#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2did s SER 2 N 0.00 5.50 0.29 1.61 0.01 -1.26 -5.10 113.70 114.76 2did s SER 2 Ca 0.00 0.01 -0.28 0.00 1.31 0.00 0.00 55.95 56.99 2did s SER 2 Cb 0.00 -1.49 -0.09 0.00 0.21 0.00 0.00 66.02 64.65 2did s SER 2 CO 0.00 0.20 0.97 -0.55 0.41 0.00 0.00 173.24 174.26 2did s SER 3 N -2.21 7.42 -0.68 2.44 0.15 -1.26 -4.86 113.70 114.70 2did s SER 3 Ca 0.27 1.94 -0.29 0.00 0.70 0.00 0.00 55.95 58.58 2did s SER 3 Cb -0.12 -2.60 -0.17 0.00 -1.71 0.00 0.00 66.02 61.42 2did s SER 3 CO 0.20 -0.01 2.04 0.61 1.20 0.00 0.00 173.24 177.28 2did n GLY 4 N 0.98 -0.31 3.73 9.45 0.00 -1.26 -4.84 105.19 112.95 2did n GLY 4 Ca 0.00 0.93 -0.40 0.00 0.00 0.00 0.00 46.02 46.56 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 6.51 7.10 -0.35 1.61 0.01 -1.26 -5.04 113.70 122.27 2did s SER 5 Ca 1.06 1.32 0.04 0.00 1.31 0.00 0.00 55.95 59.67 2did s SER 5 Cb -1.09 -2.44 0.10 0.00 0.21 0.00 0.00 66.02 62.81 2did s SER 5 CO 0.44 -0.05 0.08 -0.44 0.41 0.00 0.00 173.24 173.68 2did s SER 6 N 0.38 4.64 0.00 2.44 0.01 -1.26 -5.07 113.70 114.84 2did s SER 6 Ca 0.38 -2.19 0.00 0.00 1.31 0.00 0.00 55.95 55.45 2did s SER 6 Cb -0.19 -1.55 0.00 0.00 0.21 0.00 0.00 66.02 64.49 2did s SER 6 CO 0.20 -0.37 0.00 0.61 0.41 0.00 0.00 173.24 174.10 2did n GLY 7 N 4.19 1.61 3.15 3.44 0.00 -1.26 -4.72 105.19 111.60 2did n GLY 7 Ca 0.04 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 0.78 0.21 1.61 1.03 -1.26 -5.12 118.70 115.95 2did s GLU 8 Ca 0.00 -1.27 -0.32 0.00 0.03 0.00 0.00 54.97 53.41 2did s GLU 8 Cb 0.00 -0.14 -0.14 0.00 -0.80 0.00 0.00 34.13 33.05 2did s GLU 8 CO 0.00 -0.03 1.47 -1.13 -1.33 0.00 0.00 175.26 174.24 2did n SER 9 N 0.09 2.88 -3.71 0.83 3.41 -1.26 -4.99 113.62 110.87 2did n SER 9 Ca -0.13 1.12 -0.11 0.00 -0.26 0.00 0.00 58.87 59.49 2did n SER 9 Cb 0.60 -1.43 -0.11 0.00 -0.26 0.00 0.00 64.21 63.01 2did n SER 9 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2did s LEU 10 N 0.33 0.10 0.22 1.04 1.43 -1.26 -3.09 118.68 117.45 2did s LEU 10 Ca 0.72 0.77 -0.32 0.00 -1.03 0.00 0.00 54.13 54.27 2did s LEU 10 Cb -0.66 1.16 -0.14 0.00 0.03 0.00 0.00 46.19 46.58 2did s LEU 10 CO 0.46 -0.18 1.43 0.00 0.23 0.00 0.00 176.35 178.29 2did n PRO 12 N 2.27 0.49 0.00 0.00 -0.04 -1.26 0.19 135.00 136.65 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 0.31 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 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 -0.88 0.51 -0.01 0.54 6.02 -1.26 -4.84 117.38 117.46 2did n GLN 13 Ca 0.09 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.13 2did n GLN 13 Cb 0.04 -0.82 -0.11 0.00 1.02 0.00 0.00 30.24 30.37 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 -2.01 0.00 -2.66 1.08 8.25 -1.18 -5.00 115.22 113.69 2did n HIS 14 Ca 0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.25 2did n HIS 14 Cb 0.32 -0.36 0.01 0.00 1.12 0.00 0.00 29.99 31.09 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 -2.05 -1.39 -3.98 4.41 8.25 0.50 -4.83 115.22 116.14 2did n HIS 15 Ca -0.05 0.23 -0.31 0.00 -0.26 0.00 0.00 57.72 57.34 2did n HIS 15 Cb 0.43 -4.10 -0.05 0.00 1.12 0.00 0.00 29.99 27.39 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 -5.30 3.19 -0.30 -0.41 8.01 -1.26 -4.49 118.70 118.15 2did s GLU 16 Ca 0.13 -0.55 -0.41 0.00 0.01 0.00 0.00 54.97 54.15 2did s GLU 16 Cb -0.06 -2.90 -0.16 0.00 -4.31 0.00 0.00 34.13 26.70 2did s GLU 16 CO 0.17 0.59 1.71 0.00 0.01 0.00 0.00 175.26 177.73 2did n ALA 17 N 0.35 -0.40 -2.76 5.21 0.00 -1.25 -1.91 120.51 119.75 2did n ALA 17 Ca -0.07 0.41 -0.43 0.00 0.00 0.00 0.00 53.44 53.35 2did n ALA 17 Cb 0.51 -2.17 -0.02 0.00 0.00 0.00 0.00 19.45 17.77 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 3.35 4.35 -0.38 0.00 1.43 -1.18 -4.11 118.68 122.14 2did s LEU 18 Ca 0.99 -1.97 0.06 0.00 -1.03 0.00 0.00 54.13 52.18 2did s LEU 18 Cb -1.13 -2.48 0.50 0.00 0.03 0.00 0.00 46.19 43.11 2did s LEU 18 CO 0.67 -1.21 1.56 -1.20 0.23 0.00 0.00 176.35 176.41 2did n SER 19 N 7.51 4.20 -3.31 2.29 7.64 -1.26 -4.95 113.62 125.75 2did n SER 19 Ca 0.31 -3.77 -0.11 0.00 1.01 0.00 0.00 58.87 56.31 2did n SER 19 Cb 0.49 -0.66 -0.02 0.00 -1.01 0.00 0.00 64.21 63.01 2did n SER 19 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2did s LEU 20 N -3.46 0.41 -0.30 -3.43 1.43 -1.22 -3.93 118.68 108.18 2did s LEU 20 Ca 0.51 -1.19 -0.12 0.00 -1.03 0.00 0.00 54.13 52.30 2did s LEU 20 Cb 0.44 2.15 0.13 0.00 0.03 0.00 0.00 46.19 48.93 2did s LEU 20 CO 0.01 -1.42 0.75 0.12 0.23 0.00 0.00 176.35 176.04 2did s PHE 21 N -3.01 -1.11 -0.66 0.29 5.36 0.36 -3.32 117.98 115.88 2did s PHE 21 Ca 0.22 1.97 -0.24 0.00 -0.96 0.00 0.00 56.93 57.92 2did s PHE 21 Cb -0.03 0.67 0.06 0.00 -0.34 0.00 0.00 43.02 43.37 2did s PHE 21 CO 0.14 -0.55 1.04 0.00 -1.46 0.00 0.00 175.22 174.39 2did h TYR 23 N 9.64 0.73 -0.39 0.00 5.03 -1.11 0.86 116.97 131.74 2did h TYR 23 Ca -0.28 0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.10 2did h TYR 23 Cb 1.07 -0.25 -0.05 0.00 1.55 0.00 0.00 36.73 39.05 2did h TYR 23 CO 1.00 0.45 0.12 1.49 -1.32 0.00 0.00 178.16 179.90 2did h GLU 24 N 0.78 0.25 -0.59 1.82 4.57 -1.90 -1.24 114.58 118.27 2did h GLU 24 Ca 0.22 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 2did h GLU 24 Cb -0.06 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.47 2did h GLU 24 CO -0.05 0.17 0.00 -0.25 -1.18 0.00 0.00 179.01 177.70 2did n ASP 25 N -5.04 3.30 -4.48 1.04 8.00 -0.93 -4.93 116.55 113.51 2did n ASP 25 Ca 0.02 -2.09 -0.40 0.00 0.71 0.00 0.00 54.79 53.03 2did n ASP 25 Cb 0.15 -0.42 -0.08 0.00 -0.02 0.00 0.00 41.12 40.76 2did n ASP 25 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2did n GLN 26 N 1.12 -1.01 -4.16 -1.24 -0.06 0.23 -4.89 117.38 107.37 2did n GLN 26 Ca 0.20 0.16 -0.10 0.00 -2.00 0.00 0.00 57.00 55.25 2did n GLN 26 Cb 0.55 -4.58 -0.10 0.00 -4.06 0.00 0.00 30.24 22.05 2did n GLN 26 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 2did s GLU 27 N -7.23 1.03 0.06 3.69 0.41 -0.80 -5.01 118.70 110.84 2did s GLU 27 Ca 0.69 -1.50 -0.11 0.00 -0.41 0.00 0.00 54.97 53.64 2did s GLU 27 Cb -0.40 0.25 -0.06 0.00 -1.78 0.00 0.00 34.13 32.14 2did s GLU 27 CO 1.01 -0.31 0.40 0.00 -0.49 0.00 0.00 175.26 175.88 2did s ALA 28 N -4.09 3.72 