#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 4.91 -0.11 1.61 0.01 -1.26 -5.09 113.70 113.78 2did s SER 2 Ca 0.00 0.66 0.02 0.00 1.31 0.00 0.00 55.95 57.95 2did s SER 2 Cb 0.00 -1.33 0.01 0.00 0.21 0.00 0.00 66.02 64.91 2did s SER 2 CO 0.00 -1.58 -0.18 -0.94 0.41 0.00 0.00 173.24 170.95 2did s SER 3 N -4.49 2.65 0.00 2.44 1.04 -1.26 -5.02 113.70 109.07 2did s SER 3 Ca 0.60 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.54 2did s SER 3 Cb -0.11 -1.21 0.00 0.00 0.10 0.00 0.00 66.02 64.81 2did s SER 3 CO 0.47 0.06 0.00 0.61 0.98 0.00 0.00 173.24 175.36 2did n GLY 4 N 3.98 -0.21 3.31 7.32 0.00 -1.26 -5.15 105.19 113.18 2did n GLY 4 Ca -0.20 0.13 0.03 0.00 0.00 0.00 0.00 46.02 45.98 2did n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2did s SER 5 N 1.25 -0.53 -0.67 1.61 1.04 -1.26 -5.02 113.70 110.12 2did s SER 5 Ca 0.00 0.62 -0.01 0.00 0.48 0.00 0.00 55.95 57.03 2did s SER 5 Cb 0.00 1.56 0.44 0.00 0.10 0.00 0.00 66.02 68.11 2did s SER 5 CO 0.00 -0.10 1.97 -0.24 0.98 0.00 0.00 173.24 175.85 2did n SER 6 N 5.05 7.47 0.00 7.02 2.88 -1.26 -4.62 113.62 130.16 2did n SER 6 Ca -0.08 -3.79 0.00 0.00 -1.33 0.00 0.00 58.87 53.67 2did n SER 6 Cb 0.53 -0.94 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 2did n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2did n GLY 7 N -0.84 1.02 3.67 0.46 0.00 -1.26 -5.12 105.19 103.12 2did n GLY 7 Ca 0.60 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.22 2did n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2did s GLU 8 N 0.00 4.25 0.33 1.61 2.12 -1.26 -5.06 118.70 120.69 2did s GLU 8 Ca 0.00 0.69 0.09 0.00 0.36 0.00 0.00 54.97 56.12 2did s GLU 8 Cb 0.00 -3.56 -0.06 0.00 0.26 0.00 0.00 34.13 30.78 2did s GLU 8 CO 0.00 -0.21 -0.02 -1.12 -0.54 0.00 0.00 175.26 173.37 2did s SER 9 N 1.13 4.06 0.02 -1.70 0.01 -1.26 -5.10 113.70 110.86 2did s SER 9 Ca 0.31 -1.03 -0.07 0.00 1.31 0.00 0.00 55.95 56.47 2did s SER 9 Cb -0.16 -0.49 -0.00 0.00 0.21 0.00 0.00 66.02 65.58 2did s SER 9 CO 0.11 -0.21 0.13 -0.76 0.41 0.00 0.00 173.24 172.93 2did s LEU 10 N -3.68 1.61 0.28 2.44 1.43 -1.26 -3.05 118.68 116.45 2did s LEU 10 Ca 0.34 -0.35 -0.30 0.00 -1.03 0.00 0.00 54.13 52.78 2did s LEU 10 Cb -0.00 0.70 -0.12 0.00 0.03 0.00 0.00 46.19 46.81 2did s LEU 10 CO 0.18 -0.46 1.62 0.00 0.23 0.00 0.00 176.35 177.93 2did n PRO 12 N 2.42 0.49 0.00 0.00 -0.04 -1.26 0.15 135.00 136.76 2did n PRO 12 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2did n PRO 12 Cb 0.37 