#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 1.40 -4.61 1.61 2.88 -1.26 -5.04 113.62 108.59 2did n SER 2 Ca 0.00 0.24 -0.26 0.00 -1.33 0.00 0.00 58.87 57.52 2did n SER 2 Cb 0.00 -0.56 -0.08 0.00 -0.75 0.00 0.00 64.21 62.81 2did n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2did s SER 3 N -6.52 4.45 0.00 -3.46 0.15 -1.26 -5.09 113.70 101.98 2did s SER 3 Ca -0.25 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 55.84 2did s SER 3 Cb 0.08 -0.82 0.00 0.00 -1.71 0.00 0.00 66.02 63.57 2did s SER 3 CO 0.32 0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.44 2did n GLY 4 N -0.28 3.95 3.76 9.45 0.00 -1.26 -5.15 105.19 115.66 2did n GLY 4 Ca -0.09 -1.52 -0.27 0.00 0.00 0.00 0.00 46.02 44.14 2did n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2did s SER 5 N 0.00 4.33 -0.11 1.61 0.01 -1.26 -5.05 113.70 113.24 2did s SER 5 Ca 0.00 -1.27 -0.02 0.00 1.31 0.00 0.00 55.95 55.97 2did s SER 5 Cb 0.00 -0.08 -0.03 0.00 0.21 0.00 0.00 66.02 66.12 2did s SER 5 CO 0.00 -0.71 -0.02 -0.55 0.41 0.00 0.00 173.24 172.38 2did s SER 6 N -3.95 5.06 0.23 2.44 0.15 -1.26 -5.01 113.70 111.36 2did s SER 6 Ca 0.31 0.05 -0.10 0.00 0.70 0.00 0.00 55.95 56.91 2did s SER 6 Cb 0.03 -1.53 0.35 0.00 -1.71 0.00 0.00 66.02 63.16 2did s SER 6 CO 0.17 0.31 1.63 1.23 1.20 0.00 0.00 173.24 177.78 2did h GLY 7 N 5.66 0.67 -1.22 9.45 0.00 -2.08 -3.42 103.07 112.13 2did h GLY 7 Ca -0.45 0.16 -0.57 0.00 0.00 0.00 0.00 47.33 46.48 2did h GLY 7 CO 0.57 -0.27 -0.28 -0.54 0.00 0.00 0.00 176.54 176.02 2did s GLU 8 N -6.17 2.27 0.23 4.80 0.41 -1.26 -5.14 118.70 113.84 2did s GLU 8 Ca -0.14 -1.95 0.07 0.00 -0.41 0.00 0.00 54.97 52.54 2did s GLU 8 Cb 0.21 -2.19 -0.04 0.00 -1.78 0.00 0.00 34.13 30.34 2did s GLU 8 CO 0.75 -0.64 0.18 -1.12 -0.49 0.00 0.00 175.26 173.94 2did s SER 9 N -4.33 5.49 -0.06 -0.19 0.01 -1.26 -5.09 113.70 108.27 2did s SER 9 Ca 0.39 -0.23 -0.22 0.00 1.31 0.00 0.00 55.95 57.19 2did s SER 9 Cb -0.03 -1.40 0.05 0.00 0.21 0.00 0.00 66.02 64.85 2did s SER 9 CO 0.24 -0.01 0.51 -0.76 0.41 0.00 0.00 173.24 173.63 2did s LEU 10 N -3.65 0.05 0.24 2.44 1.43 -1.26 -3.18 118.68 114.74 2did s LEU 10 Ca 0.32 0.53 -0.30 0.00 -1.03 0.00 0.00 54.13 53.65 2did s LEU 10 Cb -0.08 1.91 -0.10 0.00 0.03 0.00 0.00 46.19 47.94 2did s LEU 10 CO 0.24 -0.47 1.46 0.00 0.23 0.00 0.00 176.35 177.82 2did n PRO 12 N 2.49 0.45 0.00 0.00 -0.04 -1.26 0.20 135.00 136.84 2did n PRO 12 Ca 0.08 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2did n PRO 12 Cb 0.40 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.04 0.34 -0.06 0.54 6.02 -1.26 -4.82 117.38 117.09 2did n GLN 13 Ca 0.11 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.05 2did n GLN 13 Cb 0.06 -0.99 -0.12 0.00 1.02 0.00 0.00 30.24 30.21 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 -2.44 0.00 -3.17 1.08 8.25 -1.18 -5.02 115.22 112.73 2did n HIS 14 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 2did n HIS 14 Cb 0.49 -0.67 0.06 0.00 1.12 0.00 0.00 29.99 30.99 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 -2.47 -1.84 -4.88 4.41 8.25 0.53 -4.86 115.22 114.35 2did n HIS 15 Ca -0.21 0.68 -0.31 0.00 -0.26 0.00 