GLN B1089 2.181 9.566 -9.829 1.00 28.97 C ATOM 2947 CG GLN B1089 0.850 9.794 -10.474 1.00 51.50 C ATOM 2948 CD GLN B1089 -0.017 8.544 -10.670 1.00 58.10 C ATOM 2949 OE1 GLN B1089 -1.097 8.666 -10.040 1.00 44.24 O ATOM 2950 NE2 GLN B1089 0.399 7.559 -11.426 1.00 48.46 N ATOM 0 H GLN B1089 1.792 10.780 -7.548 1.00 21.03 H new ATOM 0 HA GLN B1089 1.116 8.195 -8.369 1.00 26.17 H new ATOM 0 HB2 GLN B1089 2.684 10.521 -9.675 1.00 28.97 H new ATOM 0 HB3 GLN B1089 2.814 8.975 -10.490 1.00 28.97 H new ATOM 0 HG2 GLN B1089 0.292 10.510 -9.870 1.00 51.50 H new ATOM 0 HG3 GLN B1089 1.013 10.257 -11.447 1.00 51.50 H new ATOM 0 HE21 GLN B1089 1.314 7.611 -11.874 1.00 48.46 H new ATOM 0 HE22 GLN B1089 -0.192 6.739 -11.567 1.00 48.46 H new ATOM 2959 N ALA B1090 4.300 8.879 -7.842 1.00 21.31 N ATOM 2960 CA ALA B1090 5.647 8.171 -7.628 1.00 19.86 C ATOM 2961 C ALA B1090 5.536 7.109 -6.550 1.00 24.53 C ATOM 2962 O ALA B1090 6.057 6.047 -6.782 1.00 22.81 O ATOM 2963 CB ALA B1090 6.728 9.219 -7.204 1.00 17.77 C ATOM 0 H ALA B1090 4.216 9.866 -7.600 1.00 21.31 H new ATOM 0 HA ALA B1090 5.934 7.692 -8.564 1.00 19.86 H new ATOM 0 HB1 ALA B1090 7.683 8.716 -7.052 1.00 17.77 H new ATOM 0 HB2 ALA B1090 6.834 9.970 -7.987 1.00 17.77 H new ATOM 0 HB3 ALA B1090 6.422 9.703 -6.277 1.00 17.77 H new ATOM 2969 N TRP B1091 4.709 7.375 -5.435 1.00 20.51 N ATOM 2970 CA TRP B1091 4.636 6.362 -4.383 1.00 19.57 C ATOM 2971 C TRP B1091 3.857 5.155 -4.830 1.00 21.01 C ATOM 2972 O TRP B1091 4.097 4.051 -4.204 1.00 21.31 O ATOM 2973 CB TRP B1091 3.998 6.985 -3.059 1.00 21.23 C ATOM 2974 CG TRP B1091 5.158 7.668 -2.376 1.00 24.28 C ATOM 2975 CD1 TRP B1091 5.522 8.995 -2.389 1.00 23.77 C ATOM 2976 CD2 TRP B1091 6.204 6.979 -1.721 1.00 28.13 C ATOM 2977 NE1 TRP B1091 6.674 9.185 -1.705 1.00 28.55 N ATOM 2978 CE2 TRP B1091 7.147 7.940 -1.273 1.00 33.52 C ATOM 2979 CE3 TRP B1091 6.426 5.639 -1.447 1.00 21.52 C ATOM 2980 CZ2 TRP B1091 8.280 7.570 -0.629 1.00 26.72 C ATOM 2981 CZ3 TRP B1091 7.554 5.285 -0.767 1.00 27.68 C ATOM 2982 CH2 TRP B1091 8.480 6.221 -0.288 1.00 26.59 C ATOM 0 H TRP B1091 4.151 8.216 -5.291 1.00 20.51 H new ATOM 0 HA TRP B1091 5.652 6.033 -4.164 1.00 19.57 H new ATOM 0 HB2 TRP B1091 3.202 7.692 -3.295 1.00 21.23 H new ATOM 0 HB3 TRP B1091 3.561 6.213 -2.426 1.00 21.23 H new ATOM 0 HD1 TRP B1091 4.964 9.779 -2.879 1.00 23.77 H new ATOM 0 HE1 TRP B1091 7.123 10.085 -1.533 1.00 28.55 H new ATOM 0 HE3 TRP B1091 5.718 4.888 -1.766 1.00 21.52 H new ATOM 0 HZ2 TRP B1091 9.027 8.309 -0.378 1.00 26.72 H new ATOM 0 HZ3 TRP B1091 7.742 4.236 -0.590 1.00 27.68 H new ATOM 0 HH2 TRP B1091 9.318 5.917 0.322 1.00 26.59 H new ATOM 2993 N ASP B1092 2.971 5.231 -5.846 1.00 22.91 N ATOM 2994 CA ASP B1092 2.259 4.016 -6.291 1.00 26.92 C ATOM 2995 C ASP B1092 3.282 3.059 -6.955 1.00 22.88 C ATOM 2996 O ASP B1092 3.266 1.850 -6.682 1.00 20.38 O ATOM 2997 CB ASP B1092 1.132 4.467 -7.214 1.00 27.28 C ATOM 2998 CG ASP B1092 0.366 3.339 -7.890 1.00 33.49 C ATOM 2999 OD1 ASP B1092 -0.195 2.554 -7.085 1.00 31.98 O ATOM 3000 OD2 ASP B1092 0.346 3.241 -9.140 1.00 40.54 O ATOM 0 H ASP B1092 2.738 6.084 -6.355 1.00 22.91 H new ATOM 0 HA ASP B1092 1.808 3.456 -5.472 1.00 26.92 H new ATOM 0 HB2 ASP B1092 0.429 5.069 -6.638 1.00 27.28 H new ATOM 0 HB3 ASP B1092 1.550 5.115 -7.984 1.00 27.28 H new ATOM 3005 N LEU B1093 4.194 3.592 -7.725 1.00 21.73 N ATOM 3006 CA LEU B1093 5.242 2.797 -8.385 1.00 26.28 C ATOM 3007 C LEU B1093 6.266 2.357 -7.333 1.00 27.06 C ATOM 3008 O LEU B1093 6.596 1.124 -7.407 1.00 21.90 O ATOM 3009 CB LEU B1093 5.909 3.662 -9.470 1.00 22.00 C ATOM 3010 CG LEU B1093 5.073 3.920 -10.715 1.00 30.94 C ATOM 3011 CD1 LEU B1093 5.714 5.082 -11.481 1.00 26.46 C ATOM 3012 CD2 LEU B1093 5.203 2.724 -11.672 1.00 25.66 C ATOM 0 H LEU B1093 4.247 4.591 -7.924 1.00 21.73 H new ATOM 0 HA LEU B1093 4.818 1.909 -8.854 1.00 26.28 H new ATOM 0 HB2 LEU B1093 6.177 4.622 -9.029 1.00 22.00 H new ATOM 0 HB3 LEU B1093 6.839 3.180 -9.772 1.00 22.00 H new ATOM 0 HG LEU B1093 4.041 4.106 -10.417 1.00 30.94 H new ATOM 0 HD11 LEU B1093 5.134 5.289 -12.380 1.00 26.46 H new ATOM 0 HD12 LEU B1093 5.731 5.969 -10.848 1.00 26.46 H new ATOM 0 HD13 LEU B1093 6.733 4.815 -11.760 1.00 26.46 H new ATOM 0 HD21 LEU B1093 4.605 2.906 -12.565 1.00 25.66 H new ATOM 0 HD22 LEU B1093 6.248 2.596 -11.955 1.00 25.66 H new ATOM 0 HD23 LEU B1093 4.848 1.821 -11.176 1.00 25.66 H new ATOM 3024 N TYR B1094 6.571 3.219 -6.347 1.00 22.30 N ATOM 3025 CA TYR B1094 7.512 2.710 -5.332 1.00 22.91 C ATOM 3026 C TYR B1094 6.897 1.543 -4.541 1.00 21.14 C ATOM 3027 O TYR B1094 7.563 0.547 -4.221 1.00 23.88 O ATOM 3028 CB TYR B1094 7.927 3.811 -4.331 1.00 19.41 C ATOM 3029 CG TYR B1094 8.901 4.890 -4.884 1.00 22.50 C ATOM 3030 CD1 TYR B1094 10.092 4.569 -5.565 1.00 23.71 C ATOM 