#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 3.95 -0.04 0.99 2.01 -1.26 -4.93 118.68 119.40 2khb s LEU 2 Ca 0.00 2.67 -0.30 0.00 0.01 0.00 0.00 54.13 56.51 2khb s LEU 2 Cb 0.00 -4.19 -0.05 0.00 0.01 0.00 0.00 46.19 41.95 2khb s LEU 2 CO 0.00 -1.31 1.56 -2.16 1.01 0.00 0.00 176.35 175.46 2khb s PRO 3 N -2.74 4.21 0.13 1.29 0.04 -1.26 -4.90 135.00 131.76 2khb s PRO 3 Ca 0.67 2.10 -0.11 0.00 0.04 0.00 0.00 61.00 63.71 2khb s PRO 3 Cb -0.38 -3.85 -0.08 0.00 0.04 0.00 0.00 34.50 30.24 2khb s PRO 3 CO 0.46 -0.77 1.39 0.28 0.04 0.00 0.00 177.00 178.40 2khb h VAL 4 N 5.37 1.28 -4.04 -0.36 2.07 -1.97 -3.45 116.25 115.14 2khb h VAL 4 Ca -0.38 -1.81 -0.18 0.00 0.82 0.00 0.00 66.70 65.15 2khb h VAL 4 Cb 1.17 1.75 -0.17 0.00 -1.52 0.00 0.00 31.29 32.52 2khb h VAL 4 CO 0.94 0.58 -0.70 0.00 0.02 0.00 0.00 177.57 178.42 2khb n GLY 6 N 0.59 2.94 3.67 0.00 0.00 -1.26 -4.99 105.19 106.14 2khb n GLY 6 Ca -0.17 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 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 -3.48 2.81 -0.15 1.61 -1.05 -1.26 -5.05 118.70 112.13 2khb s GLU 7 Ca 0.34 -0.58 -0.20 0.00 -0.15 0.00 0.00 54.97 54.38 2khb s GLU 7 Cb 0.35 -2.68 -0.03 0.00 -0.44 0.00 0.00 34.13 31.32 2khb s GLU 7 CO -0.03 0.64 0.58 0.95 0.95 0.00 0.00 175.26 178.35 2khb s THR 8 N -1.03 5.09 -0.15 1.83 -4.23 -1.26 -1.38 115.64 114.50 2khb s THR 8 Ca 0.18 1.14 -0.03 0.00 -1.18 0.00 0.00 61.69 61.80 2khb s THR 8 Cb -0.11 -3.91 -0.03 0.00 1.34 0.00 0.00 72.50 69.78 2khb s THR 8 CO 0.08 0.21 2.69 0.00 -0.54 0.00 0.00 174.62 177.06 2khb h VAL 10 N 1.52 1.26 -0.33 0.00 2.07 -1.83 -2.25 116.25 116.69 2khb h VAL 10 Ca 0.20 -0.86 -0.06 0.00 0.82 0.00 0.00 66.70 66.79 2khb h VAL 10 Cb 1.10 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 2khb h VAL 10 CO 0.40 0.35 0.08 0.61 0.02 0.00 0.00 177.57 179.02 2khb n GLY 11 N -0.83 2.46 3.62 2.17 0.00 -1.26 -4.88 105.19 106.47 2khb n GLY 11 Ca 0.07 -0.47 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 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 0.16 -0.54 3.30 -0.02 0.00 -0.85 -4.99 105.19 102.25 2khb n GLY 12 Ca 0.17 0.25 -0.11 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.31 0.08 -0.02 2.61 -1.32 -1.26 -5.07 115.64 107.34 2khb s THR 13 Ca 0.59 -0.64 0.00 0.00 -1.21 0.00 0.00 61.69 60.43 2khb s THR 13 Cb -0.27 -1.12 0.03 0.00 -1.51 0.00 0.00 72.50 69.63 2khb s THR 13 CO 0.73 -0.35 0.02 0.00 -2.21 0.00 0.00 174.62 172.81 2khb h ASN 15 N 7.14 0.26 -2.83 0.00 -0.00 -1.98 -3.45 115.58 114.73 2khb h ASN 15 Ca -0.43 -0.88 -0.57 0.00 -0.00 0.00 0.00 56.30 54.42 2khb h ASN 15 Cb 1.13 -0.09 -0.03 0.00 -0.00 0.00 0.00 38.32 39.34 2khb h ASN 15 CO 0.48 1.37 1.13 -0.89 -0.00 0.00 0.00 177.43 179.53 2khb s THR 16 N -2.38 3.71 0.15 -3.57 2.01 -1.26 -4.95 115.64 109.36 2khb s THR 16 Ca -0.19 0.78 -0.31 0.00 0.31 0.00 0.00 61.69 62.28 2khb s THR 16 Cb 0.02 -3.78 -0.11 0.00 0.01 0.00 0.00 72.50 68.64 2khb s THR 16 CO 0.75 -0.37 1.74 -2.84 -0.69 0.00 0.00 174.62 173.21 2khb s PRO 17 N 4.82 4.15 0.00 4.92 0.02 -1.26 -1.91 135.00 145.74 2khb s PRO 17 Ca 0.71 2.55 0.00 0.00 0.02 0.00 0.00 61.00 64.27 2khb s PRO 17 Cb -0.23 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 30.94 2khb s PRO 17 CO 0.30 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.61 2khb n GLY 18 N 4.06 1.45 3.72 0.52 0.00 -1.26 -5.07 105.19 108.60 2khb n GLY 18 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 0.67 5.23 0.03 0.00 2.01 0.65 -4.84 115.64 119.40 2khb s THR 20 Ca 0.31 0.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.11 2khb s THR 20 Cb -0.16 -3.60 -0.06 0.00 0.01 0.00 0.00 72.50 68.69 2khb s THR 20 CO 0.14 0.23 1.30 0.00 -0.69 0.00 0.00 174.62 175.59 2khb n SER 22 N 4.65 1.08 -2.09 0.00 2.88 0.29 -4.84 113.62 115.59 2khb n SER 22 Ca 0.11 -2.97 -0.28 0.00 -1.33 0.00 0.00 58.87 54.40 2khb n SER 22 Cb 0.45 -0.63 -0.04 0.00 -0.75 0.00 0.00 64.21 63.24 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 0.72 0.37 -1.05 0.66 -0.00 -1.26 -1.16 117.44 115.71 2khb n TRP 23 Ca 0.24 0.49 -0.25 0.00 -0.00 0.00 0.00 57.50 57.99 2khb n TRP 23 Cb 0.57 -0.97 0.12 0.00 -0.00 0.00 0.00 31.31 31.03 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 0.85 2.24 -3.93 5.87 -0.04 -1.26 -5.07 135.00 133.66 2khb n PRO 24 Ca 0.10 -2.71 -0.10 0.00 -0.04 0.00 0.00 63.50 60.75 2khb n PRO 24 Cb 0.03 -2.06 -0.12 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 -3.42 0.07 -0.15 0.52 -7.23 -0.31 -1.49 120.40 108.39 2khb s VAL 25 Ca 0.52 -0.61 -0.28 0.00 -1.81 0.00 0.00 61.98 59.81 2khb s VAL 25 Cb 0.43 -0.22 -0.01 0.00 0.56 0.00 0.00 36.38 37.14 2khb s VAL 25 CO 0.05 -0.33 0.94 0.00 -0.31 0.00 0.00 175.10 175.44 2khb s THR 27 N 2.27 2.11 -0.11 0.00 -1.32 0.16 -4.76 115.64 113.99 2khb s THR 27 Ca 0.43 -1.06 -0.12 0.00 -1.21 0.00 0.00 61.69 59.73 2khb s THR 27 Cb -0.17 -2.17 -0.05 0.00 -1.51 0.00 0.00 72.50 68.61 2khb s THR 27 CO 0.13 0.00 0.28 0.00 -2.21 0.00 0.00 174.62 172.82 2khb s ARG 28 N -4.62 3.95 0.00 7.08 1.70 -1.26 -0.25 118.95 125.55 2khb s ARG 28 Ca 0.59 0.12 0.23 0.00 -0.47 0.00 0.00 55.73 56.19 2khb s ARG 28 Cb -0.05 -3.31 1.39 0.00 -0.57 0.00 0.00 34.95 32.41 2khb s ARG 28 CO 0.37 0.51 1.76 -1.71 -1.08 0.00 0.00 175.30 175.15