#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 0.16 -0.02 1.61 7.64 -1.26 -4.93 113.62 116.82 2did n SER 2 Ca 0.00 0.09 -0.03 0.00 1.01 0.00 0.00 58.87 59.93 2did n SER 2 Cb 0.00 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2did n SER 2 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2did h SER 3 N 0.00 -0.05 -3.84 6.43 0.02 -2.15 -3.50 113.55 110.45 2did h SER 3 Ca 0.00 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 2did h SER 3 Cb 0.40 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2did h SER 3 CO 0.00 0.52 -0.53 0.61 -1.14 0.00 0.00 176.83 176.28 2did n GLY 4 N 1.56 -4.59 3.56 -3.77 0.00 -1.26 -5.00 105.19 95.69 2did n GLY 4 Ca -0.03 -0.49 -0.29 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.43 1.09 0.19 1.61 0.01 -1.26 -5.07 113.70 109.85 2did s SER 5 Ca 0.00 0.94 0.11 0.00 1.31 0.00 0.00 55.95 58.31 2did s SER 5 Cb 0.00 -1.41 -0.04 0.00 0.21 0.00 0.00 66.02 64.78 2did s SER 5 CO 0.00 -4.05 -0.23 -0.44 0.41 0.00 0.00 173.24 168.93 2did s SER 6 N -3.46 3.26 -0.14 2.44 0.01 -1.26 -5.06 113.70 109.49 2did s SER 6 Ca 0.69 -0.87 -0.01 0.00 1.31 0.00 0.00 55.95 57.07 2did s SER 6 Cb -0.15 -0.23 -0.08 0.00 0.21 0.00 0.00 66.02 65.76 2did s SER 6 CO 0.58 0.08 -0.13 0.61 0.41 0.00 0.00 173.24 174.79 2did n GLY 7 N 0.25 -0.19 2.98 3.44 0.00 -1.26 -5.02 105.19 105.39 2did n GLY 7 Ca -0.12 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.27 1.12 0.41 1.61 -1.05 -1.26 -5.12 118.70 112.14 2did s GLU 8 Ca -0.18 -0.29 -0.26 0.00 -0.15 0.00 0.00 54.97 54.09 2did s GLU 8 Cb 0.05 -1.01 -0.10 0.00 -0.44 0.00 0.00 34.13 32.63 2did s GLU 8 CO 0.30 0.05 1.34 0.43 0.95 0.00 0.00 175.26 178.33 2did n SER 9 N 3.60 2.93 -3.75 0.83 7.64 -1.26 -4.97 113.62 118.64 2did n SER 9 Ca -0.21 1.14 -0.13 0.00 1.01 0.00 0.00 58.87 60.68 2did n SER 9 Cb 0.53 -1.54 -0.11 0.00 -1.01 0.00 0.00 64.21 62.08 2did n SER 9 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2did s LEU 10 N -1.88 0.60 0.24 -3.43 1.43 -1.26 -2.52 118.68 111.86 2did s LEU 10 Ca 0.59 0.72 -0.31 0.00 -1.03 0.00 0.00 54.13 54.10 2did s LEU 10 Cb -0.50 1.21 -0.13 0.00 0.03 0.00 0.00 46.19 46.80 2did s LEU 10 CO 0.59 -0.13 1.51 0.00 0.23 0.00 0.00 176.35 178.55 2did n PRO 12 N 2.37 0.41 0.00 0.00 -0.04 -1.26 0.17 135.00 136.65 2did n PRO 12 Ca 0.12 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2did n PRO 12 Cb 0.33 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.08 0.17 -0.03 