#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c16 s GLN 880 N 0.00 1.91 0.55 -1.40 -2.07 -1.09 -4.97 119.66 112.59 3c16 s GLN 880 Ca 0.00 -2.13 0.02 0.00 -1.82 0.00 0.00 55.36 51.43 3c16 s GLN 880 Cb 0.00 -1.18 0.04 0.00 -1.09 0.00 0.00 33.01 30.78 3c16 s GLN 880 CO 0.00 -0.25 0.77 -1.54 -1.32 0.00 0.00 175.29 172.96 3c16 s SER 881 N -3.66 5.23 0.25 12.60 1.04 -1.26 -1.87 113.70 126.03 3c16 s SER 881 Ca 0.27 -0.11 0.04 0.00 0.48 0.00 0.00 55.95 56.62 3c16 s SER 881 Cb 0.06 -0.74 -0.01 0.00 0.10 0.00 0.00 66.02 65.43 3c16 s SER 881 CO 0.13 -1.17 0.25 -1.22 0.98 0.00 0.00 173.24 172.21 3c16 n TYR 882 N -2.33 -0.74 0.00 5.02 4.02 -0.36 -4.89 117.16 117.88 3c16 n TYR 882 Ca 0.09 -1.96 0.00 0.00 -0.01 0.00 0.00 57.90 56.02 3c16 n TYR 882 Cb 0.60 0.26 0.00 0.00 -0.02 0.00 0.00 39.34 40.18 3c16 n TYR 882 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3c16 n ASP 883 N -1.97 0.83 -3.67 7.72 8.00 -1.26 -4.01 116.55 122.19 3c16 n ASP 883 Ca 0.04 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.26 3c16 n ASP 883 Cb 0.44 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.42 3c16 n ASP 883 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3c16 s VAL 885 N -0.34 3.53 -0.41 0.00 1.01 -0.88 -4.80 120.40 118.51 3c16 s VAL 885 Ca 0.25 -0.50 -0.16 0.00 0.00 0.00 0.00 61.98 61.57 3c16 s VAL 885 Cb -0.08 -2.50 0.02 0.00 0.00 0.00 0.00 36.38 33.82 3c16 s VAL 885 CO -0.12 0.53 0.34 0.00 0.00 0.00 0.00 175.10 175.85 3c16 s VAL 887 N 1.80 5.36 -0.11 0.00 1.01 0.34 -1.41 120.40 127.39 3c16 s VAL 887 Ca 0.07 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.25 3c16 s VAL 887 Cb -0.18 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.79 3c16 s VAL 887 CO 0.11 0.48 -0.21 -0.32 0.00 0.00 0.00 175.10 175.16 3c16 s MET 888 N 0.05 2.78 -0.16 2.72 1.75 -0.16 -0.89 119.30 125.39 3c16 s MET 888 Ca 0.09 -0.78 -0.04 0.00 -1.25 0.00 0.00 55.69 53.71 3c16 s MET 888 Cb -0.11 -2.18 -0.03 0.00 2.84 0.00 0.00 34.83 35.34 3c16 s MET 888 CO -0.00 0.07 -0.03 -0.06 -0.65 0.00 0.00 175.02 174.35 3c16 s PHE 889 N 0.60 3.04 -0.18 4.11 0.40 0.29 -1.78 117.98 124.46 3c16 s PHE 889 Ca -0.13 -0.27 -0.01 0.00 -0.60 0.00 0.00 56.93 55.91 3c16 s PHE 889 Cb -0.17 -1.96 0.05 0.00 0.51 0.00 0.00 43.02 41.45 3c16 s PHE 889 CO 0.04 -0.02 -0.01 0.00 0.70 0.00 0.00 175.22 175.93 3c16 s ALA 890 N 0.35 1.31 0.47 5.36 0.00 -0.28 -0.40 121.76 128.58 3c16 s ALA 890 Ca -0.04 -0.82 0.08 0.00 0.00 0.00 0.00 51.96 51.18 3c16 s ALA 890 Cb -0.14 -1.17 0.02 0.00 0.00 0.00 0.00 23.12 21.82 3c16 s ALA 890 CO 0.03 -1.00 0.48 -1.54 0.00 0.00 0.00 175.76 173.73 3c16 s SER 891 N 1.71 5.03 -0.41 0.00 1.04 -1.11 0.14 113.70 120.10 3c16 s SER 891 Ca -0.01 -0.84 0.02 0.00 0.48 0.00 0.00 55.95 55.60 3c16 s SER 891 Cb -0.16 -0.20 0.12 0.00 0.10 0.00 0.00 66.02 65.87 3c16 s SER 891 CO -0.07 -0.89 0.17 -0.63 0.98 0.00 0.00 173.24 172.79 3c16 s ILE 892 N -2.56 1.80 0.20 -1.02 1.01 -1.23 -2.69 121.20 116.71 3c16 s ILE 892 Ca 0.48 -2.45 -0.11 0.00 0.00 0.00 0.00 60.65 58.58 3c16 s ILE 892 Cb -0.04 -2.29 0.14 0.00 0.01 0.00 0.00 42.46 40.28 3c16 s ILE 892 CO 0.29 -0.75 1.86 -0.65 0.00 0.00 0.00 174.94 175.69 3c16 h PRO 893 N 7.18 0.96 0.00 2.79 0.11 -1.95 -2.68 132.00 138.41 3c16 h PRO 893 Ca -0.06 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3c16 h PRO 893 Cb 0.96 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.86 3c16 h PRO 893 CO 0.54 0.66 0.00 -0.44 -0.21 0.00 0.00 178.00 178.55 3c16 h ASP 894 N 0.98 0.00 -0.18 -2.05 3.32 -1.95 -3.16 116.42 113.38 3c16 h ASP 894 Ca 0.26 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.14 3c16 h ASP 894 Cb -0.08 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.48 3c16 h ASP 894 CO -0.05 0.00 -0.57 0.15 -1.72 0.00 0.00 179.24 177.04 3c16 h PHE 895 N 0.00 0.92 -0.92 4.55 3.57 -1.86 -3.13 116.94 120.06 3c16 h PHE 895 Ca 0.00 -0.37 0.09 0.00 3.53 0.00 0.00 57.97 61.22 3c16 h PHE 895 Cb 0.07 -0.15 -0.07 0.00 2.79 0.00 0.00 35.95 38.59 3c16 h PHE 895 CO 0.00 1.18 0.60 -0.22 -2.23 0.00 0.00 178.31 177.63 3c16 h LYS 896 N 0.40 0.92 0.22 1.11 3.64 -1.72 -0.45 116.57 120.69 3c16 h LYS 896 Ca -0.02 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 3c16 h LYS 896 Cb 1.20 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 3c16 h LYS 896 CO 0.12 0.61 -0.10 1.49 -2.27 0.00 0.00 179.45 179.30 3c16 h GLU 897 N 0.95 -0.28 -0.42 1.90 4.81 -1.76 -3.09 114.58 116.69 3c16 h GLU 897 Ca 0.43 0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.80 3c16 h GLU 897 Cb 0.37 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 3c16 h GLU 897 CO -0.19 -0.08 0.32 0.35 -0.73 0.00 0.00 179.01 178.68 3c16 h PHE 898 N -0.44 0.00 -2.70 0.92 3.57 -1.17 -3.41 116.94 113.71 3c16 h PHE 898 Ca -0.03 0.00 -0.52 0.00 3.53 0.00 0.00 57.97 60.95 3c16 h PHE 898 Cb 0.33 0.00 0.05 0.00 2.79 0.00 0.00 35.95 39.12 3c16 h PHE 898 CO -0.02 0.00 0.98 -0.47 -2.23 0.00 0.00 178.31 176.57 3c16 s TYR 899 N -4.97 2.89 0.21 0.41 5.04 -0.30 -5.01 117.35 115.62 3c16 s TYR 899 Ca -0.05 0.40 0.03 0.00 -2.44 0.00 0.00 57.07 55.01 3c16 s TYR 899 Cb 0.19 -4.08 -0.05 0.00 0.35 0.00 0.00 41.96 38.37 3c16 s TYR 899 CO 0.70 -4.08 -0.01 0.99 -1.34 0.00 0.00 175.55 171.81 3c16 s THR 900 N 1.31 0.92 -0.32 4.34 2.01 -1.26 -5.01 115.64 117.63 3c16 s THR 900 Ca 0.74 -2.02 -0.02 0.00 0.31 0.00 0.00 61.69 60.70 3c16 s THR 900 Cb -0.47 -2.25 0.12 0.00 0.01 0.00 0.00 72.50 69.90 3c16 s THR 900 CO 0.32 -0.39 0.16 -1.61 -0.69 0.00 0.00 174.62 172.41 3c16 s GLU 901 N -3.88 0.46 0.09 4.92 2.02 -1.26 -3.43 118.70 117.62 3c16 s GLU 901 Ca 0.26 -0.99 0.00 0.00 0.02 0.00 0.00 54.97 54.27 3c16 s GLU 901 Cb 0.06 -1.41 -0.04 0.00 0.10 0.00 0.00 34.13 32.84 3c16 s GLU 901 CO 0.07 -1.09 -0.03 -1.54 0.02 0.00 0.00 175.26 172.68 3c16 s SER 902 N 1.55 0.81 0.50 -0.19 1.04 -1.26 -4.85 113.70 111.30 3c16 s SER 902 Ca 0.13 -1.04 0.16 0.00 0.48 0.00 0.00 55.95 55.69 3c16 s SER 902 Cb -0.19 0.16 1.23 0.00 0.10 0.00 0.00 66.02 67.32 3c16 s SER 902 CO -0.19 -0.55 2.10 0.44 0.98 0.00 0.00 173.24 176.01 3c16 h ASP 903 N 3.01 0.08 -0.32 7.02 3.32 -1.98 0.25 116.42 127.80 3c16 h ASP 903 Ca -0.35 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.60 3c16 h ASP 903 Cb 1.16 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 