# chain residue all-atom MC-atom SC-atom SC-polar-atom SC-nonpolar-atom A:747 GLU 3.39 0.29 3.47 0.33 3.32 0.24 3.04 0.05 3.51 0.07 A:748 HIS 3.57 0.41 3.98 0.14 3.29 0.27 3.12 0.12 3.37 0.28 A:749 TYR 3.74 0.46 4.31 0.27 3.45 0.18 3.07 0.00 3.51 0.12 A:750 LEU 3.65 0.48 4.08 0.24 3.22 0.19 nan nan 3.22 0.19 A:751 ASP 3.84 0.49 4.27 0.27 3.42 0.21 3.22 0.06 3.62 0.09 A:752 ASN 4.18 0.61 4.74 0.26 3.63 0.27 3.48 0.29 3.78 0.14 A:753 LEU 4.97 0.58 5.14 0.60 4.80 0.50 nan nan 4.80 0.50 A:754 CYS 6.14 0.65 5.72 0.33 6.98 0.04 7.01 0.00 6.94 0.00 A:755 ILE 3.75 0.53 4.04 0.59 3.46 0.24 nan nan 3.46 0.24 A:756 PHE 4.46 0.66 4.84 0.19 4.24 0.73 nan nan 4.24 0.73 A:757 CYS 4.73 0.75 4.75 0.91 4.67 0.00 4.67 0.00 4.68 0.00 A:758 GLY 3.79 0.43 3.79 0.43 nan nan nan nan nan nan A:759 GLU 3.87 0.59 4.28 0.61 3.54 0.27 3.23 0.09 3.75 0.11 A:760 ARG 3.49 0.25 3.61 0.25 3.42 0.21 3.39 0.18 3.44 0.23 A:761 SER 3.86 0.26 3.92 0.24 3.74 0.25 3.49 0.00 3.98 0.00 A:762 GLU 3.42 0.30 3.66 0.21 3.22 0.19 2.99 0.03 3.38 0.05 A:763 GLU 3.69 0.44 4.07 0.23 3.39 0.31 3.03 0.09 3.62 0.13 A:764 PHE 5.51 0.72 5.07 0.61 5.77 0.66 nan nan 5.77 0.66 A:765 THR 3.82 0.51 4.17 0.38 3.35 0.17 3.50 0.00 3.27 0.17 A:766 GLU 3.49 0.39 3.81 0.37 3.23 0.15 3.05 0.04 3.35 0.02 A:767 GLU 3.50 0.44 3.93 0.26 3.15 0.20 2.93 0.07 3.30 0.07 A:768 GLY 4.45 0.32 4.45 0.32 nan nan nan nan nan nan A:769 LEU 5.24 0.79 5.84 0.11 4.64 0.73 nan nan 4.64 0.73 A:770 ASP 3.73 0.62 4.18 0.59 3.28 0.12 3.17 0.00 3.40 0.05 A:771 LEU 4.15 0.71 4.69 0.57 3.60 0.33 nan nan 3.60 0.33 A:772 HIS 5.47 0.71 5.95 0.48 5.16 0.66 4.80 0.53 5.33 0.64 A:773 TYR 4.56 0.90 5.62 0.25 4.04 0.58 3.27 0.00 4.15 0.54 A:774 TRP 3.91 0.68 4.92 0.30 3.50 0.16 3.33 0.00 3.52 0.15 A:775 LYS 3.82 0.70 4.25 0.76 3.47 0.39 2.91 0.00 3.61 0.30 A:776 HIS 3.81 0.54 4.31 0.43 3.48 0.28 3.32 0.12 3.56 0.30 A:777 CYS 5.87 0.58 5.56 0.45 6.49 0.15 6.64 0.00 6.34 0.00 A:778 LEU 4.95 1.42 6.11 0.99 3.78 0.57 nan nan 3.78 0.57 A:779 MET 7.23 0.56 7.67 0.35 6.79 0.33 6.78 0.00 6.79 0.38 A:780 LEU 6.23 0.89 6.95 0.53 5.50 0.52 nan nan 5.50 0.52 A:781 THR 5.61 0.70 5.92 0.52 5.20 0.71 4.27 0.00 5.66 0.32 A:782 ARG 3.91 0.54 4.51 0.25 3.56 0.32 3.35 0.31 3.73 0.20 A:783 CYS 5.79 0.59 5.42 0.32 6.54 0.10 6.44 0.00 6.64 0.00 A:784 ASP 3.77 0.56 4.19 0.46 3.34 0.23 3.12 0.03 3.56 0.10 A:785 HIS 3.99 0.45 4.14 0.40 3.90 0.46 3.48 0.06 4.11 0.43 A:786 CYS 4.41 0.65 4.19 0.64 4.85 0.37 5.22 0.00 4.49 0.00 A:787 LYS 3.61 0.53 4.10 0.41 3.22 0.14 3.01 0.00 3.27 0.10 A:788 GLN 3.85 0.72 4.49 0.56 3.35 0.32 3.00 0.10 3.58 0.19 A:789 VAL 3.88 0.36 3.77 0.41 4.03 0.18 nan nan 4.03 0.18 A:790 VAL 4.40 0.62 4.51 0.55 4.26 0.67 nan nan 4.26 0.67 A:791 GLU 4.21 0.74 4.81 0.64 3.72 0.36 3.33 0.06 3.98 0.19 A:792 ILE 7.33 0.73 6.72 0.50 7.95 0.23 nan nan 7.95 0.23 A:793 SER 4.51 0.82 4.58 1.00 4.37 0.12 4.25 0.00 4.48 0.00 A:794 SER 4.16 0.54 4.50 0.21 3.48 0.27 3.21 0.00 3.75 0.00 A:795 LEU 5.51 0.61 5.82 0.30 5.20 0.67 nan nan 5.20 0.67 A:796 THR 4.40 0.39 4.66 0.19 4.04 0.29 4.45 0.00 3.83 0.02 A:797 GLU 3.73 0.68 4.34 0.60 3.25 0.16 3.06 0.02 3.37 0.05 A:798 HIS 5.50 0.79 6.12 0.61 5.09 0.61 4.96 0.75 5.15 0.52 A:799 LEU 5.92 1.06 6.81 0.34 5.04 0.76 nan nan 5.04 0.76 A:800 LEU 4.03 0.67 4.33 0.83 3.73 0.19 nan nan 3.73 0.19 A:801 THR 3.84 0.48 4.10 0.45 3.50 0.23 3.74 0.00 3.38 0.19 A:802 GLU 3.72 0.56 4.14 0.54 3.38 0.28 3.12 0.12 3.56 0.22 A:803 CYS 5.42 0.84 4.86 0.32 6.55 0.01 6.55 0.00 6.54 0.00 A:804 ASP 3.64 0.43 3.94 0.35 3.34 0.26 3.13 0.19 3.55 0.08 A:805 LYS 3.80 0.53 4.29 0.35 3.41 0.27 2.99 0.00 3.51 0.19 A:806 LYS 4.47 0.73 4.91 0.34 4.12 0.76 3.04 0.00 4.39 0.61 A:807 ASP 3.53 0.39 3.84 0.31 3.22 0.16 3.07 0.05 3.38 0.04 A:808 GLY 3.85 0.41 3.85 0.41 nan nan nan nan nan nan A:809 PHE 4.99 0.71 4.68 0.72 5.17 0.65 nan nan 5.17 0.65 A:810 GLY 4.34 0.57 4.34 0.57 nan nan nan nan nan nan A:811 LYS 3.59 0.38 3.83 0.33 3.40 0.31 2.95 0.00 3.51 0.24 