#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 -4.91 -4.21 1.61 7.64 -1.26 -4.99 113.62 107.51 2did n SER 2 Ca 0.00 -0.66 -0.29 0.00 1.01 0.00 0.00 58.87 58.93 2did n SER 2 Cb 0.00 -4.54 -0.16 0.00 -1.01 0.00 0.00 64.21 58.50 2did n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2did s SER 3 N -3.52 2.61 -0.44 6.43 0.15 -1.26 -5.05 113.70 112.62 2did s SER 3 Ca 0.50 -0.43 0.05 0.00 0.70 0.00 0.00 55.95 56.77 2did s SER 3 Cb -0.24 -0.67 0.29 0.00 -1.71 0.00 0.00 66.02 63.69 2did s SER 3 CO 0.77 0.21 1.08 0.61 1.20 0.00 0.00 173.24 177.11 2did n GLY 4 N 2.99 -0.07 3.60 9.45 0.00 -1.26 -5.15 105.19 114.74 2did n GLY 4 Ca -0.17 0.26 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.21 4.41 0.36 1.61 0.01 -1.26 -5.14 113.70 112.48 2did s SER 5 Ca 0.26 -0.53 0.08 0.00 1.31 0.00 0.00 55.95 57.07 2did s SER 5 Cb 0.26 -0.81 -0.04 0.00 0.21 0.00 0.00 66.02 65.64 2did s SER 5 CO -0.14 0.10 0.18 -0.94 0.41 0.00 0.00 173.24 172.84 2did s SER 6 N -2.89 4.68 0.00 2.44 1.04 -1.26 -4.93 113.70 112.79 2did s SER 6 Ca 0.26 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.86 2did s SER 6 Cb -0.09 -0.67 0.00 0.00 0.10 0.00 0.00 66.02 65.37 2did s SER 6 CO 0.16 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 174.60 2did n GLY 7 N -1.22 1.89 3.14 7.32 0.00 -1.26 -5.13 105.19 109.93 2did n GLY 7 Ca -0.02 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 2did n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2did s GLU 8 N 0.00 0.43 -0.14 1.61 2.02 -1.26 -5.15 118.70 116.22 2did s GLU 8 Ca 0.00 -0.03 -0.13 0.00 0.02 0.00 0.00 54.97 54.83 2did s GLU 8 Cb 0.00 0.19 -0.05 0.00 0.10 0.00 0.00 34.13 34.38 2did s GLU 8 CO 0.00 -0.09 0.28 -1.54 0.02 0.00 0.00 175.26 173.92 2did s SER 9 N -0.71 6.46 -0.06 -0.19 1.04 -1.26 -5.06 113.70 113.92 2did s SER 9 Ca -0.08 0.54 -0.03 0.00 0.48 0.00 0.00 55.95 56.86 2did s SER 9 Cb -0.04 -2.17 0.03 0.00 0.10 0.00 0.00 66.02 63.94 2did s SER 9 CO 0.02 0.17 0.15 -0.76 0.98 0.00 0.00 173.24 173.80 2did s LEU 10 N 0.07 0.88 0.20 2.42 1.43 -1.26 -2.10 118.68 120.33 2did s LEU 10 Ca 0.17 0.30 -0.32 0.00 -1.03 0.00 0.00 54.13 53.24 2did s LEU 10 Cb -0.13 0.40 -0.14 0.00 0.03 0.00 0.00 46.19 46.35 2did s LEU 10 CO 0.05 -0.13 1.47 0.00 0.23 0.00 0.00 176.35 177.97 2did n PRO 12 N 2.58 0.49 0.00 0.00 -0.04 -1.26 0.20 135.00 136.97 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 0.30 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 