3c16 h ASP 903 CO 0.65 0.05 -0.17 0.58 -1.72 0.00 0.00 179.24 178.63 3c16 h VAL 904 N 0.09 1.29 -0.45 -1.35 2.07 -2.03 -2.98 116.25 112.89 3c16 h VAL 904 Ca 0.08 -1.29 -0.16 0.00 0.82 0.00 0.00 66.70 66.15 3c16 h VAL 904 Cb 0.21 1.43 -0.10 0.00 -1.52 0.00 0.00 31.29 31.32 3c16 h VAL 904 CO -0.01 0.42 0.20 -0.46 0.02 0.00 0.00 177.57 177.74 3c16 n ASN 905 N -4.34 3.51 -4.11 0.57 0.23 -1.01 -4.89 115.26 105.23 3c16 n ASN 905 Ca -0.03 -2.72 -0.30 0.00 -0.53 0.00 0.00 54.58 51.00 3c16 n ASN 905 Cb 0.40 -0.65 -0.04 0.00 -2.08 0.00 0.00 39.78 37.41 3c16 n ASN 905 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3c16 n LYS 906 N -0.07 -2.84 -3.37 -3.83 5.02 -1.12 -2.23 118.16 109.72 3c16 n LYS 906 Ca 0.25 0.34 -0.18 0.00 -2.02 0.00 0.00 58.31 56.71 3c16 n LYS 906 Cb 0.99 -4.57 0.08 0.00 -0.02 0.00 0.00 35.03 31.50 3c16 n LYS 906 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3c16 n GLU 907 N -4.42 -6.45 -0.76 1.97 4.71 0.86 -2.93 120.64 113.62 3c16 n GLU 907 Ca -0.18 0.77 0.00 0.00 -0.01 0.00 0.00 57.16 57.74 3c16 n GLU 907 Cb 0.62 -5.58 0.00 0.00 -1.01 0.00 0.00 31.44 25.47 3c16 n GLU 907 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3c16 n GLY 908 N -1.36 0.60 0.13 0.62 0.00 -1.12 -4.79 105.19 99.27 3c16 n GLY 908 Ca -0.18 -0.16 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 3c16 n GLY 908 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3c16 h LEU 909 N 0.00 0.63 -1.12 0.99 5.85 -1.32 -2.97 115.31 117.36 3c16 h LEU 909 Ca 0.00 -0.93 -0.08 0.00 0.84 0.00 0.00 57.88 57.71 3c16 h LEU 909 Cb 0.00 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 3c16 h LEU 909 CO 0.00 1.52 -0.24 -0.33 -0.34 0.00 0.00 178.44 179.05 3c16 h GLU 910 N -0.15 0.32 0.51 1.25 4.39 -1.76 0.99 114.58 120.14 3c16 h GLU 910 Ca -0.18 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.38 3c16 h GLU 910 Cb 1.84 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 30.47 3c16 h GLU 910 CO 0.20 0.55 -0.25 0.00 -1.16 0.00 0.00 179.01 178.35 3c16 h LEU 912 N -0.80 0.00 0.03 0.00 3.38 -1.32 -2.19 115.31 114.40 3c16 h LEU 912 Ca -0.07 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.62 3c16 h LEU 912 Cb 0.58 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.35 3c16 h LEU 912 CO 0.12 0.00 -1.11 -0.09 0.09 0.00 0.00 178.44 177.44 3c16 h ARG 913 N 0.00 0.64 -0.36 1.13 2.43 -0.01 -2.52 114.38 115.69 3c16 h ARG 913 Ca 0.00 -0.75 -0.13 0.00 -0.81 0.00 0.00 59.98 58.29 3c16 h ARG 913 Cb 0.21 0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 3c16 h ARG 913 CO 0.00 1.32 -0.32 1.25 -1.51 0.00 0.00 179.97 180.71 3c16 h LEU 914 N 0.33 0.82 -0.65 3.80 5.85 -0.88 -2.62 115.31 121.96 3c16 h LEU 914 Ca -0.15 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.27 3c16 h LEU 914 Cb 1.77 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.53 3c16 h LEU 914 CO 0.21 1.07 0.38 0.25 -0.34 0.00 0.00 178.44 180.02 3c16 h LEU 915 N 0.66 0.61 0.04 2.25 5.85 -1.47 -0.76 115.31 122.49 3c16 h LEU 915 Ca 0.07 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.83 3c16 h LEU 915 Cb 0.86 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 3c16 h LEU 915 CO 0.08 0.41 -0.31 -1.13 -0.34 0.00 0.00 178.44 177.15 3c16 h ASN 916 N 0.74 -0.90 -0.91 1.25 -1.24 -1.31 -0.33 115.58 112.89 3c16 h ASN 916 Ca 0.27 0.11 0.18 0.00 0.71 0.00 0.00 56.30 57.57 3c16 h ASN 916 Cb 0.09 0.36 -0.10 0.00 0.73 0.00 0.00 38.32 39.39 3c16 h ASN 916 CO -0.13 -0.38 0.48 -0.33 -1.29 0.00 0.00 177.43 175.78 3c16 h GLU 917 N -0.48 0.59 0.38 6.67 4.39 -0.95 0.19 114.58 125.37 3c16 h GLU 917 Ca 0.05 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 3c16 h GLU 917 Cb 0.55 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 3c16 h GLU 917 CO -0.23 0.39 -0.18 0.82 -1.16 0.00 0.00 179.01 178.65 3c16 h ILE 918 N 0.61 0.55 -0.53 3.13 2.04 -0.61 -1.82 117.51 120.88 3c16 h ILE 918 Ca 0.52 -0.56 0.06 0.00 1.00 0.00 0.00 64.86 65.88 3c16 h ILE 918 Cb 0.83 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 37.64 3c16 h ILE 918 CO -0.41 0.09 0.23 0.40 0.00 0.00 0.00 178.15 178.46 3c16 h ILE 919 N -0.86 0.88 -0.35 -0.67 2.04 -0.64 -0.76 117.51 117.14 3c16 h ILE 919 Ca -0.05 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.69 3c16 h ILE 919 Cb 0.54 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3c16 h ILE 919 CO 0.09 0.08 0.24 0.00 0.00 0.00 0.00 178.15 178.55 3c16 h ALA 920 N 1.32 1.90 -0.24 1.87 0.00 -0.67 0.23 119.26 123.68 3c16 h ALA 920 Ca 0.25 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 3c16 h ALA 920 Cb 0.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3c16 h ALA 920 CO -0.21 0.05 -0.31 -0.44 0.00 0.00 0.00 179.25 178.34 3c16 h ASP 921 N 0.35 0.50 0.69 0.00 5.19 -0.28 -2.22 116.42 120.65 3c16 h ASP 921 Ca 0.15 -0.19 -0.13 0.00 -0.62 0.00 0.00 57.03 56.24 3c16 h ASP 921 Cb 0.15 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.51 3c16 h ASP 921 CO -0.03 0.79 -0.63 -0.26 -3.12 0.00 0.00 179.24 175.98 3c16 h PHE 922 N 0.42 0.00 0.00 4.55 -1.00 0.37 -2.90 116.94 118.37 3c16 h PHE 922 Ca 0.05 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.70 3c16 h PHE 922 Cb 0.75 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.30 3c16 h PHE 922 CO 0.03 0.63 -0.63 -0.44 -1.61 0.00 0.00 178.31 176.28 3c16 h ASP 923 N 0.00 0.00 0.00 2.17 3.32 -0.70 -3.09 116.42 118.12 3c16 h ASP 923 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3c16 h ASP 923 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3c16 h ASP 923 CO 0.08 0.63 0.00 0.47 -1.72 0.00 0.00 179.24 178.71 3c16 n ASP 924 N -3.47 0.00 -0.04 6.45 8.00 -0.85 -2.35 116.55 124.29 3c16 n ASP 924 Ca 0.00 -0.55 0.01 0.00 0.71 0.00 0.00 54.79 54.96 3c16 n ASP 924 Cb 0.71 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.66 3c16 n ASP 924 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3c16 n LEU 925 N -0.81 0.00 0.18 0.64 4.77 -1.17 -4.46 117.00 116.15 3c16 n LEU 925 Ca 0.06 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.08 3c16 n LEU 925 Cb 0.03 0.19 0.33 0.00 -2.33 0.00 0.00 43.42 41.64 3c16 n LEU 925 CO 0.04 0.19 0.67 -0.07 -1.33 0.00 0.00 177.39 176.89 3c16 h LEU 926 N 0.00 0.00 -0.74 2.23 3.38 -1.63 -2.68 115.31 115.87 3c16 h LEU 926 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3c16 