#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fd3 s ILE 2 N 0.00 4.33 0.00 -0.61 1.01 -1.26 -4.92 121.20 119.75 1fd3 s ILE 2 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.09 1fd3 s ILE 2 Cb 0.00 -3.24 0.02 0.00 0.01 0.00 0.00 42.46 39.26 1fd3 s ILE 2 CO 0.00 0.05 0.98 0.61 0.00 0.00 0.00 174.94 176.58 1fd3 n GLY 3 N 4.93 0.56 3.19 6.18 0.00 -1.22 -1.24 105.19 117.59 1fd3 n GLY 3 Ca -0.14 -0.04 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 1fd3 n GLY 3 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fd3 s ASP 4 N -0.99 -0.06 0.22 1.61 -4.77 -1.22 -2.30 116.67 109.16 1fd3 s ASP 4 Ca 0.02 -0.16 -0.07 0.00 -3.30 0.00 0.00 52.55 49.04 1fd3 s ASP 4 Cb 0.02 0.29 0.18 0.00 -1.09 0.00 0.00 42.92 42.32 1fd3 s ASP 4 CO -0.01 -0.49 1.76 -0.65 0.70 0.00 0.00 175.17 176.49 1fd3 h PRO 5 N 3.75 1.12 -0.09 2.11 0.11 -1.85 -2.00 132.00 135.14 1fd3 h PRO 5 Ca -0.31 -0.24 -0.01 0.00 0.11 0.00 0.00 66.00 65.56 1fd3 h PRO 5 Cb 1.19 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1fd3 h PRO 5 CO 0.43 0.95 0.04 0.28 -0.21 0.00 0.00 178.00 179.49 1fd3 h VAL 6 N 1.08 1.14 -0.88 3.15 2.07 -1.98 -0.75 116.25 120.08 1fd3 h VAL 6 Ca 0.24 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.34 1fd3 h VAL 6 Cb 0.30 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 1fd3 h VAL 6 CO -0.01 0.12 0.59 0.74 0.02 0.00 0.00 177.57 179.03 1fd3 h THR 7 N -0.01 1.22 0.22 2.57 2.02 -1.97 0.53 112.91 117.49 1fd3 h THR 7 Ca 0.03 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 66.79 1fd3 h THR 7 Cb 0.16 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1fd3 h THR 7 CO -0.00 0.22 -0.11 0.00 0.37 0.00 0.00 175.52 176.00 1fd3 h LEU 9 N -0.30 1.04 -1.94 0.00 3.38 -0.91 -1.95 115.31 114.63 1fd3 h LEU 9 Ca -0.03 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.78 1fd3 h LEU 9 Cb 0.23 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1fd3 h LEU 9 CO 0.05 0.95 0.09 0.11 0.09 0.00 0.00 178.44 179.74 1fd3 h LYS 10 N 1.07 0.07 -0.02 1.13 1.79 -0.76 -2.40 116.57 117.45 1fd3 h LYS 10 Ca 0.24 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 1fd3 h LYS 10 Cb 0.28 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1fd3 h LYS 10 CO -0.01 0.05 0.00 -1.13 -1.08 0.00 0.00 179.45 177.28 1fd3 n SER 11 N -4.51 0.46 -0.06 0.86 3.41 -0.75 -4.87 113.62 108.15 1fd3 n SER 11 Ca -0.00 -1.28 -0.01 0.00 -0.26 0.00 0.00 58.87 57.32 1fd3 n SER 11 Cb 0.16 -0.01 -0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1fd3 n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fd3 n GLY 12 N 0.99 0.44 4.00 5.00 0.00 -0.90 -5.07 105.19 109.64 1fd3 n GLY 12 Ca 0.20 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.97 1fd3 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fd3 s ALA 13 N -2.03 4.58 -0.03 4.61 0.00 -1.10 -4.78 121.76 123.00 1fd3 s ALA 13 Ca 0.00 -1.90 0.06 0.00 0.00 0.00 0.00 51.96 50.12 1fd3 s ALA 13 Cb 0.00 -1.38 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 1fd3 s ALA 13 CO 0.00 -0.60 -0.21 0.42 0.00 0.00 0.00 175.76 175.37 1fd3 s ILE 14 N -2.57 1.72 -0.01 0.00 1.01 -0.26 -4.15 121.20 116.94 1fd3 s ILE 14 Ca 0.56 -0.91 -0.23 0.00 0.00 0.00 0.00 60.65 60.07 1fd3 s ILE 14 Cb -0.06 -1.