#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1af9 s ASP 876 N 0.00 6.87 0.27 1.62 -1.08 -1.26 -4.95 116.67 118.15 1af9 s ASP 876 Ca 0.00 1.04 0.01 0.00 -0.52 0.00 0.00 52.55 53.08 1af9 s ASP 876 Cb 0.00 -2.28 0.59 0.00 -1.46 0.00 0.00 42.92 39.77 1af9 s ASP 876 CO 0.00 0.29 1.76 0.40 0.52 0.00 0.00 175.17 178.14 1af9 h ILE 877 N 3.74 0.70 -0.30 4.11 2.04 -1.99 0.46 117.51 126.26 1af9 h ILE 877 Ca -0.50 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 1af9 h ILE 877 Cb 1.21 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1af9 h ILE 877 CO 0.63 0.12 0.18 0.44 0.00 0.00 0.00 178.15 179.52 1af9 h ASP 878 N 0.64 0.36 0.14 1.72 3.32 -1.99 0.68 116.42 121.28 1af9 h ASP 878 Ca 0.50 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.53 1af9 h ASP 878 Cb 0.74 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1af9 h ASP 878 CO -0.38 0.28 -0.07 0.58 -1.72 0.00 0.00 179.24 177.93 1af9 h VAL 879 N 0.41 1.01 -0.45 -1.35 2.07 -1.35 -2.70 116.25 113.89 1af9 h VAL 879 Ca 0.11 -1.05 0.08 0.00 0.82 0.00 0.00 66.70 66.66 1af9 h VAL 879 Cb -0.01 1.62 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 1af9 h VAL 879 CO -0.02 0.23 0.06 0.40 0.02 0.00 0.00 177.57 178.26 1af9 h ILE 880 N -0.73 0.71 -0.31 4.57 2.04 -0.64 -0.67 117.51 122.48 1af9 h ILE 880 Ca -0.02 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1af9 h ILE 880 Cb 0.52 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1af9 h ILE 880 CO 0.03 0.03 0.17 -0.07 0.00 0.00 0.00 178.15 178.31 1af9 h LEU 881 N 0.18 0.37 0.27 1.44 3.38 -0.95 -0.41 115.31 119.59 1af9 h LEU 881 Ca 0.23 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1af9 h LEU 881 Cb 0.31 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1af9 h LEU 881 CO -0.32 0.31 -0.13 0.50 0.09 0.00 0.00 178.44 178.89 1af9 h LYS 882 N 0.43 -0.34 -0.33 1.13 3.11 -0.85 -3.19 116.57 116.52 1af9 h LYS 882 Ca 0.11 0.02 -0.04 0.00 -2.81 0.00 0.00 60.65 57.93 1af9 h LYS 882 Cb 0.02 0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.31 1af9 h LYS 882 CO -0.02 0.00 0.02 0.87 -2.81 0.00 0.00 179.45 177.52 1af9 h LYS 883 N -0.90 0.49 0.00 1.90 1.57 -1.09 -2.81 116.57 115.74 1af9 h LYS 883 Ca -0.04 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1af9 h LYS 883 Cb 0.51 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1af9 h LYS 883 CO 0.06 0.51 0.00 0.43 -0.57 0.00 0.00 179.45 179.88 1af9 n SER 884 N -4.31 0.00 -4.67 0.86 7.64 -0.17 -4.82 113.62 108.15 1af9 n SER 884 Ca 0.01 0.13 -0.41 0.00 1.01 0.00 0.00 58.87 59.61 1af9 n SER 884 Cb 0.22 -0.37 -0.04 0.00 -1.01 0.00 0.00 64.21 63.01 1af9 n SER 884 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1af9 s THR 885 N -2.73 4.91 0.00 0.44 2.01 -1.06 -0.72 115.64 118.48 1af9 s THR 885 Ca 0.20 1.58 0.00 0.00 0.31 0.00 0.00 61.69 63.78 1af9 s THR 885 Cb 0.18 -4.11 0.00 0.00 0.01 0.00 0.00 72.50 68.57 1af9 s THR 885 CO 0.43 0.05 0.34 2.30 -0.69 0.00 0.00 174.62 177.05 1af9 n ILE 886 N 4.65 0.00 -3.65 1.82 -6.64 -0.77 -4.93 119.36 109.85 1af9 n ILE 886 Ca 0.03 -0.48 -0.07 0.00 -1.77 0.00 0.00 62.75 60.46 1af9 n ILE 886 Cb 0.49 1.03 -0.08 0.00 -1.44 0.00 0.00 39.64 39.64 1af9 n ILE 886 CO 0.00 0.00 0.00 -0.22 -1.77 0.00 0.00 176.55 174.56 1af9 s LEU 887 N -0.58 -0.79 -0.27 7.28 0.20 -1.22 -4.69 118.68 118.60 1af9 s LEU 887 Ca 0.00 1.39 -0.01 0.00 0.69 0.00 0.00 54.13 56.20 1af9 s LEU 887 Cb 0.00 2.16 0.16 0.00 -0.43 0.00 0.00 46.19 48.08 1af9 s LEU 887 CO 0.00 -0.23 0.47 0.21 -0.29 0.00 0.00 176.35 176.52 1af9 s ASN 888 N 1.73 -0.45 -0.08 3.68 2.47 -1.26 -0.54 114.94 120.48 1af9 s ASN 888 Ca -0.09 0.39 -0.18 0.00 0.42 0.00 0.00 52.86 53.40 1af9 s ASN 888 Cb -0.06 1.55 -0.05 0.00 -1.45 0.00 0.00 41.25 41.24 1af9 s ASN 888 CO -0.18 -0.29 0.48 -0.76 -3.72 0.00 0.00 177.10 172.63 1af9 s LEU 889 N 2.68 4.33 -0.00 3.21 1.43 -0.48 -0.17 118.68 129.67 1af9 s LEU 889 Ca 0.15 0.89 0.01 0.00 -1.03 0.00 0.00 54.13 54.16 1af9 s LEU 889 Cb -0.15 -2.71 -0.00 0.00 0.03 0.00 0.00 46.19 43.36 1af9 s LEU 889 CO -0.20 0.07 -0.04 -0.62 0.23 0.00 0.00 176.35 175.79 1af9 s ASP 890 N 0.22 0.49 -0.21 2.29 2.15 0.96 -4.25 116.67 118.33 1af9 s ASP 890 Ca 0.26 -0.08 -0.19 0.00 0.43 0.00 0.00 52.55 52.97 1af9 s ASP 890 Cb -0.16 -0.06 -0.03 0.00 -0.30 0.00 0.00 42.92 42.38 1af9 s ASP 890 CO 0.12 0.05 0.56 -0.63 -0.17 0.00 0.00 175.17 175.10 1af9 s ILE 891 N -0.08 5.06 -0.10 4.11 -1.09 -1.26 -1.60 121.20 126.24 1af9 s ILE 891 Ca 0.01 1.04 -0.04 0.00 -2.23 0.00 0.00 60.65 59.43 1af9 s ILE 891 Cb -0.02 -3.88 0.05 0.00 -1.58 0.00 0.00 42.46 37.03 1af9 s ILE 891 CO -0.00 0.13 0.22 0.21 -1.23 0.00 0.00 174.94 174.27 1af9 s ASN 892 N 1.24 0.24 -1.30 3.58 3.04 -0.60 -4.79 114.94 116.34 1af9 s ASN 892 Ca 0.25 0.48 0.00 0.00 0.04 0.00 0.00 52.86 53.63 1af9 s ASN 892 Cb -0.16 0.46 0.00 0.00 -1.54 0.00 0.00 41.25 40.01 1af9 s ASN 892 CO 0.10 -0.21 0.00 0.59 -3.04 0.00 0.00 177.10 174.54 1af9 n ASN 893 N 4.92 -4.42 -0.76 -4.21 3.02 -1.26 -1.99 115.26 110.56 1af9 n ASN 893 Ca -0.13 0.16 -0.10 0.00 -0.03 0.00 0.00 54.58 54.48 1af9 n ASN 893 Cb 0.51 -3.37 -0.04 0.00 -0.61 0.00 0.00 39.78 36.26 1af9 n ASN 893 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1af9 n ASP 894 N -0.41 -4.48 -4.38 6.41 8.00 -1.26 -4.99 116.55 115.44 1af9 n ASP 894 Ca -0.15 0.25 -0.33 0.00 0.71 0.00 0.00 54.79 55.27 1af9 n ASP 894 Cb 0.54 -2.85 -0.14 0.00 -0.02 0.00 0.00 41.12 38.64 1af9 n ASP 894 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1af9 s ILE 895 N -2.27 2.92 -0.02 0.53 -1.09 -0.84 -5.11 121.20 115.32 1af9 s ILE 895 Ca 0.00 -0.73 -0.24 0.00 -2.23 0.00 0.00 60.65 57.45 1af9 s ILE 895 Cb 0.00 -2.19 -0.04 0.00 -1.58 0.00 0.00 42.46 38.64 1af9 s ILE 895 CO 0.00 0.54 0.75 -0.63 -1.23 0.00 0.00 174.94 174.37 1af9 s ILE 896 N 0.09 4.92 0.15 2.92 1.01 -1.26 -1.56 121.20 127.46 1af9 s ILE 896 Ca -0.06 1.56 -0.10 0.00 0.00 0.00 0.00 60.65 62.04 1af9 s ILE 896 Cb -0.15 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.23 1af9 s ILE 896 CO 0.05 0.29 0.30 -0.55 0.00 0.00 0.00 174.94 175.02 1af9 s SER 897 N 0.49 0.01 -0.37 3.58 0.15 -0.63 -4.83 113.70 112.10 1af9 s SER 897 Ca 0.39 -0.74 -0.13 0.00 0.70 0.00 0.00 55.95 56.17 1af9 s SER 897 Cb -0.19 0.43 0.01 0.00 -1.71 0.00 0.00 66.02 64.56 1af9 s SER 897 CO 0.21 -0.87 0.25 -0.62 1.20 0.00 0.00 173.24 173.40 1af9 s ASP 898 N -2.92 5.96 -0.12 5.45 2.15 -1.26 -0.02 116.67 125.90 1af9 s ASP 898 Ca 0.12 -0.71 0.17 0.00 0.43 0.00 0.00 52.55 52.56 1af9 s ASP 898 Cb 0.03 -2.11 0.72 0.00 -0.30 0.00 0.00 42.92 41.26 1af9 s ASP 898 CO -0.04 -0.34 1.62 2.30 -0.17 0.00 0.00 175.17 178.54 1af9 n ILE 899 N 5.09 1.87 0.09 4.11 -5.35 0.76 -4.49 119.36 121.44 1af9 n ILE 899 Ca -0.12 -1.16 0.04 0.00 -0.27 0.00 0.00 62.75 61.23 1af9 n ILE 899 Cb 0.48 0.06 0.43 0.00 -1.74 0.00 0.00 39.64 38.88 1af9 n ILE 899 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1af9 h SER 900 N 3.99 0.31 0.00 7.28 4.64 -1.90 -3.46 113.55 124.40 1af9 h SER 900 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1af9 h SER 900 Cb 1.48 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 1af9 h SER 900 CO 0.26 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 177.15 1af9 n GLY 901 N -1.20 1.91 0.23 -0.77 0.00 -1.26 -4.87 105.19 99.23 1af9 n GLY 901 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1af9 n GLY 901 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1af9 h PHE 902 N 0.00 0.00 -5.09 1.61 -1.00 -1.89 -3.48 116.94 107.09 1af9 h PHE 902 Ca 0.00 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.65 1af9 h PHE 902 Cb 0.00 0.00 0.10 0.00 3.61 0.00 0.00 35.95 39.66 1af9 h PHE 902 CO 0.00 0.05 -0.44 0.09 -1.61 0.00 0.00 178.31 176.40 1af9 n ASN 903 N -3.12 -6.45 -4.78 2.17 3.02 -1.26 -4.80 115.26 100.04 1af9 n ASN 903 Ca 0.03 -0.38 -0.38 0.00 -0.03 0.00 0.00 54.58 53.82 1af9 n ASN 903 Cb 0.49 -4.65 -0.06 0.00 -0.61 0.00 0.00 39.78 34.95 1af9 n ASN 903 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1af9 s SER 904 N -3.14 7.35 0.01 6.41 0.01 -1.26 -4.70 113.70 118.38 1af9 s SER 904 Ca 0.23 1.76 -0.30 0.00 1.31 0.00 0.00 55.95 58.95 1af9 s SER 904 Cb -0.03 -2.55 -0.06 0.00 0.21 0.00 0.00 66.02 63.59 1af9 s SER 904 CO 0.64 0.02 1.41 -0.55 0.41 0.00 0.00 173.24 175.18 1af9 s SER 905 N -1.49 6.84 -0.20 2.44 0.15 -0.26 -4.52 113.70 116.66 1af9 s SER 905 Ca 0.46 2.15 -0.01 0.00 0.70 0.00 0.00 55.95 59.24 1af9 s SER 905 Cb -0.20 -2.56 0.01 0.00 -1.71 0.00 0.00 66.02 61.56 1af9 s SER 905 CO 0.25 -0.72 -0.14 -0.69 1.20 0.00 0.00 173.24 173.14 1af9 s VAL 906 N 2.30 2.57 -0.09 4.45 1.01 -1.26 0.18 120.40 129.55 1af9 s VAL 906 Ca 0.64 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.83 1af9 s VAL 906 Cb -0.32 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 1af9 s VAL 906 CO 0.27 0.49 0.04 -0.63 0.00 0.00 0.00 175.10 175.27 1af9 s ILE 907 N 1.36 4.64 -0.10 2.22 -1.09 0.12 -4.97 121.20 123.38 1af9 s ILE 907 Ca 0.05 -0.13 0.01 0.00 -2.23 0.00 0.00 60.65 58.36 1af9 s ILE 907 Cb -0.13 -2.97 0.02 0.00 -1.58 0.00 0.00 42.46 37.79 1af9 s ILE 907 CO -0.09 0.61 -0.12 -0.89 -1.23 0.00 0.00 174.94 173.21 1af9 s THR 908 N -0.93 1.29 0.45 2.92 2.01 -1.26 -0.29 115.64 119.84 1af9 s THR 908 Ca 0.14 -0.51 -0.09 0.00 0.31 0.00 0.00 61.69 61.54 1af9 s THR 908 Cb -0.12 -1.21 -0.05 0.00 0.01 0.00 0.00 72.50 71.13 1af9 s THR 908 CO 0.03 0.40 0.80 -0.31 -0.69 0.00 0.00 174.62 174.85 1af9 s TYR 909 N 1.11 3.52 0.32 4.92 1.51 -0.20 -5.00 117.35 123.53 1af9 s TYR 909 Ca -0.05 0.98 0.08 0.00 -1.01 0.00 0.00 57.07 57.07 1af9 s TYR 909 Cb -0.14 -2.42 0.92 0.00 -0.11 0.00 0.00 41.96 40.21 1af9 s TYR 909 CO -0.02 -0.22 1.60 -1.35 -1.11 0.00 0.00 175.55 174.44 1af9 h PRO 910 N 0.74 0.07 -0.58 -1.71 0.11 -1.88 -2.10 132.00 126.66 1af9 h PRO 910 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1af9 h PRO 910 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1af9 h PRO 910 CO 0.63 0.05 0.00 -3.47 -0.21 0.00 0.00 178.00 175.00 1af9 n ASP 911 N -5.33 3.17 -4.62 -2.05 -0.08 -0.53 -4.79 116.55 102.32 1af9 n ASP 911 Ca 0.27 -2.23 -0.43 0.00 -1.51 0.00 0.00 54.79 50.89 1af9 n ASP 911 Cb 0.90 -0.44 -0.02 0.00 2.34 0.00 0.00 41.12 43.90 1af9 n ASP 911 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1af9 s ALA 912 N -1.65 3.35 0.19 -1.67 0.00 -0.79 -4.39 121.76 116.80 1af9 s ALA 912 Ca 0.34 -0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.10 1af9 s ALA 912 Cb 0.21 -3.77 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 1af9 s ALA 912 CO 0.18 -1.82 0.20 -0.65 0.00 0.00 0.00 175.76 173.67 1af9 s GLN 913 N 3.99 3.06 -0.15 0.00 -0.21 -0.53 -4.93 119.66 120.89 1af9 s GLN 913 Ca 0.46 -0.86 -0.04 0.00 0.02 0.00 0.00 55.36 54.95 1af9 s GLN 913 Cb -0.10 -2.71 -0.03 0.00 1.00 0.00 0.00 33.01 31.18 1af9 s GLN 913 CO 0.22 0.46 -0.04 -0.51 -2.12 0.00 0.00 175.29 173.31 1af9 s LEU 914 N -3.42 3.27 0.32 2.90 1.43 -1.26 0.70 118.68 122.62 1af9 s LEU 914 Ca 0.32 -0.11 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 1af9 s LEU 914 Cb -0.10 -1.78 -0.06 0.00 0.03 0.00 0.00 46.19 44.28 1af9 s LEU 914 CO 0.25 0.18 0.05 0.68 0.23 0.00 0.00 176.35 177.74 1af9 s VAL 915 N 0.29 1.23 0.59 -1.59 -7.23 -0.93 -4.93 120.40 107.83 1af9 s VAL 915 Ca -0.03 -2.01 -0.17 0.00 -1.81 0.00 0.00 61.98 57.97 1af9 s VAL 915 Cb -0.14 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 33.98 1af9 s VAL 915 CO 0.03 -0.02 1.07 -2.16 -0.31 0.00 0.00 175.10 173.71 1af9 s PRO 916 N -3.88 3.29 0.00 4.82 0.04 -1.26 -0.54 135.00 137.47 1af9 s PRO 916 Ca 0.36 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.70 1af9 s PRO 916 Cb 0.09 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1af9 s PRO 916 CO 0.15 -0.85 0.00 0.41 0.04 0.00 0.00 177.00 176.76 1af9 n GLY 917 N -0.68 4.60 0.33 0.56 0.00 -0.86 -4.50 105.19 104.64 1af9 n GLY 917 Ca 0.09 -1.13 0.03 0.00 0.00 0.00 0.00 46.02 45.01 1af9 n GLY 917 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1af9 h ILE 918 N 0.00 0.98 -0.81 -0.61 1.08 -1.91 -3.36 117.51 112.88 1af9 h ILE 918 Ca 0.00 -0.32 -0.34 0.00 -0.39 0.00 0.00 64.86 63.80 1af9 h ILE 918 Cb 0.00 -0.04 -0.23 0.00 -3.07 0.00 0.00 36.82 33.47 1af9 h ILE 918 CO 0.00 0.17 -0.72 -3.20 -0.69 0.00 0.00 178.15 173.71 1af9 n ASN 919 N -4.65 -1.81 0.00 1.72 5.15 -1.26 -4.88 115.26 109.54 1af9 n ASN 919 Ca 0.14 -3.05 0.00 0.00 -0.60 0.00 0.00 54.58 51.07 1af9 n ASN 919 Cb 0.24 0.91 0.00 0.00 -0.53 0.00 0.00 39.78 40.40 1af9 n ASN 919 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1af9 n GLY 920 N 1.67 0.17 3.38 8.20 0.00 -1.26 -5.03 105.19 112.32 1af9 n GLY 920 Ca 0.14 -1.32 -0.27 0.00 0.00 0.00 0.00 46.02 44.57 1af9 n GLY 920 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1af9 s LYS 921 N 0.00 1.38 0.41 1.61 1.02 -1.26 -2.02 119.74 120.88 1af9 s LYS 921 Ca 0.00 -1.38 0.06 0.00 0.02 0.00 0.00 55.97 54.67 1af9 s LYS 921 Cb 0.00 -1.76 -0.07 0.00 -0.52 0.00 0.00 37.83 35.48 1af9 s LYS 921 CO 0.00 0.40 0.02 0.00 -0.92 0.00 0.00 175.35 174.85 1af9 s ALA 922 N -1.33 3.17 -0.07 5.17 0.00 0.30 -4.67 121.76 124.32 1af9 s ALA 922 Ca 0.15 -2.01 -0.17 0.00 0.00 0.00 0.00 51.96 49.93 1af9 s ALA 922 Cb -0.09 0.23 -0.05 0.00 0.00 0.00 0.00 23.12 23.22 1af9 s ALA 922 CO 0.07 -0.14 0.46 0.42 0.00 0.00 0.00 175.76 176.57 1af9 s ILE 923 N -2.82 5.11 -0.22 0.00 1.01 -0.15 -2.18 121.20 121.95 1af9 s ILE 923 Ca 0.31 0.93 0.01 0.00 0.00 0.00 0.00 60.65 61.90 1af9 s ILE 923 Cb 0.09 -3.79 0.04 0.00 0.01 0.00 0.00 42.46 38.81 1af9 s ILE 923 CO 0.16 0.42 -0.14 -2.28 0.00 0.00 0.00 174.94 173.09 1af9 s HIS 924 N 0.02 3.03 -0.16 3.97 2.46 0.22 -0.61 115.29 124.22 1af9 s HIS 924 Ca 0.25 -1.92 -0.05 0.00 0.47 0.00 0.00 55.06 53.81 1af9 s HIS 924 Cb -0.16 -1.94 -0.03 0.00 -0.13 0.00 0.00 32.58 30.32 1af9 s HIS 924 CO 0.11 -0.83 -0.01 -0.51 -2.47 0.00 0.00 174.74 171.03 1af9 s LEU 925 N 1.22 3.37 0.42 8.88 1.43 0.87 -1.45 118.68 133.42 1af9 s LEU 925 Ca -0.02 -0.09 0.08 0.00 -1.03 0.00 0.00 54.13 53.08 1af9 s LEU 925 Cb -0.16 -1.82 -0.00 0.00 0.03 0.00 0.00 46.19 44.23 1af9 s LEU 925 CO -0.08 0.17 0.49 0.68 0.23 0.00 0.00 176.35 177.83 1af9 s VAL 926 N 0.38 2.83 -1.29 -1.59 -7.23 -1.26 -0.91 120.40 111.33 1af9 s VAL 926 Ca -0.02 -1.15 -0.16 0.00 -1.81 0.00 0.00 61.98 58.84 1af9 s VAL 926 Cb -0.14 -2.98 0.10 0.00 0.56 0.00 0.00 36.38 33.92 1af9 s VAL 926 CO 0.02 0.00 1.71 -3.20 -0.31 0.00 0.00 175.10 173.32 1af9 n ASN 927 N -1.73 4.92 -3.49 4.85 5.15 -0.99 -4.66 115.26 119.32 1af9 n ASN 927 Ca 0.06 -2.94 -0.15 0.00 -0.60 0.00 0.00 54.58 50.95 1af9 n ASN 927 Cb 0.60 -1.68 -0.04 0.00 -0.53 0.00 0.00 39.78 38.13 1af9 n ASN 927 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1af9 s ASN 928 N 3.60 -0.61 0.53 1.20 2.20 -1.26 -4.89 114.94 115.71 1af9 s ASN 928 Ca 0.50 0.42 0.21 0.00 -0.94 0.00 0.00 52.86 53.05 1af9 s ASN 928 Cb 0.03 0.55 1.36 0.00 -2.00 0.00 0.00 41.25 41.19 1af9 s ASN 928 CO 0.04 -0.73 2.10 -0.33 -2.94 0.00 0.00 177.10 175.24 1af9 h GLU 929 N 2.59 0.00 0.00 3.55 5.08 -1.95 -2.66 114.58 121.19 1af9 h GLU 929 Ca -0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1af9 h GLU 929 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1af9 h GLU 929 CO 0.38 0.00 0.00 1.03 -1.00 0.00 0.00 179.01 179.42 1af9 h SER 930 N 0.00 0.00 -3.20 1.42 0.87 -1.96 -3.40 113.55 107.29 1af9 h SER 930 