#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qgm s ILE 2 N 0.00 5.03 -0.25 1.34 -1.09 0.73 -4.88 121.20 122.08 1qgm s ILE 2 Ca 0.00 0.66 0.02 0.00 -2.23 0.00 0.00 60.65 59.10 1qgm s ILE 2 Cb 0.00 -3.69 0.06 0.00 -1.58 0.00 0.00 42.46 37.25 1qgm s ILE 2 CO 0.00 0.39 -0.08 -1.00 -1.23 0.00 0.00 174.94 173.03 1qgm s HIS 3 N -1.29 2.85 0.00 3.97 3.76 -1.26 -1.65 115.29 121.68 1qgm s HIS 3 Ca 0.30 -2.07 0.04 0.00 -0.15 0.00 0.00 55.06 53.18 1qgm s HIS 3 Cb -0.15 -1.79 0.07 0.00 1.11 0.00 0.00 32.58 31.82 1qgm s HIS 3 CO 0.16 -0.83 0.86 0.00 -0.85 0.00 0.00 174.74 174.09 1qgm n ASP 5 N 0.08 0.27 0.19 0.00 8.00 -1.26 -5.00 116.55 118.83 1qgm n ASP 5 Ca -0.03 -0.62 -0.09 0.00 0.71 0.00 0.00 54.79 54.76 1qgm n ASP 5 Cb 0.71 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.76 1qgm n ASP 5 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qgm h ALA 6 N 1.00 -0.55 0.00 2.24 0.00 -2.03 -3.46 119.26 116.47 1qgm h ALA 6 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1qgm h ALA 6 Cb 0.00 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1qgm h ALA 6 CO 0.00 -0.52 -0.18 0.00 0.00 0.00 0.00 179.25 178.55 1qgm n ALA 7 N -2.72 2.63 -1.42 0.00 0.00 -1.26 -5.04 120.51 112.71 1qgm n ALA 7 Ca -0.07 0.00 -0.57 0.00 0.00 0.00 0.00 53.44 52.80 1qgm n ALA 7 Cb 0.23 0.09 -0.09 0.00 0.00 0.00 0.00 19.45 19.68 1qgm n ALA 7 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1qgm n THR 8 N -2.26 0.11 -2.29 0.00 -1.04 -1.26 -4.90 114.28 102.64 1qgm n THR 8 Ca 0.00 -0.11 -0.26 0.00 -2.04 0.00 0.00 64.05 61.64 1qgm n THR 8 Cb 0.09 -1.03 0.05 0.00 -1.82 0.00 0.00 70.33 67.62 1qgm n THR 8 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1qgm s ILE 9 N 5.96 2.93 0.01 12.58 1.01 -1.26 -4.59 121.20 137.84 1qgm s ILE 9 Ca 1.12 -0.14 0.04 0.00 0.00 0.00 0.00 60.65 61.68 1qgm s ILE 9 Cb -1.20 -3.21 -0.01 0.00 0.01 0.00 0.00 42.46 38.04 1qgm s ILE 9 CO 0.61 -0.23 -0.14 0.00 0.00 0.00 0.00 174.94 175.19 1qgm n PRO 11 N 2.48 -0.02 -3.47 0.00 -0.04 -1.26 0.26 135.00 132.95 1qgm n PRO 11 Ca -0.15 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.98 1qgm n PRO 11 Cb 0.55 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.96 1qgm n PRO 11 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1qgm s ASP 12 N -1.27 6.63 0.00 3.54 1.11 -1.26 -3.85 116.67 121.57 1qgm s ASP 12 Ca 0.00 0.87 0.00 0.00 0.18 0.00 0.00 52.55 53.60 1qgm s ASP 12 Cb 0.00 -2.21 0.00 0.00 1.07 0.00 0.00 42.92 41.78 1qgm s ASP 12 CO 0.00 0.00 0.00 0.61 1.18 0.00 0.00 175.17 176.96 1qgm n GLY 13 N 0.16 0.87 3.67 0.21 0.00 -1.26 -5.02 105.19 103.82 1qgm n GLY 13 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 1qgm n GLY 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qgm s THR 14 N -3.45 2.10 0.02 2.61 -4.23 -1.25 -3.75 115.64 107.68 1qgm s THR 14 Ca 0.00 -1.88 0.03 0.00 -1.18 0.00 0.00 61.69 58.66 1qgm s THR 14 Cb 0.00 -2.98 -0.02 0.00 1.34 0.00 0.00 72.50 70.85 1qgm s THR 14 CO 0.00 0.00 -0.09 0.28 -0.54 0.00 0.00 174.62 174.27 1qgm s THR 15 N -2.67 0.65 0.33 3.99 -1.32 0.07 -4.90 115.64 111.78 1qgm s THR 15 Ca 0.37 -0.71 -0.27 0.00 -1.21 0.00 0.00 61.69 59.87 1qgm s THR 15 Cb 0.07 -0.61 -0.13 0.00 -1.51 0.00 0.00 72.50 70.32 1qgm s THR 15 CO 0.19 -0.07 1.10 0.00 -2.21 