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.91 1fd3 s ILE 14 CO 0.34 0.49 0.68 0.00 0.00 0.00 0.00 174.94 176.45 1fd3 s HIS 16 N 0.13 0.74 0.14 0.00 3.76 -0.08 -4.97 115.29 115.02 1fd3 s HIS 16 Ca 0.35 -0.34 -0.30 0.00 -0.15 0.00 0.00 55.06 54.62 1fd3 s HIS 16 Cb -0.19 -0.45 -0.07 0.00 1.11 0.00 0.00 32.58 32.98 1fd3 s HIS 16 CO 0.19 -0.03 1.23 -1.25 -0.85 0.00 0.00 174.74 174.03 1fd3 s PRO 17 N -1.04 4.44 0.00 8.40 0.04 -1.26 -0.38 135.00 145.21 1fd3 s PRO 17 Ca -0.04 1.89 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1fd3 s PRO 17 Cb -0.07 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.20 1fd3 s PRO 17 CO 0.00 -0.19 0.00 0.28 0.04 0.00 0.00 177.00 177.13 1fd3 n VAL 18 N 3.09 0.00 -3.89 -0.36 0.31 -0.87 -4.82 118.33 111.79 1fd3 n VAL 18 Ca 0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.30 1fd3 n VAL 18 Cb 0.45 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.29 1fd3 n VAL 18 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 1fd3 s PHE 19 N 0.00 0.16 0.07 3.52 -0.12 -1.26 -4.88 117.98 115.47 1fd3 s PHE 19 Ca 0.00 -0.50 -0.30 0.00 -0.05 0.00 0.00 56.93 56.08 1fd3 s PHE 19 Cb 0.00 -0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 42.25 1fd3 s PHE 19 CO 0.00 -0.45 0.96 0.00 -0.05 0.00 0.00 175.22 175.68 1fd3 s PRO 21 N 0.37 2.24 0.32 0.00 0.04 -1.26 -4.85 135.00 131.87 1fd3 s PRO 21 Ca 0.48 0.97 -0.29 0.00 0.04 0.00 0.00 61.00 62.21 1fd3 s PRO 21 Cb -0.22 -1.91 -0.12 0.00 0.04 0.00 0.00 34.50 32.29 1fd3 s PRO 21 CO 0.29 -1.60 1.40 2.89 0.04 0.00 0.00 177.00 180.02 1fd3 n ARG 22 N -3.47 2.31 0.00 4.56 1.85 -1.26 -1.69 116.66 118.96 1fd3 n ARG 22 Ca 0.08 0.81 0.00 0.00 -1.00 0.00 0.00 57.85 57.74 1fd3 n ARG 22 Cb 0.54 -2.47 0.00 0.00 -1.05 0.00 0.00 32.46 29.48 1fd3 n ARG 22 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1fd3 n ARG 23 N 1.02 0.00 -2.98 2.89 1.74 -1.26 -5.07 116.66 113.01 1fd3 n ARG 23 Ca 0.06 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.75 1fd3 n ARG 23 Cb 0.36 -0.02 -0.06 0.00 -1.02 0.00 0.00 32.46 31.72 1fd3 n ARG 23 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1fd3 s TYR 24 N -2.40 3.86 -0.13 -1.55 1.51 -0.68 -4.84 117.35 113.11 1fd3 s TYR 24 Ca 0.00 1.62 -0.08 0.00 -1.01 0.00 0.00 57.07 57.60 1fd3 s TYR 24 Cb 0.00 -2.76 -0.04 0.00 -0.11 0.00 0.00 41.96 39.05 1fd3 s TYR 24 CO 0.00 0.47 0.15 0.15 -1.11 0.00 0.00 175.55 175.20 1fd3 s LYS 25 N -1.33 3.57 -0.09 -0.62 -0.14 -0.33 -4.81 119.74 116.00 1fd3 s LYS 25 Ca 0.38 -0.13 -0.30 0.00 -1.36 0.00 0.00 55.97 54.56 1fd3 s LYS 25 Cb -0.22 -3.23 -0.02 0.00 -1.68 0.00 0.00 37.83 32.68 1fd3 s LYS 25 