Ca 0.09 0.00 -0.74 0.00 -1.23 0.00 0.00 61.79 59.91 1af9 h SER 930 Cb 0.38 0.00 -0.22 0.00 -0.44 0.00 0.00 62.40 62.12 1af9 h SER 930 CO -0.00 0.00 0.35 -0.55 -0.53 0.00 0.00 176.83 176.10 1af9 s SER 931 N -4.86 6.63 -0.10 6.23 0.15 -1.00 -1.45 113.70 119.30 1af9 s SER 931 Ca 0.08 -2.29 -0.20 0.00 0.70 0.00 0.00 55.95 54.24 1af9 s SER 931 Cb 0.10 -2.29 0.05 0.00 -1.71 0.00 0.00 66.02 62.17 1af9 s SER 931 CO 0.56 -0.82 0.48 -0.70 1.20 0.00 0.00 173.24 173.96 1af9 s GLU 932 N 1.39 0.72 -0.07 5.44 2.12 -1.26 -4.61 118.70 122.43 1af9 s GLU 932 Ca 0.22 0.30 0.02 0.00 0.36 0.00 0.00 54.97 55.87 1af9 s GLU 932 Cb -0.10 0.34 0.02 0.00 0.26 0.00 0.00 34.13 34.64 1af9 s GLU 932 CO -0.07 -0.17 -0.10 0.08 -0.54 0.00 0.00 175.26 174.46 1af9 s VAL 933 N -0.60 1.03 -0.15 3.70 1.01 -0.85 -1.04 120.40 123.50 1af9 s VAL 933 Ca -0.07 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1af9 s VAL 933 Cb -0.03 -0.97 0.01 0.00 0.00 0.00 0.00 36.38 35.39 1af9 s VAL 933 CO 0.04 0.34 -0.20 -0.63 0.00 0.00 0.00 175.10 174.65 1af9 s ILE 934 N 0.82 2.20 -0.26 2.22 1.01 0.61 -1.78 121.20 126.02 1af9 s ILE 934 Ca -0.12 -0.93 -0.09 0.00 0.00 0.00 0.00 60.65 59.52 1af9 s ILE 934 Cb -0.15 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 1af9 s ILE 934 CO 0.02 0.54 0.12 -0.69 0.00 0.00 0.00 174.94 174.92 1af9 s VAL 935 N 0.89 4.73 -0.39 2.92 1.01 -0.51 0.13 120.40 129.17 1af9 s VAL 935 Ca -0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 1af9 s VAL 935 Cb -0.15 -3.23 0.03 0.00 0.00 0.00 0.00 36.38 33.03 1af9 s VAL 935 CO -0.03 0.31 0.25 -2.28 0.00 0.00 0.00 175.10 173.35 1af9 s HIS 936 N 1.62 3.25 0.48 5.22 2.46 0.13 -0.71 115.29 127.72 1af9 s HIS 936 Ca 0.06 -0.84 -0.24 0.00 0.47 0.00 0.00 55.06 54.52 1af9 s HIS 936 Cb -0.15 -2.52 -0.08 0.00 -0.13 0.00 0.00 32.58 29.71 1af9 s HIS 936 CO 0.06 -0.64 1.36 1.63 -2.47 0.00 0.00 174.74 174.69 1af9 n LYS 937 N 5.06 1.99 -2.16 2.88 5.02 -0.79 -1.10 118.16 129.06 1af9 n LYS 937 Ca -0.11 0.71 -0.35 0.00 -2.02 0.00 0.00 58.31 56.54 1af9 n LYS 937 Cb 0.46 -2.55 0.01 0.00 -0.02 0.00 0.00 35.03 32.94 1af9 n LYS 937 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1af9 s ALA 938 N -1.23 2.63 0.56 7.82 0.00 -1.26 -4.86 121.76 125.42 1af9 s ALA 938 Ca 0.65 0.90 0.28 0.00 0.00 0.00 0.00 51.96 53.79 1af9 s ALA 938 Cb -0.45 -3.40 1.48 0.00 0.00 0.00 0.00 23.12 20.75 1af9 s ALA 938 CO 0.55 -0.93 1.95 0.52 0.00 0.00 0.00 175.76 177.85 1af9 h MET 939 N 1.07 0.00 0.00 0.00 0.00 -1.94 -0.46 114.93 113.60 1af9 h MET 939 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.20 1af9 h MET 939 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.88 1af9 h MET 939 CO 0.56 0.00 -1.22 -0.25 0.00 0.00 0.00 176.91 176.00 1af9 n ASP 940 N -4.00 0.64 -2.46 1.22 8.00 -1.26 -4.60 116.55 114.08 1af9 n ASP 940 Ca 0.09 0.21 -0.09 0.00 0.71 0.00 0.00 54.79 55.71 1af9 n ASP 940 Cb 0.65 0.82 -0.07 0.00 -0.02 0.00 0.00 41.12 42.50 1af9 n ASP 940 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1af9 n ILE 941 N -2.52 1.69 -2.99 0.53 3.06 -0.18 -4.84 119.36 114.10 1af9 n ILE 941 Ca -0.01 -0.89 -0.43 0.00 -2.50 0.00 0.00 62.75 58.92 1af9 n ILE 941 Cb 0.54 -1.83 -0.05 0.00 0.54 0.00 0.00 39.64 38.85 1af9 n ILE 941 CO 0.00 0.00 0.00 -1.61 -2.50 0.00 0.00 176.55 172.44 1af9 s GLU 942 N 2.36 3.18 0.00 9.51 2.02 -1.26 -4.83 118.70 129.67 1af9 s GLU 942 Ca 0.34 -0.73 0.06 0.00 0.02 0.00 0.00 54.97 54.66 1af9 s GLU 942 Cb 0.15 -4.13 -0.06 0.00 0.10 0.00 0.00 34.13 30.18 1af9 s GLU 942 CO -0.01 -1.46 0.28 2.48 0.02 0.00 0.00 175.26 176.58 1af9 n TYR 943 N 6.90 0.00 -2.42 1.61 4.11 -1.26 -4.74 117.16 121.35 1af9 n TYR 943 Ca -0.04 0.00 -0.27 0.00 -0.00 0.00 0.00 57.90 57.59 1af9 n TYR 943 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.80 1af9 n TYR 943 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 1af9 n ASN 944 N -1.08 4.81 -2.50 9.48 3.02 -1.26 -4.52 115.26 123.21 1af9 n ASN 944 Ca 0.01 -3.73 0.00 0.00 -0.03 0.00 0.00 54.58 50.84 1af9 n ASN 944 Cb 0.10 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 1af9 n ASN 944 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1af9 n ASP 945 N -0.50 -0.27 -4.57 6.41 9.92 -1.26 -4.15 116.55 122.12 1af9 n ASP 945 Ca 0.40 -0.56 -0.46 0.00 -0.53 0.00 0.00 54.79 53.64 1af9 n ASP 945 Cb 0.68 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 41.11 1af9 n ASP 945 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 1af9 n MET 946 N -0.83 1.83 -2.72 -1.24 2.81 -1.26 -1.92 117.12 113.79 1af9 n MET 946 Ca 0.00 0.55 -0.21 0.00 -1.81 0.00 0.00 57.70 56.23 1af9 n MET 946 Cb 0.00 -2.93 0.01 0.00 -0.71 0.00 0.00 33.22 29.59 1af9 n MET 946 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1af9 n PHE 947 N 10.18 -1.50 -3.16 2.03 3.01 -1.26 -4.98 117.46 121.78 1af9 n PHE 947 Ca 0.31 0.26 -0.40 0.00 1.01 0.00 0.00 57.45 58.62 1af9 n PHE 947 Cb 0.37 -4.12 -0.07 0.00 -0.01 0.00 0.00 39.48 35.65 1af9 n PHE 947 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 1af9 s ASN 948 N -2.37 6.53 0.49 4.37 0.01 -0.81 -4.83 114.94 118.33 1af9 s ASN 948 Ca 0.15 0.65 -0.23 0.00 -0.71 0.00 0.00 52.86 52.73 1af9 s ASN 948 Cb -0.07 -2.32 -0.07 0.00 0.41 0.00 0.00 41.25 39.21 1af9 s ASN 948 CO 0.19 -0.33 1.26 0.20 -1.51 0.00 0.00 177.10 176.91 1af9 s ASN 949 N 1.47 5.84 0.06 -1.22 0.01 -1.26 -4.63 114.94 115.20 1af9 s ASN 949 Ca 0.25 2.53 -0.22 0.00 -0.71 0.00 0.00 52.86 54.70 1af9 s ASN 949 Cb -0.16 -2.62 0.05 0.00 0.41 0.00 0.00 41.25 38.94 1af9 s ASN 949 CO 0.09 -1.16 0.53 0.72 -1.51 0.00 0.00 177.10 175.76 1af9 s PHE 950 N -1.41 -0.43 0.02 2.20 -0.71 -0.73 -3.49 117.98 113.42 1af9 s PHE 950 Ca 0.66 0.46 0.04 0.00 -1.04 0.00 0.00 56.93 57.05 1af9 s PHE 950 Cb -0.34 0.36 -0.02 0.00 -1.21 0.00 0.00 43.02 41.81 1af9 s PHE 950 CO 0.42 -0.66 -0.13 0.99 -1.34 0.00 0.00 175.22 174.49 1af9 s THR 951 N -2.58 1.01 -0.07 -4.49 2.01 -1.03 0.52 115.64 111.01 1af9 s THR 951 Ca -0.05 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.18 1af9 s THR 951 Cb -0.01 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.62 1af9 s THR 951 CO -0.03 0.10 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.20 1af9 s VAL 952 N -0.62 1.14 0.13 3.82 1.01 -0.75 -0.44 120.40 124.69 1af9 s VAL 952 Ca 0.02 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 61.59 1af9 s VAL 952 Cb -0.06 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 1af9 s VAL 952 CO 0.00 0.36 -0.10 -0.94 0.00 0.00 0.00 175.10 174.42 1af9 s SER 953 N 0.83 1.72 -0.28 3.32 1.04 -0.06 -1.02 113.70 119.23 1af9 s SER 953 Ca -0.11 -0.94 -0.34 0.00 0.48 0.00 0.00 55.95 55.04 1af9 s SER 953 Cb -0.15 -0.01 0.18 0.00 0.10 0.00 0.00 66.02 66.13 1af9 s SER 953 CO 0.02 -0.30 1.36 0.72 0.98 0.00 0.00 173.24 176.03 1af9 s PHE 954 N -2.99 -0.03 0.06 5.02 -0.71 -0.80 -0.92 117.98 117.61 1af9 s PHE 954 Ca 0.13 0.03 -0.19 0.00 -1.04 0.00 0.00 56.93 55.86 1af9 s PHE 954 Cb 0.00 0.50 -0.06 0.00 -1.21 0.00 0.00 43.02 42.25 1af9 s PHE 954 CO 0.01 -0.03 0.56 -1.58 -1.34 0.00 0.00 175.22 172.83 1af9 s TRP 955 N -1.54 3.79 0.21 3.49 0.52 0.58 -0.36 118.94 125.62 1af9 s TRP 955 Ca 0.10 1.25 0.10 0.00 0.02 0.00 0.00 56.10 57.57 1af9 s TRP 955 Cb -0.01 -2.50 -0.05 0.00 -1.15 0.00 0.00 33.47 29.76 1af9 s TRP 955 CO -0.05 0.56 -0.20 -1.17 0.02 0.00 0.00 176.95 176.11 1af9 s LEU 956 N -0.98 2.49 -0.29 2.99 2.96 0.57 -1.56 118.68 124.87 1af9 s LEU 956 Ca 0.29 -0.93 0.01 0.00 -0.22 0.00 0.00 54.13 53.28 1af9 s LEU 956 Cb -0.19 -0.98 0.18 0.00 0.50 0.00 0.00 46.19 45.70 1af9 s LEU 956 CO 0.18 0.01 0.54 -0.60 -1.32 0.00 0.00 176.35 175.17 1af9 s ARG 957 N -3.06 0.51 -0.07 1.98 3.52 -0.91 -1.47 118.95 119.45 1af9 s ARG 957 Ca 0.22 0.72 0.06 0.00 -0.13 0.00 0.00 55.73 56.60 1af9 s ARG 957 Cb -0.05 0.22 -0.01 0.00 -1.56 0.00 0.00 34.95 33.54 1af9 s ARG 957 CO 0.10 -0.78 -0.24 0.14 -0.81 0.00 0.00 175.30 173.71 1af9 s VAL 958 N 2.77 2.10 1.02 7.11 -7.23 -1.26 -2.27 120.40 122.63 1af9 s VAL 958 Ca 0.16 -1.04 -0.13 0.00 -1.81 0.00 0.00 61.98 59.15 1af9 s VAL 958 Cb -0.14 -1.77 0.13 0.00 0.56 0.00 0.00 36.38 35.17 1af9 s VAL 958 CO -0.22 0.57 0.64 -0.81 -0.31 0.00 0.00 175.10 174.97 1af9 n PRO 959 N 3.03 -1.01 -2.54 4.82 -0.04 -1.26 -0.76 135.00 137.24 1af9 n PRO 959 Ca -0.18 -0.25 -0.42 0.00 -0.04 0.00 0.00 63.50 62.60 1af9 n PRO 959 Cb 0.52 -2.03 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 1af9 n PRO 959 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1af9 s LYS 960 N -4.02 4.35 0.06 0.54 2.20 0.01 -4.38 119.74 118.50 1af9 s LYS 960 Ca 0.62 1.56 -0.30 0.00 -0.36 0.00 0.00 55.97 57.49 1af9 s LYS 960 Cb -0.21 -3.59 -0.05 0.00 -1.51 0.00 0.00 37.83 32.47 1af9 s LYS 960 CO 0.64 -0.46 1.14 0.08 -0.36 0.00 0.00 175.35 176.39 1af9 s VAL 961 N 2.41 4.20 0.55 4.02 1.01 -1.26 -4.78 120.40 126.55 1af9 s VAL 961 Ca 0.53 1.61 -0.17 0.00 0.00 0.00 0.00 61.98 63.94 1af9 s VAL 961 Cb -0.22 -4.03 -0.06 0.00 0.00 0.00 0.00 36.38 32.08 1af9 s VAL 961 CO 0.18 0.14 1.04 -0.94 0.00 0.00 0.00 175.10 175.53 1af9 s SER 962 N 0.91 6.05 0.25 3.32 1.04 -1.26 -4.86 113.70 119.15 1af9 s SER 962 Ca 0.56 1.82 -0.03 0.00 0.48 0.00 0.00 55.95 58.79 1af9 s SER 962 Cb -0.28 -2.54 0.50 0.00 0.10 0.00 0.00 66.02 63.80 1af9 s SER 962 CO 0.30 -0.98 1.74 0.00 0.98 0.00 0.00 173.24 175.27 1af9 h ALA 963 N 0.84 1.14 -0.50 5.32 0.00 -1.96 -0.24 119.26 123.86 1af9 h ALA 963 Ca -0.48 0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.57 1af9 h ALA 963 Cb 1.22 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 1af9 h ALA 963 CO 0.58 -0.19 0.29 0.77 0.00 0.00 0.00 179.25 180.70 1af9 h SER 964 N 0.49 0.46 0.85 0.00 0.02 -2.00 -0.80 113.55 112.57 1af9 h SER 964 Ca 0.44 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.33 1af9 h SER 964 Cb 0.66 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1af9 h SER 964 CO -0.40 0.32 -0.34 0.45 -1.14 0.00 0.00 176.83 175.72 1af9 h HIS 965 N 0.57 0.00 0.00 3.45 -0.00 -1.63 -1.31 115.15 116.24 1af9 h HIS 965 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.58 1af9 h HIS 965 Cb 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.46 1af9 h HIS 965 CO -0.07 0.34 0.00 -0.07 -0.00 0.00 0.00 177.93 178.12 1af9 h LEU 966 N 0.00 0.00 0.00 2.43 3.38 0.32 0.38 115.31 121.82 1af9 h LEU 966 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1af9 h LEU 966 Cb 0.85 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1af9 h LEU 966 CO 0.04 0.00 -0.81 -0.33 0.09 0.00 0.00 178.44 177.44 1af9 h GLU 967 N 0.00 0.00 -0.68 1.13 5.08 -0.76 -2.90 114.58 116.45 1af9 h GLU 967 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1af9 h GLU 967 Cb 0.54 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1af9 h GLU 967 CO 0.00 0.42 0.30 1.96 -1.00 0.00 0.00 179.01 180.69 1af9 h GLN 968 N -1.00 1.01 -0.06 2.33 4.20 -1.25 -3.32 115.11 117.01 1af9 h GLN 968 Ca -0.15 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.40 1af9 h GLN 968 Cb 0.83 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.44 1af9 h GLN 968 CO -0.09 0.82 -0.01 0.66 -0.67 0.00 0.00 178.83 179.54 1af9 n TYR 969 N -4.42 0.23 0.23 2.96 4.01 0.13 -4.72 117.16 115.58 1af9 n TYR 969 Ca 0.05 -0.99 0.09 0.00 -0.16 0.00 0.00 57.90 56.90 1af9 n TYR 969 Cb 0.15 -0.19 0.52 0.00 -0.31 0.00 0.00 39.34 39.51 1af9 n TYR 969 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1af9 h GLY 970 N 0.45 0.00 -1.30 2.72 0.00 -1.46 -2.76 103.07 100.74 1af9 h GLY 970 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1af9 h GLY 970 CO 0.06 0.00 -0.12 -1.30 0.00 0.00 0.00 176.54 175.17 1af9 n THR 971 N -3.56 0.00 -2.80 4.70 -2.24 -1.26 -3.33 114.28 105.78 1af9 n THR 971 Ca -0.01 -0.37 -0.43 0.00 -2.27 0.00 0.00 64.05 60.97 1af9 n THR 971 Cb 0.38 1.18 -0.04 0.00 -2.10 0.00 0.00 70.33 69.75 1af9 n THR 971 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1af9 s ASN 972 N -2.14 6.42 -0.33 3.42 3.04 -1.04 -4.97 114.94 119.34 1af9 s ASN 972 Ca 0.27 -0.11 -0.20 0.00 0.04 0.00 0.00 52.86 52.87 1af9 s ASN 972 Cb 0.20 -2.45 -0.01 0.00 -1.54 0.00 0.00 41.25 37.45 1af9 s ASN 972 CO 0.38 -1.18 0.61 -0.70 -3.04 0.00 0.00 177.10 173.17 1af9 s GLU 973 N 3.97 3.79 -0.02 0.43 2.12 -1.26 -4.20 118.70 123.53 1af9 s GLU 973 Ca 0.34 0.15 0.06 0.00 0.36 0.00 0.00 54.97 55.89 1af9 s GLU 973 Cb -0.11 -3.76 -0.01 0.00 0.26 0.00 0.00 34.13 30.50 1af9 s GLU 973 CO 0.23 -0.63 -0.22 1.52 -0.54 0.00 0.00 175.26 175.62 1af9 s TYR 974 N 2.60 1.99 0.43 5.30 1.13 -0.49 -4.76 117.35 123.54 1af9 s TYR 974 Ca 0.24 -0.42 -0.15 0.00 -1.41 0.00 0.00 57.07 55.33 1af9 s TYR 974 Cb -0.15 -1.29 -0.08 0.00 -1.10 0.00 0.00 41.96 39.34 1af9 s TYR 974 CO 0.13 -0.06 0.87 0.45 -2.51 0.00 0.00 175.55 174.42 1af9 s SER 975 N -0.43 6.67 0.00 -0.18 0.15 0.55 -1.29 113.70 119.17 1af9 s SER 975 Ca 0.06 1.40 0.00 0.00 0.70 0.00 0.00 55.95 58.11 1af9 s SER 975 Cb -0.09 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 1af9 s SER 975 CO -0.00 -0.42 0.00 2.30 1.20 0.00 0.00 173.24 176.31 1af9 n ILE 976 N -1.12 0.00 -3.79 6.45 -5.35 -0.07 -0.76 119.36 114.72 1af9 n ILE 976 Ca 0.05 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.39 1af9 n ILE 976 Cb 0.54 -0.47 -0.15 0.00 -1.74 0.00 0.00 39.64 37.82 1af9 n ILE 976 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1af9 s ILE 977 N -1.63 -0.04 -0.18 7.28 1.01 -1.17 -0.19 121.20 126.28 1af9 s ILE 977 Ca 0.00 0.14 -0.28 0.00 0.00 0.00 0.00 60.65 60.52 1af9 s ILE 977 Cb 0.00 -0.11 0.09 0.00 0.01 0.00 0.00 42.46 42.45 1af9 s ILE 977 CO 0.00 0.06 0.80 -0.55 0.00 0.00 0.00 174.94 175.25 1af9 s SER 978 N 0.77 -0.61 -0.27 3.58 0.15 -0.54 -0.15 113.70 116.61 1af9 s SER 978 Ca -0.06 0.96 0.10 0.00 0.70 0.00 0.00 55.95 57.64 1af9 s SER 978 Cb -0.09 0.90 0.50 0.00 -1.71 0.00 0.00 66.02 65.62 1af9 s SER 978 CO -0.03 -0.36 1.43 -1.54 1.20 0.00 0.00 173.24 173.95 1af9 n SER 979 N 1.75 2.49 -4.55 5.45 3.41 0.63 -1.59 113.62 121.20 1af9 n SER 979 Ca -0.15 -3.73 -0.34 0.00 -0.26 0.00 0.00 58.87 54.39 1af9 n SER 979 Cb 0.56 -0.62 -0.11 0.00 -0.26 0.00 0.00 64.21 63.78 1af9 n SER 979 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1af9 s MET 980 N -3.21 3.71 -0.38 4.33 -1.94 -1.26 -2.37 119.30 118.19 1af9 s MET 980 Ca 0.44 -0.47 -0.21 0.00 -1.71 0.00 0.00 55.69 53.74 1af9 s MET 980 Cb 0.40 -2.99 0.01 0.00 2.01 0.00 0.00 34.83 34.26 1af9 s MET 980 CO -0.00 0.28 0.68 0.21 -0.01 0.00 0.00 175.02 176.18 1af9 s LYS 981 N 0.28 3.62 0.00 2.03 2.36 -1.26 -4.81 119.74 121.96 1af9 s LYS 981 Ca -0.01 0.04 0.00 0.00 -2.55 0.00 0.00 55.97 53.45 1af9 s LYS 981 Cb -0.13 -3.84 0.00 0.00 -1.05 0.00 0.00 37.83 32.81 1af9 s LYS 981 CO 0.02 -0.83 0.00 1.63 1.55 0.00 0.00 175.35 177.72 1af9 n LYS 982 N 6.22 0.00 -1.80 4.03 5.02 -1.26 -4.45 118.16 125.92 1af9 n LYS 982 Ca 0.00 0.14 -0.41 0.00 -2.02 0.00 0.00 58.31 56.02 1af9 n LYS 982 Cb 0.48 -0.60 -0.01 0.00 -0.02 0.00 0.00 35.03 34.88 1af9 n LYS 982 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1af9 n HIS 983 N -1.11 2.94 -3.25 2.13 -0.00 -1.26 -4.86 115.22 109.81 1af9 n HIS 983 Ca 0.00 -2.94 0.00 0.00 -0.00 0.00 0.00 57.72 54.78 1af9 n HIS 983 Cb 0.00 -2.29 0.00 0.00 -0.00 0.00 0.00 29.99 27.70 1af9 n HIS 983 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1af9 n SER 984 N 4.19 0.00 -0.05 0.41 2.88 -1.26 -5.06 113.62 114.74 1af9 n SER 984 Ca 0.58 -0.26 -0.03 0.00 -1.33 0.00 0.00 58.87 57.83 1af9 n SER 984 Cb 0.32 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 63.98 1af9 n SER 984 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1af9 h LEU 985 N 0.00 0.62 0.00 2.46 4.07 -1.93 -3.45 115.31 117.09 1af9 h LEU 985 Ca 0.00 -0.16 -0.28 0.00 0.08 0.00 0.00 57.88 57.53 1af9 h LEU 985 Cb 0.00 -0.17 0.07 0.00 1.08 0.00 0.00 40.66 41.65 1af9 h LEU 985 CO 0.00 0.73 0.14 -1.54 -1.08 0.00 0.00 178.44 176.69 1af9 n SER 986 N -4.21 0.57 -4.27 -0.43 3.41 -1.26 -5.13 113.62 102.30 1af9 n SER 986 Ca 0.01 -1.56 -0.22 0.00 -0.26 0.00 0.00 58.87 56.84 1af9 n SER 986 Cb 0.31 -0.48 -0.01 0.00 -0.26 0.00 0.00 64.21 63.77 1af9 n SER 986 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1af9 n ILE 987 N -2.58 0.00 -1.44 -1.33 5.41 -1.26 -4.95 119.36 113.21 1af9 n ILE 987 Ca 0.10 -1.80 -0.47 0.00 1.00 0.00 0.00 62.75 61.58 1af9 n ILE 987 Cb 0.36 -0.02 -0.10 0.00 -0.71 0.00 0.00 39.64 39.17 1af9 n ILE 987 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1af9 n GLY 988 N -0.29 -0.05 0.00 7.39 0.00 -1.26 -4.51 105.19 106.47 1af9 n GLY 988 Ca -0.05 1.01 0.00 0.00 0.00 0.00 0.00 46.02 46.99 1af9 n GLY 988 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1af9 n SER 989 N 10.48 0.00 0.00 1.61 7.64 -1.26 -4.69 113.62 127.40 1af9 n SER 989 Ca 0.53 0.79 0.00 0.00 1.01 0.00 0.00 58.87 61.19 1af9 n SER 989 Cb 0.15 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1af9 n SER 989 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1af9 n GLY 990 N -0.88 0.27 3.42 0.23 0.00 -1.23 -3.77 105.19 103.23 1af9 n GLY 990 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1af9 n GLY 990 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1af9 s TRP 991 N 0.00 2.04 0.04 1.61 1.48 -1.26 -1.16 118.94 121.68 1af9 s TRP 991 Ca 0.00 -0.44 -0.17 0.00 -1.06 0.00 0.00 56.10 54.43 1af9 s TRP 991 Cb 0.00 -0.90 0.03 0.00 -1.16 0.00 0.00 33.47 31.44 1af9 s TRP 991 CO 0.00 0.56 0.38 -1.54 -4.06 0.00 0.00 176.95 172.30 1af9 s SER 992 N -3.42 -0.25 -0.09 -2.66 1.04 -0.86 -0.27 113.70 107.19 1af9 s SER 992 Ca 0.27 -0.02 0.04 0.00 0.48 0.00 0.00 55.95 56.72 1af9 s SER 992 Cb -0.03 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1af9 s SER 992 CO 0.11 -0.63 -0.22 -0.69 0.98 0.00 0.00 173.24 172.80 1af9 s VAL 993 N -2.34 1.88 0.24 5.02 1.01 0.78 -2.21 120.40 124.78 1af9 s VAL 993 Ca -0.06 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 60.91 1af9 s VAL 993 Cb -0.01 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1af9 s VAL 993 CO -0.02 0.52 0.39 -0.94 0.00 0.00 0.00 175.10 175.06 1af9 s SER 994 N 0.38 0.04 0.06 3.32 1.04 -0.88 -0.89 113.70 116.77 1af9 s SER 994 Ca -0.17 -1.08 0.06 0.00 0.48 0.00 0.00 55.95 55.23 1af9 s SER 994 Cb -0.17 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 1af9 s SER 994 CO 0.08 -1.08 -0.15 -0.76 0.98 0.00 0.00 173.24 172.30 1af9 s LEU 995 N -3.07 2.23 -0.30 2.42 1.43 -0.41 -0.42 118.68 120.57 1af9 s LEU 995 Ca 0.27 -0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 52.80 1af9 s LEU 995 Cb 0.01 -0.63 0.12 0.00 0.03 0.00 0.00 46.19 45.72 1af9 s LEU 995 CO 0.11 0.00 0.19 -0.75 0.23 0.00 0.00 176.35 176.13 1af9 s LYS 996 N -1.46 0.28 6.80 1.70 2.20 -0.79 -1.40 119.74 127.07 1af9 s LYS 996 Ca 0.01 -0.53 0.00 0.00 -0.36 0.00 0.00 55.97 55.10 1af9 s LYS 996 Cb -0.09 -1.03 0.00 0.00 -1.51 0.00 0.00 37.83 35.20 1af9 s LYS 996 CO 0.02 -1.05 0.00 0.41 -0.36 0.00 0.00 175.35 174.37 1af9 n GLY 997 N 5.11 1.77 2.85 5.54 0.00 -1.21 -2.64 105.19 116.61 1af9 n GLY 997 Ca -0.03 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 1af9 n GLY 997 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1af9 n ASN 998 N 5.93 7.21 -3.90 1.61 4.13 -1.26 -4.91 115.26 124.07 1af9 n ASN 998 Ca 0.00 -3.81 -0.23 0.00 1.68 0.00 0.00 54.58 52.22 1af9 n ASN 998 Cb 0.00 -1.01 -0.17 0.00 -1.54 0.00 0.00 39.78 37.06 1af9 n ASN 998 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1af9 s ASN 999 N -1.37 1.51 -0.07 6.41 0.01 -1.08 -1.69 114.94 118.65 1af9 s ASN 999 Ca 0.50 -0.20 -0.11 0.00 -0.71 0.00 0.00 52.86 52.35 1af9 s ASN 999 Cb 0.41 -0.62 -0.05 0.00 0.41 0.00 0.00 41.25 41.41 1af9 s ASN 999 CO -0.37 -0.07 0.28 -0.22 -1.51 0.00 0.00 177.10 175.20 1af9 s LEU 1000N 1.21 4.41 -0.03 0.60 2.96 -0.63 -1.88 118.68 125.32 1af9 s LEU 1000Ca -0.06 0.70 0.03 0.00 -0.22 0.00 0.00 54.13 54.58 1af9 s LEU 1000Cb -0.14 -2.33 0.00 0.00 0.50 0.00 0.00 46.19 44.22 1af9 s LEU 1000CO -0.02 0.34 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.60 1af9 s ILE 1001N -0.90 1.01 -0.17 6.68 1.01 0.45 -0.61 121.20 128.68 1af9 s ILE 1001Ca 0.19 -0.49 -0.02 0.00 0.00 0.00 0.00 60.65 60.33 1af9 s ILE 1001Cb -0.14 -0.88 -0.02 0.00 0.01 0.00 0.00 42.46 41.43 1af9 s ILE 1001CO 0.08 0.30 -0.08 0.86 0.00 0.00 0.00 174.94 176.11 1af9 s TRP 1002N 0.12 2.92 -0.04 3.97 -0.00 -0.76 -2.06 118.94 123.08 1af9 s TRP 1002Ca -0.03 -0.64 0.04 0.00 -0.00 0.00 0.00 56.10 55.47 1af9 s TRP 1002Cb -0.09 -1.96 -0.00 0.00 -0.00 0.00 0.00 33.47 31.42 1af9 s TRP 1002CO 0.01 -0.27 -0.16 0.99 -0.00 0.00 0.00 176.95 177.52 1af9 s THR 1003N 0.71 1.32 -0.06 5.86 2.01 -0.94 -1.12 115.64 123.42 1af9 s THR 1003Ca -0.04 -0.65 0.04 0.00 0.31 0.00 0.00 61.69 61.35 1af9 s THR 1003Cb -0.15 -1.14 -0.00 0.00 0.01 0.00 0.00 72.50 71.22 1af9 s THR 1003CO 0.02 0.39 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.38 1af9 s LEU 1004N 0.09 1.95 -0.09 4.42 1.43 -0.24 -2.02 118.68 124.22 1af9 s LEU 1004Ca -0.04 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1af9 s LEU 1004Cb -0.11 -1.16 0.03 0.00 0.03 0.00 0.00 46.19 44.98 1af9 s LEU 1004CO 0.02 0.16 -0.05 -0.75 0.23 0.00 0.00 176.35 175.96 1af9 s LYS 1005N 0.17 1.15 0.97 1.70 2.20 -0.31 -1.32 119.74 124.30 1af9 s LYS 1005Ca -0.09 -0.12 -0.15 0.00 -0.36 0.00 0.00 55.97 55.25 1af9 s LYS 1005Cb -0.14 -1.31 0.22 0.00 -1.51 0.00 0.00 37.83 35.08 1af9 s LYS 1005CO 0.05 -0.26 1.32 -0.40 -0.36 0.00 0.00 175.35 175.70 1af9 n ASP 1006N 4.94 0.21 0.32 1.43 5.68 0.12 -4.17 116.55 125.08 1af9 n ASP 1006Ca -0.11 -1.55 0.20 0.00 -0.50 0.00 0.00 54.79 52.83 1af9 n ASP 1006Cb 0.50 -1.00 1.05 0.00 -1.14 0.00 0.00 41.12 40.53 1af9 n ASP 1006CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1af9 h SER 1007N -1.68 0.00 0.10 -1.12 4.64 -0.97 -0.44 113.55 114.08 1af9 h SER 1007Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1af9 h SER 1007Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1af9 h SER 1007CO 0.31 0.01 -0.22 0.00 -0.87 0.00 0.00 176.83 176.06 1af9 n ALA 1008N -2.14 3.01 -0.32 5.18 0.00 -1.26 -4.94 120.51 120.04 1af9 n ALA 1008Ca -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1af9 n ALA 1008Cb 0.13 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1af9 n ALA 1008CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1af9 n GLY 1009N 1.32 0.83 3.81 0.00 0.00 -0.17 -5.07 105.19 105.91 1af9 n GLY 1009Ca 0.13 -0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1af9 n GLY 1009CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1af9 s GLU 1010N -0.67 3.79 -0.03 1.61 0.41 -1.26 -4.77 118.70 117.78 1af9 s GLU 1010Ca 0.00 1.24 -0.04 0.00 -0.41 0.00 0.00 54.97 55.76 1af9 s GLU 1010Cb 0.00 -2.10 0.01 0.00 -1.78 0.00 0.00 34.13 30.26 1af9 s GLU 1010CO 0.00 -0.42 0.11 0.54 -0.49 0.00 0.00 175.26 175.00 1af9 s VAL 1011N -2.18 0.03 0.11 2.63 0.11 -1.26 0.12 120.40 119.95 1af9 s VAL 1011Ca 0.65 -0.24 0.09 0.00 -2.93 0.00 0.00 61.98 59.54 1af9 s VAL 1011Cb -0.14 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 1af9 s VAL 1011CO 0.23 -0.13 -0.22 -0.13 -3.33 0.00 0.00 175.10 171.53 1af9 s ARG 1012N -0.40 1.16 0.04 1.54 1.81 -0.44 -4.99 118.95 117.67 1af9 s ARG 1012Ca -0.05 -1.19 -0.06 0.00 -1.72 0.00 0.00 55.73 52.71 1af9 s ARG 1012Cb -0.03 -1.46 -0.01 0.00 -0.45 0.00 0.00 34.95 33.00 1af9 s ARG 1012CO 0.00 0.34 0.11 -0.65 -0.68 0.00 0.00 175.30 174.42 1af9 s GLN 1013N -1.93 0.60 -0.05 3.54 -0.21 -1.26 -1.08 119.66 119.27 1af9 s GLN 1013Ca 0.07 -0.74 0.05 0.00 0.02 0.00 0.00 55.36 54.77 1af9 s GLN 1013Cb -0.10 0.24 -0.01 0.00 1.00 0.00 0.00 33.01 34.14 1af9 s GLN 1013CO 0.04 -0.15 -0.21 0.42 -2.12 0.00 0.00 175.29 173.27 1af9 s ILE 1014N -2.61 1.76 -0.22 1.08 1.01 -0.27 -4.76 121.20 117.19 1af9 s ILE 1014Ca -0.05 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 59.71 1af9 s ILE 1014Cb -0.01 -1.50 0.05 0.00 0.01 0.00 0.00 42.46 41.01 1af9 s ILE 1014CO -0.04 0.50 -0.09 -0.89 0.00 0.00 0.00 174.94 174.41 1af9 s THR 1015N -0.04 1.72 -0.29 2.92 2.01 -1.26 -1.84 115.64 118.87 1af9 s THR 1015Ca -0.05 -1.21 -0.10 0.00 0.31 0.00 0.00 61.69 60.64 1af9 s THR 1015Cb -0.13 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.49 1af9 s THR 1015CO 0.03 0.04 0.16 0.12 -0.69 0.00 0.00 174.62 174.28 1af9 s PHE 1016N 1.33 3.18 -0.26 4.92 5.36 0.22 -4.98 117.98 127.76 1af9 s PHE 1016Ca -0.04 -0.20 -0.18 0.00 -0.96 0.00 0.00 56.93 55.54 1af9 s PHE 1016Cb -0.18 -2.35 -0.03 0.00 -0.34 0.00 0.00 43.02 40.12 1af9 s PHE 1016CO -0.07 -0.30 0.53 1.03 -1.46 0.00 0.00 175.22 174.96 1af9 s ARG 1017N 1.69 4.08 0.80 10.12 0.52 -1.26 -1.61 118.95 133.29 1af9 s ARG 1017Ca 0.06 0.36 -0.11 0.00 -0.52 0.00 0.00 55.73 55.52 1af9 s ARG 1017Cb -0.16 -3.65 0.07 0.00 0.52 0.00 0.00 34.95 31.73 1af9 s ARG 1017CO 0.08 -0.36 1.10 0.34 0.02 0.00 0.00 175.30 176.48 1af9 s ASP 1018N 1.53 4.22 0.54 0.23 2.15 -0.68 -5.01 116.67 119.64 1af9 s ASP 1018Ca 0.22 1.81 -0.20 0.00 0.43 0.00 0.00 52.55 54.81 1af9 s ASP 1018Cb -0.16 -2.48 -0.05 0.00 -0.30 0.00 0.00 42.92 39.93 1af9 s ASP 1018CO 0.09 -2.21 1.19 -0.76 -0.17 0.00 0.00 175.17 173.31 1af9 s LEU 1019N -6.03 3.80 0.18 -1.34 1.43 -1.26 -4.97 118.68 110.50 1af9 s LEU 1019Ca 0.62 2.36 -0.07 0.00 -1.03 0.00 0.00 54.13 56.01 1af9 s LEU 1019Cb -0.18 -4.46 0.07 0.00 0.03 0.00 0.00 46.19 41.66 1af9 s LEU 1019CO 0.56 -1.31 1.55 -0.65 0.23 0.00 0.00 176.35 176.73 1af9 h PRO 1020N 1.36 0.84 -6.19 1.29 0.11 -1.92 -3.40 132.00 124.09 1af9 h PRO 1020Ca -0.50 -0.40 -0.52 0.00 0.11 0.00 0.00 66.00 64.69 1af9 h PRO 1020Cb 1.28 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.31 1af9 h PRO 1020CO 0.57 1.03 1.17 0.34 -0.21 0.00 0.00 178.00 180.91 1af9 s ASP 1021N -6.80 5.90 0.61 -2.05 -1.08 -1.25 -1.70 116.67 110.30 1af9 s ASP 1021Ca -0.10 -0.38 0.40 0.00 -0.52 0.00 0.00 52.55 51.95 1af9 s ASP 1021Cb 0.12 -2.55 1.99 0.00 -1.46 0.00 0.00 42.92 41.01 1af9 s ASP 1021CO 0.86 -2.00 2.20 0.11 0.52 0.00 0.00 175.17 176.86 1af9 h LYS 1022N 11.39 0.00 0.00 4.34 1.79 -1.48 -0.46 116.57 132.16 1af9 h LYS 1022Ca -0.19 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.26 1af9 h LYS 1022Cb 1.07 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.72 1af9 h LYS 1022CO 1.28 0.00 -0.08 0.35 -1.08 0.00 0.00 179.45 179.92 1af9 h PHE 1023N 0.00 0.00 0.00 -1.35 3.57 -1.89 -3.13 116.94 114.14 1af9 h PHE 1023Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1af9 h PHE 1023Cb 0.19 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.93 1af9 h PHE 1023CO 0.00 0.08 -0.02 0.09 -2.23 0.00 0.00 178.31 176.23 1af9 n ASN 1024N -3.21 1.96 -4.30 0.41 3.02 -0.23 -5.07 115.26 107.84 1af9 n ASN 1024Ca 0.00 -2.38 -0.28 0.00 -0.03 0.00 0.00 54.58 51.89 1af9 n ASN 1024Cb 0.34 -0.18 0.16 0.00 -0.61 0.00 0.00 39.78 39.50 1af9 n ASN 1024CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1af9 s ALA 1025N -1.65 2.56 -0.12 5.41 0.00 -0.88 -4.94 121.76 122.14 1af9 s ALA 1025Ca 0.13 -1.27 0.14 0.00 0.00 0.00 0.00 51.96 50.96 1af9 s ALA 1025Cb 0.11 -2.63 -0.20 0.00 0.00 0.00 0.00 23.12 20.40 1af9 s ALA 1025CO 0.01 -2.18 0.12 0.66 0.00 0.00 0.00 175.76 174.37 1af9 n TYR 1026N -3.54 0.00 -1.90 0.00 4.01 -1.26 -4.52 117.16 109.94 1af9 n TYR 1026Ca 0.15 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.58 1af9 n TYR 1026Cb 0.60 -0.65 0.04 0.00 -0.31 0.00 0.00 39.34 39.02 1af9 n TYR 1026CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1af9 n LEU 1027N -2.43 6.08 -2.92 7.72 4.77 -1.26 -4.67 117.00 124.29 1af9 n LEU 1027Ca -0.19 -4.73 -0.20 0.00 -0.03 0.00 0.00 56.01 50.86 1af9 n LEU 1027Cb 0.85 -0.66 -0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1af9 n LEU 1027CO 0.32 1.90 -0.05 0.00 -1.33 0.00 0.00 177.39 178.23 1af9 n ALA 1028N -0.70 3.40 -1.15 -1.18 0.00 -1.25 -4.47 120.51 115.17 1af9 n ALA 1028Ca 0.50 -3.80 -0.05 0.00 0.00 0.00 0.00 53.44 50.09 1af9 n ALA 1028Cb 0.70 -0.83 -0.02 0.00 0.00 0.00 0.00 19.45 19.30 1af9 n ALA 1028CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1af9 n ASN 1029N -0.03 -4.03 -4.43 0.00 4.05 0.06 -4.71 115.26 106.17 1af9 n ASN 1029Ca 0.25 0.13 -0.25 0.00 0.45 0.00 0.00 54.58 55.15 1af9 n ASN 1029Cb 0.63 -1.98 -0.11 0.00 1.23 0.00 0.00 39.78 39.55 1af9 n ASN 1029CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1af9 s LYS 1030N -1.99 1.56 -0.20 1.20 1.02 -1.26 -4.78 119.74 115.29 1af9 s LYS 1030Ca 0.00 -1.62 -0.29 0.00 0.02 0.00 0.00 55.97 54.08 1af9 s LYS 1030Cb 0.00 -1.77 -0.02 0.00 -0.52 0.00 0.00 37.83 35.52 1af9 s LYS 1030CO 0.00 0.36 1.37 -1.58 -0.92 0.00 0.00 175.35 174.58 1af9 s TRP 1031N -2.05 2.59 0.00 3.18 0.52 -0.50 -4.41 118.94 118.28 1af9 s TRP 1031Ca 0.24 0.81 0.05 0.00 0.02 0.00 0.00 56.10 57.22 1af9 s TRP 1031Cb -0.06 -3.74 -0.02 0.00 -1.15 0.00 0.00 33.47 28.50 1af9 s TRP 1031CO 0.12 -2.12 -0.16 0.14 0.02 0.00 0.00 176.95 174.95 1af9 s VAL 1032N 4.08 1.23 -0.29 4.03 -7.23 -0.54 -4.91 120.40 116.76 1af9 s VAL 1032Ca 0.60 -0.78 -0.22 0.00 -1.81 0.00 0.00 61.98 59.77 1af9 s VAL 1032Cb -0.22 -1.05 -0.01 0.00 0.56 0.00 0.00 36.38 35.67 1af9 s VAL 1032CO 0.21 0.26 0.71 0.12 -0.31 0.00 0.00 175.10 176.09 1af9 s PHE 1033N -0.50 3.23 -0.12 2.82 5.36 -1.26 -0.31 117.98 127.19 1af9 s PHE 1033Ca 0.05 0.76 -0.06 0.00 -0.96 0.00 0.00 56.93 56.72 1af9 s PHE 1033Cb -0.07 -3.06 -0.04 0.00 -0.34 0.00 0.00 43.02 39.51 1af9 s PHE 1033CO 0.00 -0.48 0.11 0.42 -1.46 0.00 0.00 175.22 173.81 1af9 s ILE 1034N 2.75 5.22 -0.17 3.12 -1.09 0.51 -0.15 121.20 131.39 1af9 s ILE 1034Ca 0.29 0.10 -0.04 0.00 -2.23 0.00 0.00 60.65 58.77 1af9 s ILE 1034Cb -0.15 -3.28 0.08 0.00 -1.58 0.00 0.00 42.46 37.53 1af9 s ILE 1034CO 0.11 0.59 0.17 -0.89 -1.23 0.00 0.00 174.94 173.69 1af9 s THR 1035N -0.79 -0.24 -0.39 2.92 2.01 -0.34 -1.91 115.64 116.90 1af9 s THR 1035Ca 0.13 -0.05 -0.04 0.00 0.31 0.00 0.00 61.69 62.04 1af9 s THR 1035Cb -0.12 -0.58 0.09 0.00 0.01 0.00 0.00 72.50 71.90 1af9 s THR 1035CO 0.03 -0.17 0.17 -0.63 -0.69 0.00 0.00 174.62 173.33 1af9 s ILE 1036N 2.26 3.44 0.15 1.82 1.01 -0.19 -0.54 121.20 129.15 1af9 s ILE 1036Ca 0.05 -1.75 -0.09 0.00 0.00 0.00 0.00 60.65 58.86 1af9 s ILE 1036Cb -0.15 -3.21 -0.06 0.00 0.01 0.00 0.00 42.46 39.04 1af9 s ILE 1036CO -0.10 -0.51 0.46 0.42 0.00 0.00 0.00 174.94 175.20 1af9 s THR 1037N 1.23 5.03 -0.18 2.92 -4.23 -0.65 -1.82 115.64 117.95 1af9 s THR 1037Ca 0.04 0.39 -0.02 0.00 -1.18 0.00 0.00 61.69 60.92 1af9 s THR 1037Cb -0.22 -3.64 0.06 0.00 1.34 0.00 0.00 72.50 70.03 1af9 s THR 1037CO -0.02 0.11 0.02 0.20 -0.54 0.00 0.00 174.62 174.39 1af9 s ASN 1038N -2.12 2.83 -0.30 3.99 0.01 0.18 -1.18 114.94 118.36 1af9 s ASN 1038Ca 0.40 -0.77 -0.05 0.00 -0.71 0.00 0.00 52.86 51.74 1af9 s ASN 1038Cb -0.13 -0.62 0.03 0.00 0.41 0.00 0.00 41.25 40.94 1af9 s ASN 1038CO 0.21 -0.29 0.04 -0.62 -1.51 0.00 0.00 177.10 