3031 CD2 TYR B1094 8.696 6.178 -4.624 1.00 25.15 C ATOM 3032 CE1 TYR B1094 11.027 5.531 -5.976 1.00 16.92 C ATOM 3033 CE2 TYR B1094 9.575 7.250 -5.059 1.00 20.43 C ATOM 3034 CZ TYR B1094 10.721 6.871 -5.703 1.00 21.53 C ATOM 3035 OH TYR B1094 11.656 7.819 -6.179 1.00 20.39 O ATOM 0 H TYR B1094 6.225 4.171 -6.231 1.00 22.30 H new ATOM 0 HA TYR B1094 8.393 2.367 -5.875 1.00 22.91 H new ATOM 0 HB2 TYR B1094 7.026 4.310 -3.973 1.00 19.41 H new ATOM 0 HB3 TYR B1094 8.392 3.335 -3.468 1.00 19.41 H new ATOM 0 HD1 TYR B1094 10.295 3.531 -5.781 1.00 23.71 H new ATOM 0 HD2 TYR B1094 7.819 6.444 -4.052 1.00 25.15 H new ATOM 0 HE1 TYR B1094 11.941 5.252 -6.480 1.00 16.92 H new ATOM 0 HE2 TYR B1094 9.337 8.289 -4.884 1.00 20.43 H new ATOM 0 HH TYR B1094 12.550 7.419 -6.191 1.00 20.39 H new ATOM 3045 N TYR B1095 5.622 1.633 -4.213 1.00 21.63 N ATOM 3046 CA TYR B1095 4.979 0.598 -3.346 1.00 21.22 C ATOM 3047 C TYR B1095 4.910 -0.677 -4.179 1.00 19.55 C ATOM 3048 O TYR B1095 5.108 -1.730 -3.577 1.00 22.68 O ATOM 3049 CB TYR B1095 3.553 1.057 -3.001 1.00 19.12 C ATOM 3050 CG TYR B1095 2.837 0.096 -2.027 1.00 17.76 C ATOM 3051 CD1 TYR B1095 3.508 -0.554 -0.989 1.00 21.33 C ATOM 3052 CD2 TYR B1095 1.439 -0.094 -2.180 1.00 22.93 C ATOM 3053 CE1 TYR B1095 2.820 -1.406 -0.106 1.00 21.35 C ATOM 3054 CE2 TYR B1095 0.758 -0.878 -1.283 1.00 24.61 C ATOM 3055 CZ TYR B1095 1.415 -1.534 -0.252 1.00 27.38 C ATOM 3056 OH TYR B1095 0.800 -2.369 0.656 1.00 25.46 O ATOM 0 H TYR B1095 5.002 2.385 -4.513 1.00 21.63 H new ATOM 0 HA TYR B1095 5.535 0.440 -2.422 1.00 21.22 H new ATOM 0 HB2 TYR B1095 3.593 2.053 -2.559 1.00 19.12 H new ATOM 0 HB3 TYR B1095 2.970 1.139 -3.918 1.00 19.12 H new ATOM 0 HD1 TYR B1095 4.570 -0.401 -0.862 1.00 21.33 H new ATOM 0 HD2 TYR B1095 0.914 0.376 -2.998 1.00 22.93 H new ATOM 0 HE1 TYR B1095 3.348 -1.949 0.664 1.00 21.35 H new ATOM 0 HE2 TYR B1095 -0.312 -0.987 -1.382 1.00 24.61 H new ATOM 0 HH TYR B1095 -0.170 -2.239 0.615 1.00 25.46 H new ATOM 3066 N HIS B1096 4.561 -0.576 -5.503 1.00 16.59 N ATOM 3067 CA HIS B1096 4.515 -1.849 -6.319 1.00 21.16 C ATOM 3068 C HIS B1096 5.946 -2.510 -6.267 1.00 29.23 C ATOM 3069 O HIS B1096 5.987 -3.744 -6.105 1.00 24.37 O ATOM 3070 CB HIS B1096 4.246 -1.381 -7.705 1.00 25.48 C ATOM 3071 CG HIS B1096 4.162 -2.496 -8.715 1.00 41.49 C ATOM 3072 ND1 HIS B1096 4.709 -2.706 -9.913 1.00 51.51 N flip ATOM 3073 CD2 