#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2did n SER 2 N 0.00 0.51 -3.53 1.61 3.41 -1.26 -4.82 113.62 109.54 2did n SER 2 Ca 0.00 0.43 -0.07 0.00 -0.26 0.00 0.00 58.87 58.96 2did n SER 2 Cb 0.00 -0.85 -0.02 0.00 -0.26 0.00 0.00 64.21 63.08 2did n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2did s SER 3 N 6.83 -0.31 -0.15 4.04 1.04 -1.26 -5.17 113.70 118.73 2did s SER 3 Ca 1.19 0.03 -0.07 0.00 0.48 0.00 0.00 55.95 57.57 2did s SER 3 Cb -1.30 0.32 0.06 0.00 0.10 0.00 0.00 66.02 65.20 2did s SER 3 CO 0.55 -0.50 0.34 -0.83 0.98 0.00 0.00 173.24 173.78 2did s GLY 4 N -2.31 -0.25 0.02 7.32 0.00 -1.26 -5.16 107.32 105.69 2did s GLY 4 Ca 0.06 1.28 0.04 0.00 0.00 0.00 0.00 44.72 46.09 2did s GLY 4 CO -0.07 1.73 -0.11 -0.56 0.00 0.00 0.00 173.10 174.09 2did s SER 5 N 1.73 1.28 -0.58 1.64 0.01 -1.26 -5.05 113.70 111.46 2did s SER 5 Ca -0.06 -0.37 0.01 0.00 1.31 0.00 0.00 55.95 56.84 2did s SER 5 Cb -0.10 -0.08 0.43 0.00 0.21 0.00 0.00 66.02 66.48 2did s SER 5 CO -0.11 0.01 1.71 -1.20 0.41 0.00 0.00 173.24 174.06 2did n SER 6 N 2.14 6.61 -2.15 2.44 7.64 -1.26 -4.99 113.62 124.05 2did n SER 6 Ca -0.17 -3.78 0.00 0.00 1.01 0.00 0.00 58.87 55.93 2did n SER 6 Cb 0.55 -0.77 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 2did n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2did n GLY 7 N -0.73 -5.45 3.63 0.23 0.00 -1.26 -5.09 105.19 96.51 2did n GLY 7 Ca 0.53 -0.03 -0.11 0.00 0.00 0.00 0.00 46.02 46.41 2did n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2did s GLU 8 N -0.81 0.61 -0.06 1.61 -1.05 -1.26 -5.04 118.70 112.70 2did s GLU 8 Ca 0.00 0.68 0.05 0.00 -0.15 0.00 0.00 54.97 55.54 2did s GLU 8 Cb 0.00 0.30 -0.02 0.00 -0.44 0.00 0.00 34.13 33.97 2did s GLU 8 CO 0.00 -0.08 -0.19 -1.12 0.95 0.00 0.00 175.26 174.82 2did s SER 9 N 0.18 3.59 0.04 0.83 0.01 -1.26 -5.08 113.70 112.00 2did s SER 9 Ca 0.02 -0.35 0.05 0.00 1.31 0.00 0.00 55.95 56.98 2did s SER 9 Cb -0.05 -0.86 -0.02 0.00 0.21 0.00 0.00 66.02 65.30 2did s SER 9 CO -0.04 0.29 -0.14 -0.76 0.41 0.00 0.00 173.24 173.00 2did s LEU 10 N -0.40 2.16 0.21 2.44 1.43 -1.26 -0.59 118.68 122.67 2did s LEU 10 Ca 0.04 -0.45 -0.32 0.00 -1.03 0.00 0.00 54.13 52.37 2did s LEU 10 Cb -0.12 -0.62 -0.14 0.00 0.03 0.00 0.00 46.19 45.34 2did s LEU 10 CO 0.02 0.04 1.39 0.00 0.23 0.00 0.00 176.35 178.03 2did n PRO 12 N 2.18 0.49 0.00 0.00 -0.04 -1.26 0.16 135.00 136.53 2did n PRO 12 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2did n PRO 12 Cb 0.30 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2did n PRO 12 