#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 5.52 -4.56 1.61 3.41 -1.26 -4.86 113.62 113.48 2did n SER 2 Ca 0.00 -2.58 -0.24 0.00 -0.26 0.00 0.00 58.87 55.79 2did n SER 2 Cb 0.00 -1.26 -0.09 0.00 -0.26 0.00 0.00 64.21 62.60 2did n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2did s SER 3 N 1.66 4.07 -0.47 4.04 0.01 -1.26 -5.09 113.70 116.67 2did s SER 3 Ca 0.39 -0.82 0.07 0.00 1.31 0.00 0.00 55.95 56.91 2did s SER 3 Cb 0.21 -0.58 0.26 0.00 0.21 0.00 0.00 66.02 66.11 2did s SER 3 CO -0.02 0.03 0.61 0.61 0.41 0.00 0.00 173.24 174.87 2did n GLY 4 N -0.68 3.57 2.82 3.44 0.00 -1.26 -5.07 105.19 108.00 2did n GLY 4 Ca -0.06 -1.98 -0.15 0.00 0.00 0.00 0.00 46.02 43.82 2did n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2did s SER 5 N -1.69 0.24 0.25 1.61 0.15 -1.26 -5.15 113.70 107.85 2did s SER 5 Ca 0.37 -0.00 -0.01 0.00 0.70 0.00 0.00 55.95 57.01 2did s SER 5 Cb 0.17 -0.12 -0.03 0.00 -1.71 0.00 0.00 66.02 64.33 2did s SER 5 CO -0.08 -0.08 0.25 -0.44 1.20 0.00 0.00 173.24 174.09 2did s SER 6 N 0.80 0.55 -0.03 5.45 0.01 -1.26 -5.11 113.70 114.10 2did s SER 6 Ca -0.07 -1.42 -0.01 0.00 1.31 0.00 0.00 55.95 55.76 2did s SER 6 Cb -0.11 0.48 -0.00 0.00 0.21 0.00 0.00 66.02 66.61 2did s SER 6 CO -0.02 -0.99 -0.01 1.23 0.41 0.00 0.00 173.24 173.86 2did h GLY 7 N 2.40 0.00 -1.85 3.44 0.00 -2.07 -3.49 103.07 101.51 2did h GLY 7 Ca -0.31 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.44 2did h GLY 7 CO 0.45 0.00 -0.62 -1.83 0.00 0.00 0.00 176.54 174.54 2did s GLU 8 N -1.22 1.82 0.28 4.80 1.03 -1.26 -5.17 118.70 118.99 2did s GLU 8 Ca -0.01 -2.00 0.02 0.00 0.03 0.00 0.00 54.97 53.01 2did s GLU 8 Cb 0.00 -1.43 -0.05 0.00 -0.80 0.00 0.00 34.13 31.85 2did s GLU 8 CO 0.01 -0.04 0.10 -1.12 -1.33 0.00 0.00 175.26 172.88 2did s SER 9 N -3.62 1.47 0.05 0.83 0.01 -1.26 -5.05 113.70 106.13 2did s SER 9 Ca 0.34 -1.41 0.08 0.00 1.31 0.00 0.00 55.95 56.28 2did s SER 9 Cb 0.08 0.15 -0.03 0.00 0.21 0.00 0.00 66.02 66.43 2did s SER 9 CO 0.17 -0.73 -0.22 -0.76 0.41 0.00 0.00 173.24 172.10 2did s LEU 10 N -3.36 2.19 0.19 2.44 1.43 -1.26 -1.46 118.68 118.86 2did s LEU 10 Ca 0.37 -0.57 -0.32 0.00 -1.03 0.00 0.00 54.13 52.58 2did s LEU 10 Cb 0.08 -1.06 -0.15 0.00 0.03 0.00 0.00 46.19 45.10 2did s LEU 10 CO 0.14 0.18 1.33 0.00 0.23 0.00 0.00 176.35 178.23 2did n PRO 12 N 2.10 0.49 0.00 0.00 -0.04 -1.26 0.15 135.00 136.44 2did n PRO 12 Ca 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 2did n PRO 12 Cb 0.28 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 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 -0.99 0.41 -0.00 0.54 6.02 -1.26 -4.81 117.38 117.29 2did n GLN 13 Ca 0.11 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.20 2did n GLN 13 Cb 0.05 -0.78 -0.13 0.00 1.02 0.00 0.00 30.24 30.41 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 -1.92 0.00 -4.07 1.08 8.25 -1.21 -4.99 115.22 112.36 2did n HIS 14 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 2did n HIS 14 Cb 0.28 -0.21 -0.01 0.00 1.12 0.00 0.00 29.99 31.17 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 -1.78 -1.85 -4.33 4.41 8.25 0.39 -4.82 115.22 