HIS B1096 3.333 -3.561 -8.511 1.00 48.62 C flip ATOM 3074 CE1 HIS B1096 4.195 -3.906 -10.398 1.00 38.49 C flip ATOM 3075 NE2 HIS B1096 3.382 -4.422 -9.527 1.00 37.02 N flip ATOM 0 H HIS B1096 4.327 0.285 -5.997 1.00 16.59 H new ATOM 0 HA HIS B1096 3.776 -2.569 -5.968 1.00 21.16 H new ATOM 0 HB2 HIS B1096 3.310 -0.822 -7.715 1.00 25.48 H new ATOM 0 HB3 HIS B1096 5.033 -0.690 -8.005 1.00 25.48 H new ATOM 0 HD2 HIS B1096 2.714 -3.690 -7.635 1.00 48.62 H new ATOM 0 HE1 HIS B1096 4.437 -4.342 -11.356 1.00 38.49 H new ATOM 0 HE2 HIS B1096 2.882 -5.308 -9.605 1.00 37.02 H new ATOM 3083 N VAL B1097 7.009 -1.721 -6.481 1.00 22.94 N ATOM 3084 CA VAL B1097 8.335 -2.297 -6.287 1.00 23.19 C ATOM 3085 C VAL B1097 8.520 -2.922 -4.923 1.00 21.69 C ATOM 3086 O VAL B1097 9.028 -4.067 -4.748 1.00 24.78 O ATOM 3087 CB VAL B1097 9.467 -1.232 -6.635 1.00 23.00 C ATOM 3088 CG1 VAL B1097 10.847 -1.873 -6.263 1.00 22.58 C ATOM 3089 CG2 VAL B1097 9.374 -0.880 -8.117 1.00 18.00 C ATOM 0 H VAL B1097 6.980 -0.743 -6.770 1.00 22.94 H new ATOM 0 HA VAL B1097 8.432 -3.125 -6.989 1.00 23.19 H new ATOM 0 HB VAL B1097 9.348 -0.306 -6.072 1.00 23.00 H new ATOM 0 HG11 VAL B1097 11.648 -1.169 -6.489 1.00 22.58 H new ATOM 0 HG12 VAL B1097 10.863 -2.111 -5.199 1.00 22.58 H new ATOM 0 HG13 VAL B1097 10.992 -2.785 -6.841 1.00 22.58 H new ATOM 0 HG21 VAL B1097 10.145 -0.151 -8.367 1.00 18.00 H new ATOM 0 HG22 VAL B1097 9.518 -1.780 -8.715 1.00 18.00 H new ATOM 0 HG23 VAL B1097 8.392 -0.457 -8.330 1.00 18.00 H new ATOM 3099 N PHE B1098 8.162 -2.165 -3.858 1.00 18.69 N ATOM 3100 CA PHE B1098 8.385 -2.619 -2.509 1.00 20.52 C ATOM 3101 C PHE B1098 7.696 -3.936 -2.192 1.00 29.26 C ATOM 3102 O PHE B1098 8.251 -4.845 -1.562 1.00 25.51 O ATOM 3103 CB PHE B1098 7.918 -1.492 -1.537 1.00 24.34 C ATOM 3104 CG PHE B1098 8.140 -1.738 -0.084 1.00 22.86 C ATOM 3105 CD1 PHE B1098 9.387 -1.588 0.562 1.00 24.04 C ATOM 3106 CD2 PHE B1098 7.116 -2.236 0.712 1.00 22.27 C ATOM 3107 CE1 PHE B1098 9.546 -1.861 1.908 1.00 28.58 C ATOM 3108 CE2 PHE B1098 7.194 -2.471 2.047 1.00 25.35 C ATOM 3109 CZ PHE B1098 8.418 -2.319 2.671 1.00 27.60 C ATOM 0 H PHE B1098 7.722 -1.247 -3.930 1.00 18.69 H new ATOM 0 HA PHE B1098 9.449 -2.820 -2.386 1.00 20.52 H new ATOM 0 HB2 PHE B1098 8.432 -0.570 -1.810 1.00 24.34 H new ATOM 0 HB3 PHE B1098 6.853 -1.323 -1.696 1.00 24.34 H new ATOM 0 HD1 PHE B1098 10.239 -1.251 -0.010 1.00 