#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2khb s LEU 2 N 0.00 4.01 -0.48 0.99 2.01 -1.26 -4.89 118.68 119.06 2khb s LEU 2 Ca 0.00 2.39 -0.06 0.00 0.01 0.00 0.00 54.13 56.47 2khb s LEU 2 Cb 0.00 -4.21 -0.16 0.00 0.01 0.00 0.00 46.19 41.83 2khb s LEU 2 CO 0.00 -0.99 2.81 -0.81 1.01 0.00 0.00 176.35 178.38 2khb n PRO 3 N -0.49 2.08 -0.05 1.29 -0.04 -1.26 -4.50 135.00 132.02 2khb n PRO 3 Ca 0.07 -1.18 -0.12 0.00 -0.04 0.00 0.00 63.50 62.23 2khb n PRO 3 Cb 0.47 -2.17 -0.07 0.00 -0.04 0.00 0.00 33.50 31.70 2khb n PRO 3 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2khb h VAL 4 N 2.58 1.31 -3.77 0.52 2.07 -2.01 -3.44 116.25 113.51 2khb h VAL 4 Ca 0.35 -1.06 -0.49 0.00 0.82 0.00 0.00 66.70 66.32 2khb h VAL 4 Cb 0.84 1.74 0.01 0.00 -1.52 0.00 0.00 31.29 32.36 2khb h VAL 4 CO 0.78 0.31 0.16 0.00 0.02 0.00 0.00 177.57 178.84 2khb n GLY 6 N -1.45 -0.21 3.83 0.00 0.00 -1.26 -4.97 105.19 101.13 2khb n GLY 6 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 2khb n GLY 6 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2khb s GLU 7 N 0.00 4.10 -0.08 1.61 1.03 -1.26 -4.91 118.70 119.19 2khb s GLU 7 Ca 0.00 0.66 -0.30 0.00 0.03 0.00 0.00 54.97 55.36 2khb s GLU 7 Cb 0.00 -2.93 -0.02 0.00 -0.80 0.00 0.00 34.13 30.39 2khb s GLU 7 CO 0.00 0.45 1.05 0.95 -1.33 0.00 0.00 175.26 176.39 2khb s THR 8 N -1.47 4.65 -0.27 1.83 -4.23 -1.26 -0.59 115.64 114.30 2khb s THR 8 Ca 0.39 1.93 -0.02 0.00 -1.18 0.00 0.00 61.69 62.82 2khb s THR 8 Cb -0.16 -4.24 0.13 0.00 1.34 0.00 0.00 72.50 69.57 2khb s THR 8 CO 0.20 0.02 2.24 0.00 -0.54 0.00 0.00 174.62 176.53 2khb h VAL 10 N 1.22 1.21 -0.65 0.00 3.04 -1.85 -2.26 116.25 116.96 2khb h VAL 10 Ca 0.26 -0.83 -0.13 0.00 -1.01 0.00 0.00 66.70 64.99 2khb h VAL 10 Cb 0.93 0.94 -0.08 0.00 -2.01 0.00 0.00 31.29 31.08 2khb h VAL 10 CO 0.63 0.29 0.16 0.61 -1.01 0.00 0.00 177.57 178.25 2khb n GLY 11 N -0.83 3.29 3.55 3.17 0.00 -1.26 -4.92 105.19 108.18 2khb n GLY 11 Ca 0.02 -0.92 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 2khb n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2khb n GLY 12 N 0.17 -0.43 3.28 -0.02 0.00 -0.85 -5.01 105.19 102.34 2khb n GLY 12 Ca 0.34 0.16 -0.12 0.00 0.00 0.00 0.00 46.02 46.41 2khb n GLY 12 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2khb s THR 13 N -3.37 0.07 -0.01 2.61 -1.32 -1.26 -5.10 115.64 107.26 2khb s THR 13 Ca 0.25 -0.61 0.03 0.00 -1.21 0.00 0.00 61.69 60.15 2khb s THR 13 Cb -0.11 -0.98 -0.01 0.00 -1.51 0.00 0.00 72.50 69.89 2khb s THR 13 CO 0.74 -0.34 -0.11 0.00 -2.21 0.00 0.00 174.62 172.71 2khb n ASN 15 N 2.83 1.93 -4.61 0.00 5.15 -1.26 -4.85 115.26 114.45 2khb n ASN 15 Ca -0.14 0.37 -0.43 0.00 -0.60 0.00 0.00 54.58 53.78 2khb n ASN 15 Cb 0.56 -0.94 -0.02 0.00 -0.53 0.00 0.00 