#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ds5 s LYS 10 N 0.00 0.71 -0.02 1.61 2.36 -1.26 -5.13 119.74 118.01 2ds5 s LYS 10 Ca 0.00 0.08 -0.30 0.00 -2.55 0.00 0.00 55.97 53.20 2ds5 s LYS 10 Cb 0.00 0.33 -0.04 0.00 -1.05 0.00 0.00 37.83 37.07 2ds5 s LYS 10 CO 0.00 -0.19 1.16 -0.51 1.55 0.00 0.00 175.35 177.37 2ds5 s LEU 11 N -0.95 4.31 -0.02 5.43 1.43 -1.26 -5.02 118.68 122.60 2ds5 s LEU 11 Ca -0.10 1.84 0.04 0.00 -1.03 0.00 0.00 54.13 54.88 2ds5 s LEU 11 Cb -0.04 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.59 2ds5 s LEU 11 CO 0.05 -0.51 -0.13 -0.76 0.23 0.00 0.00 176.35 175.23 2ds5 s LEU 12 N 1.75 2.81 0.09 1.79 1.43 -1.26 -5.04 118.68 120.26 2ds5 s LEU 12 Ca 0.56 -0.23 0.08 0.00 -1.03 0.00 0.00 54.13 53.52 2ds5 s LEU 12 Cb -0.25 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 2ds5 s LEU 12 CO 0.24 0.32 -0.22 -0.31 0.23 0.00 0.00 176.35 176.61 2ds5 s TYR 13 N -0.83 1.87 0.16 0.29 1.51 -1.26 -1.70 117.35 117.39 2ds5 s TYR 13 Ca 0.13 -0.40 -0.31 0.00 -1.01 0.00 0.00 57.07 55.47 2ds5 s TYR 13 Cb -0.11 -1.04 -0.09 0.00 -0.11 0.00 0.00 41.96 40.61 2ds5 s TYR 13 CO 0.03 0.20 1.51 0.00 -1.11 0.00 0.00 175.55 176.18 2ds5 h SER 15 N 6.67 0.00 0.02 0.00 0.02 -1.27 -0.72 113.55 118.27 2ds5 h SER 15 Ca -0.43 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.21 2ds5 h SER 15 Cb 1.21 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 2ds5 h SER 15 CO 0.89 0.00 -1.70 0.49 -1.14 0.00 0.00 176.83 175.37 2ds5 n PHE 16 N -2.72 0.81 0.33 3.45 3.01 -1.26 -4.70 117.46 116.37 2ds5 n PHE 16 Ca 0.01 0.30 0.06 0.00 1.01 0.00 0.00 57.45 58.83 2ds5 n PHE 16 Cb 0.27 -1.09 -0.08 0.00 -0.01 0.00 0.00 39.48 38.57 2ds5 n PHE 16 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ds5 n GLY 18 N 1.50 0.83 3.78 0.00 0.00 -0.28 -4.99 105.19 106.03 2ds5 n GLY 18 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2ds5 n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ds5 s LYS 19 N -0.34 4.01 0.75 1.61 1.02 -1.26 -4.53 119.74 121.00 2ds5 s LYS 19 Ca 0.00 1.53 -0.08 0.00 0.02 0.00 0.00 55.97 57.44 2ds5 s LYS 19 Cb 0.00 -2.42 0.09 0.00 -0.52 0.00 0.00 37.83 34.98 2ds5 s LYS 19 CO 0.00 -0.28 1.07 -1.54 -0.92 0.00 0.00 175.35 173.68 2ds5 s SER 20 N -1.62 4.50 0.46 2.83 1.04 -1.26 -0.17 113.70 119.48 2ds5 s SER 20 Ca 0.61 0.37 0.31 0.00 0.48 0.00 0.00 55.95 57.72 2ds5 s SER 20 Cb -0.22 -0.89 1.53 0.00 0.10 0.00 0.00 66.02 66.54 2ds5 s SER 20 CO 0.27 -1.81 1.95 0.06 0.98 0.00 0.00 173.24 174.69 2ds5 h GLN 21 N -0.78 0.00 -0.01 4.02 -0.00 -1.69 -1.42 115.11 115.24 2ds5 h GLN 21 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.21 2ds5 h GLN 21 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.78 2ds5 h GLN 21 CO 0.55 0.00 -0.14 0.72 -0.00 0.00 0.00 178.83 179.96 2ds5 n HIS 22 N -2.67 0.00 0.44 0.06 8.25 -1.26 -3.72 115.22 116.32 2ds5 n HIS 22 Ca -0.01 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.51 2ds5 n HIS 22 Cb 0.15 -0.12 -0.07 0.00 1.12 0.00 0.00 29.99 31.08 2ds5 n HIS 22 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2ds5 n GLU 23 N -0.62 2.86 -4.50 -0.41 1.02 -0.54 -5.03 120.64 113.42 2ds5 n GLU 23 Ca 0.15 -0.02 -0.24 0.00 -0.02 0.00 0.00 57.16 57.03 2ds5 n GLU 23 Cb 0.31 -1.06 -0.10 0.00 -0.02 0.00 0.00 31.44 30.56 2ds5 n GLU 23 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2ds5 s VAL 24 N -2.17 2.07 0.19 2.62 -7.23 -1.18 -4.98 120.40 109.72 2ds5 s VAL 24 Ca 0.03 -2.20 -0.03 0.00 -1.81 0.00 0.00 61.98 57.97 2ds5 s VAL 24 Cb 0.08 -2.53 -0.07 0.00 0.56 0.00 0.00 36.38 34.42 2ds5 s VAL 24 CO 0.46 -0.26 1.49 0.03 -0.31 0.00 0.00 175.10 176.50 2ds5 h ARG 25 N 2.14 0.53 -2.45 4.82 3.08 -1.94 -3.46 114.38 117.11 2ds5 h ARG 25 Ca -0.41 -0.35 -0.09 0.00 0.07 0.00 0.00 59.98 59.20 2ds5 h ARG 25 Cb 1.25 0.05 -0.23 0.00 0.08 0.00 0.00 29.97 31.11 2ds5 h ARG 25 CO 0.68 0.97 -0.10 0.21 -1.07 0.00 0.00 179.97 180.66 2ds5 s LYS 26 N -3.92 0.61 -0.29 0.04 2.20 -1.26 -5.03 119.74 112.09 2ds5 s LYS 26 Ca -0.07 0.75 0.03 0.00 -0.36 0.00 0.00 55.97 56.32 2ds5 s LYS 26 Cb 0.11 0.28 0.08 0.00 -1.51 0.00 0.00 37.83 36.79 2ds5 s LYS 26 CO 0.84 -0.08 -0.03 -1.17 -0.36 0.00 0.00 175.35 174.55 2ds5 s LEU 27 N 0.37 3.77 -0.04 5.43 2.96 -1.26 -1.63 118.68 128.29 2ds5 s LEU 27 Ca -0.01 -1.66 -0.25 0.00 -0.22 0.00 0.00 54.13 51.98 2ds5 s LEU 27 Cb -0.04 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.11 2ds5 s LEU 27 CO -0.00 -0.28 0.79 -0.63 -1.32 0.00 0.00 176.35 174.91 2ds5 s ILE 28 N 1.09 4.96 -0.17 6.68 1.01 0.22 -4.88 121.20 130.11 2ds5 s ILE 28 Ca -0.00 1.64 -0.09 0.00 0.00 0.00 0.00 60.65 62.20 2ds5 s ILE 28 Cb -0.19 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 2ds5 s ILE 28 CO -0.07 0.24 0.14 0.00 0.00 0.00 0.00 174.94 175.24 2ds5 s ALA 29 N 0.77 3.76 0.13 9.38 0.00 -1.26 -0.93 121.76 133.60 2ds5 s ALA 29 Ca 0.42 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.73 2ds5 s ALA 29 Cb -0.19 -2.10 0.02 0.00 0.00 0.00 0.00 23.12 20.85 2ds5 s ALA 29 CO 0.21 0.33 0.17 0.41 0.00 0.00 0.00 175.76 176.88 2ds5 n GLY 30 N 2.95 2.01 