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 -0.95 0.23 -0.04 0.54 1.13 -1.26 -4.82 117.38 112.21 2did n GLN 13 Ca 0.10 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.17 2did n GLN 13 Cb 0.05 -0.94 -0.11 0.00 0.11 0.00 0.00 30.24 29.34 2did n GLN 13 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2did n HIS 14 N -2.35 0.00 -2.30 1.08 8.25 -1.18 -5.00 115.22 113.73 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 0.44 -0.52 -0.01 0.00 1.12 0.00 0.00 29.99 31.02 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 -2.28 -0.74 -3.96 4.41 8.25 0.54 -4.86 115.22 116.59 2did n HIS 15 Ca -0.13 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.03 2did n HIS 15 Cb 0.68 -3.20 -0.05 0.00 1.12 0.00 0.00 29.99 28.55 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 -4.77 3.30 -0.37 -0.41 8.01 -1.26 -4.53 118.70 118.67 2did s GLU 16 Ca 0.00 -0.52 -0.43 0.00 0.01 0.00 0.00 54.97 54.04 2did s GLU 16 Cb -0.00 -2.95 -0.17 0.00 -4.31 0.00 0.00 34.13 26.69 2did s GLU 16 CO 0.00 0.59 1.70 0.00 0.01 0.00 0.00 175.26 177.56 2did n ALA 17 N 0.27 -0.61 -2.60 5.21 0.00 -1.26 -2.10 120.51 119.42 2did n ALA 17 Ca -0.06 0.42 -0.43 0.00 0.00 0.00 0.00 53.44 53.38 2did n ALA 17 Cb 0.51 -2.11 -0.04 0.00 0.00 0.00 0.00 19.45 17.81 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 3.40 3.99 0.00 0.00 1.43 -0.89 -4.19 118.68 122.42 2did s LEU 18 Ca 1.01 0.55 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 2did s LEU 18 Cb -1.23 -3.26 0.00 0.00 0.03 0.00 0.00 46.19 41.72 2did s LEU 18 CO 0.72 -0.88 0.00 -1.20 0.23 0.00 0.00 176.35 175.22 2did n SER 19 N 6.81 1.37 -4.92 2.29 7.64 -1.23 -4.88 113.62 120.70 2did n SER 19 Ca 0.07 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.69 2did n SER 19 Cb 0.48 0.09 0.04 0.00 -1.01 0.00 0.00 64.21 63.81 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 -2.55 3.12 0.02 -3.43 1.43 -0.82 -0.63 118.68 115.82 2did s LEU 20 Ca 0.00 0.66 -0.03 0.00 -1.03 0.00 0.00 54.13 53.73 2did s LEU 20 Cb 0.00 -3.45 -0.01 0.00 0.03 0.00 0.00 46.19 42.76 2did s LEU 20 CO 0.00 -1.20 0.03 0.12 0.23 0.00 0.00 176.35 175.53 2did s PHE 21 N -3.06 0.21 -0.18 0.29 5.36 0.15 -0.51 117.98 120.24 2did s PHE 21 Ca 0.56 -0.46 -0.01 0.00 -0.96 0.00 0.00 56.93 56.05 2did s PHE 21 Cb -0.11 -0.16 -0.01 0.00 -0.34 0.00 0.00 43.02 42.41 2did s PHE 21 CO 0.45 -0.26 -0.11 0.00 -1.46 0.00 0.00 175.22 173.85 2did h TYR 23 N 7.54 0.71 -0.09 0.00 0.05 -1.68 0.20 116.97 123.70 2did h TYR 23 Ca -0.36 -0.29 