#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 3.86 0.00 -0.61 1.01 -1.21 -4.92 121.20 119.32 1fd4 s ILE 2 Ca 0.00 1.50 0.16 0.00 0.00 0.00 0.00 60.65 62.31 1fd4 s ILE 2 Cb 0.00 -3.96 0.27 0.00 0.01 0.00 0.00 42.46 38.78 1fd4 s ILE 2 CO 0.00 0.21 1.10 0.61 0.00 0.00 0.00 174.94 176.86 1fd4 n GLY 3 N 2.44 0.83 3.32 6.18 0.00 -1.25 -0.83 105.19 115.88 1fd4 n GLY 3 Ca 0.05 -0.54 -0.14 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.61 -0.31 0.31 1.61 -4.77 -1.23 -3.18 116.67 107.48 1fd4 s ASP 4 Ca 0.21 0.21 0.05 0.00 -3.30 0.00 0.00 52.55 49.72 1fd4 s ASP 4 Cb 0.25 0.38 0.51 0.00 -1.09 0.00 0.00 42.92 42.97 1fd4 s ASP 4 CO -0.11 -0.53 1.76 1.55 0.70 0.00 0.00 175.17 178.55 1fd4 h PRO 5 N 3.51 0.37 -0.25 2.11 0.13 -1.83 -2.39 132.00 133.64 1fd4 h PRO 5 Ca -0.29 -0.13 -0.06 0.00 -0.87 0.00 0.00 66.00 64.65 1fd4 h PRO 5 Cb 1.17 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1fd4 h PRO 5 CO 0.41 0.60 -0.06 0.28 -0.23 0.00 0.00 178.00 179.00 1fd4 h VAL 6 N 0.33 1.28 -0.60 1.56 2.07 -1.97 -1.80 116.25 117.12 1fd4 h VAL 6 Ca 0.05 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1fd4 h VAL 6 Cb 0.63 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1fd4 h VAL 6 CO 0.04 0.33 0.36 0.74 0.02 0.00 0.00 177.57 179.06 1fd4 h THR 7 N 0.23 1.18 -0.23 2.57 2.02 -1.97 -0.88 112.91 115.84 1fd4 h THR 7 Ca 0.06 -0.42 0.06 0.00 0.77 0.00 0.00 66.41 66.88 1fd4 h THR 7 Cb 0.53 0.37 -0.06 0.00 -1.74 0.00 0.00 68.15 67.24 1fd4 h THR 7 CO 0.03 0.19 -0.19 0.00 0.37 0.00 0.00 175.52 175.91 1fd4 h LEU 9 N -0.20 0.65 -1.36 0.00 3.38 -1.07 -2.30 115.31 114.42 1fd4 h LEU 9 Ca 0.13 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1fd4 h LEU 9 Cb 0.40 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1fd4 h LEU 9 CO -0.34 0.95 0.35 0.50 0.09 0.00 0.00 178.44 179.99 1fd4 h LYS 10 N 0.52 0.79 0.00 1.13 3.64 -0.84 -1.34 116.57 120.47 1fd4 h LYS 10 Ca 0.05 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1fd4 h LYS 10 Cb 0.86 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1fd4 h LYS 10 CO 0.07 0.55 0.00 -1.13 -2.27 0.00 0.00 179.45 176.68 1fd4 n SER 11 N -4.42 0.00 0.00 4.20 3.41 -0.74 -4.88 113.62 111.20 1fd4 n SER 11 Ca 0.06 -0.47 0.00 0.00 -0.26 0.00 0.00 58.87 58.20 1fd4 n SER 11 Cb 0.07 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 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 0.77 0.65 3.98 5.00 0.00 -0.50 -5.07 105.19 110.03 1fd4 n GLY 12 Ca 0.16 -0.10 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.00 3.76 -0.04 4.61 0.00 -0.90 -4.78 121.76 122.40 1fd4 s ALA 13 Ca 0.00 -1.53 0.07 0.00 0.00 0.00 0.00 51.96 50.50 1fd4 s ALA 13 Cb 0.00 -2.07 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 1fd4 s ALA 13 CO 0.00 -1.17 -0.24 0.42 0.00 0.00 0.00 175.76 174.77 1fd4 s ILE 14 N -3.00 1.96 -0.09 0.00 1.01 0.31 -4.18 121.20 117.22 1fd4 s ILE 14 Ca 0.62 -1.