CO 0.26 0.70 1.15 -1.14 -0.76 0.00 0.00 175.35 175.56 1fd3 s GLN 26 N -0.81 4.35 0.00 1.68 0.74 -1.26 -1.40 119.66 122.96 1fd3 s GLN 26 Ca 0.14 1.59 0.01 0.00 0.05 0.00 0.00 55.36 57.15 1fd3 s GLN 26 Cb -0.12 -3.58 0.00 0.00 1.10 0.00 0.00 33.01 30.41 1fd3 s GLN 26 CO 0.03 -0.45 0.40 0.44 -0.55 0.00 0.00 175.29 175.16 1fd3 n ILE 27 N 4.72 0.00 -3.52 -2.34 -5.35 -0.42 -4.98 119.36 107.46 1fd3 n ILE 27 Ca 0.11 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 1fd3 n ILE 27 Cb 0.47 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.38 1fd3 n ILE 27 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1fd3 n GLY 28 N 0.32 -0.59 3.66 3.28 0.00 -1.21 -4.51 105.19 106.14 1fd3 n GLY 28 Ca 0.01 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 1fd3 n GLY 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fd3 s THR 29 N -3.00 1.86 -0.33 2.61 -4.23 -0.38 -1.31 115.64 110.87 1fd3 s THR 29 Ca 0.00 -1.97 0.08 0.00 -1.18 0.00 0.00 61.69 58.61 1fd3 s THR 29 Cb 0.00 -2.83 0.56 0.00 1.34 0.00 0.00 72.50 71.56 1fd3 s THR 29 CO 0.00 0.00 1.59 0.00 -0.54 0.00 0.00 174.62 175.67 1fd3 n GLY 31 N -1.09 1.83 3.66 0.00 0.00 -0.97 -3.53 105.19 105.09 1fd3 n GLY 31 Ca 0.40 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.88 1fd3 n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fd3 n LEU 32 N 0.00 3.89 -4.76 0.99 4.32 -1.26 -4.85 117.00 115.33 1fd3 n LEU 32 Ca 0.00 0.97 -0.41 0.00 -0.02 0.00 0.00 56.01 56.55 1fd3 n LEU 32 Cb 0.00 -1.45 -0.00 0.00 -1.62 0.00 0.00 43.42 40.35 1fd3 n LEU 32 CO 0.00 -1.21 1.12 -2.65 -1.22 0.00 0.00 177.39 173.43 1fd3 n PRO 33 N -0.47 2.60 0.00 3.23 -0.02 -1.26 -2.33 135.00 136.75 1fd3 n PRO 33 Ca 0.10 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 1fd3 n PRO 33 Cb 0.43 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 1fd3 n PRO 33 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fd3 n GLY 34 N 0.76 3.03 3.78 -1.23 0.00 -1.26 -4.94 105.19 105.33 1fd3 n GLY 34 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1fd3 n GLY 34 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fd3 s THR 35 N -1.50 3.82 -0.01 2.61 -4.23 -0.98 -2.06 115.64 113.29 1fd3 s THR 35 Ca 0.00 1.42 0.07 0.00 -1.18 0.00 0.00 61.69 62.01 1fd3 s THR 35 Cb 0.00 -3.75 -0.02 0.00 1.34 0.00 0.00 72.50 70.07 1fd3 s THR 35 CO 0.00 0.03 -0.24 -0.54 -0.54 0.00 0.00 174.62 173.34 1fd3 s LYS 36 N -2.39 1.89 -0.25 3.99 1.02 0.49 -3.26 119.74 121.23 1fd3 s LYS 36 Ca 0.56 -0.86 -0.17 0.00 0.02 0.00 0.00 55.97 55.52 1fd3 s LYS 36 Cb -0.21 -1.85 -0.03 0.00 -0.52 0.00 0.00 37.83 35.22 1fd3 s LYS 36 CO 0.27 0.50 0.47 0.00 -0.92 0.00 0.00 175.35 175.68 1fd3 s LYS 39 N 1.27 3.73 0.00 0.00 2.47 -0.49 -1.10 119.74 125.62 1fd3 s LYS 39 Ca -0.03 -0.45 0.25 0.00 -1.56 0.00 0.00 55.97 54.18 1fd3 s LYS 39 Cb -0.14 -3.28 1.50 0.00 -1.46 0.00 0.00 37.83 34.45 1fd3 s LYS 39 CO -0.04 -0.05 1.86 1.17 0.16 0.00 0.00 175.35 178.44