#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 4.01 -0.42 1.34 -1.09 0.69 -4.87 121.20 120.87 1qgm s ILE 2 Ca 0.00 1.50 0.03 0.00 -2.23 0.00 0.00 60.65 59.95 1qgm s ILE 2 Cb 0.00 -3.76 0.16 0.00 -1.58 0.00 0.00 42.46 37.28 1qgm s ILE 2 CO 0.00 -0.03 0.31 -1.00 -1.23 0.00 0.00 174.94 172.99 1qgm s HIS 3 N -1.77 1.20 0.24 3.97 3.76 -1.26 -1.23 115.29 120.20 1qgm s HIS 3 Ca 0.57 -2.21 0.06 0.00 -0.15 0.00 0.00 55.06 53.33 1qgm s HIS 3 Cb -0.18 -1.09 0.26 0.00 1.11 0.00 0.00 32.58 32.68 1qgm s HIS 3 CO 0.23 -0.81 1.56 0.00 -0.85 0.00 0.00 174.74 174.87 1qgm n ASP 5 N -3.84 0.00 0.00 0.00 9.92 -1.26 -5.09 116.55 116.28 1qgm n ASP 5 Ca -0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.24 1qgm n ASP 5 Cb 0.63 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.11 1qgm n ASP 5 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1qgm n ALA 6 N -2.93 0.00 -1.35 2.24 0.00 -1.26 -5.06 120.51 112.14 1qgm n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1qgm n ALA 6 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1qgm n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qgm n ALA 7 N -0.40 0.00 -1.49 0.00 0.00 -1.26 -4.86 120.51 112.51 1qgm n ALA 7 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.98 1qgm n ALA 7 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 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 -0.93 0.12 -2.74 0.00 -1.04 -1.26 -4.92 114.28 103.50 1qgm n THR 8 Ca 0.00 -0.36 -0.24 0.00 -2.04 0.00 0.00 64.05 61.41 1qgm n THR 8 Cb 0.00 -1.82 0.02 0.00 -1.82 0.00 0.00 70.33 66.71 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 8.68 3.76 -0.00 12.58 1.01 -1.26 -4.69 121.20 141.28 1qgm s ILE 9 Ca 1.10 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 61.45 1qgm s ILE 9 Cb -0.72 -3.43 -0.01 0.00 0.01 0.00 0.00 42.46 38.31 1qgm s ILE 9 CO 0.43 -0.36 -0.08 0.00 0.00 0.00 0.00 174.94 174.93 1qgm s PRO 11 N -0.30 0.29 0.51 0.00 0.04 -1.26 0.25 135.00 134.53 1qgm s PRO 11 Ca 0.02 0.07 -0.18 0.00 0.04 0.00 0.00 61.00 60.95 1qgm s PRO 11 Cb -0.04 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.67 1qgm s PRO 11 CO -0.00 -2.73 1.01 -0.51 0.04 0.00 0.00 177.00 174.81 1qgm s ASP 12 N -4.11 6.39 0.00 6.66 1.11 -1.26 -3.51 116.67 121.95 1qgm s ASP 12 Ca 0.68 1.75 0.00 0.00 0.18 0.00 0.00 52.55 55.16 1qgm s ASP 12 Cb -0.11 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.34 1qgm s ASP 12 CO 0.54 -0.75 0.00 0.61 1.18 0.00 0.00 175.17 176.75 1qgm n GLY 13 N -0.89 1.30 3.63 0.21 0.00 -1.26 -5.03 105.19 103.15 1qgm n GLY 13 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.55 2.41 -0.16 2.61 -4.23 -1.23 -3.68 115.64 108.81 1qgm s THR 14 Ca 0.00 -1.97 0.01 0.00 -1.18 0.00 0.00 61.69 58.55 1qgm s THR 14 Cb 0.00 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 71.02 1qgm s THR 14 CO 0.00 -0.14 -0.15 0.28 -0.54 0.00 0.00 174.62 174.08 1qgm s THR 15 N -2.58 1.68 0.90 3.99 -1.32 0.17 -4.92 115.64 113.56 1qgm s THR 15 Ca 0.35 -0.74 -0.14 0.00 -1.21 0.00 0.00 61.69 59.95 1qgm s THR 15 Cb 0.03 -1.58 -0.01 0.00 -1.51 0.00 0.00 72.50 69.42 1qgm s THR 15 CO 0.19 0.44 0.27 0.00 -2.21 