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2did n GLN 13 N -0.89 0.84 -0.05 0.54 6.02 -1.26 -4.79 117.38 117.78 2did n GLN 13 Ca 0.09 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.14 2did n GLN 13 Cb 0.04 -0.78 0.08 0.00 1.02 0.00 0.00 30.24 30.61 2did n GLN 13 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2did n HIS 14 N -1.78 0.14 -2.85 1.08 8.25 -1.18 -4.96 115.22 113.92 2did n HIS 14 Ca 0.00 -0.14 -0.14 0.00 -0.26 0.00 0.00 57.72 57.18 2did n HIS 14 Cb 0.28 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 2did n HIS 14 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2did n HIS 15 N 0.67 -1.35 -4.00 4.41 8.25 0.42 -4.75 115.22 118.87 2did n HIS 15 Ca 0.09 0.22 -0.31 0.00 -0.26 0.00 0.00 57.72 57.45 2did n HIS 15 Cb 0.34 -1.08 -0.06 0.00 1.12 0.00 0.00 29.99 30.32 2did n HIS 15 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2did s GLU 16 N -4.83 3.18 -0.20 -0.41 2.02 -1.26 -4.58 118.70 112.62 2did s GLU 16 Ca 0.27 -0.52 -0.40 0.00 0.02 0.00 0.00 54.97 54.34 2did s GLU 16 Cb -0.16 -2.91 -0.17 0.00 0.10 0.00 0.00 34.13 31.00 2did s GLU 16 CO 0.33 0.61 1.59 0.00 0.02 0.00 0.00 175.26 177.81 2did n ALA 17 N 0.60 -0.74 -2.56 5.21 0.00 -1.26 -0.86 120.51 120.90 2did n ALA 17 Ca -0.08 0.45 -0.42 0.00 0.00 0.00 0.00 53.44 53.38 2did n ALA 17 Cb 0.52 -2.12 -0.06 0.00 0.00 0.00 0.00 19.45 17.79 2did n ALA 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2did s LEU 18 N 2.50 4.24 0.00 0.00 1.43 0.24 -4.55 118.68 122.54 2did s LEU 18 Ca 0.95 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 2did s LEU 18 Cb -1.11 -2.92 0.00 0.00 0.03 0.00 0.00 46.19 42.19 2did s LEU 18 CO 0.62 -0.78 0.00 -0.24 0.23 0.00 0.00 176.35 176.19 2did n SER 19 N 6.44 3.96 -4.93 2.29 2.88 -1.21 -4.83 113.62 118.21 2did n SER 19 Ca 0.01 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.31 2did n SER 19 Cb 0.48 0.35 0.03 0.00 -0.75 0.00 0.00 64.21 64.33 2did n SER 19 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2did s LEU 20 N -3.59 3.33 -0.13 2.46 1.43 -1.15 0.17 118.68 121.20 2did s LEU 20 Ca 0.00 0.48 -0.08 0.00 -1.03 0.00 0.00 54.13 53.51 2did s LEU 20 Cb 0.00 -3.32 0.05 0.00 0.03 0.00 0.00 46.19 42.95 2did s LEU 20 CO 0.00 -1.00 0.31 0.12 0.23 0.00 0.00 176.35 176.01 2did s PHE 21 N -2.85 -0.41 -0.01 0.29 2.19 -0.19 -1.41 117.98 115.58 2did s PHE 21 Ca 0.53 0.95 -0.07 0.00 0.33 0.00 0.00 56.93 58.67 2did s PHE 21 Cb -0.10 0.13 -0.05 0.00 -1.31 0.00 0.00 43.02 41.69 2did s PHE 21 CO 0.42 -0.25 0.26 0.00 1.83 0.00 0.00 175.22 177.48 2did h TYR 23 N 