#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 4.16 0.35 1.61 0.01 -1.26 -5.13 113.70 113.44 2did s SER 2 Ca 0.00 -1.56 -0.18 0.00 1.31 0.00 0.00 55.95 55.52 2did s SER 2 Cb 0.00 0.37 -0.10 0.00 0.21 0.00 0.00 66.02 66.50 2did s SER 2 CO 0.00 -0.82 0.81 -0.94 0.41 0.00 0.00 173.24 172.70 2did s SER 3 N -3.90 6.87 0.00 2.44 1.04 -1.26 -4.92 113.70 113.97 2did s SER 3 Ca 0.13 1.45 0.00 0.00 0.48 0.00 0.00 55.95 58.01 2did s SER 3 Cb 0.02 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.70 2did s SER 3 CO 0.07 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.67 2did n GLY 4 N -0.35 0.39 4.28 7.32 0.00 -1.26 -5.01 105.19 110.56 2did n GLY 4 Ca 0.04 -2.12 -0.38 0.00 0.00 0.00 0.00 46.02 43.57 2did n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2did n SER 5 N 0.00 -1.28 -4.56 1.61 3.41 -1.26 -4.89 113.62 106.64 2did n SER 5 Ca 0.00 -1.15 -0.25 0.00 -0.26 0.00 0.00 58.87 57.21 2did n SER 5 Cb 0.00 -1.47 -0.09 0.00 -0.26 0.00 0.00 64.21 62.39 2did n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2did s SER 6 N -3.25 4.16 0.00 4.04 1.04 -1.26 -4.92 113.70 113.51 2did s SER 6 Ca 0.65 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 56.39 2did s SER 6 Cb -0.38 -0.65 0.00 0.00 0.10 0.00 0.00 66.02 65.09 2did s SER 6 CO 0.94 0.06 0.00 0.61 0.98 0.00 0.00 173.24 175.84 2did n GLY 7 N -0.32 0.65 3.33 7.32 0.00 -1.26 -5.11 105.19 109.80 2did n GLY 7 Ca -0.09 0.08 -0.57 0.00 0.00 0.00 0.00 46.02 45.44 2did n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2did n GLU 8 N 0.00 0.33 -4.02 1.61 -0.58 -1.26 -4.91 120.64 111.81 2did n GLU 8 Ca 0.00 0.09 -0.26 0.00 -0.42 0.00 0.00 57.16 56.57 2did n GLU 8 Cb 0.00 -1.79 -0.04 0.00 -0.57 0.00 0.00 31.44 29.04 2did n GLU 8 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2did s SER 9 N 6.26 5.92 -0.09 1.62 0.01 -1.26 -5.10 113.70 121.06 2did s SER 9 Ca 1.16 0.01 -0.11 0.00 1.31 0.00 0.00 55.95 58.32 2did s SER 9 Cb -1.31 -1.67 0.03 0.00 0.21 0.00 0.00 66.02 63.28 2did s SER 9 CO 0.61 0.06 0.30 -0.76 0.41 0.00 0.00 173.24 173.86 2did s LEU 10 N -3.19 0.87 0.17 2.44 1.43 -1.26 -3.33 118.68 115.81 2did s LEU 10 Ca 0.33 0.49 -0.33 0.00 -1.03 0.00 0.00 54.13 53.58 2did s LEU 10 Cb -0.10 1.07 -0.15 0.00 0.03 0.00 0.00 46.19 47.03 2did s LEU 10 CO 0.26 -0.18 1.23 0.00 0.23 0.00 0.00 176.35 177.89 2did n PRO 12 N 1.93 0.38 0.00 0.00 -0.04 -1.26 0.14 135.00 136.15 2did n PRO 12 Ca 0.15 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 2did n PRO 12 Cb 