A:812 CYS 5.69 0.71 5.20 0.15 6.68 0.10 6.78 0.00 6.58 0.00 A:813 TYR 3.49 0.33 3.79 0.40 3.35 0.14 3.08 0.00 3.39 0.11 A:814 ARG 4.07 0.44 4.17 0.31 4.01 0.48 3.79 0.63 4.17 0.22 A:815 CYS 5.72 0.29 5.55 0.16 6.05 0.21 5.84 0.00 6.26 0.00 A:816 SER 4.35 0.53 4.67 0.34 3.71 0.05 3.76 0.00 3.65 0.00 A:817 GLU 5.31 0.65 5.84 0.24 4.88 0.56 4.55 0.72 5.10 0.23 A:818 ALA 4.73 0.77 4.61 0.82 5.19 0.00 nan nan 5.19 0.00 A:819 VAL 4.88 0.41 5.01 0.49 4.69 0.13 nan nan 4.69 0.13 A:820 PHE 4.25 0.93 5.32 0.45 3.65 0.48 nan nan 3.65 0.48 A:821 LYS 3.67 0.50 4.06 0.51 3.36 0.17 3.13 0.00 3.42 0.14 A:822 GLU 3.44 0.34 3.75 0.20 3.20 0.19 2.98 0.01 3.34 0.09 A:823 GLU 4.18 0.81 4.94 0.37 3.57 0.48 3.07 0.09 3.90 0.32 A:824 LEU 4.61 0.67 5.06 0.39 4.15 0.59 nan nan 4.15 0.59 A:825 PRO 3.69 0.42 3.95 0.22 3.34 0.36 nan nan 3.34 0.36 A:826 ARG 3.91 0.66 4.69 0.05 3.47 0.37 3.12 0.17 3.73 0.26 A:827 HIS 5.15 0.65 5.47 0.49 4.95 0.67 4.60 0.50 5.12 0.67 A:828 ILE 4.16 0.76 4.66 0.65 3.66 0.47 nan nan 3.66 0.47 A:829 LYS 3.54 0.37 3.78 0.34 3.35 0.27 3.05 0.00 3.42 0.25 A:830 HIS 3.54 0.42 3.83 0.49 3.34 0.19 3.20 0.20 3.41 0.13 A:831 LYS 3.75 0.57 4.23 0.46 3.36 0.28 2.98 0.00 3.46 0.23 A:832 ASP 3.69 0.58 3.99 0.58 3.39 0.41 3.05 0.09 3.73 0.31 A:833 CYS 4.45 0.70 4.10 0.20 5.15 0.79 5.95 0.00 4.36 0.00 A:834 ASN 4.09 0.73 4.60 0.72 3.58 0.19 3.57 0.26 3.59 0.09 A:835 PRO 4.00 0.50 4.40 0.24 3.47 0.08 nan nan 3.47 0.08 A:836 ALA 4.08 0.54 4.04 0.60 4.26 0.00 nan nan 4.26 0.00 A:837 LYS 3.63 0.41 3.88 0.22 3.42 0.41 2.92 0.00 3.55 0.36 A:838 PRO 3.70 0.60 4.07 0.52 3.20 0.17 nan nan 3.20 0.17 A:839 GLU 3.53 0.37 3.88 0.19 3.25 0.22 2.99 0.06 3.42 0.03 A:840 LYS 3.37 0.36 3.70 0.27 3.10 0.15 2.88 0.00 3.16 0.11 A:841 LEU 3.78 0.57 4.17 0.39 3.39 0.46 nan nan 3.39 0.46 A:842 ALA 5.02 0.27 5.13 0.17 4.57 0.00 nan nan 4.57 0.00 A:843 ASN 5.14 0.54 5.45 0.22 4.82 0.57 4.52 0.62 5.13 0.29 A:844 ARG 5.45 0.63 5.10 0.33 5.66 0.66 5.84 0.62 5.52 0.66 A:845 CYS 7.12 0.39 6.89 0.22 7.58 0.19 7.77 0.00 7.39 0.00 A:846 PRO 5.36 0.92 5.00 1.05 5.84 0.32 nan nan 5.84 0.32 A:847 LEU 4.52 0.53 4.40 0.45 4.65 0.57 nan nan 4.65 0.57 A:848 CYS 4.62 0.66 4.42 0.71 5.01 0.24 5.25 0.00 4.76 0.00 A:849 HIS 4.06 0.74 4.92 0.17 3.48 0.28 3.57 0.38 3.44 0.19 A:850 GLU 4.24 1.02 5.30 0.40 3.40 0.38 3.00 0.01 3.66 0.25 A:851 ASN 4.15 0.62 3.97 0.48 4.32 0.68 4.47 0.92 4.18 0.21 A:852 PHE 4.57 0.98 3.81 0.31 5.01 0.96 nan nan 5.01 0.96 A:853 SER 3.85 0.81 4.26 0.69 3.04 0.21 2.84 0.00 3.25 0.00 A:854 PRO 3.77 0.41 3.99 0.40 3.48 0.20 nan nan 3.48 0.20 A:855 GLY 3.77 0.46 3.77 0.46 nan nan nan nan nan nan A:856 GLU 3.88 0.70 4.50 0.63 3.39 0.18 3.35 0.20 3.42 0.17 A:857 GLU 3.58 0.40 4.00 0.15 3.24 0.14 3.17 0.02 3.29 0.16 A:858 ALA 4.28 0.47 4.37 0.50 3.95 0.00 nan nan 3.95 0.00 A:859 TRP 5.81 0.93 6.62 0.34 5.49 0.89 4.19 0.00 5.63 0.82 A:860 LYS 4.31 0.66 4.73 0.60 3.97 0.48 3.21 0.00 4.16 0.33 A:861 ALA 3.87 0.42 4.04 0.28 3.20 0.00 nan nan 3.20 0.00 A:862 HIS 5.09 0.67 5.33 0.62 4.93 0.66 4.74 0.77 5.02 0.57 A:863 LEU 7.63 1.28 6.45 0.57 8.80 0.46 nan nan 8.80 0.46 A:864 MET 3.95 0.64 4.16 0.80 3.75 0.33 3.58 0.00 3.80 0.37 A:865 GLY 3.67 0.19 3.67 0.19 nan nan nan nan nan nan A:866 PRO 3.25 0.26 3.41 0.24 3.04 0.03 nan nan 3.04 0.03 A:867 ALA 3.57 0.38 3.71 0.27 2.99 0.00 nan nan 2.99 0.00 A:868 GLY 3.58 0.29 3.58 0.29 nan nan nan nan nan nan A:869 CYS 5.23 0.98 4.61 0.50 6.48 0.21 6.69 0.00 6.26 0.00 A:870 THR 3.67 0.47 3.93 0.45 3.33 0.22 3.50 0.00 3.25 0.23 A:871 MET 4.09 0.60 4.51 0.16 3.67 0.57 3.32 0.00 3.79 0.62 A:872 ASN 5.22 1.01 4.32 0.48 6.12 0.45 6.34 0.44 5.90 0.35 A:873 LEU 3.43 0.40 3.68 0.37 3.18 0.24 nan nan 3.18 0.24 A:874 ARG 4.23 0.65 3.81 0.34 4.47 0.66 4.79 0.80 4.23 0.38 A:875 LYS 3.67 0.37 3.68 0.52 3.67 0.17 3.73 0.00 3.65 0.19 B:743 PRO 3.21 0.19 3.30 0.21 3.09 0.05 nan nan 3.09 0.05 B:744 HIS 3.38 0.26 3.59 0.25 3.24 0.16 3.13 0.02 3.29 0.17 B:745 MET 3.72 0.38 