0.54 0.00 -1.26 -4.80 117.38 110.92 2did n GLN 13 Ca 0.10 0.00 0.07 0.00 -0.00 0.00 0.00 57.00 57.18 2did n GLN 13 Cb 0.07 -0.91 -0.17 0.00 0.00 0.00 0.00 30.24 29.23 2did n GLN 13 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2did n HIS 14 N -2.30 0.00 -3.71 3.69 8.25 -1.20 -5.00 115.22 114.95 2did n HIS 14 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.20 2did n HIS 14 Cb 0.41 -0.59 0.06 0.00 1.12 0.00 0.00 29.99 30.99 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 -2.34 -2.58 -5.06 4.41 8.25 0.44 -4.86 115.22 113.48 2did n HIS 15 Ca -0.09 0.96 -0.30 0.00 -0.26 0.00 0.00 57.72 58.04 2did n HIS 15 Cb 0.67 -4.62 -0.15 0.00 1.12 0.00 0.00 29.99 27.01 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 -6.35 1.87 -0.21 -0.41 0.41 -1.26 -4.66 118.70 108.09 2did s GLU 16 Ca 0.55 -0.97 -0.31 0.00 -0.41 0.00 0.00 54.97 53.83 2did s GLU 16 Cb -0.26 -1.91 -0.14 0.00 -1.78 0.00 0.00 34.13 30.05 2did s GLU 16 CO 0.77 0.51 0.97 0.00 -0.49 0.00 0.00 175.26 177.02 2did n ALA 17 N 2.16 -1.64 -2.91 5.21 0.00 -1.25 -2.29 120.51 119.79 2did n ALA 17 Ca -0.16 0.38 -0.44 0.00 0.00 0.00 0.00 53.44 53.22 2did n ALA 17 Cb 0.52 -1.29 -0.03 0.00 0.00 0.00 0.00 19.45 18.64 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 1.26 4.78 -0.26 0.00 1.43 -1.05 -4.52 118.68 120.33 2did s LEU 18 Ca 0.69 -1.52 0.09 0.00 -1.03 0.00 0.00 54.13 52.36 2did s LEU 18 Cb -0.98 -2.40 0.45 0.00 0.03 0.00 0.00 46.19 43.28 2did s LEU 18 CO 0.50 -1.24 1.28 -0.24 0.23 0.00 0.00 176.35 176.88 2did n SER 19 N 7.06 2.95 -4.00 2.29 2.88 -1.26 -4.87 113.62 118.67 2did n SER 19 Ca 0.09 -3.84 -0.10 0.00 -1.33 0.00 0.00 58.87 53.69 2did n SER 19 Cb 0.47 -0.51 -0.06 0.00 -0.75 0.00 0.00 64.21 63.36 2did n SER 19 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2did s LEU 20 N -3.37 0.55 -0.23 2.46 1.43 -1.19 -2.36 118.68 115.97 2did s LEU 20 Ca 0.44 -0.95 -0.23 0.00 -1.03 0.00 0.00 54.13 52.36 2did s LEU 20 Cb 0.39 1.48 0.06 0.00 0.03 0.00 0.00 46.19 48.16 2did s LEU 20 CO -0.03 -1.04 0.65 0.12 0.23 0.00 0.00 176.35 176.28 2did s PHE 21 N -4.02 -0.71 -0.21 0.29 2.19 0.13 -2.61 117.98 113.05 2did s PHE 21 Ca 0.23 1.70 -0.10 0.00 0.33 0.00 0.00 56.93 59.09 2did s PHE 21 Cb 0.01 0.25 -0.05 0.00 -1.31 0.00 0.00 43.02 41.93 2did s PHE 21 CO 0.07 -0.36 0.13 0.00 1.83 0.00 0.00 175.22 176.88 2did h TYR 23 N 6.84 -0.01 -0.83 0.00 0.05 -1.71 0.07 116.97 121.38 2did h TYR 23 Ca -0.40 -0.00 0.10 0.00 