0.03 0.00 0.05 0.00 0.00 58.73 58.16 2did h TYR 23 Cb 1.18 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 38.76 2did h TYR 23 CO 0.53 1.06 -0.10 1.49 -1.05 0.00 0.00 178.16 180.09 2did h GLU 24 N 0.17 -0.13 -0.33 4.88 4.57 -1.95 -1.22 114.58 120.57 2did h GLU 24 Ca -0.02 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2did h GLU 24 Cb 1.08 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.70 2did h GLU 24 CO 0.10 -0.09 0.00 -0.25 -1.18 0.00 0.00 179.01 177.59 2did n ASP 25 N -5.24 1.88 -2.30 1.04 8.00 -1.24 -4.89 116.55 113.80 2did n ASP 25 Ca -0.04 -1.95 -0.06 0.00 0.71 0.00 0.00 54.79 53.45 2did n ASP 25 Cb 0.16 -0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 41.03 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 0.52 -2.19 -4.22 -1.24 1.13 -0.00 -4.83 117.38 106.55 2did n GLN 26 Ca 0.13 0.02 -0.17 0.00 -1.94 0.00 0.00 57.00 55.04 2did n GLN 26 Cb 0.31 -3.39 -0.11 0.00 0.11 0.00 0.00 30.24 27.16 2did n GLN 26 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 2did s GLU 27 N -4.07 0.95 0.51 -1.09 2.56 -0.83 -4.97 118.70 111.76 2did s GLU 27 Ca 0.11 -1.19 -0.21 0.00 0.00 0.00 0.00 54.97 53.68 2did s GLU 27 Cb -0.06 -0.77 -0.07 0.00 2.00 0.00 0.00 34.13 35.23 2did s GLU 27 CO 0.13 0.14 1.15 0.00 -0.56 0.00 0.00 175.26 176.12 2did s ALA 28 N -2.19 2.82 0.10 6.30 0.00 -1.26 -0.63 121.76 126.89 2did s ALA 28 Ca 0.07 0.87 0.02 0.00 0.00 0.00 0.00 51.96 52.92 2did s ALA 28 Cb -0.04 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 2did s ALA 28 CO 0.02 -0.72 -0.07 0.14 0.00 0.00 0.00 175.76 175.13 2did s VAL 29 N -1.67 0.70 0.31 0.00 -7.23 0.33 -4.78 120.40 108.07 2did s VAL 29 Ca 0.69 -1.86 0.06 0.00 -1.81 0.00 0.00 61.98 59.06 2did s VAL 29 Cb -0.26 -1.59 -0.02 0.00 0.56 0.00 0.00 36.38 35.07 2did s VAL 29 CO 0.30 -0.82 0.39 0.00 -0.31 0.00 0.00 175.10 174.67 2did h LEU 31 N 1.06 0.44 -0.39 0.00 -0.00 -1.90 0.32 115.31 114.84 2did h LEU 31 Ca -0.47 0.11 -0.08 0.00 -0.00 0.00 0.00 57.88 57.44 2did h LEU 31 Cb 1.25 0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.95 2did h LEU 31 CO 0.56 0.00 -0.08 0.40 -0.00 0.00 0.00 178.44 179.32 2did h ILE 32 N 0.34 1.27 0.17 0.15 1.08 -1.93 -3.11 117.51 115.48 2did h ILE 32 Ca 0.66 -1.15 0.02 0.00 -0.39 0.00 0.00 64.86 64.00 2did h ILE 32 Cb 1.72 1.23 -0.04 0.00 -3.07 0.00 0.00 36.82 36.67 2did h ILE 32 CO -0.38 0.38 -0.33 0.00 -0.69 0.00 0.00 178.15 177.14 2did h ALA 34 N 0.02 0.86 -0.98 0.00 0.00 -1.47 0.26 119.26 117.95 