#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2khb n LEU 2 N 0.00 -6.39 -4.66 0.99 7.94 -1.26 -4.91 117.00 108.71 2khb n LEU 2 Ca 0.00 1.51 -0.43 0.00 -1.11 0.00 0.00 56.01 55.98 2khb n LEU 2 Cb 0.00 -2.95 -0.02 0.00 0.53 0.00 0.00 43.42 40.98 2khb n LEU 2 CO 0.00 -2.99 1.21 -2.16 -1.11 0.00 0.00 177.39 172.34 2khb s PRO 3 N -1.10 4.22 0.17 1.96 0.04 -1.26 -4.91 135.00 134.11 2khb s PRO 3 Ca -0.10 1.91 -0.11 0.00 0.04 0.00 0.00 61.00 62.75 2khb s PRO 3 Cb 0.01 -3.84 0.05 0.00 0.04 0.00 0.00 34.50 30.75 2khb s PRO 3 CO 0.66 -0.75 1.63 0.28 0.04 0.00 0.00 177.00 178.85 2khb h VAL 4 N 5.48 1.26 0.00 -0.36 2.07 -1.91 -3.31 116.25 119.48 2khb h VAL 4 Ca -0.33 -1.11 -0.22 0.00 0.82 0.00 0.00 66.70 65.86 2khb h VAL 4 Cb 1.14 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 2khb h VAL 4 CO 0.96 0.40 -1.19 0.00 0.02 0.00 0.00 177.57 177.75 2khb n GLY 6 N 1.44 2.53 3.72 0.00 0.00 -1.25 -5.01 105.19 106.62 2khb n GLY 6 Ca -0.31 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.78 2khb n GLY 6 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2khb n GLU 7 N 0.00 2.49 -3.11 1.61 1.02 -1.26 -4.82 120.64 116.58 2khb n GLU 7 Ca 0.00 0.89 -0.40 0.00 -0.02 0.00 0.00 57.16 57.63 2khb n GLU 7 Cb 0.00 -2.63 -0.05 0.00 -0.02 0.00 0.00 31.44 28.74 2khb n GLU 7 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2khb s THR 8 N -0.06 5.05 -0.40 2.62 -4.23 -1.26 0.02 115.64 117.38 2khb s THR 8 Ca 0.65 1.27 -0.01 0.00 -1.18 0.00 0.00 61.69 62.42 2khb s THR 8 Cb -0.54 -3.97 0.26 0.00 1.34 0.00 0.00 72.50 69.58 2khb s THR 8 CO 0.49 0.20 2.05 0.00 -0.54 0.00 0.00 174.62 176.82 2khb h VAL 10 N 1.04 1.19 -0.59 0.00 3.04 -1.83 -1.95 116.25 117.16 2khb h VAL 10 Ca 0.36 -0.58 -0.17 0.00 -1.01 0.00 0.00 66.70 65.31 2khb h VAL 10 Cb 0.88 0.53 -0.10 0.00 -2.01 0.00 0.00 31.29 30.58 2khb h VAL 10 CO 0.94 0.23 0.21 0.61 -1.01 0.00 0.00 177.57 178.56 2khb n GLY 11 N -1.12 3.19 3.60 3.17 0.00 -1.26 -4.90 105.19 107.87 2khb n GLY 11 Ca 0.05 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.03 -0.50 3.29 -0.02 0.00 -0.73 -5.00 105.19 102.19 2khb n GLY 12 Ca 0.32 0.22 -0.12 0.00 0.00 0.00 0.00 46.02 46.45 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 -3.33 0.07 -0.01 2.61 -1.32 -1.26 -5.10 115.64 107.29 2khb s THR 13 Ca 0.48 -0.60 0.01 0.00 -1.21 0.00 0.00 61.69 60.37 2khb s THR 13 Cb -0.21 -1.02 0.00 0.00 -1.51 0.00 0.00 72.50 69.76 2khb s THR 13 CO 0.74 -0.33 -0.05 0.00 -2.21 0.00 0.00 174.62 172.77 2khb h ASN 15 N 6.37 0.06 -2.78 0.00 -1.24 -1.95 -3.46 115.58 112.58 2khb h ASN 15 Ca -0.32 -0.66 -0.56 0.00 0.71 0.00 0.00 56.30 55.47 2khb h ASN 15 