#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kka n GLY 912 N 0.00 0.57 3.60 0.27 0.00 -1.26 -5.01 105.19 103.36 3kka n GLY 912 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3kka n GLY 912 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kka s ILE 913 N -2.27 5.19 -2.00 -0.61 1.01 -1.26 -4.91 121.20 116.35 3kka s ILE 913 Ca 0.00 0.52 0.10 0.00 0.00 0.00 0.00 60.65 61.28 3kka s ILE 913 Cb 0.00 -3.68 0.30 0.00 0.01 0.00 0.00 42.46 39.08 3kka s ILE 913 CO 0.00 0.16 1.26 -0.81 0.00 0.00 0.00 174.94 175.56 3kka n PRO 914 N 5.31 0.83 -4.41 2.79 -0.04 -1.26 -4.75 135.00 133.46 3kka n PRO 914 Ca -0.09 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.16 3kka n PRO 914 Cb 0.51 -1.20 -0.13 0.00 -0.04 0.00 0.00 33.50 32.64 3kka n PRO 914 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3kka s TYR 915 N -2.00 1.32 -0.04 0.54 2.02 -1.26 -5.06 117.35 112.86 3kka s TYR 915 Ca 0.16 -0.35 -0.13 0.00 -0.37 0.00 0.00 57.07 56.38 3kka s TYR 915 Cb 0.07 -0.79 -0.31 0.00 -0.40 0.00 0.00 41.96 40.53 3kka s TYR 915 CO 0.12 0.04 0.71 0.00 -1.57 0.00 0.00 175.55 174.86 3kka h ARG 916 N 4.95 0.41 -5.69 -0.62 -0.00 -1.96 -3.48 114.38 107.99 3kka h ARG 916 Ca -0.39 -0.69 -0.47 0.00 -0.50 0.00 0.00 59.98 57.93 3kka h ARG 916 Cb 1.18 0.26 -0.18 0.00 0.00 0.00 0.00 29.97 31.22 3kka h ARG 916 CO 0.44 1.33 -0.77 0.95 0.00 0.00 0.00 179.97 181.92 3kka s THR 917 N -2.57 1.55 0.21 2.04 -4.23 -1.26 -4.70 115.64 106.69 3kka s THR 917 Ca -0.15 -1.78 -0.08 0.00 -1.18 0.00 0.00 61.69 58.50 3kka s THR 917 Cb 0.05 -1.65 0.15 0.00 1.34 0.00 0.00 72.50 72.39 3kka s THR 917 CO 0.86 -0.34 1.77 0.58 -0.54 0.00 0.00 174.62 176.95 3kka h VAL 918 N 3.47 0.84 -0.21 2.29 2.07 -1.91 -0.06 116.25 122.74 3kka h VAL 918 Ca -0.41 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 66.97 3kka h VAL 918 Cb 1.20 0.26 -0.07 0.00 -1.52 0.00 0.00 31.29 31.15 3kka h VAL 918 CO 0.50 0.10 -0.42 -1.28 0.02 0.00 0.00 177.57 176.48 3kka h SER 919 N 0.54 -1.35 -0.92 0.57 0.87 -1.96 0.33 113.55 111.63 3kka h SER 919 Ca 0.32 0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 61.06 3kka h SER 919 Cb 0.34 0.56 -0.04 0.00 -0.44 0.00 0.00 62.40 62.81 3kka h SER 919 CO -0.26 -0.41 0.53 -0.08 -0.53 0.00 0.00 176.83 176.08 3kka h GLU 920 N -0.44 1.27 0.20 2.24 4.81 -1.82 0.12 114.58 120.96 3kka h GLU 920 Ca 0.09 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 3kka h GLU 920 Cb 0.61 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.74 3kka h GLU 920 CO -0.45 0.91 -0.10 2.35 -0.73 0.00 0.00 179.01 180.99 3kka h TRP 921 N 1.28 -0.25 -0.75 0.92 7.01 -0.74 -1.52 115.95 121.91 3kka h TRP 921 Ca 0.33 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.30 3kka h TRP 921 Cb -0.01 0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.10 3kka h TRP 921 CO 0.01 -0.14 