0.05 0.00 0.00 58.73 58.48 2did h TYR 23 Cb 1.16 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.82 2did h TYR 23 CO 0.60 0.85 0.47 0.93 -1.05 0.00 0.00 178.16 179.96 2did h GLU 24 N -0.92 0.76 0.00 4.88 5.08 -1.95 0.00 114.58 122.43 2did h GLU 24 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2did h GLU 24 Cb 0.86 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2did h GLU 24 CO 0.00 0.50 -0.41 -0.25 -1.00 0.00 0.00 179.01 177.86 2did n ASP 25 N -4.75 0.57 -3.85 1.42 8.00 -1.25 -4.95 116.55 111.74 2did n ASP 25 Ca 0.14 0.16 -0.25 0.00 0.71 0.00 0.00 54.79 55.54 2did n ASP 25 Cb 0.29 -0.06 0.01 0.00 -0.02 0.00 0.00 41.12 41.33 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 -1.90 -4.54 -4.04 -1.24 1.13 -0.01 -4.97 117.38 101.80 2did n GLN 26 Ca 0.05 0.54 -0.10 0.00 -1.94 0.00 0.00 57.00 55.55 2did n GLN 26 Cb 0.40 -5.08 -0.06 0.00 0.11 0.00 0.00 30.24 25.60 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 -6.34 1.46 0.09 -1.09 -1.05 -0.75 -5.01 118.70 106.02 2did s GLU 27 Ca 0.21 -1.33 -0.11 0.00 -0.15 0.00 0.00 54.97 53.59 2did s GLU 27 Cb -0.11 0.42 -0.06 0.00 -0.44 0.00 0.00 34.13 33.95 2did s GLU 27 CO 0.84 -0.58 0.44 0.00 0.95 0.00 0.00 175.26 176.91 2did s ALA 28 N -4.05 3.69 0.31 -0.84 0.00 -1.26 -0.29 121.76 119.32 2did s ALA 28 Ca 0.26 -0.31 0.02 0.00 0.00 0.00 0.00 51.96 51.93 2did s ALA 28 Cb 0.01 -2.34 -0.02 0.00 0.00 0.00 0.00 23.12 20.77 2did s ALA 28 CO 0.09 0.53 0.33 0.14 0.00 0.00 0.00 175.76 176.85 2did s VAL 29 N -1.40 0.00 0.28 0.00 -7.23 -1.07 -4.87 120.40 106.10 2did s VAL 29 Ca 0.34 -1.85 0.02 0.00 -1.81 0.00 0.00 61.98 58.68 2did s VAL 29 Cb -0.14 -2.53 0.02 0.00 0.56 0.00 0.00 36.38 34.29 2did s VAL 29 CO 0.18 0.00 0.19 0.00 -0.31 0.00 0.00 175.10 175.16 2did h LEU 31 N 0.00 1.05 -0.51 0.00 -0.00 -1.90 -0.96 115.31 113.00 2did h LEU 31 Ca -0.18 -0.24 -0.03 0.00 -0.00 0.00 0.00 57.88 57.42 2did h LEU 31 Cb 0.64 -0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 41.00 2did h LEU 31 CO 0.28 1.02 0.18 0.40 -0.00 0.00 0.00 178.44 180.33 2did h ILE 32 N 1.03 1.22 -0.19 0.15 5.03 -1.96 -3.08 117.51 119.72 2did h ILE 32 Ca 0.21 -0.72 -0.03 0.00 -0.12 0.00 0.00 64.86 64.21 2did h ILE 32 Cb 0.39 0.74 -0.01 0.00 -3.03 0.00 0.00 36.82 34.92 2did h ILE 32 CO 0.01 0.27 0.00 0.00 -0.68 0.00 0.00 178.15 177.75 2did h ALA 34 N 0.79 3.32 -0.81 0.00 0.00 -1.09 0.72 119.26 122.20 2did h ALA 34 Ca 0.05 -0.02 -0.57 0.00 0.00 0.00 0.00 