h LEU 926 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 3c16 h LEU 926 CO 0.01 0.41 0.00 0.28 0.09 0.00 0.00 178.44 179.24 3c16 h SER 927 N 0.00 0.00 -3.90 -0.43 0.02 -1.78 -3.38 113.55 104.08 3c16 h SER 927 Ca -0.00 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.40 3c16 h SER 927 Cb 0.84 0.00 0.19 0.00 0.14 0.00 0.00 62.40 63.56 3c16 h SER 927 CO 0.05 0.00 0.09 0.29 -1.14 0.00 0.00 176.83 176.13 3c16 n LYS 928 N -2.94 0.21 -0.01 3.45 5.02 -1.01 -4.91 118.16 117.97 3c16 n LYS 928 Ca 0.02 0.14 -0.16 0.00 -2.02 0.00 0.00 58.31 56.29 3c16 n LYS 928 Cb 0.39 -2.25 -0.12 0.00 -0.02 0.00 0.00 35.03 33.02 3c16 n LYS 928 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3c16 h PRO 929 N -0.78 0.22 0.00 1.97 0.14 -1.88 -2.87 132.00 128.79 3c16 h PRO 929 Ca -0.46 -0.27 0.00 0.00 0.14 0.00 0.00 66.00 65.41 3c16 h PRO 929 Cb 1.31 0.08 0.00 0.00 0.14 0.00 0.00 31.00 32.53 3c16 h PRO 929 CO 0.44 1.02 0.00 0.36 0.14 0.00 0.00 178.00 179.97 3c16 n LYS 930 N -4.40 0.11 -0.25 0.86 2.85 -1.26 -1.61 118.16 114.46 3c16 n LYS 930 Ca -0.11 0.22 0.07 0.00 -1.05 0.00 0.00 58.31 57.44 3c16 n LYS 930 Cb 0.59 -1.50 0.17 0.00 -0.65 0.00 0.00 35.03 33.65 3c16 n LYS 930 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3c16 n PHE 931 N -1.36 0.53 0.26 5.58 3.72 -1.18 -4.64 117.46 120.36 3c16 n PHE 931 Ca 0.05 -0.73 0.13 0.00 -0.05 0.00 0.00 57.45 56.85 3c16 n PHE 931 Cb 0.11 -0.17 0.81 0.00 -0.94 0.00 0.00 39.48 39.29 3c16 n PHE 931 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3c16 h SER 932 N 1.36 0.00 1.50 4.37 4.64 -1.08 -1.02 113.55 123.33 3c16 h SER 932 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3c16 h SER 932 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 3c16 h SER 932 CO 0.09 0.00 0.00 1.23 -0.87 0.00 0.00 176.83 177.28 3c16 h GLY 933 N 0.00 0.00 -5.08 -0.77 0.00 -1.82 -3.44 103.07 91.96 3c16 h GLY 933 Ca 0.02 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.77 3c16 h GLY 933 CO -0.00 0.00 0.81 0.14 0.00 0.00 0.00 176.54 177.49 3c16 s VAL 934 N -3.21 4.63 -0.35 4.60 1.01 -0.39 -4.14 120.40 122.56 3c16 s VAL 934 Ca 0.08 1.97 -0.03 0.00 0.00 0.00 0.00 61.98 64.00 3c16 s VAL 934 Cb 0.10 -4.27 0.07 0.00 0.00 0.00 0.00 36.38 32.28 3c16 s VAL 934 CO 0.59 -0.17 0.10 -0.70 0.00 0.00 0.00 175.10 174.92 3c16 s GLU 935 N 3.20 2.26 0.14 2.72 2.56 -0.25 -4.95 118.70 124.37 3c16 s GLU 935 Ca 0.46 -1.49 -0.31 0.00 0.00 0.00 0.00 54.97 53.62 3c16 s GLU 935 Cb -0.16 -3.38 -0.10 0.00 2.00 0.00 0.00 34.13 32.49 3c16 s GLU 935 CO 0.08 -0.81 1.62 0.21 -0.56 0.00 0.00 175.26 175.80 3c16 s LYS 936 N 1.22 4.20 -0.16 4.30 2.20 -1.26 -2.17 119.74 128.07 3c16 s LYS 936 Ca 0.01 2.39 -0.12 0.00 -0.36 0.00 0.00 55.97 57.88 3c16 s LYS 936 Cb -0.21 -3.31 -0.08 0.00 -1.51 0.00 0.00 37.83 32.72 3c16 s LYS 936 CO -0.02 -0.67 -0.02 0.82 -0.36 0.00 0.00 175.35 175.10 3c16 h ILE 937 N 4.28 0.31 -2.47 5.43 1.08 -1.41 -3.48 117.51 121.26 3c16 h ILE 937 Ca -0.43 -1.37 0.18 0.00 -0.39 0.00 0.00 64.86 62.85 3c16 h ILE 937 Cb 1.20 0.73 -0.04 0.00 -3.07 0.00 0.00 36.82 35.64 3c16 h ILE 937 CO 0.92 0.11 0.61 -1.59 -0.69 0.00 0.00 178.15 177.51 3c16 s LYS 938 N -2.21 1.22 -0.15 2.37 -2.85 -1.11 -4.93 119.74 112.08 3c16 s LYS 938 Ca -0.17 -0.78 -0.03 0.00 -1.00 0.00 0.00 55.97 53.99 3c16 s LYS 938 Cb 0.03 0.35 0.05 0.00 -2.06 0.00 0.00 37.83 36.19 3c16 s LYS 938 CO 0.32 -0.57 0.03 0.95 0.10 0.00 0.00 175.35 176.18 3c16 s THR 939 N -2.25 0.41 -0.71 3.79 -4.23 -1.26 -1.84 115.64 109.55 3c16 s THR 939 Ca 0.21 -0.27 -0.22 0.00 -1.18 0.00 0.00 61.69 60.23 3c16 s THR 939 Cb -0.02 -0.80 0.08 0.00 1.34 0.00 0.00 72.50 73.09 3c16 s THR 939 CO 0.04 -0.05 1.01 -0.63 -0.54 0.00 0.00 174.62 174.46 3c16 s ILE 940 N 1.93 4.35 0.00 2.99 1.09 0.18 -4.85 121.20 126.89 3c16 s ILE 940 Ca 0.02 -0.53 0.00 0.00 -1.10 0.00 0.00 60.65 59.03 3c16 s ILE 940 Cb -0.15 -4.72 0.00 0.00 -1.06 0.00 0.00 42.46 36.53 3c16 s ILE 940 CO -0.07 -1.49 0.00 0.61 -0.10 0.00 0.00 174.94 173.89 3c16 n GLY 941 N 5.40 0.56 0.32 6.18 0.00 -1.26 0.89 105.19 117.28 3c16 n GLY 941 Ca 0.02 0.54 0.04 0.00 0.00 0.00 0.00 46.02 46.62 3c16 n GLY 941 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3c16 n SER 942 N 7.06 1.64 -4.62 1.61 3.41 -1.26 -4.96 113.62 116.49 3c16 n SER 942 Ca 0.00 -1.32 -0.43 0.00 -0.26 0.00 0.00 58.87 56.86 3c16 n SER 942 Cb 0.00 0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 63.96 3c16 n SER 942 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3c16 s THR 943 N -0.71 4.41 -0.18 6.66 2.01 0.26 -3.49 115.64 124.59 3c16 s THR 943 Ca 0.09 1.47 -0.19 0.00 0.31 0.00 0.00 61.69 63.37 3c16 s THR 943 Cb 0.07 -4.48 -0.03 0.00 0.01 0.00 0.00 72.50 68.07 3c16 s THR 943 CO 0.11 -0.69 0.54 -0.47 -0.69 0.00 0.00 174.62 173.42 3c16 s TYR 944 N 3.93 3.40 -0.17 4.92 5.04 0.37 0.50 117.35 135.34 3c16 s TYR 944 Ca 0.45 0.84 0.01 0.00 -2.44 0.00 0.00 57.07 55.94 3c16 s TYR 944 Cb -0.10 -2.69 0.02 0.00 0.35 0.00 0.00 41.96 39.54 3c16 s TYR 944 CO 0.22 -0.07 -0.18 1.41 -1.34 0.00 0.00 175.55 175.59 3c16 s MET 945 N 1.52 2.76 0.15 4.97 -2.45 -0.76 -1.13 119.30 124.35 3c16 s MET 945 Ca 0.26 -0.74 -0.03 0.00 -1.25 0.00 0.00 55.69 53.93 3c16 s MET 945 Cb -0.16 -2.40 -0.03 0.00 1.25 0.00 0.00 34.83 33.49 3c16 s MET 945 CO 0.10 -0.21 0.13 0.00 1.05 0.00 0.00 175.02 176.09 3c16 s ALA 946 N 1.33 0.71 -0.06 4.11 0.00 -0.73 -0.99 121.76 126.12 3c16 s ALA 946 Ca 0.04 -1.37 -0.12 0.00 0.00 0.00 0.00 51.96 50.50 3c16 s ALA 946 Cb -0.13 0.96 0.02 0.00 0.00 0.00 0.00 23.12 23.98 3c16 s ALA 946 CO -0.12 -0.55 0.30 0.00 0.00 0.00 0.00 175.76 175.39 3c16 s ALA 947 N -4.05 -0.75 -0.05 0.00 0.00 -0.92 -0.99 121.76 115.00 3c16 s ALA 947 Ca 0.25 0.55 0.05 0.00 0.00 0.00 0.00 51.96 52.81 3c16 s ALA 947 Cb 0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 3c16 s ALA 947 CO 0.03 -0.21 -0.21 0.95 0.00 0.00 0.00 175.76 176.32 3c16 s THR 948 N -0.65 1.76 0.00 0.00 -4.23 -0.50 -1.10 115.64 110.93 3c16 s THR 948 Ca -0.07 -0.90 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 3c16 s THR 948 Cb -0.04 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.30 3c16 s THR 948 CO 0.02 0.50 0.00 0.61 -0.54 0.00 0.00 174.62 175.21 3c16 n GLY 949 N 3.03 1.36 0.15 3.99 0.00 -1.26 -1.61 105.19 110.85 3c16 n GLY 949 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.98 3c16 n GLY 949 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3c16 n LEU 950 N 0.00 0.68 -0.09 0.99 4.77 -1.26 -4.79 117.00 117.30 3c16 n LEU 950 Ca 0.00 -0.08 -0.18 0.00 -0.03 0.00 0.00 56.01 55.72 3c16 n LEU 950 Cb 0.00 -0.18 -0.06 0.00 -2.33 0.00 0.00 43.42 40.85 3c16 n LEU 950 CO 0.00 0.13 -1.00 -1.20 -1.33 0.00 0.00 177.39 173.99 3c16 n SER 951 N -0.90 1.61 -0.09 -1.43 7.64 -1.26 -5.19 113.62 114.00 3c16 n SER 951 Ca 0.12 0.27 -0.17 0.00 1.01 0.00 0.00 58.87 60.10 3c16 n SER 951 Cb 0.31 -0.64 -0.11 0.00 -1.01 0.00 0.00 64.21 62.76 3c16 n SER 951 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 3c16 h GLN 965 N -0.78 0.00 0.00 1.43 4.15 -2.04 -3.55 115.11 114.32 3c16 h GLN 965 Ca -0.36 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.06 3c16 h GLN 965 Cb 1.