24.04 H new ATOM 0 HD2 PHE B1098 6.176 -2.455 0.227 1.00 22.27 H new ATOM 0 HE1 PHE B1098 10.508 -1.731 2.381 1.00 28.58 H new ATOM 0 HE2 PHE B1098 6.321 -2.770 2.608 1.00 25.35 H new ATOM 0 HZ PHE B1098 8.525 -2.542 3.722 1.00 27.60 H new ATOM 3119 N ARG B1099 6.411 -4.060 -2.651 1.00 25.71 N ATOM 3120 CA ARG B1099 5.682 -5.250 -2.485 1.00 28.32 C ATOM 3121 C ARG B1099 6.360 -6.385 -3.291 1.00 28.70 C ATOM 3122 O ARG B1099 6.440 -7.443 -2.626 1.00 35.65 O ATOM 3123 CB ARG B1099 4.217 -5.196 -3.014 1.00 20.61 C ATOM 3124 CG ARG B1099 3.356 -4.477 -1.858 1.00 22.87 C ATOM 3125 CD ARG B1099 1.918 -4.538 -2.358 1.00 31.66 C ATOM 3126 NE ARG B1099 1.457 -5.936 -1.984 1.00 35.20 N ATOM 3127 CZ ARG B1099 1.187 -6.386 -0.776 1.00 39.22 C ATOM 3128 NH1 ARG B1099 1.255 -5.725 0.407 1.00 38.44 N ATOM 3129 NH2 ARG B1099 0.801 -7.680 -0.737 1.00 38.00 N ATOM 0 H ARG B1099 5.904 -3.318 -3.133 1.00 25.71 H new ATOM 0 HA ARG B1099 5.664 -5.413 -1.407 1.00 28.32 H new ATOM 0 HB2 ARG B1099 4.160 -4.638 -3.948 1.00 20.61 H new ATOM 0 HB3 ARG B1099 3.838 -6.198 -3.217 1.00 20.61 H new ATOM 0 HG2 ARG B1099 3.466 -4.991 -0.903 1.00 22.87 H new ATOM 0 HG3 ARG B1099 3.679 -3.447 -1.705 1.00 22.87 H new ATOM 0 HD2 ARG B1099 1.299 -3.774 -1.887 1.00 31.66 H new ATOM 0 HD3 ARG B1099 1.862 -4.374 -3.434 1.00 31.66 H new ATOM 0 HE ARG B1099 1.344 -6.598 -2.752 1.00 35.20 H new ATOM 0 HH11 ARG B1099 1.547 -4.748 0.429 1.00 38.44 H new ATOM 0 HH12 ARG B1099 1.014 -6.205 1.274 1.00 38.44 H new ATOM 0 HH21 ARG B1099 0.740 -8.220 -1.600 1.00 38.00 H new ATOM 0 HH22 ARG B1099 0.571 -8.117 0.156 1.00 38.00 H new ATOM 3142 N ARG B1100 6.799 -6.129 -4.484 1.00 24.38 N ATOM 3143 CA ARG B1100 7.424 -7.227 -5.300 1.00 27.33 C ATOM 3144 C ARG B1100 8.703 -7.701 -4.637 1.00 34.21 C ATOM 3145 O ARG B1100 8.894 -8.923 -4.444 1.00 33.55 O ATOM 3146 CB ARG B1100 7.626 -6.849 -6.758 1.00 30.68 C ATOM 3147 CG ARG B1100 6.321 -6.893 -7.596 1.00 36.41 C ATOM 3148 CD ARG B1100 6.738 -6.775 -9.026 1.00 60.81 C ATOM 3149 NE ARG B1100 6.687 -5.437 -9.627 1.00 63.57 N ATOM 3150 CZ ARG B1100 7.362 -5.083 -10.724 1.00 78.54 C ATOM 3151 NH1 ARG B1100 8.219 -5.861 -11.365 1.00 76.64 N ATOM 3152 NH2 ARG B1100 7.160 -3.870 -11.176 1.00 86.15 N ATOM 0 H ARG B1100 6.758 -5.217 -4.938 1.00 24.38 H new ATOM 0 HA ARG B1100 6.722 -8.061 -5.325 1.00 27.33 H new ATOM 0 HB2 ARG B1100 8.048 -5.845 -6.810 