#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1le3 s GLU 42 N 0.00 1.16 0.13 1.61 -1.05 0.12 -5.01 118.70 115.67 1le3 s GLU 42 Ca 0.00 -1.56 -0.16 0.00 -0.15 0.00 0.00 54.97 53.10 1le3 s GLU 42 Cb 0.00 0.28 -0.07 0.00 -0.44 0.00 0.00 34.13 33.90 1le3 s GLU 42 CO 0.00 -0.38 0.57 -1.58 0.95 0.00 0.00 175.26 174.82 1le3 s TRP 43 N -4.12 3.66 -0.10 4.83 0.52 -1.26 -0.70 118.94 121.77 1le3 s TRP 43 Ca 0.34 1.15 0.01 0.00 0.02 0.00 0.00 56.10 57.62 1le3 s TRP 43 Cb 0.07 -2.43 0.02 0.00 -1.15 0.00 0.00 33.47 29.98 1le3 s TRP 43 CO 0.09 0.46 -0.13 0.99 0.02 0.00 0.00 176.95 178.38 1le3 s THR 44 N -1.38 1.34 0.54 2.01 2.01 0.53 -4.90 115.64 115.79 1le3 s THR 44 Ca 0.36 -0.54 -0.20 0.00 0.31 0.00 0.00 61.69 61.62 1le3 s THR 44 Cb -0.16 -1.25 -0.06 0.00 0.01 0.00 0.00 72.50 71.04 1le3 s THR 44 CO 0.19 0.41 1.14 0.86 -0.69 0.00 0.00 174.62 176.53 1le3 s TRP 45 N 1.11 2.67 -0.42 4.92 -0.11 -1.26 -0.49 118.94 125.35 1le3 s TRP 45 Ca -0.05 1.54 0.03 0.00 1.22 0.00 0.00 56.10 58.84 1le3 s TRP 45 Cb -0.14 -3.32 0.16 0.00 -1.50 0.00 0.00 33.47 28.67 1le3 s TRP 45 CO -0.03 -1.63 0.33 0.34 -4.62 0.00 0.00 176.95 171.34 1le3 s ASP 46 N -1.70 2.01 0.60 5.86 -1.08 0.10 -4.85 116.67 117.61 1le3 s ASP 46 Ca 0.72 -2.96 0.34 0.00 -0.52 0.00 0.00 52.55 50.13 1le3 s ASP 46 Cb -0.25 -0.54 1.84 0.00 -1.46 0.00 0.00 42.92 42.51 1le3 s ASP 46 CO 0.28 -0.19 2.03 -2.24 0.52 0.00 0.00 175.17 175.57 1le3 h ASP 47 N 5.90 0.00 0.25 -0.34 2.03 -1.94 -0.36 116.42 121.95 1le3 h ASP 47 Ca 0.21 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.51 1le3 h ASP 47 Cb 0.91 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.41 1le3 h ASP 47 CO 0.38 0.00 -0.01 0.00 -1.03 0.00 0.00 179.24 178.58 1le3 h ALA 48 N 1.68 1.05 0.00 4.15 0.00 -1.94 -2.99 119.26 121.22 1le3 h ALA 48 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1le3 h ALA 48 Cb 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1le3 h ALA 48 CO 0.00 0.01 -0.19 -2.37 0.00 0.00 0.00 179.25 176.70 1le3 n THR 49 N -3.17 0.40 -3.68 0.00 5.66 -0.24 -5.03 114.28 108.22 1le3 n THR 49 Ca -0.02 -0.45 -0.26 0.00 -3.05 0.00 0.00 64.05 60.27 1le3 n THR 49 Cb 0.13 0.57 -0.06 0.00 -1.55 0.00 0.00 70.33 69.42 1le3 n THR 49 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1le3 n LYS 50 N -0.27 -0.87 -4.20 1.09 4.76 -0.63 -4.92 118.16 113.13 1le3 n LYS 50 Ca 0.02 0.08 -0.13 0.00 -2.87 0.00 0.00 58.31 55.41 1le3 n LYS 50 Cb 0.56 -2.90 -0.09 0.00 -1.84 0.00 0.00 35.03 30.76 1le3 n LYS 50 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1le3 s THR 51 N -3.20 0.00 0.03 -0.18 2.01 -1.16 -4.98 115.64 108.16 1le3 s THR 51 Ca 0.32 -1.94 -0.05 0.00 0.31 0.00 0.00 61.69 60.32 1le3 s THR 51 Cb -0.18 -2.48 -0.05 0.00 0.01 0.00 0.00 72.50 69.80 1le3 s THR 51 CO 0.70 0.00 0.26 0.26 -0.69 0.00 0.00 174.62 175.15 1le3 s TRP 52 N -3.98 3.55 0.23 4.92 0.52 -1.26 -0.72 118.94 122.20 1le3 s TRP 52 Ca 0.38 0.49 0.09 0.00 0.02 0.00 0.00 56.10 57.08 1le3 s TRP 52 Cb 0.05 -1.93 -0.05 0.00 -1.15 0.00 0.00 33.47 30.39 1le3 s TRP 52 CO 0.15 0.60 -0.16 -0.08 0.02 0.00 0.00 176.95 177.48 1le3 s THR 53 N -1.37 1.97 0.01 2.01 -1.32 0.35 -4.92 115.64 112.37 1le3 s THR 53 Ca 0.30 -2.27 -0.11 0.00 -1.21 0.00 0.00 61.69 58.39 1le3 s THR 53 Cb -0.13 -2.13 -0.05 0.00 -1.51 0.00 0.00 72.50 68.67 1le3 s THR 53 CO 0.19 -0.53 0.36 0.86 -2.21 0.00 0.00 174.62 173.29 1le3 s TRP 54 N -2.83 3.66 -0.18 9.09 -0.11 -1.26 -0.35 118.94 126.96 1le3 s TRP 54 Ca 0.25 0.83 -0.00 0.00 1.22 0.00 0.00 56.10 58.40 1le3 s TRP 54 Cb -0.02 -2.18 0.05 0.00 -1.50 0.00 0.00 33.47 29.82 1le3 s TRP 54 CO 0.09 0.62 -0.05 0.95 -4.62 0.00 0.00 176.95 173.95 1le3 s THR 55 N -1.19 1.14 0.00 5.86 -4.23 0.13 -4.87 115.64 112.48 1le3 s THR 55 Ca 0.26 -0.74 0.00 0.00 -1.18 0.00 0.00 61.69 60.03 1le3 s THR 55 Cb -0.15 -1.36 0.00 0.00 1.34 0.00 0.00 72.50 72.33 1le3 s THR 55 CO 0.14 0.06 0.48 1.21 -0.54 0.00 0.00 174.62 175.97