#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 4.27 0.00 -0.61 1.01 -1.00 -4.95 121.20 119.93 1fd4 s ILE 2 Ca 0.00 1.78 0.00 0.00 0.00 0.00 0.00 60.65 62.43 1fd4 s ILE 2 Cb 0.00 -4.13 0.00 0.00 0.01 0.00 0.00 42.46 38.34 1fd4 s ILE 2 CO 0.00 0.39 0.46 0.61 0.00 0.00 0.00 174.94 176.40 1fd4 n GLY 3 N 1.22 -0.39 2.99 6.18 0.00 -1.26 -1.53 105.19 112.41 1fd4 n GLY 3 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.20 0.29 0.33 1.61 -4.77 -1.25 -2.85 116.67 109.83 1fd4 s ASP 4 Ca 0.00 -0.56 0.07 0.00 -3.30 0.00 0.00 52.55 48.76 1fd4 s ASP 4 Cb 0.00 0.11 0.59 0.00 -1.09 0.00 0.00 42.92 42.52 1fd4 s ASP 4 CO 0.00 -0.33 1.80 1.55 0.70 0.00 0.00 175.17 178.89 1fd4 h PRO 5 N 4.48 0.29 -0.19 2.11 0.13 -1.81 -2.32 132.00 134.68 1fd4 h PRO 5 Ca -0.32 -0.10 -0.05 0.00 -0.87 0.00 0.00 66.00 64.66 1fd4 h PRO 5 Cb 1.20 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1fd4 h PRO 5 CO 0.44 0.53 -0.07 0.28 -0.23 0.00 0.00 178.00 178.95 1fd4 h VAL 6 N 0.26 1.30 -0.49 1.56 2.07 -1.96 -1.05 116.25 117.94 1fd4 h VAL 6 Ca 0.04 -1.09 0.03 0.00 0.82 0.00 0.00 66.70 66.50 1fd4 h VAL 6 Cb 0.59 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.96 1fd4 h VAL 6 CO 0.04 0.33 0.28 0.74 0.02 0.00 0.00 177.57 178.98 1fd4 h THR 7 N 0.08 1.02 0.25 2.57 2.02 -1.95 0.15 112.91 117.05 1fd4 h THR 7 Ca 0.04 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.04 1fd4 h THR 7 Cb 0.54 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 1fd4 h THR 7 CO 0.02 0.10 -0.48 0.00 0.37 0.00 0.00 175.52 175.53 1fd4 h LEU 9 N -0.80 0.77 -1.81 0.00 3.38 -1.06 -1.42 115.31 114.37 1fd4 h LEU 9 Ca -0.02 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1fd4 h LEU 9 Cb 0.77 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1fd4 h LEU 9 CO -0.19 0.78 0.11 0.07 0.09 0.00 0.00 178.44 179.30 1fd4 h LYS 10 N 0.78 0.23 0.00 1.13 2.10 -0.42 -0.60 116.57 119.79 1fd4 h LYS 10 Ca 0.17 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 1fd4 h LYS 10 Cb 0.35 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.62 1fd4 h LYS 10 CO 0.01 0.16 0.00 -1.13 -2.00 0.00 0.00 179.45 176.49 1fd4 n SER 11 N -4.50 0.00 0.00 7.07 3.41 -0.47 -4.85 113.62 114.28 1fd4 n SER 11 Ca -0.00 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1fd4 n SER 11 Cb 0.08 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 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 0.45 0.84 3.69 5.00 0.00 -0.23 -5.07 105.19 109.87 1fd4 n GLY 12 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.04 -1.79 -2.58 4.61 0.00 -1.10 -4.98 120.51 113.63 1fd4 n ALA 13 Ca 0.00 -1.67 -0.26 0.00 0.00 0.00 0.00 53.44 51.52 1fd4 n ALA 13 Cb 0.00 -0.09 -0.09 0.00 0.00 0.00 0.00 19.45 19.27 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 -3.68 3.22 -0.18 0.00 -4.36 0.66 -4.45 121.20 