174.93 1af9 s ASP 1039N 1.84 4.97 0.60 -1.22 2.15 -0.83 -1.77 116.67 122.41 1af9 s ASP 1039Ca -0.01 -0.96 0.30 0.00 0.43 0.00 0.00 52.55 52.31 1af9 s ASP 1039Cb -0.17 -1.80 1.70 0.00 -0.30 0.00 0.00 42.92 42.35 1af9 s ASP 1039CO -0.08 -0.23 2.08 0.03 -0.17 0.00 0.00 175.17 176.81 1af9 h ARG 1040N 8.14 0.00 -0.00 4.34 2.47 -1.88 0.13 114.38 127.58 1af9 h ARG 1040Ca -0.27 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 1af9 h ARG 1040Cb 1.10 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.42 1af9 h ARG 1040CO 0.58 0.00 -0.22 1.28 0.56 0.00 0.00 179.97 182.17 1af9 n LEU 1041N -3.64 0.68 0.00 3.04 4.77 -1.26 -4.27 117.00 116.32 1af9 n LEU 1041Ca 0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1af9 n LEU 1041Cb 0.34 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1af9 n LEU 1041CO 0.25 0.13 0.00 -1.54 -1.33 0.00 0.00 177.39 174.91 1af9 n SER 1042N -0.94 0.00 -3.66 -1.43 3.41 0.34 -4.85 113.62 106.49 1af9 n SER 1042Ca 0.12 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.67 1af9 n SER 1042Cb 0.32 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.27 1af9 n SER 1042CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1af9 s SER 1043N -0.31 -0.25 -0.18 4.04 1.04 -0.64 -1.79 113.70 115.62 1af9 s SER 1043Ca 0.00 -0.25 -0.08 0.00 0.48 0.00 0.00 55.95 56.10 1af9 s SER 1043Cb 0.00 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 1af9 s SER 1043CO 0.00 -0.79 0.09 0.00 0.98 0.00 0.00 173.24 173.52 1af9 s ALA 1044N -3.22 3.56 -0.07 5.32 0.00 0.01 -1.97 121.76 125.39 1af9 s ALA 1044Ca 0.10 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.37 1af9 s ALA 1044Cb -0.01 -2.00 -0.02 0.00 0.00 0.00 0.00 23.12 21.08 1af9 s ALA 1044CO -0.02 0.23 -0.13 -0.80 0.00 0.00 0.00 175.76 175.04 1af9 s ASN 1045N 0.17 4.09 -0.19 0.00 0.01 -0.32 -1.44 114.94 117.26 1af9 s ASN 1045Ca 0.07 -0.20 -0.06 0.00 -0.71 0.00 0.00 52.86 51.96 1af9 s ASN 1045Cb -0.12 -1.04 -0.03 0.00 0.41 0.00 0.00 41.25 40.47 1af9 s ASN 1045CO -0.00 0.31 0.02 -0.22 -1.51 0.00 0.00 177.10 175.70 1af9 s LEU 1046N -0.51 3.46 -0.02 0.60 2.96 0.17 -1.64 118.68 123.69 1af9 s LEU 1046Ca 0.07 -0.09 0.08 0.00 -0.22 0.00 0.00 54.13 53.97 1af9 s LEU 1046Cb -0.12 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 1af9 s LEU 1046CO 0.02 0.12 -0.25 -0.31 -1.32 0.00 0.00 176.35 174.60 1af9 s TYR 1047N 0.68 2.29 -0.08 5.38 1.51 0.30 -0.05 117.35 127.38 1af9 s TYR 1047Ca 0.01 -0.46 0.02 0.00 -1.01 0.00 0.00 57.07 55.63 1af9 s TYR 1047Cb -0.14 -1.48 0.02 0.00 -0.11 0.00 0.00 41.96 40.25 1af9 s TYR 1047CO 0.02 -0.05 -0.11 0.42 -1.11 0.00 0.00 175.55 174.71 1af9 s ILE 1048N -0.56 1.12 -1.62 2.71 1.01 -0.57 -1.20 121.20 122.09 1af9 s ILE 1048Ca 0.09 -0.44 -0.17 0.00 0.00 0.00 0.00 60.65 60.13 1af9 s ILE 1048Cb -0.10 -1.05 0.13 0.00 0.01 0.00 0.00 42.46 41.45 1af9 s ILE 1048CO -0.01 0.36 0.84 0.59 0.00 0.00 0.00 174.94 176.72 1af9 n ASN 1049N 4.10 -3.90 0.00 3.58 3.02 0.78 -0.82 115.26 122.03 1af9 n ASN 1049Ca -0.20 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.46 1af9 n ASN 1049Cb 0.51 -3.16 0.00 0.00 -0.61 0.00 0.00 39.78 36.53 1af9 n ASN 1049CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1af9 n GLY 1050N -1.47 0.69 3.27 7.41 0.00 -1.26 -5.03 105.19 108.80 1af9 n GLY 1050Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1af9 n GLY 1050CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1af9 s VAL 1051N -2.86 2.33 0.12 1.61 1.01 0.00 -4.76 120.40 117.84 1af9 s VAL 1051Ca 0.00 -0.93 -0.31 0.00 0.00 0.00 0.00 61.98 60.74 1af9 s VAL 1051Cb 0.00 -1.91 -0.10 0.00 0.00 0.00 0.00 36.38 34.37 1af9 s VAL 1051CO 0.00 0.55 1.75 -0.22 0.00 0.00 0.00 175.10 177.18 1af9 s LEU 1052N 0.26 4.38 0.00 3.92 2.96 -1.26 -1.51 118.68 127.43 1af9 s LEU 1052Ca -0.15 2.69 0.00 0.00 -0.22 0.00 0.00 54.13 56.45 1af9 s LEU 1052Cb -0.17 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.95 1af9 s LEU 1052CO 0.07 -0.95 0.25 0.23 -1.32 0.00 0.00 176.35 174.63 1af9 n MET 1053N 5.31 2.33 -3.63 1.98 2.81 0.92 -4.94 117.12 121.91 1af9 n MET 1053Ca 0.17 -0.25 -0.05 0.00 -1.81 0.00 0.00 57.70 55.75 1af9 n MET 1053Cb 0.38 -0.73 -0.05 0.00 -0.71 0.00 0.00 33.22 32.11 1af9 n MET 1053CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1af9 s GLY 1054N -0.40 0.03 0.16 3.03 0.00 -1.13 -4.95 107.32 104.05 1af9 s GLY 1054Ca 0.00 2.76 0.00 0.00 0.00 0.00 0.00 44.72 47.48 1af9 s GLY 1054CO 0.00 1.37 0.03 -0.56 0.00 0.00 0.00 173.10 173.94 1af9 s SER 1055N -0.65 0.80 -0.28 1.64 0.01 -1.26 0.41 113.70 114.38 1af9 s SER 1055Ca 0.05 -1.20 -0.11 0.00 1.31 0.00 0.00 55.95 56.00 1af9 s SER 1055Cb -0.02 0.20 0.11 0.00 0.21 0.00 0.00 66.02 66.52 1af9 s SER 1055CO -0.07 -0.65 0.62 0.00 0.41 0.00 0.00 173.24 173.55 1af9 s ALA 1056N -3.84 -1.87 -0.03 1.44 0.00 -0.52 -4.89 121.76 112.05 1af9 s ALA 1056Ca 0.25 2.22 -0.30 0.00 0.00 0.00 0.00 51.96 54.13 1af9 s ALA 1056Cb 0.07 -1.63 -0.06 0.00 0.00 0.00 0.00 23.12 21.50 1af9 s ALA 1056CO 0.04 -0.79 1.52 -1.21 0.00 0.00 0.00 175.76 175.32 1af9 s GLU 1057N 2.60 4.22 0.00 0.00 2.02 -1.26 -0.81 118.70 125.47 1af9 s GLU 1057Ca -0.06 2.08 0.19 0.00 0.02 0.00 0.00 54.97 57.19 1af9 s GLU 1057Cb -0.11 -3.75 0.26 0.00 0.10 0.00 0.00 34.13 30.63 1af9 s GLU 1057CO -0.18 -0.72 1.19 0.44 0.02 0.00 0.00 175.26 176.02 1af9 n ILE 1058N 5.05 0.29 -1.73 -1.63 -5.35 -0.74 -4.89 119.36 110.36 1af9 n ILE 1058Ca 0.15 -0.64 -0.35 0.00 -0.27 0.00 0.00 62.75 61.63 1af9 n ILE 1058Cb 0.43 1.13 0.06 0.00 -1.74 0.00 0.00 39.64 39.53 1af9 n ILE 1058CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1af9 s THR 1059N -1.40 2.41 0.00 7.28 -4.23 -1.20 -2.55 115.64 115.94 1af9 s THR 1059Ca 0.27 0.23 0.00 0.00 -1.18 0.00 0.00 61.69 61.01 1af9 s THR 1059Cb 0.17 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 71.05 1af9 s THR 1059CO 0.24 -0.08 0.00 0.61 -0.54 0.00 0.00 174.62 174.86 1af9 n GLY 1060N 0.50 1.41 3.74 3.99 0.00 -1.26 -5.04 105.19 108.53 1af9 n GLY 1060Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1af9 n GLY 1060CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1af9 s LEU 1061N 0.00 4.54 0.00 0.99 1.43 -1.06 -5.06 118.68 119.53 1af9 s LEU 1061Ca 0.00 1.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.89 1af9 s LEU 1061Cb 0.00 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1af9 s LEU 1061CO 0.00 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.22 1af9 n GLY 1062N 2.00 -1.23 3.79 -3.19 0.00 -1.26 -4.97 105.19 100.33 1af9 n GLY 1062Ca -0.00 -1.55 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 1af9 n GLY 1062CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1af9 s ALA 1063N -3.65 2.74 -0.36 4.61 0.00 -1.26 -4.73 121.76 119.11 1af9 s ALA 1063Ca 0.00 0.53 -0.11 0.00 0.00 0.00 0.00 51.96 52.39 1af9 s ALA 1063Cb 0.00 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.87 1af9 s ALA 1063CO 0.00 -0.72 0.19 0.42 0.00 0.00 0.00 175.76 175.65 1af9 s ILE 1064N -2.21 4.55 -0.93 0.00 1.01 -1.26 -0.37 121.20 121.99 1af9 s ILE 1064Ca 0.66 -0.78 -0.13 0.00 0.00 0.00 0.00 60.65 60.40 1af9 s ILE 1064Cb -0.18 -3.50 0.22 0.00 0.01 0.00 0.00 42.46 39.02 1af9 s ILE 1064CO 0.31 -0.17 0.92 -0.60 0.00 0.00 0.00 174.94 175.40 1af9 s ARG 1065N 1.56 3.78 1.03 2.79 3.00 -1.25 -4.67 118.95 125.19 1af9 s ARG 1065Ca 0.02 -2.59 -0.16 0.00 -1.00 0.00 0.00 55.73 52.00 1af9 s ARG 1065Cb -0.19 -4.54 0.21 0.00 0.00 0.00 0.00 34.95 30.43 1af9 s ARG 1065CO 0.06 -1.35 1.19 -2.00 0.00 0.00 0.00 175.30 173.21 1af9 s GLU 1066N 0.12 0.16 0.07 5.12 2.12 -1.26 -4.36 118.70 120.68 1af9 s GLU 1066Ca 0.24 -0.08 -0.05 0.00 0.36 0.00 0.00 54.97 55.43 1af9 s GLU 1066Cb -0.09 -1.76 -0.05 0.00 0.26 0.00 0.00 34.13 32.49 1af9 s GLU 1066CO -0.08 -2.79 0.32 0.34 -0.54 0.00 0.00 175.26 172.50 1af9 s ASP 1067N -4.30 6.49 0.61 -1.70 2.15 -1.00 -4.93 116.67 114.00 1af9 s ASP 1067Ca 0.70 0.55 0.36 0.00 0.43 0.00 0.00 52.55 54.59 1af9 s ASP 1067Cb -0.09 -2.08 2.02 0.00 -0.30 0.00 0.00 42.92 42.47 1af9 s ASP 1067CO 0.54 0.16 2.27 0.78 -0.17 0.00 0.00 175.17 178.75 1af9 h ASN 1068N 3.39 0.00 -3.17 -0.34 2.35 -1.95 -3.42 115.58 112.43 1af9 h ASN 1068Ca -0.48 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 54.60 1af9 h ASN 1068Cb 1.18 0.00 -0.13 0.00 0.05 0.00 0.00 38.32 39.42 1af9 h ASN 1068CO 0.70 0.02 -0.59 0.20 -1.65 0.00 0.00 177.43 176.10 1af9 s ASN 1069N -5.70 5.48 -0.33 5.81 0.01 -1.26 -1.88 114.94 117.07 1af9 s ASN 1069Ca -0.04 0.21 -0.05 0.00 -0.71 0.00 0.00 52.86 52.27 1af9 s ASN 1069Cb 0.14 -1.61 0.05 0.00 0.41 0.00 0.00 41.25 40.23 1af9 s ASN 1069CO 0.49 0.38 0.08 -0.63 -1.51 0.00 0.00 177.10 175.91 1af9 s ILE 1070N -0.90 3.54 -0.19 0.60 1.01 0.11 -4.56 121.20 120.82 1af9 s ILE 1070Ca 0.13 -1.24 -0.05 0.00 0.00 0.00 0.00 60.65 59.49 1af9 s ILE 1070Cb -0.11 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 1af9 s ILE 1070CO 0.03 -0.18 -0.00 0.42 0.00 0.00 0.00 174.94 175.20 1af9 s THR 1071N 1.35 4.02 -0.30 2.92 -4.23 -0.62 -1.43 115.64 117.34 1af9 s THR 1071Ca -0.02 -0.30 -0.15 0.00 -1.18 0.00 0.00 61.69 60.04 1af9 s THR 1071Cb -0.20 -2.80 -0.03 0.00 1.34 0.00 0.00 72.50 70.82 1af9 s THR 1071CO 0.01 0.45 0.36 -0.76 -0.54 0.00 0.00 174.62 174.15 1af9 s LEU 1072N 0.76 4.21 -0.26 4.79 1.43 -0.74 -1.47 118.68 127.41 1af9 s LEU 1072Ca 0.00 0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.85 1af9 s LEU 1072Cb -0.14 -2.38 0.17 0.00 0.03 0.00 0.00 46.19 43.88 1af9 s LEU 1072CO 0.02 -0.25 1.28 -0.75 0.23 0.00 0.00 176.35 176.87 1af9 s LYS 1073N 2.05 0.20 -0.87 1.70 2.20 0.73 -2.00 119.74 123.74 1af9 s LYS 1073Ca 0.13 0.07 -0.24 0.00 -0.36 0.00 0.00 55.97 55.57 1af9 s LYS 1073Cb -0.16 0.09 0.05 0.00 -1.51 0.00 0.00 37.83 36.30 1af9 s LYS 1073CO 0.11 -0.06 1.33 -0.51 -0.36 0.00 0.00 175.35 175.86 1af9 s LEU 1074N -0.85 3.51 -0.16 5.43 1.43 -1.26 -3.50 118.68 123.29 1af9 s LEU 1074Ca 0.06 -1.03 -0.07 0.00 -1.03 0.00 0.00 54.13 52.06 1af9 s LEU 1074Cb -0.02 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 1af9 s LEU 1074CO -0.07 -1.62 0.06 -0.62 0.23 0.00 0.00 176.35 174.34 1af9 s ASP 1075N 4.29 5.68 -0.06 2.29 2.15 0.06 -4.35 116.67 126.74 1af9 s ASP 1075Ca 0.39 0.14 0.00 0.00 0.43 0.00 0.00 52.55 53.51 1af9 s ASP 1075Cb -0.05 -1.92 0.00 0.00 -0.30 0.00 0.00 42.92 40.66 1af9 s ASP 1075CO 0.02 0.23 0.00 0.54 -0.17 0.00 0.00 175.17 175.79 1af9 n ARG 1076N 3.16 -0.14 -2.68 4.34 5.12 -1.26 -0.33 116.66 124.87 1af9 n ARG 1076Ca -0.17 0.22 -0.43 0.00 -1.93 0.00 0.00 57.85 55.54 1af9 n ARG 1076Cb 0.53 -3.50 -0.02 0.00 -1.16 0.00 0.00 32.46 28.30 1af9 n ARG 1076CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1af9 n ASN 1078N 6.51 3.03 -4.03 0.00 3.02 -1.26 -4.70 115.26 117.83 1af9 n ASN 1078Ca 0.11 -2.15 -0.31 0.00 -0.03 0.00 0.00 54.58 52.20 1af9 n ASN 1078Cb 0.47 -0.40 -0.15 0.00 -0.61 0.00 0.00 39.78 39.08 1af9 n ASN 1078CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1af9 s ASN 1079N -0.89 4.62 0.14 6.41 3.84 -1.26 -4.99 114.94 122.80 1af9 s ASN 1079Ca 0.34 -1.86 0.10 0.00 0.21 0.00 0.00 52.86 51.65 1af9 s ASN 1079Cb 0.20 -1.57 0.54 0.00 -0.55 0.00 0.00 41.25 39.87 1af9 s ASN 1079CO 0.20 -0.31 1.32 0.59 -2.79 0.00 0.00 177.10 176.10 1af9 n ASN 1080N 4.34 0.25 -1.10 -4.21 3.02 -1.26 -1.35 115.26 114.94 1af9 n ASN 1080Ca -0.03 0.61 0.11 0.00 -0.03 0.00 0.00 54.58 55.24 1af9 n ASN 1080Cb 0.42 -0.64 0.22 0.00 -0.61 0.00 0.00 39.78 39.16 1af9 n ASN 1080CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1af9 n ASN 1081N -1.83 3.42 -4.71 6.41 5.03 -1.26 -4.47 115.26 117.84 1af9 n ASN 1081Ca -0.00 -1.96 -0.42 0.00 0.87 0.00 0.00 54.58 53.06 1af9 n ASN 1081Cb 0.03 -0.27 -0.03 0.00 -1.02 0.00 0.00 39.78 38.49 1af9 n ASN 1081CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1af9 s GLN 1082N -1.34 4.50 0.12 3.52 -1.52 -0.46 -4.97 119.66 119.51 1af9 s GLN 1082Ca 0.37 1.63 -0.04 0.00 -1.95 0.00 0.00 55.36 55.38 1af9 s GLN 1082Cb 0.21 -3.38 -0.03 0.00 -0.22 0.00 0.00 33.01 29.60 1af9 s GLN 1082CO 0.30 -0.15 0.11 1.52 -0.25 0.00 0.00 175.29 176.82 1af9 s TYR 1083N 0.92 0.61 -0.00 0.91 -0.85 -1.26 -2.34 117.35 115.33 1af9 s TYR 1083Ca 0.55 -1.01 -0.19 0.00 -0.52 0.00 0.00 57.07 55.90 1af9 s TYR 1083Cb -0.26 -0.31 0.04 0.00 0.38 0.00 0.00 41.96 41.80 1af9 s TYR 1083CO 0.29 -0.55 0.42 0.54 -1.52 0.00 0.00 175.55 174.73 1af9 s VAL 1084N -3.99 0.04 -0.03 -3.49 0.11 -0.09 -4.48 120.40 108.48 1af9 s VAL 1084Ca 0.17 -0.37 0.07 0.00 -2.93 0.00 0.00 61.98 58.92 1af9 s VAL 1084Cb 0.06 -0.80 -0.02 0.00 -1.53 0.00 0.00 36.38 34.09 1af9 s VAL 1084CO -0.02 -0.20 -0.25 -0.44 -3.33 0.00 0.00 175.10 170.86 1af9 s SER 1085N -1.51 2.95 0.00 3.54 0.01 -0.96 -0.09 113.70 117.64 1af9 s SER 1085Ca -0.10 -0.47 0.03 0.00 1.31 0.00 0.00 55.95 56.72 1af9 s SER 1085Cb -0.03 -0.53 -0.01 0.00 0.21 0.00 0.00 66.02 65.66 1af9 s SER 1085CO 0.03 0.28 -0.11 -0.63 0.41 0.00 0.00 173.24 173.22 1af9 s ILE 1086N -0.40 0.85 -0.00 1.44 1.01 0.22 -2.15 121.20 122.16 1af9 s ILE 1086Ca 0.04 -0.57 -0.08 0.00 0.00 0.00 0.00 60.65 60.04 1af9 s ILE 1086Cb -0.11 -0.73 0.00 0.00 0.01 0.00 0.00 42.46 41.63 1af9 s ILE 1086CO 0.01 0.15 0.16 -0.62 0.00 0.00 0.00 174.94 174.64 1af9 s ASP 1087N -0.48 -0.00 -1.38 3.58 2.15 -0.60 -0.97 116.67 118.97 1af9 s ASP 1087Ca 0.03 -0.16 -0.08 0.00 0.43 0.00 0.00 52.55 52.77 1af9 s ASP 1087Cb -0.05 0.22 0.03 0.00 -0.30 0.00 0.00 42.92 42.82 1af9 s ASP 1087CO -0.00 -0.37 1.01 0.29 -0.17 0.00 0.00 175.17 175.93 1af9 n LYS 1088N 1.47 -6.46 -1.80 4.34 4.76 -1.26 -0.31 118.16 118.89 1af9 n LYS 1088Ca -0.22 0.72 -0.42 0.00 -2.87 0.00 0.00 58.31 55.52 1af9 n LYS 1088Cb 0.56 -5.64 -0.03 0.00 -1.84 0.00 0.00 35.03 28.08 1af9 n LYS 1088CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1af9 s PHE 1089N -3.38 1.54 0.04 2.13 5.36 -1.26 -4.21 117.98 118.20 1af9 s PHE 1089Ca 0.42 -0.05 0.03 0.00 -0.96 0.00 0.00 56.93 56.37 1af9 s PHE 1089Cb -0.20 -4.09 -0.02 0.00 -0.34 0.00 0.00 43.02 38.37 1af9 s PHE 1089CO 0.78 -4.64 -0.10 0.50 -1.46 0.00 0.00 175.22 170.29 1af9 s ARG 1090N 4.62 0.67 -0.02 10.12 3.52 -0.09 -1.39 118.95 136.39 1af9 s ARG 1090Ca 0.84 -0.71 0.04 0.00 -0.13 0.00 0.00 55.73 55.77 1af9 s ARG 1090Cb -0.37 -0.58 -0.01 0.00 -1.56 0.00 0.00 34.95 32.43 1af9 s ARG 1090CO 0.36 0.13 -0.13 0.42 -0.81 0.00 0.00 175.30 175.27 1af9 s ILE 1091N -1.04 1.08 0.17 4.11 1.01 0.29 -0.88 121.20 125.94 1af9 s ILE 1091Ca -0.04 -0.57 0.10 0.00 0.00 0.00 0.00 60.65 60.15 1af9 s ILE 1091Cb -0.08 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1af9 s ILE 1091CO 0.01 0.31 -0.20 -0.36 0.00 0.00 0.00 174.94 174.70 1af9 s PHE 1092N -0.22 2.41 -0.55 3.97 0.40 0.41 -1.84 117.98 122.56 1af9 s PHE 1092Ca 0.03 -0.31 0.08 0.00 -0.60 0.00 0.00 56.93 56.13 1af9 s PHE 1092Cb -0.06 -1.22 0.49 0.00 0.51 0.00 0.00 43.02 42.74 1af9 s PHE 1092CO -0.00 0.47 1.24 0.00 0.70 0.00 0.00 175.22 177.63 1af9 s LYS 1094N -2.05 1.15 -0.35 0.00 -2.85 -1.23 -4.62 119.74 109.79 1af9 s LYS 1094Ca 0.32 -1.10 -0.20 0.00 -1.00 0.00 0.00 55.97 54.00 1af9 s LYS 1094Cb 0.25 0.40 -0.00 0.00 -2.06 0.00 0.00 37.83 36.41 1af9 s LYS 1094CO 0.09 -0.43 0.63 0.00 0.10 0.00 0.00 175.35 175.75 1af9 s ALA 1095N -3.94 3.47 0.67 0.59 0.00 -1.26 -2.68 121.76 118.60 1af9 s ALA 1095Ca 0.14 -0.82 -0.13 0.00 0.00 0.00 0.00 51.96 51.15 1af9 s ALA 1095Cb 0.03 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 