1.00 30.68 H new ATOM 0 HB3 ARG B1100 8.357 -7.525 -7.202 1.00 30.68 H new ATOM 0 HG2 ARG B1100 5.780 -7.823 -7.424 1.00 36.41 H new ATOM 0 HG3 ARG B1100 5.652 -6.079 -7.317 1.00 36.41 H new ATOM 0 HD2 ARG B1100 7.759 -7.147 -9.113 1.00 60.81 H new ATOM 0 HD3 ARG B1100 6.106 -7.437 -9.619 1.00 60.81 H new ATOM 0 HE ARG B1100 6.100 -4.734 -9.179 1.00 63.57 H new ATOM 0 HH11 ARG B1100 8.403 -6.805 -11.026 1.00 76.64 H new ATOM 0 HH12 ARG B1100 8.696 -5.516 -12.198 1.00 76.64 H new ATOM 0 HH21 ARG B1100 6.513 -3.247 -10.693 1.00 86.15 H new ATOM 0 HH22 ARG B1100 7.650 -3.549 -12.011 1.00 86.15 H new ATOM 3165 N ILE B1101 9.501 -6.796 -4.103 1.00 35.00 N ATOM 3166 CA ILE B1101 10.741 -7.138 -3.385 1.00 39.17 C ATOM 3167 C ILE B1101 10.431 -7.923 -2.120 1.00 44.12 C ATOM 3168 O ILE B1101 11.308 -8.601 -1.591 1.00 41.39 O ATOM 3169 CB ILE B1101 11.606 -5.916 -2.997 1.00 38.31 C ATOM 3170 CG1 ILE B1101 12.125 -5.178 -4.221 1.00 34.51 C ATOM 3171 CG2 ILE B1101 12.678 -6.244 -1.982 1.00 39.08 C ATOM 3172 CD1 ILE B1101 12.593 -3.771 -3.673 1.00 32.67 C ATOM 0 H ILE B1101 9.317 -5.794 -4.149 1.00 35.00 H new ATOM 0 HA ILE B1101 11.317 -7.737 -4.090 1.00 39.17 H new ATOM 0 HB ILE B1101 10.948 -5.217 -2.481 1.00 38.31 H new ATOM 0 HG12 ILE B1101 12.951 -5.716 -4.687 1.00 34.51 H new ATOM 0 HG13 ILE B1101 11.348 -5.070 -4.977 1.00 34.51 H new ATOM 0 HG21 ILE B1101 13.249 -5.344 -1.753 1.00 39.08 H new ATOM 0 HG22 ILE B1101 12.213 -6.621 -1.071 1.00 39.08 H new ATOM 0 HG23 ILE B1101 13.345 -7.003 -2.390 1.00 39.08 H new ATOM 0 HD11 ILE B1101 12.983 -3.172 -4.496 1.00 32.67 H new ATOM 0 HD12 ILE B1101 11.745 -3.257 -3.220 1.00 32.67 H new ATOM 0 HD13 ILE B1101 13.373 -3.913 -2.925 1.00 32.67 H new ATOM 3184 N SER B1102 9.265 -7.721 -1.514 1.00 34.67 N ATOM 3185 CA SER B1102 8.909 -8.263 -0.249 1.00 37.80 C ATOM 3186 C SER B1102 8.427 -9.719 -0.369 1.00 45.24 C ATOM 3187 O SER B1102 7.911 -10.158 -1.441 1.00 42.81 O ATOM 3188 CB SER B1102 7.819 -7.465 0.486 1.00 41.63 C ATOM 3189 OG SER B1102 8.248 -6.228 0.933 1.00 40.15 O ATOM 3190 OXT SER B1102 8.573 -10.320 0.739 1.00 41.20 O ATOM 0 H SER B1102 8.527 -7.149 -1.925 1.00 34.67 H new ATOM 0 HA SER B1102 9.828 -8.208 0.335 1.00 37.80 H new ATOM 0 HB2 SER B1102 6.969 -7.326 -0.182 1.00 41.63 H new ATOM 0 HB3 SER B1102 7.465 -8.047 1.337 1.00 41.63 H new ATOM 0 HG SER B1102 8.293 -5.605 0.178 1.00 40.15 H new