#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 4.23 0.15 0.99 2.96 -1.26 -4.99 118.68 120.76 2khb s LEU 2 Ca 0.00 1.73 -0.31 0.00 -0.22 0.00 0.00 54.13 55.34 2khb s LEU 2 Cb 0.00 -3.55 -0.08 0.00 0.50 0.00 0.00 46.19 43.06 2khb s LEU 2 CO 0.00 -0.65 1.38 -2.84 -1.32 0.00 0.00 176.35 172.92 2khb s PRO 3 N 2.73 4.33 0.06 0.98 0.02 -1.26 -4.94 135.00 136.92 2khb s PRO 3 Ca 0.54 2.10 -0.18 0.00 0.02 0.00 0.00 61.00 63.48 2khb s PRO 3 Cb -0.23 -3.22 -0.13 0.00 0.02 0.00 0.00 34.50 30.95 2khb s PRO 3 CO 0.18 -0.39 1.36 0.28 -0.33 0.00 0.00 177.00 178.10 2khb h VAL 4 N 4.05 1.33 -2.86 3.83 2.07 -1.94 -3.44 116.25 119.29 2khb h VAL 4 Ca -0.43 -1.40 -0.51 0.00 0.82 0.00 0.00 66.70 65.17 2khb h VAL 4 Cb 1.21 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 2khb h VAL 4 CO 0.84 0.43 -0.27 0.00 0.02 0.00 0.00 177.57 178.58 2khb n GLY 6 N -1.02 0.88 3.74 0.00 0.00 -1.23 -4.76 105.19 102.80 2khb n GLY 6 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 2khb n GLY 6 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2khb s GLU 7 N 0.00 4.75 -0.07 1.61 8.01 -1.26 -4.82 118.70 126.92 2khb s GLU 7 Ca 0.00 1.50 -0.30 0.00 0.01 0.00 0.00 54.97 56.18 2khb s GLU 7 Cb 0.00 -3.33 -0.04 0.00 -4.31 0.00 0.00 34.13 26.45 2khb s GLU 7 CO 0.00 0.32 1.40 0.95 0.01 0.00 0.00 175.26 177.94 2khb s THR 8 N -0.52 3.91 -0.39 3.63 -4.23 -1.26 -0.05 115.64 116.72 2khb s THR 8 Ca 0.45 1.19 -0.00 0.00 -1.18 0.00 0.00 61.69 62.15 2khb s THR 8 Cb -0.25 -3.77 0.34 0.00 1.34 0.00 0.00 72.50 70.16 2khb s THR 8 CO 0.31 -0.06 1.90 0.00 -0.54 0.00 0.00 174.62 176.24 2khb h VAL 10 N 0.90 1.23 -0.55 0.00 2.07 -1.85 -1.89 116.25 116.17 2khb h VAL 10 Ca 0.40 -0.46 -0.18 0.00 0.82 0.00 0.00 66.70 67.28 2khb h VAL 10 Cb 1.27 -0.03 -0.11 0.00 -1.52 0.00 0.00 31.29 30.91 2khb h VAL 10 CO 0.95 0.23 0.23 0.61 0.02 0.00 0.00 177.57 179.61 2khb n GLY 11 N -1.29 3.13 3.52 2.17 0.00 -1.26 -4.90 105.19 106.56 2khb n GLY 11 Ca 0.09 -0.70 -0.19 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.10 -0.39 3.27 -0.02 0.00 -0.71 -5.01 105.19 102.24 2khb n GLY 12 Ca 0.30 0.13 -0.12 0.00 0.00 0.00 0.00 46.02 46.34 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 -3.40 0.07 -0.01 2.61 -1.32 -1.26 -5.11 115.64 107.22 2khb s THR 13 Ca 0.13 -0.58 0.02 0.00 -1.21 0.00 0.00 61.69 60.05 2khb s THR 13 Cb -0.06 -0.90 -0.00 0.00 -1.51 0.00 0.00 72.50 70.03 2khb s THR 13 CO 0.75 -0.32 -0.07 0.00 -2.21 0.00 0.00 174.62 172.77 2khb h ASN 15 N 6.19 -0.00 -2.97 0.00 -1.24 -1.94 -3.44 115.58 112.17 2khb h ASN 15 Ca -0.31 -0.60 -0.57 0.00 0.71 0.00 0.00 56.30 55.53 2khb h ASN 15 Cb 1.18 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.19 