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.93 3c16 h GLN 965 CO -0.22 0.94 0.00 0.66 -1.93 0.00 0.00 178.83 178.28 3c16 n TYR 966 N -4.52 0.00 0.31 3.99 4.01 -1.26 -4.71 117.16 114.98 3c16 n TYR 966 Ca -0.21 -0.31 0.19 0.00 -0.16 0.00 0.00 57.90 57.41 3c16 n TYR 966 Cb 0.57 -0.03 1.02 0.00 -0.31 0.00 0.00 39.34 40.59 3c16 n TYR 966 CO 0.00 0.00 0.00 1.98 -0.46 0.00 0.00 176.86 178.38 3c16 h MET 967 N 0.00 0.00 0.00 -0.72 1.85 -2.00 -1.95 114.93 112.10 3c16 h MET 967 Ca 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 59.70 59.03 3c16 h MET 967 Cb 0.58 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.60 3c16 h MET 967 CO 0.00 0.02 -0.26 1.12 -0.40 0.00 0.00 176.91 177.38 3c16 h HIS 968 N 0.00 0.00 -0.11 1.39 2.07 -1.94 -1.73 115.15 114.83 3c16 h HIS 968 Ca -0.00 0.00 -0.20 0.00 -2.85 0.00 0.00 60.37 57.32 3c16 h HIS 968 Cb 0.14 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.13 3c16 h HIS 968 CO 0.00 0.26 -0.72 0.82 -3.07 0.00 0.00 177.93 175.22 3c16 h ILE 969 N 0.00 1.31 -0.67 6.12 2.04 -1.68 -3.15 117.51 121.48 3c16 h ILE 969 Ca -0.00 -1.97 -0.07 0.00 1.00 0.00 0.00 64.86 63.82 3c16 h ILE 969 Cb 0.90 2.14 -0.03 0.00 -0.74 0.00 0.00 36.82 39.09 3c16 h ILE 969 CO 0.03 0.61 0.16 1.23 0.00 0.00 0.00 178.15 180.18 3c16 h GLY 970 N 0.36 1.15 0.66 5.37 0.00 -1.51 -3.09 103.07 106.01 3c16 h GLY 970 Ca -0.06 -0.71 0.02 0.00 0.00 0.00 0.00 47.33 46.58 3c16 h GLY 970 CO 0.15 0.66 -0.19 -0.84 0.00 0.00 0.00 176.54 176.32 3c16 h THR 971 N 1.01 0.57 -1.08 4.70 2.02 -1.38 -1.83 112.91 116.92 3c16 h THR 971 Ca 0.21 0.00 0.29 0.00 0.77 0.00 0.00 66.41 67.69 3c16 h THR 971 Cb 0.36 0.57 -0.10 0.00 -1.74 0.00 0.00 68.15 67.25 3c16 h THR 971 CO 0.00 0.00 0.69 -0.03 0.37 0.00 0.00 175.52 176.55 3c16 h MET 972 N -0.35 0.33 -0.06 6.66 -1.53 -1.49 0.18 114.93 118.67 3c16 h MET 972 Ca 0.03 -0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.24 3c16 h MET 972 Cb 0.38 -0.08 -0.00 0.00 -0.55 0.00 0.00 31.60 31.35 3c16 h MET 972 CO -0.11 0.22 -0.08 0.28 0.14 0.00 0.00 176.91 177.36 3c16 h VAL 973 N 0.34 1.38 -0.14 -5.77 2.07 -1.32 0.76 116.25 113.58 3c16 h VAL 973 Ca 0.64 -1.27 0.04 0.00 0.82 0.00 0.00 66.70 66.93 3c16 h VAL 973 Cb 1.68 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 33.53 3c16 h VAL 973 CO -0.33 0.35 0.11 -0.33 0.02 0.00 0.00 177.57 177.38 3c16 h GLU 974 N -0.29 0.00 -0.06 1.57 4.39 -0.12 0.30 114.58 120.37 3c16 h GLU 974 Ca 0.01 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 3c16 h GLU 974 Cb 0.60 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 3c16 h GLU 974 CO 0.02 0.00 -0.10 0.35 -1.16 0.00 0.00 179.01 178.12 3c16 h PHE 975 N 0.00 0.22 -0.53 4.33 3.57 -0.62 -2.00 116.94 121.90 3c16 h PHE 975 Ca 0.07 -0.08 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 3c16 h PHE 975 Cb 0.28 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 3c16 h PHE 975 CO 0.00 0.69 0.06 0.00 -2.23 0.00 0.00 178.31 176.82 3c16 h ALA 976 N 0.49 1.10 0.37 2.41 0.00 0.21 -1.66 119.26 122.19 3c16 h ALA 976 Ca 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 3c16 h ALA 976 Cb 0.67 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3c16 h ALA 976 CO 0.02 0.58 -0.46 1.88 0.00 0.00 0.00 179.25 181.27 3c16 h TYR 977 N 0.81 -1.28 -0.94 0.00 0.05 -0.50 -3.12 116.97 111.99 3c16 h TYR 977 Ca 0.16 0.02 0.28 0.00 0.05 0.00 0.00 58.73 59.24 3c16 h TYR 977 Cb 0.41 0.51 -0.16 0.00 1.01 0.00 0.00 36.73 38.50 3c16 h TYR 977 CO 0.02 -0.61 0.23 0.00 -1.05 0.00 0.00 178.16 176.76 3c16 h ALA 978 N -0.59 1.41 -0.31 3.88 0.00 -0.63 0.26 119.26 123.28 3c16 h ALA 978 Ca -0.03 0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.16 3c16 h ALA 978 Cb 0.79 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3c16 h ALA 978 CO -0.12 -0.58 0.21 -0.07 0.00 0.00 0.00 179.25 178.69 3c16 h LEU 979 N 0.12 0.32 -0.45 0.00 3.38 -1.27 -0.65 115.31 116.76 3c16 h LEU 979 Ca 0.62 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.54 3c16 h LEU 979 Cb 1.35 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 3c16 h LEU 979 CO -0.75 0.23 0.12 0.58 0.09 0.00 0.00 178.44 178.70 3c16 h VAL 980 N 0.38 1.23 -0.53 1.22 2.07 -0.49 0.63 116.25 120.77 3c16 h VAL 980 Ca 0.12 -0.79 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 3c16 h VAL 980 Cb 0.03 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 3c16 h VAL 980 CO -0.03 0.28 0.21 1.23 0.02 0.00 0.00 177.57 179.29 3c16 h GLY 981 N 0.59 0.82 1.25 2.17 0.00 -1.01 0.40 103.07 107.28 3c16 h GLY 981 Ca 0.14 -0.40 -0.22 0.00 0.00 0.00 0.00 47.33 46.85 3c16 h GLY 981 CO -0.00 0.38 -0.78 0.50 0.00 0.00 0.00 176.54 176.65 3c16 h LYS 982 N 0.75 0.73 -0.02 4.80 1.79 -0.74 -1.44 116.57 122.44 3c16 h LYS 982 Ca 0.18 -0.60 -0.19 0.00 -2.18 0.00 0.00 60.65 57.86 3c16 h LYS 982 Cb 0.15 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.92 3c16 h LYS 982 CO -0.02 1.21 -0.82 1.25 -1.08 0.00 0.00 179.45 179.99 3c16 h LEU 983 N 0.50 0.36 0.08 2.94 5.85 0.62 -2.96 115.31 122.69 3c16 h LEU 983 Ca -0.05 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 3c16 h LEU 983 Cb 1.40 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.32 3c16 h LEU 983 CO 0.16 1.03 -0.04 0.44 -0.34 0.00 0.00 178.44 179.69 3c16 h ASP 984 N 0.18 -0.09 -0.71 1.25 5.19 -0.27 -2.99 116.42 118.98 3c16 h ASP 984 Ca -0.04 -0.17 0.14 0.00 -0.62 0.00 0.00 57.03 56.34 3c16 h ASP 984 Cb 1.42 0.02 -0.14 