#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fd4 s ILE 2 N 0.00 4.55 -0.04 -0.61 1.01 -1.26 -4.89 121.20 119.95 1fd4 s ILE 2 Ca 0.00 1.35 0.25 0.00 0.00 0.00 0.00 60.65 62.25 1fd4 s ILE 2 Cb 0.00 -4.37 0.44 0.00 0.01 0.00 0.00 42.46 38.54 1fd4 s ILE 2 CO 0.00 -0.54 1.16 0.61 0.00 0.00 0.00 174.94 176.17 1fd4 n GLY 3 N 4.26 1.13 3.35 6.18 0.00 -1.26 -2.16 105.19 116.68 1fd4 n GLY 3 Ca 0.09 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 1fd4 n GLY 3 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fd4 s ASP 4 N -2.29 -0.33 0.28 1.61 -4.77 -1.19 -2.21 116.67 107.78 1fd4 s ASP 4 Ca 0.33 -0.11 0.03 0.00 -3.30 0.00 0.00 52.55 49.49 1fd4 s ASP 4 Cb 0.38 0.48 0.41 0.00 -1.09 0.00 0.00 42.92 43.10 1fd4 s ASP 4 CO -0.15 -0.80 1.72 1.55 0.70 0.00 0.00 175.17 178.19 1fd4 h PRO 5 N 2.54 0.46 -0.04 2.11 0.13 -1.80 -2.30 132.00 133.09 1fd4 h PRO 5 Ca -0.33 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1fd4 h PRO 5 Cb 1.24 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1fd4 h PRO 5 CO 0.44 0.69 -0.03 0.28 -0.23 0.00 0.00 178.00 179.15 1fd4 h VAL 6 N 0.40 1.35 -0.69 1.56 2.07 -1.96 -0.26 116.25 118.73 1fd4 h VAL 6 Ca 0.06 -1.10 0.07 0.00 0.82 0.00 0.00 66.70 66.55 1fd4 h VAL 6 Cb 0.69 2.01 -0.06 0.00 -1.52 0.00 0.00 31.29 32.41 1fd4 h VAL 6 CO 0.05 0.30 0.37 0.74 0.02 0.00 0.00 177.57 179.04 1fd4 h THR 7 N -0.34 0.92 -0.05 2.57 2.02 -1.98 -0.54 112.91 115.51 1fd4 h THR 7 Ca 0.01 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 1fd4 h THR 7 Cb 0.49 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1fd4 h THR 7 CO 0.01 0.12 0.02 0.00 0.37 0.00 0.00 175.52 176.04 1fd4 h LEU 9 N -0.06 0.26 -1.64 0.00 3.38 -0.91 -2.45 115.31 113.89 1fd4 h LEU 9 Ca 0.02 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1fd4 h LEU 9 Cb 0.15 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1fd4 h LEU 9 CO -0.00 0.81 -0.19 0.50 0.09 0.00 0.00 178.44 179.64 1fd4 h LYS 10 N 0.17 0.00 -0.00 1.13 3.64 -0.95 -1.85 116.57 118.70 1fd4 h LYS 10 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1fd4 h LYS 10 Cb 1.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1fd4 h LYS 10 CO 0.09 0.19 -0.04 -1.13 -2.27 0.00 0.00 179.45 176.30 1fd4 n SER 11 N -4.19 0.22 0.00 4.20 3.41 -1.00 -4.87 113.62 111.38 1fd4 n SER 11 Ca -0.02 -0.52 0.00 0.00 -0.26 0.00 0.00 58.87 58.07 1fd4 n SER 11 Cb 0.26 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1fd4 n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fd4 n GLY 12 N 1.22 0.58 0.60 5.00 0.00 -0.69 -5.08 105.19 106.82 1fd4 n GLY 12 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.15 1fd4 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fd4 n ALA 13 N -1.60 -0.05 -2.71 4.61 0.00 -0.96 -5.01 120.51 114.78 1fd4 n ALA 13 Ca 0.00 -0.29 -0.18 0.00 0.00 0.00 0.00 53.44 52.97 1fd4 n ALA 13 Cb 0.00 0.03 -0.13 0.00 0.00 0.00 0.00 19.45 19.35 1fd4 n ALA 13 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1fd4 s