#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 0.79 -0.02 1.61 -1.05 0.29 -4.99 118.70 115.34 1le3 s GLU 42 Ca 0.00 -1.33 -0.20 0.00 -0.15 0.00 0.00 54.97 53.28 1le3 s GLU 42 Cb 0.00 0.08 -0.05 0.00 -0.44 0.00 0.00 34.13 33.72 1le3 s GLU 42 CO 0.00 -0.13 0.59 -1.58 0.95 0.00 0.00 175.26 175.09 1le3 s TRP 43 N -3.87 3.67 0.03 4.83 0.52 -1.26 -0.29 118.94 122.57 1le3 s TRP 43 Ca 0.14 1.18 0.02 0.00 0.02 0.00 0.00 56.10 57.46 1le3 s TRP 43 Cb 0.07 -2.61 -0.04 0.00 -1.15 0.00 0.00 33.47 29.74 1le3 s TRP 43 CO -0.04 0.33 0.04 0.99 0.02 0.00 0.00 176.95 178.29 1le3 s THR 44 N -0.09 4.39 0.25 2.01 2.01 0.10 -4.94 115.64 119.37 1le3 s THR 44 Ca 0.31 -0.64 -0.30 0.00 0.31 0.00 0.00 61.69 61.37 1le3 s THR 44 Cb -0.18 -3.03 -0.09 0.00 0.01 0.00 0.00 72.50 69.21 1le3 s THR 44 CO 0.17 0.27 0.94 0.86 -0.69 0.00 0.00 174.62 176.16 1le3 s TRP 45 N -1.22 3.96 -0.38 4.92 -0.11 -1.26 -1.04 118.94 123.81 1le3 s TRP 45 Ca 0.24 1.90 0.02 0.00 1.22 0.00 0.00 56.10 59.48 1le3 s TRP 45 Cb -0.12 -2.97 0.11 0.00 -1.50 0.00 0.00 33.47 28.99 1le3 s TRP 45 CO 0.15 0.44 0.13 0.34 -4.62 0.00 0.00 176.95 173.40 1le3 s ASP 46 N -1.22 4.29 0.52 5.86 2.15 0.29 -4.89 116.67 123.67 1le3 s ASP 46 Ca 0.42 -2.26 0.30 0.00 0.43 0.00 0.00 52.55 51.43 1le3 s ASP 46 Cb -0.25 -1.32 1.43 0.00 -0.30 0.00 0.00 42.92 42.47 1le3 s ASP 46 CO 0.31 -0.34 1.87 -2.24 -0.17 0.00 0.00 175.17 174.60 1le3 h ASP 47 N 7.37 0.07 1.19 -0.34 2.03 -1.97 -0.11 116.42 124.67 1le3 h ASP 47 Ca -0.07 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.24 1le3 h ASP 47 Cb 0.98 -0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.48 1le3 h ASP 47 CO 0.53 0.02 0.00 0.00 -1.03 0.00 0.00 179.24 178.76 1le3 h ALA 48 N 1.55 1.00 0.00 4.15 0.00 -1.94 -3.29 119.26 120.73 1le3 h ALA 48 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1le3 h ALA 48 Cb 1.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1le3 h ALA 48 CO -0.04 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.46 1le3 n THR 49 N -2.34 0.34 -3.80 0.00 -2.24 -0.47 -5.02 114.28 100.76 1le3 n THR 49 Ca 0.04 -0.50 -0.27 0.00 -2.27 0.00 0.00 64.05 61.04 1le3 n THR 49 Cb 0.35 0.99 -0.07 0.00 -2.10 0.00 0.00 70.33 69.51 1le3 n THR 49 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1le3 n LYS 50 N -0.17 -0.87 -4.11 -0.78 4.76 -0.18 -4.91 118.16 111.90 1le3 n LYS 50 Ca 0.00 0.09 -0.13 0.00 -2.87 0.00 0.00 58.31 55.40 1le3 n LYS 50 Cb 0.21 -3.07 -0.06 0.00 -1.84 0.00 0.00 35.03 30.26 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 -3.33 0.00 -0.02 -0.18 2.01 -1.16 -5.01 115.64 107.95 1le3 s THR 51 Ca 0.32 -1.68 -0.10 0.00 0.31 0.00 0.00 61.69 60.54 1le3 s THR 51 Cb -0.18 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 1le3 s THR 51 CO 0.75 0.00 0.30 0.26 -0.69 0.00 0.00 174.62 175.24 1le3 s TRP 52 N -3.67 3.64 0.04 4.92 0.52 -1.26 -0.55 118.94 122.59 1le3 s TRP 52 Ca 0.31 0.74 0.05 0.00 0.02 0.00 0.00 56.10 57.22 1le3 s TRP 52 Cb 0.02 -2.10 -0.02 0.00 -1.15 0.00 0.00 33.47 30.21 1le3 s TRP 52 CO 0.15 0.65 -0.14 0.99 0.02 0.00 0.00 176.95 178.62 1le3 s THR 53 N -1.16 1.10 0.05 2.01 2.01 -0.20 -4.91 115.64 114.54 1le3 s THR 53 Ca 0.24 -1.04 -0.19 0.00 0.31 0.00 0.00 61.69 61.01 1le3 s THR 53 Cb -0.14 -1.01 -0.06 0.00 0.01 0.00 0.00 72.50 71.30 1le3 s THR 53 CO 0.12 -0.03 0.55 0.86 -0.69 0.00 0.00 174.62 175.42 1le3 s TRP 54 N -0.91 3.78 -0.29 4.92 -0.11 -1.26 -0.72 118.94 124.34 1le3 s TRP 54 Ca 0.01 1.22 0.01 0.00 1.22 0.00 0.00 56.10 58.56 1le3 s TRP 54 Cb -0.08 -2.48 0.09 0.00 -1.50 0.00 0.00 33.47 29.50 1le3 s TRP 54 CO 0.01 0.57 0.04 0.95 -4.62 0.00 0.00 176.95 173.91 1le3 s THR 55 N -1.01 1.41 -2.00 5.86 -4.23 0.61 -4.91 115.64 111.36 1le3 s THR 55 Ca 0.28 -1.55 0.01 0.00 -1.18 0.00 0.00 61.69 59.25 1le3 s THR 55 Cb -0.19 -1.93 0.01 0.00 1.34 0.00 0.00 72.50 71.73 1le3 s THR 55 CO 0.18 -0.46 0.53 -0.62 -0.54 0.00 0.00 174.62 173.70