#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c09 s LYS 2 N 0.00 4.78 0.44 0.03 2.47 -1.26 -4.90 119.74 121.30 1c09 s LYS 2 Ca 0.00 1.41 -0.15 0.00 -1.56 0.00 0.00 55.97 55.67 1c09 s LYS 2 Cb 0.00 -3.21 -0.08 0.00 -1.46 0.00 0.00 37.83 33.08 1c09 s LYS 2 CO 0.00 0.49 0.88 0.15 0.16 0.00 0.00 175.35 177.03 1c09 s LYS 3 N -1.30 3.95 0.01 4.03 1.02 -1.26 -4.61 119.74 121.57 1c09 s LYS 3 Ca 0.41 0.79 0.04 0.00 0.02 0.00 0.00 55.97 57.24 1c09 s LYS 3 Cb -0.25 -2.26 -0.01 0.00 -0.52 0.00 0.00 37.83 34.79 1c09 s LYS 3 CO 0.30 -0.10 -0.13 0.71 -0.92 0.00 0.00 175.35 175.21 1c09 s TYR 4 N -2.39 1.16 -0.04 3.18 1.51 -0.84 -1.12 117.35 118.82 1c09 s TYR 4 Ca 0.56 -0.26 0.05 0.00 -1.01 0.00 0.00 57.07 56.41 1c09 s TYR 4 Cb -0.10 -0.73 -0.02 0.00 -0.11 0.00 0.00 41.96 41.00 1c09 s TYR 4 CO 0.26 -0.00 -0.19 -0.08 -1.11 0.00 0.00 175.55 174.43 1c09 s THR 5 N -0.48 2.66 -0.23 -0.71 -1.32 -0.13 0.67 115.64 116.11 1c09 s THR 5 Ca 0.04 -0.87 -0.29 0.00 -1.21 0.00 0.00 61.69 59.35 1c09 s THR 5 Cb -0.06 -2.01 -0.01 0.00 -1.51 0.00 0.00 72.50 68.91 1c09 s THR 5 CO 0.00 0.58 1.34 0.00 -2.21 0.00 0.00 174.62 174.33 1c09 h THR 7 N 5.78 0.03 0.13 0.00 1.35 -1.45 0.26 112.91 119.01 1c09 h THR 7 Ca -0.28 -0.51 -0.25 0.00 -0.55 0.00 0.00 66.41 64.82 1c09 h THR 7 Cb 1.11 1.49 0.03 0.00 -1.73 0.00 0.00 68.15 69.05 1c09 h THR 7 CO 1.00 0.01 -1.06 0.58 -0.25 0.00 0.00 175.52 175.80 1c09 h VAL 8 N 0.00 1.37 0.00 6.82 2.07 -1.91 -3.42 116.25 121.18 1c09 h VAL 8 Ca -0.00 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 65.05 1c09 h VAL 8 Cb 0.49 2.90 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1c09 h VAL 8 CO 0.00 0.73 -0.02 0.00 0.02 0.00 0.00 177.57 178.30 1c09 n GLY 10 N 0.73 0.79 3.66 0.00 0.00 0.90 -5.02 105.19 106.25 1c09 n GLY 10 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1c09 n GLY 10 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1c09 n TYR 11 N -2.00 1.96 -3.82 1.61 9.36 -1.26 -4.63 117.16 118.38 1c09 n TYR 11 Ca 0.00 0.54 -0.36 0.00 3.32 0.00 0.00 57.90 61.40 1c09 n TYR 11 Cb 0.00 -2.39 -0.13 0.00 -0.63 0.00 0.00 39.34 36.19 1c09 n TYR 11 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1c09 s ILE 12 N -0.59 4.08 -0.29 2.97 1.01 -1.26 -0.50 121.20 126.63 1c09 s ILE 12 Ca 0.63 -0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.74 1c09 s ILE 12 Cb -0.65 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 38.94 1c09 s ILE 12 CO 0.56 0.37 1.05 -0.47 0.00 0.00 0.00 174.94 176.44 1c09 s TYR 13 N 1.51 3.22 -0.33 3.97 5.04 0.21 -4.94 117.35 126.02 1c09 s