0.00 0.00 174.62 173.31 1qgm s SER 17 N -1.74 -0.43 -0.12 0.00 0.01 0.13 -4.56 113.70 106.98 1qgm s SER 17 Ca 0.57 0.61 -0.02 0.00 1.31 0.00 0.00 55.95 58.41 1qgm s SER 17 Cb -0.24 0.54 -0.03 0.00 0.21 0.00 0.00 66.02 66.49 1qgm s SER 17 CO 0.67 -0.31 -0.03 -0.22 0.41 0.00 0.00 173.24 173.76 1qgm s LEU 18 N -0.66 3.34 0.80 2.44 0.20 -1.26 -1.01 118.68 122.52 1qgm s LEU 18 Ca -0.01 -0.03 -0.12 0.00 0.69 0.00 0.00 54.13 54.66 1qgm s LEU 18 Cb -0.02 -1.78 0.07 0.00 -0.43 0.00 0.00 46.19 44.03 1qgm s LEU 18 CO 0.00 0.27 1.14 -0.94 -0.29 0.00 0.00 176.35 176.53 1qgm s SER 19 N -0.22 4.60 0.11 3.68 1.04 0.31 -4.88 113.70 118.34 1qgm s SER 19 Ca 0.04 0.98 0.18 0.00 0.48 0.00 0.00 55.95 57.63 1qgm s SER 19 Cb -0.13 -1.60 0.76 0.00 0.10 0.00 0.00 66.02 65.15 1qgm s SER 19 CO 0.02 -1.86 1.55 -0.81 0.98 0.00 0.00 173.24 173.12 1qgm n PRO 20 N -3.32 0.08 0.00 4.02 -0.04 -1.26 -1.51 135.00 132.97 1qgm n PRO 20 Ca 0.07 0.33 0.12 0.00 -0.04 0.00 0.00 63.50 63.98 1qgm n PRO 20 Cb 0.59 -1.66 0.14 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.81 0.00 -0.34 0.54 4.01 -1.26 -4.92 117.16 113.38 1qgm n TYR 21 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1qgm n TYR 21 Cb 0.19 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 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 1.35 0.89 3.62 2.72 0.00 -0.57 -5.05 105.19 108.15 1qgm n GLY 22 Ca 0.13 -0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 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 5.03 -0.11 1.61 1.01 -1.25 -4.81 120.40 119.89 1qgm s VAL 23 Ca 0.00 0.92 -0.26 0.00 0.00 0.00 0.00 61.98 62.64 1qgm s VAL 23 Cb 0.00 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 1qgm s VAL 23 CO 0.00 0.04 0.83 0.26 0.00 0.00 0.00 175.10 176.23 1qgm s TRP 24 N 2.39 3.51 0.29 5.22 0.23 -1.26 -0.53 118.94 128.80 1qgm s TRP 24 Ca 0.23 1.35 -0.05 0.00 -2.03 0.00 0.00 56.10 55.60 1qgm s TRP 24 Cb -0.16 -2.98 -0.01 0.00 0.03 0.00 0.00 33.47 30.36 1qgm s TRP 24 CO 0.09 -0.11 0.42 1.52 0.96 0.00 0.00 176.95 179.84 1qgm s TYR 25 N 1.56 0.89 -0.33 -1.98 1.13 -0.18 -4.96 117.35 113.49 1qgm s TYR 25 Ca 0.41 -1.15 -0.02 0.00 -1.41 0.00 0.00 57.07 54.89 1qgm s TYR 25 Cb -0.18 -0.09 0.06 0.00 -1.10 0.00 0.00 41.96 40.66 1qgm s TYR 25 CO 0.17 -1.02 0.05 0.00 -2.51 0.00 0.00 175.55 172.24 1qgm s SER 27 N 1.37 6.54 0.90 0.00 0.15 0.12 -4.70 113.70 118.08 1qgm s SER 27 Ca -0.02 2.34 -0.13 0.00 0.70 0.00 0.00 55.95 58.85 1qgm s SER 27 Cb -0.20 -2.61 0.13 0.00 -1.71 0.00 0.00 66.02 61.63 1qgm s SER 27 CO -0.02 -0.66 1.15 -2.16 1.20 0.00 0.00 173.24 172.76 1qgm s PRO 28 N -2.28 1.23 -1.04 5.44 0.04 -1.26 0.41 135.00 137.54 1qgm s PRO 28 Ca 0.57 0.21 -0.12 0.00 0.04 0.00 0.00 61.00 61.69 1qgm s PRO 28 Cb -0.31 -1.86 0.23 0.00 0.04 0.00 0.00 34.50 32.61 1qgm s PRO 28 CO 0.39 -2.12 1.08 -0.06 0.04 0.00 0.00 177.00 176.33 1qgm s PHE 29 N -3.37 3.91 -0.34 0.56 0.40 -1.24 -4.65 117.98 113.26 1qgm s PHE 29 Ca 0.64 -2.31 0.00 0.00 -0.60 0.00 0.00 56.93 54.66 1qgm s PHE 29 Cb -0.13 -3.95 0.00 0.00 0.51 0.00 0.00 43.02 39.44 1qgm s PHE 29 CO 0.52 -1.08 0.08 0.43 0.70 0.00 0.00 175.22 175.87