39.78 38.85 2khb n ASN 15 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2khb s THR 16 N -2.42 3.93 0.23 -0.44 2.01 -1.26 -4.97 115.64 112.71 2khb s THR 16 Ca -0.27 0.99 -0.31 0.00 0.31 0.00 0.00 61.69 62.40 2khb s THR 16 Cb 0.06 -4.10 -0.12 0.00 0.01 0.00 0.00 72.50 68.35 2khb s THR 16 CO 0.64 -0.61 1.67 -2.84 -0.69 0.00 0.00 174.62 172.79 2khb s PRO 17 N 4.72 4.13 0.00 4.92 0.02 -1.26 -1.79 135.00 145.75 2khb s PRO 17 Ca 0.62 2.57 0.00 0.00 0.02 0.00 0.00 61.00 64.21 2khb s PRO 17 Cb -0.16 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.29 2khb s PRO 17 CO 0.29 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 2khb n GLY 18 N 3.41 2.06 3.71 0.52 0.00 -1.26 -5.05 105.19 108.58 2khb n GLY 18 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 2khb n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2khb s THR 20 N 0.91 4.11 -0.05 0.00 -1.32 0.12 -4.75 115.64 114.66 2khb s THR 20 Ca 0.26 -0.35 -0.30 0.00 -1.21 0.00 0.00 61.69 60.10 2khb s THR 20 Cb -0.15 -3.54 -0.02 0.00 -1.51 0.00 0.00 72.50 67.27 2khb s THR 20 CO 0.10 -0.42 0.98 0.00 -2.21 0.00 0.00 174.62 173.08 2khb n SER 22 N 4.42 0.83 -2.10 0.00 7.64 -0.00 -4.91 113.62 119.50 2khb n SER 22 Ca 0.07 -2.85 -0.27 0.00 1.01 0.00 0.00 58.87 56.82 2khb n SER 22 Cb 0.50 -0.64 -0.04 0.00 -1.01 0.00 0.00 64.21 63.02 2khb n SER 22 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 2khb n TRP 23 N 1.15 0.29 -0.81 1.43 -0.00 -1.26 -1.35 117.44 116.90 2khb n TRP 23 Ca 0.23 0.49 -0.20 0.00 -0.00 0.00 0.00 57.50 58.02 2khb n TRP 23 Cb 0.53 -0.97 0.13 0.00 -0.00 0.00 0.00 31.31 31.00 2khb n TRP 23 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2khb n PRO 24 N 0.70 2.03 -3.86 5.87 -0.04 -1.26 -5.06 135.00 133.37 2khb n PRO 24 Ca 0.09 -2.40 -0.12 0.00 -0.04 0.00 0.00 63.50 61.04 2khb n PRO 24 Cb 0.04 -1.94 -0.11 0.00 -0.04 0.00 0.00 33.50 31.45 2khb n PRO 24 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2khb s VAL 25 N -2.75 0.06 0.16 0.52 -7.23 -0.46 -1.09 120.40 109.61 2khb s VAL 25 Ca 0.46 -0.46 -0.27 0.00 -1.81 0.00 0.00 61.98 59.90 2khb s VAL 25 Cb 0.38 -0.36 -0.08 0.00 0.56 0.00 0.00 36.38 36.89 2khb s VAL 25 CO 0.07 -0.25 0.84 0.00 -0.31 0.00 0.00 175.10 175.45 2khb n THR 27 N 1.89 0.00 -3.27 0.00 5.66 0.33 -4.29 114.28 114.60 2khb n THR 27 Ca -0.03 -0.24 -0.39 0.00 -3.05 0.00 0.00 64.05 60.34 2khb n THR 27 Cb 0.48 0.16 -0.06 0.00 -1.55 0.00 0.00 70.33 69.37 2khb n THR 27 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2khb s ARG 28 N -2.10 4.24 0.00 1.09 1.70 -1.26 0.10 118.95 122.72 2khb s ARG 28 Ca 0.04 0.67 0.32 0.00 -0.47 0.00 0.00 55.73 56.29 2khb s ARG 28 Cb -0.00 -3.30 1.86 0.00 -0.57 0.00 0.00 34.95 32.94 2khb s ARG 28 CO 0.03 0.47 2.20 -1.71 -1.08 0.00 0.00 175.30 175.21