2khb h ASN 15 CO 0.49 0.80 1.04 -0.89 -1.29 0.00 0.00 177.43 177.58 2khb s THR 16 N -1.97 3.95 0.02 -3.57 2.01 -1.26 -4.96 115.64 109.86 2khb s THR 16 Ca -0.11 1.07 -0.30 0.00 0.31 0.00 0.00 61.69 62.65 2khb s THR 16 Cb -0.02 -3.96 -0.08 0.00 0.01 0.00 0.00 72.50 68.46 2khb s THR 16 CO 0.42 -0.39 1.77 -2.84 -0.69 0.00 0.00 174.62 172.88 2khb s PRO 17 N 4.38 4.17 0.00 4.92 0.02 -1.26 -1.73 135.00 145.49 2khb s PRO 17 Ca 0.63 2.40 0.00 0.00 0.02 0.00 0.00 61.00 64.04 2khb s PRO 17 Cb -0.20 -3.90 0.00 0.00 0.02 0.00 0.00 34.50 30.42 2khb s PRO 17 CO 0.26 -0.85 0.00 0.41 -0.33 0.00 0.00 177.00 176.49 2khb n GLY 18 N 4.23 1.97 3.74 0.52 0.00 -1.26 -5.09 105.19 109.30 2khb n GLY 18 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 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 0.27 4.76 -0.07 0.00 2.01 0.16 -4.77 115.64 118.00 2khb s THR 20 Ca 0.31 0.97 -0.30 0.00 0.31 0.00 0.00 61.69 62.98 2khb s THR 20 Cb -0.17 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 2khb s THR 20 CO 0.15 0.22 1.06 0.00 -0.69 0.00 0.00 174.62 175.37 2khb n SER 22 N 4.82 1.64 -2.08 0.00 7.64 0.05 -4.93 113.62 120.76 2khb n SER 22 Ca 0.09 -3.03 -0.28 0.00 1.01 0.00 0.00 58.87 56.66 2khb n SER 22 Cb 0.48 -0.64 -0.04 0.00 -1.01 0.00 0.00 64.21 63.00 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 0.97 0.40 -0.99 1.43 -0.00 -1.26 -0.98 117.44 117.02 2khb n TRP 23 Ca 0.25 0.49 -0.23 0.00 -0.00 0.00 0.00 57.50 58.01 2khb n TRP 23 Cb 0.50 -0.97 0.13 0.00 -0.00 0.00 0.00 31.31 30.97 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 0.93 2.17 -3.86 5.87 -0.04 -1.26 -5.07 135.00 133.74 2khb n PRO 24 Ca 0.10 -2.63 -0.12 0.00 -0.04 0.00 0.00 63.50 60.81 2khb n PRO 24 Cb 0.02 -2.03 -0.14 0.00 -0.04 0.00 0.00 33.50 31.31 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 -3.18 -0.00 0.13 0.52 -7.23 -0.15 -0.72 120.40 109.77 2khb s VAL 25 Ca 0.50 0.01 -0.26 0.00 -1.81 0.00 0.00 61.98 60.43 2khb s VAL 25 Cb 0.42 -0.05 -0.07 0.00 0.56 0.00 0.00 36.38 37.24 2khb s VAL 25 CO 0.07 0.01 0.81 0.00 -0.31 0.00 0.00 175.10 175.67 2khb s THR 27 N -0.71 0.05 -0.24 0.00 -1.32 0.77 -3.51 115.64 110.68 2khb s THR 27 Ca 0.38 -0.38 -0.10 0.00 -1.21 0.00 0.00 61.69 60.38 2khb s THR 27 Cb -0.23 -0.65 -0.05 0.00 -1.51 0.00 0.00 72.50 70.06 2khb s THR 27 CO 0.26 -0.21 0.16 -0.60 -2.21 0.00 0.00 174.62 172.02 2khb s ARG 28 N -1.19 4.07 0.00 7.08 3.52 -1.26 0.36 118.95 131.53 2khb s ARG 28 Ca -0.12 -0.27 0.15 0.00 -0.13 0.00 0.00 55.73 55.36 2khb s ARG 28 Cb -0.04 -3.53 0.91 0.00 -1.56 0.00 0.00 34.95 30.73 2khb s ARG 28 CO 0.05 0.07 1.33 0.09 -0.81 0.00 0.00 175.30 176.02