TYR 13 Ca 0.06 1.27 -0.09 0.00 -2.44 0.00 0.00 57.07 55.87 1c09 s TYR 13 Cb -0.15 -3.52 0.01 0.00 0.35 0.00 0.00 41.96 38.66 1c09 s TYR 13 CO 0.02 -0.65 0.14 1.21 -1.34 0.00 0.00 175.55 174.93 1c09 s ASN 14 N 1.49 5.47 0.42 4.32 3.84 -1.26 -1.98 114.94 127.25 1c09 s ASN 14 Ca 0.44 -0.77 0.16 0.00 0.21 0.00 0.00 52.86 52.90 1c09 s ASN 14 Cb -0.13 -1.96 1.06 0.00 -0.55 0.00 0.00 41.25 39.67 1c09 s ASN 14 CO 0.12 -0.26 1.89 -0.65 -2.79 0.00 0.00 177.10 175.40 1c09 h PRO 15 N 8.33 0.41 -0.10 0.43 0.11 -1.82 -0.45 132.00 138.91 1c09 h PRO 15 Ca -0.29 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.72 1c09 h PRO 15 Cb 1.12 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1c09 h PRO 15 CO 0.63 0.27 -0.28 0.93 -0.21 0.00 0.00 178.00 179.33 1c09 h GLU 16 N 0.42 0.18 0.01 1.05 4.39 -1.92 0.50 114.58 119.21 1c09 h GLU 16 Ca 0.42 -0.06 -0.29 0.00 0.34 0.00 0.00 59.36 59.76 1c09 h GLU 16 Cb 1.00 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.59 1c09 h GLU 16 CO -0.15 0.46 -1.69 -0.44 -1.16 0.00 0.00 179.01 176.04 1c09 h ASP 17 N 0.17 0.03 0.00 1.42 3.45 -1.59 -3.34 116.42 116.56 1c09 h ASP 17 Ca 0.02 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.41 1c09 h ASP 17 Cb 0.59 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.35 1c09 h ASP 17 CO 0.04 1.07 0.00 0.61 -1.57 0.00 0.00 179.24 179.39 1c09 n GLY 18 N 1.57 0.68 2.22 2.75 0.00 -0.31 -4.00 105.19 108.11 1c09 n GLY 18 Ca -0.17 -0.81 -0.21 0.00 0.00 0.00 0.00 46.02 44.83 1c09 n GLY 18 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1c09 n ASP 19 N -2.49 0.20 0.02 1.61 2.03 0.11 -4.72 116.55 113.31 1c09 n ASP 19 Ca 0.00 -2.83 0.05 0.00 0.52 0.00 0.00 54.79 52.53 1c09 n ASP 19 Cb 0.00 -0.49 0.45 0.00 -0.72 0.00 0.00 41.12 40.36 1c09 n ASP 19 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1c09 h PRO 20 N 3.68 0.47 0.00 -0.67 0.13 -1.51 -1.31 132.00 132.80 1c09 h PRO 20 Ca 0.07 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1c09 h PRO 20 Cb 0.92 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1c09 h PRO 20 CO 0.46 0.31 0.00 -0.44 -0.23 0.00 0.00 178.00 178.10 1c09 h ASP 21 N 0.49 0.00 -0.17 1.44 3.32 -1.96 -1.16 116.42 118.38 1c09 h ASP 21 Ca 0.15 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 1c09 h ASP 21 Cb -0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 1c09 h ASP 21 CO -0.03 0.00 -0.08 0.59 -1.72 0.00 0.00 179.24 178.00 1c09 n ASN 22 N -2.78 2.84 0.00 6.45 3.02 -0.57 -4.98 115.26 119.24 1c09 n ASN 22 Ca -0.01 -3.32 0.00 0.00 -0.03 0.00 0.00 54.58 51.22 1c09 n ASN 22 Cb 