3.99 0.30 3.44 0.23 3.60 0.00 3.39 0.24 B:746 ASP 3.61 0.40 3.99 0.15 3.24 0.14 3.10 0.03 3.38 0.04 B:747 GLU 3.56 0.37 3.91 0.25 3.27 0.15 3.13 0.04 3.37 0.11 B:748 HIS 3.60 0.45 4.08 0.17 3.28 0.25 3.14 0.21 3.34 0.25 B:749 TYR 3.91 0.61 4.65 0.15 3.55 0.38 2.99 0.00 3.62 0.34 B:750 LEU 3.80 0.57 4.28 0.38 3.33 0.25 nan nan 3.33 0.25 B:751 ASP 3.91 0.53 4.38 0.17 3.43 0.28 3.16 0.03 3.70 0.08 B:752 ASN 4.32 0.76 4.97 0.41 3.67 0.37 3.37 0.28 3.96 0.17 B:753 LEU 4.80 0.72 5.13 0.60 4.46 0.66 nan nan 4.46 0.66 B:754 CYS 5.93 0.81 5.44 0.49 6.93 0.02 6.95 0.00 6.91 0.00 B:755 ILE 3.69 0.52 4.03 0.49 3.36 0.26 nan nan 3.36 0.26 B:756 PHE 4.35 0.63 4.63 0.19 4.19 0.73 nan nan 4.19 0.73 B:757 CYS 5.05 0.71 4.84 0.78 5.49 0.16 5.65 0.00 5.33 0.00 B:758 GLY 3.70 0.43 3.70 0.43 nan nan nan nan nan nan B:759 GLU 3.88 0.56 4.35 0.62 3.65 0.34 3.40 0.31 3.81 0.25 B:760 ARG 3.57 0.33 3.69 0.35 3.49 0.29 3.51 0.30 3.48 0.29 B:761 SER 4.17 0.33 4.36 0.19 3.77 0.16 3.62 0.00 3.93 0.00 B:762 GLU 3.43 0.40 3.77 0.33 3.15 0.16 3.08 0.19 3.20 0.11 B:763 GLU 3.60 0.44 4.03 0.22 3.26 0.22 3.03 0.02 3.41 0.16 B:764 PHE 5.33 0.79 4.92 0.70 5.56 0.75 nan nan 5.56 0.75 B:765 THR 3.82 0.54 4.20 0.38 3.32 0.22 3.50 0.00 3.23 0.22 B:766 GLU 3.44 0.27 3.68 0.17 3.24 0.14 3.08 0.02 3.35 0.04 B:767 GLU 3.48 0.43 3.91 0.25 3.14 0.14 2.98 0.03 3.25 0.07 B:768 GLY 4.43 0.34 4.43 0.34 nan nan nan nan nan nan B:769 LEU 5.14 0.73 5.65 0.08 4.64 0.74 nan nan 4.64 0.74 B:770 ASP 3.92 0.72 4.61 0.15 3.24 0.26 2.99 0.04 3.49 0.09 B:771 LEU 4.18 0.78 4.85 0.47 3.51 0.30 nan nan 3.51 0.30 B:772 HIS 5.46 0.69 5.86 0.51 5.19 0.66 5.02 0.82 5.28 0.55 B:773 TYR 4.40 0.86 5.40 0.33 3.90 0.55 3.28 0.00 3.99 0.53 B:774 TRP 4.00 0.84 5.21 0.30 3.52 0.37 3.29 0.00 3.55 0.38 B:775 LYS 4.01 0.81 4.57 0.79 3.57 0.48 3.22 0.00 3.66 0.50 B:776 HIS 3.97 0.69 4.70 0.38 3.48 0.33 3.26 0.15 3.59 0.34 B:777 CYS 6.56 0.63 6.23 0.49 7.23 0.20 7.43 0.00 7.03 0.00 B:778 LEU 5.42 1.50 6.73 0.84 4.12 0.64 nan nan 4.12 0.64 B:779 MET 6.63 0.87 7.39 0.28 5.88 0.55 5.90 0.00 5.87 0.63 B:780 LEU 6.11 1.01 7.00 0.31 5.21 0.57 nan nan 5.21 0.57 B:781 THR 5.74 0.74 6.20 0.40 5.13 0.64 4.25 0.00 5.57 0.22 B:782 ARG 4.31 0.54 4.88 0.33 3.98 0.33 3.77 0.27 4.14 0.28 B:783 CYS 5.93 0.35 5.73 0.22 6.31 0.23 6.08 0.00 6.54 0.00 B:784 ASP 3.67 0.57 4.04 0.57 3.31 0.25 3.12 0.21 3.50 0.09 B:785 HIS 3.91 0.46 3.86 0.41 3.94 0.49 3.47 0.02 4.18 0.44 B:786 CYS 4.23 0.45 4.09 0.49 4.49 0.12 4.62 0.00 4.37 0.00 B:787 LYS 3.71 0.52 4.09 0.52 3.41 0.24 3.22 0.00 3.46 0.24 B:788 GLN 3.92 0.63 4.39 0.68 3.55 0.14 3.41 0.03 3.65 0.11 B:789 VAL 3.74 0.31 3.82 0.37 3.63 0.14 nan nan 3.63 0.14 B:790 VAL 4.62 0.53 4.66 0.50 4.58 0.56 nan nan 4.58 0.56 B:791 GLU 4.27 0.79 4.91 0.57 3.76 0.52 3.19 0.10 4.13 0.30 B:792 ILE 7.03 0.64 6.50 0.48 7.56 0.18 nan nan 7.56 0.18 B:793 SER 4.28 0.79 4.46 0.90 3.92 0.21 3.71 0.00 4.14 0.00 B:794 SER 4.15 0.60 4.56 0.18 3.34 0.13 3.21 0.00 3.47 0.00 B:795 LEU 5.55 0.60 5.87 0.25 5.22 0.66 nan nan 5.22 0.66 B:796 THR 4.71 0.41 5.03 0.18 4.28 0.16 4.51 0.00 4.17 0.03 B:797 GLU 3.81 0.62 4.40 0.39 3.34 0.28 3.02 0.01 3.56 0.10 B:798 HIS 5.73 0.66 5.58 0.65 5.84 0.64 5.98 0.57 5.76 0.65 B:799 LEU 5.82 1.12 6.79 0.18 4.85 0.77 nan nan 4.85 0.77 B:800 LEU 4.43 0.69 4.63 0.92 4.23 0.20 nan nan 4.23 0.20 B:801 THR 3.65 0.53 3.94 0.54 3.28 0.08 3.38 0.00 3.23 0.05 B:802 GLU 3.70 0.47 4.03 0.47 3.43 0.23 3.25 0.22 3.55 0.15 B:803 CYS 5.38 0.95 4.77 0.48 6.61 0.02 6.63 0.00 6.59 0.00 B:804 ASP 3.49 0.38 3.70 0.41 3.29 0.20 3.09 0.05 3.49 0.05 B:805 LYS 3.81 0.52 4.30 0.25 3.43 0.32 3.01 0.00 3.53 0.28 B:806 LYS 4.36 0.76 4.91 0.33 3.91 0.71 3.02 0.00 4.14 0.61 B:807 ASP 3.61 0.47 3.94 0.40 3.27 0.23 3.06 0.14 3.48 0.00 B:808 GLY 3.82 0.30 3.82 0.30 nan nan nan nan nan nan B:809 PHE 5.29 0.73 4.88 0.69 5.53 0.65 nan nan 5.53 0.65 B:810 GLY 4.64 0.61 4.64 0.61 nan nan nan nan nan nan B:811 LYS 4.11 0.50 4.32 0.40 3.94 