#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qgm n ILE 2 N 0.00 0.73 0.03 1.34 2.08 0.24 -4.26 119.36 119.51 1qgm n ILE 2 Ca 0.00 -0.47 0.00 0.00 0.56 0.00 0.00 62.75 62.84 1qgm n ILE 2 Cb 0.00 -0.28 0.00 0.00 -0.75 0.00 0.00 39.64 38.61 1qgm n ILE 2 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 1qgm n HIS 3 N -1.95 -0.03 0.00 1.39 8.25 -1.26 0.26 115.22 121.87 1qgm n HIS 3 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1qgm n HIS 3 Cb 0.49 0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.62 1qgm n HIS 3 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1qgm n ASP 5 N 0.23 -0.54 -0.01 0.00 8.00 -1.26 -4.94 116.55 118.03 1qgm n ASP 5 Ca 0.00 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.59 1qgm n ASP 5 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 40.96 1qgm n ASP 5 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qgm n ALA 6 N -2.71 2.66 -0.97 2.24 0.00 -1.26 -4.94 120.51 115.53 1qgm n ALA 6 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1qgm n ALA 6 Cb 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 -2.11 2.03 -1.49 0.00 0.00 -1.26 -5.07 120.51 112.61 1qgm n ALA 7 Ca -0.03 0.00 -0.56 0.00 0.00 0.00 0.00 53.44 52.85 1qgm n ALA 7 Cb 0.46 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.84 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 -1.05 0.43 -2.94 0.00 -1.04 -1.26 -4.94 114.28 103.47 1qgm n THR 8 Ca 0.00 -0.11 -0.20 0.00 -2.04 0.00 0.00 64.05 61.71 1qgm n THR 8 Cb 0.00 -0.12 0.05 0.00 -1.82 0.00 0.00 70.33 68.44 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 -0.16 2.39 -0.05 12.58 1.09 -1.26 -4.54 121.20 131.26 1qgm s ILE 9 Ca 0.84 -0.92 0.03 0.00 -1.10 0.00 0.00 60.65 59.50 1qgm s ILE 9 Cb -1.15 -2.47 0.01 0.00 -1.06 0.00 0.00 42.46 37.79 1qgm s ILE 9 CO 0.56 0.00 -0.11 0.00 -0.10 0.00 0.00 174.94 175.28 1qgm s PRO 11 N 0.42 3.72 0.15 0.00 0.04 -1.26 0.79 135.00 138.85 1qgm s PRO 11 Ca -0.08 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1qgm s PRO 11 Cb -0.12 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.32 1qgm s PRO 11 CO 0.02 -0.47 0.00 -0.25 0.04 0.00 0.00 177.00 176.34 1qgm n ASP 12 N -1.73 -3.78 0.19 6.66 9.92 -1.26 -4.14 116.55 122.41 1qgm n ASP 12 Ca 0.07 0.27 -0.11 0.00 -0.53 0.00 0.00 54.79 54.49 1qgm n ASP 12 Cb 0.54 -2.26 -0.06 0.00 -0.64 0.00 0.00 41.12 38.69 1qgm n ASP 12 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1qgm h GLY 13 N -0.64 -1.02 -0.66 0.44 0.00 -1.99 -3.36 103.07 95.85 1qgm h GLY 13 Ca 0.01 0.46 0.08 0.00 0.00 0.00 0.00 47.33 47.88 1qgm h GLY 13 CO 0.01 -0.33 -0.11 -1.30 0.00 0.00 0.00 176.54 174.81 1qgm n THR 14 N -4.18 0.00 -4.11 4.70 -2.24 -1.26 -4.75 114.28 102.44 1qgm n THR 14 Ca -0.07 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.59 1qgm n THR 14 Cb 0.28 -0.10 -0.11 0.00 -2.10 0.00 0.00 70.33 68.30 1qgm n THR 14 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1qgm s THR 15 N -1.18 0.57 0.06 4.28 -1.32 0.94 -4.87 115.64 114.13 1qgm s THR 15 Ca 0.00 -1.54 -0.31 0.00 -1.21 0.00 0.00 61.69 58.63 1qgm s THR 15 Cb 0.00 -1.18 -0.07 0.00 -1.51 0.00 0.00 72.50 69.74 1qgm s THR 15 CO 0.00 -0.67 