0.00 57.72 57.62 2did n HIS 15 Cb 0.89 -3.82 -0.14 0.00 1.12 0.00 0.00 29.99 28.04 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 -5.64 2.05 -0.52 -0.41 0.41 -1.26 -4.61 118.70 108.72 2did s GLU 16 Ca 0.30 -0.97 -0.40 0.00 -0.41 0.00 0.00 54.97 53.48 2did s GLU 16 Cb -0.13 -2.12 -0.18 0.00 -1.78 0.00 0.00 34.13 29.91 2did s GLU 16 CO 0.49 0.55 2.08 0.00 -0.49 0.00 0.00 175.26 177.89 2did n ALA 17 N 1.88 0.21 -2.29 5.21 0.00 -1.25 -2.45 120.51 121.83 2did n ALA 17 Ca -0.16 0.13 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 2did n ALA 17 Cb 0.52 -1.98 -0.02 0.00 0.00 0.00 0.00 19.45 17.96 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 5.97 4.25 0.00 0.00 1.43 -1.19 -4.66 118.68 124.48 2did s LEU 18 Ca 1.15 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 56.16 2did s LEU 18 Cb -1.39 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 41.28 2did s LEU 18 CO 0.61 -0.77 0.00 -0.24 0.23 0.00 0.00 176.35 176.17 2did n SER 19 N 6.34 3.33 -4.98 2.29 2.88 -1.24 -4.92 113.62 117.33 2did n SER 19 Ca 0.14 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.48 2did n SER 19 Cb 0.44 0.38 0.00 0.00 -0.75 0.00 0.00 64.21 64.29 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 -2.85 3.85 -0.18 2.46 1.43 -1.14 -0.02 118.68 122.23 2did s LEU 20 Ca 0.00 -0.01 -0.06 0.00 -1.03 0.00 0.00 54.13 53.03 2did s LEU 20 Cb 0.00 -2.90 0.08 0.00 0.03 0.00 0.00 46.19 43.40 2did s LEU 20 CO 0.00 -0.54 0.39 0.12 0.23 0.00 0.00 176.35 176.55 2did s PHE 21 N -2.32 -0.72 0.24 0.29 2.19 0.14 -1.60 117.98 116.20 2did s PHE 21 Ca 0.46 1.41 -0.30 0.00 0.33 0.00 0.00 56.93 58.83 2did s PHE 21 Cb -0.10 0.23 -0.09 0.00 -1.31 0.00 0.00 43.02 41.76 2did s PHE 21 CO 0.34 -0.45 1.20 0.00 1.83 0.00 0.00 175.22 178.14 2did h TYR 23 N 4.54 0.00 -0.72 0.00 3.20 -1.04 -1.72 116.97 121.23 2did h TYR 23 Ca -0.46 0.00 0.16 0.00 3.14 0.00 0.00 58.73 61.57 2did h TYR 23 Cb 1.22 0.00 -0.13 0.00 1.54 0.00 0.00 36.73 39.36 2did h TYR 23 CO 0.60 0.00 -0.06 1.49 -1.64 0.00 0.00 178.16 178.55 2did h GLU 24 N -0.64 0.06 0.00 1.82 4.57 -1.94 0.42 114.58 118.87 2did h GLU 24 Ca 0.00 -0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 2did h GLU 24 Cb 0.08 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 2did h GLU 24 CO 0.00 0.04 -0.48 -0.44 -1.18 0.00 0.00 179.01 176.95 2did h ASP 25 N 0.06 0.00 -5.35 1.04 3.32 -1.94 -3.47 116.42 110.09 2did h ASP 25 Ca 0.38 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.08 2did h ASP 25 Cb 0.63 0.00 0.13 0.00 0.22 0.00 0.00 39.33 40.31 2did h ASP 25 CO -0.67 0.48 -0.63 0.00 -1.72 0.00 0.00 179.24 176.70 2did n GLN 26 N -3.48 -6.94 -4.28 3.56 1.13 0.15 -5.01 117.38 102.51 2did n GLN 26 Ca 0.00 0.75 -0.17 0.00 -1.94 0.00 0.00 57.00 55.64 2did n GLN 26 Cb 0.61 -5.54 -0.09 0.00 0.11 0.00 0.00 30.24 25.32 2did n GLN 26 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2did s GLU 27 N -5.98 1.55 0.05 -1.09 2.02 -1.02 -5.00 118.70 109.23 2did s GLU 27 Ca 0.42 -1.88 -0.17 0.00 0.02 0.00 0.00 54.97 53.36 2did s GLU 27 Cb -0.18 0.18 -0.06 0.00 0.10 0.00 0.00 34.13 34.16 2did s GLU 27 CO 0.66 -0.52 0.51 0.00 0.02 0.00 0.00 175.26 175.93 2did