#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nix s LYS 3 N 1.04 1.53 0.90 0.00 3.01 -1.26 -4.73 119.74 120.23 1nix s LYS 3 Ca -0.09 -0.61 -0.13 0.00 -1.01 0.00 0.00 55.97 54.13 1nix s LYS 3 Cb -0.14 -1.41 0.14 0.00 -1.01 0.00 0.00 37.83 35.40 1nix s LYS 3 CO -0.01 0.32 1.17 0.20 0.51 0.00 0.00 175.35 177.54 1nix s GLY 4 N -0.22 1.60 0.26 -3.33 0.00 -1.26 -3.88 107.32 100.49 1nix s GLY 4 Ca 0.03 -0.65 -0.30 0.00 0.00 0.00 0.00 44.72 43.79 1nix s GLY 4 CO 0.00 -0.08 1.41 -0.12 0.00 0.00 0.00 173.10 174.32 1nix s PHE 5 N -3.42 3.03 0.00 1.90 5.36 -1.26 -2.71 117.98 120.88 1nix s PHE 5 Ca 0.65 1.10 0.00 0.00 -0.96 0.00 0.00 56.93 57.72 1nix s PHE 5 Cb -0.12 -3.79 0.00 0.00 -0.34 0.00 0.00 43.02 38.77 1nix s PHE 5 CO 0.52 -2.51 0.00 0.41 -1.46 0.00 0.00 175.22 172.19 1nix n GLY 6 N 1.97 0.50 3.63 13.12 0.00 -0.87 -4.94 105.19 118.60 1nix n GLY 6 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1nix n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nix s LYS 7 N -0.94 4.13 0.15 1.61 -0.14 -1.10 -4.74 119.74 118.72 1nix s LYS 7 Ca 0.00 0.53 -0.34 0.00 -1.36 0.00 0.00 55.97 54.80 1nix s LYS 7 Cb 0.00 -3.63 -0.15 0.00 -1.68 0.00 0.00 37.83 32.37 1nix s LYS 7 CO 0.00 -0.36 1.35 -1.13 -0.76 0.00 0.00 175.35 174.45 1nix n SER 8 N 5.52 2.02 -3.52 2.83 3.41 -1.26 -0.01 113.62 122.61 1nix n SER 8 Ca -0.01 1.12 -0.16 0.00 -0.26 0.00 0.00 58.87 59.56 1nix n SER 8 Cb 0.49 -1.28 -0.05 0.00 -0.26 0.00 0.00 64.21 63.11 1nix n SER 8 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nix s VAL 10 N -1.98 5.18 0.56 0.00 1.01 -1.26 -3.78 120.40 120.13 1nix s VAL 10 Ca -0.07 0.85 -0.18 0.00 0.00 0.00 0.00 61.98 62.58 1nix s VAL 10 Cb -0.01 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1nix s VAL 10 CO 0.03 0.28 1.09 -2.16 0.00 0.00 0.00 175.10 174.33 1nix s PRO 11 N 1.01 3.36 0.00 2.72 0.04 -1.26 -4.17 135.00 136.70 1nix s PRO 11 Ca 0.23 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.68 1nix s PRO 11 Cb -0.15 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1nix s PRO 11 CO 0.09 -0.81 0.00 0.41 0.04 0.00 0.00 177.00 176.73 1nix n GLY 12 N -0.33 3.10 0.06 0.56 0.00 -1.26 -4.80 105.19 102.53 1nix n GLY 12 Ca 0.10 -0.90 0.12 0.00 0.00 0.00 0.00 46.02 45.34 1nix n GLY 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nix h LYS 13 N 0.00 0.00 -5.59 1.61 6.56 -1.97 -3.49 116.57 113.68 1nix h LYS 13 Ca 0.00 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.49 1nix h LYS 13 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1nix h LYS 13 CO 0.00 0.00 -0.64 -1.71 -2.06 0.00 0.00 179.45 175.04 1nix n ASN 14 N -2.15 -7.36 -2.26 0.86 5.15 -1.26 -4.91 115.26 103.34 1nix n ASN 14 Ca 0.03 0.32 -0.32 0.00 -0.60 0.00 0.00 54.58 54.00 1nix n ASN 14 Cb 0.45 -4.51 0.07 0.00 -0.53 0.00 0.00 39.78 35.27 1nix n ASN 14 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1nix n GLU 15 N -0.42 2.83 -2.30 1.20 -0.58 -1.26 -4.96 120.64 115.14 1nix n GLU 15 Ca 0.06 -3.43 -0.07 0.00 -0.42 0.00 0.00 57.16 53.30 1nix n GLU 15 Cb 0.52 -2.28 -0.01 0.00 -0.57 0.00 0.00 31.44 29.10 1nix n GLU 15 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nix n SER 18 N -2.72 4.00 0.00 0.00 2.88 -1.26 -1.64 113.62 114.88 1nix n SER 18 Ca 0.12 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 1nix n SER 18 Cb 0.60 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 