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2did n PRO 12 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2did n GLN 13 N -0.85 0.00 -0.01 0.54 7.27 -1.26 -4.82 117.38 118.25 2did n GLN 13 Ca 0.08 0.00 0.10 0.00 0.07 0.00 0.00 57.00 57.25 2did n GLN 13 Cb 0.04 -0.72 -0.14 0.00 2.41 0.00 0.00 30.24 31.83 2did n GLN 13 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2did n HIS 14 N -2.25 0.00 -3.76 3.69 8.25 -1.20 -4.99 115.22 114.96 2did n HIS 14 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 2did n HIS 14 Cb 0.31 -0.32 0.03 0.00 1.12 0.00 0.00 29.99 31.13 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 -1.98 -2.33 -4.25 4.41 8.25 0.40 -4.84 115.22 114.89 2did n HIS 15 Ca -0.02 0.86 -0.28 0.00 -0.26 0.00 0.00 57.72 58.02 2did n HIS 15 Cb 0.46 -4.08 -0.09 0.00 1.12 0.00 0.00 29.99 27.40 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 -6.47 2.13 -0.37 -0.41 2.02 -1.26 -4.60 118.70 109.75 2did s GLU 16 Ca 0.61 -1.14 -0.44 0.00 0.02 0.00 0.00 54.97 54.02 2did s GLU 16 Cb -0.30 -2.25 -0.18 0.00 0.10 0.00 0.00 34.13 31.50 2did s GLU 16 CO 0.75 0.47 1.63 0.00 0.02 0.00 0.00 175.26 178.13 2did n ALA 17 N 0.30 -0.96 -2.63 5.21 0.00 -1.26 -1.78 120.51 119.39 2did n ALA 17 Ca -0.12 0.46 -0.42 0.00 0.00 0.00 0.00 53.44 53.36 2did n ALA 17 Cb 0.54 -2.04 -0.03 0.00 0.00 0.00 0.00 19.45 17.91 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 3.03 3.66 -0.11 0.00 1.43 -1.17 -4.23 118.68 121.29 2did s LEU 18 Ca 1.01 -0.30 0.16 0.00 -1.03 0.00 0.00 54.13 53.97 2did s LEU 18 Cb -1.30 -2.82 0.38 0.00 0.03 0.00 0.00 46.19 42.48 2did s LEU 18 CO 0.73 -1.51 1.18 -1.20 0.23 0.00 0.00 176.35 175.79 2did n SER 19 N 8.34 1.40 -3.80 2.29 7.64 -1.25 -4.94 113.62 123.30 2did n SER 19 Ca 0.04 -3.02 -0.10 0.00 1.01 0.00 0.00 58.87 56.79 2did n SER 19 Cb 0.48 -0.42 -0.07 0.00 -1.01 0.00 0.00 64.21 63.19 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 -1.84 1.15 -0.02 -3.43 1.43 -1.16 -2.92 118.68 111.89 2did s LEU 20 Ca 0.33 -0.43 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2did s LEU 20 Cb 0.34 1.19 0.01 0.00 0.03 0.00 0.00 46.19 47.76 2did s LEU 20 CO -0.09 -0.67 0.05 0.12 0.23 0.00 0.00 176.35 175.99 2did s PHE 21 N -3.21 -0.05 -0.23 0.29 2.19 -0.36 -0.73 117.98 115.88 2did s PHE 21 Ca -0.00 0.14 -0.06 0.00 0.33 0.00 0.00 56.93 57.34 2did s PHE 21 Cb 0.02 0.01 -0.02 0.00 -1.31 0.00 0.00 43.02 41.71 2did s PHE 21 CO -0.07 -0.03 0.03 0.00 1.83 0.00 0.00 175.22 176.97 2did h TYR 23 N 8.00 -0.50 -0.93 