0.00 0.00 174.62 173.64 1qgm s SER 17 N -0.50 -1.05 -0.30 0.00 0.15 0.97 -4.63 113.70 108.33 1qgm s SER 17 Ca 0.58 1.54 -0.11 0.00 0.70 0.00 0.00 55.95 58.65 1qgm s SER 17 Cb -0.63 1.90 -0.03 0.00 -1.71 0.00 0.00 66.02 65.54 1qgm s SER 17 CO 0.60 -0.23 0.20 -0.22 1.20 0.00 0.00 173.24 174.79 1qgm s LEU 18 N 2.34 4.17 0.99 3.45 0.20 -1.26 -1.00 118.68 127.56 1qgm s LEU 18 Ca -0.08 -0.22 -0.12 0.00 0.69 0.00 0.00 54.13 54.40 1qgm s LEU 18 Cb -0.09 -2.10 0.12 0.00 -0.43 0.00 0.00 46.19 43.69 1qgm s LEU 18 CO -0.19 -0.13 0.71 -1.54 -0.29 0.00 0.00 176.35 174.91 1qgm n SER 19 N 5.06 -1.18 0.00 3.68 3.41 0.14 -4.81 113.62 119.91 1qgm n SER 19 Ca -0.14 0.25 0.07 0.00 -0.26 0.00 0.00 58.87 58.80 1qgm n SER 19 Cb 0.51 -1.29 0.34 0.00 -0.26 0.00 0.00 64.21 63.51 1qgm n SER 19 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1qgm n PRO 20 N -3.08 0.15 0.00 4.33 -0.04 -1.26 -1.49 135.00 133.61 1qgm n PRO 20 Ca 0.08 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.82 1qgm n PRO 20 Cb 0.54 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 1qgm n PRO 20 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1qgm n TYR 21 N -1.34 0.00 -0.04 0.54 4.01 -1.26 -4.94 117.16 114.13 1qgm n TYR 21 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1qgm n TYR 21 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 1qgm n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qgm n GLY 22 N 1.43 0.98 3.58 2.72 0.00 -0.55 -5.06 105.19 108.28 1qgm n GLY 22 Ca 0.08 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1qgm n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qgm s VAL 23 N -2.00 4.87 -0.03 1.61 1.01 -1.25 -4.83 120.40 119.78 1qgm s VAL 23 Ca 0.00 0.72 -0.30 0.00 0.00 0.00 0.00 61.98 62.40 1qgm s VAL 23 Cb 0.00 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1qgm s VAL 23 CO 0.00 -0.29 1.25 0.26 0.00 0.00 0.00 175.10 176.32 1qgm s TRP 24 N 2.76 3.13 0.31 5.22 0.23 -1.26 -0.69 118.94 128.65 1qgm s TRP 24 Ca 0.26 1.12 -0.12 0.00 -2.03 0.00 0.00 56.10 55.33 1qgm s TRP 24 Cb -0.14 -3.48 0.02 0.00 0.03 0.00 0.00 33.47 29.89 1qgm s TRP 24 CO 0.14 -1.60 0.60 1.52 0.96 0.00 0.00 176.95 178.58 1qgm s TYR 25 N 2.12 0.38 -0.23 -1.98 -0.85 -0.17 -4.96 117.35 111.66 1qgm s TYR 25 Ca 0.58 -0.81 -0.01 0.00 -0.52 0.00 0.00 57.07 56.31 1qgm s TYR 25 Cb -0.27 0.39 0.02 0.00 0.38 0.00 0.00 41.96 42.48 1qgm s TYR 25 CO 0.24 -1.23 -0.08 0.00 -1.52 0.00 0.00 175.55 172.96 1qgm s SER 27 N 1.34 7.21 -0.20 0.00 0.15 0.69 -4.62 113.70 118.26 1qgm s SER 27 Ca 0.02 1.44 -0.29 0.00 0.70 0.00 0.00 55.95 57.82 1qgm s SER 27 Cb -0.16 -2.47 -0.01 0.00 -1.71 0.00 0.00 66.02 61.68 1qgm s SER 27 CO -0.06 0.02 1.33 -2.16 1.20 0.00 0.00 173.24 173.57 1qgm s PRO 28 N -0.06 4.10 0.24 5.44 0.04 -1.26 -0.75 135.00 142.74 1qgm s PRO 28 Ca 0.38 1.57 0.11 0.00 0.04 0.00 0.00 61.00 63.10 1qgm s PRO 28 Cb -0.20 -3.83 -0.05 0.00 0.04 0.00 0.00 34.50 30.45 1qgm s PRO 28 CO 0.23 -0.89 -0.20 -0.59 0.04 0.00 0.00 177.00 175.59 1qgm s PHE 29 N 3.94 2.18 0.00 0.56 -0.71 -1.25 -4.97 117.98 117.73 1qgm s PHE 29 Ca 0.58 -0.38 0.00 0.00 -1.04 0.00 0.00 56.93 56.09 1qgm s PHE 29 Cb -0.21 -1.00 0.00 0.00 -1.21 0.00 0.00 43.02 40.60 1qgm s PHE 29 CO 0.19 0.59 0.00 0.43 -1.34 0.00 0.00 175.22 175.09