#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 4.71 0.19 0.00 2.01 -1.26 -4.18 115.64 117.12 1afp s THR 2 Ca 0.00 1.96 -0.01 0.00 0.31 0.00 0.00 61.69 63.95 1afp s THR 2 Cb 0.00 -4.26 0.04 0.00 0.01 0.00 0.00 72.50 68.29 1afp s THR 2 CO 0.00 0.09 0.26 -1.22 -0.69 0.00 0.00 174.62 173.07 1afp n TYR 3 N 4.34 -3.49 -3.78 4.92 4.01 -1.00 -4.84 117.16 117.33 1afp n TYR 3 Ca 0.08 -0.38 -0.13 0.00 -0.16 0.00 0.00 57.90 57.31 1afp n TYR 3 Cb 0.49 -0.20 -0.12 0.00 -0.31 0.00 0.00 39.34 39.20 1afp n TYR 3 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1afp s ASN 4 N -2.04 -0.21 0.00 7.72 0.02 -1.26 -3.22 114.94 115.95 1afp s ASN 4 Ca 0.17 0.42 0.00 0.00 -1.02 0.00 0.00 52.86 52.43 1afp s ASN 4 Cb -0.01 0.39 0.00 0.00 0.02 0.00 0.00 41.25 41.65 1afp s ASN 4 CO 0.11 -0.10 0.00 0.61 0.02 0.00 0.00 177.10 177.75 1afp n GLY 5 N 3.34 3.23 3.18 0.66 0.00 -0.17 -4.12 105.19 111.32 1afp n GLY 5 Ca -0.16 -0.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.67 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 4.98 0.81 0.10 1.61 1.02 0.21 -2.60 119.74 125.87 1afp s LYS 6 Ca 0.00 -1.12 0.05 0.00 0.02 0.00 0.00 55.97 54.92 1afp s LYS 6 Cb 0.00 0.29 -0.03 0.00 -0.52 0.00 0.00 37.83 37.57 1afp s LYS 6 CO 0.00 -0.23 -0.13 0.00 -0.92 0.00 0.00 175.35 174.07 1afp s TYR 8 N -1.94 2.78 -0.08 0.00 2.02 -0.66 -1.79 117.35 117.68 1afp s TYR 8 Ca 0.04 -0.28 -0.25 0.00 -0.37 0.00 0.00 57.07 56.21 1afp s TYR 8 Cb -0.06 -1.71 -0.25 0.00 -0.40 0.00 0.00 41.96 39.53 1afp s TYR 8 CO 0.02 0.08 0.94 1.57 -1.57 0.00 0.00 175.55 176.59 1afp h LYS 9 N 5.78 0.14 -0.76 -0.62 5.09 -1.81 2.05 116.57 126.44 1afp h LYS 9 Ca -0.40 -0.18 0.11 0.00 0.09 0.00 0.00 60.65 60.28 1afp h LYS 9 Cb 1.17 0.06 -0.08 0.00 0.10 0.00 0.00 32.23 33.48 1afp h LYS 9 CO 0.53 0.98 0.37 -0.22 -2.09 0.00 0.00 179.45 179.02 1afp h LYS 10 N -0.63 0.58 -0.01 0.07 3.64 -1.95 0.98 116.57 119.25 1afp h LYS 10 Ca -0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1afp h LYS 10 Cb 1.09 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1afp h LYS 10 CO 0.05 0.38 -0.60 -0.25 -2.27 0.00 0.00 179.45 176.76 1afp n ASP 11 N -4.88 1.19 -4.07 4.20 10.43 -1.24 -4.97 116.55 117.21 1afp n ASP 11 Ca 0.13 -0.97 -0.44 0.00 2.57 0.00 0.00 54.79 56.08 1afp n ASP 11 Cb 0.33 0.53 0.02 0.00 1.84 0.00 0.00 41.12 43.84 1afp n ASP 11 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 1afp n ASN 12 N -0.91 -3.61 -3.83 -2.24 5.15 0.68 -4.74 115.26 105.75 1afp n ASN 12 Ca 0.07 -1.21 -0.22 0.00 -0.60 0.00 0.00 54.58 52.63 1afp n ASN 12 Cb 0.37 -1.45 -0.08 0.00 -0.53 0.00 0.00 39.78 38.09 1afp n ASN 12 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1afp s ILE 13 N -3.67 0.32 -0.25 -1.44 -5.25 -0.18 0.24 121.20 110.96 1afp s ILE 13 Ca 0.44 -2.00 0.00 0.00 -0.99 0.00 0.00 60.65 58.11 1afp s ILE 13 Cb -0.25 -2.43 0.07 0.00 2.95 0.00 0.00 42.46 42.80 1afp s ILE 13 CO 0.90 0.00 -0.01 0.00 -1.79 0.00 0.00 174.94 174.04 1afp s LYS 15 N 1.43 3.84 0.09 0.00 -2.85 0.29 0.17 119.74 122.70 1afp s LYS 15 Ca -0.01 -0.40 -0.26 0.00 -1.00 0.00 0.00 55.97 54.30 1afp s LYS 15 Cb -0.18 -3.10 0.08 0.00 -2.06 0.00 0.00 37.83 32.57 1afp s LYS 15 CO -0.09 0.29 0.72 1.52 0.10 0.00 0.00 175.35 177.89 1afp s TYR 16 N 0.29 -0.46 -0.45 1.78 1.13 -1.26 0.67 117.35 119.03 1afp s TYR 16 Ca 0.01 0.31 -0.24 0.00 -1.41 0.00 0.00 57.07 55.74 1afp s TYR 16 Cb -0.13 0.55 0.03 0.00 -1.10 0.00 0.00 41.96 41.30 1afp s TYR 16 CO 0.01 -0.72 0.86 0.21 -2.51 0.00 0.00 175.55 173.41 1afp s LYS 17 N -3.41 3.48 0.96 -3.49 2.36 -1.26 -4.13 119.74 114.26 1afp s LYS 17 Ca 0.02 0.05 -0.12 0.00 -2.55 0.00 0.00 55.97 53.37 1afp s LYS 17 Cb -0.01 -3.93 0.08 0.00 -1.05 0.00 0.00 37.83 32.92 1afp s LYS 17 CO -0.11 -1.17 0.60 0.00 1.55 0.00 0.00 175.35 176.22 1afp n ALA 18 N 6.96 -2.24 0.28 3.13 0.00 -1.26 -4.70 120.51 122.68 1afp n ALA 18 Ca 0.04 -0.66 0.18 0.00 0.00 0.00 0.00 53.44 53.00 1afp n ALA 18 Cb 0.48 -1.89 0.96 0.00 0.00 0.00 0.00 19.45 19.00 1afp n ALA 18 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1afp h GLN 19 N -1.72 0.00 0.00 0.00 4.20 -1.95 -1.05 115.11 114.59 1afp h GLN 19 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1afp h GLN 19 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 1afp h GLN 19 CO 0.37 0.00 -0.03 -1.13 -0.67 0.00 0.00 178.83 177.37 1afp n SER 20 N -3.59 1.40 0.00 1.46 3.41 -1.26 -4.96 113.62 110.07 1afp n SER 20 Ca -0.02 -1.88 0.00 0.00 -0.26 0.00 0.00 58.87 56.71 1afp n SER 20 Cb 0.17 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1afp n SER 20 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1afp n GLY 21 N -0.46 0.54 0.14 5.00 0.00 -0.40 -4.89 105.19 105.12 1afp n GLY 21 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 1afp n GLY 21 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1afp h LYS 22 N 1.49 -0.32 0.00 1.61 3.64 -1.93 -3.43 116.57 117.62 1afp h LYS 22 Ca 0.00 0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1afp h LYS 22 Cb 0.13 0.07 0.05 0.00 -0.41 0.00 0.00 32.23 32.07 1afp h LYS 22 CO 0.00 -0.22 -0.04 -2.37 -2.27 0.00 0.00 179.45 174.55 1afp n THR 23 N -3.35 0.00 -1.43 1.00 5.66 -1.26 -4.92 114.28 109.98 1afp n THR 23 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 1afp n THR 23 Cb 0.13 -0.22 0.00 0.00 -1.55 0.00 0.00 70.33 68.69 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 -2.86 0.00 -1.57 1.79 0.00 -1.26 -4.39 120.51 112.21 1afp n ALA 24 Ca -0.04 0.00 -0.49 0.00 