0.00 -1.99 -1.78 0.85 116.97 120.61 2did h TYR 23 Ca -0.38 -0.01 0.14 0.00 2.00 0.00 0.00 58.73 60.47 2did h TYR 23 Cb 1.17 0.17 -0.15 0.00 2.00 0.00 0.00 36.73 39.92 2did h TYR 23 CO 0.63 -0.31 -0.42 1.49 -0.00 0.00 0.00 178.16 179.55 2did h GLU 24 N -0.66 -0.03 0.00 4.88 4.81 -1.96 1.34 114.58 122.96 2did h GLU 24 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2did h GLU 24 Cb 0.42 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.80 2did h GLU 24 CO 0.09 -0.02 0.00 -0.44 -0.73 0.00 0.00 179.01 177.91 2did h ASP 25 N -0.03 0.00 -6.18 1.04 5.19 -1.95 -3.47 116.42 111.02 2did h ASP 25 Ca 0.30 0.00 -0.45 0.00 -0.62 0.00 0.00 57.03 56.26 2did h ASP 25 Cb 0.56 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.09 2did h ASP 25 CO -0.94 0.00 -0.76 1.67 -3.12 0.00 0.00 179.24 176.09 2did n GLN 26 N -2.82 -5.83 -3.98 3.56 -0.06 0.46 -4.98 117.38 103.73 2did n GLN 26 Ca 0.03 0.64 -0.09 0.00 -2.00 0.00 0.00 57.00 55.59 2did n GLN 26 Cb 0.39 -5.50 -0.10 0.00 -4.06 0.00 0.00 30.24 20.97 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 -6.42 0.58 -0.34 3.69 -1.05 -0.69 -4.98 118.70 109.50 2did s GLU 27 Ca 0.51 -0.89 -0.26 0.00 -0.15 0.00 0.00 54.97 54.18 2did s GLU 27 Cb -0.25 0.22 0.01 0.00 -0.44 0.00 0.00 34.13 33.67 2did s GLU 27 CO 0.81 -0.13 0.92 0.00 0.95 0.00 0.00 175.26 177.81 2did s ALA 28 N -2.96 3.47 0.41 -0.84 0.00 -1.26 -0.31 121.76 120.28 2did s ALA 28 Ca -0.02 -0.34 0.07 0.00 0.00 0.00 0.00 51.96 51.67 2did s ALA 28 Cb 0.01 -3.50 0.07 0.00 0.00 0.00 0.00 23.12 19.70 2did s ALA 28 CO -0.06 -1.45 0.57 1.33 0.00 0.00 0.00 175.76 176.15 2did n VAL 29 N 5.81 0.00 -4.40 0.00 0.24 0.09 -4.94 118.33 115.14 2did n VAL 29 Ca 0.07 -1.36 -0.20 0.00 -2.04 0.00 0.00 64.34 60.81 2did n VAL 29 Cb 0.48 -0.66 -0.10 0.00 -1.47 0.00 0.00 33.84 32.08 2did n VAL 29 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2did n LEU 31 N -0.50 -0.83 -0.21 0.00 -0.00 -1.26 -0.52 117.00 113.67 2did n LEU 31 Ca -0.06 1.62 -0.11 0.00 -0.00 0.00 0.00 56.01 57.45 2did n LEU 31 Cb 0.62 -0.27 -0.07 0.00 -0.00 0.00 0.00 43.42 43.70 2did n LEU 31 CO 0.37 -1.37 0.53 0.40 -0.00 0.00 0.00 177.39 177.33 2did h ILE 32 N 0.00 0.04 -0.82 1.96 1.08 -1.95 -0.51 117.51 117.31 2did h ILE 32 Ca 0.21 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.83 2did h ILE 32 Cb 0.44 0.04 -0.15 0.00 -3.07 0.00 0.00 36.82 34.08 2did h ILE 32 CO -0.88 0.00 -0.30 0.00 -0.69 0.00 0.00 178.15 176.28 2did h ALA 34 N 1.45 -0.66 -0.18 0.00 0.00 -0.67 0.45 