0.00 0.18 0.00 0.00 39.33 40.82 3c16 h ASP 984 CO 0.13 0.11 -0.18 0.00 -3.12 0.00 0.00 179.24 176.19 3c16 h ALA 985 N 0.62 0.47 -0.26 3.45 0.00 -1.21 0.80 119.26 123.13 3c16 h ALA 985 Ca -0.01 0.28 0.06 0.00 0.00 0.00 0.00 54.91 55.24 3c16 h ALA 985 Cb 0.25 0.54 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 3c16 h ALA 985 CO 0.02 -0.41 -0.22 0.82 0.00 0.00 0.00 179.25 179.46 3c16 h ILE 986 N 0.00 0.43 -0.88 0.00 1.08 -1.53 -2.32 117.51 114.28 3c16 h ILE 986 Ca 0.34 0.00 0.22 0.00 -0.39 0.00 0.00 64.86 65.03 3c16 h ILE 986 Cb 0.52 0.43 -0.13 0.00 -3.07 0.00 0.00 36.82 34.58 3c16 h ILE 986 CO -0.74 0.00 0.35 0.78 -0.69 0.00 0.00 178.15 177.85 3c16 h ASN 987 N -0.21 0.24 0.09 1.72 4.21 -0.70 0.52 115.58 121.45 3c16 h ASN 987 Ca 0.14 0.16 0.02 0.00 1.21 0.00 0.00 56.30 57.84 3c16 h ASN 987 Cb 0.43 0.17 -0.04 0.00 -1.12 0.00 0.00 38.32 37.75 3c16 h ASN 987 CO -0.38 -0.04 -0.36 0.50 -1.29 0.00 0.00 177.43 175.86 3c16 h LYS 988 N 0.35 -0.55 0.00 0.81 1.63 -0.95 -2.35 116.57 115.51 3c16 h LYS 988 Ca 0.55 0.04 -0.20 0.00 -0.85 0.00 0.00 60.65 60.19 3c16 h LYS 988 Cb 1.06 0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 32.79 3c16 h LYS 988 CO -0.55 -0.36 -0.96 0.45 -3.45 0.00 0.00 179.45 174.57 3c16 h HIS 989 N -0.57 0.00 -0.52 1.91 3.86 -1.21 -3.34 115.15 115.29 3c16 h HIS 989 Ca 0.04 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3c16 h HIS 989 Cb 0.61 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.08 3c16 h HIS 989 CO -0.33 0.96 0.00 -1.13 0.86 0.00 0.00 177.93 178.29 3c16 n SER 990 N -3.38 3.36 -2.64 2.45 3.41 0.17 -4.94 113.62 112.05 3c16 n SER 990 Ca -0.00 -1.97 -0.14 0.00 -0.26 0.00 0.00 58.87 56.49 3c16 n SER 990 Cb 0.91 -0.34 -0.00 0.00 -0.26 0.00 0.00 64.21 64.51 3c16 n SER 990 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3c16 n PHE 991 N 1.37 -1.53 -4.42 7.33 3.72 -0.89 -4.94 117.46 118.09 3c16 n PHE 991 Ca 0.21 0.11 -0.30 0.00 -0.05 0.00 0.00 57.45 57.42 3c16 n PHE 991 Cb 0.56 -2.79 -0.06 0.00 -0.94 0.00 0.00 39.48 36.25 3c16 n PHE 991 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3c16 s ASN 992 N -2.19 4.30 -0.29 4.37 3.84 -1.21 -5.09 114.94 118.68 3c16 s ASN 992 Ca 0.09 -1.46 0.18 0.00 0.21 0.00 0.00 52.86 51.87 3c16 s ASN 992 Cb -0.05 0.36 0.48 0.00 -0.55 0.00 0.00 41.25 41.50 3c16 s ASN 992 CO 0.11 -0.89 1.09 -0.67 -2.79 0.00 0.00 177.10 173.94 3c16 n ASP 993 N -1.41 2.31 -4.76 -4.21 2.03 -1.26 -4.61 116.55 104.63 3c16 n ASP 993 Ca -0.12 -2.58 -0.41 0.00 0.52 0.00 0.00 54.79 52.20 3c16 n ASP 993 Cb 0.66 -0.47 -0.02 0.00 -0.72 0.00 0.00 41.12 40.57 3c16 n ASP 993 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 3c16 s PHE 994 N -3.59 3.04 -0.06 -0.67 0.08 -1.26 -5.02 117.98 110.48 3c16 s PHE 994 Ca 0.32 1.28 0.04 0.00 0.12 0.00 0.00 56.93 58.69 3c16 s PHE 994 Cb 0.37 -3.73 0.00 0.00 -0.57 0.00 0.00 43.02 39.09 3c16 s PHE 994 CO -0.02 -2.14 -0.19 0.15 -0.10 0.00 0.00 175.22 172.93 3c16 s LYS 995 N -1.26 2.15 0.25 0.44 -0.14 -1.26 -4.82 119.74 115.09 3c16 s LYS 995 Ca 0.53 -0.66 -0.11 0.00 -1.36 0.00 0.00 55.97 54.36 3c16 s LYS 995 Cb -0.40 -1.76 -0.08 0.00 -1.68 0.00 0.00 37.83 33.91 3c16 s LYS 995 CO 0.49 0.20 0.60 -1.17 -0.76 0.00 0.00 175.35 174.71 3c16 s LEU 996 N 0.23 4.15 -0.14 3.17 2.96 -1.26 -4.44 118.68 123.35 3c16 s LEU 996 Ca -0.10 1.03 -0.01 0.00 -0.22 0.00 0.00 54.13 54.83 3c16 s LEU 996 Cb -0.14 -3.76 0.04 0.00 0.50 0.00 0.00 46.19 42.82 3c16 s LEU 996 CO 0.04 -0.10 -0.03 -0.60 -1.32 0.00 0.00 176.35 174.35 3c16 s ARG 997 N -2.80 1.15 -0.16 1.98 3.52 -1.09 -1.20 118.95 120.34 3c16 s ARG 997 Ca 0.49 -0.33 -0.02 0.00 -0.13 0.00 0.00 55.73 55.73 3c16 s ARG 997 Cb -0.11 -1.75 -0.02 0.00 -1.56 0.00 0.00 34.95 31.51 3c16 s ARG 997 CO 0.20 -0.42 -0.09 0.08 -0.81 0.00 0.00 175.30 174.27 3c16 s VAL 998 N 1.75 3.35 -0.13 7.11 1.01 -1.10 -2.75 120.40 129.65 3c16 s VAL 998 Ca 0.02 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.48 3c16 s VAL 998 Cb -0.15 -2.45 0.01 0.00 0.00 0.00 0.00 36.38 33.79 3c16 s VAL 998 CO -0.07 0.50 -0.22 -0.83 0.00 0.00 0.00 175.10 174.48 3c16 s GLY 999 N 0.57 1.37 -0.10 4.51 0.00 0.47 -0.53 107.32 113.61 3c16 s GLY 999 Ca -0.06 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.61 3c16 s GLY 999 CO 0.03 -0.09 -0.09 -0.42 0.00 0.00 0.00 173.10 172.53 3c16 s ILE 1000N 0.70 1.07 0.43 0.90 1.01 -0.71 -0.55 121.20 124.04 3c16 s ILE 1000Ca -0.10 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.24 3c16 s ILE 1000Cb -0.16 -1.05 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 3c16 s ILE 1000CO 0.01 0.37 0.10 0.21 0.00 0.00 0.00 174.94 175.62 3c16 s ASN 1001N 1.40 3.06 -0.01 3.58 3.04 -0.07 -4.23 114.94 121.70 3c16 s ASN 1001Ca -0.01 -1.65 -0.24 0.00 0.04 0.00 0.00 52.86 51.00 3c16 s ASN 1001Cb -0.13 0.47 0.05 0.00 -1.54 0.00 0.00 41.25 40.10 3c16 s ASN 1001CO -0.05 -0.90 0.53 -1.38 -3.04 0.00 0.00 177.10 172.27 3c16 s HIS 1002N -3.14 -0.46 -5.00 0.43 -3.43 -1.26 -0.51 115.29 101.93 3c16 s HIS 1002Ca 0.21 0.69 0.00 0.00 -0.80 0.00 0.00 55.06 55.16 3c16 s HIS 1002Cb 0.03 0.31 0.00 0.00 -1.43 0.00 0.00 32.58 31.48 3c16 s HIS 1002CO 0.12 -0.56 0.00 0.41 -2.00 0.00 0.00 174.74 172.71 3c16 n GLY 1003N 0.84 -0.86 3.75 -1.38 0.00 -0.79 -4.95 105.19 101.80 3c16 n GLY 1003Ca -0.19 -1.32 -0.41 0.00 0.00 0.00 0.00 46.02 44.09 3c16 n GLY 1003CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3c16 s PRO 1004N -2.00 4.10 0.18 1.61 0.04 -0.82 -2.07 135.00 136.05 3c16 s PRO 1004Ca 0.00 2.61 0.01 0.00 0.04 0.00 0.00 61.00 63.66 3c16 s PRO 1004Cb 0.00 -3.01 -0.04 0.00 0.04 0.00 0.00 34.50 31.48 3c16 s PRO 1004CO 0.00 -0.65 0.04 0.14 0.04 0.00 0.00 177.00 176.57 3c16 s VAL 1005N -0.07 0.46 -0.16 -0.36 -7.23 -1.26 -4.21 120.40 107.57 3c16 s VAL 1005Ca 0.63 -1.97 0.01 0.00 -1.81 0.00 0.00 61.98 58.84 3c16 s VAL 1005Cb -0.48 -2.23 0.01 0.00 0.56 0.00 0.00 36.38 34.24 3c16 s VAL 1005CO 0.49 -0.35 -0.18 -0.63 -0.31 0.00 0.00 175.10 174.12 3c16 s ILE 1006N -3.81 2.35 -0.08 -0.62 1.01 -0.83 -1.23 121.20 117.99 3c16 s ILE 1006Ca 0.28 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 60.06 3c16 s ILE 1006Cb 0.07 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 3c16 s ILE 1006CO 0.06 0.53 -0.07 0.00 0.00 0.00 0.00 174.94 175.46 3c16 s ALA 1007N 0.97 