115.49 2did n HIS 15 Ca 0.00 0.81 -0.25 0.00 -0.26 0.00 0.00 57.72 58.03 2did n HIS 15 Cb 0.39 -3.43 -0.09 0.00 1.12 0.00 0.00 29.99 27.98 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 -6.73 2.05 -0.26 -0.41 0.41 -1.26 -4.63 118.70 107.87 2did s GLU 16 Ca 0.50 -1.43 -0.39 0.00 -0.41 0.00 0.00 54.97 53.23 2did s GLU 16 Cb -0.27 -2.07 -0.15 0.00 -1.78 0.00 0.00 34.13 29.86 2did s GLU 16 CO 0.89 0.39 1.78 0.00 -0.49 0.00 0.00 175.26 177.83 2did n ALA 17 N -0.44 -0.01 -2.63 5.21 0.00 -1.26 -1.81 120.51 119.58 2did n ALA 17 Ca -0.08 0.36 -0.43 0.00 0.00 0.00 0.00 53.44 53.30 2did n ALA 17 Cb 0.58 -2.27 -0.04 0.00 0.00 0.00 0.00 19.45 17.72 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 3.73 3.89 0.00 0.00 1.43 -0.53 -4.11 118.68 123.08 2did s LEU 18 Ca 0.98 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 2did s LEU 18 Cb -1.02 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 42.26 2did s LEU 18 CO 0.64 -1.31 0.00 -1.20 0.23 0.00 0.00 176.35 174.71 2did n SER 19 N 7.78 3.11 -4.95 2.29 7.64 -1.23 -4.74 113.62 123.52 2did n SER 19 Ca 0.04 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.69 2did n SER 19 Cb 0.48 0.34 0.05 0.00 -1.01 0.00 0.00 64.21 64.06 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 -2.79 3.10 -0.07 -3.43 1.43 -1.21 -0.70 118.68 115.01 2did s LEU 20 Ca 0.00 0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 53.26 2did s LEU 20 Cb 0.00 -3.01 0.02 0.00 0.03 0.00 0.00 46.19 43.23 2did s LEU 20 CO 0.00 -1.31 0.19 0.12 0.23 0.00 0.00 176.35 175.59 2did s PHE 21 N -2.96 -0.22 -0.38 0.29 5.36 0.26 -1.30 117.98 119.03 2did s PHE 21 Ca 0.58 0.53 -0.17 0.00 -0.96 0.00 0.00 56.93 56.92 2did s PHE 21 Cb -0.10 0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.64 2did s PHE 21 CO 0.41 -0.12 0.42 0.00 -1.46 0.00 0.00 175.22 174.47 2did h TYR 23 N 8.57 0.68 -0.37 0.00 5.03 -1.79 0.14 116.97 129.24 2did h TYR 23 Ca -0.28 -0.38 -0.02 0.00 2.58 0.00 0.00 58.73 60.63 2did h TYR 23 Cb 1.13 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 39.31 2did h TYR 23 CO 0.67 1.21 0.14 0.93 -1.32 0.00 0.00 178.16 179.79 2did h GLU 24 N 0.25 0.53 -0.29 1.82 5.08 -1.92 -2.34 114.58 117.70 2did h GLU 24 Ca -0.09 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2did h GLU 24 Cb 1.63 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.79 2did h GLU 24 CO 0.18 0.45 0.00 -0.25 -1.00 0.00 0.00 179.01 178.38 2did n ASP 25 N -4.38 3.28 -3.84 1.42 8.00 -1.21 -4.98 116.55 114.83 2did n ASP 25 Ca 0.02 -2.44 -0.25 0.00 0.71 0.00 0.00 54.79 52.84 2did n ASP 25 Cb 0.15 -0.35 -0.05 0.00 -0.02 0.00 0.00 41.12 40.84 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 0.02 -0.85 -3.73 -1.24 3.00 0.28 -4.89 117.38 109.98 2did n GLN 26 Ca 0.15 0.03 -0.13 0.00 -0.01 0.00 0.00 57.00 57.04 2did n GLN 26 Cb 0.61 -2.33 -0.10 0.00 0.00 0.00 0.00 30.24 28.42 2did n GLN 26 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 2did s GLU 27 N -6.27 0.53 0.87 -1.09 -1.05 -0.03 -5.00 118.70 106.66 2did s GLU 27 Ca 0.07 0.45 -0.12 0.00 -0.15 0.00 0.00 54.97 55.23 2did s GLU 27 Cb -0.04 0.26 0.11 0.00 -0.44 0.00 0.00 34.13 34.02 2did