4.17 0.00 -0.94 0.00 -1.99 -1.73 -2.19 116.97 114.30 2did h TYR 23 Ca -0.51 0.00 0.11 0.00 2.00 0.00 0.00 58.73 60.33 2did h TYR 23 Cb 1.20 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 39.80 2did h TYR 23 CO 0.69 0.00 -0.47 0.39 -0.00 0.00 0.00 178.16 178.78 2did n GLU 24 N -4.55 -0.32 0.02 4.88 4.71 -1.26 0.57 120.64 124.68 2did n GLU 24 Ca -0.02 1.43 -0.07 0.00 -0.01 0.00 0.00 57.16 58.49 2did n GLU 24 Cb 0.07 -2.11 0.11 0.00 -1.01 0.00 0.00 31.44 28.50 2did n GLU 24 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 2did h ASP 25 N 0.00 0.51 -2.47 1.62 5.19 -1.97 -3.47 116.42 115.82 2did h ASP 25 Ca 0.23 -0.25 -0.17 0.00 -0.62 0.00 0.00 57.03 56.23 2did h ASP 25 Cb 0.47 -0.14 0.04 0.00 0.18 0.00 0.00 39.33 39.87 2did h ASP 25 CO -0.90 0.91 -0.26 1.67 -3.12 0.00 0.00 179.24 177.54 2did n GLN 26 N -3.98 -2.52 -3.83 3.56 -0.06 0.19 -5.04 117.38 105.70 2did n GLN 26 Ca -0.02 0.37 -0.11 0.00 -2.00 0.00 0.00 57.00 55.23 2did n GLN 26 Cb 0.56 -4.05 -0.09 0.00 -4.06 0.00 0.00 30.24 22.60 2did n GLN 26 CO 0.00 0.00 0.00 -1.83 -0.20 0.00 0.00 177.06 175.03 2did s GLU 27 N -5.21 0.66 0.65 3.69 -1.05 -1.15 -5.02 118.70 111.27 2did s GLU 27 Ca 0.17 -0.51 -0.17 0.00 -0.15 0.00 0.00 54.97 54.31 2did s GLU 27 Cb -0.08 0.28 -0.01 0.00 -0.44 0.00 0.00 34.13 33.89 2did s GLU 27 CO 0.21 -0.19 1.24 0.00 0.95 0.00 0.00 175.26 177.48 2did s ALA 28 N -2.16 2.36 0.26 -0.84 0.00 -1.26 -2.63 121.76 117.50 2did s ALA 28 Ca -0.08 1.06 -0.04 0.00 0.00 0.00 0.00 51.96 52.90 2did s ALA 28 Cb -0.03 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 2did s ALA 28 CO -0.02 -1.53 0.32 0.14 0.00 0.00 0.00 175.76 174.68 2did s VAL 29 N -1.62 0.00 0.41 0.00 -7.23 -0.50 -4.85 120.40 106.61 2did s VAL 29 Ca 0.79 -1.74 0.08 0.00 -1.81 0.00 0.00 61.98 59.29 2did s VAL 29 Cb -0.33 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.13 2did s VAL 29 CO 0.39 0.00 0.28 0.00 -0.31 0.00 0.00 175.10 175.46 2did h LEU 31 N 1.23 0.86 -1.11 0.00 8.10 -1.93 0.31 115.31 122.77 2did h LEU 31 Ca -0.42 0.05 -0.06 0.00 0.11 0.00 0.00 57.88 57.56 2did h LEU 31 Cb 1.26 -0.12 -0.02 0.00 -0.44 0.00 0.00 40.66 41.34 2did h LEU 31 CO 0.63 0.44 -0.06 0.40 -4.11 0.00 0.00 178.44 175.74 2did h ILE 32 N 0.92 1.22 -0.38 0.15 2.04 -1.96 -2.31 117.51 117.19 2did h ILE 32 Ca 0.49 -0.93 -0.16 0.00 1.00 0.00 0.00 64.86 65.27 2did h ILE 32 Cb 0.57 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 2did h ILE 32 CO -0.26 0.31 -0.39 0.00 0.00 0.00 0.00 178.15 177.81 2did h ALA 34 N 0.76 0.35 0.00 0.00 0.00 -1.03 -2.67 119.26 116.67 