2.98 0.00 9.38 0.00 -0.78 -0.54 121.76 133.76 3c16 s ALA 1007Ca -0.03 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.05 3c16 s ALA 1007Cb -0.15 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.70 3c16 s ALA 1007CO -0.04 0.52 0.00 0.41 0.00 0.00 0.00 175.76 176.65 3c16 n GLY 1008N 2.41 -0.94 3.72 0.00 0.00 -0.06 -2.68 105.19 107.65 3c16 n GLY 1008Ca -0.18 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.71 3c16 n GLY 1008CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c16 s VAL 1009N -3.00 4.50 -0.06 1.61 1.01 -1.26 -1.07 120.40 122.13 3c16 s VAL 1009Ca 0.00 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.72 3c16 s VAL 1009Cb 0.00 -2.95 0.01 0.00 0.00 0.00 0.00 36.38 33.44 3c16 s VAL 1009CO 0.00 0.52 -0.13 -0.51 0.00 0.00 0.00 175.10 174.98 3c16 s ILE 1010N -0.99 1.17 0.06 2.22 2.07 -1.25 -4.99 121.20 119.49 3c16 s ILE 1010Ca 0.16 -0.52 0.00 0.00 -1.41 0.00 0.00 60.65 58.88 3c16 s ILE 1010Cb -0.12 -1.05 0.00 0.00 0.13 0.00 0.00 42.46 41.42 3c16 s ILE 1010CO 0.06 0.36 0.00 0.61 -1.91 0.00 0.00 174.94 174.06 3c16 n GLY 1011N 3.65 -3.27 0.19 1.50 0.00 -1.26 -4.42 105.19 101.58 3c16 n GLY 1011Ca -0.22 -1.06 0.13 0.00 0.00 0.00 0.00 46.02 44.88 3c16 n GLY 1011CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c16 n ALA 1012N -0.83 2.98 -1.00 4.61 0.00 -1.26 -4.05 120.51 120.96 3c16 n ALA 1012Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3c16 n ALA 1012Cb 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3c16 n ALA 1012CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3c16 n GLN 1013N -0.79 0.00 -3.83 0.00 1.13 -1.26 -4.66 117.38 107.97 3c16 n GLN 1013Ca 0.13 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.84 3c16 n GLN 1013Cb 0.32 -0.74 -0.12 0.00 0.11 0.00 0.00 30.24 29.81 3c16 n GLN 1013CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 3c16 s LYS 1014N -0.53 1.90 -0.16 -1.09 -2.85 -1.26 -5.08 119.74 110.66 3c16 s LYS 1014Ca 0.00 -1.82 -0.29 0.00 -1.00 0.00 0.00 55.97 52.85 3c16 s LYS 1014Cb 0.00 -3.50 -0.07 0.00 -2.06 0.00 0.00 37.83 32.21 3c16 s LYS 1014CO 0.00 -1.04 2.15 -2.30 0.10 0.00 0.00 175.35 174.26 3c16 n PRO 1015N 4.52 2.11 -4.68 1.78 -0.02 -1.26 -4.91 135.00 132.54 3c16 n PRO 1015Ca -0.01 0.65 -0.23 0.00 -2.02 0.00 0.00 63.50 61.88 3c16 n PRO 1015Cb 0.42 -3.10 -0.15 0.00 -0.02 0.00 0.00 33.50 30.65 3c16 n PRO 1015CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3c16 s GLN 1016N 5.80 1.26 0.13 -0.52 -0.21 -1.26 -5.01 119.66 119.85 3c16 s GLN 1016Ca 0.99 -0.52 -0.31 0.00 0.02 0.00 0.00 55.36 55.54 3c16 s GLN 1016Cb -0.42 -1.19 -0.08 0.00 1.00 0.00 0.00 33.01 32.32 3c16 s GLN 1016CO 0.39 0.29 1.31 -0.47 -2.12 0.00 0.00 175.29 174.68 3c16 s TYR 1017N -0.23 3.31 -0.03 0.91 5.04 -1.26 -3.78 117.35 121.31 3c16 s TYR 1017Ca 0.03 1.15 -0.22 0.00 -2.44 0.00 0.00 57.07 55.59 3c16 s TYR 1017Cb -0.07 -3.58 0.04 0.00 0.35 0.00 0.00 41.96 38.71 3c16 s TYR 1017CO -0.00 -1.88 0.47 0.34 -1.34 0.00 0.00 175.55 173.14 3c16 s ASP 1018N 0.81 -0.40 -0.01 4.32 -1.08 -0.23 -4.90 116.67 115.19 3c16 s ASP 1018Ca 0.60 0.35 0.06 0.00 -0.52 0.00 0.00 52.55 53.04 3c16 s ASP 1018Cb -0.35 0.41 -0.03 0.00 -1.46 0.00 0.00 42.92 41.50 3c16 s ASP 1018CO 0.32 -0.53 -0.17 0.27 0.52 0.00 0.00 175.17 175.59 3c16 s ILE 1019N -1.32 2.84 0.20 4.11 -4.36 -1.26 -0.88 121.20 120.53 3c16 s ILE 1019Ca -0.12 -0.96 0.04 0.00 -0.26 0.00 0.00 60.65 59.34 3c16 s ILE 1019Cb -0.03 -2.14 -0.05 0.00 1.25 0.00 0.00 42.46 41.50 3c16 s ILE 1019CO 0.06 0.48 -0.04 0.26 0.24 0.00 0.00 174.94 175.95 3c16 s TRP 1020N -0.80 1.44 0.00 1.37 0.51 0.30 -4.96 118.94 116.80 3c16 s TRP 1020Ca 0.13 -0.87 0.00 0.00 -2.12 0.00 0.00 56.10 53.24 3c16 s TRP 1020Cb -0.10 -0.80 0.00 0.00 -0.81 0.00 0.00 33.47 31.75 3c16 s TRP 1020CO 0.02 -0.00 0.00 0.41 -0.51 0.00 0.00 176.95 176.87 3c16 n GLY 1021N -0.33 1.55 0.24 0.98 0.00 -1.26 -1.97 105.19 104.39 3c16 n GLY 1021Ca -0.07 -2.26 -0.10 0.00 0.00 0.00 0.00 46.02 43.59 3c16 n GLY 1021CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3c16 h ASN 1022N 0.00 -0.59 -0.97 1.61 -0.00 -2.00 -2.76 115.58 110.87 3c16 h ASN 1022Ca 0.00 0.10 0.20 0.00 -0.00 0.00 0.00 56.30 56.59 3c16 h ASN 1022Cb 0.00 0.26 -0.18 0.00 -0.00 0.00 0.00 38.32 38.40 3c16 h ASN 1022CO 0.00 -0.25 -0.23 0.74 -0.00 0.00 0.00 177.43 177.69 3c16 h THR 1023N -0.28 0.03 0.58 -3.57 2.02 -1.90 0.47 112.91 110.27 3c16 h THR 1023Ca 0.08 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 3c16 h THR 1023Cb 0.39 0.03 0.01 0.00 -1.74 0.00 0.00 68.15 66.84 3c16 h THR 1023CO -0.24 0.00 -0.28 0.58 0.37 0.00 0.00 175.52 175.95 3c16 h VAL 1024N 0.00 0.39 -1.11 3.16 2.07 -1.82 -2.07 116.25 116.87 3c16 h VAL 1024Ca 0.47 -0.16 0.33 0.00 0.82 0.00 0.00 66.70 68.16 3c16 h VAL 1024Cb 0.73 0.45 -0.12 0.00 -1.52 0.00 0.00 31.29 30.83 3c16 h VAL 1024CO -0.99 0.02 0.69 0.78 0.02 0.00 0.00 177.57 178.09 3c16 h ASN 1025N -0.89 0.42 -0.02 0.57 2.35 -0.68 0.23 115.58 117.56 3c16 h ASN 1025Ca -0.08 0.13 -0.17 0.00 -0.55 0.00 0.00 56.30 55.63 3c16 h ASN 1025Cb 0.64 0.08 0.01 0.00 0.05 0.00 0.00 38.32 39.10 3c16 h ASN 1025CO 0.13 -0.05 -0.67 0.58 -1.65 0.00 0.00 177.43 175.77 3c16 h VAL 1026N 0.29 1.39 -0.67 2.81 2.07 -1.18 -2.07 116.25 118.90 3c16 h VAL 1026Ca 0.70 -2.07 0.13 0.00 0.82 0.00 0.00 66.70 66.29 3c16 h VAL 1026Cb 1.85 2.49 -0.10 0.00 -1.52 0.00 0.00 31.29 34.01 3c16 h VAL 1026CO -0.42 0.61 0.14 0.00 0.02 0.00 0.00 177.57 177.92 3c16 h ALA 1027N 0.36 0.82 -0.24 1.67 0.00 0.12 0.90 119.26 122.90 3c16 h ALA 1027Ca -0.08 0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 3c16 h ALA 1027Cb 1.36 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 3c16 h ALA 1027CO 0.13 -0.32 -0.23 1.03 0.00 0.00 0.00 179.25 179.87 3c16 h SER 1028N 0.26 0.61 0.35 0.00 0.87 -1.13 -2.90 113.55 111.61 3c16 h SER 1028Ca 0.36 -0.47 -0.01 0.00 -1.23 0.00 0.00 61.79 60.44 3c16 h SER 1028Cb 0.58 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.36 3c16 h SER 1028CO -0.46 0.96 -0.06 0.03 -0.53 0.00 0.00 176.83 176.77 3c16 h ARG 1029N 0.27 0.00 0.00 2.24 2.47 -0.54 -1.72 114.38 117.10 3c16 h ARG 1029Ca 0.04 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.64 3c16 h ARG 1029Cb 0.78 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.08 3c16 h ARG 1029CO 0.06 