#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2khb h LEU 2 N 0.00 0.44 -5.37 0.99 8.10 -2.07 -3.35 115.31 114.05 2khb h LEU 2 Ca 0.00 -0.17 -0.54 0.00 0.11 0.00 0.00 57.88 57.28 2khb h LEU 2 Cb 0.00 -0.12 0.02 0.00 -0.44 0.00 0.00 40.66 40.12 2khb h LEU 2 CO 0.00 0.76 3.14 -0.81 -4.11 0.00 0.00 178.44 177.42 2khb n PRO 3 N -4.07 2.76 -0.05 0.17 -0.04 -1.26 -4.55 135.00 127.96 2khb n PRO 3 Ca -0.01 -1.86 -0.12 0.00 -0.04 0.00 0.00 63.50 61.46 2khb n PRO 3 Cb 0.46 -2.68 -0.07 0.00 -0.04 0.00 0.00 33.50 31.17 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 3.37 1.31 -1.67 0.52 2.07 -1.99 -3.41 116.25 116.45 2khb h VAL 4 Ca 0.65 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2khb h VAL 4 Cb 0.28 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.79 2khb h VAL 4 CO 1.65 0.30 0.00 0.00 0.02 0.00 0.00 177.57 179.55 2khb n GLY 6 N 0.00 0.35 3.76 0.00 0.00 -1.08 -4.99 105.19 103.24 2khb n GLY 6 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 3.45 0.05 1.61 1.03 -1.26 -4.55 118.70 119.03 2khb s GLU 7 Ca 0.00 2.18 -0.31 0.00 0.03 0.00 0.00 54.97 56.87 2khb s GLU 7 Cb 0.00 -2.42 -0.07 0.00 -0.80 0.00 0.00 34.13 30.84 2khb s GLU 7 CO 0.00 -0.92 1.44 0.95 -1.33 0.00 0.00 175.26 175.40 2khb s THR 8 N -1.32 3.46 -0.27 1.83 -4.23 -1.26 -0.31 115.64 113.54 2khb s THR 8 Ca 0.66 0.94 -0.04 0.00 -1.18 0.00 0.00 61.69 62.07 2khb s THR 8 Cb -0.39 -3.60 -0.00 0.00 1.34 0.00 0.00 72.50 69.85 2khb s THR 8 CO 0.47 0.02 2.79 0.00 -0.54 0.00 0.00 174.62 177.37 2khb n VAL 10 N 1.27 2.81 0.00 0.00 0.31 -1.26 -2.35 118.33 119.11 2khb n VAL 10 Ca 0.39 -2.42 0.00 0.00 -0.01 0.00 0.00 64.34 62.31 2khb n VAL 10 Cb 0.65 -2.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.09 2khb n VAL 10 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2khb n GLY 11 N 4.25 0.02 0.55 2.92 0.00 -1.26 -4.97 105.19 106.71 2khb n GLY 11 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 0.00 0.84 3.30 -0.02 0.00 -0.99 -5.10 105.19 103.21 2khb n GLY 12 Ca 0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.24 0.06 -0.02 2.61 -1.32 -1.26 -5.06 115.64 108.41 2khb s THR 13 Ca 0.00 -0.52 0.03 0.00 -1.21 0.00 0.00 61.69 59.99 2khb s THR 13 Cb 0.00 -0.93 -0.00 0.00 -1.51 0.00 0.00 72.50 70.06 2khb s THR 13 CO 0.00 -0.28 -0.11 0.00 -2.21 0.00 0.00 174.62 172.02 2khb h ASN 15 N 6.21 -0.51 -3.33 0.00 -1.24 -1.95 -3.42 115.58 111.34 2khb h ASN 15 Ca -0.33 -0.10 -0.58 0.00 0.71 0.00 0.00 56.30 56.01 2khb h ASN 15 Cb 1.17 0.13 -0.07 0.00 0.73 0.00 0.00 38.32 40.28 2khb h ASN 15 CO 0.49 -0.14 0.80 -0.89 -1.29 0.00 0.00 177.43 176.40 2khb s THR 16 N -4.64 4.53 0.14 -3.57 2.01 -1.26 -4.99 115.64 107.86 2khb s THR 16 Ca -0.14 1.66 -0.31 0.00 0.31 0.00 0.00 61.69 63.21 2khb s THR 16 Cb 0.02 -4.39 -0.11 0.00 0.01 0.00 0.00 72.50 68.03 2khb s THR 16 CO 0.49 -0.47 1.81 -2.84 -0.69 0.00 0.00 174.62 172.92 2khb s PRO 17 N 3.60 4.14 0.00 4.92 0.02 -1.26 -1.95 135.00 144.46 2khb s PRO 17 Ca 0.44 2.60 0.00 0.00 0.02 0.00 0.00 61.00 64.06 2khb s PRO 17 Cb -0.12 -3.52 0.00 0.00 0.02 0.00 0.00 34.50 30.88 2khb s PRO 17 CO 0.16 -0.83 0.00 0.41 -0.33 0.00 0.00 177.00 176.41 2khb n GLY 18 N 4.20 1.84 3.75 0.52 0.00 -1.26 -4.94 105.19 109.30 2khb n GLY 18 Ca 0.17 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 0.02 4.79 -0.65 0.00 2.01 0.74 -4.80 115.64 117.75 2khb s THR 20 Ca 0.32 0.88 -0.28 0.00 0.31 0.00 0.00 61.69 62.92 2khb s THR 20 Cb -0.18 -3.73 0.03 0.00 0.01 0.00 0.00 72.50 68.63 2khb s THR 20 CO 0.17 0.13 1.23 0.00 -0.69 0.00 0.00 174.62 175.46 2khb n SER 22 N 8.85 6.74 -1.91 0.00 7.64 0.25 -4.96 113.62 130.23 2khb n SER 22 Ca 0.06 -3.67 -0.25 0.00 1.01 0.00 0.00 58.87 56.02 2khb n SER 22 Cb 0.49 -1.06 -0.03 0.00 -1.01 0.00 0.00 64.21 62.59 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 0.02 0.26 -0.72 1.43 -0.00 -1.26 -1.35 117.44 115.82 2khb n TRP 23 Ca 0.42 0.45 -0.19 0.00 -0.00 0.00 0.00 57.50 58.18 2khb n TRP 23 Cb 0.29 -0.89 0.10 0.00 -0.00 0.00 0.00 31.31 30.82 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 0.63 1.97 -3.94 5.87 -0.04 -1.26 -5.07 135.00 133.17 2khb n PRO 24 Ca 0.08 -2.16 -0.13 0.00 -0.04 0.00 0.00 63.50 61.25 2khb n PRO 24 Cb 0.04 -1.85 -0.14 0.00 -0.04 0.00 0.00 33.50 31.50 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 -2.63 0.11 0.11 0.52 -7.23 -0.46 -0.64 120.40 110.18 2khb s VAL 25 Ca 0.41 -0.03 -0.28 0.00 -1.81 0.00 0.00 61.98 60.27 2khb s VAL 25 Cb 0.34 -0.11 -0.06 0.00 0.56 0.00 0.00 36.38 37.11 2khb s VAL 25 CO 0.05 0.04 0.88 0.00 -0.31 0.00 0.00 175.10 175.76 2khb s THR 27 N -0.29 0.05 -0.03 0.00 2.01 -0.13 -2.62 115.64 114.63 2khb s THR 27 Ca 0.42 -0.41 -0.03 0.00 0.31 0.00 0.00 61.69 61.98 2khb s THR 27 Cb -0.23 -0.66 -0.12 0.00 0.01 0.00 0.00 72.50 71.51 2khb s THR 27 CO 0.28 -0.23 2.82 -2.11 -0.69 0.00 0.00 174.62 174.69 2khb n ARG 28 N 1.26 1.58 0.00 4.92 1.85 -1.26 -0.18 116.66 124.82 2khb n ARG 28 Ca -0.21 -0.65 0.12 0.00 -1.00 0.00 0.00 57.85 56.11 2khb n ARG 28 Cb 0.56 -1.56 0.15 0.00 -1.05 0.00 0.00 32.46 30.56 2khb n ARG 28 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89