#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 -3.56 4.25 0.00 0.00 -0.14 -1.23 -4.70 119.74 114.35 1nix s LYS 3 Ca 0.33 0.35 0.00 0.00 -1.36 0.00 0.00 55.97 55.29 1nix s LYS 3 Cb 0.02 -3.40 0.00 0.00 -1.68 0.00 0.00 37.83 32.78 1nix s LYS 3 CO 0.22 0.27 0.00 0.41 -0.76 0.00 0.00 175.35 175.49 1nix n GLY 4 N 3.05 1.44 3.23 -3.33 0.00 -1.26 -0.55 105.19 107.77 1nix n GLY 4 Ca -0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 -0.54 -0.27 1.61 5.36 -1.26 -4.67 117.98 118.20 1nix s PHE 5 Ca 0.00 1.17 -0.01 0.00 -0.96 0.00 0.00 56.93 57.13 1nix s PHE 5 Cb 0.00 0.22 0.00 0.00 -0.34 0.00 0.00 43.02 42.90 1nix s PHE 5 CO 0.00 -0.31 0.12 0.41 -1.46 0.00 0.00 175.22 173.97 1nix n GLY 6 N 4.16 0.48 3.08 13.12 0.00 -0.61 -4.93 105.19 120.49 1nix n GLY 6 Ca -0.23 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 44.90 1nix n GLY 6 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nix s LYS 7 N -4.76 2.20 0.02 1.61 2.36 -1.26 -4.84 119.74 115.07 1nix s LYS 7 Ca 0.06 -0.58 -0.36 0.00 -2.55 0.00 0.00 55.97 52.54 1nix s LYS 7 Cb -0.03 -1.78 -0.15 0.00 -1.05 0.00 0.00 37.83 34.82 1nix s LYS 7 CO 0.07 0.04 1.53 -1.13 1.55 0.00 0.00 175.35 177.41 1nix n SER 8 N 3.86 2.33 -3.30 1.43 3.41 -1.26 -0.40 113.62 119.69 1nix n SER 8 Ca -0.21 1.09 -0.15 0.00 -0.26 0.00 0.00 58.87 59.34 1nix n SER 8 Cb 0.52 -1.26 -0.05 0.00 -0.26 0.00 0.00 64.21 63.16 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 -3.16 3.01 0.18 0.00 1.01 -1.26 -4.53 120.40 115.65 1nix s VAL 10 Ca 0.32 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 1nix s VAL 10 Cb 0.00 -2.51 -0.08 0.00 0.00 0.00 0.00 36.38 33.79 1nix s VAL 10 CO 0.21 0.22 1.14 -2.16 0.00 0.00 0.00 175.10 174.51 1nix s PRO 11 N 1.36 4.55 0.00 2.72 0.04 -1.26 -4.20 135.00 138.20 1nix s PRO 11 Ca 0.01 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1nix s PRO 11 Cb -0.16 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1nix s PRO 11 CO -0.04 0.01 0.00 0.41 0.04 0.00 0.00 177.00 177.42 1nix n GLY 12 N 2.10 3.15 0.92 0.56 0.00 -1.26 -4.87 105.19 105.78 1nix n GLY 12 Ca 0.03 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.67 1nix n GLY 12 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nix n LYS 13 N 0.00 2.23 -3.12 1.61 5.02 -1.26 -4.99 118.16 117.65 1nix n LYS 13 Ca 0.00 -1.83 -0.02 0.00 -2.02 0.00 0.00 58.31 54.43 1nix n LYS 13 Cb 0.00 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 1nix n LYS 13 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1nix n ASN 14 N 1.11 -7.56 0.05 4.39 4.13 -1.26 -4.92 115.26 111.20 1nix n ASN 14 Ca 0.17 -0.16 0.12 0.00 1.68 0.00 0.00 54.58 56.39 1nix n ASN 14 Cb 0.53 -5.08 0.30 0.00 -1.54 0.00 0.00 39.78 33.99 1nix n ASN 14 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1nix n GLU 15 N -1.91 0.19 -0.85 3.52 4.71 -1.26 -4.90 120.64 120.14 1nix n GLU 15 Ca -0.02 0.09 -0.29 0.00 -0.01 0.00 0.00 57.16 56.93 1nix n GLU 15 Cb 0.52 -1.65 0.21 0.00 -1.01 0.00 0.00 31.44 29.50 1nix n GLU 15 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1nix s SER 18 N -3.31 6.44 0.00 0.00 1.04 -1.26 -1.99 113.70 114.62 1nix s SER 18 Ca 0.64 2.70 0.00 0.00 0.48 0.00 0.00 55.95 59.78 1nix s SER 18 Cb -0.19 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1nix