ILE 14 N -0.65 0.93 -0.23 0.00 -4.36 -0.57 -4.33 121.20 112.00 1fd4 s ILE 14 Ca 0.11 -1.01 -0.11 0.00 -0.26 0.00 0.00 60.65 59.38 1fd4 s ILE 14 Cb -0.00 -0.88 -0.05 0.00 1.25 0.00 0.00 42.46 42.78 1fd4 s ILE 14 CO 0.07 -0.11 0.17 0.00 0.24 0.00 0.00 174.94 175.32 1fd4 s HIS 16 N 0.90 3.24 0.34 0.00 3.76 -0.21 -4.95 115.29 118.38 1fd4 s HIS 16 Ca 0.09 0.23 0.09 0.00 -0.15 0.00 0.00 55.06 55.32 1fd4 s HIS 16 Cb -0.13 -1.84 0.62 0.00 1.11 0.00 0.00 32.58 32.34 1fd4 s HIS 16 CO 0.03 0.49 1.80 -1.00 -0.85 0.00 0.00 174.74 175.21 1fd4 h PRO 17 N 5.26 0.20 0.00 8.40 0.13 -1.87 0.77 132.00 144.89 1fd4 h PRO 17 Ca -0.50 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1fd4 h PRO 17 Cb 1.20 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1fd4 h PRO 17 CO 0.56 0.49 -0.31 0.28 -0.23 0.00 0.00 178.00 178.79 1fd4 n VAL 18 N -4.13 0.00 -3.74 1.56 0.31 -1.25 -3.33 118.33 107.75 1fd4 n VAL 18 Ca -0.01 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.22 1fd4 n VAL 18 Cb 0.39 -0.15 -0.06 0.00 -0.91 0.00 0.00 33.84 33.10 1fd4 n VAL 18 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 1fd4 s PHE 19 N -1.31 -0.05 -0.07 3.52 -0.12 -1.26 -4.76 117.98 113.93 1fd4 s PHE 19 Ca 0.00 -0.28 -0.30 0.00 -0.05 0.00 0.00 56.93 56.31 1fd4 s PHE 19 Cb 0.00 0.11 -0.02 0.00 -0.63 0.00 0.00 43.02 42.48 1fd4 s PHE 19 CO 0.00 -0.60 1.04 0.00 -0.05 0.00 0.00 175.22 175.60 1fd4 n PRO 21 N 4.73 0.47 -0.05 0.00 -0.02 -1.26 -4.73 135.00 134.13 1fd4 n PRO 21 Ca 0.08 0.21 -0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1fd4 n PRO 21 Cb 0.49 -2.14 -0.01 0.00 -0.02 0.00 0.00 33.50 31.83 1fd4 n PRO 21 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1fd4 n ARG 22 N -1.61 0.11 0.00 -0.52 0.63 -1.26 -1.77 116.66 112.24 1fd4 n ARG 22 Ca 0.12 -0.03 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 1fd4 n ARG 22 Cb 0.49 -1.49 0.00 0.00 0.45 0.00 0.00 32.46 31.91 1fd4 n ARG 22 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1fd4 n ARG 23 N 2.37 0.00 -4.36 -0.14 0.00 -1.26 -5.13 116.66 108.13 1fd4 n ARG 23 Ca 0.01 -0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.58 1fd4 n ARG 23 Cb 0.05 -0.07 -0.12 0.00 -0.00 0.00 0.00 32.46 32.33 1fd4 n ARG 23 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1fd4 s TYR 24 N 0.00 2.41 -0.34 2.89 1.51 -0.73 -4.68 117.35 118.41 1fd4 s TYR 24 Ca 0.00 -0.32 -0.12 0.00 -1.01 0.00 0.00 57.07 55.63 1fd4 s TYR 24 Cb 0.00 -1.24 -0.01 0.00 -0.11 0.00 0.00 41.96 40.60 1fd4 s TYR 24 CO 0.00 0.44 0.21 0.21 -1.11 0.00 0.00 175.55 175.29 1fd4 s LYS 25 N -2.42 3.35 0.11 -0.62 2.47 0.49 -4.82 119.74 118.29 1fd4 s LYS 25 Ca 0.19 -0.73 -0.31 0.00 -1.56 0.00 0.00 55.97 53.56 1fd4 s LYS 25 Cb -0.09 -3.72 -0.10 0.00 -1.46 0.00 0.00 37.83 32.46 1fd4 s LYS 25 CO 0.10 -0.47 1.85 -1.14 0.16 0.00 0.00 175.35 175.85 1fd4 s GLN 26 N 1.67 4.14 0.00 4.03 0.74 -1.26 -0.06 119.66 128.91 1fd4 s GLN 26 Ca 0.05 2.59 0.00 0.00 0.05 0.00 0.00 55.36 58.06 1fd4 s GLN 26 Cb -0.18 -3.70 0.00 0.00 1.10 0.00 0.00 33.01 30.23 1fd4 s GLN 26 CO 0.09 -0.86 0.88 0.44 -0.55 0.00 0.00 175.29 175.28 1fd4 n ILE 27 N 4.89 0.78 -2.95 -2.34 -5.35 0.49 -4.91 119.36 109.97 1fd4 n ILE 27 Ca 0.18 -0.84 0.00 0.00 -0.27 0.00 0.00 62.75 61.82 1fd4 n ILE 27 Cb 0.39 0.62 0.00 0.00 -1.74 0.00 0.00 39.64 38.91 1fd4 n ILE 27 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1fd4 n GLY 28 N -0.39 -0.48 3.60 3.28 0.00 -1.15 -4.62 105.19 105.43 1fd4 n GLY 28 Ca 0.00 -1.04 -0.28 0.00 0.00 0.00 0.00 46.02 44.70 1fd4 n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fd4 s THR 29 N -3.26 0.89 -0.36 2.61 -4.23 -0.92 -0.38 115.64 110.00 1fd4 s THR 29 Ca 0.00 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.57 1fd4 s THR 29 Cb 0.00 -2.34 0.45 0.00 1.34 0.00 0.00 72.50 71.95 1fd4 s THR 29 CO 0.00 0.00 1.23 0.00 -0.54 0.00 0.00 174.62 175.31 1fd4 n GLY 31 N -0.66 2.28 3.72 0.00 0.00 -0.94 -3.41 105.19 106.19 1fd4 n GLY 31 Ca 0.44 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 46.00 1fd4 n GLY 31 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1fd4 s LEU 32 N 0.00 4.37 0.37 0.99 2.34 -1.26 -4.84 118.68 120.65 1fd4 s LEU 32 Ca 0.00 2.81 -0.26 0.00 0.06 0.00 0.00 54.13 56.75 1fd4 s LEU 32 Cb 0.00 -3.60 -0.12 0.00 -0.56 0.00 0.00 46.19 41.91 1fd4 s LEU 32 CO 0.00 -0.93 0.97 -2.65 -1.06 0.00 0.00 176.35 172.68 1fd4 n PRO 33 N 3.84 1.29 0.00 1.48 -0.02 -1.26 -1.82 135.00 138.51 1fd4 n PRO 33 Ca 0.15 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1fd4 n PRO 33 Cb 0.36 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1fd4 n PRO 33 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fd4 n GLY 34 N 1.25 2.56 3.83 -1.23 0.00 -1.26 -5.03 105.19 105.31 1fd4 n GLY 34 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 1fd4 n GLY 34 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fd4 s THR 35 N -2.20 4.61 -0.05 2.61 -4.23 -0.75 -3.80 115.64 111.83 1fd4 s THR 35 Ca 0.00 1.11 0.06 0.00 -1.18 0.00 0.00 61.69 61.68 1fd4 s THR 35 Cb 0.00 -3.69 -0.01 0.00 1.34 0.00 0.00 72.50 70.14 1fd4 s THR 35 CO 0.00 -0.07 -0.24 -0.54 -0.54 0.00 0.00 174.62 173.24 1fd4 s LYS 36 N -2.67 2.39 -0.41 3.99 -0.14 0.26 -2.93 119.74 120.24 1fd4 s LYS 36 Ca 0.51 -0.85 -0.19 0.00 -1.36 0.00 0.00 55.97 54.09 1fd4 s LYS 36 Cb -0.12 -2.04 0.01 0.00 -1.68 0.00 0.00 37.83 34.00 1fd4 s LYS 36 CO 0.18 0.36 0.53 0.00 -0.76 0.00 0.00 175.35 175.66 1fd4 s LYS 39 N -0.50 -0.04 -0.24 0.00 2.47 0.92 -1.51 119.74 120.83 1fd4 s LYS 39 Ca 0.07 0.25 -0.29 0.00 -1.56 0.00 0.00 55.97 54.43 1fd4 s LYS 39 Cb -0.12 -0.31 -0.01 0.00 -1.46 0.00 0.00 37.83 35.93 1fd4 s LYS 39 CO 0.02 -0.21 1.36 0.21 0.16 0.00 0.00 175.35 176.89 1fd4 s LYS 40 N 1.36 3.99 0.00 4.03 2.20 -1.26 0.19 119.74 130.25 1fd4 s LYS 40 Ca -0.06 1.47 0.16 0.00 -0.36 0.00 0.00 55.97 57.18 1fd4 s LYS 40 Cb -0.13 -3.88 0.93 0.00 -1.51 0.00 0.00 37.83 33.24 1fd4 s LYS 40 CO -0.03 -1.02 1.34 -0.35 -0.36 0.00 0.00 175.35 174.93