0.38 -0.07 -2.79 0.00 0.00 178.44 175.82 3kka h LEU 922 N -0.30 0.96 -0.31 0.65 3.38 0.14 -2.51 115.31 117.33 3kka h LEU 922 Ca -0.03 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 57.89 3kka h LEU 922 Cb 0.23 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.66 3kka h LEU 922 CO 0.05 0.81 -0.18 -0.33 0.09 0.00 0.00 178.44 178.88 3kka h GLU 923 N 1.04 -0.14 -0.96 1.13 5.08 -0.70 0.21 114.58 120.25 3kka h GLU 923 Ca 0.26 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.79 3kka h GLU 923 Cb 0.09 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.29 3kka h GLU 923 CO -0.04 -0.09 0.61 0.77 -1.00 0.00 0.00 179.01 179.26 3kka h SER 924 N -0.14 0.74 -0.72 1.42 0.02 -0.84 -0.86 113.55 113.17 3kka h SER 924 Ca 0.16 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3kka h SER 924 Cb 0.39 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.85 3kka h SER 924 CO -0.39 0.33 0.00 2.30 -1.14 0.00 0.00 176.83 177.93 3kka n ILE 925 N -4.64 1.17 -3.51 3.27 -5.35 -1.03 -4.96 119.36 104.31 3kka n ILE 925 Ca 0.20 -1.03 -0.20 0.00 -0.27 0.00 0.00 62.75 61.45 3kka n ILE 925 Cb 0.51 0.41 0.08 0.00 -1.74 0.00 0.00 39.64 38.90 3kka n ILE 925 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3kka n ARG 926 N 1.55 -7.10 -0.49 6.28 5.12 -0.33 -4.90 116.66 116.79 3kka n ARG 926 Ca 0.25 0.83 0.03 0.00 -1.93 0.00 0.00 57.85 57.03 3kka n ARG 926 Cb 0.68 -5.85 0.05 0.00 -1.16 0.00 0.00 32.46 26.18 3kka n ARG 926 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 3kka n MET 927 N -4.49 0.40 0.27 5.56 2.81 -0.04 -4.81 117.12 116.82 3kka n MET 927 Ca -0.17 -1.61 0.18 0.00 -1.81 0.00 0.00 57.70 54.29 3kka n MET 927 Cb 0.62 -0.76 0.85 0.00 -0.71 0.00 0.00 33.22 33.22 3kka n MET 927 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 3kka h LYS 928 N 0.14 0.00 -0.09 0.03 3.64 -1.86 -2.31 116.57 116.12 3kka h LYS 928 Ca -0.02 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 3kka h LYS 928 Cb 1.33 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.14 3kka h LYS 928 CO 0.01 0.00 0.69 0.07 -2.27 0.00 0.00 179.45 177.95 3kka h ARG 929 N 0.00 0.00 -0.46 1.90 0.11 -1.92 -1.28 114.38 112.73 3kka h ARG 929 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3kka h ARG 929 Cb 0.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.35 3kka h ARG 929 CO 0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 3kka n TYR 930 N -2.78 0.81 -0.23 4.08 0.53 -0.87 -4.63 117.16 114.07 3kka n TYR 930 Ca 0.01 -0.57 -0.02 0.00 -1.02 0.00 0.00 57.90 56.30 3kka n TYR 930 Cb 0.74 -0.10 0.10 0.00 -1.03 0.00 0.00 39.34 39.04 3kka n TYR 930 CO 0.00 0.00 0.00 0.97 -1.02 0.00 0.00 176.86 176.81 3kka h ILE 931 N 2.78 0.97 -0.38 -0.72 6.09 -1.42 -2.10 117.51 122.72 3kka h ILE 931 Ca 0.00 -0.24 -0.08 0.00 -1.37 0.00 0.00 64.86 63.17 3kka h ILE 931 Cb 1.01 0.22 -0.02 0.00 0.47 0.00 0.00 36.82 38.51 3kka h ILE 931 CO 0.07 0.13 -0.10 -0.07 -3.07 0.00 0.00 178.15 175.11 3kka h LEU 932 N 0.69 0.63 -0.80 2.19 4.07 -1.84 -2.03 115.31 118.22 3kka h LEU 932 Ca 0.30 -0.17 0.03 0.00 0.08 0.00 0.00 57.88 58.12 3kka h LEU 932 Cb 0.19 -0.17 -0.05 0.00 1.08 0.00 0.00 40.66 41.71 3kka h LEU 932 CO -0.18 0.77 0.51 0.45 -1.08 0.00 0.00 178.44 178.90 3kka h HIS 933 N 0.60 0.95 -0.33 1.13 3.86 -1.72 0.98 115.15 120.63 3kka h HIS 933 Ca 0.11 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.31 3kka h HIS 933 Cb 0.52 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 3kka h HIS 933 CO 0.02 0.54 0.07 0.74 0.86 0.00 0.00 177.93 180.17 3kka h PHE 934 N 0.99 0.57 -0.35 2.45 -1.00 -1.09 -2.29 116.94 116.22 3kka h PHE 934 Ca 0.32 -0.07 -0.01 0.00 2.81 0.00 0.00 57.97 61.02 3kka h PHE 934 Cb 0.02 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.41 3kka h PHE 934 CO -0.03 0.59 0.17 0.45 -1.61 0.00 0.00 178.31 177.89 3kka h HIS 935 N 0.38 0.50 -0.87 -0.55 3.86 -1.10 0.24 115.15 117.62 3kka h HIS 935 Ca 0.10 -0.02 0.18 0.00 -1.16 0.00 0.00 60.37 59.47 3kka h HIS 935 Cb 0.32 -0.16 -0.11 0.00 1.06 0.00 0.00 27.41 28.52 3kka h HIS 935 CO 0.02 0.42 0.42 0.77 0.86 0.00 0.00 177.93 180.42 3kka h SER 936 N 0.43 0.45 -0.10 2.45 0.02 -0.77 0.11 113.55 116.15 3kka h SER 936 Ca 0.12 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 3kka h SER 936 Cb 0.11 0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3kka h SER 936 CO -0.02 0.13 0.00 0.00 -1.14 0.00 0.00 176.83 175.80 3kka n ALA 937 N -2.45 2.54 -2.73 3.77 0.00 -0.87 -4.87 120.51 115.90 3kka n ALA 937 Ca 0.19 -0.26 -0.16 0.00 0.00 0.00 0.00 53.44 53.21 3kka n ALA 937 Cb 0.53 -1.12 0.02 0.00 0.00 0.00 0.00 19.45 18.87 3kka n ALA 937 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kka n GLY 938 N 0.84 -0.18 3.24 0.00 0.00 0.38 -4.96 105.19 104.52 3kka n GLY 938 Ca 0.11 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 3kka n GLY 938 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kka s LEU 939 N -4.80 6.17 -0.02 0.99 1.02 0.82 -4.87 118.68 118.00 3kka s LEU 939 Ca 0.19 -2.90 0.11 0.00 0.02 0.00 0.00 54.13 51.55 3kka s LEU 939 Cb -0.08 -2.08 -0.17 0.00 0.02 0.00 0.00 46.19 43.88 3kka s LEU 939 CO 0.23 -0.46 0.25 0.47 0.02 0.00 0.00 176.35 176.86 3kka n ASP 940 N 3.59 2.42 -4.42 2.29 10.43 -1.26 -4.08 116.55 125.50 3kka n ASP 940 Ca 0.13 -0.01 -0.25 0.00 2.57 0.00 0.00 54.79 57.24 3kka n ASP 940 Cb 0.43 1.51 -0.11 0.00 1.84 0.00 0.00 41.12 44.78 3kka n ASP 940 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 3kka s THR 941 N -2.77 2.30 0.38 -3.53 -4.23 -1.26 -4.59 115.64 101.94 3kka s THR 941 Ca -0.04 -2.15 0.10 0.00 -1.18 0.00 0.00 61.69 58.42 3kka s THR 941 Cb 0.07 -2.14 0.32 0.00 1.34 0.00 0.00 72.50 72.09 3kka s THR 941 CO 0.47 -0.26 1.91 0.24 -0.54 0.00 0.00 174.62 176.44 3kka h MET 942 N 2.87 0.61 -0.05 3.99 2.86 -1.92 -0.99 114.93 122.31 3kka h MET 942 Ca -0.43 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.17 3kka h MET 942 Cb 1.23 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.74 3kka h MET 942 CO 0.53 0.41 0.02 1.49 1.06 0.00 0.00 176.91 180.42 3kka h GLU 943 N 0.63 0.07 0.00 1.72 4.81 -1.96 -1.57 114.58 118.29 3kka h GLU 943 Ca 0.39 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.55 3kka h GLU 943 Cb 0.63 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 3kka h GLU 943 CO -0.15 0.06 -0.30 0.00 -0.73 0.00 0.00 179.01 177.88 3kka n VAL 945 N -3.50 0.00 0.25 0.00 0.24 -0.59 -4.35 118.33 110.38 3kka n VAL 945 Ca -0.00 -0.06 0.10 0.00 -2.04 0.00 0.00 64.34 62.33 3kka n VAL 945 Cb 0.46 0.10 0.66 0.00 -1.47 0.00 0.00 33.84 33.59 3kka n VAL 945 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3kka h LEU 946 N 0.61 0.00 -2.84 1.34 3.38 -1.67 -2.60 115.31 113.53 3kka h LEU 946 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3kka h LEU 946 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3kka h LEU 946 CO 0.00 0.11 0.00 -0.62 0.09 0.00 0.00 178.44 178.02 3kka n GLU 947 N -4.04 2.82 -1.63 1.13 1.02 -1.26 -5.00 120.64 113.67 3kka n GLU 947 Ca -0.02 -2.20 -0.45 0.00 -0.02 0.00 0.00 57.16 54.47 3kka n GLU 947 Cb 0.20 -1.35 -0.02 0.00 -0.02 0.00 0.00 31.44 30.25 3kka n GLU 947 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3kka n LEU 948 N 0.81 2.49 -4.82 -4.62 4.77 -0.98 -5.01 117.00 109.63 3kka n LEU 948 Ca 0.15 1.17 -0.26 0.00 -0.03 0.00 0.00 56.01 57.03 3kka n LEU 948 Cb 0.48 -1.36 -0.04 0.00 -2.33 0.00 0.00 43.42 40.17 3kka n LEU 948 CO 0.10 -0.94 -0.07 0.42 -1.33 0.00 0.00 177.39 175.57 3kka s THR 949 N -0.67 1.87 0.24 -5.08 -4.23 -1.26 -5.01 115.64 101.50 3kka s THR 949 Ca 0.63 -1.63 -0.05 0.00 -1.18 0.00 0.00 61.69 59.45 3kka s THR 949 Cb -0.68 -2.50 0.17 0.00 1.34 0.00 0.00 72.50 70.83 3kka s THR 949 CO 0.57 0.00 1.82 0.00 -0.54 0.00 0.00 174.62 176.47 3kka h ALA 950 N 1.10 1.14 -0.54 3.99 0.00 -1.96 -2.04 119.26 120.95 3kka h ALA 950 Ca -0.40 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.35 3kka h ALA 950 Cb 1.29 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 3kka h ALA 950 CO 0.64 0.62 0.33 1.05 0.00 0.00 0.00 179.25 181.90 3kka h GLU 951 N 1.07 0.64 -0.79 0.00 -0.00 -1.97 0.74 114.58 114.26 3kka h GLU 951 Ca 0.25 -0.04 -0.02 0.00 -0.00 0.00 0.00 59.36 59.55 3kka h GLU 951 Cb 0.19 -0.14 -0.04 0.00 -0.00 0.00 0.00 28.75 28.75 3kka h GLU 951 CO -0.02 0.42 0.41 -0.44 -0.00 0.00 0.00 179.01 179.39 3kka h ASP 952 N 0.66 1.00 -0.23 3.06 3.32 -1.89 -1.77 116.42 120.58 3kka h ASP 952 Ca 0.21 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 3kka h ASP 952 Cb 0.00 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 