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.03 1fd4 s ILE 14 Cb -0.08 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.71 1fd4 s ILE 14 CO 0.42 0.55 0.57 0.00 0.00 0.00 0.00 174.94 176.48 1fd4 s HIS 16 N 0.62 2.64 0.30 0.00 3.76 0.18 -4.96 115.29 117.83 1fd4 s HIS 16 Ca 0.30 -0.20 0.08 0.00 -0.15 0.00 0.00 55.06 55.09 1fd4 s HIS 16 Cb -0.16 -1.49 0.48 0.00 1.11 0.00 0.00 32.58 32.52 1fd4 s HIS 16 CO 0.14 0.30 1.71 -1.00 -0.85 0.00 0.00 174.74 175.03 1fd4 h PRO 17 N 4.42 0.18 0.00 8.40 0.13 -1.87 0.16 132.00 143.42 1fd4 h PRO 17 Ca -0.48 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1fd4 h PRO 17 Cb 1.16 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1fd4 h PRO 17 CO 0.49 0.58 -0.16 0.28 -0.23 0.00 0.00 178.00 178.96 1fd4 n VAL 18 N -4.01 0.00 -4.24 1.56 0.31 -1.25 -3.48 118.33 107.22 1fd4 n VAL 18 Ca -0.02 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.15 1fd4 n VAL 18 Cb 0.49 -0.51 -0.14 0.00 -0.91 0.00 0.00 33.84 32.77 1fd4 n VAL 18 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1fd4 s PHE 19 N -1.78 0.70 0.48 3.52 0.40 -1.26 -4.76 117.98 115.28 1fd4 s PHE 19 Ca 0.00 -0.20 -0.22 0.00 -0.60 0.00 0.00 56.93 55.91 1fd4 s PHE 19 Cb 0.00 -0.44 -0.07 0.00 0.51 0.00 0.00 43.02 43.02 1fd4 s PHE 19 CO 0.00 -0.02 1.14 0.00 0.70 0.00 0.00 175.22 177.04 1fd4 n PRO 21 N -0.71 1.91 -0.31 0.00 -0.02 -1.26 -4.86 135.00 129.75 1fd4 n PRO 21 Ca 0.08 0.68 0.16 0.00 -2.02 0.00 0.00 63.50 62.40 1fd4 n PRO 21 Cb 0.49 -2.33 0.34 0.00 -0.02 0.00 0.00 33.50 31.98 1fd4 n PRO 21 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1fd4 h ARG 22 N 2.13 0.20 -0.01 -0.52 1.12 -2.03 0.43 114.38 115.70 1fd4 h ARG 22 Ca -0.47 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.39 1fd4 h ARG 22 Cb 1.30 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 31.21 1fd4 h ARG 22 CO 0.60 0.13 -0.16 0.54 -3.11 0.00 0.00 179.97 177.98 1fd4 n ARG 23 N -5.22 1.03 -2.29 0.20 1.74 -1.26 -4.87 116.66 105.99 1fd4 n ARG 23 Ca 0.24 -0.56 -0.27 0.00 -0.77 0.00 0.00 57.85 56.50 1fd4 n ARG 23 Cb 0.78 -1.49 0.04 0.00 -1.02 0.00 0.00 32.46 30.77 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 -2.35 3.20 -0.15 -1.55 1.51 0.15 -4.00 117.35 114.16 1fd4 s TYR 24 Ca 0.29 0.66 -0.00 0.00 -1.01 0.00 0.00 57.07 57.01 1fd4 s TYR 24 Cb 0.20 -2.87 -0.01 0.00 -0.11 0.00 0.00 41.96 39.18 1fd4 s TYR 24 CO 0.46 -0.98 -0.14 0.21 -1.11 0.00 0.00 175.55 173.99 1fd4 s LYS 25 N -5.09 3.29 0.13 -0.62 2.20 -0.64 -4.83 119.74 114.18 1fd4 s LYS 25 Ca 0.56 -0.72 -0.31 0.00 -0.36 0.00 0.00 55.97 55.14 1fd4 s LYS 25 Cb -0.11 -2.65 -0.08 0.00 -1.51 0.00 0.00 37.83 33.49 1fd4 s LYS 25 CO 0.46 0.08 1.34 -1.14 -0.36 0.00 0.00 175.35 175.73 1fd4 s GLN 26 N 0.68 4.35 0.00 4.03 0.74 -1.26 -1.25 119.66 126.95 1fd4 s GLN 26 Ca -0.07 2.03 0.00 0.00 0.05 0.00 0.00 