119.26 119.65 2did h ALA 34 Ca 0.34 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.19 2did h ALA 34 Cb 0.59 1.21 -0.05 0.00 0.00 0.00 0.00 17.79 19.54 2did h ALA 34 CO -0.85 -0.97 0.13 0.44 0.00 0.00 0.00 179.25 178.01 2did n ILE 35 N -5.16 1.81 -4.72 0.00 -5.35 -0.38 -3.50 119.36 102.05 2did n ILE 35 Ca -0.01 -0.61 -0.26 0.00 -0.27 0.00 0.00 62.75 61.59 2did n ILE 35 Cb 0.29 -1.15 -0.17 0.00 -1.74 0.00 0.00 39.64 36.87 2did n ILE 35 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2did s SER 36 N 0.93 2.05 0.31 7.28 0.15 0.16 -5.00 113.70 119.59 2did s SER 36 Ca 0.11 -0.35 0.22 0.00 0.70 0.00 0.00 55.95 56.63 2did s SER 36 Cb 0.09 -0.94 1.08 0.00 -1.71 0.00 0.00 66.02 64.53 2did s SER 36 CO 0.01 0.06 1.15 0.00 1.20 0.00 0.00 173.24 175.66 2did n HIS 37 N 3.73 0.58 0.17 3.44 1.44 -1.26 0.18 115.22 123.51 2did n HIS 37 Ca -0.22 0.59 -0.14 0.00 -2.01 0.00 0.00 57.72 55.94 2did n HIS 37 Cb 0.52 -1.00 -0.08 0.00 0.12 0.00 0.00 29.99 29.56 2did n HIS 37 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 2did h THR 38 N 0.00 0.00 -1.47 0.61 2.02 -1.93 -3.22 112.91 108.93 2did h THR 38 Ca 0.64 0.00 -0.62 0.00 0.77 0.00 0.00 66.41 67.20 2did h THR 38 Cb 2.00 0.00 -0.39 0.00 -1.74 0.00 0.00 68.15 68.02 2did h THR 38 CO -0.39 0.00 -0.36 1.41 0.37 0.00 0.00 175.52 176.55 2did n HIS 39 N -4.82 3.23 -0.09 3.16 8.25 0.13 -4.72 115.22 120.36 2did n HIS 39 Ca -0.08 -2.84 -0.23 0.00 -0.26 0.00 0.00 57.72 54.30 2did n HIS 39 Cb 0.35 -0.37 -0.12 0.00 1.12 0.00 0.00 29.99 30.97 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 -0.54 0.62 -1.31 -0.41 0.63 0.15 -4.11 116.66 111.69 2did n ARG 40 Ca 0.43 0.41 -0.33 0.00 -0.92 0.00 0.00 57.85 57.44 2did n ARG 40 Cb 0.63 -1.67 0.09 0.00 0.45 0.00 0.00 32.46 31.97 2did n ARG 40 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2did n ALA 41 N -3.49 6.23 -2.61 5.13 0.00 -1.26 -4.95 120.51 119.55 2did n ALA 41 Ca -0.38 -3.38 -0.30 0.00 0.00 0.00 0.00 53.44 49.38 2did n ALA 41 Cb 0.83 -1.73 -0.05 0.00 0.00 0.00 0.00 19.45 18.51 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 -3.73 1.74 -1.09 0.00 3.76 -1.26 -5.08 115.29 109.64 2did s HIS 42 Ca 0.63 -0.92 -0.09 0.00 -0.15 0.00 0.00 55.06 54.54 2did s HIS 42 Cb 0.50 -1.73 0.27 0.00 1.11 0.00 0.00 32.58 32.73 2did s HIS 42 CO 0.01 -0.07 1.08 0.99 -0.85 0.00 0.00 174.74 175.89 2did s THR 43 N -2.84 5.88 -0.13 1.30 2.01 -1.26 -5.03 115.64 115.58 2did s THR 43 Ca 0.16 -3.42 -0.14 0.00 0.31 0.00 0.00 61.69 58.60 2did s THR 43 