#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 4.44 -1.24 -0.61 1.09 -1.26 -4.89 121.20 118.73 1fd4 s ILE 2 Ca 0.00 0.28 0.10 0.00 -1.10 0.00 0.00 60.65 59.93 1fd4 s ILE 2 Cb 0.00 -4.50 0.07 0.00 -1.06 0.00 0.00 42.46 36.97 1fd4 s ILE 2 CO 0.00 -1.05 0.80 0.61 -0.10 0.00 0.00 174.94 175.20 1fd4 n GLY 3 N 5.10 -0.36 3.13 6.18 0.00 -1.26 -1.05 105.19 116.94 1fd4 n GLY 3 Ca 0.02 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.97 0.20 0.37 1.61 -4.77 -1.24 -2.16 116.67 109.72 1fd4 s ASP 4 Ca 0.12 -0.61 0.09 0.00 -3.30 0.00 0.00 52.55 48.84 1fd4 s ASP 4 Cb 0.09 0.25 0.71 0.00 -1.09 0.00 0.00 42.92 42.87 1fd4 s ASP 4 CO 0.15 -0.57 1.86 1.55 0.70 0.00 0.00 175.17 178.87 1fd4 h PRO 5 N 3.39 0.23 -0.21 2.11 0.13 -1.79 -1.36 132.00 134.51 1fd4 h PRO 5 Ca -0.33 -0.07 -0.13 0.00 -0.87 0.00 0.00 66.00 64.61 1fd4 h PRO 5 Cb 1.18 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1fd4 h PRO 5 CO 0.54 0.43 -0.36 0.28 -0.23 0.00 0.00 178.00 178.65 1fd4 h VAL 6 N 0.22 1.33 0.06 1.56 2.07 -1.96 0.44 116.25 119.98 1fd4 h VAL 6 Ca 0.04 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 65.97 1fd4 h VAL 6 Cb 0.48 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1fd4 h VAL 6 CO 0.03 0.49 -0.03 0.74 0.02 0.00 0.00 177.57 178.82 1fd4 h THR 7 N 0.29 1.06 -0.05 2.57 2.02 -1.97 -1.08 112.91 115.76 1fd4 h THR 7 Ca 0.01 -0.42 0.03 0.00 0.77 0.00 0.00 66.41 66.80 1fd4 h THR 7 Cb 0.96 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 68.64 1fd4 h THR 7 CO 0.08 0.11 -0.53 0.00 0.37 0.00 0.00 175.52 175.55 1fd4 h LEU 9 N -0.63 0.63 -1.35 0.00 3.38 -0.12 -2.43 115.31 114.79 1fd4 h LEU 9 Ca 0.03 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1fd4 h LEU 9 Cb 0.70 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1fd4 h LEU 9 CO -0.39 0.46 -0.30 0.50 0.09 0.00 0.00 178.44 178.80 1fd4 h LYS 10 N 0.75 0.00 -0.08 1.13 3.64 -0.59 -1.78 116.57 119.63 1fd4 h LYS 10 Ca 0.20 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1fd4 h LYS 10 Cb -0.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1fd4 h LYS 10 CO -0.04 0.30 0.00 -1.13 -2.27 0.00 0.00 179.45 176.31 1fd4 n SER 11 N -3.82 0.46 -0.39 4.20 3.41 -0.91 -4.86 113.62 111.70 1fd4 n SER 11 Ca -0.01 -1.95 -0.05 0.00 -0.26 0.00 0.00 58.87 56.59 1fd4 n SER 11 Cb 0.38 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.26 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 0.66 0.76 3.96 5.00 0.00 -0.67 -5.04 105.19 109.86 1fd4 n GLY 12 Ca 0.04 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 1fd4 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fd4 s ALA 13 N -2.08 3.69 0.14 4.61 0.00 -1.10 -4.85 121.76 122.17 1fd4 s ALA 13 Ca 0.00 -1.22 0.07 0.00 0.00 0.00 0.00 51.96 50.81 1fd4 s ALA 13 Cb 0.00 -2.22 -0.04 0.00 0.00 0.00 0.00 23.12 20.86 1fd4 s ALA 13 CO 0.00 -0.91 -0.05 0.42 0.00 0.00 