#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afp s THR 2 N 0.00 5.44 -0.20 0.00 2.01 -1.26 -3.61 115.64 118.03 1afp s THR 2 Ca 0.00 0.20 -0.03 0.00 0.31 0.00 0.00 61.69 62.18 1afp s THR 2 Cb 0.00 -3.46 -0.01 0.00 0.01 0.00 0.00 72.50 69.04 1afp s THR 2 CO 0.00 0.55 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.09 1afp s TYR 3 N -1.10 2.91 0.49 4.92 1.51 -0.38 -4.86 117.35 120.84 1afp s TYR 3 Ca 0.19 -0.96 -0.05 0.00 -1.01 0.00 0.00 57.07 55.24 1afp s TYR 3 Cb -0.13 -2.03 -0.03 0.00 -0.11 0.00 0.00 41.96 39.66 1afp s TYR 3 CO 0.08 -0.51 0.78 -0.80 -1.11 0.00 0.00 175.55 173.99 1afp s ASN 4 N 1.23 6.13 0.00 2.29 -0.87 -1.26 0.15 114.94 122.61 1afp s ASN 4 Ca 0.03 0.82 0.00 0.00 -1.57 0.00 0.00 52.86 52.13 1afp s ASN 4 Cb -0.14 -2.10 0.00 0.00 -0.02 0.00 0.00 41.25 38.99 1afp s ASN 4 CO -0.03 -0.64 0.00 0.61 -2.57 0.00 0.00 177.10 174.47 1afp n GLY 5 N -2.27 1.28 3.11 0.66 0.00 0.11 -3.80 105.19 104.29 1afp n GLY 5 Ca 0.01 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 1afp n GLY 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1afp s LYS 6 N 3.90 0.61 0.30 1.61 1.02 0.25 -2.31 119.74 125.13 1afp s LYS 6 Ca 0.00 -0.90 0.03 0.00 0.02 0.00 0.00 55.97 55.12 1afp s LYS 6 Cb 0.00 0.23 -0.06 0.00 -0.52 0.00 0.00 37.83 37.49 1afp s LYS 6 CO 0.00 -0.15 0.08 0.00 -0.92 0.00 0.00 175.35 174.36 1afp s TYR 8 N -3.48 0.21 -0.03 0.00 1.51 -0.74 -0.35 117.35 114.46 1afp s TYR 8 Ca 0.37 -0.44 -0.04 0.00 -1.01 0.00 0.00 57.07 55.95 1afp s TYR 8 Cb 0.08 -0.16 -0.02 0.00 -0.11 0.00 0.00 41.96 41.76 1afp s TYR 8 CO 0.15 -0.22 0.24 0.87 -1.11 0.00 0.00 175.55 175.48 1afp h LYS 9 N 4.49 -0.12 -0.98 -0.62 1.57 -1.81 1.65 116.57 120.75 1afp h LYS 9 Ca -0.32 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.64 1afp h LYS 9 Cb 1.20 0.03 -0.17 0.00 0.08 0.00 0.00 32.23 33.37 1afp h LYS 9 CO 0.42 -0.08 -0.32 1.17 -0.57 0.00 0.00 179.45 180.06 1afp n LYS 10 N -3.44 -0.17 0.13 3.15 3.00 -1.26 0.22 118.16 119.79 1afp n LYS 10 Ca -0.02 1.51 0.02 0.00 -0.00 0.00 0.00 58.31 59.83 1afp n LYS 10 Cb 0.05 -2.25 0.01 0.00 0.00 0.00 0.00 35.03 32.84 1afp n LYS 10 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1afp h ASP 11 N 0.00 0.00 -6.45 3.14 5.19 -2.00 -3.47 116.42 112.83 1afp h ASP 11 Ca 0.40 0.00 -0.49 0.00 -0.62 0.00 0.00 57.03 56.32 1afp h ASP 11 Cb 0.64 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.10 1afp h ASP 11 CO -0.99 0.52 -0.87 -3.20 -3.12 0.00 0.00 179.24 171.59 1afp n ASN 12 N -3.20 -0.87 -3.32 6.45 5.15 0.61 -4.88 115.26 115.19 1afp n ASN 12 Ca 0.01 -0.97 -0.20 0.00 -0.60 0.00 0.00 54.58 52.83 1afp n ASN 12 Cb 0.75 -3.21 -0.06 0.00 -0.53 0.00 0.00 39.78 36.73 1afp n ASN 12 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1afp n ILE 13 N -4.39 0.00 -3.66 -1.44 -6.64 -0.80 -1.34 119.36 101.08 1afp n ILE 13 Ca -0.26 -1.87 -0.27 0.00 -1.77 0.00 0.00 62.75 58.58 1afp n ILE 13 Cb 0.66 0.68 -0.16 0.00 -1.44 0.00 0.00 39.64 39.38 1afp n ILE 13 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1afp s LYS 15 N 1.99 3.72 0.16 0.00 1.02 0.58 1.00 119.74 128.20 1afp s LYS 15 Ca 0.02 0.13 -0.24 0.00 0.02 0.00 0.00 55.97 55.90 1afp s LYS 15 Cb -0.17 -3.22 0.07 0.00 -0.52 0.00 0.00 37.83 33.99 1afp s LYS 15 CO -0.13 0.70 0.99 1.52 -0.92 0.00 0.00 175.35 177.51 1afp s TYR 16 N -0.94 -0.07 -0.27 3.18 1.13 -1.26 0.86 117.35 119.98 1afp s TYR 16 Ca 0.19 -0.26 -0.12 0.00 -1.41 0.00 0.00 57.07 55.48 1afp s TYR 16 Cb -0.14 0.65 -0.05 0.00 -1.10 0.00 0.00 41.96 41.32 1afp s TYR 16 CO 0.08 -0.84 0.22 0.15 -2.51 0.00 0.00 175.55 172.65 1afp s LYS 17 N -2.96 3.98 0.88 -3.49 1.02 -1.25 -4.26 119.74 113.66 1afp s LYS 17 Ca 0.15 -0.25 -0.12 0.00 0.02 0.00 0.00 55.97 55.76 1afp s LYS 17 Cb -0.01 -3.64 0.12 0.00 -0.52 0.00 0.00 37.83 33.78 1afp s LYS 17 CO 0.03 -0.16 1.13 0.00 -0.92 0.00 0.00 175.35 175.43 1afp s ALA 18 N 1.70 1.94 0.23 5.17 0.00 -1.26 -4.71 121.76 124.83 1afp s ALA 18 Ca 0.08 -0.47 -0.12 0.00 0.00 0.00 0.00 51.96 51.45 1afp s ALA 18 Cb -0.16 -3.04 0.30 0.00 0.00 0.00 0.00 23.12 20.22 1afp s ALA 18 CO 0.10 -2.12 1.60 0.37 0.00 0.00 0.00 175.76 175.71 1afp h GLN 19 N -1.38 -0.01 -0.05 0.00 4.15 -1.97 -1.01 115.11 114.85 1afp h GLN 19 Ca -0.49 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.93 1afp h GLN 19 Cb 1.32 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.01 1afp h GLN 19 CO 0.62 -0.01 0.00 0.43 -1.93 0.00 0.00 178.83 177.94 1afp n SER 20 N -5.50 2.61 0.00 -0.69 7.64 -1.26 -4.93 113.62 111.49 1afp n SER 20 Ca 0.10 -3.00 0.00 0.00 1.01 0.00 0.00 58.87 56.98 1afp n SER 20 Cb 0.39 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1afp n SER 20 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1afp n GLY 21 N -1.20 0.32 0.21 0.23 0.00 -0.38 -4.81 105.19 99.56 1afp n GLY 21 Ca 0.16 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.32 1afp n GLY 21 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1afp h LYS 22 N 0.81 0.00 0.00 1.61 1.79 -1.92 -3.42 116.57 115.44 1afp h LYS 22 Ca 0.00 0.00 -0.41 0.00 -2.18 0.00 0.00 60.65 58.06 1afp h LYS 22 Cb 0.34 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.95 1afp h LYS 22 CO 0.00 0.00 -0.20 -2.37 -1.08 0.00 0.00 179.45 175.80 1afp n THR 23 N -2.46 0.00 0.00 -0.16 5.66 -1.26 -5.05 114.28 111.01 1afp n THR 23 Ca -0.02 -1.54 0.00 0.00 -3.05 0.00 0.00 64.05 59.44 1afp n THR 23 Cb 0.05 -0.13 0.00 0.00 -1.55 0.00 0.00 70.33 68.70 1afp n THR 23 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1afp n ALA 24 N -2.17 0.00 -1.76 1.79 0.00 -1.26 -4.44 120.51 112.67 1afp n ALA 24 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1afp n ALA 24 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 1afp