#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 4.50 -0.28 0.99 2.96 -1.26 -4.94 118.68 120.65 2khb s LEU 2 Ca 0.00 1.64 -0.04 0.00 -0.22 0.00 0.00 54.13 55.51 2khb s LEU 2 Cb 0.00 -3.40 -0.10 0.00 0.50 0.00 0.00 46.19 43.19 2khb s LEU 2 CO 0.00 0.02 2.03 -2.65 -1.32 0.00 0.00 176.35 174.43 2khb n PRO 3 N 2.58 1.29 -0.53 0.98 -0.02 -1.26 -4.41 135.00 133.63 2khb n PRO 3 Ca -0.01 -0.79 0.02 0.00 -2.02 0.00 0.00 63.50 60.70 2khb n PRO 3 Cb 0.49 -1.97 0.21 0.00 -0.02 0.00 0.00 33.50 32.22 2khb n PRO 3 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2khb n VAL 4 N 3.28 1.65 -0.76 -1.45 0.31 -1.26 -4.95 118.33 115.14 2khb n VAL 4 Ca 0.28 -0.82 -0.31 0.00 -0.01 0.00 0.00 64.34 63.47 2khb n VAL 4 Cb 0.34 -0.42 0.16 0.00 -0.91 0.00 0.00 33.84 33.02 2khb n VAL 4 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2khb n GLY 6 N 0.06 0.37 3.68 0.00 0.00 -1.24 -5.06 105.19 102.99 2khb n GLY 6 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2khb n GLY 6 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2khb n GLU 7 N 0.00 1.07 -3.59 1.61 2.13 -1.26 -4.77 120.64 115.82 2khb n GLU 7 Ca 0.00 0.41 -0.37 0.00 0.66 0.00 0.00 57.16 57.87 2khb n GLU 7 Cb 0.00 -2.37 -0.08 0.00 0.27 0.00 0.00 31.44 29.26 2khb n GLU 7 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2khb s THR 8 N -1.43 5.32 -0.29 6.31 -4.23 -1.26 -0.17 115.64 119.88 2khb s THR 8 Ca 0.79 0.36 -0.02 0.00 -1.18 0.00 0.00 61.69 61.64 2khb s THR 8 Cb -0.40 -3.57 0.08 0.00 1.34 0.00 0.00 72.50 69.95 2khb s THR 8 CO 0.44 0.35 2.47 0.00 -0.54 0.00 0.00 174.62 177.34 2khb h VAL 10 N 1.46 1.23 -0.61 0.00 3.04 -1.81 -2.32 116.25 117.24 2khb h VAL 10 Ca 0.28 -0.68 -0.24 0.00 -1.01 0.00 0.00 66.70 65.05 2khb h VAL 10 Cb 0.93 0.34 -0.15 0.00 -2.01 0.00 0.00 31.29 30.40 2khb h VAL 10 CO 0.66 0.28 0.31 0.61 -1.01 0.00 0.00 177.57 178.42 2khb n GLY 11 N -1.04 3.37 3.41 3.17 0.00 -1.26 -4.88 105.19 107.96 2khb n GLY 11 Ca 0.07 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.29 -0.54 3.39 -0.02 0.00 -0.87 -4.98 105.19 101.89 2khb n GLY 12 Ca 0.35 0.21 -0.10 0.00 0.00 0.00 0.00 46.02 46.48 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 -3.26 0.06 -0.11 2.61 -1.32 -1.26 -5.10 115.64 107.26 2khb s THR 13 Ca 0.49 -0.89 -0.04 0.00 -1.21 0.00 0.00 61.69 60.04 2khb s THR 13 Cb -0.22 -1.50 0.05 0.00 -1.51 0.00 0.00 72.50 69.32 2khb s THR 13 CO 0.61 -0.26 0.21 0.00 -2.21 0.00 0.00 174.62 172.97 2khb h ASN 15 N 8.32 0.56 -2.23 0.00 -1.24 -1.95 -3.44 115.58 115.61 2khb h ASN 15 Ca -0.14 -0.56 -0.58 0.00 0.71 0.00 0.00 56.30 55.73 2khb h ASN 15 Cb 1.12 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 