3kka h ASP 952 CO -0.09 0.82 0.05 -0.07 -1.72 0.00 0.00 179.24 178.24 3kka h LEU 953 N 1.12 0.35 -0.60 1.55 3.38 -0.79 -1.74 115.31 118.58 3kka h LEU 953 Ca 0.28 -0.24 0.12 0.00 0.09 0.00 0.00 57.88 58.13 3kka h LEU 953 Cb 0.06 -0.09 -0.12 0.00 0.09 0.00 0.00 40.66 40.60 3kka h LEU 953 CO -0.04 0.50 -0.22 0.74 0.09 0.00 0.00 178.44 179.50 3kka h THR 954 N 0.19 0.29 0.00 0.22 2.02 -0.49 0.91 112.91 116.06 3kka h THR 954 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 3kka h THR 954 Cb 0.29 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 3kka h THR 954 CO 0.00 0.00 0.00 1.56 0.37 0.00 0.00 175.52 177.45 3kka h GLN 955 N -0.07 0.00 0.00 6.66 1.08 -1.03 0.83 115.11 122.57 3kka h GLN 955 Ca 0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.48 3kka h GLN 955 Cb 0.50 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 3kka h GLN 955 CO -0.65 0.00 -0.02 -1.33 -0.95 0.00 0.00 178.83 175.88 3kka n MET 956 N -2.54 0.04 -1.05 1.46 2.81 -0.19 -4.90 117.12 112.75 3kka n MET 956 Ca 0.01 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 3kka n MET 956 Cb 0.24 -1.55 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 3kka n MET 956 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3kka n GLY 957 N 1.47 0.46 3.24 3.03 0.00 0.28 -4.91 105.19 108.77 3kka n GLY 957 Ca 0.07 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 3kka n GLY 957 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kka s ILE 958 N -2.00 4.76 -0.07 -0.61 1.01 0.14 -4.91 121.20 119.52 3kka s ILE 958 Ca 0.00 -2.36 0.09 0.00 0.00 0.00 0.00 60.65 58.38 3kka s ILE 958 Cb 0.00 -4.03 -0.13 0.00 0.01 0.00 0.00 42.46 38.32 3kka s ILE 958 CO 0.00 -0.92 0.09 0.35 0.00 0.00 0.00 174.94 174.47 3kka n THR 959 N 4.17 0.42 -1.81 2.92 -2.24 -1.26 -2.88 114.28 113.61 3kka n THR 959 Ca 0.05 -0.34 -0.42 0.00 -2.27 0.00 0.00 64.05 61.07 3kka n THR 959 Cb 0.42 -0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 68.21 3kka n THR 959 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3kka s LEU 960 N -4.35 4.39 0.18 3.22 1.43 -1.26 -4.90 118.68 117.38 3kka s LEU 960 Ca -0.04 2.62 -0.19 0.00 -1.03 0.00 0.00 54.13 55.49 3kka s LEU 960 Cb 0.04 -3.56 0.11 0.00 0.03 0.00 0.00 46.19 42.81 3kka s LEU 960 CO 0.39 -0.96 1.62 -0.65 0.23 0.00 0.00 176.35 176.98 3kka h PRO 961 N 8.71 -0.15 -0.97 1.29 0.11 -1.99 -0.92 132.00 138.08 3kka h PRO 961 Ca -0.45 0.01 0.20 0.00 0.11 0.00 0.00 66.00 65.88 3kka h PRO 961 Cb 1.21 0.03 -0.11 0.00 0.11 0.00 0.00 31.00 32.24 3kka h PRO 961 CO 0.94 -0.10 0.56 0.78 -0.21 0.00 0.00 178.00 179.97 3kka h GLY 962 N -0.15 1.75 1.39 -0.55 0.00 -1.99 0.11 103.07 103.63 3kka h GLY 962 Ca 0.21 -0.31 -0.28 0.00 0.00 0.00 0.00 47.33 46.95 3kka h GLY 962 CO -0.53 -0.14 -1.19 0.45 0.00 0.00 0.00 176.54 175.13 3kka h HIS 963 