#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 -2.36 4.21 0.00 0.00 -0.14 -1.20 -4.66 119.74 115.58 1nix s LYS 3 Ca 0.24 1.22 0.00 0.00 -1.36 0.00 0.00 55.97 56.07 1nix s LYS 3 Cb -0.05 -2.29 0.00 0.00 -1.68 0.00 0.00 37.83 33.81 1nix s LYS 3 CO 0.76 -0.06 0.00 0.41 -0.76 0.00 0.00 175.35 175.70 1nix n GLY 4 N -0.32 1.00 3.81 -3.33 0.00 -1.26 -3.32 105.19 101.78 1nix n GLY 4 Ca 0.06 -1.53 -0.37 0.00 0.00 0.00 0.00 46.02 44.18 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 0.32 3.60 -0.51 1.61 2.19 -1.26 -4.15 117.98 119.77 1nix s PHE 5 Ca 0.00 0.72 0.00 0.00 0.33 0.00 0.00 56.93 57.98 1nix s PHE 5 Cb 0.00 -2.20 0.00 0.00 -1.31 0.00 0.00 43.02 39.51 1nix s PHE 5 CO 0.00 0.54 0.00 0.41 1.83 0.00 0.00 175.22 178.00 1nix n GLY 6 N 2.39 0.30 3.77 13.12 0.00 -1.09 -4.93 105.19 118.75 1nix n GLY 6 Ca -0.15 -0.69 -0.36 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 -3.84 3.80 -0.14 1.61 2.47 -1.26 -4.77 119.74 117.61 1nix s LYS 7 Ca 0.00 -0.22 -0.38 0.00 -1.56 0.00 0.00 55.97 53.81 1nix s LYS 7 Cb 0.00 -3.26 -0.16 0.00 -1.46 0.00 0.00 37.83 32.96 1nix s LYS 7 CO 0.00 0.50 1.63 0.43 0.16 0.00 0.00 175.35 178.07 1nix n SER 8 N 2.86 2.30 -3.69 1.43 7.64 -1.26 -1.26 113.62 121.63 1nix n SER 8 Ca -0.18 1.08 -0.14 0.00 1.01 0.00 0.00 58.87 60.64 1nix n SER 8 Cb 0.53 -1.19 -0.09 0.00 -1.01 0.00 0.00 64.21 62.46 1nix n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nix s VAL 10 N -0.45 5.11 -0.36 0.00 1.01 -1.26 -3.50 120.40 120.96 1nix s VAL 10 Ca -0.06 1.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.64 1nix s VAL 10 Cb -0.03 -3.86 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 1nix s VAL 10 CO 0.03 0.21 1.56 -2.16 0.00 0.00 0.00 175.10 174.74 1nix s PRO 11 N 1.39 3.54 0.00 2.72 0.04 -1.26 -3.50 135.00 137.93 1nix s PRO 11 Ca 0.26 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1nix s PRO 11 Cb -0.15 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.31 1nix s PRO 11 CO 0.10 -1.60 0.00 0.41 0.04 0.00 0.00 177.00 175.95 1nix n GLY 12 N 5.10 3.15 0.06 0.56 0.00 -1.26 -4.92 105.19 107.88 1nix n GLY 12 Ca 0.19 -0.44 0.12 0.00 0.00 0.00 0.00 46.02 45.89 1nix n GLY 12 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1nix h LYS 13 N 0.00 0.00 -5.41 1.61 3.64 -1.99 -3.49 116.57 110.94 1nix h LYS 13 Ca 0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1nix h LYS 13 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1nix h LYS 13 CO 0.00 0.00 -0.60 -1.71 -2.27 0.00 0.00 179.45 174.87 1nix n ASN 14 N -2.10 -7.72 -0.94 4.20 5.15 -1.25 -4.94 115.26 107.65 1nix n ASN 14 Ca 0.03 0.51 0.12 0.00 -0.60 0.00 0.00 54.58 54.64 1nix n ASN 14 Cb 0.44 -5.01 0.10 0.00 -0.53 0.00 0.00 39.78 34.78 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 -0.23 2.27 -2.04 1.20 4.71 -1.26 -4.97 120.64 120.31 1nix n GLU 15 Ca 0.09 -1.90 -0.28 0.00 -0.01 0.00 0.00 57.16 55.06 1nix n GLU 15 Cb 0.46 -1.45 0.08 0.00 -1.01 0.00 0.00 31.44 29.52 1nix n GLU 15 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1nix n SER 18 N -3.29 3.90 0.00 0.00 3.41 -1.26 -2.46 113.62 113.92 1nix n SER 18 Ca 0.07 0.98 0.00 0.00 -0.26 0.00 0.00 58.87 59.66 1nix n SER 18 Cb 0.56 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.00 