0.00 175.76 175.22 1fd4 s ILE 14 N -2.90 3.54 -0.20 0.00 1.01 0.38 -4.13 121.20 118.89 1fd4 s ILE 14 Ca 0.58 -1.36 -0.06 0.00 0.00 0.00 0.00 60.65 59.81 1fd4 s ILE 14 Cb -0.10 -2.72 -0.03 0.00 0.01 0.00 0.00 42.46 39.61 1fd4 s ILE 14 CO 0.40 -0.01 0.03 0.00 0.00 0.00 0.00 174.94 175.37 1fd4 s HIS 16 N 0.92 2.71 0.03 0.00 2.46 -0.15 -4.93 115.29 116.32 1fd4 s HIS 16 Ca 0.02 -0.18 0.13 0.00 0.47 0.00 0.00 55.06 55.50 1fd4 s HIS 16 Cb -0.14 -1.40 0.11 0.00 -0.13 0.00 0.00 32.58 31.02 1fd4 s HIS 16 CO 0.02 0.44 1.46 -1.35 -2.47 0.00 0.00 174.74 172.84 1fd4 h PRO 17 N 3.44 0.00 0.00 2.88 0.11 -1.88 0.58 132.00 137.12 1fd4 h PRO 17 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1fd4 h PRO 17 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1fd4 h PRO 17 CO 0.52 0.65 -0.25 0.28 -0.21 0.00 0.00 178.00 179.00 1fd4 n VAL 18 N -3.37 0.00 -3.90 3.15 0.31 -1.24 -3.15 118.33 110.13 1fd4 n VAL 18 Ca 0.01 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1fd4 n VAL 18 Cb 0.75 -0.17 -0.10 0.00 -0.91 0.00 0.00 33.84 33.41 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 -1.30 0.11 0.39 3.52 -0.71 -1.26 -4.73 117.98 113.99 1fd4 s PHE 19 Ca 0.00 -0.28 -0.27 0.00 -1.04 0.00 0.00 56.93 55.35 1fd4 s PHE 19 Cb 0.00 -0.09 -0.09 0.00 -1.21 0.00 0.00 43.02 41.63 1fd4 s PHE 19 CO 0.00 -0.30 1.31 0.00 -1.34 0.00 0.00 175.22 174.89 1fd4 n PRO 21 N 0.31 -1.20 -2.71 0.00 -0.04 -1.26 -4.91 135.00 125.19 1fd4 n PRO 21 Ca 0.03 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.06 1fd4 n PRO 21 Cb 0.43 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.86 1fd4 n PRO 21 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1fd4 s ARG 22 N -2.65 4.12 -0.00 0.54 3.52 -1.26 -3.18 118.95 120.03 1fd4 s ARG 22 Ca 0.00 1.08 0.00 0.00 -0.13 0.00 0.00 55.73 56.68 1fd4 s ARG 22 Cb 0.00 -3.70 0.00 0.00 -1.56 0.00 0.00 34.95 29.69 1fd4 s ARG 22 CO 0.00 -0.76 0.00 0.54 -0.81 0.00 0.00 175.30 174.27 1fd4 n ARG 23 N 6.55 -0.01 -3.94 5.12 1.74 -1.26 -5.04 116.66 119.83 1fd4 n ARG 23 Ca 0.10 0.04 -0.23 0.00 -0.77 0.00 0.00 57.85 56.99 1fd4 n ARG 23 Cb 0.47 -3.08 -0.02 0.00 -1.02 0.00 0.00 32.46 28.81 1fd4 n ARG 23 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1fd4 s TYR 24 N -2.00 3.47 -0.02 -1.55 1.51 -1.19 -4.73 117.35 112.84 1fd4 s TYR 24 Ca 0.00 0.05 0.03 0.00 -1.01 0.00 0.00 57.07 56.15 1fd4 s TYR 24 Cb 0.00 -1.62 -0.00 0.00 -0.11 0.00 0.00 41.96 40.22 1fd4 s TYR 24 CO 0.00 0.46 -0.12 0.15 -1.11 0.00 0.00 175.55 174.93 1fd4 s LYS 25 N -3.68 1.13 0.04 -0.62 -0.14 -1.03 -4.80 119.74 110.64 1fd4 s LYS 25 Ca 0.34 -0.43 -0.31 0.00 -1.36 0.00 0.00 55.97 54.22 1fd4 s LYS 25 Cb -0.10 -1.06 -0.06 0.00 -1.68 0.00 0.00 37.83 34.93 1fd4 s LYS 25 CO 0.29 0.21 1.38 -1.14 -0.76 0.00 0.00 175.35 175.33 1fd4 s GLN 26 N -0.06 4.31 -0.07 1.68 0.74 -1.26 -1.39 119.66 123.61 1fd4 s GLN 26 