n ALA 24 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1afp n ILE 25 N 0.00 -5.61 -3.29 0.00 -0.00 -1.22 -4.93 119.36 104.31 1afp n ILE 25 Ca 0.00 2.57 -0.06 0.00 -0.00 0.00 0.00 62.75 65.26 1afp n ILE 25 Cb 0.00 -3.44 -0.06 0.00 -0.00 0.00 0.00 39.64 36.15 1afp n ILE 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1afp n LYS 27 N 5.38 0.00 -2.91 0.00 5.02 -1.26 -1.14 118.16 123.24 1afp n LYS 27 Ca -0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.85 1afp n LYS 27 Cb 0.50 -0.78 -0.05 0.00 -0.02 0.00 0.00 35.03 34.69 1afp n LYS 27 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1afp n TYR 29 N 6.71 0.00 -0.24 0.00 4.11 -1.26 -4.66 117.16 121.82 1afp n TYR 29 Ca 0.04 0.00 -0.06 0.00 -0.00 0.00 0.00 57.90 57.88 1afp n TYR 29 Cb 0.48 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.77 1afp n TYR 29 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 1afp n VAL 30 N 0.00 -0.39 -1.54 -3.48 0.31 -1.26 -3.46 118.33 108.51 1afp n VAL 30 Ca 0.00 1.76 -0.16 0.00 -0.01 0.00 0.00 64.34 65.93 1afp n VAL 30 Cb 0.00 -2.21 -0.11 0.00 -0.91 0.00 0.00 33.84 30.61 1afp n VAL 30 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1afp n LYS 31 N -4.35 0.41 -1.41 5.55 3.00 -1.26 -4.86 118.16 115.24 1afp n LYS 31 Ca 0.01 -0.61 -0.33 0.00 -0.00 0.00 0.00 58.31 57.38 1afp n LYS 31 Cb 0.15 -2.94 0.09 0.00 0.00 0.00 0.00 35.03 32.33 1afp n LYS 31 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1afp s LYS 32 N 8.39 2.16 0.25 1.64 2.20 -1.22 -4.63 119.74 128.53 1afp s LYS 32 Ca 1.04 1.61 -0.30 0.00 -0.36 0.00 0.00 55.97 57.97 1afp s LYS 32 Cb -0.34 -1.85 -0.09 0.00 -1.51 0.00 0.00 37.83 34.04 1afp s LYS 32 CO 0.22 -1.79 1.28 0.00 -0.36 0.00 0.00 175.35 174.71 1afp h PRO 34 N 4.60 0.51 0.00 0.00 0.13 -1.90 -3.41 132.00 131.92 1afp h PRO 34 Ca -0.46 -0.50 0.00 0.00 -0.87 0.00 0.00 66.00 64.17 1afp h PRO 34 Cb 1.22 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.48 1afp h PRO 34 CO 0.73 1.13 0.00 2.89 -0.23 0.00 0.00 178.00 182.52 1afp n ARG 35 N -3.81 0.00 -1.68 0.86 1.85 -1.26 -4.90 116.66 107.71 1afp n ARG 35 Ca -0.07 0.00 -0.44 0.00 -1.00 0.00 0.00 57.85 56.34 1afp n ARG 35 Cb 0.80 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 32.19 1afp n ARG 35 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1afp n ASP 36 N 0.00 2.87 0.00 2.89 2.03 -1.25 -0.58 116.55 122.51 1afp n ASP 36 Ca 0.00 1.15 0.00 0.00 0.52 0.00 0.00 54.79 56.46 1afp n ASP 36 Cb 0.00 -1.46 0.00 0.00 -0.72 0.00 0.00 41.12 38.94 1afp n ASP 36 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1afp n GLY 37 N 1.90 3.14 3.69 0.27 0.00 0.53 -4.95 105.19 109.77 1afp n GLY 37 Ca 0.10 0.00 -0.67 0.00 0.00 0.00 0.00 46.02 45.45 1afp n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1afp n ALA 38 N -0.79 -1.30 -1.77 4.61 0.00 0.26 -4.28 120.51 117.24 1afp n