0.25 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.21 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 -1.11 0.56 -0.01 0.54 6.02 -1.26 -4.80 117.38 117.32 2did n GLN 13 Ca 0.10 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.19 2did n GLN 13 Cb 0.08 -0.85 -0.16 0.00 1.02 0.00 0.00 30.24 30.32 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 -2.07 0.03 -3.67 1.08 8.25 -1.21 -5.00 115.22 112.63 2did n HIS 14 Ca 0.00 0.01 -0.24 0.00 -0.26 0.00 0.00 57.72 57.23 2did n HIS 14 Cb 0.35 -0.54 0.06 0.00 1.12 0.00 0.00 29.99 30.98 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 -2.30 -2.40 -4.61 4.41 8.25 0.38 -4.84 115.22 114.10 2did n HIS 15 Ca -0.05 0.94 -0.25 0.00 -0.26 0.00 0.00 57.72 58.10 2did n HIS 15 Cb 0.60 -4.63 -0.14 0.00 1.12 0.00 0.00 29.99 26.94 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 -6.15 1.33 -0.28 -0.41 0.41 -1.26 -4.64 118.70 107.70 2did s GLU 16 Ca 0.38 -0.91 -0.42 0.00 -0.41 0.00 0.00 54.97 53.61 2did s GLU 16 Cb -0.18 -1.43 -0.19 0.00 -1.78 0.00 0.00 34.13 30.55 2did s GLU 16 CO 0.77 0.36 1.31 0.00 -0.49 0.00 0.00 175.26 177.22 2did n ALA 17 N 1.88 -2.19 -2.60 5.21 0.00 -1.25 -1.57 120.51 119.99 2did n ALA 17 Ca -0.17 0.51 -0.43 0.00 0.00 0.00 0.00 53.44 53.35 2did n ALA 17 Cb 0.53 -1.76 -0.04 0.00 0.00 0.00 0.00 19.45 18.19 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 1.69 3.97 -0.07 0.00 1.43 -1.21 -4.58 118.68 119.91 2did s LEU 18 Ca 0.94 0.48 0.10 0.00 -1.03 0.00 0.00 54.13 54.62 2did s LEU 18 Cb -1.34 -3.27 0.15 0.00 0.03 0.00 0.00 46.19 41.76 2did s LEU 18 CO 0.68 -0.93 1.04 -1.20 0.23 0.00 0.00 176.35 176.17 2did n SER 19 N 6.95 1.58 -4.15 2.29 7.64 -1.25 -4.93 113.62 121.75 2did n SER 19 Ca 0.07 -2.50 -0.11 0.00 1.01 0.00 0.00 58.87 57.34 2did n SER 19 Cb 0.48 -0.27 -0.09 0.00 -1.01 0.00 0.00 64.21 63.32 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 -1.69 1.17 -0.30 -3.43 1.43 -1.15 -1.41 118.68 113.30 2did s LEU 20 Ca 0.17 -1.25 -0.08 0.00 -1.03 0.00 0.00 54.13 51.94 2did s LEU 20 Cb 0.15 0.60 0.14 0.00 0.03 0.00 0.00 46.19 47.11 2did s LEU 20 CO 0.02 -0.86 0.63 0.12 0.23 0.00 0.00 176.35 176.49 2did s PHE 21 N -4.10 -1.38 0.67 0.29 2.19 0.49 -2.63 117.98 113.51 2did s PHE 21 Ca 0.32 2.16 -0.16 0.00 0.33 0.00 0.00 56.93 59.58 2did s PHE 21 Cb 0.06 0.73 0.01 0.00 -1.31 0.00 0.00 43.02 42.51 2did s PHE 21 CO 0.09 -0.71 1.17 0.00 1.83 0.00 0.00 175.22 177.60 2did n TYR 23 N -2.34 0.29 -0.06 0.00 9.36 -1.16 -3.63 117.16 119.62 2did n TYR 23 Ca 0.12 0.10 -0.04 0.00 3.32 0.00 0.00 57.90 61.41 2did n TYR 23 Cb 0.51 -1.05 -0.02 0.00 -0.63 0.00 0.00 39.34 38.14 2did n TYR 23 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 2did h GLU 24 N 0.00 0.00 0.00 2.98 3.07 -1.93 -3.33 114.58 115.36 2did h GLU 24 Ca -0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 2did h GLU 24 Cb 2.