s GLU 27 CO 0.71 -0.09 1.16 0.00 0.95 0.00 0.00 175.26 177.99 2did n ALA 28 N 2.55 -0.49 -3.81 -0.84 0.00 -1.26 0.16 120.51 116.82 2did n ALA 28 Ca -0.15 -0.45 -0.13 0.00 0.00 0.00 0.00 53.44 52.71 2did n ALA 28 Cb 0.57 -2.21 -0.04 0.00 0.00 0.00 0.00 19.45 17.77 2did n ALA 28 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2did n VAL 29 N -3.78 0.00 -4.45 0.00 0.24 -0.42 -4.61 118.33 105.31 2did n VAL 29 Ca 0.13 -1.51 -0.21 0.00 -2.04 0.00 0.00 64.34 60.70 2did n VAL 29 Cb 0.51 0.81 -0.11 0.00 -1.47 0.00 0.00 33.84 33.59 2did n VAL 29 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2did h LEU 31 N 2.15 -0.76 0.41 0.00 7.12 -1.90 -1.93 115.31 120.40 2did h LEU 31 Ca -0.41 0.22 -0.01 0.00 0.13 0.00 0.00 57.88 57.81 2did h LEU 31 Cb 1.24 0.47 -0.02 0.00 -0.53 0.00 0.00 40.66 41.82 2did h LEU 31 CO 0.69 -0.25 -0.43 0.40 -0.13 0.00 0.00 178.44 178.73 2did h ILE 32 N -0.03 0.00 -0.82 4.05 1.08 -1.93 -1.98 117.51 117.88 2did h ILE 32 Ca 0.32 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.88 2did h ILE 32 Cb 0.53 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.18 2did h ILE 32 CO -0.73 0.00 -0.45 0.00 -0.69 0.00 0.00 178.15 176.28 2did h ALA 34 N 0.56 -0.55 -0.05 0.00 0.00 -1.28 0.46 119.26 118.39 2did h ALA 34 Ca 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2did h ALA 34 Cb 0.37 0.61 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2did h ALA 34 CO -0.78 -0.88 0.00 0.44 0.00 0.00 0.00 179.25 178.03 2did n ILE 35 N -5.43 0.23 -4.43 0.00 -6.64 0.66 -4.02 119.36 99.74 2did n ILE 35 Ca -0.06 -0.12 -0.21 0.00 -1.77 0.00 0.00 62.75 60.59 2did n ILE 35 Cb 0.34 -0.41 -0.10 0.00 -1.44 0.00 0.00 39.64 38.03 2did n ILE 35 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 2did s SER 36 N -0.20 2.98 0.13 7.28 0.15 0.40 -4.98 113.70 119.47 2did s SER 36 Ca 0.05 -1.11 -0.19 0.00 0.70 0.00 0.00 55.95 55.40 2did s SER 36 Cb 0.04 -0.21 -0.01 0.00 -1.71 0.00 0.00 66.02 64.13 2did s SER 36 CO 0.02 -0.20 1.73 0.45 1.20 0.00 0.00 173.24 176.44 2did h HIS 37 N 2.33 0.06 -0.90 3.44 3.86 -1.87 -1.99 115.15 120.08 2did h HIS 37 Ca -0.40 0.02 0.18 0.00 -1.16 0.00 0.00 60.37 59.01 2did h HIS 37 Cb 1.24 0.01 -0.17 0.00 1.06 0.00 0.00 27.41 29.55 2did h HIS 37 CO 0.73 0.01 -0.21 2.41 0.86 0.00 0.00 177.93 181.72 2did n THR 38 N -5.10 -0.38 -3.35 2.45 -1.04 -1.26 -2.61 114.28 102.99 2did n THR 38 Ca -0.01 2.06 -0.26 0.00 -2.04 0.00 0.00 64.05 63.79 2did n THR 38 Cb 0.11 -2.85 -0.08 0.00 -1.82 0.00 0.00 70.33 65.69 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 -5.46 0.86 -0.05 -1.42 8.25 -1.00 -4.93 115.22 111.47 2did n HIS 39 Ca 0.15 -3.73 -0.06 0.00 -0.26 0.00 0.00 57.72 53.81 2did n HIS 39 Cb 0.46 -0.32 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 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 1.58 0.36 -0.14 -0.41 3.00 -0.78 -3.26 116.66 117.01 2did n ARG 40 Ca 0.25 0.14 -0.12 0.00 -0.00 0.00 0.00 57.85 58.12 2did n ARG 40 Cb 0.47 -1.12 -0.01 0.00 0.00 0.00 0.00 32.46 31.80 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 -0.97 0.64 -2.06 5.13 0.00 -1.87 -3.46 119.26 116.67 2did h ALA 41 Ca 0.00 -0.42 -0.60 0.00 0.00 0.00 0.00 54.91 53.89 2did h ALA 41 Cb 0.69 -0.15 0.18 0.00 0.00 0.00 0.00 17.79 18.51 2did h ALA 41 CO 0.00 0.68 -1.09 0.72 0.00 0.00 0.00 179.25 179.56 2did n HIS 42 N -4.08 -2.71 -2.59 0.00 8.25 -1.26 -4.76 115.22 108.07 2did n HIS 42 Ca -0.01 0.44 -0.42 0.00 -0.26 0.00 0.00 57.72 57.46 2did n HIS 42 Cb 0.50 -1.71 -0.01 0.00 1.12 0.00 0.00 29.99 29.89 2did n HIS 42 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2did s THR 43 N -1.97 4.09 0.05 1.59 2.01 -1.26 -4.97 115.64 115.17 2did s THR 43 Ca 0.58 -1.58 -0.30 0.00 0.31 0.00 0.00 61.69 60.69 2did s THR 43 Cb -0.48 -5.15 -0.04 0.00 0.01 0.00 0.00 72.50 66.84 2did s THR 43 CO 0.65 -1.99 1.03 -0.69 -0.69 0.00 0.00 174.62 172.93 2did s VAL 44 N 4.38 4.55 0.02 3.82 1.01 -1.26 -2.77 120.40 130.15 2did s VAL 44 Ca 0.51 1.91 0.04 0.00 0.00 0.00 0.00 61.98 64.44 2did s VAL 44 Cb 0.03 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 2did s VAL 44 CO 0.02 0.19 -0.13 0.68 0.00 0.00 0.00 175.10 175.87 2did s VAL 45 N 0.71 1.00 0.27 2.92 -7.23 -0.15 -4.94 120.40 112.99 2did s VAL 45 Ca 0.52 -0.79 -0.29 0.00 -1.81 0.00 0.00 61.98 59.61 2did s VAL 45 Cb -0.24 -0.88 -0.10 0.00 0.56 0.00 0.00 36.38 35.72 2did s VAL 45 CO 0.29 0.09 1.25 -2.16 -0.31 0.00 0.00 175.10 174.27 2did s PRO 46 N -0.79 4.44 -0.55 4.82 0.04 -1.26 -0.58 135.00 141.13 2did s PRO 46 Ca 0.02 2.05 -0.02 0.00 0.04 0.00 0.00 61.00 63.10 2did s PRO 46 Cb -0.06 -3.14 0.30 0.00 0.04 0.00 0.00 34.50 31.63 2did s PRO 46 CO 0.00 -0.10 2.15 1.28 0.04 0.00 0.00 177.00 180.37 2did n LEU 47 N 1.50 7.09 0.06 -3.56 4.77 0.13 -4.36 117.00 122.64 2did n LEU 47 Ca 0.02 -4.02 0.00 0.00 -0.03 0.00 0.00 56.01 51.98 2did n LEU 47 Cb 0.43 -1.06 0.00 0.00 -2.33 0.00 0.00 43.42 40.46 2did n LEU 47 CO 0.57 1.48 0.00 -1.20 -1.33 0.00 0.00 177.39 176.91 2did n SER 48 N -0.17 0.72 0.00 -1.43 7.64 -1.26 -5.02 113.62 114.10 2did n SER 48 Ca 0.49 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.56 2did n SER 48 Cb 0.55 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 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 3.05 -1.46 0.08 0.23 0.00 -1.26 -4.71 105.19 101.12 2did n GLY 49 Ca 0.00 -2.09 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 2did n GLY 49 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2did h PRO 50 N 1.01 0.11 -6.86 1.61 0.13 -2.02 -3.46 132.00 122.52 2did h PRO 50 Ca 0.00 -0.06 -0.57 0.00 -0.87 0.00 0.00 66.00 64.50 2did h PRO 50 Cb 0.00 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 30.81 2did h PRO 50 CO 0.00 0.56 -0.84 -1.13 -0.23 0.00 0.00 178.00 176.36 2did n SER 51 N -4.77 -1.14 -4.31 1.44 3.41 -1.26 -4.87 113.62 102.13 2did n SER 51 Ca -0.08 -1.15 -0.39 0.00 -0.26 0.00 0.00 58.87 57.00 2did n SER 51 Cb 0.28 -1.46 -0.12 0.00 -0.26 0.00 0.00 64.21 62.66 2did n SER 51 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2did s SER 52 N -3.31 5.49 0.00 4.04 0.15 -1.26 -5.28 113.70 113.53 2did s SER 52 Ca 0.61 -1.13 0.28 0.00 0.70 0.00 0.00 55.95 56.40 2did s SER 52 Cb -0.35 -1.93 1.08 0.00 -1.71 0.00 0.00 66.02 63.10 2did s SER 52 CO 0.93 -0.37 1.76 0.61 1.20 0.00 0.00 173.24 177.38