0.51 3.11 0.00 4.15 0.33 B:812 CYS 5.71 0.28 5.65 0.19 5.81 0.38 5.42 0.00 6.19 0.00 B:813 TYR 3.51 0.35 3.82 0.41 3.36 0.15 3.02 0.00 3.41 0.09 B:814 ARG 3.87 0.37 4.07 0.28 3.75 0.37 3.78 0.53 3.74 0.17 B:815 CYS 5.76 0.40 5.97 0.23 5.34 0.32 5.01 0.00 5.66 0.00 B:816 SER 4.73 0.55 5.06 0.37 4.09 0.01 4.08 0.00 4.09 0.00 B:817 GLU 5.35 0.86 6.15 0.28 4.72 0.59 4.34 0.70 4.97 0.30 B:818 ALA 4.86 0.81 4.72 0.85 5.44 0.00 nan nan 5.44 0.00 B:819 VAL 4.76 0.52 5.00 0.56 4.44 0.17 nan nan 4.44 0.17 B:820 PHE 4.03 0.75 4.94 0.30 3.52 0.31 nan nan 3.52 0.31 B:821 LYS 3.63 0.44 3.91 0.47 3.40 0.23 3.08 0.00 3.48 0.19 B:822 GLU 3.40 0.30 3.65 0.22 3.20 0.19 2.99 0.08 3.34 0.08 B:823 GLU 4.15 0.71 4.85 0.20 3.59 0.41 3.18 0.09 3.87 0.29 B:824 LEU 4.73 0.62 5.17 0.20 4.29 0.59 nan nan 4.29 0.59 B:825 PRO 3.71 0.37 3.95 0.22 3.38 0.29 nan nan 3.38 0.29 B:826 ARG 3.59 0.57 4.29 0.22 3.19 0.21 3.02 0.13 3.32 0.15 B:827 HIS 4.42 0.69 4.90 0.52 4.10 0.59 3.86 0.50 4.23 0.59 B:828 ILE 4.09 0.71 4.51 0.69 3.67 0.42 nan nan 3.67 0.42 B:829 LYS 3.63 0.44 3.97 0.38 3.36 0.27 2.97 0.00 3.46 0.21 B:830 HIS 3.72 0.54 4.11 0.58 3.46 0.30 3.24 0.09 3.57 0.31 B:831 LYS 3.79 0.62 4.27 0.56 3.40 0.31 3.01 0.00 3.50 0.27 B:832 ASP 3.49 0.47 3.72 0.56 3.26 0.15 3.19 0.16 3.34 0.08 B:833 CYS 4.17 0.56 3.93 0.10 4.66 0.74 5.40 0.00 3.92 0.00 B:834 ASN 3.87 0.77 4.39 0.79 3.35 0.12 3.27 0.12 3.44 0.00 B:835 PRO 3.93 0.55 4.38 0.21 3.33 0.14 nan nan 3.33 0.14 B:836 ALA 4.31 0.62 4.16 0.60 4.90 0.00 nan nan 4.90 0.00 B:837 LYS 3.75 0.42 4.10 0.15 3.47 0.34 3.00 0.00 3.58 0.28 B:838 PRO 3.78 0.61 4.18 0.51 3.24 0.14 nan nan 3.24 0.14 B:839 GLU 3.54 0.36 3.88 0.16 3.28 0.24 3.00 0.02 3.46 0.10 B:840 LYS 3.35 0.31 3.59 0.26 3.15 0.18 2.89 0.00 3.22 0.14 B:841 LEU 3.68 0.51 3.99 0.41 3.36 0.40 nan nan 3.36 0.40 B:842 ALA 5.09 0.23 5.17 0.17 4.76 0.00 nan nan 4.76 0.00 B:843 ASN 5.04 0.75 5.55 0.38 4.53 0.68 4.21 0.74 4.85 0.42 B:844 ARG 5.53 0.68 5.03 0.34 5.82 0.66 5.94 0.62 5.74 0.67 B:845 CYS 7.16 0.38 6.94 0.23 7.61 0.17 7.78 0.00 7.44 0.00 B:846 PRO 5.28 0.83 4.98 0.96 5.69 0.32 nan nan 5.69 0.32 B:847 LEU 4.63 0.62 4.39 0.56 4.86 0.59 nan nan 4.86 0.59 B:848 CYS 4.81 0.58 4.62 0.60 5.19 0.27 5.46 0.00 4.92 0.00 B:849 HIS 4.09 0.74 4.92 0.33 3.54 0.26 3.50 0.27 3.56 0.25 B:850 GLU 4.42 1.06 5.50 0.43 3.57 0.46 3.12 0.07 3.87 0.35 B:851 ASN 4.26 0.63 4.10 0.54 4.41 0.66 4.49 0.93 4.34 0.07 B:852 PHE 4.74 0.83 4.26 0.29 5.01 0.91 nan nan 5.01 0.91 B:853 SER 3.91 0.72 4.29 0.58 3.16 0.19 2.97 0.00 3.35 0.00 B:854 PRO 3.89 0.43 4.04 0.49 3.69 0.22 nan nan 3.69 0.22 B:855 GLY 3.79 0.54 3.79 0.54 nan nan nan nan nan nan B:856 GLU 3.53 0.33 3.87 0.14 3.26 0.13 3.14 0.05 3.34 0.10 B:857 GLU 3.55 0.41 3.95 0.24 3.23 0.13 3.09 0.05 3.32 0.08 B:858 ALA 4.04 0.37 4.14 0.36 3.66 0.00 nan nan 3.66 0.00 B:859 TRP 5.60 0.81 5.98 0.28 5.45 0.90 4.25 0.00 5.58 0.86 B:860 LYS 4.06 0.66 4.59 0.51 3.65 0.42 2.97 0.00 3.81 0.28 B:861 ALA 3.81 0.40 4.00 0.16 3.07 0.00 nan nan 3.07 0.00 B:862 HIS 5.00 0.67 5.06 0.66 4.96 0.67 4.90 0.83 4.99 0.58 B:863 LEU 7.36 1.04 6.45 0.58 8.26 0.41 nan nan 8.26 0.41 B:864 MET 4.00 0.64 4.19 0.80 3.82 0.33 3.79 0.00 3.82 0.38 B:865 GLY 3.83 0.17 3.83 0.17 nan nan nan nan nan nan B:866 PRO 3.35 0.26 3.50 0.26 3.15 0.05 nan nan 3.15 0.05 B:867 ALA 3.50 0.32 3.60 0.27 3.08 0.00 nan nan 3.08 0.00 B:868 GLY 3.86 0.27 3.86 0.27 nan nan nan nan nan nan B:869 CYS 5.17 1.01 4.54 0.52 6.45 0.32 6.76 0.00 6.13 0.00 B:870 THR 3.60 0.45 3.83 0.45 3.28 0.15 3.29 0.00 3.27 0.19 B:871 MET 4.10 0.65 4.59 0.07 3.61 0.60 3.12 0.00 3.77 0.61 B:872 ASN 5.13 0.94 4.29 0.41 5.96 0.44 6.16 0.44 5.77 0.33 B:873 LEU 3.46 0.35 3.65 0.35 3.26 0.23 nan nan 3.26 0.23 B:874 ARG 4.47 0.76 3.95 0.30 4.77 0.78 5.24 0.80 4.41 0.55 B:875 LYS 3.50 0.43 3.60 0.58 3.42 0.23 3.44 0.00 3.42 0.26 C:742 GLY 3.18 0.18 3.18 0.18 nan nan nan nan nan nan C:743 PRO 3.44 0.26 3.63 0.19 3.20 0.06 nan nan 3.20 