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.08 2did h GLU 24 CO 0.04 0.11 0.00 -0.25 -1.40 0.00 0.00 179.01 177.51 2did n ASP 25 N -4.69 0.00 -3.38 1.42 8.00 -1.26 -4.83 116.55 111.81 2did n ASP 25 Ca -0.05 0.39 -0.21 0.00 0.71 0.00 0.00 54.79 55.63 2did n ASP 25 Cb 0.16 -0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 40.80 2did n ASP 25 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2did n GLN 26 N -1.44 -2.50 -4.79 -1.24 1.13 -1.24 -4.91 117.38 102.39 2did n GLN 26 Ca 0.03 0.25 -0.24 0.00 -1.94 0.00 0.00 57.00 55.10 2did n GLN 26 Cb 0.11 -4.86 -0.15 0.00 0.11 0.00 0.00 30.24 25.45 2did n GLN 26 CO 0.00 0.00 0.00 -1.83 -1.44 0.00 0.00 177.06 173.79 2did s GLU 27 N -5.99 1.36 -0.05 -1.09 -1.05 -1.26 -4.98 118.70 105.65 2did s GLU 27 Ca 0.38 -0.61 -0.30 0.00 -0.15 0.00 0.00 54.97 54.28 2did s GLU 27 Cb -0.21 -1.32 -0.05 0.00 -0.44 0.00 0.00 34.13 32.11 2did s GLU 27 CO 0.46 0.36 1.52 0.00 0.95 0.00 0.00 175.26 178.55 2did s ALA 28 N -0.41 3.62 0.49 -0.84 0.00 -1.26 -2.36 121.76 120.99 2did s ALA 28 Ca 0.06 0.87 0.04 0.00 0.00 0.00 0.00 51.96 52.93 2did s ALA 28 Cb -0.07 -3.68 -0.02 0.00 0.00 0.00 0.00 23.12 19.35 2did s ALA 28 CO -0.01 -1.20 0.08 0.14 0.00 0.00 0.00 175.76 174.78 2did s VAL 29 N 3.36 1.51 0.51 0.00 -7.23 -1.08 -4.95 120.40 112.53 2did s VAL 29 Ca 0.68 -1.89 0.05 0.00 -1.81 0.00 0.00 61.98 59.00 2did s VAL 29 Cb -0.31 -2.41 0.01 0.00 0.56 0.00 0.00 36.38 34.23 2did s VAL 29 CO 0.26 0.00 0.26 0.00 -0.31 0.00 0.00 175.10 175.32 2did h LEU 31 N 1.02 0.89 0.73 0.00 8.10 -1.92 -2.77 115.31 121.35 2did h LEU 31 Ca -0.40 0.03 -0.04 0.00 0.11 0.00 0.00 57.88 57.59 2did h LEU 31 Cb 1.30 -0.15 0.01 0.00 -0.44 0.00 0.00 40.66 41.37 2did h LEU 31 CO 0.64 0.51 -0.35 0.40 -4.11 0.00 0.00 178.44 175.53 2did h ILE 32 N 0.97 0.12 -1.13 0.15 2.04 -1.96 -2.73 117.51 114.98 2did h ILE 32 Ca 0.45 -0.23 0.44 0.00 1.00 0.00 0.00 64.86 66.51 2did h ILE 32 Cb 0.41 0.16 -0.17 0.00 -0.74 0.00 0.00 36.82 36.47 2did h ILE 32 CO -0.21 0.01 0.66 0.00 0.00 0.00 0.00 178.15 178.61 2did n ALA 34 N -2.35 -0.15 -0.36 0.00 0.00 -1.10 -3.33 120.51 113.22 2did n ALA 