39.97 2khb h ASN 15 CO 0.14 1.41 1.42 -0.89 -1.29 0.00 0.00 177.43 178.22 2khb s THR 16 N -2.80 3.18 0.20 -3.57 2.01 -1.26 -4.92 115.64 108.47 2khb s THR 16 Ca -0.06 0.18 -0.32 0.00 0.31 0.00 0.00 61.69 61.81 2khb s THR 16 Cb 0.07 -3.25 -0.11 0.00 0.01 0.00 0.00 72.50 69.22 2khb s THR 16 CO 0.90 -0.16 1.66 -2.84 -0.69 0.00 0.00 174.62 173.49 2khb s PRO 17 N 6.17 4.16 0.00 4.92 0.02 -1.26 -1.75 135.00 147.25 2khb s PRO 17 Ca 0.93 2.52 0.00 0.00 0.02 0.00 0.00 61.00 64.47 2khb s PRO 17 Cb -0.29 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.14 2khb s PRO 17 CO 0.34 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.72 2khb n GLY 18 N 3.82 3.45 3.66 0.52 0.00 -1.26 -4.20 105.19 111.19 2khb n GLY 18 Ca 0.15 0.00 -0.40 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 1.79 4.76 0.07 0.00 -4.23 0.13 -4.74 115.64 113.41 2khb s THR 20 Ca 0.28 1.04 -0.31 0.00 -1.18 0.00 0.00 61.69 61.52 2khb s THR 20 Cb -0.16 -3.81 -0.07 0.00 1.34 0.00 0.00 72.50 69.80 2khb s THR 20 CO 0.10 0.32 1.39 0.00 -0.54 0.00 0.00 174.62 175.89 2khb n SER 22 N 4.48 0.96 -2.14 0.00 2.88 0.18 -4.89 113.62 115.07 2khb n SER 22 Ca 0.12 -2.92 -0.28 0.00 -1.33 0.00 0.00 58.87 54.46 2khb n SER 22 Cb 0.43 -0.63 -0.04 0.00 -0.75 0.00 0.00 64.21 63.22 2khb n SER 22 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 2khb n TRP 23 N 0.92 0.38 -0.97 0.66 -0.00 -1.26 -1.04 117.44 116.12 2khb n TRP 23 Ca 0.24 0.51 -0.23 0.00 -0.00 0.00 0.00 57.50 58.02 2khb n TRP 23 Cb 0.55 -1.00 0.13 0.00 -0.00 0.00 0.00 31.31 30.99 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 0.87 2.16 -3.93 5.87 -0.04 -1.26 -5.07 135.00 133.59 2khb n PRO 24 Ca 0.10 -2.62 -0.12 0.00 -0.04 0.00 0.00 63.50 60.83 2khb n PRO 24 Cb 0.03 -2.03 -0.13 0.00 -0.04 0.00 0.00 33.50 31.33 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 -3.13 0.09 -0.00 0.52 -7.23 -0.21 -1.68 120.40 108.76 2khb s VAL 25 Ca 0.50 -0.29 -0.27 0.00 -1.81 0.00 0.00 61.98 60.11 2khb s VAL 25 Cb 0.41 -0.13 -0.04 0.00 0.56 0.00 0.00 36.38 37.18 2khb s VAL 25 CO 0.07 -0.13 0.84 0.00 -0.31 0.00 0.00 175.10 175.58 2khb s THR 27 N 0.65 0.18 -1.20 0.00 -1.32 0.57 -3.67 115.64 110.86 2khb s THR 27 Ca 0.44 -1.52 -0.16 0.00 -1.21 0.00 0.00 61.69 59.24 2khb s THR 27 Cb -0.20 -1.20 0.14 0.00 -1.51 0.00 0.00 72.50 69.73 2khb s THR 27 CO 0.24 -0.84 1.49 -0.60 -2.21 0.00 0.00 174.62 172.70 2khb s ARG 28 N -3.30 4.00 0.00 7.08 3.00 -1.26 0.19 118.95 128.65 2khb s ARG 28 Ca 0.01 -2.29 0.19 0.00 -1.00 0.00 0.00 55.73 52.64 2khb s ARG 28 Cb 0.03 -5.19 1.13 0.00 0.00 0.00 0.00 34.95 30.93 2khb s ARG 28 CO -0.08 -1.92 1.53 -1.71 0.00 0.00 0.00 175.30 173.12