ALA 38 Ca 0.00 0.49 -0.36 0.00 0.00 0.00 0.00 53.44 53.56 1afp n ALA 38 Cb 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 17.55 1afp n ALA 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1afp s LYS 39 N 3.05 3.50 0.16 0.00 2.36 -1.26 0.13 119.74 127.67 1afp s LYS 39 Ca 1.04 1.72 -0.17 0.00 -2.55 0.00 0.00 55.97 56.01 1afp s LYS 39 Cb -1.48 -2.18 0.04 0.00 -1.05 0.00 0.00 37.83 33.15 1afp s LYS 39 CO 0.81 -0.76 0.47 0.00 1.55 0.00 0.00 175.35 177.42 1afp s GLU 41 N -3.83 1.05 -0.37 0.00 1.03 -1.25 0.06 118.70 115.39 1afp s GLU 41 Ca 0.06 -0.31 -0.16 0.00 0.03 0.00 0.00 54.97 54.59 1afp s GLU 41 Cb 0.00 -0.97 0.00 0.00 -0.80 0.00 0.00 34.13 32.37 1afp s GLU 41 CO -0.08 0.09 0.40 0.12 -1.33 0.00 0.00 175.26 174.46 1afp s PHE 42 N 0.30 3.19 -0.01 4.83 5.36 0.39 -2.55 117.98 129.50 1afp s PHE 42 Ca -0.05 -0.15 -0.26 0.00 -0.96 0.00 0.00 56.93 55.51 1afp s PHE 42 Cb -0.10 -2.76 -0.04 0.00 -0.34 0.00 0.00 43.02 39.78 1afp s PHE 42 CO 0.01 -0.54 0.81 0.34 -1.46 0.00 0.00 175.22 174.38 1afp s ASP 43 N 1.76 7.19 0.05 6.13 -1.08 -1.20 -1.25 116.67 128.28 1afp s ASP 43 Ca 0.12 1.43 0.24 0.00 -0.52 0.00 0.00 52.55 53.82 1afp s ASP 43 Cb -0.17 -2.48 0.28 0.00 -1.46 0.00 0.00 42.92 39.09 1afp s ASP 43 CO 0.12 -0.12 1.24 -1.54 0.52 0.00 0.00 175.17 175.40 1afp n SER 44 N 3.48 0.62 0.00 -0.34 3.41 -1.24 -0.84 113.62 118.72 1afp n SER 44 Ca 0.01 -0.15 0.08 0.00 -0.26 0.00 0.00 58.87 58.54 1afp n SER 44 Cb 0.51 0.43 0.36 0.00 -0.26 0.00 0.00 64.21 65.24 1afp n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1afp n TYR 45 N -1.84 0.00 0.11 7.33 4.11 -1.26 -4.33 117.16 121.28 1afp n TYR 45 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.94 1afp n TYR 45 Cb 0.40 -0.41 0.00 0.00 -0.00 0.00 0.00 39.34 39.33 1afp n TYR 45 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1afp n LYS 46 N -1.41 0.00 0.00 -3.48 5.02 -1.25 -5.05 118.16 111.99 1afp n LYS 46 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1afp n LYS 46 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.17 1afp n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1afp n GLY 47 N 0.30 1.75 3.95 0.72 0.00 -0.02 -5.10 105.19 106.79 1afp n GLY 47 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1afp n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1afp s LYS 48 N -0.00 1.88 -0.37 1.61 1.02 -1.23 -4.92 119.74 117.72 1afp s LYS 48 Ca 0.00 -0.55 0.03 0.00 0.02 0.00 0.00 55.97 55.47 1afp s LYS 48 Cb 0.00 -2.20 0.11 0.00 -0.52 0.00 0.00 37.83 35.22 1afp s LYS 48 CO 0.00 -1.40 0.11 0.00 -0.92 0.00 0.00 175.35 173.14 1afp n TYR 50 N 4.10 1.61 0.60 0.00 4.02 -1.06 -4.76 117.16 121.68 1afp n TYR 50 Ca 0.03 -1.97 0.05 0.00 -0.01 0.00 0.00 57.90 56.01 1afp n TYR 50 Cb 0.40 -1.72 0.28 0.00 -0.02 0.00 0.00 39.34 38.28 1afp n TYR 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85