20.00 1af9 s ALA 1095CO -0.02 -1.28 1.08 -0.51 0.00 0.00 0.00 175.76 175.03 1af9 s LEU 1096N 2.67 3.30 0.47 0.00 1.43 -1.26 -5.02 118.68 120.26 1af9 s LEU 1096Ca 0.24 1.81 0.07 0.00 -1.03 0.00 0.00 54.13 55.23 1af9 s LEU 1096Cb -0.15 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.55 1af9 s LEU 1096CO 0.14 -1.51 0.42 0.54 0.23 0.00 0.00 176.35 176.17 1af9 s ASN 1097N -3.09 4.92 0.23 2.29 4.22 -1.26 -4.92 114.94 117.32 1af9 s ASN 1097Ca 0.63 -0.91 -0.10 0.00 -2.14 0.00 0.00 52.86 50.34 1af9 s ASN 1097Cb -0.17 -0.21 0.35 0.00 1.28 0.00 0.00 41.25 42.50 1af9 s ASN 1097CO 0.46 -0.84 1.64 -0.65 -2.04 0.00 0.00 177.10 175.67 1af9 h PRO 1098N 0.89 0.07 -0.55 3.55 0.11 -1.97 0.53 132.00 134.63 1af9 h PRO 1098Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1af9 h PRO 1098Cb 1.28 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 1af9 h PRO 1098CO 0.56 0.05 0.36 -0.22 -0.21 0.00 0.00 178.00 178.53 1af9 h LYS 1099N 0.07 0.72 0.04 1.05 3.64 -1.97 -0.56 116.57 119.55 1af9 h LYS 1099Ca 0.36 -0.05 -0.23 0.00 -1.27 0.00 0.00 60.65 59.47 1af9 h LYS 1099Cb 0.60 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1af9 h LYS 1099CO -0.64 0.48 -1.05 0.93 -2.27 0.00 0.00 179.45 176.90 1af9 h GLU 1100N 0.74 0.09 -0.16 1.90 5.08 -1.35 -3.01 114.58 117.87 1af9 h GLU 1100Ca 0.20 -0.14 -0.17 0.00 -1.00 0.00 0.00 59.36 58.24 1af9 h GLU 1100Cb -0.08 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1af9 h GLU 1100CO -0.04 1.05 -0.62 0.82 -1.00 0.00 0.00 179.01 179.22 1af9 h ILE 1101N 0.03 1.33 0.02 3.13 2.04 -0.68 -2.02 117.51 121.35 1af9 h ILE 1101Ca -0.05 -1.89 -0.00 0.00 1.00 0.00 0.00 64.86 63.92 1af9 h ILE 1101Cb 1.79 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 39.74 1af9 h ILE 1101CO 0.15 0.59 -0.01 -0.08 0.00 0.00 0.00 178.15 178.80 1af9 h GLU 1102N 0.42 -0.02 -0.67 2.37 4.57 -1.18 0.91 114.58 120.97 1af9 h GLU 1102Ca -0.01 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.22 1af9 h GLU 1102Cb 1.18 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.72 1af9 h GLU 1102CO 0.12 0.24 0.39 -0.22 -1.18 0.00 0.00 179.01 178.36 1af9 h LYS 1103N -0.28 0.72 -0.21 1.92 1.63 -1.52 -1.19 116.57 117.63 1af9 h LYS 1103Ca -0.00 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.73 1af9 h LYS 1103Cb 0.27 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.73 1af9 h LYS 1103CO 0.00 0.48 0.04 1.25 -3.45 0.00 0.00 179.45 177.78 1af9 h LEU 1104N 0.75 0.33 0.01 5.20 5.85 -1.24 -2.42 115.31 123.79 1af9 h LEU 1104Ca 0.29 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.80 1af9 h LEU 1104Cb 0.12 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1af9 h LEU 1104CO -0.15 0.49 -0.27 0.22 -0.34 0.00 0.00 178.44 178.38 1af9 h TYR 1105N 0.15 -0.74 0.00 1.25 3.20 -0.41 -2.52 116.97 117.91 1af9 h TYR 1105Ca 0.07 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1af9 h TYR 1105Cb 0.29 0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.89 1af9 h TYR 1105CO 0.01 -0.37 0.00 1.79 -1.64 0.00 0.00 178.16 177.96 1af9 h THR 1106N -0.42 0.00 0.00 1.81 1.35 -1.26 -3.09 112.91 111.29 1af9 h THR 1106Ca 0.06 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 1af9 h THR 1106Cb 0.50 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 1af9 h THR 1106CO -0.23 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.50 1af9 n SER 1107N -2.39 0.66 0.04 5.36 3.41 -0.91 -1.42 113.62 118.36 1af9 n SER 1107Ca 0.03 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.44 1af9 n SER 1107Cb 0.32 -0.82 0.12 0.00 -0.26 0.00 0.00 64.21 63.57 1af9 n SER 1107CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1af9 n TYR 1108N -2.25 0.36 -2.57 7.33 4.01 -1.17 -4.58 117.16 118.30 1af9 n TYR 1108Ca 0.01 0.11 -0.43 0.00 -0.16 0.00 0.00 57.90 57.43 1af9 n TYR 1108Cb 0.20 -0.51 0.00 0.00 -0.31 0.00 0.00 39.34 38.72 1af9 n TYR 1108CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1af9 n LEU 1109N -1.97 5.95 -4.65 7.72 4.77 -0.51 -4.76 117.00 123.55 1af9 n LEU 1109Ca 0.03 -4.48 -0.40 0.00 -0.03 0.00 0.00 56.01 51.13 1af9 n LEU 1109Cb 0.42 -1.57 -0.06 0.00 -2.33 0.00 0.00 43.42 39.88 1af9 n LEU 1109CO 0.38 1.00 0.34 -0.94 -1.33 0.00 0.00 177.39 176.84 1af9 s SER 1110N 2.06 6.61 -1.25 -1.43 1.04 -1.26 -4.98 113.70 114.49 1af9 s SER 1110Ca 0.42 0.74 -0.18 0.00 0.48 0.00 0.00 55.95 57.41 1af9 s SER 1110Cb 0.04 -2.33 0.07 0.00 0.10 0.00 0.00 66.02 63.91 1af9 s SER 1110CO 0.00 -0.28 1.67 -0.63 0.98 0.00 0.00 173.24 174.98 1af9 s ILE 1111N 2.04 4.16 0.01 -1.02 -1.09 -1.26 -4.30 121.20 119.74 1af9 s ILE 1111Ca 0.26 -1.79 -0.00 0.00 -2.23 0.00 0.00 60.65 56.89 1af9 s ILE 1111Cb -0.16 -5.16 -0.00 0.00 -1.58 0.00 0.00 42.46 35.57 1af9 s ILE 1111CO 0.10 -1.98 -0.00 0.41 -1.23 0.00 0.00 174.94 172.23 1af9 n THR 1112N 6.35 0.20 -3.94 2.92 -1.04 -1.26 -4.86 114.28 112.64 1af9 n THR 1112Ca 0.46 0.08 -0.31 0.00 -2.04 0.00 0.00 64.05 62.23 1af9 n THR 1112Cb 0.47 -1.11 -0.04 0.00 -1.82 0.00 0.00 70.33 67.82 1af9 n THR 1112CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1af9 s PHE 1113N -1.16 3.46 0.36 -1.42 0.08 -1.26 -0.83 117.98 117.21 1af9 s PHE 1113Ca -0.00 0.22 -0.12 0.00 0.12 0.00 0.00 56.93 57.15 1af9 s PHE 1113Cb 0.00 -1.74 -0.07 0.00 -0.57 0.00 0.00 43.02 40.64 1af9 s PHE 1113CO 0.00 0.58 0.74 -0.51 -0.10 0.00 0.00 175.22 175.93 1af9 s LEU 1114N -2.46 3.94 0.16 -0.37 1.43 -0.87 -4.75 118.68 115.75 1af9 s LEU 1114Ca 0.34 1.16 0.09 0.00 -1.03 0.00 0.00 54.13 54.69 1af9 s LEU 1114Cb -0.13 -4.01 -0.04 0.00 0.03 0.00 0.00 46.19 42.04 1af9 s LEU 1114CO 0.27 -0.30 -0.12 -0.13 0.23 0.00 0.00 176.35 176.29 1af9 s ARG 1115N -3.47 1.97 0.74 1.70 0.52 -1.26 -0.58 118.95 118.58 1af9 s ARG 1115Ca 0.52 -1.24 -0.08 0.00 -0.52 0.00 0.00 55.73 54.41 1af9 s ARG 1115Cb -0.10 -2.15 0.16 0.00 0.52 0.00 0.00 34.95 33.38 1af9 s ARG 1115CO 0.26 0.45 1.01 -0.40 0.02 0.00 0.00 175.30 176.64 1af9 n ASP 1116N 0.29 0.52 0.19 0.23 5.68 1.00 -4.54 116.55 119.91 1af9 n ASP 1116Ca -0.12 -1.63 0.18 0.00 -0.50 0.00 0.00 54.79 52.71 1af9 n ASP 1116Cb 0.54 -0.73 0.76 0.00 -1.14 0.00 0.00 41.12 40.55 1af9 n ASP 1116CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 1af9 h PHE 1117N -1.21 0.00 -0.01 2.11 3.57 -1.10 -0.93 116.94 119.37 1af9 h PHE 1117Ca -0.33 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.17 1af9 h PHE 1117Cb 1.01 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.75 1af9 h PHE 1117CO 0.00 0.00 -0.42 0.91 -2.23 0.00 0.00 178.31 176.57 1af9 n TRP 1118N -3.35 0.00 -0.06 0.41 7.02 -1.26 -4.91 117.44 115.28 1af9 n TRP 1118Ca 0.04 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.52 1af9 n TRP 1118Cb 0.54 -0.06 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 1af9 n TRP 1118CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1af9 n GLY 1119N 1.40 0.46 3.90 6.99 0.00 -0.35 -1.41 105.19 116.18 1af9 n GLY 1119Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 1af9 n GLY 1119CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1af9 s ASN 1120N -2.74 5.79 0.35 1.61 0.02 -1.26 -4.60 114.94 114.11 1af9 s ASN 1120Ca 0.00 0.94 -0.28 0.00 -1.02 0.00 0.00 52.86 52.50 1af9 s ASN 1120Cb 0.00 -1.96 -0.10 0.00 0.02 0.00 0.00 41.25 39.21 1af9 s ASN 1120CO 0.00 -0.99 1.32 -2.84 0.02 0.00 0.00 177.10 174.60 1af9 s PRO 1121N -5.04 4.24 -0.05 -0.60 0.02 -1.26 -0.00 135.00 132.30 1af9 s PRO 1121Ca 0.54 2.22 -0.30 0.00 0.02 0.00 0.00 61.00 63.48 1af9 s PRO 1121Cb -0.11 -2.98 -0.04 0.00 0.02 0.00 0.00 34.50 31.39 1af9 s PRO 1121CO 0.48 -0.29 1.29 -1.17 -0.33 0.00 0.00 177.00 176.98 1af9 s LEU 1122N -1.98 4.28 0.01 -5.54 2.96 0.26 -4.63 118.68 114.04 1af9 s LEU 1122Ca 0.51 1.90 0.00 0.00 -0.22 0.00 0.00 54.13 56.33 1af9 s LEU 1122Cb -0.40 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.70 1af9 s LEU 1122CO 0.53 -0.66 0.06 -0.13 -1.32 0.00 0.00 176.35 174.82 1af9 s ARG 1123N 2.52 2.98 0.00 1.98 0.52 -1.26 -0.28 118.95 125.41 1af9 s ARG 1123Ca 0.59 -0.54 0.00 0.00 -0.52 0.00 0.00 55.73 55.26 1af9 s ARG 1123Cb -0.27 -2.80 0.00 0.00 0.52 0.00 0.00 34.95 32.40 1af9 s ARG 1123CO 0.22 0.63 0.40 0.66 0.02 0.00 0.00 175.30 177.23 1af9 n TYR 1124N 1.14 0.00 -1.02 -0.53 4.01 -0.50 -4.00 117.16 116.26 1af9 n TYR 1124Ca -0.13 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.48 1af9 n TYR 1124Cb 0.53 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.39 1af9 n TYR 1124CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1af9 n ASP 1125N -0.40 5.42 -4.26 7.72 8.00 -1.22 -2.70 116.55 129.10 1af9 n ASP 1125Ca 0.00 -2.49 -0.25 0.00 0.71 0.00 0.00 54.79 52.76 1af9 n ASP 1125Cb 0.00 -1.43 -0.14 0.00 -0.02 0.00 0.00 41.12 39.54 1af9 n ASP 1125CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1af9 s THR 1126N 1.03 1.68 0.31 -3.53 2.01 -1.26 -5.00 115.64 110.88 1af9 s THR 1126Ca 0.67 -1.31 -0.24 0.00 0.31 0.00 0.00 61.69 61.12 1af9 s THR 1126Cb 0.31 -1.48 -0.10 0.00 0.01 0.00 0.00 72.50 71.25 1af9 s THR 1126CO -0.00 0.12 0.88 -1.61 -0.69 0.00 0.00 174.62 173.31 1af9 s GLU 1127N -1.42 4.45 -0.01 4.92 2.02 -1.26 -4.23 118.70 123.18 1af9 s GLU 1127Ca 0.07 1.17 -0.06 0.00 0.02 0.00 0.00 54.97 56.17 1af9 s GLU 1127Cb -0.09 -2.76 0.00 0.00 0.10 0.00 0.00 34.13 31.38 1af9 s GLU 1127CO 0.03 0.28 0.12 0.71 0.02 0.00 0.00 175.26 176.42 1af9 s TYR 1128N -1.65 0.02 -0.15 1.61 2.02 -0.18 -4.53 117.35 114.49 1af9 s TYR 1128Ca 0.49 -0.07 -0.07 0.00 -0.37 0.00 0.00 57.07 57.05 1af9 s TYR 1128Cb -0.17 -0.04 -0.04 0.00 -0.40 0.00 0.00 41.96 41.31 1af9 s TYR 1128CO 0.22 -0.24 0.09 0.71 -1.57 0.00 0.00 175.55 174.76 1af9 s TYR 1129N -1.11 3.36 0.10 2.71 1.51 0.52 0.06 117.35 124.51 1af9 s TYR 1129Ca -0.12 0.27 -0.15 0.00 -1.01 0.00 0.00 57.07 56.06 1af9 s TYR 1129Cb -0.07 -2.01 -0.07 0.00 -0.11 0.00 0.00 41.96 39.71 1af9 s TYR 1129CO 0.01 0.39 0.51 -0.51 -1.11 0.00 0.00 175.55 174.85 1af9 s LEU 1130N -0.22 4.39 -0.23 -1.29 1.02 -1.26 0.03 118.68 121.13 1af9 s LEU 1130Ca 0.09 1.05 -0.03 0.00 0.02 0.00 0.00 54.13 55.26 1af9 s LEU 1130Cb -0.12 -3.07 0.12 0.00 0.02 0.00 0.00 46.19 43.14 1af9 s LEU 1130CO 0.01 0.17 0.30 -0.63 0.02 0.00 0.00 176.35 176.22 1af9 s ILE 1131N -1.34 -0.46 0.07 -0.59 1.01 -0.94 -4.27 121.20 114.67 1af9 s ILE 1131Ca 0.34 -0.13 -0.32 0.00 0.00 0.00 0.00 60.65 60.53 1af9 s ILE 1131Cb -0.16 -0.77 -0.11 0.00 0.01 0.00 0.00 42.46 41.43 1af9 s ILE 1131CO 0.18 -0.19 1.83 -0.81 0.00 0.00 0.00 174.94 175.95 1af9 n PRO 1132N 5.34 2.55 0.22 2.79 -0.04 -1.26 -1.69 135.00 142.90 1af9 n PRO 1132Ca -0.04 0.93 0.11 0.00 -0.04 0.00 0.00 63.50 64.46 1af9 n PRO 1132Cb 0.50 -2.80 0.69 0.00 -0.04 0.00 0.00 33.50 31.84 1af9 n PRO 1132CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1af9 h VAL 1133N 4.83 0.88 0.00 0.52 -1.51 -1.47 -1.42 116.25 118.08 1af9 h VAL 1133Ca -0.47 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 64.96 1af9 h VAL 1133Cb 1.24 0.95 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 1af9 h VAL 1133CO 0.94 0.00 -0.17 0.00 -1.23 0.00 0.00 177.57 177.11 1af9 h ALA 1134N 1.94 1.27 -1.69 5.19 0.00 -1.89 -3.31 119.26 120.77 1af9 h ALA 1134Ca 0.05 -0.16 -0.48 0.00 0.00 0.00 0.00 54.91 54.32 1af9 h ALA 1134Cb 0.20 -0.03 -0.33 0.00 0.00 0.00 0.00 17.79 17.63 1af9 h ALA 1134CO -0.00 0.21 -0.93 -1.13 0.00 0.00 0.00 179.25 177.40 1af9 n SER 1135N -3.68 -0.78 -0.39 0.00 3.41 -0.57 -5.00 113.62 106.62 1af9 n SER 1135Ca -0.02 -2.73 0.00 0.00 -0.26 0.00 0.00 58.87 55.86 1af9 n SER 1135Cb 0.29 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1af9 n SER 1135CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1af9 n SER 1136N 1.92 0.10 -0.08 4.04 3.41 -1.02 -1.85 113.62 120.14 1af9 n SER 1136Ca 0.21 -0.26 0.01 0.00 -0.26 0.00 0.00 58.87 58.57 1af9 n SER 1136Cb 0.54 -0.05 0.01 0.00 -0.26 0.00 0.00 64.21 64.44 1af9 n SER 1136CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1af9 n SER 1137N 0.23 1.18 -4.78 4.04 3.41 -1.26 -4.98 113.62 111.45 1af9 n SER 1137Ca 0.00 -1.10 -0.29 0.00 -0.26 0.00 0.00 58.87 57.22 1af9 n SER 1137Cb 0.03 -0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 1af9 n SER 1137CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1af9 s LYS 1138N -0.18 2.88 0.25 4.33 -0.14 -0.77 -0.34 119.74 125.78 1af9 s LYS 1138Ca 0.02 -0.73 0.11 0.00 -1.36 0.00 0.00 55.97 54.01 1af9 s LYS 1138Cb 0.02 -2.71 -0.05 0.00 -1.68 0.00 0.00 37.83 33.41 1af9 s LYS 1138CO 0.02 0.55 -0.14 -0.51 -0.76 0.00 0.00 175.35 174.51 1af9 s ASP 1139N -2.55 3.92 -0.16 2.83 1.01 -0.41 -4.56 116.67 116.74 1af9 s ASP 1139Ca 0.30 -0.85 -0.12 0.00 0.71 0.00 0.00 52.55 52.59 1af9 s ASP 1139Cb -0.12 -0.50 -0.05 0.00 1.01 0.00 0.00 42.92 43.27 1af9 s ASP 1139CO 0.22 0.05 0.24 -0.69 0.21 0.00 0.00 175.17 175.20 1af9 s VAL 1140N -2.26 5.34 0.14 -1.27 1.01 -1.26 -0.28 120.40 121.83 1af9 s VAL 1140Ca 0.29 0.43 0.08 0.00 0.00 0.00 0.00 61.98 62.78 1af9 s VAL 1140Cb -0.06 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1af9 s VAL 1140CO 0.16 0.44 -0.18 -1.10 0.00 0.00 0.00 175.10 174.42 1af9 s GLN 1141N 0.20 1.19 -0.26 2.72 -1.52 0.14 -1.56 119.66 120.57 1af9 s GLN 1141Ca 0.14 -1.33 -0.13 0.00 -1.95 0.00 0.00 55.36 52.10 1af9 s GLN 1141Cb -0.13 -1.24 -0.04 0.00 -0.22 0.00 0.00 33.01 31.38 1af9 s GLN 1141CO 0.03 0.26 0.29 -1.17 -0.25 0.00 0.00 175.29 174.45 1af9 s LEU 1142N -2.49 4.06 0.04 2.90 2.96 -1.26 -0.67 118.68 124.22 1af9 s LEU 1142Ca 0.12 0.21 -0.28 0.00 -0.22 0.00 0.00 54.13 53.96 1af9 s LEU 1142Cb -0.06 -2.30 -0.17 0.00 0.50 0.00 0.00 46.19 44.15 1af9 s LEU 1142CO 0.05 -0.09 1.38 0.50 -1.32 0.00 0.00 176.35 176.87 1af9 h LYS 1143N 8.00 -0.69 -1.88 1.98 3.64 -1.57 -3.47 116.57 122.59 1af9 h LYS 1143Ca -0.34 0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.06 1af9 h LYS 1143Cb 1.17 0.16 -0.20 0.00 -0.41 0.00 0.00 32.23 32.95 1af9 h LYS 1143CO 0.63 -0.39 0.28 1.21 -2.27 0.00 0.00 179.45 178.91 1af9 s ASN 1144N -4.67 -0.59 0.00 4.20 3.84 -1.26 -5.05 114.94 111.41 1af9 s ASN 1144Ca -0.15 0.68 0.00 0.00 0.21 0.00 0.00 52.86 53.60 1af9 s ASN 1144Cb 0.03 0.54 0.00 0.00 -0.55 0.00 0.00 41.25 41.27 1af9 s ASN 1144CO 0.55 -0.51 0.15 0.00 -2.79 0.00 0.00 177.10 174.50 1af9 n ILE 1145N 0.99 0.00 0.45 -5.21 3.06 -1.26 0.09 119.36 117.48 1af9 n ILE 1145Ca -0.16 0.32 0.03 0.00 -2.50 0.00 0.00 62.75 60.44 1af9 n ILE 1145Cb 0.57 -0.50 0.17 0.00 0.54 0.00 0.00 39.64 40.42 1af9 n ILE 1145CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 1af9 n THR 1146N -0.58 0.00 -2.50 9.51 -2.24 -1.16 -3.65 114.28 113.66 1af9 n THR 1146Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1af9 n THR 1146Cb 0.00 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 1af9 n THR 1146CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1af9 n ASP 1147N -0.90 0.00 -4.81 3.42 8.00 0.11 -4.34 116.55 118.04 1af9 n ASP 1147Ca 0.04 -0.56 -0.27 0.00 0.71 0.00 0.00 54.79 54.72 1af9 n ASP 1147Cb 0.02 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.21 1af9 n ASP 1147CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1af9 s TYR 1148N 1.38 2.68 0.11 1.24 -0.85 -1.26 -0.82 117.35 119.83 1af9 s TYR 1148Ca 0.00 0.44 0.10 0.00 -0.52 0.00 0.00 57.07 57.10 1af9 s TYR 1148Cb 0.00 -3.36 -0.04 0.00 0.38 0.00 0.00 41.96 38.94 1af9 s TYR 1148CO 0.00 -1.66 -0.24 -1.64 -1.52 0.00 0.00 175.55 170.49 1af9 s MET 1149N -5.39 1.58 0.13 -3.49 -1.94 -1.26 -1.40 