112.40 1fd4 s ILE 14 Ca 0.72 -1.73 -0.08 0.00 -0.26 0.00 0.00 60.65 59.31 1fd4 s ILE 14 Cb -0.03 -2.62 -0.04 0.00 1.25 0.00 0.00 42.46 41.02 1fd4 s ILE 14 CO 0.52 -0.17 0.07 0.00 0.24 0.00 0.00 174.94 175.60 1fd4 s HIS 16 N 0.36 2.32 0.22 0.00 2.46 0.08 -4.97 115.29 115.76 1fd4 s HIS 16 Ca 0.04 -0.44 0.36 0.00 0.47 0.00 0.00 55.06 55.49 1fd4 s HIS 16 Cb -0.12 -1.49 1.65 0.00 -0.13 0.00 0.00 32.58 32.50 1fd4 s HIS 16 CO -0.00 -0.03 2.07 -1.00 -2.47 0.00 0.00 174.74 173.30 1fd4 h PRO 17 N 5.47 0.00 0.00 2.88 0.13 -1.89 -0.02 132.00 138.57 1fd4 h PRO 17 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1fd4 h PRO 17 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1fd4 h PRO 17 CO 0.47 0.00 0.00 0.28 -0.23 0.00 0.00 178.00 178.52 1fd4 n VAL 18 N -2.99 0.00 -4.03 1.56 0.31 -1.26 -3.89 118.33 108.03 1fd4 n VAL 18 Ca -0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1fd4 n VAL 18 Cb 0.22 -0.19 -0.08 0.00 -0.91 0.00 0.00 33.84 32.88 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 -1.38 0.57 -0.19 3.52 -0.12 -1.26 -4.74 117.98 114.38 1fd4 s PHE 19 Ca 0.00 -0.93 -0.17 0.00 -0.05 0.00 0.00 56.93 55.78 1fd4 s PHE 19 Cb 0.00 -0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.14 1fd4 s PHE 19 CO 0.00 -0.65 0.44 0.00 -0.05 0.00 0.00 175.22 174.96 1fd4 s PRO 21 N 1.27 3.88 -0.98 0.00 0.02 -1.26 -4.80 135.00 133.13 1fd4 s PRO 21 Ca 0.22 2.44 -0.24 0.00 0.02 0.00 0.00 61.00 63.43 1fd4 s PRO 21 Cb -0.15 -2.79 -0.07 0.00 0.02 0.00 0.00 34.50 31.51 1fd4 s PRO 21 CO 0.09 -0.66 1.97 -0.98 -0.33 0.00 0.00 177.00 177.09 1fd4 s ARG 22 N -2.28 2.45 0.00 5.54 1.70 -1.26 -1.51 118.95 123.58 1fd4 s ARG 22 Ca 0.57 -0.50 0.00 0.00 -0.47 0.00 0.00 55.73 55.34 1fd4 s ARG 22 Cb -0.44 -5.10 0.00 0.00 -0.57 0.00 0.00 34.95 28.84 1fd4 s ARG 22 CO 0.58 -3.66 0.00 -2.13 -1.08 0.00 0.00 175.30 169.00 1fd4 n ARG 23 N 8.67 0.00 -4.37 3.89 0.63 -1.26 -5.12 116.66 119.10 1fd4 n ARG 23 Ca 0.42 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 57.07 1fd4 n ARG 23 Cb 0.47 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 33.26 1fd4 n ARG 23 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1fd4 s TYR 24 N 0.00 2.40 0.01 -0.14 1.51 -0.57 -4.46 117.35 116.10 1fd4 s TYR 24 Ca 0.00 -0.32 -0.05 0.00 -1.01 0.00 0.00 57.07 55.69 1fd4 s TYR 24 Cb 0.00 -1.22 -0.05 0.00 -0.11 0.00 0.00 41.96 40.58 1fd4 s TYR 24 CO 0.00 0.45 0.24 0.21 -1.11 0.00 0.00 175.55 175.34 1fd4 s LYS 25 N -2.49 3.53 -0.26 -0.62 2.20 0.18 -4.81 119.74 117.47 1fd4 s LYS 25 Ca 0.20 -0.16 -0.29 0.00 -0.36 0.00 0.00 55.97 55.35 1fd4 s LYS 25 Cb -0.09 -3.07 -0.01 0.00 -1.51 0.00 0.00 37.83 33.15 1fd4 s LYS 25 CO 0.10 0.65 1.35 -1.14 -0.36 0.00 0.00 175.35 175.95 1fd4 s GLN 26 N -1.86 3.95 0.00 4.03 0.74 -1.26 -0.41 119.66 124.85 1fd4 s GLN 26 Ca 0.28 1.40 