#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 1.19 3.54 0.00 0.00 -0.14 -1.25 -4.82 119.74 118.28 1nix s LYS 3 Ca 0.73 -0.31 0.00 0.00 -1.36 0.00 0.00 55.97 55.02 1nix s LYS 3 Cb -0.47 -3.08 0.00 0.00 -1.68 0.00 0.00 37.83 32.61 1nix s LYS 3 CO 0.32 0.53 0.00 0.41 -0.76 0.00 0.00 175.35 175.84 1nix n GLY 4 N 2.74 0.22 3.77 -3.33 0.00 -1.26 -3.27 105.19 104.06 1nix n GLY 4 Ca -0.18 -1.81 -0.38 0.00 0.00 0.00 0.00 46.02 43.64 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 0.46 3.78 -0.07 1.61 2.19 -1.26 -3.72 117.98 120.97 1nix s PHE 5 Ca 0.00 1.82 -0.00 0.00 0.33 0.00 0.00 56.93 59.08 1nix s PHE 5 Cb 0.00 -2.99 0.00 0.00 -1.31 0.00 0.00 43.02 38.72 1nix s PHE 5 CO 0.00 0.19 0.00 0.41 1.83 0.00 0.00 175.22 177.66 1nix n GLY 6 N 0.99 0.39 3.24 13.12 0.00 -1.26 -4.98 105.19 116.69 1nix n GLY 6 Ca 0.00 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 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 -4.14 3.17 -0.32 1.61 -0.14 -1.24 -4.96 119.74 113.73 1nix s LYS 7 Ca 0.00 -0.77 -0.39 0.00 -1.36 0.00 0.00 55.97 53.45 1nix s LYS 7 Cb -0.00 -2.60 -0.15 0.00 -1.68 0.00 0.00 37.83 33.39 1nix s LYS 7 CO 0.00 -0.01 1.88 0.45 -0.76 0.00 0.00 175.35 176.91 1nix n SER 8 N 4.13 2.20 -4.04 2.83 2.88 -1.26 -2.05 113.62 118.31 1nix n SER 8 Ca -0.19 0.90 -0.16 0.00 -1.33 0.00 0.00 58.87 58.08 1nix n SER 8 Cb 0.52 -1.14 -0.13 0.00 -0.75 0.00 0.00 64.21 62.70 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 -0.64 5.27 0.11 0.00 1.01 -1.26 -4.36 120.40 120.53 1nix s VAL 10 Ca -0.01 0.57 -0.31 0.00 0.00 0.00 0.00 61.98 62.22 1nix s VAL 10 Cb -0.06 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.59 1nix s VAL 10 CO 0.00 0.33 1.41 -2.16 0.00 0.00 0.00 175.10 174.68 1nix s PRO 11 N 0.87 4.31 0.00 2.72 0.04 -1.26 -2.86 135.00 138.82 1nix s PRO 11 Ca 0.16 2.10 0.00 0.00 0.04 0.00 0.00 61.00 63.30 1nix s PRO 11 Cb -0.14 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.15 1nix s PRO 11 CO 0.06 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.05 1nix n GLY 12 N 3.53 1.58 0.10 0.56 0.00 -1.26 -4.87 105.19 104.82 1nix n GLY 12 Ca 0.12 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.16 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 0.05 0.00 -5.65 1.61 1.57 -1.96 -3.49 116.57 108.70 1nix h LYS 13 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 1nix h LYS 13 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1nix h LYS 13 CO 0.00 0.25 -0.24 -1.71 -0.57 0.00 0.00 179.45 177.18 1nix n ASN 14 N -2.88 -7.21 -1.47 0.86 5.15 -1.25 -4.93 115.26 103.54 1nix n ASN 14 Ca -0.07 -0.23 -0.09 0.00 -0.60 0.00 0.00 54.58 53.59 1nix n ASN 14 Cb 0.78 -4.58 0.20 0.00 -0.53 0.00 0.00 39.78 35.66 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 -1.88 2.09 -3.51 1.20 -0.58 -1.26 -5.00 120.64 111.69 1nix n GLU 15 Ca -0.06 -3.12 -0.19 0.00 -0.42 0.00 0.00 57.16 53.37 1nix n GLU 15 Cb 0.54 -1.93 -0.01 0.00 -0.57 0.00 0.00 31.44 29.47 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 -3.82 3.53 0.00 0.00 7.64 -1.26 -1.40 113.62 118.31 1nix n SER 18 Ca 0.06 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.02 1nix n SER 18 Cb 0.58 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 1nix n