54.91 54.38 2did h ALA 34 Cb 0.38 0.13 -0.41 0.00 0.00 0.00 0.00 17.79 17.89 2did h ALA 34 CO 0.01 -1.82 -0.61 0.44 0.00 0.00 0.00 179.25 177.27 2did n ILE 35 N -4.20 2.66 -4.29 0.00 -5.35 -1.07 -4.65 119.36 102.45 2did n ILE 35 Ca 0.36 -4.10 -0.35 0.00 -0.27 0.00 0.00 62.75 58.39 2did n ILE 35 Cb 1.59 -1.15 -0.09 0.00 -1.74 0.00 0.00 39.64 38.26 2did n ILE 35 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2did s SER 36 N -3.38 5.39 0.28 7.28 0.01 0.25 -4.95 113.70 118.57 2did s SER 36 Ca 0.52 0.17 0.06 0.00 1.31 0.00 0.00 55.95 58.01 2did s SER 36 Cb 0.42 -1.54 0.78 0.00 0.21 0.00 0.00 66.02 65.89 2did s SER 36 CO 0.02 0.37 1.36 1.41 0.41 0.00 0.00 173.24 176.81 2did n HIS 37 N 2.01 0.66 -0.06 2.43 8.25 -1.26 0.13 115.22 127.38 2did n HIS 37 Ca -0.18 1.04 -0.10 0.00 -0.26 0.00 0.00 57.72 58.21 2did n HIS 37 Cb 0.54 -1.22 -0.04 0.00 1.12 0.00 0.00 29.99 30.39 2did n HIS 37 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2did h THR 38 N 0.00 1.14 -1.41 1.59 2.02 -1.94 -2.99 112.91 111.32 2did h THR 38 Ca 0.57 -0.41 -0.71 0.00 0.77 0.00 0.00 66.41 66.63 2did h THR 38 Cb 1.29 1.03 -0.29 0.00 -1.74 0.00 0.00 68.15 68.44 2did h THR 38 CO -0.78 0.14 0.84 1.41 0.37 0.00 0.00 175.52 177.50 2did n HIS 39 N -4.85 3.12 -3.16 3.16 -0.00 0.34 -4.99 115.22 108.84 2did n HIS 39 Ca -0.04 -2.72 -0.33 0.00 -0.00 0.00 0.00 57.72 54.64 2did n HIS 39 Cb 0.10 -1.26 -0.06 0.00 -0.00 0.00 0.00 29.99 28.77 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 -3.91 4.03 -1.70 -0.41 1.81 0.27 -4.06 118.95 114.98 2did s ARG 40 Ca 0.59 0.67 -0.15 0.00 -1.72 0.00 0.00 55.73 55.12 2did s ARG 40 Cb 0.47 -2.55 0.14 0.00 -0.45 0.00 0.00 34.95 32.56 2did s ARG 40 CO -0.18 0.22 0.56 0.00 -0.68 0.00 0.00 175.30 175.22 2did n ALA 41 N -0.11 -1.46 -2.27 2.13 0.00 -1.26 -4.93 120.51 112.61 2did n ALA 41 Ca 0.02 -0.17 -0.23 0.00 0.00 0.00 0.00 53.44 53.06 2did n ALA 41 Cb 0.53 -2.50 -0.01 0.00 0.00 0.00 0.00 19.45 17.47 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 -3.54 2.12 -0.97 0.00 3.76 -1.26 -5.07 115.29 110.33 2did s HIS 42 Ca 0.56 -0.66 -0.10 0.00 -0.15 0.00 0.00 55.06 54.70 2did s HIS 42 Cb -0.31 -2.08 0.25 0.00 1.11 0.00 0.00 32.58 31.55 2did s HIS 42 CO 0.97 -0.39 0.93 0.99 -0.85 0.00 0.00 174.74 176.39 2did s THR 43 N -2.62 5.68 0.02 1.30 2.01 -1.26 -5.04 115.64 115.74 2did s THR 43 Ca 0.44 -3.06 -0.02 0.00 0.31 0.00 0.00 61.69 59.36 2did s THR 43 Cb -0.03 -4.46 -0.04 0.00 