0.09 0.00 0.05 0.00 0.00 55.36 57.18 1fd4 s GLN 26 Cb -0.13 -3.89 0.25 0.00 1.10 0.00 0.00 33.01 30.34 1fd4 s GLN 26 CO 0.17 -1.08 1.19 0.44 -0.55 0.00 0.00 175.29 175.47 1fd4 n ILE 27 N 6.09 0.95 -1.00 -2.34 -5.35 0.19 -4.98 119.36 112.92 1fd4 n ILE 27 Ca 0.15 -0.97 0.00 0.00 -0.27 0.00 0.00 62.75 61.66 1fd4 n ILE 27 Cb 0.46 0.54 0.00 0.00 -1.74 0.00 0.00 39.64 38.90 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 0.36 -0.31 3.56 3.28 0.00 -1.21 -2.38 105.19 108.49 1fd4 n GLY 28 Ca 0.09 -0.99 -0.26 0.00 0.00 0.00 0.00 46.02 44.87 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 -3.71 1.21 -0.33 2.61 -4.23 -0.58 -0.66 115.64 109.94 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 -2.60 0.46 0.00 1.34 0.00 0.00 72.50 71.69 1fd4 s THR 29 CO 0.00 0.00 1.31 0.00 -0.54 0.00 0.00 174.62 175.39 1fd4 n GLY 31 N -0.78 1.98 3.69 0.00 0.00 -1.13 -3.68 105.19 105.27 1fd4 n GLY 31 Ca 0.44 -0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.95 1fd4 n GLY 31 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fd4 n LEU 32 N 0.00 3.51 -4.70 0.99 7.94 -1.26 -4.86 117.00 118.62 1fd4 n LEU 32 Ca 0.00 1.14 -0.44 0.00 -1.11 0.00 0.00 56.01 55.60 1fd4 n LEU 32 Cb 0.00 -1.48 -0.03 0.00 0.53 0.00 0.00 43.42 42.44 1fd4 n LEU 32 CO 0.00 -0.26 1.17 -2.65 -1.11 0.00 0.00 177.39 174.54 1fd4 n PRO 33 N 2.20 2.36 0.00 1.96 -0.02 -1.26 -1.68 135.00 138.56 1fd4 n PRO 33 Ca 0.11 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1fd4 n PRO 33 Cb 0.33 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.22 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 2.67 3.11 3.81 -1.23 0.00 -1.26 -5.05 105.19 107.24 1fd4 n GLY 34 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.66 4.01 -0.02 2.61 -4.23 -0.68 -4.02 115.64 110.65 1fd4 s THR 35 Ca 0.00 0.92 0.04 0.00 -1.18 0.00 0.00 61.69 61.47 1fd4 s THR 35 Cb 0.00 -3.47 -0.01 0.00 1.34 0.00 0.00 72.50 70.36 1fd4 s THR 35 CO 0.00 -0.60 -0.14 -0.54 -0.54 0.00 0.00 174.62 172.81 1fd4 s LYS 36 N -4.20 1.29 -0.23 3.99 -0.14 -0.02 -3.56 119.74 116.87 1fd4 s LYS 36 Ca 0.62 -0.49 -0.15 0.00 -1.36 0.00 0.00 55.97 54.59 1fd4 s LYS 36 Cb -0.14 -1.19 -0.04 0.00 -1.68 0.00 0.00 37.83 34.77 1fd4 s LYS 36 CO 0.38 0.24 0.35 0.00 -0.76 0.00 0.00 175.35 175.56 1fd4 s LYS 39 N 0.39 0.22 0.33 0.00 2.20 0.45 -0.25 119.74 123.09 1fd4 s LYS 39 Ca -0.11 -0.17 -0.29 0.00 -0.36 0.00 0.00 55.97 55.04 1fd4 s LYS 39 Cb -0.15 -0.16 -0.11 0.00 -1.51 0.00 0.00 37.83 35.90 1fd4 s LYS 39 CO 0.04 0.04 1.53 0.15 -0.36 0.00 0.00 175.35 176.75 1fd4 s LYS 40 N -0.26 4.13 0.00 4.03 1.02 -1.26 0.50 119.74 127.89 1fd4 s LYS 40 Ca -0.01 2.55 0.05 0.00 0.02 0.00 0.00 55.97 58.58 1fd4 s LYS 40 Cb -0.02 -3.00 0.28 0.00 -0.52 0.00 0.00 37.83 34.56 1fd4 s LYS 40 CO -0.00 -0.56 0.75 -0.35 -0.92 0.00 0.00 175.35 174.27