119.30 107.54 1af9 s MET 1149Ca 0.63 -1.26 -0.09 0.00 -1.71 0.00 0.00 55.69 53.26 1af9 s MET 1149Cb -0.10 -1.98 -0.01 0.00 2.01 0.00 0.00 34.83 34.76 1af9 s MET 1149CO 0.47 0.47 0.24 1.52 -0.01 0.00 0.00 175.02 177.70 1af9 s TYR 1150N -1.04 0.31 0.40 -0.03 1.13 0.15 -0.97 117.35 117.31 1af9 s TYR 1150Ca 0.15 -0.70 -0.23 0.00 -1.41 0.00 0.00 57.07 54.88 1af9 s TYR 1150Cb -0.10 -0.07 -0.10 0.00 -1.10 0.00 0.00 41.96 40.59 1af9 s TYR 1150CO 0.06 -0.64 0.97 -0.51 -2.51 0.00 0.00 175.55 172.93 1af9 s LEU 1151N -2.93 4.07 0.26 -3.49 1.43 -0.43 0.29 118.68 117.88 1af9 s LEU 1151Ca 0.12 1.81 0.01 0.00 -1.03 0.00 0.00 54.13 55.04 1af9 s LEU 1151Cb 0.04 -4.35 -0.05 0.00 0.03 0.00 0.00 46.19 41.86 1af9 s LEU 1151CO -0.05 -0.35 0.10 -0.89 0.23 0.00 0.00 176.35 175.40 1af9 s THR 1152N -1.93 0.53 -0.21 5.49 2.01 0.62 -4.73 115.64 117.42 1af9 s THR 1152Ca 0.59 -2.00 -0.16 0.00 0.31 0.00 0.00 61.69 60.43 1af9 s THR 1152Cb -0.14 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.71 1af9 s THR 1152CO 0.19 0.00 0.41 0.20 -0.69 0.00 0.00 174.62 174.72 1af9 s ASN 1153N -3.32 6.42 0.32 3.53 -0.87 -1.26 -1.29 114.94 118.46 1af9 s ASN 1153Ca 0.38 0.49 -0.28 0.00 -1.57 0.00 0.00 52.86 51.88 1af9 s ASN 1153Cb 0.08 -2.23 -0.10 0.00 -0.02 0.00 0.00 41.25 38.98 1af9 s ASN 1153CO 0.14 -0.11 1.15 0.00 -2.57 0.00 0.00 177.10 175.71 1af9 s ALA 1154N 1.48 3.37 0.68 0.60 0.00 0.54 -4.83 121.76 123.60 1af9 s ALA 1154Ca 0.19 0.98 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 1af9 s ALA 1154Cb -0.15 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.60 1af9 s ALA 1154CO 0.08 -0.33 1.05 -1.25 0.00 0.00 0.00 175.76 175.32 1af9 s PRO 1155N -1.72 3.07 0.10 0.00 0.04 -1.26 -4.87 135.00 130.36 1af9 s PRO 1155Ca 0.48 0.90 0.09 0.00 0.04 0.00 0.00 61.00 62.51 1af9 s PRO 1155Cb -0.33 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 1af9 s PRO 1155CO 0.42 -0.99 -0.19 -1.12 0.04 0.00 0.00 177.00 175.16 1af9 s SER 1156N -3.88 3.79 -0.09 6.66 0.01 -1.26 -0.80 113.70 118.13 1af9 s SER 1156Ca 0.57 -0.55 -0.02 0.00 1.31 0.00 0.00 55.95 57.26 1af9 s SER 1156Cb -0.13 -0.52 -0.03 0.00 0.21 0.00 0.00 66.02 65.55 1af9 s SER 1156CO 0.55 0.20 -0.01 -0.47 0.41 0.00 0.00 173.24 173.92 1af9 s TYR 1157N -1.08 3.13 0.00 2.43 5.04 0.28 -4.88 117.35 122.27 1af9 s TYR 1157Ca 0.17 0.15 -0.04 0.00 -2.44 0.00 0.00 57.07 54.91 1af9 s TYR 1157Cb -0.10 -1.79 -0.01 0.00 0.35 0.00 0.00 41.96 40.41 1af9 s TYR 1157CO 0.08 0.43 0.07 0.95 -1.34 0.00 0.00 175.55 175.74 1af9 s THR 1158N -0.80 0.08 -0.33 4.34 -4.23 -1.26 -1.17 115.64 112.28 1af9 s THR 1158Ca 0.12 -0.67 0.02 0.00 -1.18 0.00 0.00 61.69 59.98 1af9 s THR 1158Cb -0.11 -0.33 0.15 0.00 1.34 0.00 0.00 72.50 73.55 1af9 s THR 1158CO 0.02 -0.37 0.38 0.21 -0.54 0.00 0.00 174.62 174.32 1af9 s ASN 1159N -1.21 0.92 0.21 3.99 3.84 0.13 -4.94 114.94 117.88 1af9 s ASN 1159Ca -0.13 -0.96 -0.10 0.00 0.21 0.00 0.00 52.86 51.88 1af9 s ASN 1159Cb -0.07 0.79 0.19 0.00 -0.55 0.00 0.00 41.25 41.60 1af9 s ASN 1159CO 0.00 -0.32 1.84 1.23 -2.79 0.00 0.00 177.10 177.07 1af9 h GLY 1160N 7.72 0.99 1.00 1.21 0.00 -1.97 -0.93 103.07 111.08 1af9 h GLY 1160Ca -0.04 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 1af9 h GLY 1160CO 0.25 0.26 0.39 0.07 0.00 0.00 0.00 176.54 177.51 1af9 h LYS 1161N 0.82 0.84 -0.20 4.80 2.10 -1.96 -2.28 116.57 120.69 1af9 h LYS 1161Ca 0.28 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 58.86 1af9 h LYS 1161Cb 0.04 -0.18 0.00 0.00 -0.90 0.00 0.00 32.23 31.19 1af9 h LYS 1161CO -0.12 0.59 0.00 1.28 -2.00 0.00 0.00 179.45 179.20 1af9 n LEU 1162N -4.61 2.25 -3.74 7.07 4.77 -1.15 -4.96 117.00 116.62 1af9 n LEU 1162Ca 0.05 -0.92 -0.34 0.00 -0.03 0.00 0.00 56.01 54.77 1af9 n LEU 1162Cb 0.04 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1af9 n LEU 1162CO 0.36 0.46 -0.09 -3.20 -1.33 0.00 0.00 177.39 173.60 1af9 n ASN 1163N 0.71 -5.18 -3.88 -1.43 5.15 -0.40 -4.99 115.26 105.23 1af9 n ASN 1163Ca 0.17 -1.06 -0.11 0.00 -0.60 0.00 0.00 54.58 52.98 1af9 n ASN 1163Cb 0.43 -3.12 -0.11 0.00 -0.53 0.00 0.00 39.78 36.45 1af9 n ASN 1163CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1af9 s ILE 1164N -3.47 0.07 -0.10 -1.44 2.07 -0.89 -4.48 121.20 112.95 1af9 s ILE 1164Ca 0.48 -0.55 -0.32 0.00 -1.41 0.00 0.00 60.65 58.85 1af9 s ILE 1164Cb -0.19 -0.32 0.12 0.00 0.13 0.00 0.00 42.46 42.20 1af9 s ILE 1164CO 0.88 -0.30 1.08 -0.72 -1.91 0.00 0.00 174.94 173.97 1af9 s TYR 1165N -1.00 -0.21 -0.29 3.50 -0.85 -0.69 0.19 117.35 118.01 1af9 s TYR 1165Ca -0.11 0.12 -0.37 0.00 -0.52 0.00 0.00 57.07 56.19 1af9 s TYR 1165Cb -0.06 0.53 0.17 0.00 0.38 0.00 0.00 41.96 42.97 1af9 s TYR 1165CO 0.01 -0.36 1.38 1.52 -1.52 0.00 0.00 175.55 176.58 1af9 s TYR 1166N -2.72 -0.01 0.13 -3.49 1.13 -0.32 -1.52 117.35 110.55 1af9 s TYR 1166Ca 0.08 0.01 -0.30 0.00 -1.41 0.00 0.00 57.07 55.45 1af9 s TYR 1166Cb -0.01 0.50 -0.06 0.00 -1.10 0.00 0.00 41.96 41.29 1af9 s TYR 1166CO -0.06 -0.02 1.06 -0.98 -2.51 0.00 0.00 175.55 173.03 1af9 s ARG 1167N -1.83 4.61 0.36 -3.49 1.70 -1.26 -0.56 118.95 118.47 1af9 s ARG 1167Ca 0.11 1.61 -0.28 0.00 -0.47 0.00 0.00 55.73 56.71 1af9 s ARG 1167Cb -0.01 -3.33 -0.10 0.00 -0.57 0.00 0.00 34.95 30.94 1af9 s ARG 1167CO -0.04 0.07 1.31 1.03 -1.08 0.00 0.00 175.30 176.59 1af9 s ARG 1168N 0.04 4.22 0.44 3.89 0.52 0.02 -4.89 118.95 123.20 1af9 s ARG 1168Ca 0.50 2.20 0.08 0.00 -0.52 0.00 0.00 55.73 57.99 1af9 s ARG 1168Cb -0.27 -2.96 0.00 0.00 0.52 0.00 0.00 34.95 32.25 1af9 s ARG 1168CO 0.32 -0.30 0.47 -0.51 0.02 0.00 0.00 175.30 175.30 1af9 s LEU 1169N -2.02 3.37 -0.27 2.53 1.43 -1.26 -4.71 118.68 117.74 1af9 s LEU 1169Ca 0.52 -0.72 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 1af9 s LEU 1169Cb -0.39 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 43.74 1af9 s LEU 1169CO 0.52 -0.78 0.00 -1.22 0.23 0.00 0.00 176.35 175.09 1af9 n TYR 1170N -1.71 0.00 -4.73 0.29 4.01 -1.26 -4.97 117.16 108.80 1af9 n TYR 1170Ca 0.05 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.48 1af9 n TYR 1170Cb 0.61 -0.83 -0.13 0.00 -0.31 0.00 0.00 39.34 38.69 1af9 n TYR 1170CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1af9 s ASN 1171N -2.71 3.76 0.00 7.72 4.22 -1.26 -5.07 114.94 121.60 1af9 s ASN 1171Ca 0.00 -0.41 0.00 0.00 -2.14 0.00 0.00 52.86 50.31 1af9 s ASN 1171Cb 0.00 -0.61 0.00 0.00 1.28 0.00 0.00 41.25 41.92 1af9 s ASN 1171CO 0.00 0.27 0.00 0.61 -2.04 0.00 0.00 177.10 175.94 1af9 n GLY 1172N 1.70 1.10 3.70 0.45 0.00 -1.26 -4.75 105.19 106.13 1af9 n GLY 1172Ca -0.16 -2.27 -0.36 0.00 0.00 0.00 0.00 46.02 43.22 1af9 n GLY 1172CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1af9 n LEU 1173N 0.00 5.39 -4.37 0.99 4.32 -0.60 -5.00 117.00 117.73 1af9 n LEU 1173Ca 0.00 0.77 -0.33 0.00 -0.02 0.00 0.00 56.01 56.43 1af9 n LEU 1173Cb 0.00 -1.52 -0.14 0.00 -1.62 0.00 0.00 43.42 40.14 1af9 n LEU 1173CO 0.00 -1.27 -0.42 -0.54 -1.22 0.00 0.00 177.39 173.94 1af9 s LYS 1174N -3.44 3.41 0.30 3.23 1.02 -1.26 -4.37 119.74 118.62 1af9 s LYS 1174Ca 0.80 -0.66 0.08 0.00 0.02 0.00 0.00 55.97 56.21 1af9 s LYS 1174Cb -0.37 -2.74 -0.04 0.00 -0.52 0.00 0.00 37.83 34.17 1af9 s LYS 1174CO 0.43 0.12 0.17 -0.06 -0.92 0.00 0.00 175.35 175.09 1af9 s PHE 1175N 0.60 2.87 -0.06 3.18 0.40 0.11 -0.86 117.98 124.22 1af9 s PHE 1175Ca -0.06 -0.25 -0.04 0.00 -0.60 0.00 0.00 56.93 55.98 1af9 s PHE 1175Cb -0.15 -1.52 0.03 0.00 0.51 0.00 0.00 43.02 41.89 1af9 s PHE 1175CO 0.03 0.41 0.15 0.42 0.70 0.00 0.00 175.22 176.92 1af9 s ILE 1176N -2.29 -0.03 -0.26 0.64 1.01 -0.77 -1.01 121.20 118.49 1af9 s ILE 1176Ca 0.36 0.11 -0.12 0.00 0.00 0.00 0.00 60.65 61.00 1af9 s ILE 1176Cb -0.06 -0.23 -0.05 0.00 0.01 0.00 0.00 42.46 42.14 1af9 s ILE 1176CO 0.24 0.05 0.23 -0.63 0.00 0.00 0.00 174.94 174.83 1af9 s ILE 1177N 0.78 5.29 0.01 2.92 1.01 -1.10 -1.88 121.20 128.23 1af9 s ILE 1177Ca -0.06 0.30 0.06 0.00 0.00 0.00 0.00 60.65 60.95 1af9 s ILE 1177Cb -0.08 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 38.79 1af9 s ILE 1177CO -0.04 0.26 -0.19 -0.54 0.00 0.00 0.00 174.94 174.44 1af9 s LYS 1178N 1.57 2.16 0.51 2.79 -0.14 0.17 -3.38 119.74 123.43 1af9 s LYS 1178Ca 0.10 -0.91 -0.21 0.00 -1.36 0.00 0.00 55.97 53.59 1af9 s LYS 1178Cb -0.15 -2.20 -0.07 0.00 -1.68 0.00 0.00 37.83 33.73 1af9 s LYS 1178CO 0.09 0.56 1.13 -0.98 -0.76 0.00 0.00 175.35 175.39 1af9 s ARG 1179N -1.15 3.51 -0.00 1.68 1.70 -1.26 0.36 118.95 123.79 1af9 s ARG 1179Ca 0.13 1.63 -0.24 0.00 -0.47 0.00 0.00 55.73 56.79 1af9 s ARG 1179Cb -0.10 -2.13 -0.15 0.00 -0.57 0.00 0.00 34.95 32.00 1af9 s ARG 1179CO 0.03 -0.72 1.10 -0.92 -1.08 0.00 0.00 175.30 173.71 1af9 h TYR 1180N 1.48 -0.50 -3.83 5.89 3.20 -1.69 -3.42 116.97 118.10 1af9 h TYR 1180Ca -0.50 -0.01 -0.26 0.00 3.14 0.00 0.00 58.73 61.10 1af9 h TYR 1180Cb 1.25 0.16 -0.17 0.00 1.54 0.00 0.00 36.73 39.51 1af9 h TYR 1180CO 0.52 -0.17 -0.72 0.95 -1.64 0.00 0.00 178.16 177.11 1af9 s THR 1181N -4.38 0.72 -0.60 1.81 -4.23 -1.26 -5.03 115.64 102.68 1af9 s THR 1181Ca -0.13 -1.63 -0.28 0.00 -1.18 0.00 0.00 61.69 58.47 1af9 s THR 1181Cb 0.02 -1.31 0.03 0.00 1.34 0.00 0.00 72.50 72.58 1af9 s THR 1181CO 0.47 -0.66 1.19 -2.16 -0.54 0.00 0.00 174.62 172.92 1af9 s PRO 1182N -2.95 3.47 0.55 3.99 0.04 -1.26 -5.01 135.00 133.83 1af9 s PRO 1182Ca 0.04 0.16 0.05 0.00 0.04 0.00 0.00 61.00 61.30 1af9 s PRO 1182Cb -0.01 -4.04 0.04 0.00 0.04 0.00 0.00 34.50 30.54 1af9 s PRO 1182CO -0.02 -1.72 0.42 0.54 0.04 0.00 0.00 177.00 176.26 1af9 s ASN 1183N 3.04 4.63 0.00 6.66 4.22 -1.26 -5.02 114.94 127.21 1af9 s ASN 1183Ca 0.41 -1.26 0.00 0.00 -2.14 0.00 0.00 52.86 49.87 1af9 s ASN 1183Cb -0.08 0.48 0.00 0.00 1.28 0.00 0.00 41.25 42.93 1af9 s ASN 1183CO 0.24 -1.14 0.00 0.59 -2.04 0.00 0.00 177.10 174.74 1af9 n ASN 1184N -1.80 0.00 -4.12 3.54 4.13 -1.26 -4.26 115.26 111.49 1af9 n ASN 1184Ca -0.01 0.00 -0.26 0.00 1.68 0.00 0.00 54.58 55.99 1af9 n ASN 1184Cb 0.64 0.00 -0.16 0.00 -1.54 0.00 0.00 39.78 38.72 1af9 n ASN 1184CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1af9 s GLU 1185N -0.25 1.76 -0.87 3.52 8.01 -1.26 -5.08 118.70 124.53 1af9 s GLU 1185Ca 0.00 -0.57 -0.25 0.00 0.01 0.00 0.00 54.97 54.15 1af9 s GLU 1185Cb 0.00 -1.52 0.03 0.00 -4.31 0.00 0.00 34.13 28.34 1af9 s GLU 1185CO 0.00 0.21 1.40 0.42 0.01 0.00 0.00 175.26 177.30 1af9 s ILE 1186N 0.13 3.79 0.11 -1.63 -1.09 -1.26 -4.98 121.20 116.27 1af9 s ILE 1186Ca -0.06 -0.16 -0.09 0.00 -2.23 0.00 0.00 60.65 58.12 1af9 s ILE 1186Cb -0.12 -4.92 -0.06 0.00 -1.58 0.00 0.00 42.46 35.78 1af9 s ILE 1186CO 0.02 -1.84 0.42 -0.62 -1.23 0.00 0.00 174.94 171.70 1af9 s ASP 1187N 4.59 6.61 0.38 3.58 -1.08 -1.26 -4.99 116.67 124.50 1af9 s ASP 1187Ca 0.42 0.77 0.24 0.00 -0.52 0.00 0.00 52.55 53.46 1af9 s ASP 1187Cb -0.04 -2.17 0.40 0.00 -1.46 0.00 0.00 42.92 39.65 1af9 s ASP 1187CO 0.03 0.12 1.60 0.77 0.52 0.00 0.00 175.17 178.21 1af9 h SER 1188N 3.39 0.00 -3.10 -0.34 4.64 -1.96 -3.45 113.55 112.73 1af9 h SER 1188Ca -0.48 -0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.22 1af9 h SER 1188Cb 1.18 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.17 1af9 h SER 1188CO 0.68 0.00 -0.44 -0.36 -0.87 0.00 0.00 176.83 175.84 1af9 s PHE 1189N -3.20 3.48 0.01 4.77 0.08 -1.26 -1.41 117.98 120.46 1af9 s PHE 1189Ca 0.07 0.46 -0.30 0.00 0.12 0.00 0.00 56.93 57.28 1af9 s PHE 1189Cb 0.07 -2.14 -0.05 0.00 -0.57 0.00 0.00 43.02 40.33 1af9 s PHE 1189CO 0.66 0.41 1.23 0.08 -0.10 0.00 0.00 175.22 177.51 1af9 s VAL 1190N -0.04 4.05 0.06 -0.44 1.01 0.62 -4.92 120.40 120.73 1af9 s VAL 1190Ca 0.12 1.43 0.00 0.00 0.00 0.00 0.00 61.98 63.54 1af9 s VAL 1190Cb -0.12 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 1af9 s VAL 1190CO 0.01 0.05 0.18 -0.54 0.00 0.00 0.00 175.10 174.80 1af9 s LYS 1191N 1.69 3.32 0.09 2.72 1.02 -1.26 -2.05 119.74 125.27 1af9 s LYS 1191Ca 0.59 -0.48 -0.31 0.00 0.02 0.00 0.00 55.97 55.79 1af9 s LYS 1191Cb -0.28 -2.98 -0.10 0.00 -0.52 0.00 0.00 37.83 33.95 1af9 s LYS 1191CO 0.26 0.61 1.89 0.45 -0.92 0.00 0.00 175.35 177.64 1af9 s SER 1192N -2.43 6.42 0.00 2.83 0.15 -0.01 -1.59 113.70 119.07 1af9 s SER 1192Ca 0.33 2.74 0.00 0.00 0.70 0.00 0.00 55.95 59.72 1af9 s SER 1192Cb -0.13 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1af9 s SER 1192CO 0.26 -1.03 0.00 0.61 1.20 0.00 0.00 173.24 174.28 1af9 n GLY 1193N 4.37 1.36 3.77 9.45 0.00 0.11 -4.98 105.19 119.27 1af9 n GLY 1193Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1af9 n GLY 1193CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1af9 s ASP 1194N -1.86 6.30 -0.09 1.61 1.01 -0.62 -4.78 116.67 118.25 1af9 s ASP 1194Ca 0.00 2.40 -0.19 0.00 0.71 0.00 0.00 52.55 55.47 1af9 s ASP 1194Cb 0.00 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 1af9 s ASP 1194CO 0.00 -0.83 0.51 -0.36 0.21 0.00 0.00 175.17 174.70 1af9 s PHE 1195N -1.43 3.56 0.24 4.23 0.08 -1.26 -1.91 117.98 121.49 1af9 s PHE 1195Ca 0.60 0.98 0.04 0.00 0.12 0.00 0.00 56.93 58.68 1af9 s PHE 1195Cb -0.32 -2.57 -0.02 0.00 -0.57 0.00 0.00 43.02 39.55 1af9 s PHE 1195CO 0.39 0.23 0.16 0.44 -0.10 0.00 0.00 175.22 176.34 1af9 n ILE 1196N 3.39 0.00 -4.05 0.64 -5.35 0.14 -2.20 119.36 111.92 1af9 n ILE 1196Ca -0.07 -1.65 -0.19 0.00 -0.27 0.00 0.00 62.75 60.58 1af9 n ILE 1196Cb 0.52 0.74 -0.16 0.00 -1.74 0.00 0.00 39.64 38.99 1af9 n ILE 1196CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1af9 s LYS 1197N -2.97 0.60 -0.13 6.28 1.02 0.16 -1.74 119.74 122.96 1af9 s LYS 1197Ca 0.23 -0.02 -0.06 0.00 0.02 0.00 0.00 55.97 56.13 1af9 s LYS 1197Cb 0.01 -0.70 -0.04 0.00 -0.52 0.00 0.00 37.83 36.58 1af9 s LYS 1197CO 0.16 -0.11 0.11 -1.17 -0.92 0.00 0.00 175.35 173.41 1af9 s LEU 1198N 1.01 4.18 0.28 3.17 2.96 -1.26 -0.65 118.68 128.36 1af9 s LEU 1198Ca -0.10 0.36 0.03 0.00 -0.22 0.00 0.00 54.13 54.20 1af9 s LEU 1198Cb -0.14 -2.02 -0.06 0.00 0.50 0.00 0.00 46.19 44.47 1af9 s LEU 1198CO -0.01 0.36 0.05 -0.31 -1.32 0.00 0.00 176.35 175.12 1af9 s TYR 1199N -0.73 1.74 -0.08 5.38 1.51 -0.79 -1.31 117.35 123.07 1af9 s TYR 1199Ca 0.13 -0.99 -0.01 0.00 -1.01 0.00 0.00 57.07 55.19 1af9 s TYR 1199Cb -0.12 -1.07 0.03 0.00 -0.11 0.00 0.00 41.96 40.69 1af9 s TYR 1199CO 0.03 -0.08 -0.03 0.14 -1.11 0.00 0.00 175.55 174.49 1af9 s VAL 1200N -3.44 0.62 -0.01 0.71 -7.23 0.25 -1.84 120.40 109.46 1af9 s VAL 1200Ca 0.34 -0.05 -0.30 0.00 -1.81 0.00 0.00 61.98 60.16 1af9 s VAL 1200Cb 0.07 -0.71 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 1af9 s VAL 1200CO 0.13 0.29 1.28 -0.44 -0.31 0.00 0.00 175.10 176.05 1af9 s SER 1201N 1.73 6.98 -0.27 4.85 0.01 -0.04 -1.27 113.70 125.68 1af9 s SER 1201Ca 0.03 1.97 -0.15 0.00 1.31 0.00 0.00 55.95 59.10 1af9 s SER 1201Cb -0.13 -2.56 0.08 0.00 0.21 0.00 0.00 66.02 63.62 1af9 s SER 1201CO -0.05 -0.62 0.67 -0.47 0.41 0.00 0.00 173.24 173.18 1af9 s TYR 1202N 2.07 -1.04 -1.32 2.43 5.04 -0.48 -4.22 117.35 119.84 1af9 s TYR 1202Ca 0.59 2.08 0.00 0.00 -2.44 0.00 0.00 57.07 57.30 1af9 s TYR 1202Cb -0.28 0.61 0.00 0.00 0.35 0.00 0.00 41.96 42.64 1af9 s TYR 1202CO 0.25 -0.52 0.00 -1.71 -1.34 0.00 0.00 175.55 172.23 1af9 n ASN 1203N 4.35 -4.49 -0.20 4.32 5.15 -1.26 -1.53 115.26 121.60 1af9 n ASN 1203Ca -0.20 0.15 -0.03 0.00 -0.60 0.00 0.00 54.58 53.91 1af9 n ASN 1203Cb 0.58 -3.81 -0.01 0.00 -0.53 0.00 0.00 39.78 36.01 1af9 n ASN 