s SER 18 CO 0.58 -1.03 0.00 0.61 0.98 0.00 0.00 173.24 174.37 1nix n GLY 19 N 4.41 3.08 3.91 7.32 0.00 -1.26 -5.06 105.19 117.58 1nix n GLY 19 Ca 0.19 -1.05 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.37 3.49 0.07 1.61 2.02 -0.84 -3.81 117.35 119.52 1nix s TYR 20 Ca 0.00 0.45 0.03 0.00 -0.37 0.00 0.00 57.07 57.18 1nix s TYR 20 Cb 0.00 -1.92 -0.03 0.00 -0.40 0.00 0.00 41.96 39.61 1nix s TYR 20 CO 0.00 0.49 -0.10 0.00 -1.57 0.00 0.00 175.55 174.37 1nix s ALA 21 N -1.60 0.94 0.27 3.71 0.00 0.11 -4.37 121.76 120.82 1nix s ALA 21 Ca 0.39 -1.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.03 1nix s ALA 21 Cb -0.12 0.02 -0.09 0.00 0.00 0.00 0.00 23.12 22.92 1nix s ALA 21 CO 0.26 -0.00 1.06 0.00 0.00 0.00 0.00 175.76 177.08 1nix s ASN 23 N -0.93 4.66 0.00 0.00 4.22 -1.03 -4.80 114.94 117.07 1nix s ASN 23 Ca 0.44 -1.24 0.12 0.00 -2.14 0.00 0.00 52.86 50.04 1nix s ASN 23 Cb -0.31 0.50 0.04 0.00 1.28 0.00 0.00 41.25 42.76 1nix s ASN 23 CO 0.39 -1.18 0.77 -1.20 -2.04 0.00 0.00 177.10 173.84 1nix n SER 24 N -1.85 1.60 -0.08 3.54 7.64 -1.26 -3.67 113.62 119.54 1nix n SER 24 Ca 0.00 -1.30 -0.13 0.00 1.01 0.00 0.00 58.87 58.45 1nix n SER 24 Cb 0.64 0.29 -0.08 0.00 -1.01 0.00 0.00 64.21 64.04 1nix n SER 24 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1nix h ARG 25 N 1.75 0.00 -0.02 1.43 2.43 -1.97 -3.39 114.38 114.61 1nix h ARG 25 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1nix h ARG 25 Cb 0.45 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1nix h ARG 25 CO 0.00 0.66 -0.05 -3.47 -1.51 0.00 0.00 179.97 175.60 1nix n ASP 26 N -4.58 2.33 -3.87 -3.80 -0.08 -1.26 -4.98 116.55 100.30 1nix n ASP 26 Ca -0.15 -1.67 -0.29 0.00 -1.51 0.00 0.00 54.79 51.17 1nix n ASP 26 Cb 0.43 0.07 0.03 0.00 2.34 0.00 0.00 41.12 43.99 1nix n ASP 26 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1nix n LYS 27 N 0.82 -5.62 -2.03 -0.67 5.02 -1.24 -4.95 118.16 109.49 1nix n LYS 27 Ca 0.10 0.61 -0.00 0.00 -2.02 0.00 0.00 58.31 57.00 1nix n LYS 27 Cb 0.42 -5.48 -0.00 0.00 -0.02 0.00 0.00 35.03 29.95 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 -4.66 -0.01 -2.67 2.13 4.27 -1.26 -2.21 117.44 113.04 1nix n TRP 28 Ca -0.00 -0.03 -0.42 0.00 -3.89 0.00 0.00 57.50 53.16 1nix n TRP 28 Cb 0.55 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.47 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 1.07 -0.02 0.51 0.00 2.20 0.16 -1.58 119.74 122.08 1nix s LYS 30 Ca 0.53 0.10 -0.22 0.00 -0.36 0.00 0.00 55.97 56.02 1nix s LYS 30 Cb -0.22 -0.12 -0.06 0.00 -1.51 0.00 0.00 37.83 35.92 1nix s LYS 30 CO 0.28 -0.08 1.25 0.54 -0.36 0.00 0.00 175.35 176.98 1nix s VAL 31 N 0.54 2.60 0.03 4.02 0.11 -1.26 -0.71 120.40 125.72 1nix s VAL 31 Ca -0.04 0.44 -0.25 0.00 -2.93 0.00 0.00 61.98 59.19 1nix s VAL 31 Cb -0.06 -3.22 -0.17 0.00 -1.53 0.00 0.00 36.38 31.40 1nix s VAL 31 CO -0.02 -0.02 1.43 0.25 -3.33 0.00 0.00 175.10 173.42 1nix h LEU 32 N 1.65 -0.16 -0.99 2.54 5.85 -1.91 -3.45 115.31 118.84 1nix h LEU 32 Ca -0.50 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.02 1nix h LEU 32 Cb 1.28 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1nix h LEU 32 CO 0.58 0.12 0.00 0.00 -0.34 0.00 0.00 178.44 178.80