Cb -0.00 -4.54 -0.05 0.00 0.01 0.00 0.00 72.50 67.92 2did s THR 43 CO 0.10 -1.17 0.33 -0.69 -0.69 0.00 0.00 174.62 172.50 2did s VAL 44 N -1.21 5.26 0.02 3.82 1.01 -1.26 -2.53 120.40 125.51 2did s VAL 44 Ca 0.30 0.64 0.07 0.00 0.00 0.00 0.00 61.98 62.98 2did s VAL 44 Cb -0.10 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 2did s VAL 44 CO -0.08 0.42 -0.19 0.68 0.00 0.00 0.00 175.10 175.93 2did s VAL 45 N 0.20 2.72 0.07 2.92 -7.23 0.92 -4.91 120.40 115.09 2did s VAL 45 Ca 0.19 -1.11 -0.31 0.00 -1.81 0.00 0.00 61.98 58.94 2did s VAL 45 Cb -0.14 -2.11 -0.07 0.00 0.56 0.00 0.00 36.38 34.63 2did s VAL 45 CO 0.06 0.41 1.39 -2.16 -0.31 0.00 0.00 175.10 174.49 2did s PRO 46 N -1.22 4.31 -1.13 4.82 0.04 -1.26 -1.22 135.00 139.33 2did s PRO 46 Ca 0.13 2.03 -0.03 0.00 0.04 0.00 0.00 61.00 63.18 2did s PRO 46 Cb -0.10 -3.39 0.24 0.00 0.04 0.00 0.00 34.50 31.28 2did s PRO 46 CO 0.04 -0.49 2.07 1.28 0.04 0.00 0.00 177.00 179.93 2did n LEU 47 N 4.54 7.63 -3.64 -3.56 4.77 -1.15 -4.88 117.00 120.72 2did n LEU 47 Ca 0.12 -5.16 -0.05 0.00 -0.03 0.00 0.00 56.01 50.89 2did n LEU 47 Cb 0.43 -1.24 -0.07 0.00 -2.33 0.00 0.00 43.42 40.21 2did n LEU 47 CO 0.59 2.04 0.83 -0.55 -1.33 0.00 0.00 177.39 178.97 2did s SER 48 N -0.64 -0.35 0.95 -1.43 0.15 -1.26 -4.89 113.70 106.23 2did s SER 48 Ca 0.46 0.63 -0.11 0.00 0.70 0.00 0.00 55.95 57.63 2did s SER 48 Cb 0.20 0.84 0.13 0.00 -1.71 0.00 0.00 66.02 65.48 2did s SER 48 CO -0.12 -0.11 0.96 0.61 1.20 0.00 0.00 173.24 175.78 2did n GLY 49 N 2.61 -0.89 1.92 9.45 0.00 -1.26 -5.01 105.19 112.01 2did n GLY 49 Ca -0.14 -0.76 -0.16 0.00 0.00 0.00 0.00 46.02 44.95 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 -3.71 -2.20 -0.05 1.61 -0.04 -1.26 -4.97 135.00 124.38 2did n PRO 50 Ca 0.10 -0.96 -0.11 0.00 -0.04 0.00 0.00 63.50 62.49 2did n PRO 50 Cb 0.53 -0.90 -0.05 0.00 -0.04 0.00 0.00 33.50 33.03 2did n PRO 50 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2did h SER 51 N -1.96 0.28 -3.38 3.54 4.64 -2.09 -3.32 113.55 111.25 2did h SER 51 Ca -0.23 -0.27 -0.80 0.00 -0.47 0.00 0.00 61.79 60.03 2did h SER 51 Cb 0.69 -0.07 -0.28 0.00 -0.31 0.00 0.00 62.40 62.43 2did h SER 51 CO 0.15 0.48 0.56 -1.20 -0.87 0.00 0.00 176.83 175.94 2did n SER 52 N -4.77 5.67 0.00 4.97 7.64 -1.26 -5.34 113.62 120.54 2did n SER 52 Ca -0.05 -3.10 0.09 0.00 1.01 0.00 0.00 58.87 56.82 2did n SER 52 Cb 0.19 -1.37 0.51 0.00 -1.01 0.00 0.00 64.21 62.53 2did n SER 52 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64