Cb 1.18 -0.02 -0.03 0.00 0.73 0.00 0.00 38.32 40.18 2khb h ASN 15 CO 0.49 1.42 1.03 -0.89 -1.29 0.00 0.00 177.43 178.19 2khb s THR 16 N -2.35 3.88 0.22 -3.57 2.01 -1.26 -4.96 115.64 109.61 2khb s THR 16 Ca -0.26 1.04 -0.32 0.00 0.31 0.00 0.00 61.69 62.47 2khb s THR 16 Cb 0.04 -3.75 -0.12 0.00 0.01 0.00 0.00 72.50 68.68 2khb s THR 16 CO 0.64 -0.17 1.67 -0.81 -0.69 0.00 0.00 174.62 175.25 2khb n PRO 17 N 7.10 2.68 0.00 4.92 -0.04 -1.26 -1.59 135.00 146.81 2khb n PRO 17 Ca 0.16 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.58 2khb n PRO 17 Cb 0.44 -2.78 0.00 0.00 -0.04 0.00 0.00 33.50 31.12 2khb n PRO 17 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2khb n GLY 18 N 3.43 1.33 3.66 0.55 0.00 -1.26 -5.05 105.19 107.86 2khb n GLY 18 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 2.03 4.75 -0.13 0.00 2.01 0.19 -4.77 115.64 119.72 2khb s THR 20 Ca 0.31 1.13 -0.29 0.00 0.31 0.00 0.00 61.69 63.15 2khb s THR 20 Cb -0.16 -3.86 -0.03 0.00 0.01 0.00 0.00 72.50 68.47 2khb s THR 20 CO 0.11 0.46 1.33 0.00 -0.69 0.00 0.00 174.62 175.82 2khb n SER 22 N 6.46 2.51 -2.13 0.00 2.88 0.12 -4.93 113.62 118.53 2khb n SER 22 Ca 0.14 -3.25 -0.28 0.00 -1.33 0.00 0.00 58.87 54.15 2khb n SER 22 Cb 0.45 -0.62 -0.04 0.00 -0.75 0.00 0.00 64.21 63.25 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 0.53 0.37 -0.97 0.66 -0.00 -1.26 -1.06 117.44 115.71 2khb n TRP 23 Ca 0.27 0.50 -0.23 0.00 -0.00 0.00 0.00 57.50 58.04 2khb n TRP 23 Cb 0.49 -0.99 0.12 0.00 -0.00 0.00 0.00 31.31 30.93 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 0.86 2.17 -3.88 5.87 -0.04 -1.26 -5.07 135.00 133.66 2khb n PRO 24 Ca 0.10 -2.59 -0.12 0.00 -0.04 0.00 0.00 63.50 60.86 2khb n PRO 24 Cb 0.03 -2.01 -0.13 0.00 -0.04 0.00 0.00 33.50 31.34 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 -3.20 0.02 0.12 0.52 -7.23 -0.22 -1.18 120.40 109.23 2khb s VAL 25 Ca 0.50 -0.15 -0.27 0.00 -1.81 0.00 0.00 61.98 60.24 2khb s VAL 25 Cb 0.41 -0.10 -0.07 0.00 0.56 0.00 0.00 36.38 37.18 2khb s VAL 25 CO 0.06 -0.08 0.86 0.00 -0.31 0.00 0.00 175.10 175.62 2khb s THR 27 N -0.40 0.03 -1.36 0.00 -1.32 0.42 -3.84 115.64 109.18 2khb s THR 27 Ca 0.41 -1.27 -0.15 0.00 -1.21 0.00 0.00 61.69 59.47 2khb s THR 27 Cb -0.23 -1.93 0.08 0.00 -1.51 0.00 0.00 72.50 68.91 2khb s THR 27 CO 0.27 -0.14 1.93 0.54 -2.21 0.00 0.00 174.62 175.02 2khb n ARG 28 N -0.31 3.12 0.00 7.08 5.12 -1.26 0.53 116.66 130.94 2khb n ARG 28 Ca -0.06 -3.08 0.13 0.00 -1.93 0.00 0.00 57.85 52.91 2khb n ARG 28 Cb 0.62 -3.30 0.76 0.00 -1.16 0.00 0.00 32.46 29.39 2khb n ARG 28 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99