#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 -3.79 2.89 0.00 0.00 3.01 -1.26 -4.79 119.74 115.80 1nix s LYS 3 Ca 0.22 -0.52 0.00 0.00 -1.01 0.00 0.00 55.97 54.67 1nix s LYS 3 Cb 0.06 -2.74 0.00 0.00 -1.01 0.00 0.00 37.83 34.14 1nix s LYS 3 CO 0.11 0.66 0.00 0.41 0.51 0.00 0.00 175.35 177.04 1nix n GLY 4 N 1.65 -0.15 3.78 -3.33 0.00 -1.26 -2.09 105.19 103.79 1nix n GLY 4 Ca -0.16 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 43.70 1nix n GLY 4 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1nix s PHE 5 N -0.20 3.11 0.00 1.61 2.19 -1.26 -3.93 117.98 119.49 1nix s PHE 5 Ca 0.00 1.60 0.00 0.00 0.33 0.00 0.00 56.93 58.86 1nix s PHE 5 Cb 0.00 -3.18 0.00 0.00 -1.31 0.00 0.00 43.02 38.53 1nix s PHE 5 CO 0.00 -0.91 0.00 0.41 1.83 0.00 0.00 175.22 176.55 1nix n GLY 6 N 0.25 0.84 2.85 13.12 0.00 -0.96 -4.95 105.19 116.35 1nix n GLY 6 Ca 0.06 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.20 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 -4.73 1.20 -0.06 1.61 -0.14 -1.25 -4.86 119.74 111.51 1nix s LYS 7 Ca 0.00 -0.20 -0.36 0.00 -1.36 0.00 0.00 55.97 54.05 1nix s LYS 7 Cb 0.00 -1.50 -0.14 0.00 -1.68 0.00 0.00 37.83 34.51 1nix s LYS 7 CO 0.00 -0.32 1.71 0.45 -0.76 0.00 0.00 175.35 176.43 1nix n SER 8 N 5.00 2.88 -3.44 2.83 2.88 -1.26 -0.55 113.62 121.95 1nix n SER 8 Ca -0.11 1.04 -0.16 0.00 -1.33 0.00 0.00 58.87 58.32 1nix n SER 8 Cb 0.49 -1.30 -0.06 0.00 -0.75 0.00 0.00 64.21 62.59 1nix n SER 8 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nix s VAL 10 N -3.37 5.32 0.11 0.00 1.01 -1.26 -4.49 120.40 117.71 1nix s VAL 10 Ca 0.35 0.26 -0.31 0.00 0.00 0.00 0.00 61.98 62.28 1nix s VAL 10 Cb 0.01 -3.54 -0.07 0.00 0.00 0.00 0.00 36.38 32.78 1nix s VAL 10 CO 0.21 0.30 1.27 -2.16 0.00 0.00 0.00 175.10 174.71 1nix s PRO 11 N 1.34 4.40 0.00 2.72 0.04 -1.26 -3.18 135.00 139.06 1nix s PRO 11 Ca 0.09 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.03 1nix s PRO 11 Cb -0.14 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1nix s PRO 11 CO 0.07 -0.28 0.00 0.41 0.04 0.00 0.00 177.00 177.24 1nix n GLY 12 N 3.06 2.65 0.12 0.56 0.00 -1.26 -4.84 105.19 105.48 1nix n GLY 12 Ca 0.09 -0.75 0.12 0.00 0.00 0.00 0.00 46.02 45.47 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 -5.70 1.61 6.56 -1.97 -3.49 116.57 113.58 1nix h LYS 13 Ca 0.00 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.44 1nix h LYS 13 Cb 0.00 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 31.68 1nix h LYS 13 CO 0.00 0.00 -0.35 -1.71 -2.06 0.00 0.00 179.45 175.33 1nix n ASN 14 N -2.70 -6.97 -3.54 0.86 5.15 -1.24 -4.91 115.26 101.92 1nix n ASN 14 Ca 0.00 -0.37 -0.39 0.00 -0.60 0.00 0.00 54.58 53.23 1nix n ASN 14 Cb 0.54 -4.47 0.01 0.00 -0.53 0.00 0.00 39.78 35.34 1nix n ASN 14 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1nix n GLU 15 N -2.23 5.14 -2.84 1.20 0.28 -1.26 -4.97 120.64 115.96 1nix n GLU 15 Ca -0.07 -4.68 -0.08 0.00 -0.16 0.00 0.00 57.16 52.17 1nix n GLU 15 Cb 0.55 -2.44 -0.03 0.00 1.43 0.00 0.00 31.44 30.96 1nix n GLU 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1nix s SER 18 N -4.21 6.41 0.00 0.00 0.15 -1.26 -2.05 113.70 112.74 1nix s SER 18 Ca 0.60 2.81 0.00 0.00 0.70 0.00 0.00 55.95 60.06 1nix s SER 18 Cb -0.12 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 