#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 1.57 3.08 0.66 0.00 3.01 -1.26 -4.81 119.74 121.98 1nix s LYS 3 Ca -0.09 -0.93 -0.02 0.00 -1.01 0.00 0.00 55.97 53.93 1nix s LYS 3 Cb -0.09 -2.68 0.07 0.00 -1.01 0.00 0.00 37.83 34.13 1nix s LYS 3 CO -0.13 0.43 0.92 0.20 0.51 0.00 0.00 175.35 177.28 1nix s GLY 4 N -3.73 1.77 0.19 -3.33 0.00 -1.26 -3.94 107.32 97.03 1nix s GLY 4 Ca 0.33 -1.34 -0.30 0.00 0.00 0.00 0.00 44.72 43.41 1nix s GLY 4 CO 0.26 -0.92 0.98 -0.12 0.00 0.00 0.00 173.10 173.30 1nix s PHE 5 N -3.04 3.84 0.00 1.90 5.36 -1.26 -3.37 117.98 121.40 1nix s PHE 5 Ca 0.61 1.82 0.00 0.00 -0.96 0.00 0.00 56.93 58.40 1nix s PHE 5 Cb -0.09 -3.07 0.00 0.00 -0.34 0.00 0.00 43.02 39.52 1nix s PHE 5 CO 0.42 0.13 0.00 0.41 -1.46 0.00 0.00 175.22 174.72 1nix n GLY 6 N 1.78 0.44 3.61 13.12 0.00 -0.86 -4.93 105.19 118.35 1nix n GLY 6 Ca 0.00 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.57 3.64 0.04 1.61 2.36 -1.22 -4.78 119.74 119.83 1nix s LYS 7 Ca 0.00 -0.41 -0.33 0.00 -2.55 0.00 0.00 55.97 52.68 1nix s LYS 7 Cb 0.00 -3.02 -0.12 0.00 -1.05 0.00 0.00 37.83 33.64 1nix s LYS 7 CO 0.00 0.38 1.76 -1.13 1.55 0.00 0.00 175.35 177.91 1nix n SER 8 N 3.17 3.43 -3.62 1.43 3.41 -1.26 -0.93 113.62 119.24 1nix n SER 8 Ca -0.17 1.01 -0.22 0.00 -0.26 0.00 0.00 58.87 59.23 1nix n SER 8 Cb 0.53 -1.42 -0.08 0.00 -0.26 0.00 0.00 64.21 62.97 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 -3.35 4.36 0.48 0.00 1.01 -1.26 -4.60 120.40 117.04 1nix s VAL 10 Ca 0.34 -0.68 -0.21 0.00 0.00 0.00 0.00 61.98 61.42 1nix s VAL 10 Cb 0.02 -3.32 -0.08 0.00 0.00 0.00 0.00 36.38 33.01 1nix s VAL 10 CO 0.23 -0.04 1.09 -2.16 0.00 0.00 0.00 175.10 174.22 1nix s PRO 11 N 1.55 3.74 0.00 2.72 0.04 -1.26 -3.93 135.00 137.86 1nix s PRO 11 Ca 0.03 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.61 1nix s PRO 11 Cb -0.18 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.14 1nix s PRO 11 CO 0.05 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.98 1nix n GLY 12 N 0.12 3.13 0.09 0.56 0.00 -1.26 -4.78 105.19 103.05 1nix n GLY 12 Ca 0.09 -0.88 0.12 0.00 0.00 0.00 0.00 46.02 45.35 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 -5.56 1.61 1.57 -2.02 -3.49 116.57 108.68 1nix h LYS 13 Ca 0.00 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 1nix h LYS 13 Cb 0.00 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.40 1nix h LYS 13 CO 0.00 0.00 -0.52 -1.71 -0.57 0.00 0.00 179.45 176.65 1nix n ASN 14 N -2.41 -6.92 -0.74 0.86 2.85 -1.25 -4.91 115.26 102.75 1nix n ASN 14 Ca 0.02 -0.49 0.08 0.00 -0.11 0.00 0.00 54.58 54.08 1nix n ASN 14 Cb 0.50 -4.89 0.25 0.00 1.24 0.00 0.00 39.78 36.87 1nix n ASN 14 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1nix n GLU 15 N -2.69 1.94 -1.78 1.20 -0.58 -1.26 -4.93 120.64 112.54 1nix n GLU 15 Ca -0.06 -1.44 -0.30 0.00 -0.42 0.00 0.00 57.16 54.94 1nix n GLU 15 Cb 0.57 -1.36 0.18 0.00 -0.57 0.00 0.00 31.44 30.26 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 -3.38 3.61 0.00 0.00 7.64 -1.26 -2.09 113.62 118.14 1nix n SER 18 Ca 0.09 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.15 1nix n SER 18 Cb 0.53 -1.57 