0.06 -0.93 0.52 0.56 0.00 0.00 179.97 180.23 3c16 h MET 1030N 0.00 0.00 0.45 0.04 2.86 -0.78 -2.94 114.93 114.55 3c16 h MET 1030Ca -0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3c16 h MET 1030Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 3c16 h MET 1030CO 0.01 0.36 -0.21 0.22 1.06 0.00 0.00 176.91 178.34 3c16 h ASP 1031N 0.00 -0.51 -0.16 1.22 3.58 -1.13 -3.10 116.42 116.32 3c16 h ASP 1031Ca -0.07 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.26 3c16 h ASP 1031Cb 1.43 0.13 -0.01 0.00 1.72 0.00 0.00 39.33 42.60 3c16 h ASP 1031CO 0.05 -0.12 0.05 0.77 -2.88 0.00 0.00 179.24 177.10 3c16 h SER 1032N -0.97 0.30 -0.37 2.28 4.64 -1.50 0.12 113.55 118.05 3c16 h SER 1032Ca -0.06 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 3c16 h SER 1032Cb 0.57 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3c16 h SER 1032CO 0.10 0.32 0.00 0.35 -0.87 0.00 0.00 176.83 176.74 3c16 n THR 1033N -4.39 1.64 -2.54 2.95 -2.24 -1.11 -4.97 114.28 103.62 3c16 n THR 1033Ca 0.00 -0.85 -0.24 0.00 -2.27 0.00 0.00 64.05 60.69 3c16 n THR 1033Cb 0.16 -0.31 0.13 0.00 -2.10 0.00 0.00 70.33 68.21 3c16 n THR 1033CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3c16 s GLY 1034N -0.53 1.75 0.14 3.38 0.00 0.41 -5.02 107.32 107.46 3c16 s GLY 1034Ca 0.34 -1.80 0.09 0.00 0.00 0.00 0.00 44.72 43.36 3c16 s GLY 1034CO 0.11 -1.16 -0.18 0.14 0.00 0.00 0.00 173.10 172.01 3c16 s VAL 1035N -3.26 2.79 0.44 1.40 1.01 -1.26 -5.08 120.40 116.44 3c16 s VAL 1035Ca 0.69 -1.63 -0.25 0.00 0.00 0.00 0.00 61.98 60.79 3c16 s VAL 1035Cb -0.04 -2.31 -0.08 0.00 0.00 0.00 0.00 36.38 33.95 3c16 s VAL 1035CO 0.46 0.03 1.31 -0.76 0.00 0.00 0.00 175.10 176.14 3c16 s LEU 1036N -2.35 4.12 0.00 3.92 1.43 -1.26 -2.63 118.68 121.92 3c16 s LEU 1036Ca 0.19 2.66 0.00 0.00 -1.03 0.00 0.00 54.13 55.96 3c16 s LEU 1036Cb -0.10 -4.00 0.00 0.00 0.03 0.00 0.00 46.19 42.12 3c16 s LEU 1036CO 0.11 -1.01 0.00 0.47 0.23 0.00 0.00 176.35 176.15 3c16 n ASP 1037N -0.16 -3.13 -4.31 2.29 8.00 -0.34 -4.97 116.55 113.92 3c16 n ASP 1037Ca 0.05 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.26 3c16 n ASP 1037Cb 0.44 -2.08 -0.15 0.00 -0.02 0.00 0.00 41.12 39.31 3c16 n ASP 1037CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3c16 s LYS 1038N -1.03 1.79 -0.30 -1.24 -0.14 -1.08 -4.99 119.74 112.76 3c16 s LYS 1038Ca 0.00 -1.01 -0.12 0.00 -1.36 0.00 0.00 55.97 53.48 3c16 s LYS 1038Cb 0.00 -1.88 -0.04 0.00 -1.68 0.00 0.00 37.83 34.23 3c16 s LYS 1038CO 0.00 0.50 0.24 0.42 -0.76 0.00 0.00 175.35 175.75 3c16 s ILE 1039N -0.73 5.27 -0.15 2.17 1.01 -1.26 -2.71 121.20 124.81 3c16 s ILE 1039Ca 0.10 0.08 -0.14 0.00 0.00 0.00 0.00 60.65 60.70 3c16 s ILE 1039Cb -0.10 -3.63 -0.05 0.00 0.01 0.00 0.00 42.46 38.69 3c16 s ILE 1039CO 0.01 0.13 0.30 -1.58 0.00 0.00 0.00 174.94 173.80 3c16 s GLN 1040N 1.81 4.21 0.08 2.79 0.74 0.31 -2.41 119.66 127.18 3c16 s GLN 1040Ca 0.08 0.12 0.03 0.00 0.05 0.00 0.00 55.36 55.64 3c16 s GLN 1040Cb -0.16 -3.41 -0.03 0.00 1.10 0.00 0.00 33.01 30.51 3c16 s GLN 1040CO 0.11 0.28 -0.09 0.14 -0.55 0.00 0.00 175.29 175.17 3c16 s VAL 1041N 0.34 0.79 0.87 1.34 -7.23 0.74 -1.74 120.40 115.52 3c16 s VAL 1041Ca 0.17 -1.47 -0.12 0.00 -1.81 0.00 0.00 61.98 58.75 3c16 s VAL 1041Cb -0.13 -1.13 0.11 0.00 0.56 0.00 0.00 36.38 35.79 3c16 s VAL 1041CO 0.05 -0.51 1.14 0.42 -0.31 0.00 0.00 175.10 175.88 3c16 s THR 1042N -2.14 2.20 0.31 5.32 -4.23 -1.26 0.79 115.64 116.63 3c16 s THR 1042Ca 0.01 0.06 0.05 0.00 -1.18 0.00 0.00 61.69 60.63 3c16 s THR 1042Cb -0.05 -2.86 0.30 0.00 1.34 0.00 0.00 72.50 71.23 3c16 s THR 1042CO -0.00 -0.08 1.85 -0.08 -0.54 0.00 0.00 174.62 175.76 3c16 h GLU 1043N -1.34 0.83 0.25 3.99 4.81 -1.90 0.12 114.58 121.35 3c16 h GLU 1043Ca -0.49 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 3c16 h GLU 1043Cb 1.32 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.52 3c16 h GLU 1043CO 0.62 0.55 -0.12 0.93 -0.73 0.00 0.00 179.01 180.26 3c16 h GLU 1044N 0.86 -0.32 -0.57 1.92 3.07 -1.93 -2.78 114.58 114.83 3c16 h GLU 1044Ca 0.48 0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 59.33 3c16 h GLU 1044Cb 0.60 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.56 3c16 h GLU 1044CO -0.24 -0.07 0.23 1.15 -1.40 0.00 0.00 179.01 178.68 3c16 h THR 1045N -0.55 1.20 -0.41 1.13 2.02 -1.85 -2.27 112.91 112.19 3c16 h THR 1045Ca -0.03 -0.63 0.08 0.00 0.77 0.00 0.00 66.41 66.60 3c16 h THR 1045Cb 0.40 0.51 -0.09 0.00 -1.74 0.00 0.00 68.15 67.24 3c16 h THR 1045CO 0.06 0.25 -0.28 -1.28 0.37 0.00 0.00 175.52 174.64 3c16 h SER 1046N 0.82 -0.93 0.73 4.18 0.87 -0.66 -0.89 113.55 117.67 3c16 h SER 1046Ca 0.20 0.18 -0.04 0.00 -1.23 0.00 0.00 61.79 60.90 3c16 h SER 1046Cb 0.15 0.46 0.01 0.00 -0.44 0.00 0.00 62.40 62.57 3c16 h SER 1046CO -0.02 -0.29 -0.36 -0.07 -0.53 0.00 0.00 176.83 175.57 3c16 h LEU 1047N -0.21 -0.85 -0.63 2.23 3.38 -1.14 -2.25 115.31 115.85 3c16 h LEU 1047Ca 0.19 0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.32 3c16 h LEU 1047Cb 0.50 0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.38 3c16 h LEU 1047CO -0.52 -0.60 0.06 0.40 0.09 0.00 0.00 178.44 177.87 3c16 h ILE 1048N -0.99 0.54 0.00 1.22 2.04 -1.14 0.21 117.51 119.39 3c16 h ILE 1048Ca -0.10 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 3c16 h ILE 1048Cb 0.76 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.18 3c16 h ILE 1048CO 0.16 0.03 -0.16 -0.07 0.00 0.00 0.00 178.15 178.11 3c16 h LEU 1049N 0.18 0.00 -1.03 1.44 3.38 -1.11 -2.33 115.31 115.83 3c16 h LEU 1049Ca 0.33 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.21 3c16 h LEU 1049Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 3c16 h LEU 1049CO -0.49 0.16 -0.38 1.56 0.09 0.00 0.00 178.44 179.39 3c16 h GLN 1050N 0.00 0.20 -0.40 1.13 4.20 0.03 0.16 115.11 120.43 3c16 h GLN 1050Ca -0.00 -0.09 -0.12 0.00 0.06 0.00 0.00 58.65 58.50 3c16 h GLN 1050Cb 0.31 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 3c16 h GLN 1050CO 0.02 0.55 -0.25 1.79 -0.67 0.00 0.00 178.83 180.27 3c16 h THR 1051N 0.17 1.27 -0.03 -0.54 1.35 -0.93 -3.12 112.91 111.09 3c16 h THR 1051Ca 0.02 -1.