0.06 C:744 HIS 3.35 0.29 3.60 0.27 3.18 0.16 3.05 0.03 3.25 0.16 C:745 MET 3.31 0.22 3.48 0.16 3.13 0.11 3.31 0.00 3.07 0.06 C:746 ASP 3.54 0.24 3.67 0.24 3.42 0.15 3.37 0.15 3.47 0.14 C:747 GLU 3.44 0.33 3.69 0.29 3.24 0.18 3.05 0.07 3.37 0.10 C:748 HIS 3.86 0.55 4.41 0.33 3.50 0.31 3.23 0.08 3.64 0.30 C:749 TYR 3.77 0.62 4.56 0.25 3.38 0.28 2.81 0.00 3.46 0.19 C:750 LEU 3.65 0.45 4.03 0.31 3.28 0.17 nan nan 3.28 0.17 C:751 ASP 3.74 0.37 4.06 0.19 3.42 0.18 3.25 0.06 3.60 0.02 C:752 ASN 4.11 0.64 4.59 0.52 3.64 0.29 3.41 0.24 3.87 0.10 C:753 LEU 4.72 0.64 5.08 0.48 4.37 0.59 nan nan 4.37 0.59 C:754 CYS 6.01 0.87 5.49 0.55 7.06 0.04 7.09 0.00 7.02 0.00 C:755 ILE 3.71 0.50 3.97 0.55 3.46 0.24 nan nan 3.46 0.24 C:756 PHE 4.41 0.68 4.85 0.18 4.16 0.73 nan nan 4.16 0.73 C:757 CYS 5.02 0.81 4.76 0.89 5.53 0.05 5.58 0.00 5.48 0.00 C:758 GLY 3.65 0.43 3.65 0.43 nan nan nan nan nan nan C:759 GLU 3.92 0.60 4.49 0.54 3.63 0.38 3.33 0.19 3.83 0.34 C:760 ARG 3.60 0.30 3.80 0.34 3.48 0.19 3.51 0.16 3.46 0.21 C:761 SER 4.04 0.43 4.21 0.39 3.70 0.27 3.43 0.00 3.97 0.00 C:762 GLU 3.55 0.42 3.93 0.30 3.24 0.18 3.13 0.05 3.31 0.20 C:763 GLU 3.81 0.60 4.43 0.18 3.32 0.27 3.07 0.01 3.48 0.23 C:764 PHE 5.38 0.75 5.16 0.64 5.50 0.79 nan nan 5.50 0.79 C:765 THR 3.91 0.60 4.34 0.40 3.32 0.21 3.59 0.00 3.19 0.11 C:766 GLU 3.66 0.57 4.15 0.48 3.27 0.24 2.99 0.00 3.47 0.03 C:767 GLU 3.65 0.55 4.18 0.39 3.22 0.11 3.11 0.05 3.29 0.08 C:768 GLY 4.30 0.37 4.30 0.37 nan nan nan nan nan nan C:769 LEU 5.23 0.77 5.82 0.09 4.64 0.70 nan nan 4.64 0.70 C:770 ASP 4.16 0.67 4.82 0.34 3.74 0.46 3.36 0.18 4.13 0.30 C:771 LEU 4.09 0.75 4.71 0.52 3.48 0.28 nan nan 3.48 0.28 C:772 HIS 5.25 0.68 5.67 0.49 4.97 0.64 4.76 0.68 5.08 0.59 C:773 TYR 4.64 0.96 5.83 0.27 4.05 0.53 3.35 0.00 4.15 0.49 C:774 TRP 3.99 0.70 5.03 0.32 3.58 0.23 3.23 0.00 3.62 0.21 C:775 LYS 3.78 0.59 4.09 0.66 3.53 0.37 2.92 0.00 3.69 0.24 C:776 HIS 3.72 0.54 4.27 0.44 3.35 0.16 3.29 0.15 3.38 0.15 C:777 CYS 6.12 0.68 5.77 0.54 6.83 0.27 7.09 0.00 6.56 0.00 C:778 LEU 5.46 1.46 6.67 0.92 4.24 0.68 nan nan 4.24 0.68 C:779 MET 7.57 0.61 8.10 0.33 7.03 0.26 6.91 0.00 7.08 0.29 C:780 LEU 6.12 0.90 6.76 0.69 5.49 0.59 nan nan 5.49 0.59 C:781 THR 5.16 0.86 5.72 0.52 4.42 0.62 3.59 0.00 4.83 0.24 C:782 ARG 4.02 0.53 4.44 0.32 3.78 0.48 3.45 0.37 4.03 0.40 C:783 CYS 5.69 0.25 5.54 0.16 5.99 0.08 5.91 0.00 6.07 0.00 C:784 ASP 3.79 0.60 4.31 0.39 3.28 0.22 3.09 0.08 3.47 0.12 C:785 HIS 3.97 0.46 4.11 0.48 3.88 0.42 3.48 0.12 4.08 0.37 C:786 CYS 4.32 0.37 4.27 0.44 4.43 0.05 4.48 0.00 4.39 0.00 C:787 LYS 3.84 0.65 4.52 0.31 3.29 0.15 3.16 0.00 3.33 0.15 C:788 GLN 4.09 0.87 4.98 0.45 3.38 0.26 3.15 0.17 3.53 0.18 C:789 VAL 4.04 0.40 3.97 0.50 4.13 0.18 nan nan 4.13 0.18 C:790 VAL 4.58 0.59 4.60 0.58 4.56 0.59 nan nan 4.56 0.59 C:791 GLU 4.28 0.83 4.94 0.71 3.76 0.46 3.30 0.21 4.06 0.31 C:792 ILE 7.00 0.49 6.70 0.43 7.29 0.35 nan nan 7.29 0.35 C:793 SER 4.40 0.85 4.60 0.98 4.01 0.16 3.85 0.00 4.17 0.00 C:794 SER 4.27 0.56 4.65 0.17 3.53 0.21 3.32 0.00 3.74 0.00 C:795 LEU 5.39 0.76 5.91 0.32 4.87 0.72 nan nan 4.87 0.72 C:796 THR 4.44 0.48 4.81 0.18 3.94 0.26 4.30 0.00 3.75 0.01 C:797 GLU 3.75 0.68 4.41 0.46 3.23 0.20 3.01 0.09 3.38 0.07 C:798 HIS 5.39 0.66 5.77 0.60 5.13 0.57 4.93 0.43 5.23 0.60 C:799 LEU 5.83 1.12 6.79 0.26 4.88 0.78 nan nan 4.88 0.78 C:800 LEU 4.28 0.71 4.63 0.83 3.92 0.25 nan nan 3.92 0.25 C:801 THR 3.68 0.52 3.93 0.56 3.35 0.16 3.57 0.00 3.24 0.05 C:802 GLU 3.59 0.55 3.97 0.54 3.29 0.31 3.12 0.29 3.41 0.26 C:803 CYS 5.02 0.77 4.51 0.30 6.05 0.05 6.10 0.00 6.00 0.00 C:804 ASP 3.66 0.51 4.03 0.29 3.29 0.40 2.97 0.00 3.62 0.32 C:805 LYS 3.97 0.62 4.55 0.26 3.50 0.40 3.23 0.00 3.57 0.42 C:806 LYS 4.56 0.90 5.13 0.44 4.10 0.91 3.08 0.00 4.35 0.85 C:807 ASP 3.63 0.47 4.03 0.34 3.23 0.12 3.13 0.01 3.33 0.11 C:808 GLY 4.02 0.35 4.02 0.35 nan nan nan nan nan nan C:809 PHE 5.14 0.73 4.72 0.74 5.38 0.60 nan nan 5.38 0.60 C:810 