55.36 57.37 1fd4 s GLN 26 Cb -0.16 -3.25 0.00 0.00 1.10 0.00 0.00 33.01 30.71 1fd4 s GLN 26 CO 0.02 -0.37 0.77 0.44 -0.55 0.00 0.00 175.29 175.60 1fd4 n ILE 27 N 3.64 0.59 -2.75 -2.34 -5.35 0.78 -4.96 119.36 108.97 1fd4 n ILE 27 Ca 0.10 -0.65 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 1fd4 n ILE 27 Cb 0.43 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.09 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 -0.29 -0.29 3.78 3.28 0.00 -1.18 -3.36 105.19 107.13 1fd4 n GLY 28 Ca 0.00 -1.16 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 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 -3.20 1.32 -0.30 2.61 -4.23 -0.01 -1.07 115.64 110.78 1fd4 s THR 29 Ca 0.00 -1.89 0.08 0.00 -1.18 0.00 0.00 61.69 58.70 1fd4 s THR 29 Cb 0.00 -2.21 0.46 0.00 1.34 0.00 0.00 72.50 72.09 1fd4 s THR 29 CO 0.00 0.00 1.18 0.00 -0.54 0.00 0.00 174.62 175.26 1fd4 n GLY 31 N -0.69 0.99 3.74 0.00 0.00 -1.19 -3.65 105.19 104.39 1fd4 n GLY 31 Ca 0.41 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1fd4 n GLY 31 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fd4 s LEU 32 N 0.00 3.60 0.13 0.99 1.43 -1.26 -4.89 118.68 118.68 1fd4 s LEU 32 Ca 0.00 2.54 -0.33 0.00 -1.03 0.00 0.00 54.13 55.30 1fd4 s LEU 32 Cb 0.00 -4.61 -0.17 0.00 0.03 0.00 0.00 46.19 41.44 1fd4 s LEU 32 CO 0.00 -1.87 0.98 -2.65 0.23 0.00 0.00 176.35 173.04 1fd4 n PRO 33 N -1.81 0.56 0.00 1.29 -0.02 -1.26 -2.22 135.00 131.54 1fd4 n PRO 33 Ca 0.15 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1fd4 n PRO 33 Cb 0.49 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 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 1.85 3.14 3.82 -1.23 0.00 -1.26 -5.03 105.19 106.48 1fd4 n GLY 34 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.92 4.13 -0.00 2.61 -4.23 -0.94 -3.80 115.64 111.49 1fd4 s THR 35 Ca 0.00 1.08 0.04 0.00 -1.18 0.00 0.00 61.69 61.64 1fd4 s THR 35 Cb 0.00 -3.54 -0.01 0.00 1.34 0.00 0.00 72.50 70.29 1fd4 s THR 35 CO 0.00 -0.52 -0.14 -0.54 -0.54 0.00 0.00 174.62 172.88 1fd4 s LYS 36 N -3.88 1.11 -0.35 3.99 -0.14 0.57 -3.53 119.74 117.51 1fd4 s LYS 36 Ca 0.62 -0.53 -0.14 0.00 -1.36 0.00 0.00 55.97 54.56 1fd4 s LYS 36 Cb -0.13 -1.08 -0.01 0.00 -1.68 0.00 0.00 37.83 34.93 1fd4 s LYS 36 CO 0.30 0.29 0.29 0.00 -0.76 0.00 0.00 175.35 175.48 1fd4 s LYS 39 N 0.05 2.74 0.97 0.00 -2.85 -0.38 -0.53 119.74 119.74 1fd4 s LYS 39 Ca -0.09 -0.58 -0.13 0.00 -1.00 0.00 0.00 55.97 54.18 1fd4 s LYS 39 Cb -0.15 -2.56 0.08 0.00 -2.06 0.00 0.00 37.83 33.14 1fd4 s LYS 39 CO 0.05 0.64 0.58 1.63 0.10 0.00 0.00 175.35 178.35 1fd4 n LYS 40 N 2.30 -0.54 0.00 1.78 5.02 -1.26 -1.61 118.16 123.84 1fd4 n LYS 40 Ca -0.18 -0.11 0.15 0.00 -2.02 0.00 0.00 58.31 56.15 1fd4 n LYS 40 Cb 0.53 -1.98 0.68 0.00 -0.02 0.00 0.00 35.03 34.23 1fd4 n LYS 40 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53