1nix s SER 18 CO 0.52 -0.98 0.00 0.61 1.20 0.00 0.00 173.24 174.60 1nix n GLY 19 N 4.07 2.53 3.54 9.45 0.00 -1.26 -5.04 105.19 118.48 1nix n GLY 19 Ca 0.17 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.70 3.17 0.54 1.61 2.02 -0.87 -1.78 117.35 120.33 1nix s TYR 20 Ca 0.00 -0.13 0.05 0.00 -0.37 0.00 0.00 57.07 56.62 1nix s TYR 20 Cb 0.00 -2.25 0.04 0.00 -0.40 0.00 0.00 41.96 39.35 1nix s TYR 20 CO 0.00 -0.17 0.39 0.00 -1.57 0.00 0.00 175.55 174.19 1nix s ALA 21 N 1.36 4.41 -0.21 3.71 0.00 0.44 -4.27 121.76 127.21 1nix s ALA 21 Ca 0.06 -1.23 -0.11 0.00 0.00 0.00 0.00 51.96 50.68 1nix s ALA 21 Cb -0.15 -0.70 -0.05 0.00 0.00 0.00 0.00 23.12 22.22 1nix s ALA 21 CO 0.05 -0.43 0.19 0.00 0.00 0.00 0.00 175.76 175.57 1nix s ASN 23 N 0.66 4.78 -0.07 0.00 4.22 -0.94 -4.64 114.94 118.96 1nix s ASN 23 Ca 0.10 -1.11 0.15 0.00 -2.14 0.00 0.00 52.86 49.86 1nix s ASN 23 Cb -0.12 0.36 -0.23 0.00 1.28 0.00 0.00 41.25 42.54 1nix s ASN 23 CO 0.02 -1.17 0.25 -1.54 -2.04 0.00 0.00 177.10 172.62 1nix n SER 24 N -1.91 1.34 -0.19 3.54 3.41 -1.26 -2.88 113.62 115.66 1nix n SER 24 Ca 0.04 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.61 1nix n SER 24 Cb 0.63 1.43 0.06 0.00 -0.26 0.00 0.00 64.21 66.08 1nix n SER 24 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1nix h ARG 25 N 0.00 0.58 -0.00 4.33 9.65 -1.97 -3.22 114.38 123.75 1nix h ARG 25 Ca -0.14 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.70 1nix h ARG 25 Cb 1.15 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.60 1nix h ARG 25 CO 0.01 0.38 -0.05 -0.25 2.80 0.00 0.00 179.97 182.86 1nix n ASP 26 N -4.83 0.70 -3.35 -3.80 9.92 -1.26 -5.01 116.55 108.93 1nix n ASP 26 Ca 0.06 -0.85 -0.24 0.00 -0.53 0.00 0.00 54.79 53.23 1nix n ASP 26 Cb 0.13 0.47 0.04 0.00 -0.64 0.00 0.00 41.12 41.13 1nix n ASP 26 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1nix n LYS 27 N -0.42 -5.76 -1.79 -1.24 4.81 -1.14 -4.96 118.16 107.66 1nix n LYS 27 Ca 0.01 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 1nix n LYS 27 Cb 0.05 -5.71 0.00 0.00 0.02 0.00 0.00 35.03 29.39 1nix n LYS 27 CO 0.00 0.00 0.00 -2.67 1.17 0.00 0.00 177.40 175.90 1nix n TRP 28 N -4.63 -0.01 -2.53 5.64 4.27 -1.25 -2.22 117.44 116.71 1nix n TRP 28 Ca -0.05 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.15 1nix n TRP 28 Cb 0.58 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.50 1nix n TRP 28 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1nix s LYS 30 N 0.70 0.48 0.58 0.00 -0.14 0.16 -2.25 119.74 119.27 1nix s LYS 30 Ca 0.55 -0.72 -0.19 0.00 -1.36 0.00 0.00 55.97 54.24 1nix s LYS 30 Cb -0.27 -0.20 -0.04 0.00 -1.68 0.00 0.00 37.83 35.64 1nix s LYS 30 CO 0.30 0.03 1.21 0.54 -0.76 0.00 0.00 175.35 176.66 1nix s VAL 31 N -1.39 2.67 0.61 3.17 0.11 -1.26 -0.42 120.40 123.88 1nix s VAL 31 Ca -0.11 0.43 0.05 0.00 -2.93 0.00 0.00 61.98 59.41 1nix s VAL 31 Cb -0.10 -3.18 0.09 0.00 -1.53 0.00 0.00 36.38 31.66 1nix s VAL 31 CO 0.00 -0.08 0.84 -0.76 -3.33 0.00 0.00 175.10 171.77 1nix s LEU 32 N -3.98 3.14 0.00 2.54 1.43 -0.74 -4.75 118.68 116.32 1nix s LEU 32 Ca 0.76 -0.54 0.23 0.00 -1.03 0.00 0.00 54.13 53.56 1nix s LEU 32 Cb -0.30 -2.00 0.19 0.00 0.03 0.00 0.00 46.19 44.11 1nix s LEU 32 CO 0.33 -1.45 1.24 0.00 0.23 0.00 0.00 176.35 176.70