0.01 0.00 0.00 72.50 67.98 2did s THR 43 CO 0.27 -1.11 0.21 -0.69 -0.69 0.00 0.00 174.62 172.61 2did s VAL 44 N -0.66 5.39 0.02 3.82 1.01 -1.26 -2.14 120.40 126.58 2did s VAL 44 Ca 0.25 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.07 2did s VAL 44 Cb -0.10 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 2did s VAL 44 CO -0.08 0.26 -0.07 0.68 0.00 0.00 0.00 175.10 175.89 2did s VAL 45 N -1.40 0.50 0.17 2.92 -7.23 0.10 -4.91 120.40 110.56 2did s VAL 45 Ca 0.30 -0.59 -0.30 0.00 -1.81 0.00 0.00 61.98 59.58 2did s VAL 45 Cb -0.13 -0.48 -0.08 0.00 0.56 0.00 0.00 36.38 36.25 2did s VAL 45 CO 0.21 -0.08 1.32 -2.16 -0.31 0.00 0.00 175.10 174.09 2did s PRO 46 N -0.73 4.38 0.28 4.82 0.04 -1.26 0.20 135.00 142.73 2did s PRO 46 Ca -0.03 2.04 -0.05 0.00 0.04 0.00 0.00 61.00 63.00 2did s PRO 46 Cb -0.05 -3.22 -0.05 0.00 0.04 0.00 0.00 34.50 31.22 2did s PRO 46 CO 0.00 -0.30 0.55 -0.51 0.04 0.00 0.00 177.00 176.78 2did s LEU 47 N 0.25 4.07 0.32 -3.56 1.43 -0.99 -4.88 118.68 115.32 2did s LEU 47 Ca 0.59 0.73 -0.26 0.00 -1.03 0.00 0.00 54.13 54.16 2did s LEU 47 Cb -0.36 -3.54 -0.10 0.00 0.03 0.00 0.00 46.19 42.22 2did s LEU 47 CO 0.36 -0.18 0.94 -0.55 0.23 0.00 0.00 176.35 177.15 2did s SER 48 N -3.07 7.32 0.00 2.29 0.15 -1.26 -4.79 113.70 114.34 2did s SER 48 Ca 0.44 1.82 0.00 0.00 0.70 0.00 0.00 55.95 58.91 2did s SER 48 Cb -0.11 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2did s SER 48 CO 0.29 -0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.27 2did n GLY 49 N 0.53 -0.80 3.73 9.45 0.00 -1.26 -5.10 105.19 111.73 2did n GLY 49 Ca 0.02 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.49 4.36 1.09 1.61 0.04 -1.26 -5.01 135.00 135.35 2did s PRO 50 Ca 0.00 2.04 -0.12 0.00 0.04 0.00 0.00 61.00 62.96 2did s PRO 50 Cb 0.00 -3.23 0.24 0.00 0.04 0.00 0.00 34.50 31.55 2did s PRO 50 CO 0.00 -0.34 1.06 -1.12 0.04 0.00 0.00 177.00 176.64 2did s SER 51 N 0.75 1.60 -0.44 6.66 0.01 -1.26 -4.99 113.70 116.03 2did s SER 51 Ca 0.60 1.59 -0.09 0.00 1.31 0.00 0.00 55.95 59.36 2did s SER 51 Cb -0.36 -2.29 0.10 0.00 0.21 0.00 0.00 66.02 63.68 2did s SER 51 CO 0.34 -3.83 0.29 -0.55 0.41 0.00 0.00 173.24 169.90 2did s SER 52 N -2.70 5.65 0.00 2.44 0.15 -1.26 -5.28 113.70 112.69 2did s SER 52 Ca 0.67 -1.71 0.00 0.00 0.70 0.00 0.00 55.95 55.62 2did s SER 52 Cb -0.23 -1.99 0.00 0.00 -1.71 0.00 0.00 66.02 62.09 2did s SER 52 CO 0.62 -0.61 0.22 0.61 1.20 0.00 0.00 173.24 175.29