34 Ca 0.39 0.00 0.37 0.00 0.00 0.00 0.00 53.44 54.20 2did n ALA 34 Cb 1.39 0.00 0.66 0.00 0.00 0.00 0.00 19.45 21.50 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 0.12 -4.29 0.00 3.07 -1.08 -3.38 117.51 111.95 2did h ILE 35 Ca 0.00 0.00 -0.52 0.00 1.55 0.00 0.00 64.86 65.89 2did h ILE 35 Cb 0.00 0.16 0.14 0.00 -0.27 0.00 0.00 36.82 36.85 2did h ILE 35 CO 0.00 0.00 0.31 -0.94 -1.05 0.00 0.00 178.15 176.47 2did s SER 36 N -4.14 4.33 0.00 2.16 1.04 0.56 -4.88 113.70 112.76 2did s SER 36 Ca -0.04 1.90 -0.05 0.00 0.48 0.00 0.00 55.95 58.24 2did s SER 36 Cb 0.20 -2.53 -0.24 0.00 0.10 0.00 0.00 66.02 63.55 2did s SER 36 CO 0.68 -2.16 3.41 1.41 0.98 0.00 0.00 173.24 177.57 2did n HIS 37 N -3.50 0.00 0.00 5.02 8.25 -1.26 -3.70 115.22 120.02 2did n HIS 37 Ca 0.10 -1.43 0.00 0.00 -0.26 0.00 0.00 57.72 56.13 2did n HIS 37 Cb 0.53 -1.47 0.00 0.00 1.12 0.00 0.00 29.99 30.17 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 2.40 0.00 -3.05 1.59 -1.04 -1.26 -4.91 114.28 108.02 2did n THR 38 Ca 0.38 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 62.15 2did n THR 38 Cb 0.86 -1.10 -0.04 0.00 -1.82 0.00 0.00 70.33 68.23 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 -2.77 2.80 -0.12 -1.42 8.25 -1.22 -4.85 115.22 115.89 2did n HIS 39 Ca 0.00 -3.95 -0.24 0.00 -0.26 0.00 0.00 57.72 53.27 2did n HIS 39 Cb 0.37 -0.47 -0.10 0.00 1.12 0.00 0.00 29.99 30.92 2did n HIS 39 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2did n ARG 40 N 0.02 0.57 -0.19 -0.41 3.00 -1.26 -4.51 116.66 113.88 2did n ARG 40 Ca 0.29 0.39 -0.10 0.00 -0.00 0.00 0.00 57.85 58.43 2did n ARG 40 Cb 0.47 -1.59 0.01 0.00 0.00 0.00 0.00 32.46 31.35 2did n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2did h ALA 41 N -0.81 0.71 -1.44 5.13 0.00 -1.95 -3.45 119.26 117.45 2did h ALA 41 Ca -0.48 -0.29 -0.28 0.00 0.00 0.00 0.00 54.91 53.86 2did h ALA 41 Cb 1.39 -0.20 0.15 0.00 0.00 0.00 0.00 17.79 19.14 2did h ALA 41 CO -0.29 0.53 -0.65 0.72 0.00 0.00 0.00 179.25 179.56 2did n HIS 42 N -4.29 -2.01 -3.54 0.00 8.25 -1.26 -4.91 115.22 107.46 2did n HIS 42 Ca 0.02 0.12 -0.35 0.00 -0.26 0.00 0.00 57.72 57.25 2did n HIS 42 Cb 0.32 -1.42 -0.06 0.00 1.12 0.00 0.00 29.99 29.95 2did n HIS 42 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2did n THR 43 N -4.25 3.10 -2.46 1.59 -1.04 -1.26 -5.02 114.28 104.94 2did n THR 43 Ca 0.04 -5.23 -0.42 0.00 -2.04 0.00 0.00 64.05 56.40 2did n THR 43 Cb 0.42 -2.27 -0.03 0.00 -1.82 0.00 0.00 70.33 66.63 2did n THR 