0.28 0.00 0.00 0.15 -4.98 105.19 105.60 2ds5 n GLY 30 Ca -0.17 -2.15 0.01 0.00 0.00 0.00 0.00 46.02 43.71 2ds5 n GLY 30 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ds5 h PRO 31 N 0.00 0.67 0.00 1.61 0.11 -2.04 -3.31 132.00 129.04 2ds5 h PRO 31 Ca -0.06 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.98 2ds5 h PRO 31 Cb 0.27 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 31.16 2ds5 h PRO 31 CO 0.09 0.45 -0.58 0.43 -0.21 0.00 0.00 178.00 178.17 2ds5 n SER 32 N -4.80 0.17 -3.66 -2.05 7.64 -1.26 -5.11 113.62 104.56 2ds5 n SER 32 Ca 0.12 -1.98 -0.15 0.00 1.01 0.00 0.00 58.87 57.87 2ds5 n SER 32 Cb 0.26 -0.21 -0.08 0.00 -1.01 0.00 0.00 64.21 63.17 2ds5 n SER 32 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2ds5 s VAL 33 N 0.00 0.00 0.02 0.44 -7.23 -1.25 -5.12 120.40 107.26 2ds5 s VAL 33 Ca 0.06 -1.86 -0.09 0.00 -1.81 0.00 0.00 61.98 58.28 2ds5 s VAL 33 Cb 0.07 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.51 2ds5 s VAL 33 CO -0.03 0.00 0.17 -0.31 -0.31 0.00 0.00 175.10 174.62 2ds5 s TYR 34 N -3.64 0.04 -0.06 2.82 2.02 -1.26 0.33 117.35 117.60 2ds5 s TYR 34 Ca 0.36 -0.18 -0.03 0.00 -0.37 0.00 0.00 57.07 56.85 2ds5 s TYR 34 Cb 0.03 -0.04 0.03 0.00 -0.40 0.00 0.00 41.96 41.58 2ds5 s TYR 34 CO 0.19 -0.35 0.14 -1.50 -1.57 0.00 0.00 175.55 172.46 2ds5 s ILE 35 N -1.91 -0.03 0.58 2.71 2.07 -0.10 -0.73 121.20 123.79 2ds5 s ILE 35 Ca -0.10 0.12 -0.02 0.00 -1.41 0.00 0.00 60.65 59.24 2ds5 s ILE 35 Cb -0.04 -0.23 0.03 0.00 0.13 0.00 0.00 42.46 42.35 2ds5 s ILE 35 CO -0.01 0.05 0.83 0.00 -1.91 0.00 0.00 174.94 173.91 2ds5 h ASP 37 N -0.08 0.21 -0.45 0.00 2.03 -1.71 -1.56 116.42 114.85 2ds5 h ASP 37 Ca -0.44 -0.03 -0.09 0.00 -0.73 0.00 0.00 57.03 55.74 2ds5 h ASP 37 Cb 1.29 -0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 39.72 2ds5 h ASP 37 CO 0.56 0.27 -0.08 -0.33 -1.03 0.00 0.00 179.24 178.63 2ds5 h GLU 38 N 0.22 0.85 -0.04 4.15 5.08 -1.94 -0.38 114.58 122.52 2ds5 h GLU 38 Ca 0.05 -0.31 -0.12 0.00 -1.00 0.00 0.00 59.36 57.98 2ds5 h GLU 38 Cb 0.20 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2ds5 h GLU 38 CO 0.01 0.95 -0.53 0.00 -1.00 0.00 0.00 179.01 178.43 2ds5 h VAL 40 N 0.09 1.27 -0.39 0.00 2.07 -1.05 0.20 116.25 118.44 2ds5 h VAL 40 Ca -0.00 -1.16 0.03 0.00 0.82 0.00 0.00 66.70 66.39 2ds5 h VAL 40 Cb 0.96 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 2ds5 h VAL 40 CO 0.07 0.41 0.19 -0.78 0.02 0.00 0.00 177.57 177.48 2ds5 h ASP 41 N 0.83 0.26 -0.63 0.57 3.58 -0.62 -0.71 116.42 