N 0.65 0.81 0.16 5.60 3.86 -1.66 -1.81 115.15 122.77 3kka h HIS 963 Ca 0.58 -0.52 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 3kka h HIS 963 Cb 0.98 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.38 3kka h HIS 963 CO -0.03 1.37 -0.15 1.96 0.86 0.00 0.00 177.93 181.93 3kka h GLN 964 N 0.22 -0.33 -0.31 2.45 4.20 -0.35 -2.09 115.11 118.91 3kka h GLN 964 Ca -0.16 0.02 0.07 0.00 0.06 0.00 0.00 58.65 58.64 3kka h GLN 964 Cb 1.87 0.07 -0.07 0.00 0.30 0.00 0.00 27.48 29.65 3kka h GLN 964 CO 0.22 -0.22 -0.16 -0.22 -0.67 0.00 0.00 178.83 177.78 3kka h LYS 965 N -0.34 -0.12 -0.55 1.46 3.64 -0.80 0.18 116.57 120.04 3kka h LYS 965 Ca 0.00 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.50 3kka h LYS 965 Cb 0.32 0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 32.07 3kka h LYS 965 CO -0.03 -0.08 0.02 -0.09 -2.27 0.00 0.00 179.45 177.00 3kka h ARG 966 N -0.12 0.14 -0.16 1.90 9.65 -1.24 0.11 114.38 124.66 3kka h ARG 966 Ca 0.16 -0.01 -0.10 0.00 -1.10 0.00 0.00 59.98 58.94 3kka h ARG 966 Cb 0.36 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.91 3kka h ARG 966 CO -0.39 0.09 -0.28 0.82 2.80 0.00 0.00 179.97 183.02 3kka h ILE 967 N 0.14 1.35 -0.16 1.20 2.04 -0.65 -2.92 117.51 118.52 3kka h ILE 967 Ca 0.28 -1.51 -0.05 0.00 1.00 0.00 0.00 64.86 64.58 3kka h ILE 967 Cb 0.44 1.94 -0.00 0.00 -0.74 0.00 0.00 36.82 38.45 3kka h ILE 967 CO -0.45 0.45 -0.10 -0.07 0.00 0.00 0.00 178.15 177.99 3kka h LEU 968 N 0.10 0.36 -1.11 1.44 3.38 -0.45 -2.11 115.31 116.92 3kka h LEU 968 Ca 0.01 -0.43 0.06 0.00 0.09 0.00 0.00 57.88 57.61 3kka h LEU 968 Cb 0.86 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.45 3kka h LEU 968 CO 0.06 0.71 0.60 0.00 0.09 0.00 0.00 178.44 179.91 3kka h SER 970 N 1.09 0.26 -0.11 0.00 0.87 -1.40 0.45 113.55 114.72 3kka h SER 970 Ca 0.39 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.91 3kka h SER 970 Cb 0.14 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3kka h SER 970 CO -0.14 0.23 0.05 0.40 -0.53 0.00 0.00 176.83 176.84 3kka h ILE 971 N 0.27 0.99 -0.09 2.23 2.04 -0.84 -1.87 117.51 120.24 3kka h ILE 971 Ca 0.08 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.93 3kka h ILE 971 Cb 0.01 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3kka h ILE 971 CO -0.02 0.02 0.11 1.56 0.00 0.00 0.00 178.15 179.82 3kka h GLN 972 N 0.11 0.00 -0.00 2.37 4.20 -0.82 -1.41 115.11 119.55 3kka h GLN 972 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3kka h GLN 972 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 3kka h GLN 972 CO -0.03 0.00 -0.09 0.41 -0.67 0.00 0.00 178.83 178.45 3kka n GLY 973 N -1.36 -1.29 0.00 3.46 0.00 0.12 -5.10 105.19 101.02 3kka n GLY 973 Ca -0.01 -0.18 0.02 0.00 0.00 0.00 0.00 46.02 45.85 3kka n GLY 973 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01