1203CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1af9 n ASN 1204N -1.76 -3.27 -4.30 1.20 3.02 -1.26 -5.04 115.26 103.85 1af9 n ASN 1204Ca -0.18 0.06 -0.16 0.00 -0.03 0.00 0.00 54.58 54.28 1af9 n ASN 1204Cb 0.62 -1.04 -0.10 0.00 -0.61 0.00 0.00 39.78 38.65 1af9 n ASN 1204CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1af9 s ASN 1205N -2.97 1.58 -0.21 6.41 0.02 -0.58 -5.14 114.94 114.06 1af9 s ASN 1205Ca 0.00 -1.22 -0.04 0.00 -1.02 0.00 0.00 52.86 50.59 1af9 s ASN 1205Cb 0.00 0.06 -0.01 0.00 0.02 0.00 0.00 41.25 41.31 1af9 s ASN 1205CO 0.00 -0.55 -0.04 -1.61 0.02 0.00 0.00 177.10 174.92 1af9 s GLU 1206N -3.89 3.43 -0.18 -0.60 2.02 -1.26 -1.38 118.70 116.84 1af9 s GLU 1206Ca 0.28 -0.61 -0.04 0.00 0.02 0.00 0.00 54.97 54.61 1af9 s GLU 1206Cb 0.06 -2.98 -0.02 0.00 0.10 0.00 0.00 34.13 31.28 1af9 s GLU 1206CO 0.07 -0.11 -0.02 -1.01 0.02 0.00 0.00 175.26 174.21 1af9 s HIS 1207N 1.25 3.02 0.28 1.61 3.76 -0.40 -4.86 115.29 119.96 1af9 s HIS 1207Ca 0.03 -0.43 -0.29 0.00 -0.15 0.00 0.00 55.06 54.22 1af9 s HIS 1207Cb -0.14 -2.02 -0.10 0.00 1.11 0.00 0.00 32.58 31.43 1af9 s HIS 1207CO -0.01 -0.17 1.27 -1.50 -0.85 0.00 0.00 174.74 173.48 1af9 s ILE 1208N 0.73 2.99 -0.19 0.60 -1.16 -1.26 -0.58 121.20 122.34 1af9 s ILE 1208Ca -0.01 0.94 -0.08 0.00 -0.51 0.00 0.00 60.65 60.99 1af9 s ILE 1208Cb -0.14 -3.60 -0.04 0.00 0.61 0.00 0.00 42.46 39.29 1af9 s ILE 1208CO 0.02 0.20 0.07 -0.69 -2.81 0.00 0.00 174.94 171.73 1af9 s VAL 1209N -0.77 4.83 0.04 4.00 1.01 -0.43 -0.87 120.40 128.21 1af9 s VAL 1209Ca 0.50 -0.02 -0.05 0.00 0.00 0.00 0.00 61.98 62.42 1af9 s VAL 1209Cb -0.37 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 32.84 1af9 s VAL 1209CO 0.46 0.45 0.22 0.61 0.00 0.00 0.00 175.10 176.85 1af9 n GLY 1210N 3.58 1.15 2.95 4.51 0.00 -0.99 -4.65 105.19 111.73 1af9 n GLY 1210Ca -0.16 -0.97 -0.26 0.00 0.00 0.00 0.00 46.02 44.62 1af9 n GLY 1210CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1af9 s TYR 1211N -5.15 1.51 0.74 1.61 5.04 -0.56 -0.97 117.35 119.57 1af9 s TYR 1211Ca 0.05 -0.71 -0.15 0.00 -2.44 0.00 0.00 57.07 53.82 1af9 s TYR 1211Cb -0.01 -1.20 0.04 0.00 0.35 0.00 0.00 41.96 41.14 1af9 s TYR 1211CO 0.01 -0.46 1.20 -2.14 -1.34 0.00 0.00 175.55 172.83 1af9 s PRO 1212N 1.40 2.11 0.29 4.97 0.02 -1.26 -0.86 135.00 141.66 1af9 s PRO 1212Ca -0.01 1.75 0.02 0.00 0.02 0.00 0.00 61.00 62.78 1af9 s PRO 1212Cb -0.13 -1.83 0.70 0.00 0.02 0.00 0.00 34.50 33.25 1af9 s PRO 1212CO -0.05 -1.85 1.64 -0.22 -0.33 0.00 0.00 177.00 176.19 1af9 h LYS 1213N -0.35 0.18 -0.88 5.54 3.64 -0.23 -2.19 116.57 122.28 1af9 h LYS 1213Ca -0.47 -0.01 -0.39 0.00 -1.27 0.00 0.00 60.65 58.50 1af9 h LYS 1213Cb 1.29 -0.04 -0.41 0.00 -0.41 0.00 0.00 32.23 32.67 1af9 h LYS 1213CO 0.49 0.12 -1.04 -0.25 -2.27 0.00 0.00 179.45 176.51 1af9 n ASP 1214N -5.25 2.56 -4.45 4.20 8.00 -1.26 -5.08 116.55 115.27 1af9 n ASP 1214Ca 0.21 -2.83 -0.29 0.00 0.71 0.00 0.00 54.79 52.59 1af9 n ASP 1214Cb 0.68 -0.48 0.20 0.00 -0.02 0.00 0.00 41.12 41.50 1af9 n ASP 1214CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1af9 s GLY 1215N -3.47 1.56 0.36 0.44 0.00 -0.82 -4.96 107.32 100.43 1af9 s GLY 1215Ca 0.34 -0.52 -0.26 0.00 0.00 0.00 0.00 44.72 44.28 1af9 s GLY 1215CO -0.03 0.17 1.03 -2.01 0.00 0.00 0.00 173.10 172.26 1af9 n ASN 1216N -4.38 1.38 -3.64 1.64 5.15 -1.26 -4.86 115.26 109.30 1af9 n ASN 1216Ca 0.07 1.11 -0.10 0.00 -0.60 0.00 0.00 54.58 55.06 1af9 n ASN 1216Cb 0.58 -1.34 -0.07 0.00 -0.53 0.00 0.00 39.78 38.42 1af9 n ASN 1216CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1af9 s ALA 1217N -1.18 -1.93 0.30 5.20 0.00 -1.26 -1.87 121.76 121.02 1af9 s ALA 1217Ca 0.60 2.05 -0.27 0.00 0.00 0.00 0.00 51.96 54.34 1af9 s ALA 1217Cb -0.61 -1.38 -0.10 0.00 0.00 0.00 0.00 23.12 21.03 1af9 s ALA 1217CO 0.59 -0.31 0.93 -0.06 0.00 0.00 0.00 175.76 176.91 1af9 s PHE 1218N 0.61 3.75 -0.29 0.00 0.08 0.03 -4.11 117.98 118.06 1af9 s PHE 1218Ca -0.01 1.79 0.00 0.00 0.12 0.00 0.00 56.93 58.83 1af9 s PHE 1218Cb -0.05 -2.92 0.00 0.00 -0.57 0.00 0.00 43.02 39.48 1af9 s PHE 1218CO -0.07 0.27 0.00 -1.71 -0.10 0.00 0.00 175.22 173.61 1af9 n ASN 1219N 0.77 -1.70 0.00 1.36 5.15 -1.26 -1.28 115.26 118.30 1af9 n ASN 1219Ca 0.01 0.39 0.00 0.00 -0.60 0.00 0.00 54.58 54.38 1af9 n ASN 1219Cb 0.49 -1.58 0.00 0.00 -0.53 0.00 0.00 39.78 38.16 1af9 n ASN 1219CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1af9 n ASN 1220N -1.39 -2.28 0.06 1.20 3.02 -1.26 -4.69 115.26 109.93 1af9 n ASN 1220Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 1af9 n ASN 1220Cb 0.49 -1.84 0.00 0.00 -0.61 0.00 0.00 39.78 37.83 1af9 n ASN 1220CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1af9 n LEU 1221N 0.00 0.33 -4.56 3.41 4.77 -0.40 -4.96 117.00 115.59 1af9 n LEU 1221Ca 0.00 0.21 -0.22 0.00 -0.03 0.00 0.00 56.01 55.96 1af9 n LEU 1221Cb 0.14 0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 1af9 n LEU 1221CO 0.00 -0.68 1.42 -1.81 -1.33 0.00 0.00 177.39 174.98 1af9 s ASP 1222N -5.19 4.36 -0.16 -1.43 1.11 -0.59 -4.79 116.67 109.98 1af9 s ASP 1222Ca 0.00 0.09 -0.29 0.00 0.18 0.00 0.00 52.55 52.53 1af9 s ASP 1222Cb 0.00 -2.54 -0.01 0.00 1.07 0.00 0.00 42.92 41.44 1af9 s ASP 1222CO 0.00 -3.35 1.12 -0.13 1.18 0.00 0.00 175.17 173.99 1af9 s ARG 1223N 8.23 4.30 -0.04 8.23 0.52 -0.81 -0.79 118.95 138.59 1af9 s ARG 1223Ca 0.87 1.50 -0.30 0.00 -0.52 0.00 0.00 55.73 57.27 1af9 s ARG 1223Cb -0.12 -3.64 -0.04 0.00 0.52 0.00 0.00 34.95 31.67 1af9 s ARG 1223CO 0.10 -0.56 1.27 0.42 0.02 0.00 0.00 175.30 176.55 1af9 s ILE 1224N 2.88 4.08 0.17 1.52 1.01 -0.78 -0.94 121.20 129.13 1af9 s ILE 1224Ca 0.50 1.42 -0.30 0.00 0.00 0.00 0.00 60.65 62.27 1af9 s ILE 1224Cb -0.19 -3.91 -0.07 0.00 0.01 0.00 0.00 42.46 38.30 1af9 s ILE 1224CO 0.13 -0.01 0.98 -0.76 0.00 0.00 0.00 174.94 175.28 1af9 s LEU 1225N 2.32 4.55 0.06 2.97 1.43 -1.17 -4.76 118.68 124.08 1af9 s LEU 1225Ca 0.58 1.89 0.07 0.00 -1.03 0.00 0.00 54.13 55.65 1af9 s LEU 1225Cb -0.27 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.32 1af9 s LEU 1225CO 0.23 -0.01 -0.15 -0.13 0.23 0.00 0.00 176.35 176.52 1af9 s ARG 1226N -0.46 2.11 -0.20 1.70 1.81 -0.15 -3.99 118.95 119.76 1af9 s ARG 1226Ca 0.45 -0.98 -0.07 0.00 -1.72 0.00 0.00 55.73 53.41 1af9 s ARG 1226Cb -0.25 -2.24 -0.03 0.00 -0.45 0.00 0.00 34.95 31.97 1af9 s ARG 1226CO 0.31 0.53 0.05 0.08 -0.68 0.00 0.00 175.30 175.60 1af9 s VAL 1227N -1.02 4.48 -1.44 3.52 1.01 -0.00 -2.36 120.40 124.59 1af9 s VAL 1227Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1af9 s VAL 1227Cb -0.11 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1af9 s VAL 1227CO 0.08 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1af9 n GLY 1228N 4.00 0.48 3.59 4.51 0.00 -0.05 -2.98 105.19 114.75 1af9 n GLY 1228Ca -0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.41 1af9 n GLY 1228CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1af9 n TYR 1229N -2.78 1.99 -4.08 1.61 9.36 -1.26 -4.60 117.16 117.39 1af9 n TYR 1229Ca -0.16 -0.09 -0.33 0.00 3.32 0.00 0.00 57.90 60.64 1af9 n TYR 1229Cb 0.56 -2.70 -0.16 0.00 -0.63 0.00 0.00 39.34 36.41 1af9 n TYR 1229CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1af9 s ASN 1230N 7.53 3.35 -0.18 2.98 2.20 -1.26 -5.03 114.94 124.53 1af9 s ASN 1230Ca 1.01 -0.63 -0.07 0.00 -0.94 0.00 0.00 52.86 52.23 1af9 s ASN 1230Cb -0.45 -1.52 0.08 0.00 -2.00 0.00 0.00 41.25 37.36 1af9 s ASN 1230CO 0.39 -0.01 0.39 0.00 -2.94 0.00 0.00 177.10 174.93 1af9 s ALA 1231N 1.32 -1.02 -0.16 3.54 0.00 -1.26 -5.12 121.76 119.06 1af9 s ALA 1231Ca 0.05 1.40 -0.29 0.00 0.00 0.00 0.00 51.96 53.12 1af9 s ALA 1231Cb -0.13 -1.17 -0.05 0.00 0.00 0.00 0.00 23.12 21.76 1af9 s ALA 1231CO -0.11 -0.62 2.04 -1.25 0.00 0.00 0.00 175.76 175.81 1af9 s PRO 1232N 2.29 3.51 0.00 0.00 0.04 -1.26 -2.74 135.00 136.84 1af9 s PRO 1232Ca -0.03 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1af9 s PRO 1232Cb -0.11 -4.26 0.00 0.00 0.04 0.00 0.00 34.50 30.17 1af9 s PRO 1232CO -0.12 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 175.66 1af9 n GLY 1233N 5.26 0.64 3.31 0.56 0.00 -1.26 -5.05 105.19 108.65 1af9 n GLY 1233Ca 0.25 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.91 1af9 n GLY 1233CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1af9 s ILE 1234N -2.49 3.65 0.31 -0.61 -1.09 -1.11 -5.09 121.20 114.77 1af9 s ILE 1234Ca 0.00 -0.69 -0.29 0.00 -2.23 0.00 0.00 60.65 57.43 1af9 s ILE 1234Cb 0.00 -2.83 -0.11 0.00 -1.58 0.00 0.00 42.46 37.95 1af9 s ILE 1234CO 0.00 0.18 1.46 -2.84 -1.23 0.00 0.00 174.94 172.51 1af9 s PRO 1235N 1.47 4.21 -0.08 2.79 0.02 -1.26 -4.78 135.00 137.37 1af9 s PRO 1235Ca 0.03 2.41 0.01 0.00 0.02 0.00 0.00 61.00 63.47 1af9 s PRO 1235Cb -0.16 -3.05 -0.03 0.00 0.02 0.00 0.00 34.50 31.28 1af9 s PRO 1235CO 0.00 -0.45 -0.10 -1.17 -0.33 0.00 0.00 177.00 174.95 1af9 s LEU 1236N -1.10 2.95 -0.31 -5.54 2.96 -1.26 0.53 118.68 116.90 1af9 s LEU 1236Ca 0.56 -0.14 -0.11 0.00 -0.22 0.00 0.00 54.13 54.22 1af9 s LEU 1236Cb -0.44 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 44.59 1af9 s LEU 1236CO 0.51 0.31 0.19 -0.31 -1.32 0.00 0.00 176.35 175.74 1af9 s TYR 1237N -0.53 3.20 0.00 5.38 2.02 -0.04 -4.89 117.35 122.49 1af9 s TYR 1237Ca 0.07 -0.21 0.00 0.00 -0.37 0.00 0.00 57.07 56.56 1af9 s TYR 1237Cb -0.12 -2.40 0.00 0.00 -0.40 0.00 0.00 41.96 39.04 1af9 s TYR 1237CO 0.02 -0.32 0.00 1.63 -1.57 0.00 0.00 175.55 175.30 1af9 n LYS 1238N 5.05 3.00 -1.57 -0.62 4.01 -1.26 -1.49 118.16 125.28 1af9 n LYS 1238Ca -0.14 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.25 1af9 n LYS 1238Cb 0.50 -0.66 -0.04 0.00 -0.51 0.00 0.00 35.03 34.33 1af9 n LYS 1238CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1af9 n LYS 1239N -0.91 1.57 -4.24 1.97 4.81 -1.26 -4.59 118.16 115.50 1af9 n LYS 1239Ca 0.00 0.34 -0.25 0.00 -0.87 0.00 0.00 58.31 57.53 1af9 n LYS 1239Cb 0.00 -3.20 -0.07 0.00 0.02 0.00 0.00 35.03 31.78 1af9 n LYS 1239CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1af9 s MET 1240N 6.98 2.37 -0.14 1.64 -1.94 -0.71 -1.04 119.30 126.46 1af9 s MET 1240Ca 1.02 -1.24 0.00 0.00 -1.71 0.00 0.00 55.69 53.76 1af9 s MET 1240Cb -0.36 -2.27 0.02 0.00 2.01 0.00 0.00 34.83 34.23 1af9 s MET 1240CO 0.34 0.41 -0.13 -2.00 -0.01 0.00 0.00 175.02 173.64 1af9 s GLU 1241N -3.30 2.10 -0.27 2.03 2.12 0.96 -0.69 118.70 121.65 1af9 s GLU 1241Ca 0.29 -0.48 -0.20 0.00 0.36 0.00 0.00 54.97 54.94 1af9 s GLU 1241Cb -0.08 -1.95 -0.02 0.00 0.26 0.00 0.00 34.13 32.34 1af9 s GLU 1241CO 0.19 -0.22 0.63 0.00 -0.54 0.00 0.00 175.26 175.32 1af9 s ALA 1242N 1.48 3.59 0.15 6.30 0.00 -0.80 -1.22 121.76 131.25 1af9 s ALA 1242Ca 0.04 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.51 1af9 s ALA 1242Cb -0.13 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1af9 s ALA 1242CO -0.09 -0.89 0.01 0.14 0.00 0.00 0.00 175.76 174.92 1af9 s VAL 1243N 2.55 0.51 -0.49 0.00 -7.23 -0.48 0.06 120.40 115.31 1af9 s VAL 1243Ca 0.26 -1.95 0.01 0.00 -1.81 0.00 0.00 61.98 58.50 1af9 s VAL 1243Cb -0.15 -2.02 0.13 0.00 0.56 0.00 0.00 36.38 34.90 1af9 s VAL 1243CO 0.09 -0.55 0.25 -0.75 -0.31 0.00 0.00 175.10 173.83 1af9 s LYS 1244N -3.94 2.01 0.03 4.82 2.47 -1.26 -2.23 119.74 121.64 1af9 s LYS 1244Ca 0.22 -2.33 0.18 0.00 -1.56 0.00 0.00 55.97 52.48 1af9 s LYS 1244Cb 0.06 -3.43 -0.17 0.00 -1.46 0.00 0.00 37.83 32.84 1af9 s LYS 1244CO 0.02 -1.08 0.69 1.28 0.16 0.00 0.00 175.35 176.42 1af9 n LEU 1245N 3.65 0.62 -3.54 5.43 4.77 -1.26 -5.02 117.00 121.65 1af9 n LEU 1245Ca 0.04 0.27 -0.11 0.00 -0.03 0.00 0.00 56.01 56.18 1af9 n LEU 1245Cb 0.37 0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 1af9 n LEU 1245CO 0.31 0.14 0.38 0.00 -1.33 0.00 0.00 177.39 176.89 1af9 s ARG 1246N -3.00 1.35 -0.51 3.23 1.04 -1.26 -5.03 118.95 114.78 1af9 s ARG 1246Ca -0.04 -0.61 -0.00 0.00 -1.04 0.00 0.00 55.73 54.04 1af9 s ARG 1246Cb 0.09 0.58 0.00 0.00 -2.04 0.00 0.00 34.95 33.58 1af9 s ARG 1246CO 0.83 -0.59 0.48 -3.47 -0.04 0.00 0.00 175.30 172.50 1af9 n ASP 1247N -0.38 -6.00 0.28 -2.89 -0.08 -1.26 -4.93 116.55 101.29 1af9 n ASP 1247Ca -0.14 -0.04 0.16 0.00 -1.51 0.00 0.00 54.79 53.26 1af9 n ASP 1247Cb 0.64 -3.97 0.75 0.00 2.34 0.00 0.00 41.12 40.87 1af9 n ASP 1247CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1af9 h LEU 1248N 0.34 0.00 -0.04 -2.67 3.38 -1.98 -2.37 115.31 111.97 1af9 h LEU 1248Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1af9 h LEU 1248Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1af9 h LEU 1248CO 0.21 0.05 -0.26 0.29 0.09 0.00 0.00 178.44 178.81 1af9 n LYS 1249N -3.22 0.10 -4.18 1.13 5.02 -1.26 -4.82 118.16 110.93 1af9 n LYS 1249Ca -0.00 -0.04 -0.36 0.00 -2.02 0.00 0.00 58.31 55.89 1af9 n LYS 1249Cb 0.28 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.71 1af9 n LYS 1249CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1af9 s THR 1250N -2.93 4.76 -1.39 -0.18 2.01 -0.89 -5.01 115.64 112.01 1af9 s THR 1250Ca 0.14 -0.07 -0.10 0.00 0.31 0.00 0.00 61.69 61.97 1af9 s THR 1250Cb 0.18 -3.04 0.09 0.00 0.01 0.00 0.00 72.50 69.74 1af9 s THR 1250CO 0.61 0.61 2.23 -1.22 -0.69 0.00 0.00 174.62 176.15 1af9 n TYR 1251N 2.12 2.96 -4.63 4.92 4.01 -1.26 -4.91 117.16 120.36 1af9 n TYR 1251Ca -0.19 -2.89 -0.28 0.00 -0.16 0.00 0.00 57.90 54.37 1af9 n TYR 1251Cb 0.54 -2.18 -0.10 0.00 -0.31 0.00 0.00 39.34 37.29 1af9 n TYR 1251CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1af9 s SER 1252N 1.61 3.81 0.06 7.72 1.04 -1.26 -4.26 113.70 122.43 1af9 s SER 1252Ca 0.49 -1.42 0.02 0.00 0.48 0.00 0.00 55.95 55.52 1af9 s SER 1252Cb 0.14 -0.22 -0.03 0.00 0.10 0.00 0.00 66.02 66.01 1af9 s SER 1252CO -0.05 -0.53 -0.07 -0.69 0.98 0.00 0.00 173.24 172.88 1af9 s VAL 1253N -2.78 0.57 -0.12 5.02 1.01 0.13 -4.78 120.40 119.44 1af9 s VAL 1253Ca 0.30 -1.39 0.01 0.00 0.00 0.00 0.00 61.98 60.90 1af9 s VAL 1253Cb 0.08 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.49 1af9 s VAL 1253CO 0.15 -0.57 -0.14 -1.10 0.00 0.00 0.00 175.10 173.44 1af9 s GLN 1254N -2.42 2.13 -0.22 2.72 1.11 -0.95 0.17 119.66 122.21 1af9 s GLN 1254Ca -0.02 -0.51 -0.08 0.00 0.01 0.00 0.00 55.36 54.76 1af9 s GLN 1254Cb -0.04 -1.91 -0.04 0.00 -1.01 0.00 0.00 33.01 30.01 1af9 s GLN 1254CO -0.02 -0.16 0.08 -0.51 0.01 0.00 0.00 175.29 174.69 1af9 s LEU 1255N 1.28 3.69 -0.14 2.90 1.43 -1.26 -1.39 118.68 125.19 1af9 s LEU 1255Ca -0.01 -0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.02 1af9 s LEU 1255Cb -0.14 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 1af9 s LEU 1255CO -0.06 0.07 -0.02 -0.75 0.23 0.00 0.00 176.35 175.83 1af9 s LYS 1256N 0.98 3.52 -0.06 1.70 2.20 -0.36 -0.50 119.74 127.22 1af9 s LYS 1256Ca 0.04 -0.47 -0.02 0.00 -0.36 0.00 0.00 55.97 55.17 1af9 s LYS 1256Cb -0.14 -2.91 -0.04 0.00 -1.51 0.00 0.00 37.83 33.23 1af9 s LYS 1256CO 0.03 0.37 0.03 -1.17 -0.36 0.00 0.00 175.35 174.26 1af9 s LEU 1257N 0.02 3.73 0.28 5.43 2.96 0.10 -0.03 118.68 131.18 1af9 s LEU 1257Ca 0.02 0.16 0.09 0.00 -0.22 0.00 0.00 54.13 54.17 1af9 s LEU 1257Cb -0.13 -1.98 -0.06 0.00 0.50 0.00 0.00 46.19 44.53 1af9 s LEU 1257CO 0.02 0.34 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.97 1af9 s TYR 1258N -1.00 2.08 0.45 5.38 2.02 -0.20 -1.02 117.35 125.06 1af9 s TYR 1258Ca 0.17 -0.54 0.08 0.00 -0.37 0.00 0.00 57.07 56.40 1af9 s TYR 1258Cb -0.12 -1.08 -0.00 0.00 -0.40 0.00 0.00 41.96 40.36 1af9 s TYR 1258CO 0.06 0.47 0.43 0.16 -1.57 0.00 0.00 175.55 175.10 1af9 s ASP 1259N -3.47 5.03 0.53 2.29 -4.77 -0.39 -4.21 116.67 111.68 1af9 s ASP 1259Ca 0.29 -0.81 0.39 0.00 -3.30 0.00 0.00 52.55 49.12 1af9 s ASP 1259Cb 0.01 -0.35 1.57 0.00 -1.09 0.00 0.00 42.92 43.05 1af9 s ASP 1259CO 0.13 -0.79 1.72 -2.24 0.70 0.00 0.00 175.17 174.69 1af9 h ASP 1260N 0.88 0.05 -0.50 2.11 2.03 -1.93 0.69 116.42 119.75 1af9 h ASP 1260Ca -0.40 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 55.92 1af9 h ASP 1260Cb 1.27 0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.79 1af9 h ASP 1260CO 0.55 -0.01 0.00 0.29 -1.03 0.00 0.00 179.24 179.04 1af9 n LYS 1261N -4.18 2.29 -2.78 4.15 4.76 -1.26 -4.92 118.16 116.21 1af9 n LYS 1261Ca 0.32 -1.85 -0.20 0.00 -2.87 0.00 0.00 58.31 53.70 1af9 n LYS 1261Cb 1.46 -1.44 0.02 0.00 -1.84 0.00 0.00 35.03 33.23 1af9 n LYS 1261CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1af9 n ASN 1262N 0.95 -5.77 -4.94 4.39 3.02 0.24 -5.00 115.26 108.15 1af9 n ASN 1262Ca 0.17 -0.19 -0.25 0.00 -0.03 0.00 0.00 54.58 54.28 1af9 n ASN 1262Cb 0.46 -4.66 -0.02 0.00 -0.61 0.00 0.00 39.78 34.95 1af9 n ASN 1262CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1af9 s ALA 1263N -3.09 3.77 -0.09 5.41 0.00 -1.25 -4.84 121.76 121.66 1af9 s ALA 1263Ca 0.20 -0.90 -0.22 0.00 0.00 0.00 0.00 51.96 51.04 1af9 s ALA 1263Cb -0.09 -2.