Ca 0.00 1.99 0.11 0.00 0.05 0.00 0.00 55.36 57.51 1fd4 s GLN 26 Cb -0.07 -3.46 0.26 0.00 1.10 0.00 0.00 33.01 30.84 1fd4 s GLN 26 CO 0.00 -0.51 1.19 0.44 -0.55 0.00 0.00 175.29 175.86 1fd4 n ILE 27 N 4.39 1.51 -2.78 -2.34 -5.35 0.08 -4.93 119.36 109.94 1fd4 n ILE 27 Ca 0.12 -1.52 0.00 0.00 -0.27 0.00 0.00 62.75 61.09 1fd4 n ILE 27 Cb 0.43 0.15 0.00 0.00 -1.74 0.00 0.00 39.64 38.48 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 -0.51 -0.05 3.12 3.28 0.00 -1.18 -4.40 105.19 105.44 1fd4 n GLY 28 Ca 0.11 -1.34 -0.25 0.00 0.00 0.00 0.00 46.02 44.54 1fd4 n GLY 28 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fd4 n THR 29 N 9.00 0.00 -2.44 2.61 -2.24 -0.21 -1.59 114.28 119.41 1fd4 n THR 29 Ca 0.00 -2.17 -0.20 0.00 -2.27 0.00 0.00 64.05 59.41 1fd4 n THR 29 Cb 0.00 0.69 0.02 0.00 -2.10 0.00 0.00 70.33 68.93 1fd4 n THR 29 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fd4 n GLY 31 N -0.46 0.77 3.76 0.00 0.00 -0.92 -3.97 105.19 104.37 1fd4 n GLY 31 Ca 0.31 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 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 3.81 0.61 0.99 2.34 -1.26 -4.91 118.68 120.26 1fd4 s LEU 32 Ca 0.00 2.44 -0.18 0.00 0.06 0.00 0.00 54.13 56.45 1fd4 s LEU 32 Cb 0.00 -4.43 -0.05 0.00 -0.56 0.00 0.00 46.19 41.15 1fd4 s LEU 32 CO 0.00 -1.38 0.85 -2.65 -1.06 0.00 0.00 176.35 172.11 1fd4 n PRO 33 N -1.14 0.74 0.00 1.48 -0.02 -1.26 -2.74 135.00 132.06 1fd4 n PRO 33 Ca 0.11 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1fd4 n PRO 33 Cb 0.48 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 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 1.41 3.07 3.77 -1.23 0.00 -1.26 -5.04 105.19 105.91 1fd4 n GLY 34 Ca 0.13 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.75 2.22 -0.12 2.61 -4.23 -1.11 -3.60 115.64 110.66 1fd4 s THR 35 Ca 0.00 0.21 -0.00 0.00 -1.18 0.00 0.00 61.69 60.72 1fd4 s THR 35 Cb 0.00 -3.13 0.03 0.00 1.34 0.00 0.00 72.50 70.74 1fd4 s THR 35 CO 0.00 0.04 -0.08 -0.54 -0.54 0.00 0.00 174.62 173.50 1fd4 s LYS 36 N -2.18 1.60 -0.13 3.99 1.02 0.19 -3.85 119.74 120.38 1fd4 s LYS 36 Ca 0.55 -0.29 -0.29 0.00 0.02 0.00 0.00 55.97 55.96 1fd4 s LYS 36 Cb -0.44 -1.65 -0.02 0.00 -0.52 0.00 0.00 37.83 35.20 1fd4 s LYS 36 CO 0.58 -0.27 1.29 0.00 -0.92 0.00 0.00 175.35 176.02 1fd4 s LYS 39 N -0.28 2.44 -0.73 0.00 2.47 -0.48 -0.47 119.74 122.69 1fd4 s LYS 39 Ca 0.02 -0.75 -0.16 0.00 -1.56 0.00 0.00 55.97 53.52 1fd4 s LYS 39 Cb -0.11 -2.31 0.16 0.00 -1.46 0.00 0.00 37.83 34.11 1fd4 s LYS 39 CO 0.01 0.60 0.75 0.21 0.16 0.00 0.00 175.35 177.08 1fd4 s LYS 40 N -0.68 3.35 0.00 4.03 2.20 -1.26 -2.45 119.74 124.93 1fd4 s LYS 40 Ca 0.10 -1.96 0.00 0.00 -0.36 0.00 0.00 55.97 53.75 1fd4 s LYS 40 Cb -0.11 -4.44 0.00 0.00 -1.51 0.00 0.00 37.83 31.78 1fd4 s LYS 40 CO 0.00 -1.42 0.20 -0.35 -0.36 0.00 0.00 175.35 173.42