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 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 1.44 2.87 3.50 0.23 0.00 -1.26 -5.03 105.19 106.94 1nix n GLY 19 Ca 0.06 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.83 2.79 0.34 1.61 1.51 -0.89 -0.46 117.35 119.43 1nix s TYR 20 Ca 0.00 -0.14 0.10 0.00 -1.01 0.00 0.00 57.07 56.01 1nix s TYR 20 Cb 0.00 -1.68 -0.06 0.00 -0.11 0.00 0.00 41.96 40.11 1nix s TYR 20 CO 0.00 0.19 -0.09 0.00 -1.11 0.00 0.00 175.55 174.54 1nix s ALA 21 N -0.64 2.96 -0.02 3.71 0.00 0.11 -4.41 121.76 123.48 1nix s ALA 21 Ca 0.10 -2.09 -0.24 0.00 0.00 0.00 0.00 51.96 49.73 1nix s ALA 21 Cb -0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 1nix s ALA 21 CO 0.01 0.08 0.73 0.00 0.00 0.00 0.00 175.76 176.59 1nix s ASN 23 N 0.45 5.01 -0.10 0.00 3.84 -0.74 -4.79 114.94 118.62 1nix s ASN 23 Ca 0.38 -0.92 0.06 0.00 0.21 0.00 0.00 52.86 52.59 1nix s ASN 23 Cb -0.19 0.46 -0.11 0.00 -0.55 0.00 0.00 41.25 40.86 1nix s ASN 23 CO 0.20 -1.43 -0.00 -1.20 -2.79 0.00 0.00 177.10 171.88 1nix n SER 24 N -2.30 2.78 0.01 -4.21 7.64 -1.26 -3.25 113.62 113.03 1nix n SER 24 Ca 0.17 -0.02 -0.10 0.00 1.01 0.00 0.00 58.87 59.93 1nix n SER 24 Cb 0.62 0.50 -0.05 0.00 -1.01 0.00 0.00 64.21 64.27 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 0.00 -0.05 -0.01 1.43 9.65 -1.98 -3.15 114.38 120.27 1nix h ARG 25 Ca -0.26 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.62 1nix h ARG 25 Cb 1.54 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 30.13 1nix h ARG 25 CO -0.00 -0.03 -0.46 -0.25 2.80 0.00 0.00 179.97 182.03 1nix n ASP 26 N -5.17 1.23 -3.38 -3.80 9.92 -1.26 -4.99 116.55 109.10 1nix n ASP 26 Ca -0.05 -1.12 -0.24 0.00 -0.53 0.00 0.00 54.79 52.85 1nix n ASP 26 Cb 0.10 0.67 0.02 0.00 -0.64 0.00 0.00 41.12 41.28 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 -0.60 -4.77 -2.15 -1.24 5.02 -1.19 -4.90 118.16 108.33 1nix n LYS 27 Ca 0.05 0.69 -0.02 0.00 -2.02 0.00 0.00 58.31 57.01 1nix n LYS 27 Cb 0.29 -5.52 -0.00 0.00 -0.02 0.00 0.00 35.03 29.77 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 -4.39 -0.00 -2.68 2.13 2.14 -1.26 -1.36 117.44 112.02 1nix n TRP 28 Ca -0.04 -0.17 -0.42 0.00 2.07 0.00 0.00 57.50 58.94 1nix n TRP 28 Cb 0.57 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 31.04 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 1.45 1.58 0.43 0.00 1.02 0.14 -2.03 119.74 122.33 1nix s LYS 30 Ca 0.51 -1.83 -0.22 0.00 0.02 0.00 0.00 55.97 54.45 1nix s LYS 30 Cb -0.21 -1.04 -0.10 0.00 -0.52 0.00 0.00 37.83 35.96 1nix s LYS 30 CO 0.24 -0.05 0.97 0.54 -0.92 0.00 0.00 175.35 176.13 1nix s VAL 31 N -3.12 4.23 -0.16 3.17 0.11 -1.26 0.06 120.40 123.43 1nix s VAL 31 Ca 0.32 1.45 -0.04 0.00 -2.93 0.00 0.00 61.98 60.78 1nix s VAL 31 Cb 0.06 -3.62 0.06 0.00 -1.53 0.00 0.00 36.38 31.35 1nix s VAL 31 CO 0.13 -0.24 0.12 -0.22 -3.33 0.00 0.00 175.10 171.56 1nix s LEU 32 N -3.08 0.18 0.00 2.54 0.20 0.39 -4.61 118.68 114.30 1nix s LEU 32 Ca 0.61 -0.37 0.24 0.00 0.69 0.00 0.00 54.13 55.31 1nix s LEU 32 Cb -0.12 -0.04 0.19 0.00 -0.43 0.00 0.00 46.19 45.79 1nix s LEU 32 CO 0.16 -0.32 1.26 0.00 -0.29 0.00 0.00 176.35 177.16