GLY 4.55 0.59 4.55 0.59 nan nan nan nan nan nan C:811 LYS 3.65 0.41 3.99 0.34 3.38 0.22 3.06 0.00 3.46 0.17 C:812 CYS 5.29 0.75 4.80 0.30 6.28 0.16 6.45 0.00 6.12 0.00 C:813 TYR 3.49 0.25 3.67 0.28 3.40 0.18 3.33 0.00 3.41 0.19 C:814 ARG 4.12 0.56 4.20 0.32 4.08 0.66 3.68 0.72 4.38 0.40 C:815 CYS 5.66 0.33 5.60 0.23 5.79 0.44 5.35 0.00 6.23 0.00 C:816 SER 4.47 0.67 4.85 0.44 3.71 0.31 3.40 0.00 4.01 0.00 C:817 GLU 5.10 0.66 5.65 0.27 4.66 0.54 4.41 0.77 4.82 0.15 C:818 ALA 4.80 0.72 4.67 0.75 5.34 0.00 nan nan 5.34 0.00 C:819 VAL 4.53 0.61 4.87 0.61 4.09 0.16 nan nan 4.09 0.16 C:820 PHE 4.35 0.93 5.35 0.61 3.78 0.51 nan nan 3.78 0.51 C:821 LYS 3.84 0.60 4.26 0.62 3.51 0.29 3.09 0.00 3.61 0.22 C:822 GLU 3.49 0.33 3.75 0.28 3.29 0.19 3.20 0.15 3.35 0.19 C:823 GLU 4.12 0.69 4.78 0.12 3.58 0.44 3.12 0.02 3.89 0.28 C:824 LEU 4.56 0.65 4.96 0.28 4.16 0.66 nan nan 4.16 0.66 C:825 PRO 3.60 0.32 3.76 0.21 3.38 0.32 nan nan 3.38 0.32 C:826 ARG 3.72 0.61 4.39 0.46 3.33 0.23 3.20 0.17 3.43 0.21 C:827 HIS 4.37 0.63 4.79 0.38 4.08 0.60 3.85 0.54 4.20 0.59 C:828 ILE 4.14 0.75 4.75 0.48 3.53 0.41 nan nan 3.53 0.41 C:829 LYS 3.52 0.45 3.94 0.31 3.19 0.20 2.99 0.00 3.24 0.19 C:830 HIS 3.76 0.47 4.12 0.44 3.51 0.30 3.36 0.12 3.59 0.33 C:831 LYS 3.88 0.63 4.37 0.58 3.49 0.33 3.21 0.00 3.56 0.33 C:832 ASP 3.46 0.45 3.73 0.49 3.18 0.15 3.06 0.02 3.30 0.13 C:833 CYS 4.20 0.56 3.96 0.19 4.68 0.73 5.41 0.00 3.95 0.00 C:834 ASN 3.93 0.84 4.53 0.81 3.32 0.14 3.28 0.18 3.36 0.08 C:835 PRO 3.95 0.49 4.36 0.13 3.40 0.16 nan nan 3.40 0.16 C:836 ALA 3.97 0.47 3.99 0.53 3.87 0.00 nan nan 3.87 0.00 C:837 LYS 3.65 0.38 3.92 0.19 3.45 0.37 3.00 0.00 3.56 0.32 C:838 PRO 3.76 0.55 4.09 0.50 3.32 0.17 nan nan 3.32 0.17 C:839 GLU 3.49 0.30 3.76 0.19 3.26 0.15 3.09 0.01 3.38 0.07 C:840 LYS 3.35 0.33 3.64 0.24 3.13 0.17 2.89 0.00 3.18 0.13 C:841 LEU 3.78 0.53 4.12 0.49 3.45 0.34 nan nan 3.45 0.34 C:842 ALA 4.77 0.32 4.89 0.22 4.27 0.00 nan nan 4.27 0.00 C:843 ASN 5.22 0.56 5.51 0.19 4.93 0.65 4.57 0.63 5.29 0.42 C:844 ARG 5.30 0.62 5.04 0.26 5.45 0.72 5.90 0.27 5.11 0.76 C:845 CYS 6.95 0.43 6.66 0.18 7.52 0.08 7.59 0.00 7.44 0.00 C:846 PRO 5.22 0.83 4.90 0.92 5.65 0.41 nan nan 5.65 0.41 C:847 LEU 4.35 0.52 4.23 0.48 4.47 0.53 nan nan 4.47 0.53 C:848 CYS 4.24 0.59 4.24 0.71 4.26 0.17 4.43 0.00 4.09 0.00 C:849 HIS 3.99 0.58 4.56 0.26 3.61 0.40 3.64 0.53 3.59 0.32 C:850 GLU 4.00 0.83 4.72 0.74 3.43 0.25 3.19 0.14 3.59 0.17 C:851 ASN 4.48 0.69 4.08 0.56 4.88 0.57 5.08 0.69 4.68 0.34 C:852 PHE 4.68 0.87 4.12 0.27 5.00 0.93 nan nan 5.00 0.93 C:853 SER 3.80 0.67 4.18 0.47 3.04 0.20 2.85 0.00 3.24 0.00 C:854 PRO 3.70 0.38 3.88 0.42 3.47 0.08 nan nan 3.47 0.08 C:855 GLY 3.70 0.46 3.70 0.46 nan nan nan nan nan nan C:856 GLU 3.83 0.59 4.26 0.64 3.49 0.22 3.58 0.26 3.43 0.15 C:857 GLU 3.55 0.42 3.98 0.18 3.21 0.17 3.00 0.03 3.35 0.02 C:858 ALA 4.15 0.35 4.25 0.32 3.75 0.00 nan nan 3.75 0.00 C:859 TRP 5.65 0.94 6.29 0.33 5.40 0.99 3.89 0.00 5.56 0.90 C:860 LYS 4.11 0.66 4.61 0.61 3.72 0.36 3.33 0.00 3.81 0.34 C:861 ALA 3.65 0.31 3.80 0.12 3.07 0.00 nan nan 3.07 0.00 C:862 HIS 4.81 0.65 4.61 0.52 4.94 0.69 4.94 0.88 4.95 0.57 C:863 LEU 7.61 1.29 6.39 0.45 8.83 0.38 nan nan 8.83 0.38 C:864 MET 4.02 0.63 4.17 0.79 3.88 0.35 3.90 0.00 3.87 0.40 C:865 GLY 3.72 0.18 3.72 0.18 nan nan nan nan nan nan C:866 PRO 3.38 0.30 3.59 0.22 3.09 0.05 nan nan 3.09 0.05 C:867 ALA 3.31 0.22 3.39 0.18 3.02 0.00 nan nan 3.02 0.00 C:868 GLY 3.87 0.24 3.87 0.24 nan nan nan nan nan nan C:869 CYS 5.06 1.00 4.42 0.54 6.32 0.19 6.51 0.00 6.13 0.00 C:870 THR 3.56 0.37 3.76 0.36 3.28 0.14 3.30 0.00 3.27 0.18 C:871 MET 4.12 0.62 4.55 0.24 3.69 0.58 3.29 0.00 3.82 0.62 C:872 ASN 5.46 0.89 4.69 0.39 6.22 0.53 6.33 0.69 6.12 0.25 C:873 LEU 3.49 0.44 3.78 0.41 3.20 0.24 nan nan 3.20 0.24 C:874 ARG 4.22 0.61 3.86 0.37 4.42 0.62 4.68 0.78 4.23 0.36 C:875 LYS 3.63 0.43 3.67 0.58 3.60 0.26 3.26 0.00 3.69 0.21 D:743 PRO 3.19 0.13 3.25 