43 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2did s VAL 44 N -1.79 4.16 0.01 12.58 1.01 -1.26 -2.98 120.40 132.13 2did s VAL 44 Ca 0.30 1.55 0.05 0.00 0.00 0.00 0.00 61.98 63.88 2did s VAL 44 Cb -0.01 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2did s VAL 44 CO -0.08 0.12 -0.13 0.68 0.00 0.00 0.00 175.10 175.69 2did s VAL 45 N 1.09 3.17 0.09 2.92 -7.23 -0.24 -4.89 120.40 115.30 2did s VAL 45 Ca 0.58 -0.96 -0.31 0.00 -1.81 0.00 0.00 61.98 59.48 2did s VAL 45 Cb -0.28 -2.34 -0.07 0.00 0.56 0.00 0.00 36.38 34.25 2did s VAL 45 CO 0.29 0.39 1.38 -2.16 -0.31 0.00 0.00 175.10 174.69 2did s PRO 46 N -1.33 4.32 -1.22 4.82 0.04 -1.26 -0.38 135.00 140.00 2did s PRO 46 Ca 0.15 2.03 -0.14 0.00 0.04 0.00 0.00 61.00 63.08 2did s PRO 46 Cb -0.11 -3.32 0.17 0.00 0.04 0.00 0.00 34.50 31.28 2did s PRO 46 CO 0.06 -0.45 1.45 -0.51 0.04 0.00 0.00 177.00 177.59 2did s LEU 47 N 1.33 5.01 -1.36 -3.56 1.43 -0.50 -4.62 118.68 116.42 2did s LEU 47 Ca 0.64 -2.99 -0.15 0.00 -1.03 0.00 0.00 54.13 50.60 2did s LEU 47 Cb -0.35 -2.41 0.15 0.00 0.03 0.00 0.00 46.19 43.61 2did s LEU 47 CO 0.30 -0.75 0.36 -1.20 0.23 0.00 0.00 176.35 175.28 2did n SER 48 N 5.72 -0.98 -4.98 2.29 7.64 -1.26 -4.80 113.62 117.26 2did n SER 48 Ca 0.37 -0.93 -0.18 0.00 1.01 0.00 0.00 58.87 59.14 2did n SER 48 Cb 0.43 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.44 2did n SER 48 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2did s GLY 49 N -2.92 1.98 0.00 0.23 0.00 -1.26 -4.99 107.32 100.36 2did s GLY 49 Ca 0.51 -1.71 0.15 0.00 0.00 0.00 0.00 44.72 43.67 2did s GLY 49 CO 0.76 -1.53 1.40 -1.55 0.00 0.00 0.00 173.10 172.18 2did n PRO 50 N -1.78 0.24 -1.01 2.90 -0.04 -1.26 -4.88 135.00 129.16 2did n PRO 50 Ca 0.07 0.13 -0.34 0.00 -0.04 0.00 0.00 63.50 63.32 2did n PRO 50 Cb 0.60 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.54 2did n PRO 50 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2did n SER 51 N -1.25 -1.65 -3.99 3.54 7.64 -1.26 -4.97 113.62 111.68 2did n SER 51 Ca 0.08 0.72 -0.09 0.00 1.01 0.00 0.00 58.87 60.58 2did n SER 51 Cb 0.11 -0.69 -0.06 0.00 -1.01 0.00 0.00 64.21 62.57 2did n SER 51 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2did s SER 52 N -0.76 -0.08 0.00 6.43 0.15 -1.26 -5.17 113.70 113.01 2did s SER 52 Ca 0.46 -0.92 0.00 0.00 0.70 0.00 0.00 55.95 56.19 2did s SER 52 Cb -0.58 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.30 2did s SER 52 CO 0.45 -1.10 0.00 0.61 1.20 0.00 0.00 173.24 174.40