0.15 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 1c09 n ASN 22 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1c09 n GLY 23 N -1.01 0.48 3.24 7.41 0.00 -0.44 -5.01 105.19 109.85 1c09 n GLY 23 Ca 0.22 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 1c09 n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c09 s VAL 24 N -2.00 4.16 0.59 1.61 1.01 -0.75 -4.95 120.40 120.06 1c09 s VAL 24 Ca 0.00 -1.59 -0.19 0.00 0.00 0.00 0.00 61.98 60.19 1c09 s VAL 24 Cb 0.00 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1c09 s VAL 24 CO 0.00 -0.62 1.24 0.20 0.00 0.00 0.00 175.10 175.92 1c09 s ASN 25 N 2.32 5.17 0.21 3.32 -0.87 -1.26 0.04 114.94 123.87 1c09 s ASN 25 Ca 0.04 2.48 -0.31 0.00 -1.57 0.00 0.00 52.86 53.50 1c09 s ASN 25 Cb -0.24 -2.61 -0.15 0.00 -0.02 0.00 0.00 41.25 38.23 1c09 s ASN 25 CO 0.01 -1.61 1.16 -2.65 -2.57 0.00 0.00 177.10 171.43 1c09 n PRO 26 N -1.48 1.32 -0.41 -0.60 -0.02 -1.26 -2.58 135.00 129.97 1c09 n PRO 26 Ca 0.13 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1c09 n PRO 26 Cb 0.49 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 1c09 n PRO 26 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1c09 n GLY 27 N 1.86 0.76 3.67 -1.23 0.00 0.17 -4.90 105.19 105.53 1c09 n GLY 27 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1c09 n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c09 s THR 28 N -2.32 4.95 0.40 2.61 2.01 -1.06 -4.95 115.64 117.27 1c09 s THR 28 Ca 0.00 1.44 -0.26 0.00 0.31 0.00 0.00 61.69 63.18 1c09 s THR 28 Cb 0.00 -4.05 -0.09 0.00 0.01 0.00 0.00 72.50 68.37 1c09 s THR 28 CO 0.00 0.07 1.29 -0.62 -0.69 0.00 0.00 174.62 174.68 1c09 s ASP 29 N 1.15 6.34 0.28 3.53 3.68 -1.26 -4.62 116.67 125.77 1c09 s ASP 29 Ca 0.34 2.63 -0.01 0.00 2.13 0.00 0.00 52.55 57.64 1c09 s ASP 29 Cb -0.16 -2.64 0.47 0.00 -1.45 0.00 0.00 42.92 39.14 1c09 s ASP 29 CO 0.12 -0.83 1.88 0.15 0.13 0.00 0.00 175.17 176.63 1c09 h PHE 30 N 2.69 1.15 0.00 -5.34 3.57 -1.96 -0.44 116.94 116.61 1c09 h PHE 30 Ca -0.49 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.03 1c09 h PHE 30 Cb 1.24 -0.37 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 1c09 h PHE 30 CO 0.53 0.57 -0.01 1.57 -2.23 0.00 0.00 178.31 178.75 1c09 h LYS 31 N 1.10 0.00 -0.01 1.11 2.10 -1.98 -2.32 116.57 116.58 1c09 h LYS 31 Ca 0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 1c09 h LYS 31 Cb 0.