SER 18 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nix n GLY 19 N 3.67 0.51 3.23 0.23 0.00 -1.26 -5.05 105.19 106.53 1nix n GLY 19 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.14 1.89 0.07 1.61 2.02 -0.49 -2.66 117.35 117.65 1nix s TYR 20 Ca 0.00 -0.36 0.06 0.00 -0.37 0.00 0.00 57.07 56.40 1nix s TYR 20 Cb 0.00 -1.20 -0.03 0.00 -0.40 0.00 0.00 41.96 40.33 1nix s TYR 20 CO 0.00 -0.01 -0.17 0.00 -1.57 0.00 0.00 175.55 173.80 1nix s ALA 21 N -0.56 1.48 0.48 3.71 0.00 0.20 -4.39 121.76 122.68 1nix s ALA 21 Ca 0.08 -1.07 -0.24 0.00 0.00 0.00 0.00 51.96 50.73 1nix s ALA 21 Cb -0.08 -0.19 -0.07 0.00 0.00 0.00 0.00 23.12 22.77 1nix s ALA 21 CO -0.00 0.27 1.37 0.00 0.00 0.00 0.00 175.76 177.40 1nix s ASN 23 N -0.76 3.26 -0.19 0.00 3.84 -0.89 -4.80 114.94 115.39 1nix s ASN 23 Ca 0.65 -0.88 -0.14 0.00 0.21 0.00 0.00 52.86 52.70 1nix s ASN 23 Cb -0.41 -0.23 -0.21 0.00 -0.55 0.00 0.00 41.25 39.85 1nix s ASN 23 CO 0.51 0.07 0.16 -1.20 -2.79 0.00 0.00 177.10 173.85 1nix n SER 24 N 0.17 1.97 -0.01 -4.21 7.64 -1.26 -1.91 113.62 116.01 1nix n SER 24 Ca -0.12 0.30 -0.04 0.00 1.01 0.00 0.00 58.87 60.02 1nix n SER 24 Cb 0.57 -0.87 0.18 0.00 -1.01 0.00 0.00 64.21 63.08 1nix n SER 24 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1nix h ARG 25 N -0.56 0.54 0.00 1.43 2.47 -1.98 -3.04 114.38 113.24 1nix h ARG 25 Ca -0.44 -0.20 -0.18 0.00 -1.26 0.00 0.00 59.98 57.90 1nix h ARG 25 Cb 1.64 -0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 29.89 1nix h ARG 25 CO -0.13 0.74 -1.40 -0.44 0.56 0.00 0.00 179.97 179.30 1nix h ASP 26 N 0.48 0.00 -0.51 7.04 3.32 -2.00 -3.48 116.42 121.28 1nix h ASP 26 Ca 0.07 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.90 1nix h ASP 26 Cb 0.66 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.12 1nix h ASP 26 CO 0.05 0.63 -0.20 1.17 -1.72 0.00 0.00 179.24 179.17 1nix n LYS 27 N -2.93 -1.27 -3.23 3.56 0.00 -0.81 -4.95 118.16 108.53 1nix n LYS 27 Ca -0.10 0.84 -0.11 0.00 0.00 0.00 0.00 58.31 58.94 1nix n LYS 27 Cb 0.86 -5.02 -0.04 0.00 0.00 0.00 0.00 35.03 30.84 1nix n LYS 27 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 1nix n TRP 28 N -2.43 -0.65 -2.14 5.64 2.14 -1.25 -2.34 117.44 116.41 1nix n TRP 28 Ca -0.11 -1.59 -0.42 0.00 2.07 0.00 0.00 57.50 57.45 1nix n TRP 28 Cb 0.48 0.22 -0.03 0.00 -0.81 0.00 0.00 31.31 31.18 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 5.55 2.28 0.73 0.00 2.20 -0.27 -3.99 119.74 126.24 1nix s LYS 30 Ca 0.71 -1.95 -0.11 0.00 -0.36 0.00 0.00 55.97 54.26 1nix s LYS 30 Cb -0.18 -2.17 0.03 0.00 -1.51 0.00 0.00 37.83 34.00 1nix s LYS 30 CO 0.32 -0.60 1.10 0.54 -0.36 0.00 0.00 175.35 176.35 1nix s VAL 31 N -2.74 3.31 0.06 4.02 0.11 -1.26 0.60 120.40 124.50 1nix s VAL 31 Ca 0.38 0.43 -0.28 0.00 -2.93 0.00 0.00 61.98 59.58 1nix s VAL 31 Cb -0.02 -3.39 -0.17 0.00 -1.53 0.00 0.00 36.38 31.27 1nix s VAL 31 CO 0.23 -0.56 1.59 -0.07 -3.33 0.00 0.00 175.10 172.96 1nix h LEU 32 N -0.75 -0.40 -0.33 2.54 -0.00 -1.84 -3.38 115.31 111.16 1nix h LEU 32 Ca -0.45 -0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 1nix h LEU 32 Cb 1.26 0.10 0.00 0.00 -0.00 0.00 0.00 40.66 42.02 1nix h LEU 32 CO 0.63 -0.22 0.00 0.18 -0.00 0.00 0.00 178.44 179.03