2did h ALA 34 Ca 0.02 0.23 -0.60 0.00 0.00 0.00 0.00 54.91 54.56 2did h ALA 34 Cb 0.60 0.38 -0.30 0.00 0.00 0.00 0.00 17.79 18.47 2did h ALA 34 CO -0.17 -0.42 0.73 0.44 0.00 0.00 0.00 179.25 179.83 2did n ILE 35 N -5.31 3.41 -3.99 0.00 -5.35 -0.90 -4.73 119.36 102.50 2did n ILE 35 Ca 0.14 -2.55 -0.14 0.00 -0.27 0.00 0.00 62.75 59.93 2did n ILE 35 Cb 0.49 -0.86 -0.14 0.00 -1.74 0.00 0.00 39.64 37.39 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 -1.68 0.30 0.33 7.28 0.15 0.91 -4.97 113.70 116.02 2did s SER 36 Ca 0.61 -0.04 0.17 0.00 0.70 0.00 0.00 55.95 57.39 2did s SER 36 Cb 0.49 -0.06 1.17 0.00 -1.71 0.00 0.00 66.02 65.92 2did s SER 36 CO 0.04 0.01 1.45 1.57 1.20 0.00 0.00 173.24 177.51 2did n HIS 37 N 3.18 1.01 -0.33 3.44 -0.00 -1.26 0.31 115.22 121.57 2did n HIS 37 Ca -0.15 1.09 0.18 0.00 0.46 0.00 0.00 57.72 59.30 2did n HIS 37 Cb 0.58 -1.45 0.34 0.00 -0.12 0.00 0.00 29.99 29.34 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 -5.11 -0.41 -3.33 3.57 -1.04 -1.26 -2.20 114.28 104.49 2did n THR 38 Ca 0.33 2.12 -0.26 0.00 -2.04 0.00 0.00 64.05 64.20 2did n THR 38 Cb 1.12 -3.16 -0.08 0.00 -1.82 0.00 0.00 70.33 66.40 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 -5.41 1.67 -3.95 -1.42 -0.00 0.15 -5.10 115.22 101.16 2did n HIS 39 Ca 0.26 -3.86 -0.21 0.00 -0.00 0.00 0.00 57.72 53.90 2did n HIS 39 Cb 0.85 -0.44 -0.02 0.00 -0.00 0.00 0.00 29.99 30.38 2did n HIS 39 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 2did s ARG 40 N -1.77 3.36 -0.73 -0.41 1.81 -0.94 -4.40 118.95 115.87 2did s ARG 40 Ca 0.37 -0.81 -0.06 0.00 -1.72 0.00 0.00 55.73 53.50 2did s ARG 40 Cb 0.15 -2.85 0.06 0.00 -0.45 0.00 0.00 34.95 31.86 2did s ARG 40 CO -0.07 0.40 0.20 0.00 -0.68 0.00 0.00 175.30 175.15 2did n ALA 41 N -1.40 -1.02 -2.60 2.13 0.00 -1.26 -4.90 120.51 111.46 2did n ALA 41 Ca -0.08 -0.01 -0.23 0.00 0.00 0.00 0.00 53.44 53.11 2did n ALA 41 Cb 0.57 -1.42 -0.08 0.00 0.00 0.00 0.00 19.45 18.52 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 -2.49 2.63 -0.98 0.00 3.76 -1.26 -5.07 115.29 111.89 2did s HIS 42 Ca 0.23 -0.28 -0.19 0.00 -0.15 0.00 0.00 55.06 54.67 2did s HIS 42 Cb -0.13 -1.26 0.12 0.00 1.11 0.00 0.00 32.58 32.41 2did s HIS 42 CO 0.28 0.58 1.23 0.99 -0.85 0.00 0.00 174.74 176.98 2did s THR 43 N -2.38 4.58 0.03 1.30 2.01 -1.26 -5.01 115.64 114.91 2did s THR 43 Ca 0.32 -1.51 -0.15 0.00 0.31 0.00 0.00 61.69 60.66 2did s THR 43 Cb -0.05 -4.86 -0.06 0.00 0.01 0.00 0.00 72.50 67.55 