0.24 5.21 0.00 -1.26 -0.02 121.76 125.56 2did s ALA 28 Ca 0.29 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.94 2did s ALA 28 Cb 0.07 -2.30 -0.05 0.00 0.00 0.00 0.00 23.12 20.84 2did s ALA 28 CO 0.05 0.55 0.02 0.14 0.00 0.00 0.00 175.76 176.52 2did s VAL 29 N -1.32 0.91 0.28 0.00 -7.23 -1.21 -4.83 120.40 106.99 2did s VAL 29 Ca 0.31 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 58.48 2did s VAL 29 Cb -0.14 -2.42 0.02 0.00 0.56 0.00 0.00 36.38 34.40 2did s VAL 29 CO 0.17 -0.25 0.16 0.00 -0.31 0.00 0.00 175.10 174.87 2did h LEU 31 N 0.00 -0.91 -0.37 0.00 5.85 -1.88 -2.25 115.31 115.76 2did h LEU 31 Ca -0.19 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.66 2did h LEU 31 Cb 0.66 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 41.90 2did h LEU 31 CO 0.30 -0.44 -0.46 0.40 -0.34 0.00 0.00 178.44 177.90 2did h ILE 32 N -0.67 0.09 -0.95 4.05 2.04 -1.97 0.07 117.51 120.17 2did h ILE 32 Ca -0.04 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.09 2did h ILE 32 Cb 0.58 0.09 -0.17 0.00 -0.74 0.00 0.00 36.82 36.58 2did h ILE 32 CO -0.04 0.00 0.17 0.00 0.00 0.00 0.00 178.15 178.28 2did n ALA 34 N -2.86 -0.33 -0.22 0.00 0.00 -0.06 -2.98 120.51 114.06 2did n ALA 34 Ca 0.24 0.00 0.31 0.00 0.00 0.00 0.00 53.44 54.00 2did n ALA 34 Cb 0.80 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.93 2did n ALA 34 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2did h ILE 35 N 0.00 0.25 -4.12 0.00 3.07 -0.84 -3.36 117.51 112.49 2did h ILE 35 Ca 0.00 0.00 -0.50 0.00 1.55 0.00 0.00 64.86 65.91 2did h ILE 35 Cb 0.00 0.33 0.07 0.00 -0.27 0.00 0.00 36.82 36.95 2did h ILE 35 CO 0.00 0.00 0.40 -0.44 -1.05 0.00 0.00 178.15 177.06 2did s SER 36 N -4.61 5.67 0.00 2.16 0.01 0.16 -4.88 113.70 112.22 2did s SER 36 Ca -0.04 2.06 -0.04 0.00 1.31 0.00 0.00 55.95 59.24 2did s SER 36 Cb 0.19 -2.57 -0.16 0.00 0.21 0.00 0.00 66.02 63.69 2did s SER 36 CO 0.65 -1.25 2.70 1.41 0.41 0.00 0.00 173.24 177.17 2did n HIS 37 N -1.60 0.00 0.00 2.43 8.25 -1.26 -3.53 115.22 119.51 2did n HIS 37 Ca 0.11 -1.13 0.00 0.00 -0.26 0.00 0.00 57.72 56.44 2did n HIS 37 Cb 0.52 -1.14 0.00 0.00 1.12 0.00 0.00 29.99 30.49 2did n HIS 37 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2did n THR 38 N 2.32 0.00 -1.95 1.59 -1.04 -1.26 -4.82 114.28 109.12 2did n THR 38 Ca 0.26 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 62.25 2did n THR 38 Cb 0.67 -0.93 0.12 0.00 -1.82 0.00 0.00 70.33 68.37 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 -2.70 0.74 -0.07 -1.42 8.25 -1.23 -4.79 115.22 114.00 2did n HIS 39 Ca 0.00 -1.54 -0.17 0.00 -0.26 0.00 0.00 57.72 55.75 2did n HIS 39 Cb 0.48 -0.25 -0.13 0.00 1.12 0.00 0.00 29.99 31.21 2did n HIS 39 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2did h ARG 40 N 1.40 0.03 -1.13 -0.41 3.08 -1.71 -3.33 114.38 112.32 2did h ARG 40 Ca 0.03 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 59.90 2did h ARG 40 Cb 1.30 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 31.30 2did h ARG 40 CO 0.21 1.03 0.17 0.00 -1.07 0.00 0.00 179.97 180.31 2did n ALA 41 N -2.81 3.49 -2.57 0.04 0.00 -1.26 -4.85 