119.70 2ds5 h ASP 41 Ca 0.15 0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.56 2ds5 h ASP 41 Cb 0.58 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.58 2ds5 h ASP 41 CO 0.03 0.19 0.18 0.25 -2.88 0.00 0.00 179.24 177.02 2ds5 h LEU 42 N 0.38 0.95 -1.27 2.28 5.85 -0.76 -2.41 115.31 120.33 2ds5 h LEU 42 Ca 0.17 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2ds5 h LEU 42 Cb 0.09 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 2ds5 h LEU 42 CO -0.13 0.90 0.37 0.00 -0.34 0.00 0.00 178.44 179.25 2ds5 h ASN 44 N 0.89 0.92 -0.58 0.00 2.35 -0.66 0.04 115.58 118.55 2ds5 h ASN 44 Ca 0.23 -0.16 -0.09 0.00 -0.55 0.00 0.00 56.30 55.73 2ds5 h ASN 44 Cb -0.01 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 2ds5 h ASN 44 CO -0.04 0.87 0.02 0.44 -1.65 0.00 0.00 177.43 177.07 2ds5 h ASP 45 N 0.96 1.00 -0.13 5.81 3.32 -1.18 0.16 116.42 126.35 2ds5 h ASP 45 Ca 0.21 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 2ds5 h ASP 45 Cb 0.28 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 2ds5 h ASP 45 CO -0.01 1.04 0.01 0.40 -1.72 0.00 0.00 179.24 178.96 2ds5 h ILE 46 N 0.95 1.24 -0.21 0.35 2.04 -0.87 0.37 117.51 121.38 2ds5 h ILE 46 Ca 0.17 -0.77 -0.05 0.00 1.00 0.00 0.00 64.86 65.21 2ds5 h ILE 46 Cb 0.52 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 2ds5 h ILE 46 CO 0.02 0.22 -0.08 0.40 0.00 0.00 0.00 178.15 178.72 2ds5 h ILE 47 N -0.03 1.30 0.00 -0.67 2.04 -0.91 -3.08 117.51 116.16 2ds5 h ILE 47 Ca 0.04 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.78 2ds5 h ILE 47 Cb 0.34 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 2ds5 h ILE 47 CO 0.00 0.34 -0.01 0.54 0.00 0.00 0.00 178.15 179.02 2ds5 n ARG 48 N -4.58 0.12 -3.58 2.37 1.74 0.54 -4.95 116.66 108.32 2ds5 n ARG 48 Ca -0.05 0.09 -0.25 0.00 -0.77 0.00 0.00 57.85 56.87 2ds5 n ARG 48 Cb 0.31 -1.63 0.05 0.00 -1.02 0.00 0.00 32.46 30.16 2ds5 n ARG 48 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ds5 n GLU 49 N -1.83 -2.24 -3.74 5.56 1.02 0.13 -5.00 120.64 114.54 2ds5 n GLU 49 Ca 0.06 0.59 -0.11 0.00 -0.02 0.00 0.00 57.16 57.69 2ds5 n GLU 49 Cb 0.38 -4.77 -0.06 0.00 -0.02 0.00 0.00 31.44 26.96 2ds5 n GLU 49 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2ds5 s GLU 50 N -5.59 0.90 0.00 3.49 -1.05 -0.92 -5.05 118.70 110.49 2ds5 s GLU 50 Ca 0.37 -0.66 0.00 0.00 -0.15 0.00 0.00 54.97 54.53 2ds5 s GLU 50 Cb -0.11 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 33.97 2ds5 s GLU 50 CO 0.82 -0.31 0.49 -0.89 0.95 0.00 0.00 175.26 176.32