2did s THR 43 CO 0.20 -1.61 0.44 -0.69 -0.69 0.00 0.00 174.62 172.26 2did s VAL 44 N 3.09 4.97 -0.02 3.82 1.01 -1.26 -1.99 120.40 130.02 2did s VAL 44 Ca 0.37 0.86 -0.05 0.00 0.00 0.00 0.00 61.98 63.15 2did s VAL 44 Cb -0.03 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.61 2did s VAL 44 CO -0.08 0.52 0.12 0.68 0.00 0.00 0.00 175.10 176.34 2did s VAL 45 N -1.14 0.05 0.24 2.92 -7.23 0.66 -4.95 120.40 110.94 2did s VAL 45 Ca 0.26 -0.38 -0.30 0.00 -1.81 0.00 0.00 61.98 59.76 2did s VAL 45 Cb -0.17 -0.31 -0.09 0.00 0.56 0.00 0.00 36.38 36.37 2did s VAL 45 CO 0.15 -0.21 1.27 -2.16 -0.31 0.00 0.00 175.10 173.85 2did s PRO 46 N -0.69 4.42 -0.28 4.82 0.04 -1.26 0.31 135.00 142.36 2did s PRO 46 Ca -0.08 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.00 2did s PRO 46 Cb -0.05 -3.17 0.21 0.00 0.04 0.00 0.00 34.50 31.54 2did s PRO 46 CO 0.01 -0.16 1.94 1.28 0.04 0.00 0.00 177.00 180.10 2did n LEU 47 N 1.99 6.17 -4.62 -3.56 4.77 0.20 -4.86 117.00 117.09 2did n LEU 47 Ca 0.04 -3.14 -0.31 0.00 -0.03 0.00 0.00 56.01 52.57 2did n LEU 47 Cb 0.43 -1.01 -0.09 0.00 -2.33 0.00 0.00 43.42 40.42 2did n LEU 47 CO 0.57 1.15 -0.37 -0.55 -1.33 0.00 0.00 177.39 176.86 2did s SER 48 N 0.26 4.72 -0.13 -1.43 0.15 -1.26 -5.04 113.70 110.96 2did s SER 48 Ca 0.28 -0.20 -0.14 0.00 0.70 0.00 0.00 55.95 56.59 2did s SER 48 Cb 0.22 -1.07 -0.05 0.00 -1.71 0.00 0.00 66.02 63.42 2did s SER 48 CO 0.00 0.23 0.31 -0.83 1.20 0.00 0.00 173.24 174.15 2did s GLY 49 N -1.87 2.25 -0.79 9.45 0.00 -1.26 -5.01 107.32 110.09 2did s GLY 49 Ca 0.21 -0.42 -0.25 0.00 0.00 0.00 0.00 44.72 44.26 2did s GLY 49 CO 0.12 0.37 1.92 2.56 0.00 0.00 0.00 173.10 178.07 2did s PRO 50 N 0.19 2.58 -0.32 2.90 0.04 -1.26 -4.92 135.00 134.21 2did s PRO 50 Ca 0.18 0.04 0.03 0.00 0.04 0.00 0.00 61.00 61.30 2did s PRO 50 Cb -0.14 -4.81 0.09 0.00 0.04 0.00 0.00 34.50 29.68 2did s PRO 50 CO 0.06 -3.14 0.01 0.45 0.04 0.00 0.00 177.00 174.41 2did s SER 51 N 8.07 4.70 -0.11 6.66 0.15 -1.26 -5.08 113.70 126.83 2did s SER 51 Ca 0.69 -1.90 -0.16 0.00 0.70 0.00 0.00 55.95 55.28 2did s SER 51 Cb -0.09 -1.62 0.04 0.00 -1.71 0.00 0.00 66.02 62.64 2did s SER 51 CO 0.07 -0.33 0.41 -0.94 1.20 0.00 0.00 173.24 173.65 2did s SER 52 N 1.01 -0.39 0.00 5.45 1.04 -1.26 -5.32 113.70 114.23 2did s SER 52 Ca 0.04 0.62 0.25 0.00 0.48 0.00 0.00 55.95 57.35 2did s SER 52 Cb -0.19 0.68 0.42 0.00 0.10 0.00 0.00 66.02 67.03 2did s SER 52 CO -0.07 -0.27 1.39 0.61 0.98 0.00 0.00 173.24 175.89