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.56 1c09 h LYS 31 CO -0.18 0.01 -0.39 -0.25 -2.00 0.00 0.00 179.45 176.65 1c09 n ASP 32 N -3.27 1.07 -4.74 7.07 8.00 -0.18 -4.89 116.55 119.60 1c09 n ASP 32 Ca -0.03 -0.86 -0.42 0.00 0.71 0.00 0.00 54.79 54.20 1c09 n ASP 32 Cb 0.11 0.26 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 1c09 n ASP 32 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1c09 s ILE 33 N -2.63 2.71 0.14 0.53 1.01 -0.88 -4.95 121.20 117.14 1c09 s ILE 33 Ca 0.20 0.58 -0.34 0.00 0.00 0.00 0.00 60.65 61.08 1c09 s ILE 33 Cb 0.19 -3.37 -0.16 0.00 0.01 0.00 0.00 42.46 39.13 1c09 s ILE 33 CO 0.59 0.08 1.22 -2.65 0.00 0.00 0.00 174.94 174.17 1c09 n PRO 34 N 2.70 1.14 0.00 2.79 -0.02 -1.26 -4.85 135.00 135.49 1c09 n PRO 34 Ca 0.08 0.41 0.05 0.00 -2.02 0.00 0.00 63.50 62.02 1c09 n PRO 34 Cb 0.40 -1.95 0.30 0.00 -0.02 0.00 0.00 33.50 32.23 1c09 n PRO 34 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1c09 n ASP 35 N 2.18 0.00 -0.81 2.55 8.00 -1.26 -1.46 116.55 125.74 1c09 n ASP 35 Ca 0.16 -0.82 0.11 0.00 0.71 0.00 0.00 54.79 54.95 1c09 n ASP 35 Cb 0.22 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.40 1c09 n ASP 35 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1c09 n ASP 36 N -0.78 2.69 -4.77 -2.24 3.85 -1.26 -4.68 116.55 109.36 1c09 n ASP 36 Ca 0.08 -1.84 -0.38 0.00 -0.71 0.00 0.00 54.79 51.93 1c09 n ASP 36 Cb 0.03 0.11 -0.01 0.00 -1.35 0.00 0.00 41.12 39.91 1c09 n ASP 36 CO 0.00 0.00 0.00 0.86 -1.01 0.00 0.00 177.20 177.05 1c09 s TRP 37 N -2.03 2.85 0.21 2.11 -0.00 -0.54 -4.98 118.94 116.57 1c09 s TRP 37 Ca 0.25 1.48 0.09 0.00 -0.00 0.00 0.00 56.10 57.91 1c09 s TRP 37 Cb 0.19 -3.54 -0.05 0.00 -0.00 0.00 0.00 33.47 30.07 1c09 s TRP 37 CO 0.35 -1.81 -0.16 0.14 -0.00 0.00 0.00 176.95 175.47 1c09 s VAL 38 N -1.37 1.88 -0.03 5.86 -7.23 -1.26 -3.31 120.40 114.94 1c09 s VAL 38 Ca 0.60 -2.21 -0.35 0.00 -1.81 0.00 0.00 61.98 58.21 1c09 s VAL 38 Cb -0.34 -2.06 -0.13 0.00 0.56 0.00 0.00 36.38 34.41 1c09 s VAL 38 CO 0.43 -0.53 1.77 0.00 -0.31 0.00 0.00 175.10 176.46 1c09 h PRO 40 N 8.01 0.00 0.02 0.00 0.13 -1.97 -0.04 132.00 138.14 1c09 h PRO 40 Ca -0.47 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.30 1c09 h PRO 40 Cb 1.27 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.34 1c09 h PRO 40 CO 0.93 0.00 -2.22 1.28 -0.23 0.00 0.00 178.00 177.76 1c09 n LEU 41 N -2.96 1.26 0.00 1.56 4.77 -1.26 -4.72 117.00 115.65 1c09 n LEU 41 Ca -0.01 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1c09 n LEU 41 Cb 0.16 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1c09 n LEU 41 CO 0.22 0.63 0.12 0.00 -1.33 0.00 0.00 177.39 177.02 1c09 n GLY 43 N 0.26 0.84 3.77 0.00 0.00 -0.03 -4.98 105.19 105.04 1c09 