2did h ALA 34 Ca 0.06 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2did h ALA 34 Cb 0.98 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2did h ALA 34 CO 0.10 -0.09 -0.19 -0.84 0.00 0.00 0.00 179.25 178.23 2did h ILE 35 N 0.30 0.37 -4.28 0.00 3.07 -1.42 -3.39 117.51 112.16 2did h ILE 35 Ca 0.09 -1.25 -0.52 0.00 1.55 0.00 0.00 64.86 64.73 2did h ILE 35 Cb 0.13 1.95 0.16 0.00 -0.27 0.00 0.00 36.82 38.79 2did h ILE 35 CO -0.01 0.18 0.29 -0.44 -1.05 0.00 0.00 178.15 177.12 2did s SER 36 N -6.18 3.86 0.14 2.16 0.01 0.16 -4.85 113.70 109.00 2did s SER 36 Ca 0.03 2.03 -0.18 0.00 1.31 0.00 0.00 55.95 59.15 2did s SER 36 Cb 0.08 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.75 2did s SER 36 CO 0.66 -2.47 1.79 -0.74 0.41 0.00 0.00 173.24 172.88 2did h HIS 37 N -1.29 0.33 -0.70 2.43 2.76 -1.88 -2.68 115.15 114.12 2did h HIS 37 Ca -0.44 0.01 0.25 0.00 -2.20 0.00 0.00 60.37 58.00 2did h HIS 37 Cb 1.25 -0.11 -0.13 0.00 1.55 0.00 0.00 27.41 29.98 2did h HIS 37 CO 0.54 0.20 0.24 0.25 -1.30 0.00 0.00 177.93 177.85 2did n THR 38 N -4.91 -0.30 -3.20 6.26 -2.24 -1.26 -1.04 114.28 107.59 2did n THR 38 Ca -0.01 1.47 -0.24 0.00 -2.27 0.00 0.00 64.05 63.01 2did n THR 38 Cb 0.05 -2.29 -0.06 0.00 -2.10 0.00 0.00 70.33 65.93 2did n THR 38 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2did n HIS 39 N -4.73 1.55 -0.08 4.78 8.25 -1.02 -4.91 115.22 119.06 2did n HIS 39 Ca 0.23 -3.85 -0.12 0.00 -0.26 0.00 0.00 57.72 53.72 2did n HIS 39 Cb 0.76 -0.44 -0.07 0.00 1.12 0.00 0.00 29.99 31.35 2did n HIS 39 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2did h ARG 40 N 3.59 0.00 -1.31 -0.41 9.65 -0.96 -3.39 114.38 121.54 2did h ARG 40 Ca 0.12 0.00 -0.67 0.00 -1.10 0.00 0.00 59.98 58.33 2did h ARG 40 Cb 0.78 0.00 -0.33 0.00 -1.39 0.00 0.00 29.97 29.03 2did h ARG 40 CO 0.63 0.59 0.39 0.00 2.80 0.00 0.00 179.97 184.38 2did n ALA 41 N -3.12 5.97 -2.23 2.80 0.00 -1.26 -5.00 120.51 117.67 2did n ALA 41 Ca -0.14 -3.84 -0.21 0.00 0.00 0.00 0.00 53.44 49.25 2did n ALA 41 Cb 0.40 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 2did n ALA 41 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2did s HIS 42 N -3.82 2.71 -0.90 0.00 3.76 -1.26 -5.06 115.29 110.71 2did s HIS 42 Ca 0.56 -0.49 -0.16 0.00 -0.15 0.00 0.00 55.06 54.82 2did s HIS 42 Cb 0.46 -2.16 0.18 0.00 1.11 0.00 0.00 32.58 32.16 2did s HIS 42 CO -0.14 -0.11 0.98 0.99 -0.85 0.00 0.00 174.74 175.61 2did s THR 43 N -2.48 5.17 -0.12 1.30 2.01 -1.26 -5.02 115.64 115.24 2did s THR 43 Ca 0.48 -2.07 -0.09 0.00 0.31 0.00 0.00 61.69 