s ALA 28 N -3.69 3.63 0.20 5.21 0.00 -1.26 -1.04 121.76 124.80 2did s ALA 28 Ca 0.39 -0.07 0.03 0.00 0.00 0.00 0.00 51.96 52.31 2did s ALA 28 Cb 0.04 -2.54 -0.05 0.00 0.00 0.00 0.00 23.12 20.58 2did s ALA 28 CO 0.20 0.43 -0.01 0.14 0.00 0.00 0.00 175.76 176.53 2did s VAL 29 N -1.13 0.88 0.54 0.00 -7.23 -0.63 -4.84 120.40 107.99 2did s VAL 29 Ca 0.28 -2.01 0.04 0.00 -1.81 0.00 0.00 61.98 58.47 2did s VAL 29 Cb -0.18 -2.23 0.02 0.00 0.56 0.00 0.00 36.38 34.56 2did s VAL 29 CO 0.17 -0.41 0.27 0.00 -0.31 0.00 0.00 175.10 174.82 2did h LEU 31 N 0.94 -0.49 -0.88 0.00 5.85 -1.90 -2.50 115.31 116.33 2did h LEU 31 Ca -0.39 0.04 0.23 0.00 0.84 0.00 0.00 57.88 58.60 2did h LEU 31 Cb 1.31 0.16 -0.15 0.00 0.37 0.00 0.00 40.66 42.35 2did h LEU 31 CO 0.63 -0.23 0.16 0.40 -0.34 0.00 0.00 178.44 179.05 2did h ILE 32 N -0.35 0.25 -0.17 4.05 2.04 -1.99 -0.78 117.51 120.56 2did h ILE 32 Ca -0.02 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.82 2did h ILE 32 Cb 0.31 0.10 -0.07 0.00 -0.74 0.00 0.00 36.82 36.42 2did h ILE 32 CO -0.02 0.03 -0.53 0.00 0.00 0.00 0.00 178.15 177.63 2did h ALA 34 N -0.19 -0.54 -1.01 0.00 0.00 -0.71 -1.00 119.26 115.81 2did h ALA 34 Ca 0.05 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 55.20 2did h ALA 34 Cb 0.67 0.68 -0.08 0.00 0.00 0.00 0.00 17.79 19.06 2did h ALA 34 CO -0.45 -0.59 0.66 -0.84 0.00 0.00 0.00 179.25 178.03 2did h ILE 35 N -0.14 0.56 -3.45 0.00 3.07 -1.32 -3.35 117.51 112.87 2did h ILE 35 Ca 0.01 -0.13 -0.48 0.00 1.55 0.00 0.00 64.86 65.81 2did h ILE 35 Cb 0.16 0.16 0.21 0.00 -0.27 0.00 0.00 36.82 37.08 2did h ILE 35 CO -0.11 0.07 -0.18 -0.24 -1.05 0.00 0.00 178.15 176.64 2did n SER 36 N -4.56 -1.22 -1.81 2.16 2.88 0.17 -4.86 113.62 106.38 2did n SER 36 Ca 0.24 0.10 -0.14 0.00 -1.33 0.00 0.00 58.87 57.74 2did n SER 36 Cb 0.85 -1.28 0.04 0.00 -0.75 0.00 0.00 64.21 63.07 2did n SER 36 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2did n HIS 37 N -4.48 1.30 -0.04 0.66 -0.00 -1.26 -3.93 115.22 107.47 2did n HIS 37 Ca 0.06 -1.76 -0.06 0.00 0.46 0.00 0.00 57.72 56.42 2did n HIS 37 Cb 0.54 -0.86 -0.03 0.00 -0.12 0.00 0.00 29.99 29.52 2did n HIS 37 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 2did n THR 38 N 0.47 0.42 -2.27 3.57 -1.04 -1.26 -4.79 114.28 109.38 2did n THR 38 Ca 0.25 -0.14 -0.18 0.00 -2.04 0.00 0.00 64.05 61.94 2did n THR 38 Cb 0.60 -1.07 0.03 0.00 -1.82 0.00 0.00 70.33 68.07 2did n THR 38 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2did n HIS 39 N -2.95 2.37 -0.00 -1.42 8.25 -1.25 -4.85 115.22 115.36 2did n HIS 39 Ca -0.14 -2.26 -0.01 0.00 -0.26 0.00 0.00 57.72 55.04 2did n HIS 39 Cb 0.63 -0.30 -0.01 0.00 1.12 0.00 0.00 29.99 31.43 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 2.33 -0.09 -1.98 -0.41 9.65 -1.70 -3.34 114.38 118.85 2did h ARG 40 Ca 0.22 0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 59.04 2did h ARG 40 Cb 1.43 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 30.00 2did h ARG 40 CO 0.61 -0.06 -0.08 0.00 2.80 0.00 0.00 179.97 183.24 2did n ALA 41 N -2.68 4.73 -2.52 2.80 0.00 -1.26 -4.83 120.51 116.75 2did n ALA 41 Ca -0.01 -0.62 -0.24 0.00 0.00 0.00 0.00 