0.13 3.11 0.07 nan nan 3.11 0.07 D:744 HIS 3.35 0.21 3.43 0.27 3.30 0.14 3.21 0.10 3.34 0.15 D:745 MET 3.50 0.29 3.73 0.19 3.27 0.17 3.05 0.00 3.35 0.12 D:746 ASP 3.67 0.43 4.01 0.36 3.34 0.14 3.22 0.08 3.45 0.09 D:747 GLU 3.59 0.37 3.86 0.33 3.37 0.22 3.11 0.08 3.55 0.04 D:748 HIS 3.73 0.59 4.38 0.35 3.30 0.15 3.24 0.06 3.33 0.16 D:749 TYR 4.02 0.73 4.90 0.22 3.57 0.44 2.98 0.00 3.66 0.40 D:750 LEU 3.84 0.64 4.35 0.49 3.34 0.28 nan nan 3.34 0.28 D:751 ASP 3.93 0.62 4.49 0.28 3.37 0.26 3.14 0.06 3.61 0.13 D:752 ASN 4.19 0.72 4.82 0.36 3.56 0.34 3.28 0.24 3.84 0.14 D:753 LEU 4.89 0.77 5.33 0.59 4.45 0.66 nan nan 4.45 0.66 D:754 CYS 6.21 0.72 5.78 0.46 7.09 0.07 7.16 0.00 7.01 0.00 D:755 ILE 3.77 0.57 4.10 0.60 3.44 0.27 nan nan 3.44 0.27 D:756 PHE 4.52 0.75 5.09 0.22 4.19 0.76 nan nan 4.19 0.76 D:757 CYS 5.02 0.85 4.85 0.99 5.37 0.02 5.38 0.00 5.35 0.00 D:758 GLY 3.75 0.43 3.75 0.43 nan nan nan nan nan nan D:759 GLU 3.88 0.67 4.42 0.60 3.45 0.32 3.18 0.03 3.63 0.30 D:760 ARG 3.67 0.29 3.72 0.35 3.64 0.25 3.71 0.20 3.59 0.27 D:761 SER 3.84 0.36 4.05 0.26 3.44 0.10 3.35 0.00 3.54 0.00 D:762 GLU 3.42 0.29 3.68 0.20 3.22 0.17 3.10 0.04 3.30 0.17 D:763 GLU 3.80 0.57 4.39 0.27 3.33 0.19 3.12 0.11 3.47 0.08 D:764 PHE 5.12 0.73 5.33 0.44 5.00 0.84 nan nan 5.00 0.84 D:765 THR 3.95 0.66 4.47 0.35 3.26 0.17 3.35 0.00 3.21 0.19 D:766 GLU 3.51 0.46 3.93 0.34 3.17 0.16 3.00 0.06 3.29 0.07 D:767 GLU 3.68 0.46 4.10 0.29 3.34 0.25 3.05 0.00 3.53 0.11 D:768 GLY 4.07 0.32 4.07 0.32 nan nan nan nan nan nan D:769 LEU 5.09 0.68 5.59 0.10 4.59 0.64 nan nan 4.59 0.64 D:770 ASP 3.73 0.60 4.19 0.52 3.27 0.14 3.15 0.10 3.40 0.01 D:771 LEU 3.91 0.71 4.46 0.57 3.35 0.26 nan nan 3.35 0.26 D:772 HIS 5.15 0.68 5.49 0.57 4.92 0.66 4.72 0.75 5.02 0.59 D:773 TYR 4.48 0.88 5.51 0.29 3.97 0.56 3.35 0.00 4.06 0.54 D:774 TRP 3.96 0.73 5.04 0.29 3.53 0.25 3.22 0.00 3.56 0.24 D:775 LYS 3.84 0.71 4.31 0.76 3.45 0.33 2.94 0.00 3.58 0.24 D:776 HIS 3.70 0.57 4.29 0.43 3.31 0.19 3.18 0.02 3.38 0.20 D:777 CYS 6.00 0.70 5.64 0.57 6.71 0.28 6.99 0.00 6.43 0.00 D:778 LEU 5.39 1.51 6.61 1.12 4.18 0.60 nan nan 4.18 0.60 D:779 MET 7.58 0.45 7.91 0.30 7.26 0.31 6.99 0.00 7.35 0.31 D:780 LEU 5.76 0.89 6.44 0.65 5.07 0.47 nan nan 5.07 0.47 D:781 THR 4.84 0.81 5.35 0.53 4.16 0.57 3.37 0.00 4.55 0.16 D:782 ARG 3.81 0.44 4.16 0.34 3.61 0.35 3.44 0.39 3.73 0.26 D:783 CYS 5.24 0.39 4.99 0.15 5.75 0.16 5.59 0.00 5.91 0.00 D:784 ASP 3.69 0.48 4.10 0.27 3.27 0.19 3.09 0.08 3.45 0.02 D:785 HIS 3.86 0.46 3.90 0.56 3.84 0.37 3.47 0.12 4.02 0.32 D:786 CYS 4.45 0.61 4.15 0.51 5.06 0.23 5.28 0.00 4.83 0.00 D:787 LYS 3.69 0.62 4.31 0.39 3.20 0.15 2.95 0.00 3.26 0.09 D:788 GLN 4.11 0.81 4.85 0.48 3.52 0.48 3.02 0.00 3.86 0.32 D:789 VAL 3.74 0.33 3.78 0.40 3.69 0.19 nan nan 3.69 0.19 D:790 VAL 4.63 0.54 4.50 0.51 4.80 0.54 nan nan 4.80 0.54 D:791 GLU 4.27 0.86 4.97 0.75 3.70 0.42 3.28 0.19 3.98 0.27 D:792 ILE 6.79 0.49 6.58 0.56 7.00 0.29 nan nan 7.00 0.29 D:793 SER 4.49 0.82 4.63 0.96 4.21 0.26 3.95 0.00 4.47 0.00 D:794 SER 4.44 0.58 4.82 0.17 3.68 0.28 3.39 0.00 3.96 0.00 D:795 LEU 5.07 0.83 5.70 0.25 4.43 0.71 nan nan 4.43 0.71 D:796 THR 4.45 0.31 4.69 0.17 4.14 0.08 4.17 0.00 4.12 0.10 D:797 GLU 3.78 0.63 4.33 0.47 3.34 0.31 2.98 0.05 3.58 0.12 D:798 HIS 5.58 0.62 5.93 0.55 5.35 0.56 5.17 0.48 5.43 0.57 D:799 LEU 5.72 1.14 6.72 0.21 4.73 0.77 nan nan 4.73 0.77 D:800 LEU 4.31 0.67 4.54 0.87 4.09 0.20 nan nan 4.09 0.20 D:801 THR 3.70 0.58 4.09 0.46 3.18 0.17 3.37 0.00 3.09 0.12 D:802 GLU 3.65 0.50 4.03 0.47 3.34 0.25 3.15 0.20 3.47 0.19 D:803 CYS 5.16 0.88 4.58 0.38 6.32 0.12 6.44 0.00 6.20 0.00 D:804 ASP 3.58 0.40 3.85 0.33 3.31 0.26 3.06 0.00 3.56 0.12 D:805 LYS 3.82 0.52 4.27 0.33 3.45 0.31 2.95 0.00 3.58 0.21 D:806 LYS 4.39 0.82 5.00 0.39 3.90 0.74 3.08 0.00 4.10 0.68 D:807 ASP 3.59 0.45 3.94 0.38 3.24 0.14 3.13 0.09 3.35 0.11 D:808 GLY 3.83 0.36 3.83 0.36 nan nan nan nan nan nan D:809 PHE 5.09 0.65 4.99 0.66 5.14 