120.51 112.54 2did n ALA 41 Ca -0.16 -0.74 -0.26 0.00 0.00 0.00 0.00 53.44 52.28 2did n ALA 41 Cb 0.57 -1.12 -0.11 0.00 0.00 0.00 0.00 19.45 18.79 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 -0.84 2.39 -1.13 0.00 3.76 -1.25 -5.07 115.29 113.15 2did s HIS 42 Ca 0.14 -0.65 -0.19 0.00 -0.15 0.00 0.00 55.06 54.21 2did s HIS 42 Cb 0.12 -1.57 0.09 0.00 1.11 0.00 0.00 32.58 32.33 2did s HIS 42 CO 0.02 0.43 1.49 0.99 -0.85 0.00 0.00 174.74 176.82 2did s THR 43 N -2.76 4.33 -0.01 1.30 2.01 -1.26 -4.98 115.64 114.27 2did s THR 43 Ca 0.34 -1.64 -0.17 0.00 0.31 0.00 0.00 61.69 60.53 2did s THR 43 Cb 0.07 -5.03 -0.06 0.00 0.01 0.00 0.00 72.50 67.50 2did s THR 43 CO 0.17 -1.84 0.47 -0.69 -0.69 0.00 0.00 174.62 172.04 2did s VAL 44 N 3.70 4.98 0.01 3.82 1.01 -1.26 -0.64 120.40 132.02 2did s VAL 44 Ca 0.46 0.98 0.01 0.00 0.00 0.00 0.00 61.98 63.43 2did s VAL 44 Cb 0.00 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 2did s VAL 44 CO -0.02 0.51 -0.05 0.68 0.00 0.00 0.00 175.10 176.23 2did s VAL 45 N -0.69 0.34 0.14 2.92 -7.23 0.33 -4.95 120.40 111.27 2did s VAL 45 Ca 0.26 -0.50 -0.31 0.00 -1.81 0.00 0.00 61.98 59.62 2did s VAL 45 Cb -0.17 -0.35 -0.08 0.00 0.56 0.00 0.00 36.38 36.34 2did s VAL 45 CO 0.14 -0.11 1.34 -2.16 -0.31 0.00 0.00 175.10 174.01 2did s PRO 46 N -0.65 4.35 -0.07 4.82 0.04 -1.26 -0.49 135.00 141.74 2did s PRO 46 Ca -0.04 2.04 -0.03 0.00 0.04 0.00 0.00 61.00 63.01 2did s PRO 46 Cb -0.05 -3.24 -0.09 0.00 0.04 0.00 0.00 34.50 31.16 2did s PRO 46 CO -0.00 -0.36 2.78 1.28 0.04 0.00 0.00 177.00 180.74 2did n LEU 47 N 3.52 5.52 -2.42 -3.56 4.77 -1.25 -4.47 117.00 119.11 2did n LEU 47 Ca 0.09 -2.99 -0.36 0.00 -0.03 0.00 0.00 56.01 52.73 2did n LEU 47 Cb 0.43 -1.26 0.07 0.00 -2.33 0.00 0.00 43.42 40.33 2did n LEU 47 CO 0.58 1.40 1.47 -1.54 -1.33 0.00 0.00 177.39 177.97 2did n SER 48 N 1.76 7.69 0.00 -1.43 3.41 -1.26 -4.96 113.62 118.83 2did n SER 48 Ca 0.26 -3.79 0.00 0.00 -0.26 0.00 0.00 58.87 55.08 2did n SER 48 Cb 0.69 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 2did n SER 48 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2did n GLY 49 N -0.85 3.16 3.67 5.00 0.00 -1.26 -4.71 105.19 110.20 2did n GLY 49 Ca 0.61 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 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 -4.75 4.24 -1.73 1.61 0.04 -1.26 -3.35 135.00 129.79 2did s PRO 50 Ca 0.00 2.01 -0.15 0.00 0.04 0.00 0.00 61.00 62.90 2did s PRO 50 Cb 0.00 -3.73 0.15 0.00 0.04 0.00 0.00 34.50 30.95 2did s PRO 50 CO 0.00 -0.69 0.48 -1.13 0.04 0.00 0.00 177.00 175.70 2did n SER 51 N 6.13 -1.37 -3.83 6.66 3.41 -1.26 -4.91 113.62 118.46 2did n SER 51 Ca 0.15 -1.19 -0.12 0.00 -0.26 0.00 0.00 58.87 57.45 2did n SER 51 Cb 0.43 -1.95 -0.11 0.00 -0.26 0.00 0.00 64.21 62.32 2did n SER 51 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2did s SER 52 N -3.61 -0.11 0.00 4.04 0.01 -1.21 -5.25 113.70 107.56 2did s SER 52 Ca 0.56 0.12 0.32 0.00 1.31 0.00 0.00 55.95 58.26 2did s SER 52 Cb -0.32 0.32 1.86 0.00 0.21 0.00 0.00 66.02 68.09 2did s SER 52 CO 0.99 -0.23 2.20 0.61 0.41 0.00 0.00 173.24 177.22