53.44 52.57 2did n ALA 41 Cb 0.04 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.00 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 0.15 2.11 -1.08 0.00 3.76 -1.25 -5.09 115.29 113.89 2did s HIS 42 Ca 0.20 -0.90 -0.11 0.00 -0.15 0.00 0.00 55.06 54.10 2did s HIS 42 Cb 0.10 -1.43 0.24 0.00 1.11 0.00 0.00 32.58 32.60 2did s HIS 42 CO -0.00 0.12 1.13 0.99 -0.85 0.00 0.00 174.74 176.12 2did s THR 43 N -3.11 5.66 -0.08 1.30 2.01 -1.26 -5.02 115.64 115.14 2did s THR 43 Ca 0.34 -2.99 -0.22 0.00 0.31 0.00 0.00 61.69 59.13 2did s THR 43 Cb 0.08 -4.66 -0.04 0.00 0.01 0.00 0.00 72.50 67.90 2did s THR 43 CO 0.16 -1.27 0.63 -0.69 -0.69 0.00 0.00 174.62 172.76 2did s VAL 44 N -0.19 5.09 0.04 3.82 1.01 -1.26 -0.42 120.40 128.48 2did s VAL 44 Ca 0.31 1.30 0.09 0.00 0.00 0.00 0.00 61.98 63.68 2did s VAL 44 Cb -0.08 -3.97 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 2did s VAL 44 CO -0.07 0.28 -0.25 0.68 0.00 0.00 0.00 175.10 175.74 2did s VAL 45 N 0.74 2.27 0.21 2.92 -7.23 0.46 -4.91 120.40 114.85 2did s VAL 45 Ca 0.34 -1.31 -0.30 0.00 -1.81 0.00 0.00 61.98 58.90 2did s VAL 45 Cb -0.17 -1.88 -0.09 0.00 0.56 0.00 0.00 36.38 34.80 2did s VAL 45 CO 0.16 0.39 1.30 -2.16 -0.31 0.00 0.00 175.10 174.48 2did s PRO 46 N -1.20 4.40 -0.10 4.82 0.04 -1.26 -0.69 135.00 141.01 2did s PRO 46 Ca 0.12 2.05 -0.06 0.00 0.04 0.00 0.00 61.00 63.14 2did s PRO 46 Cb -0.10 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 2did s PRO 46 CO 0.02 -0.23 -0.12 -0.07 0.04 0.00 0.00 177.00 176.64 2did h LEU 47 N 5.23 0.00 -9.23 -3.56 3.38 -0.74 -3.47 115.31 106.92 2did h LEU 47 Ca -0.45 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 56.89 2did h LEU 47 Cb 1.21 0.00 0.13 0.00 0.09 0.00 0.00 40.66 42.09 2did h LEU 47 CO 0.76 0.55 -0.37 -0.24 0.09 0.00 0.00 178.44 179.23 2did n SER 48 N -4.02 -0.68 0.00 -0.43 2.88 -1.24 -4.92 113.62 105.21 2did n SER 48 Ca -0.05 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.52 2did n SER 48 Cb 0.18 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 2did n SER 48 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2did n GLY 49 N 1.77 4.48 0.00 0.46 0.00 -1.26 -4.93 105.19 105.71 2did n GLY 49 Ca 0.13 -0.88 0.06 0.00 0.00 0.00 0.00 46.02 45.32 2did n GLY 49 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2did n PRO 50 N -1.68 0.49 -2.76 1.61 -0.04 -1.26 -4.81 135.00 126.55 2did n PRO 50 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 2did n PRO 50 Cb 0.00 -1.36 0.02 0.00 -0.04 0.00 0.00 33.50 32.13 2did n PRO 50 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2did n SER 51 N -0.86 -3.10 -0.09 3.54 2.88 -1.26 -4.98 113.62 109.75 2did n SER 51 Ca 0.08 -0.16 -0.19 0.00 -1.33 0.00 0.00 58.87 57.27 2did n SER 51 Cb 0.04 -1.82 -0.07 0.00 -0.75 0.00 0.00 64.21 61.61 2did n SER 51 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2did n SER 52 N -0.07 1.41 0.00 -3.46 7.64 -1.26 -5.31 113.62 112.57 2did n SER 52 Ca -0.01 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.06 2did n SER 52 Cb 0.52 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 2did n SER 52 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64