n GLY 43 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1c09 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c09 s ALA 44 N -3.34 3.28 0.91 4.61 0.00 -1.26 -4.53 121.76 121.43 1c09 s ALA 44 Ca 0.00 1.32 -0.12 0.00 0.00 0.00 0.00 51.96 53.17 1c09 s ALA 44 Cb 0.00 -3.52 0.14 0.00 0.00 0.00 0.00 23.12 19.73 1c09 s ALA 44 CO 0.00 -0.94 1.09 0.20 0.00 0.00 0.00 175.76 176.11 1c09 s GLY 45 N -0.63 1.61 0.47 0.00 0.00 -1.26 -0.10 107.32 107.41 1c09 s GLY 45 Ca 0.58 -0.07 0.18 0.00 0.00 0.00 0.00 44.72 45.40 1c09 s GLY 45 CO 0.52 0.43 2.00 0.50 0.00 0.00 0.00 173.10 176.55 1c09 h LYS 46 N -1.62 0.23 0.00 2.90 1.57 -1.83 -1.53 116.57 116.29 1c09 h LYS 46 Ca -0.50 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1c09 h LYS 46 Cb 1.29 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1c09 h LYS 46 CO 0.54 0.15 0.00 -0.40 -0.57 0.00 0.00 179.45 179.17 1c09 n ASP 47 N -4.45 0.61 -1.44 0.86 3.85 -1.26 -1.13 116.55 113.58 1c09 n ASP 47 Ca 0.09 0.73 0.08 0.00 -0.71 0.00 0.00 54.79 54.97 1c09 n ASP 47 Cb 0.42 -0.83 0.31 0.00 -1.35 0.00 0.00 41.12 39.68 1c09 n ASP 47 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1c09 n GLN 48 N -2.26 3.46 -4.06 0.11 6.02 -0.58 -4.93 117.38 115.15 1c09 n GLN 48 Ca -0.00 -2.49 -0.26 0.00 -0.01 0.00 0.00 57.00 54.24 1c09 n GLN 48 Cb 0.10 -1.85 -0.05 0.00 1.02 0.00 0.00 30.24 29.46 1c09 n GLN 48 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1c09 s PHE 49 N -1.88 3.21 0.04 1.08 0.40 -0.29 -1.10 117.98 119.45 1c09 s PHE 49 Ca 0.44 0.01 -0.08 0.00 -0.60 0.00 0.00 56.93 56.70 1c09 s PHE 49 Cb 0.29 -1.54 -0.00 0.00 0.51 0.00 0.00 43.02 42.28 1c09 s PHE 49 CO 0.20 0.52 0.16 -1.83 0.70 0.00 0.00 175.22 174.97 1c09 s GLU 50 N -3.16 0.67 0.36 0.44 -1.05 -0.73 -4.95 118.70 110.29 1c09 s GLU 50 Ca 0.32 -0.72 -0.28 0.00 -0.15 0.00 0.00 54.97 54.14 1c09 s GLU 50 Cb -0.10 0.27 -0.11 0.00 -0.44 0.00 0.00 34.13 33.75 1c09 s GLU 50 CO 0.24 -0.19 1.44 0.39 0.95 0.00 0.00 175.26 178.10 1c09 n GLU 51 N 0.62 2.52 0.14 -4.83 1.02 -1.26 -0.95 120.64 117.90 1c09 n GLU 51 Ca -0.18 0.88 -0.06 0.00 -0.02 0.00 0.00 57.16 57.78 1c09 n GLU 51 Cb 0.59 -2.58 -0.03 0.00 -0.02 0.00 0.00 31.44 29.40 1c09 n GLU 51 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1c09 h VAL 52 N 2.87 0.00 0.00 2.62 2.07 -1.46 -3.45 116.25 118.90 1c09 h VAL 52 Ca -0.49 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1c09 h VAL 52 Cb 1.25 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1c09 h VAL 52 CO 0.65 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 177.62