0.65 nan nan 5.14 0.65 D:810 GLY 4.75 0.62 4.75 0.62 nan nan nan nan nan nan D:811 LYS 4.00 0.62 4.45 0.42 3.65 0.51 2.88 0.00 3.84 0.37 D:812 CYS 5.55 0.33 5.56 0.26 5.54 0.44 5.10 0.00 5.98 0.00 D:813 TYR 3.49 0.38 3.77 0.41 3.35 0.28 2.90 0.00 3.41 0.23 D:814 ARG 3.78 0.40 3.98 0.27 3.67 0.41 3.64 0.62 3.69 0.10 D:815 CYS 5.70 0.25 5.70 0.23 5.69 0.29 5.41 0.00 5.98 0.00 D:816 SER 4.47 0.61 4.84 0.35 3.71 0.05 3.76 0.00 3.66 0.00 D:817 GLU 5.09 0.78 5.81 0.28 4.51 0.53 4.28 0.75 4.66 0.21 D:818 ALA 4.63 0.69 4.51 0.72 5.12 0.00 nan nan 5.12 0.00 D:819 VAL 4.61 0.62 4.95 0.61 4.15 0.18 nan nan 4.15 0.18 D:820 PHE 4.30 0.90 5.28 0.52 3.74 0.51 nan nan 3.74 0.51 D:821 LYS 3.69 0.53 4.08 0.55 3.38 0.20 3.00 0.00 3.48 0.08 D:822 GLU 3.46 0.24 3.54 0.28 3.39 0.18 3.28 0.11 3.47 0.18 D:823 GLU 3.88 0.58 4.47 0.21 3.41 0.27 3.12 0.14 3.60 0.11 D:824 LEU 4.64 0.68 5.15 0.18 4.12 0.61 nan nan 4.12 0.61 D:825 PRO 3.71 0.46 4.04 0.19 3.26 0.33 nan nan 3.26 0.33 D:826 ARG 3.61 0.46 4.12 0.31 3.32 0.22 3.12 0.14 3.47 0.12 D:827 HIS 4.27 0.56 4.57 0.42 4.06 0.54 3.88 0.58 4.15 0.50 D:828 ILE 4.18 0.78 4.81 0.52 3.54 0.39 nan nan 3.54 0.39 D:829 LYS 3.62 0.59 4.12 0.55 3.22 0.17 2.96 0.00 3.29 0.12 D:830 HIS 3.67 0.42 4.00 0.31 3.46 0.33 3.23 0.00 3.57 0.35 D:831 LYS 3.86 0.61 4.32 0.54 3.49 0.38 2.90 0.00 3.64 0.26 D:832 ASP 3.51 0.48 3.83 0.50 3.20 0.10 3.14 0.04 3.26 0.10 D:833 CYS 4.19 0.54 3.94 0.12 4.69 0.67 5.37 0.00 4.02 0.00 D:834 ASN 4.02 0.80 4.56 0.82 3.49 0.14 3.40 0.14 3.57 0.07 D:835 PRO 3.92 0.50 4.35 0.11 3.36 0.13 nan nan 3.36 0.13 D:836 ALA 4.05 0.48 4.06 0.54 4.04 0.00 nan nan 4.04 0.00 D:837 LYS 3.73 0.39 3.97 0.23 3.54 0.39 3.09 0.00 3.65 0.36 D:838 PRO 3.67 0.61 4.05 0.57 3.17 0.12 nan nan 3.17 0.12 D:839 GLU 3.46 0.33 3.75 0.23 3.23 0.19 3.01 0.01 3.38 0.07 D:840 LYS 3.40 0.36 3.72 0.28 3.15 0.16 2.94 0.00 3.20 0.14 D:841 LEU 3.73 0.52 4.05 0.48 3.41 0.33 nan nan 3.41 0.33 D:842 ALA 4.81 0.33 4.93 0.27 4.36 0.00 nan nan 4.36 0.00 D:843 ASN 5.13 0.53 5.33 0.32 4.92 0.62 4.66 0.74 5.17 0.28 D:844 ARG 5.10 0.83 4.50 0.27 5.45 0.85 5.99 0.31 5.04 0.89 D:845 CYS 6.69 0.54 6.32 0.20 7.41 0.05 7.46 0.00 7.37 0.00 D:846 PRO 4.76 0.66 4.59 0.75 4.98 0.42 nan nan 4.98 0.42 D:847 LEU 4.42 0.48 4.44 0.38 4.40 0.57 nan nan 4.40 0.57 D:848 CYS 4.21 0.63 4.11 0.65 4.41 0.52 4.93 0.00 3.89 0.00 D:849 HIS 4.05 0.56 4.58 0.39 3.70 0.35 3.76 0.48 3.67 0.25 D:850 GLU 4.20 0.80 4.95 0.60 3.61 0.29 3.33 0.09 3.80 0.22 D:851 ASN 4.38 0.72 3.95 0.56 4.80 0.62 5.03 0.73 4.56 0.35 D:852 PHE 4.41 0.71 3.98 0.24 4.65 0.78 nan nan 4.65 0.78 D:853 SER 3.78 0.70 4.14 0.59 3.07 0.14 2.93 0.00 3.21 0.00 D:854 PRO 3.69 0.40 3.88 0.41 3.44 0.23 nan nan 3.44 0.23 D:855 GLY 3.86 0.54 3.86 0.54 nan nan nan nan nan nan D:856 GLU 3.84 0.57 4.24 0.55 3.52 0.34 3.66 0.44 3.43 0.21 D:857 GLU 3.48 0.42 3.88 0.23 3.17 0.21 2.91 0.02 3.34 0.04 D:858 ALA 4.49 0.30 4.56 0.28 4.18 0.00 nan nan 4.18 0.00 D:859 TRP 5.73 0.96 6.51 0.30 5.42 0.96 4.04 0.00 5.57 0.89 D:860 LYS 4.19 0.71 4.80 0.52 3.70 0.40 3.21 0.00 3.83 0.36 D:861 ALA 3.90 0.30 4.04 0.14 3.35 0.00 nan nan 3.35 0.00 D:862 HIS 4.76 0.64 4.79 0.53 4.74 0.70 4.67 0.91 4.78 0.56 D:863 LEU 7.61 1.12 6.57 0.44 8.66 0.37 nan nan 8.66 0.37 D:864 MET 4.14 0.68 4.34 0.82 3.93 0.42 3.95 0.00 3.92 0.48 D:865 GLY 3.86 0.21 3.86 0.21 nan nan nan nan nan nan D:866 PRO 3.42 0.32 3.65 0.24 3.11 0.07 nan nan 3.11 0.07 D:867 ALA 3.36 0.22 3.43 0.19 3.08 0.00 nan nan 3.08 0.00 D:868 GLY 3.89 0.19 3.89 0.19 nan nan nan nan nan nan D:869 CYS 5.27 0.99 4.64 0.52 6.53 0.14 6.67 0.00 6.38 0.00 D:870 THR 3.65 0.47 3.94 0.42 3.26 0.11 3.25 0.00 3.26 0.13 D:871 MET 4.12 0.66 4.56 0.34 3.67 0.59 3.29 0.00 3.80 0.63 D:872 ASN 5.51 1.03 4.65 0.61 6.36 0.54 6.48 0.69 6.24 0.27 D:873 LEU 3.45 0.45 3.71 0.47 3.20 0.21 nan nan 3.20 0.21 D:874 ARG 4.20 0.59 3.84 0.32 4.41 0.61 4.66 0.78 4.22 0.33 D:875 LYS 3.74 0.41 3.60 0.54 3.85 0.22 4.08 0.00 3.79 0.21