0.00 0.00 0.00 53.44 52.91 1afp n ALA 24 Cb 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.54 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 0.58 0.91 -3.60 0.00 5.41 -1.25 -4.37 119.36 117.05 1afp n ILE 25 Ca 0.00 -0.23 -0.26 0.00 1.00 0.00 0.00 62.75 63.26 1afp n ILE 25 Cb 0.00 -0.80 -0.17 0.00 -0.71 0.00 0.00 39.64 37.96 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 5.28 0.00 0.00 0.00 2.85 -1.26 0.13 118.16 125.16 1afp n LYS 27 Ca -0.07 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.19 1afp n LYS 27 Cb 0.48 -0.83 0.00 0.00 -0.65 0.00 0.00 35.03 34.04 1afp n LYS 27 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1afp s TYR 29 N 0.00 -0.17 0.00 0.00 6.14 -1.26 -4.94 117.35 117.12 1afp s TYR 29 Ca 0.00 0.10 0.00 0.00 0.64 0.00 0.00 57.07 57.81 1afp s TYR 29 Cb 0.00 0.03 0.00 0.00 0.42 0.00 0.00 41.96 42.41 1afp s TYR 29 CO 0.00 -0.10 0.00 0.28 0.64 0.00 0.00 175.55 176.37 1afp n VAL 30 N 5.06 0.00 -1.14 3.14 0.31 -1.26 -4.53 118.33 119.91 1afp n VAL 30 Ca 0.09 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.00 1afp n VAL 30 Cb 0.58 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.46 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 0.00 1.57 -1.16 5.55 4.81 -1.26 -4.91 118.16 122.76 1afp n LYS 31 Ca 0.00 -1.84 -0.38 0.00 -0.87 0.00 0.00 58.31 55.22 1afp n LYS 31 Cb 0.00 -2.90 0.02 0.00 0.02 0.00 0.00 35.03 32.17 1afp n LYS 31 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1afp n LYS 32 N 6.82 0.01 -2.05 1.64 4.81 -1.26 -4.69 118.16 123.44 1afp n LYS 32 Ca 0.49 0.01 -0.39 0.00 -0.87 0.00 0.00 58.31 57.55 1afp n LYS 32 Cb 0.39 -1.03 0.00 0.00 0.02 0.00 0.00 35.03 34.41 1afp n LYS 32 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1afp h PRO 34 N 2.28 0.36 -1.18 0.00 0.13 -1.87 -3.40 132.00 128.31 1afp h PRO 34 Ca -0.50 -0.35 0.18 0.00 -0.87 0.00 0.00 66.00 64.46 1afp h PRO 34 Cb 1.26 0.09 -0.30 0.00 0.13 0.00 0.00 31.00 32.18 1afp h PRO 34 CO 0.61 1.02 0.81 -0.98 -0.23 0.00 0.00 178.00 179.23 1afp s ARG 35 N -3.34 0.17 0.13 0.86 1.70 -1.26 -4.83 118.95 112.37 1afp s ARG 35 Ca -0.14 0.14 -0.31 0.00 -0.47 0.00 0.00 55.73 54.95 1afp s ARG 35 Cb 0.03 0.08 -0.17 0.00 -0.57 0.00 0.00 34.95 34.32 1afp s ARG 35 CO 0.80 -0.03 0.68 -3.47 -1.08 0.00 0.00 175.30 172.19 1afp n ASP 36 N 1.35 -0.81 0.00 -2.89 -0.08 -1.24 0.17 116.55 113.06 1afp n ASP 36 Ca -0.08 1.10 0.00 0.00 -1.51 0.00 0.00 54.79 54.30 1afp n ASP 36 Cb 0.57 -0.90 0.00 0.00 2.34 0.00 0.00 41.12 43.13 1afp n ASP 36 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1afp n GLY 37 N 1.77 3.17 3.68 0.27 0.00 -0.74 -4.97 105.19 108.37 1afp n GLY 37 Ca 0.18 0.00 -0.61 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.90 -0.51 -1.75 4.61 0.00 0.13 -4.42 120.51 117.68 1afp n ALA 38 Ca 0.00 0.39 -0.37 0.00 0.00 0.00 0.00 53.44 53.45 1afp n ALA 38 Cb 0.00 -2.12 0.04 0.00 0.00 0.00 0.00 19.45 17.37 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 3.71 3.03 -0.09 0.00 2.20 -1.26 0.98 119.74 128.31 1afp s LYS 39 Ca 1.03 2.07 -0.21 0.00 -0.36 0.00 0.00 55.97 58.50 1afp s LYS 39 Cb -1.25 -2.11 0.05 0.00 -1.51 0.00 0.00 37.83 33.01 1afp s LYS 39 CO 0.71 -1.23 0.50 0.00 -0.36 0.00 0.00 175.35 174.97 1afp s GLU 41 N -0.74 3.25 -0.56 0.00 0.41 -1.24 -0.99 118.70 118.82 1afp s GLU 41 Ca -0.08 -0.76 -0.22 0.00 -0.41 0.00 0.00 54.97 53.49 1afp s GLU 41 Cb -0.03 -2.50 0.05 0.00 -1.78 0.00 0.00 34.13 29.88 1afp s GLU 41 CO 0.05 0.20 0.84 0.12 -0.49 0.00 0.00 175.26 175.98 1afp s PHE 42 N 0.35 2.85 0.10 1.61 5.36 -1.20 -2.65 117.98 124.42 1afp s PHE 42 Ca -0.14 -0.32 -0.31 0.00 -0.96 0.00 0.00 56.93 55.20 1afp s PHE 42 Cb -0.17 -3.96 -0.07 0.00 -0.34 0.00 0.00 43.02 38.48 1afp s PHE 42 CO 0.07 -1.31 1.34 0.34 -1.46 0.00 0.00 175.22 174.20 1afp s ASP 43 N 3.00 6.88 0.00 6.13 3.68 -1.20 -2.36 116.67 132.80 1afp s ASP 43 Ca 0.23 2.26 0.25 0.00 2.13 0.00 0.00 52.55 57.42 1afp s ASP 43 Cb -0.16 -2.58 0.40 0.00 -1.45 0.00 0.00 42.92 39.13 1afp s ASP 43 CO 0.15 -0.61 1.35 -1.54 0.13 0.00 0.00 175.17 174.65 1afp n SER 44 N 3.92 1.77 0.04 -0.34 3.41 -1.26 -2.22 113.62 118.94 1afp n SER 44 Ca 0.11 -1.38 0.10 0.00 -0.26 0.00 0.00 58.87 57.45 1afp n SER 44 Cb 0.43 0.24 0.44 0.00 -0.26 0.00 0.00 64.21 65.06 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 -0.01 0.26 0.12 7.33 4.11 -1.26 -4.43 117.16 123.27 1afp n TYR 45 Ca 0.12 0.09 0.00 0.00 -0.00 0.00 0.00 57.90 58.11 1afp n TYR 45 Cb 0.43 -0.65 0.00 0.00 -0.00 0.00 0.00 39.34 39.13 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 -1.73 0.00 0.00 -3.48 5.02 -1.25 -5.07 118.16 111.65 1afp n LYS 46 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1afp n LYS 46 Cb 0.26 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.27 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 0.95 1.33 3.90 0.72 0.00 -0.94 -5.13 105.19 106.02 1afp n GLY 47 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 2.23 -0.44 1.61 3.01 -1.22 -5.01 119.74 119.92 1afp s LYS 48 Ca 0.00 -2.13 0.04 0.00 -1.01 0.00 0.00 55.97 52.87 1afp s LYS 48 Cb 0.00 -2.00 0.12 0.00 -1.01 0.00 0.00 37.83 34.94 1afp s LYS 48 CO 0.00 -0.65 0.17 0.00 0.51 0.00 0.00 175.35 175.38 1afp n TYR 50 N 3.61 1.68 1.79 0.00 4.02 -1.08 -4.71 117.16 122.47 1afp n TYR 50 Ca 0.05 -1.20 0.15 0.00 -0.01 0.00 0.00 57.90 56.88 1afp n TYR 50 Cb 0.36 -1.99 0.78 0.00 -0.02 0.00 0.00 39.34 38.47 1afp n TYR 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85