1.40 0.00 -2.21 0.00 0.00 174.62 173.13 1qgm s SER 17 N 1.48 0.38 -0.13 0.00 0.01 -0.09 -4.85 113.70 110.50 1qgm s SER 17 Ca 0.64 0.25 -0.06 0.00 1.31 0.00 0.00 55.95 58.09 1qgm s SER 17 Cb -0.34 0.15 -0.04 0.00 0.21 0.00 0.00 66.02 66.00 1qgm s SER 17 CO 0.29 -0.19 0.10 -0.22 0.41 0.00 0.00 173.24 173.63 1qgm s LEU 18 N 1.70 4.16 0.77 2.44 0.20 -1.26 -1.02 118.68 125.67 1qgm s LEU 18 Ca -0.03 0.34 -0.12 0.00 0.69 0.00 0.00 54.13 55.01 1qgm s LEU 18 Cb -0.12 -2.02 0.05 0.00 -0.43 0.00 0.00 46.19 43.68 1qgm s LEU 18 CO -0.05 0.35 1.13 -0.94 -0.29 0.00 0.00 176.35 176.55 1qgm s SER 19 N -0.67 4.84 0.00 3.68 1.04 -0.05 -4.88 113.70 117.66 1qgm s SER 19 Ca 0.12 0.99 0.14 0.00 0.48 0.00 0.00 55.95 57.69 1qgm s SER 19 Cb -0.12 -1.65 0.66 0.00 0.10 0.00 0.00 66.02 65.02 1qgm s SER 19 CO 0.02 -1.71 1.42 -0.81 0.98 0.00 0.00 173.24 173.14 1qgm n PRO 20 N -3.23 0.10 0.00 4.02 -0.04 -1.26 -1.54 135.00 133.05 1qgm n PRO 20 Ca 0.07 0.21 0.09 0.00 -0.04 0.00 0.00 63.50 63.83 1qgm n PRO 20 Cb 0.59 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.58 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 -1.40 0.00 -0.38 0.54 4.01 -1.26 -4.94 117.16 113.73 1qgm n TYR 21 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1qgm n TYR 21 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 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 1.17 1.21 3.55 2.72 0.00 -0.59 -5.06 105.19 108.19 1qgm n GLY 22 Ca 0.09 -0.25 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 5.08 -0.11 1.61 1.01 -1.25 -4.82 120.40 119.92 1qgm s VAL 23 Ca 0.00 0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.87 1qgm s VAL 23 Cb 0.00 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 1qgm s VAL 23 CO 0.00 -0.17 1.17 0.26 0.00 0.00 0.00 175.10 176.35 1qgm s TRP 24 N 2.22 3.17 0.27 5.22 0.23 -1.26 -0.87 118.94 127.93 1qgm s TRP 24 Ca 0.15 1.25 -0.06 0.00 -2.03 0.00 0.00 56.10 55.42 1qgm s TRP 24 Cb -0.16 -3.39 -0.01 0.00 0.03 0.00 0.00 33.47 29.94 1qgm s TRP 24 CO 0.13 -1.14 0.40 1.52 0.96 0.00 0.00 176.95 178.81 1qgm s TYR 25 N 2.59 0.83 0.03 -1.98 1.13 -0.18 -4.99 117.35 114.78 1qgm s TYR 25 Ca 0.53 -1.10 0.02 0.00 -1.41 0.00 0.00 57.07 55.11 1qgm s TYR 25 Cb -0.22 -0.09 -0.04 0.00 -1.10 0.00 0.00 41.96 40.51 1qgm s TYR 25 CO 0.18 -0.97 0.05 0.00 -2.51 0.00 0.00 175.55 172.30 1qgm s SER 27 N -1.94 1.65 0.01 0.00 0.15 -0.17 -4.84 113.70 108.57 1qgm s SER 27 Ca 0.24 -0.59 -0.30 0.00 0.70 0.00 0.00 55.95 56.00 1qgm s SER 27 Cb -0.12 -0.06 -0.05 0.00 -1.71 0.00 0.00 66.02 64.09 1qgm s SER 27 CO 0.16 -0.06 1.23 -2.16 1.20 0.00 0.00 173.24 173.61 1qgm s PRO 28 N -1.63 4.38 0.44 5.44 0.04 -1.26 -0.04 135.00 142.37 1qgm s PRO 28 Ca -0.02 1.77 0.07 0.00 0.04 0.00 0.00 61.00 62.87 1qgm s PRO 28 Cb -0.10 -3.45 -0.01 0.00 0.04 0.00 0.00 34.50 30.99 1qgm s PRO 28 CO 0.02 -0.37 0.39 -0.59 0.04 0.00 0.00 177.00 176.49 1qgm s PHE 29 N 1.65 2.47 0.00 0.56 -0.12 -1.26 -4.93 117.98 116.34 1qgm s PHE 29 Ca 0.58 -0.57 0.00 0.00 -0.05 0.00 0.00 56.93 56.90 1qgm s PHE 29 Cb -0.28 -2.12 0.00 0.00 -0.63 0.00 0.00 43.02 39.99 1qgm s PHE 29 CO 0.26 -0.21 0.00 0.45 -0.05 0.00 0.00 175.22 175.67