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.96 1af9 s ALA 1263CO 0.24 0.19 0.63 0.45 0.00 0.00 0.00 175.76 177.27 1af9 s SER 1264N -3.67 6.88 0.00 0.00 0.15 -1.26 -1.26 113.70 114.53 1af9 s SER 1264Ca 0.39 1.05 0.25 0.00 0.70 0.00 0.00 55.95 58.34 1af9 s SER 1264Cb -0.10 -2.37 0.48 0.00 -1.71 0.00 0.00 66.02 62.32 1af9 s SER 1264CO 0.32 -0.09 1.39 0.18 1.20 0.00 0.00 173.24 176.24 1af9 n LEU 1265N 3.83 0.90 0.00 3.45 4.77 -0.19 -4.93 117.00 124.83 1af9 n LEU 1265Ca -0.03 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 1af9 n LEU 1265Cb 0.51 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 1af9 n LEU 1265CO 0.46 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1af9 n GLY 1266N 1.43 0.86 3.83 -0.72 0.00 -1.19 -3.37 105.19 106.02 1af9 n GLY 1266Ca 0.08 -2.19 -0.33 0.00 0.00 0.00 0.00 46.02 43.59 1af9 n GLY 1266CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1af9 s LEU 1267N 0.00 3.94 -0.00 0.99 1.43 0.28 -0.72 118.68 124.59 1af9 s LEU 1267Ca 0.00 1.63 -0.29 0.00 -1.03 0.00 0.00 54.13 54.44 1af9 s LEU 1267Cb 0.00 -4.48 -0.03 0.00 0.03 0.00 0.00 46.19 41.71 1af9 s LEU 1267CO 0.00 -0.35 0.93 -0.69 0.23 0.00 0.00 176.35 176.47 1af9 s VAL 1268N -2.18 4.88 0.00 -1.59 1.01 0.35 -0.41 120.40 122.45 1af9 s VAL 1268Ca 0.61 1.96 0.00 0.00 0.00 0.00 0.00 61.98 64.54 1af9 s VAL 1268Cb -0.09 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 32.02 1af9 s VAL 1268CO 0.15 0.19 0.00 0.61 0.00 0.00 0.00 175.10 176.04 1af9 n GLY 1269N 2.89 3.56 3.40 4.51 0.00 -0.55 -4.40 105.19 114.61 1af9 n GLY 1269Ca 0.05 -0.40 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 1af9 n GLY 1269CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1af9 s THR 1270N -0.64 0.94 -0.20 2.61 -4.23 -1.26 -1.43 115.64 111.43 1af9 s THR 1270Ca 0.00 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.34 1af9 s THR 1270Cb 0.00 -2.72 0.06 0.00 1.34 0.00 0.00 72.50 71.17 1af9 s THR 1270CO 0.00 0.00 0.52 -2.28 -0.54 0.00 0.00 174.62 172.32 1af9 s HIS 1271N -3.46 -0.63 -0.09 3.99 2.46 -0.52 -4.80 115.29 112.25 1af9 s HIS 1271Ca 0.37 1.46 -0.17 0.00 0.47 0.00 0.00 55.06 57.18 1af9 s HIS 1271Cb 0.08 0.25 -0.05 0.00 -0.13 0.00 0.00 32.58 32.74 1af9 s HIS 1271CO 0.15 -0.31 0.45 1.21 -2.47 0.00 0.00 174.74 173.77 1af9 s ASN 1272N 0.59 6.71 0.00 9.88 3.84 -1.26 -0.86 114.94 133.84 1af9 s ASN 1272Ca -0.02 0.84 0.00 0.00 0.21 0.00 0.00 52.86 53.89 1af9 s ASN 1272Cb -0.05 -2.27 0.00 0.00 -0.55 0.00 0.00 41.25 38.38 1af9 s ASN 1272CO -0.03 0.09 0.00 0.61 -2.79 0.00 0.00 177.10 174.97 1af9 n GLY 1273N 2.92 -1.02 3.46 1.21 0.00 0.02 -4.97 105.19 106.80 1af9 n GLY 1273Ca -0.09 -0.89 -0.23 0.00 0.00 0.00 0.00 46.02 44.81 1af9 n GLY 1273CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1af9 s GLN 1274N -0.72 1.63 -0.22 1.61 1.11 -1.26 -0.57 119.66 121.24 1af9 s GLN 1274Ca 0.00 -1.81 -0.04 0.00 0.01 0.00 0.00 55.36 53.53 1af9 s GLN 1274Cb 0.00 -1.41 0.10 0.00 -1.01 0.00 0.00 33.01 30.69 1af9 s GLN 1274CO 0.00 0.13 0.25 0.42 0.01 0.00 0.00 175.29 176.10 1af9 s ILE 1275N -2.81 -0.37 0.00 1.08 1.01 -1.26 -5.05 121.20 113.80 1af9 s ILE 1275Ca 0.30 -0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.80 1af9 s ILE 1275Cb 0.02 -0.73 0.00 0.00 0.01 0.00 0.00 42.46 41.76 1af9 s ILE 1275CO 0.13 -0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.46 1af9 n GLY 1276N 5.32 0.71 0.21 6.18 0.00 -1.26 -1.96 105.19 114.40 1af9 n GLY 1276Ca -0.05 -0.82 0.07 0.00 0.00 0.00 0.00 46.02 45.22 1af9 n GLY 1276CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1af9 n ASN 1277N 1.04 0.63 -4.77 1.61 3.02 -1.26 -4.90 115.26 110.63 1af9 n ASN 1277Ca 0.00 -1.69 -0.40 0.00 -0.03 0.00 0.00 54.58 52.46 1af9 n ASN 1277Cb 0.00 -0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.10 1af9 n ASN 1277CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1af9 s ASP 1278N -1.38 6.72 0.96 6.41 1.01 -0.83 -5.00 116.67 124.56 1af9 s ASP 1278Ca 0.22 2.67 -0.10 0.00 0.71 0.00 0.00 52.55 56.05 1af9 s ASP 1278Cb 0.11 -2.65 0.17 0.00 1.01 0.00 0.00 42.92 41.56 1af9 s ASP 1278CO 0.17 -0.57 1.13 -2.16 0.21 0.00 0.00 175.17 173.96 1af9 s PRO 1279N -1.85 0.69 0.22 8.23 0.04 -1.26 -4.24 135.00 136.82 1af9 s PRO 1279Ca 0.50 1.46 -0.32 0.00 0.04 0.00 0.00 61.00 62.68 1af9 s PRO 1279Cb -0.39 -1.70 -0.13 0.00 0.04 0.00 0.00 34.50 32.32 1af9 s PRO 1279CO 0.52 -2.83 1.49 -1.71 0.04 0.00 0.00 177.00 174.51 1af9 n ASN 1280N -4.36 3.04 -3.93 6.66 2.85 -1.26 -4.70 115.26 113.55 1af9 n ASN 1280Ca 0.11 1.12 -0.09 0.00 -0.11 0.00 0.00 54.58 55.60 1af9 n ASN 1280Cb 0.52 -1.45 -0.07 0.00 1.24 0.00 0.00 39.78 40.02 1af9 n ASN 1280CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1af9 s ARG 1281N 0.04 1.06 -0.68 1.20 0.52 0.26 -4.96 118.95 116.39 1af9 s ARG 1281Ca 0.71 -1.12 -0.11 0.00 -0.52 0.00 0.00 55.73 54.70 1af9 s ARG 1281Cb -0.63 0.36 0.18 0.00 0.52 0.00 0.00 34.95 35.37 1af9 s ARG 1281CO 0.45 -0.37 0.58 -0.51 0.02 0.00 0.00 175.30 175.47 1af9 s ASP 1282N -2.94 6.12 0.23 0.23 1.01 -1.26 -0.80 116.67 119.26 1af9 s ASP 1282Ca 0.14 -2.49 -0.24 0.00 0.71 0.00 0.00 52.55 50.67 1af9 s ASP 1282Cb 0.04 -2.08 -0.09 0.00 1.01 0.00 0.00 42.92 41.80 1af9 s ASP 1282CO -0.03 -0.58 0.81 -0.63 0.21 0.00 0.00 175.17 174.95 1af9 s ILE 1283N 0.49 4.38 0.16 0.77 1.01 -0.04 -1.32 121.20 126.65 1af9 s ILE 1283Ca 0.14 1.62 -0.30 0.00 0.00 0.00 0.00 60.65 62.10 1af9 s ILE 1283Cb -0.18 -4.03 -0.07 0.00 0.01 0.00 0.00 42.46 38.19 1af9 s ILE 1283CO -0.05 0.33 1.20 -0.76 0.00 0.00 0.00 174.94 175.66 1af9 s LEU 1284N -1.63 4.43 0.38 2.97 1.43 -0.14 -1.43 118.68 124.68 1af9 s LEU 1284Ca 0.42 2.18 0.06 0.00 -1.03 0.00 0.00 54.13 55.75 1af9 s LEU 1284Cb -0.20 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.39 1af9 s LEU 1284CO 0.24 -0.39 0.21 0.27 0.23 0.00 0.00 176.35 176.91 1af9 s ILE 1285N 0.21 0.27 -0.10 -0.59 -5.25 -0.52 -3.06 121.20 112.16 1af9 s ILE 1285Ca 0.54 -2.00 0.02 0.00 -0.99 0.00 0.00 60.65 58.22 1af9 s ILE 1285Cb -0.32 -2.40 0.01 0.00 2.95 0.00 0.00 42.46 42.71 1af9 s ILE 1285CO 0.35 0.00 -0.15 0.00 -1.79 0.00 0.00 174.94 173.34 1af9 s ALA 1286N -3.31 1.65 -0.09 2.27 0.00 -0.11 -1.48 121.76 120.69 1af9 s ALA 1286Ca 0.31 -0.69 -0.15 0.00 0.00 0.00 0.00 51.96 51.43 1af9 s ALA 1286Cb 0.02 -0.78 0.03 0.00 0.00 0.00 0.00 23.12 22.39 1af9 s ALA 1286CO 0.21 -0.01 0.38 0.45 0.00 0.00 0.00 175.76 176.79 1af9 s SER 1287N 0.87 -0.34 0.11 0.00 0.15 0.45 -1.93 113.70 113.02 1af9 s SER 1287Ca -0.09 0.50 0.25 0.00 0.70 0.00 0.00 55.95 57.31 1af9 s SER 1287Cb -0.15 0.59 0.53 0.00 -1.71 0.00 0.00 66.02 65.27 1af9 s SER 1287CO 0.00 -0.29 1.47 0.59 1.20 0.00 0.00 173.24 176.21 1af9 n ASN 1288N 2.09 0.64 -0.33 5.45 3.02 -1.26 -0.55 115.26 124.32 1af9 n ASN 1288Ca -0.17 0.19 0.20 0.00 -0.03 0.00 0.00 54.58 54.77 1af9 n ASN 1288Cb 0.57 -0.07 0.45 0.00 -0.61 0.00 0.00 39.78 40.11 1af9 n ASN 1288CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1af9 h TRP 1289N 0.00 0.82 0.00 3.10 2.91 -1.95 -0.44 115.95 120.39 1af9 h TRP 1289Ca 0.00 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1af9 h TRP 1289Cb 0.69 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 29.10 1af9 h TRP 1289CO 0.00 0.09 0.01 1.88 -1.03 0.00 0.00 178.44 179.39 1af9 h TYR 1290N 0.50 0.00 -0.01 2.65 0.05 -1.83 0.19 116.97 118.52 1af9 h TYR 1290Ca 0.61 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.39 1af9 h TYR 1290Cb 1.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.07 1af9 h TYR 1290CO -0.00 0.00 -0.01 1.19 -1.05 0.00 0.00 178.16 178.28 1af9 n PHE 1291N -2.39 0.00 -0.12 4.88 3.72 -0.17 -3.82 117.46 119.55 1af9 n PHE 1291Ca -0.02 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.17 1af9 n PHE 1291Cb 0.05 -0.01 -0.10 0.00 -0.94 0.00 0.00 39.48 38.48 1af9 n PHE 1291CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1af9 n ASN 1292N -0.16 1.98 -4.28 4.37 3.02 0.64 -4.75 115.26 116.08 1af9 n ASN 1292Ca 0.20 0.08 -0.43 0.00 -0.03 0.00 0.00 54.58 54.40 1af9 n ASN 1292Cb 0.30 -0.55 -0.07 0.00 -0.61 0.00 0.00 39.78 38.84 1af9 n ASN 1292CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1af9 s HIS 1293N -2.47 3.33 0.00 3.10 3.76 -1.15 -4.83 115.29 117.03 1af9 s HIS 1293Ca -0.34 -1.49 0.00 0.00 -0.15 0.00 0.00 55.06 53.08 1af9 s HIS 1293Cb 0.11 -3.47 0.00 0.00 1.11 0.00 0.00 32.58 30.33 1af9 s HIS 1293CO 0.50 -0.95 0.00 -0.11 -0.85 0.00 0.00 174.74 173.33 1af9 n LEU 1294N 5.06 0.00 -0.37 0.89 7.94 -1.26 -4.64 117.00 124.63 1af9 n LEU 1294Ca -0.11 0.00 0.14 0.00 -1.11 0.00 0.00 56.01 54.93 1af9 n LEU 1294Cb 0.41 0.00 0.50 0.00 0.53 0.00 0.00 43.42 44.86 1af9 n LEU 1294CO 0.47 0.00 0.81 1.17 -1.11 0.00 0.00 177.39 178.73 1af9 n LYS 1295N 0.00 1.32 -1.41 1.96 4.81 -1.26 -4.93 118.16 118.65 1af9 n LYS 1295Ca 0.00 -0.74 -0.32 0.00 -0.87 0.00 0.00 58.31 56.38 1af9 n LYS 1295Cb 0.00 -1.48 0.08 0.00 0.02 0.00 0.00 35.03 33.65 1af9 n LYS 1295CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1af9 s ASP 1296N -2.19 4.62 0.12 3.14 1.01 -1.26 -4.96 116.67 117.15 1af9 s ASP 1296Ca 0.33 1.93 -0.12 0.00 0.71 0.00 0.00 52.55 55.41 1af9 s ASP 1296Cb 0.20 -2.54 -0.11 0.00 1.01 0.00 0.00 42.92 41.49 1af9 s ASP 1296CO 0.40 -1.96 1.37 0.11 0.21 0.00 0.00 175.17 175.30 1af9 h LYS 1297N -0.72 0.85 -5.26 8.23 1.57 -2.01 -3.43 116.57 115.80 1af9 h LYS 1297Ca -0.45 -0.59 -0.66 0.00 -1.87 0.00 0.00 60.65 57.08 1af9 h LYS 1297Cb 1.24 0.09 -0.29 0.00 0.08 0.00 0.00 32.23 33.35 1af9 h LYS 1297CO 0.52 1.22 -0.79 0.42 -0.57 0.00 0.00 179.45 180.24 1af9 s ILE 1298N -3.98 2.78 0.04 1.86 1.01 -1.26 -5.03 121.20 116.63 1af9 s ILE 1298Ca -0.10 -0.74 -0.00 0.00 0.00 0.00 0.00 60.65 59.80 1af9 s ILE 1298Cb 0.10 -2.17 -0.00 0.00 0.01 0.00 0.00 42.46 40.40 1af9 s ILE 1298CO 0.90 0.52 -0.01 -0.11 0.00 0.00 0.00 174.94 176.24 1af9 n LEU 1299N 3.80 0.58 0.00 2.97 0.00 -1.26 -5.06 117.00 118.03 1af9 n LEU 1299Ca -0.19 0.07 0.00 0.00 0.00 0.00 0.00 56.01 55.90 1af9 n LEU 1299Cb 0.52 -0.18 0.00 0.00 0.00 0.00 0.00 43.42 43.76 1af9 n LEU 1299CO 0.29 -0.37 0.00 0.61 0.00 0.00 0.00 177.39 177.93 1af9 n GLY 1300N 3.21 1.22 1.00 -3.96 0.00 -1.26 -4.91 105.19 100.49 1af9 n GLY 1300Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.12 1af9 n GLY 1300CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1af9 s ASP 1302N -1.48 6.67 -0.04 0.00 1.01 -1.26 -4.37 116.67 117.20 1af9 s ASP 1302Ca 0.33 0.82 0.05 0.00 0.71 0.00 0.00 52.55 54.45 1af9 s ASP 1302Cb 0.20 -2.35 -0.01 0.00 1.01 0.00 0.00 42.92 41.77 1af9 s ASP 1302CO 0.28 -0.29 -0.20 0.26 0.21 0.00 0.00 175.17 175.43 1af9 s TRP 1303N 2.02 1.88 -0.01 4.23 0.52 0.13 -1.12 118.94 126.58 1af9 s TRP 1303Ca 0.28 -0.49 -0.20 0.00 0.02 0.00 0.00 56.10 55.71 1af9 s TRP 1303Cb -0.16 -1.24 -0.05 0.00 -1.15 0.00 0.00 33.47 30.87 1af9 s TRP 1303CO 0.10 -0.14 0.58 0.71 0.02 0.00 0.00 176.95 178.23 1af9 s TYR 1304N -0.15 3.68 -0.42 -1.98 2.02 -0.68 0.17 117.35 119.99 1af9 s TYR 1304Ca -0.00 1.18 -0.09 0.00 -0.37 0.00 0.00 57.07 57.78 1af9 s TYR 1304Cb -0.11 -2.59 0.08 0.00 -0.40 0.00 0.00 41.96 38.94 1af9 s TYR 1304CO 0.02 0.35 0.26 -0.06 -1.57 0.00 0.00 175.55 174.55 1af9 s PHE 1305N -0.19 3.34 -0.37 2.71 0.40 -1.26 -2.22 117.98 120.40 1af9 s PHE 1305Ca 0.30 -1.54 -0.12 0.00 -0.60 0.00 0.00 56.93 54.98 1af9 s PHE 1305Cb -0.18 -2.96 0.02 0.00 0.51 0.00 0.00 43.02 40.40 1af9 s PHE 1305CO 0.17 -0.85 0.22 0.08 0.70 0.00 0.00 175.22 175.53 1af9 s VAL 1306N 1.42 4.76 0.22 -0.44 1.01 0.10 -0.71 120.40 126.76 1af9 s VAL 1306Ca 0.03 -0.70 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 1af9 s VAL 1306Cb -0.23 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.49 1af9 s VAL 1306CO 0.02 -0.18 0.49 -2.16 0.00 0.00 0.00 175.10 173.27 1af9 s PRO 1307N 1.60 3.69 0.18 2.72 0.04 -1.26 -0.35 135.00 141.61 1af9 s PRO 1307Ca 0.03 0.07 -0.32 0.00 0.04 0.00 0.00 61.00 60.83 1af9 s PRO 1307Cb -0.19 -2.72 -0.11 0.00 0.04 0.00 0.00 34.50 31.53 1af9 s PRO 1307CO 0.07 0.34 1.68 0.99 0.04 0.00 0.00 177.00 180.13 1af9 s THR 1308N -1.84 2.34 -0.01 1.26 2.01 -1.26 -4.98 115.64 113.16 1af9 s THR 1308Ca 0.44 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.64 1af9 s THR 1308Cb -0.11 -3.12 0.01 0.00 0.01 0.00 0.00 72.50 69.28 1af9 s THR 1308CO 0.25 0.01 -0.03 -0.62 -0.69 0.00 0.00 174.62 173.54 1af9 s ASP 1309N 1.43 0.50 0.00 3.53 2.15 -1.26 -5.01 116.67 118.01 1af9 s ASP 1309Ca 0.74 -0.07 0.19 0.00 0.43 0.00 0.00 52.55 53.85 1af9 s ASP 1309Cb -0.47 -0.14 0.99 0.00 -0.30 0.00 0.00 42.92 43.00 1af9 s ASP 1309CO 0.32 0.00 1.60 -1.84 -0.17 0.00 0.00 175.17 175.08 1af9 n GLU 1310N 3.38 0.30 0.03 4.34 0.28 -1.26 -1.42 120.64 126.29 1af9 n GLU 1310Ca -0.18 0.10 0.12 0.00 -0.16 0.00 0.00 57.16 57.04 1af9 n GLU 1310Cb 0.56 -1.50 0.50 0.00 1.43 0.00 0.00 31.44 32.43 1af9 n GLU 1310CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1af9 n GLY 1311N 0.35 -1.40 2.75 -1.84 0.00 -1.26 -4.55 105.19 99.23 1af9 n GLY 1311Ca 0.09 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1af9 n GLY 1311CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1af9 s TRP 1312N -3.04 1.26 -0.05 1.61 -0.11 -0.51 -0.81 118.94 117.29 1af9 s TRP 1312Ca 0.11 -1.12 0.03 0.00 1.22 0.00 0.00 56.10 56.35 1af9 s TRP 1312Cb 0.15 -1.21 -0.03 0.00 -1.50 0.00 0.00 33.47 30.88 1af9 s TRP 1312CO 0.47 -0.69 -0.14 0.95 -4.62 0.00 0.00 176.95 172.93 1af9 s THR 1313N 1.78 3.12 0.01 5.86 -4.23 -1.26 -4.68 115.64 116.24 1af9 s THR 1313Ca 0.01 -0.70 -0.27 0.00 -1.18 0.00 0.00 61.69 59.55 1af9 s THR 1313Cb -0.17 -2.23 -0.04 0.00 1.34 0.00 0.00 72.50 71.40 1af9 s THR 1313CO -0.12 0.59 0.85 0.20 -0.54 0.00 0.00 174.62 175.60 1af9 s ASN 1314N -0.73 7.24 0.00 3.99 0.01 -1.26 -4.97 114.94 119.23 1af9 s ASN 1314Ca 0.11 1.50 0.30 0.00 -0.71 0.00 0.00 52.86 54.06 1af9 s ASN 1314Cb -0.11 -2.50 1.80 0.00 0.41 0.00 0.00 41.25 40.85 1af9 s ASN 1314CO 0.01 -0.12 2.13 0.47 -1.51 0.00 0.00 177.10 178.07