60.32 2did s THR 43 Cb -0.03 -4.64 -0.04 0.00 0.01 0.00 0.00 72.50 67.79 2did s THR 43 CO 0.28 -1.29 0.19 -0.69 -0.69 0.00 0.00 174.62 172.41 2did s VAL 44 N 1.41 5.41 0.02 3.82 1.01 -1.26 -2.01 120.40 128.80 2did s VAL 44 Ca 0.27 0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.60 2did s VAL 44 Cb -0.07 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 2did s VAL 44 CO -0.09 0.56 -0.10 0.68 0.00 0.00 0.00 175.10 176.15 2did s VAL 45 N -0.63 0.79 -0.14 2.92 -7.23 0.26 -4.93 120.40 111.44 2did s VAL 45 Ca 0.15 -0.70 -0.29 0.00 -1.81 0.00 0.00 61.98 59.33 2did s VAL 45 Cb -0.13 -0.72 -0.04 0.00 0.56 0.00 0.00 36.38 36.06 2did s VAL 45 CO 0.04 0.03 1.55 -2.16 -0.31 0.00 0.00 175.10 174.25 2did s PRO 46 N -0.76 4.05 0.46 4.82 0.04 -1.26 -1.03 135.00 141.33 2did s PRO 46 Ca 0.00 1.88 -0.24 0.00 0.04 0.00 0.00 61.00 62.69 2did s PRO 46 Cb -0.06 -3.96 -0.07 0.00 0.04 0.00 0.00 34.50 30.45 2did s PRO 46 CO 0.00 -0.98 1.24 -0.51 0.04 0.00 0.00 177.00 176.80 2did s LEU 47 N 4.34 4.05 -0.23 -3.56 1.43 0.13 -4.90 118.68 119.94 2did s LEU 47 Ca 0.69 2.50 -0.00 0.00 -1.03 0.00 0.00 54.13 56.28 2did s LEU 47 Cb -0.28 -4.13 0.17 0.00 0.03 0.00 0.00 46.19 41.98 2did s LEU 47 CO 0.26 -1.01 1.90 -1.20 0.23 0.00 0.00 176.35 176.53 2did n SER 48 N -0.38 5.72 -1.74 2.29 7.64 -1.26 -4.89 113.62 120.99 2did n SER 48 Ca 0.07 -2.85 0.00 0.00 1.01 0.00 0.00 58.87 57.09 2did n SER 48 Cb 0.46 -1.00 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 2did n SER 48 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2did n GLY 49 N 0.51 0.84 3.55 0.23 0.00 -1.26 -4.98 105.19 104.09 2did n GLY 49 Ca 0.22 -1.94 -0.36 0.00 0.00 0.00 0.00 46.02 43.94 2did n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2did s PRO 50 N -1.15 2.61 -0.54 1.61 0.04 -1.26 -4.91 135.00 131.40 2did s PRO 50 Ca 0.00 0.45 0.04 0.00 0.04 0.00 0.00 61.00 61.53 2did s PRO 50 Cb 0.00 -4.51 0.14 0.00 0.04 0.00 0.00 34.50 30.18 2did s PRO 50 CO 0.00 -2.85 0.32 0.45 0.04 0.00 0.00 177.00 174.96 2did s SER 51 N 8.10 4.05 -0.17 6.66 0.15 -1.26 -4.94 113.70 126.29 2did s SER 51 Ca 0.68 -3.13 -0.14 0.00 0.70 0.00 0.00 55.95 54.07 2did s SER 51 Cb -0.12 -1.37 -0.07 0.00 -1.71 0.00 0.00 66.02 62.75 2did s SER 51 CO 0.17 -0.20 -0.17 -1.20 1.20 0.00 0.00 173.24 173.04 2did n SER 52 N 2.92 1.86 -0.27 5.45 7.64 -1.26 -5.24 113.62 124.71 2did n SER 52 Ca 0.12 0.51 0.03 0.00 1.01 0.00 0.00 58.87 60.54 2did n SER 52 Cb 0.35 -0.85 0.03 0.00 -1.01 0.00 0.00 64.21 62.72 2did n SER 52 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64