1nix n SER 18 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1nix n GLY 19 N 3.81 3.39 3.30 0.46 0.00 -1.26 -5.03 105.19 109.86 1nix n GLY 19 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1nix n GLY 19 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nix s TYR 20 N -2.78 2.39 0.01 1.61 2.02 -0.65 -0.75 117.35 119.20 1nix s TYR 20 Ca 0.00 -0.56 0.04 0.00 -0.37 0.00 0.00 57.07 56.17 1nix s TYR 20 Cb 0.00 -1.55 -0.01 0.00 -0.40 0.00 0.00 41.96 40.00 1nix s TYR 20 CO 0.00 -0.11 -0.11 0.00 -1.57 0.00 0.00 175.55 173.75 1nix s ALA 21 N -0.41 0.92 0.24 3.71 0.00 0.44 -4.10 121.76 122.56 1nix s ALA 21 Ca 0.04 -0.57 -0.30 0.00 0.00 0.00 0.00 51.96 51.13 1nix s ALA 21 Cb -0.12 -0.19 -0.09 0.00 0.00 0.00 0.00 23.12 22.72 1nix s ALA 21 CO 0.01 0.19 1.34 0.00 0.00 0.00 0.00 175.76 177.31 1nix s ASN 23 N 0.14 4.24 -0.21 0.00 0.01 0.19 -4.26 114.94 115.04 1nix s ASN 23 Ca 0.56 -1.26 0.06 0.00 -0.71 0.00 0.00 52.86 51.50 1nix s ASN 23 Cb -0.39 -0.24 -0.17 0.00 0.41 0.00 0.00 41.25 40.86 1nix s ASN 23 CO 0.43 -0.60 -0.13 -0.24 -1.51 0.00 0.00 177.10 175.05 1nix n SER 24 N -1.20 1.76 -0.02 -1.22 2.88 -1.26 -2.94 113.62 111.61 1nix n SER 24 Ca -0.05 -0.09 -0.10 0.00 -1.33 0.00 0.00 58.87 57.31 1nix n SER 24 Cb 0.66 0.01 -0.03 0.00 -0.75 0.00 0.00 64.21 64.09 1nix n SER 24 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1nix h ARG 25 N 0.00 -0.33 -0.00 -1.46 2.47 -1.97 -2.62 114.38 110.46 1nix h ARG 25 Ca -0.50 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.24 1nix h ARG 25 Cb 1.88 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 30.28 1nix h ARG 25 CO -0.05 -0.22 -0.78 -0.25 0.56 0.00 0.00 179.97 179.23 1nix n ASP 26 N -5.40 1.11 -3.64 7.04 9.92 -1.26 -4.98 116.55 119.34 1nix n ASP 26 Ca -0.02 -0.96 -0.25 0.00 -0.53 0.00 0.00 54.79 53.03 1nix n ASP 26 Cb 0.31 0.73 0.07 0.00 -0.64 0.00 0.00 41.12 41.60 1nix n ASP 26 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1nix n LYS 27 N -1.18 -7.69 -1.32 -1.24 5.02 -0.99 -4.96 118.16 105.80 1nix n LYS 27 Ca 0.06 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 1nix n LYS 27 Cb 0.36 -5.84 0.00 0.00 -0.02 0.00 0.00 35.03 29.53 1nix n LYS 27 CO 0.00 0.00 0.00 -2.67 -0.52 0.00 0.00 177.40 174.21 1nix n TRP 28 N -4.97 -0.35 -2.85 2.13 2.14 -1.22 -1.69 117.44 110.63 1nix n TRP 28 Ca 0.01 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.15 1nix n TRP 28 Cb 0.56 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 31.01 1nix n TRP 28 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1nix s LYS 30 N 3.64 2.46 0.41 0.00 2.20 0.08 -2.05 119.74 126.48 1nix s LYS 30 Ca 0.36 -0.83 -0.27 0.00 -0.36 0.00 0.00 55.97 54.87 1nix s LYS 30 Cb -0.11 -2.47 -0.10 0.00 -1.51 0.00 0.00 37.83 33.64 1nix s LYS 30 CO 0.25 0.56 1.45 1.55 -0.36 0.00 0.00 175.35 178.80 1nix n VAL 31 N 1.04 2.38 -3.79 4.02 3.14 -1.26 -0.42 118.33 123.43 1nix n VAL 31 Ca -0.13 -0.50 -0.29 0.00 -2.96 0.00 0.00 64.34 60.46 1nix n VAL 31 Cb 0.52 -1.89 -0.12 0.00 -1.06 0.00 0.00 33.84 31.29 1nix n VAL 31 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 1nix s LEU 32 N -2.29 3.77 0.00 6.55 2.96 0.07 -4.73 118.68 125.01 1nix s LEU 32 Ca 0.57 -3.31 0.00 0.00 -0.22 0.00 0.00 54.13 51.17 1nix s LEU 32 Cb -0.47 -1.33 0.00 0.00 0.50 0.00 0.00 46.19 44.89 1nix s LEU 32 CO 0.61 -0.16 0.49 0.18 -1.32 0.00 0.00 176.35 176.15