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 3c16 h THR 1051Cb 0.75 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 3c16 h THR 1051CO 0.06 0.47 0.00 0.18 -0.25 0.00 0.00 175.52 175.97 3c16 n LEU 1052N -4.10 0.39 0.00 3.87 4.77 -0.99 -4.89 117.00 116.05 3c16 n LEU 1052Ca -0.00 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3c16 n LEU 1052Cb 0.46 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3c16 n LEU 1052CO 0.45 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3c16 n GLY 1053N 0.92 0.87 3.80 -0.72 0.00 -0.92 -5.07 105.19 104.07 3c16 n GLY 1053Ca 0.17 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 3c16 n GLY 1053CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3c16 s TYR 1054N -2.00 3.59 0.11 1.61 1.51 0.52 -5.00 117.35 117.68 3c16 s TYR 1054Ca 0.00 0.72 -0.08 0.00 -1.01 0.00 0.00 57.07 56.70 3c16 s TYR 1054Cb 0.00 -2.24 -0.06 0.00 -0.11 0.00 0.00 41.96 39.56 3c16 s TYR 1054CO 0.00 0.49 0.40 0.95 -1.11 0.00 0.00 175.55 176.28 3c16 s THR 1055N -0.41 5.11 0.02 -0.71 -4.23 -1.26 -3.35 115.64 110.81 3c16 s THR 1055Ca 0.19 0.31 0.07 0.00 -1.18 0.00 0.00 61.69 61.08 3c16 s THR 1055Cb -0.14 -3.63 -0.02 0.00 1.34 0.00 0.00 72.50 70.05 3c16 s THR 1055CO 0.07 0.18 -0.20 0.00 -0.54 0.00 0.00 174.62 174.14 3c16 s THR 1057N -0.67 2.21 0.07 0.00 2.01 -0.08 -4.90 115.64 114.28 3c16 s THR 1057Ca 0.07 -0.91 -0.31 0.00 0.31 0.00 0.00 61.69 60.85 3c16 s THR 1057Cb -0.08 -1.91 -0.09 0.00 0.01 0.00 0.00 72.50 70.43 3c16 s THR 1057CO 0.01 0.54 1.76 0.00 -0.69 0.00 0.00 174.62 176.23 3c16 h ARG 1059N 8.81 0.85 0.00 0.00 1.12 -0.57 -3.47 114.38 121.12 3c16 h ARG 1059Ca -0.44 -0.51 0.00 0.00 -1.11 0.00 0.00 59.98 57.91 3c16 h ARG 1059Cb 1.21 0.05 0.00 0.00 -0.01 0.00 0.00 29.97 31.22 3c16 h ARG 1059CO 0.94 1.15 0.00 0.41 -3.11 0.00 0.00 179.97 179.36 3c16 n GLY 1060N 0.31 0.40 3.25 2.80 0.00 -1.24 -5.00 105.19 105.70 3c16 n GLY 1060Ca -0.04 -1.27 -0.24 0.00 0.00 0.00 0.00 46.02 44.47 3c16 n GLY 1060CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3c16 s ILE 1061N -0.99 1.62 -0.02 -0.61 1.09 -1.26 -2.31 121.20 118.73 3c16 s ILE 1061Ca 0.00 -1.32 0.04 0.00 -1.10 0.00 0.00 60.65 58.27 3c16 s ILE 1061Cb 0.00 -1.45 -0.01 0.00 -1.06 0.00 0.00 42.46 39.95 3c16 s ILE 1061CO 0.00 0.07 -0.13 -0.63 -0.10 0.00 0.00 174.94 174.15 3c16 s ILE 1062N -0.96 1.05 -0.93 2.92 1.01 -0.03 -4.91 121.20 119.34 3c16 s ILE 1062Ca 0.06 -0.55 -0.19 0.00 0.00 0.00 0.00 60.65 59.97 3c16 s ILE 1062Cb -0.09 -0.88 0.12 0.00 0.01 0.00 0.00 42.46 41.62 3c16 s ILE 1062CO 0.03 0.30 1.16 0.21 0.00 0.00 0.00 174.94 176.63 3c16 s ASN 1063N -0.21 6.60 -0.08 3.58 3.84 -1.26 -1.29 114.94 126.13 3c16 s ASN 1063Ca 0.03 -1.96 -0.30 0.00 0.21 0.00 0.00 52.86 50.85 3c16 s ASN 1063Cb -0.06 -2.42 -0.03 0.00 -0.55 0.00 0.00 41.25 38.19 3c16 s ASN 1063CO -0.00 -1.12 1.19 -0.69 -2.79 0.00 0.00 177.10 173.69 3c16 s VAL 1064N 2.96 4.32 -0.62 -5.21 1.01 0.34 -4.92 120.40 118.27 3c16 s VAL 1064Ca 0.34 1.63 -0.26 0.00 0.00 0.00 0.00 61.98 63.69 3c16 s VAL 1064Cb -0.05 -4.05 -0.10 0.00 0.00 0.00 0.00 36.38 32.19 3c16 s VAL 1064CO -0.09 -0.02 2.42 -0.54 0.00 0.00 0.00 175.10 176.86 3c16 s LYS 1065N 2.40 1.85 0.00 2.72 1.02 -1.26 -0.91 119.74 125.56 3c16 s LYS 1065Ca 0.55 1.01 0.00 0.00 0.02 0.00 0.00 55.97 57.55 3c16 s LYS 1065Cb -0.23 -4.67 0.00 0.00 -0.52 0.00 0.00 37.83 32.40 3c16 s LYS 1065CO 0.20 -3.83 0.00 0.41 -0.92 0.00 0.00 175.35 171.21 3c16 n GLY 1066N 6.37 2.41 0.20 -3.33 0.00 -1.26 -4.88 105.19 104.70 3c16 n GLY 1066Ca 0.41 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.47 3c16 n GLY 1066CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3c16 n LYS 1067N -0.99 2.04 0.00 1.61 4.81 -0.59 -5.12 118.16 119.92 3c16 n LYS 1067Ca 0.00 -0.58 0.00 0.00 -0.87 0.00 0.00 58.31 56.86 3c16 n LYS 1067Cb 0.00 -1.03 0.00 0.00 0.02 0.00 0.00 35.03 34.02 3c16 n LYS 1067CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3c16 n GLY 1068N 0.78 -1.01 3.75 3.14 0.00 -0.09 -4.83 105.19 106.92 3c16 n GLY 1068Ca 0.03 -1.24 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 3c16 n GLY 1068CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3c16 s ASP 1069N -4.00 7.26 0.05 1.61 1.01 -1.25 -0.51 116.67 120.85 3c16 s ASP 1069Ca 0.00 2.18 -0.21 0.00 0.71 0.00 0.00 52.55 55.23 3c16 s ASP 1069Cb 0.00 -2.61 0.05 0.00 1.01 0.00 0.00 42.92 41.36 3c16 s ASP 1069CO 0.00 -0.19 0.50 -1.48 0.21 0.00 0.00 175.17 174.21 3c16 s LEU 1070N -0.87 0.02 0.16 1.23 0.05 -0.41 -4.92 118.68 113.95 3c16 s LEU 1070Ca 0.47 0.11 -0.26 0.00 0.05 0.00 0.00 54.13 54.50 3c16 s LEU 1070Cb -0.31 2.06 -0.08 0.00 -2.05 0.00 0.00 46.19 45.81 3c16 s LEU 1070CO 0.38 -0.73 0.81 -0.75 -0.55 0.00 0.00 176.35 175.51 3c16 s LYS 1071N -2.58 4.62 0.15 1.48 2.20 -1.26 -0.85 119.74 123.50 3c16 s LYS 1071Ca -0.05 1.22 0.03 0.00 -0.36 0.00 0.00 55.97 56.82 3c16 s LYS 1071Cb -0.01 -3.28 -0.05 0.00 -1.51 0.00 0.00 37.83 32.99 3c16 s LYS 1071CO -0.03 0.52 -0.06 0.95 -0.36 0.00 0.00 175.35 176.37 3c16 s THR 1072N -0.99 0.92 0.05 3.43 -4.23 -0.98 -2.92 115.64 110.92 3c16 s THR 1072Ca 0.37 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.86 3c16 s THR 1072Cb -0.23 -1.93 -0.03 0.00 1.34 0.00 0.00 72.50 71.64 3c16 s THR 1072CO 0.27 -0.66 -0.01 -0.31 -0.54 0.00 0.00 174.62 173.37 3c16 s TYR 1073N -3.49 0.45 -0.09 3.99 1.51 0.24 0.19 117.35 120.14 3c16 s TYR 1073Ca 0.19 -0.95 0.04 0.00 -1.01 0.00 0.00 57.07 55.33 3c16 s TYR 1073Cb 0.04 -0.33 -0.00 0.00 -0.11 0.00 0.00 41.96 41.56 3c16 s TYR 1073CO 0.01 -0.37 -0.23 -0.06 -1.11 0.00 0.00 175.55 173.79 3c16 s PHE 1074N -3.60 2.57 0.20 2.71 0.08 0.70 -0.18 117.98 120.45 3c16 s PHE 1074Ca 0.04 -0.93 -0.30 0.00 0.12 0.00 0.00 56.93 55.86 3c16 s PHE 1074Cb 0.05 -1.70 -0.08 0.00 -0.57 0.00 0.00 43.02 40.72 3c16 s PHE 1074CO -0.09 -0.35 1.03 0.08 -0.10 0.00 0.00 175.22 175.79 3c16 s VAL 1075N 0.23 3.96 -0.08 -0.44 1.01 -1.01 -0.90 120.40 123.17 3c16 s VAL 1075Ca -0.15 1.80 -0.29 0.00 0.00 0.00 0.00 61.98 63.34 3c16 s VAL 1075Cb -0.17 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 3c16 s VAL 1075CO 0.08 0.36 0.98 0.20 0.00 0.00 0.00 175.10 176.72 3c16 s ASN 1076N -0.52 7.26 0.00 3.32 0.01 -0.86 -4.59 114.94 119.56 3c16 s ASN 1076Ca 0.46 1.54 0.00 0.00 -0.71 0.00 0.00 52.86 54.15 3c16 s ASN 1076Cb -0.28 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 38.83 3c16 s ASN 1076CO 0.34 -0.38 0.21 0.41 -1.51 0.00 0.00 177.10 176.17