1nix n SER 18 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nix n GLY 19 N 4.22 3.09 3.57 5.00 0.00 -1.26 -5.08 105.19 114.73 1nix n GLY 19 Ca 0.19 -1.01 -0.34 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.07 2.91 -0.08 1.61 2.02 -1.03 -3.34 117.35 119.38 1nix s TYR 20 Ca 0.00 0.00 0.02 0.00 -0.37 0.00 0.00 57.07 56.72 1nix s TYR 20 Cb 0.00 -1.70 -0.02 0.00 -0.40 0.00 0.00 41.96 39.84 1nix s TYR 20 CO 0.00 0.32 -0.13 0.00 -1.57 0.00 0.00 175.55 174.17 1nix s ALA 21 N -0.82 2.68 -0.00 3.71 0.00 0.20 -4.50 121.76 123.03 1nix s ALA 21 Ca 0.13 -0.94 -0.30 0.00 0.00 0.00 0.00 51.96 50.84 1nix s ALA 21 Cb -0.11 -1.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.89 1nix s ALA 21 CO 0.02 0.45 1.37 0.00 0.00 0.00 0.00 175.76 177.60 1nix n ASN 23 N 5.26 1.49 -0.01 0.00 6.94 -0.73 -4.47 115.26 123.74 1nix n ASN 23 Ca 0.13 -2.13 0.04 0.00 -0.02 0.00 0.00 54.58 52.60 1nix n ASN 23 Cb 0.44 -0.41 -0.09 0.00 -2.36 0.00 0.00 39.78 37.37 1nix n ASN 23 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 1nix n SER 24 N -2.62 2.38 0.24 0.53 2.88 -1.26 -3.64 113.62 112.12 1nix n SER 24 Ca 0.13 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.52 1nix n SER 24 Cb 0.48 1.42 -0.08 0.00 -0.75 0.00 0.00 64.21 65.29 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 -0.71 -0.15 -1.46 2.47 -1.96 -3.14 114.38 109.43 1nix h ARG 25 Ca -0.04 0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1nix h ARG 25 Cb 0.68 0.16 0.00 0.00 -1.65 0.00 0.00 29.97 29.16 1nix h ARG 25 CO 0.00 -0.47 0.00 -3.47 0.56 0.00 0.00 179.97 176.59 1nix n ASP 26 N -5.46 2.77 -3.76 7.04 -0.08 -1.26 -4.98 116.55 110.82 1nix n ASP 26 Ca -0.10 -1.82 -0.24 0.00 -1.51 0.00 0.00 54.79 51.11 1nix n ASP 26 Cb 0.36 -0.09 0.03 0.00 2.34 0.00 0.00 41.12 43.77 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 1.08 -5.35 -1.16 -0.67 5.02 -1.19 -4.91 118.16 110.99 1nix n LYS 27 Ca 0.13 0.63 0.00 0.00 -2.02 0.00 0.00 58.31 57.05 1nix n LYS 27 Cb 0.48 -5.34 0.00 0.00 -0.02 0.00 0.00 35.03 30.15 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 -4.45 -0.29 -2.59 2.13 2.14 -1.23 -1.12 117.44 112.04 1nix n TRP 28 Ca -0.17 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 58.98 1nix n TRP 28 Cb 0.62 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 31.09 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 1.73 2.85 0.59 0.00 2.36 -0.15 -2.66 119.74 124.45 1nix s LYS 30 Ca 0.53 -0.79 -0.20 0.00 -2.55 0.00 0.00 55.97 52.96 1nix s LYS 30 Cb -0.22 -2.30 -0.03 0.00 -1.05 0.00 0.00 37.83 34.22 1nix s LYS 30 CO 0.23 -0.01 1.27 0.54 1.55 0.00 0.00 175.35 178.93 1nix s VAL 31 N 0.81 2.36 0.50 4.02 0.11 -1.26 -0.63 120.40 126.31 1nix s VAL 31 Ca -0.08 0.24 0.09 0.00 -2.93 0.00 0.00 61.98 59.30 1nix s VAL 31 Cb -0.16 -3.10 0.04 0.00 -1.53 0.00 0.00 36.38 31.63 1nix s VAL 31 CO -0.01 -0.03 0.64 -0.76 -3.33 0.00 0.00 175.10 171.61 1nix s LEU 32 N -3.94 3.33 0.00 2.54 1.43 -1.21 -4.77 118.68 116.06 1nix s LEU 32 Ca 0.76 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1nix s LEU 32 Cb -0.35 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 43.82 1nix s LEU 32 CO 0.39 -1.03 0.07 0.00 0.23 0.00 0.00 176.35 176.00