#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 -0.96 0.25 0.99 2.96 -1.26 -5.15 118.68 115.51 2khb s LEU 2 Ca 0.00 1.48 -0.30 0.00 -0.22 0.00 0.00 54.13 55.09 2khb s LEU 2 Cb 0.00 2.32 -0.10 0.00 0.50 0.00 0.00 46.19 48.92 2khb s LEU 2 CO 0.00 -0.23 1.36 -2.84 -1.32 0.00 0.00 176.35 173.33 2khb s PRO 3 N 1.90 4.33 0.12 0.98 0.02 -1.26 -4.94 135.00 136.15 2khb s PRO 3 Ca -0.09 2.19 -0.15 0.00 0.02 0.00 0.00 61.00 62.97 2khb s PRO 3 Cb -0.06 -3.13 -0.03 0.00 0.02 0.00 0.00 34.50 31.29 2khb s PRO 3 CO -0.19 -0.31 1.57 -0.24 -0.33 0.00 0.00 177.00 177.50 2khb h VAL 4 N 3.52 1.25 -2.89 3.83 3.04 -2.01 -3.43 116.25 119.56 2khb h VAL 4 Ca -0.46 -0.95 -0.50 0.00 -1.01 0.00 0.00 66.70 63.78 2khb h VAL 4 Cb 1.22 1.14 -0.00 0.00 -2.01 0.00 0.00 31.29 31.64 2khb h VAL 4 CO 0.75 0.32 -0.23 0.00 -1.01 0.00 0.00 177.57 177.40 2khb n GLY 6 N -1.22 0.11 3.80 0.00 0.00 -1.26 -4.87 105.19 101.75 2khb n GLY 6 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 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 4.38 -0.03 1.61 1.03 -1.26 -4.86 118.70 119.56 2khb s GLU 7 Ca 0.00 1.06 -0.30 0.00 0.03 0.00 0.00 54.97 55.76 2khb s GLU 7 Cb 0.00 -2.80 -0.04 0.00 -0.80 0.00 0.00 34.13 30.49 2khb s GLU 7 CO 0.00 0.32 1.19 0.95 -1.33 0.00 0.00 175.26 176.39 2khb s THR 8 N -1.60 4.25 -0.41 1.83 -4.23 -1.26 -0.44 115.64 113.77 2khb s THR 8 Ca 0.47 1.58 -0.00 0.00 -1.18 0.00 0.00 61.69 62.56 2khb s THR 8 Cb -0.17 -4.02 0.35 0.00 1.34 0.00 0.00 72.50 70.00 2khb s THR 8 CO 0.22 0.03 1.92 0.00 -0.54 0.00 0.00 174.62 176.24 2khb h VAL 10 N 0.91 1.24 -0.37 0.00 2.07 -1.84 -1.67 116.25 116.58 2khb h VAL 10 Ca 0.42 -0.52 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 2khb h VAL 10 Cb 1.26 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 2khb h VAL 10 CO 0.99 0.25 0.11 0.61 0.02 0.00 0.00 177.57 179.55 2khb n GLY 11 N -1.21 2.61 3.56 2.17 0.00 -1.26 -4.88 105.19 106.17 2khb n GLY 11 Ca 0.09 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 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 0.11 -0.44 3.27 -0.02 0.00 -0.63 -5.01 105.19 102.47 2khb n GLY 12 Ca 0.20 0.17 -0.13 0.00 0.00 0.00 0.00 46.02 46.26 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 -3.37 0.06 0.04 2.61 -1.32 -1.26 -5.11 115.64 107.29 2khb s THR 13 Ca 0.29 -0.50 0.08 0.00 -1.21 0.00 0.00 61.69 60.36 2khb s THR 13 Cb -0.13 -0.78 -0.03 0.00 -1.51 0.00 0.00 72.50 70.05 2khb s THR 13 CO 0.75 -0.27 -0.22 0.00 -2.21 0.00 0.00 174.62 172.66 2khb n ASN 15 N 1.70 1.93 -4.62 0.00 5.15 -1.26 -4.87 115.26 113.28 2khb n ASN 15 Ca -0.17 0.34 -0.43 0.00 -0.60 0.00 0.00 54.58 53.72 2khb n ASN 15 Cb 0.52 -0.87 -0.02 0.00 -0.53 0.00 0.00 39.78 38.88 2khb n ASN 15 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2khb s THR 16 N -2.44 4.47 0.32 -0.44 2.01 -1.26 -5.00 115.64 113.29 2khb s THR 16 Ca -0.32 1.50 -0.29 0.00 0.31 0.00 0.00 61.69 62.89 2khb s THR 16 Cb 0.10 -4.43 -0.12 0.00 0.01 0.00 0.00 72.50 68.05 2khb s THR 16 CO 0.57 -0.59 1.41 -0.81 -0.69 0.00 0.00 174.62 174.50 2khb n PRO 17 N 7.03 2.31 0.00 4.92 -0.04 -1.26 -1.75 135.00 146.21 2khb n PRO 17 Ca 0.11 0.82 0.00 0.00 -0.04 0.00 0.00 63.50 64.38 2khb n PRO 17 Cb 0.48 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 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 1.28 3.25 3.74 0.55 0.00 -1.26 -5.03 105.19 107.73 2khb n GLY 18 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 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 0.33 4.96 -0.01 0.00 -1.32 0.89 -4.74 115.64 115.76 2khb s THR 20 Ca 0.28 0.06 -0.30 0.00 -1.21 0.00 0.00 61.69 60.52 2khb s THR 20 Cb -0.16 -3.82 -0.03 0.00 -1.51 0.00 0.00 72.50 66.98 2khb s THR 20 CO 0.13 -0.63 1.01 0.00 -2.21 0.00 0.00 174.62 172.92 2khb n SER 22 N 4.11 1.30 -1.88 0.00 7.64 0.07 -4.91 113.62 119.94 2khb n SER 22 Ca 0.07 -2.97 -0.25 0.00 1.01 0.00 0.00 58.87 56.73 2khb n SER 22 Cb 0.50 -0.64 -0.03 0.00 -1.01 0.00 0.00 64.21 63.03 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 0.95 0.32 -0.81 1.43 -0.00 -1.26 -1.27 117.44 116.79 2khb n TRP 23 Ca 0.24 0.45 -0.20 0.00 -0.00 0.00 0.00 57.50 57.99 2khb n TRP 23 Cb 0.52 -0.88 0.13 0.00 -0.00 0.00 0.00 31.31 31.09 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 0.73 2.04 -3.83 5.87 -0.04 -1.26 -5.06 135.00 133.45 2khb n PRO 24 Ca 0.09 -2.39 -0.12 0.00 -0.04 0.00 0.00 63.50 61.04 2khb n PRO 24 Cb 0.03 -1.94 -0.12 0.00 -0.04 0.00 0.00 33.50 31.43 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 -2.78 0.01 0.24 0.52 -7.23 -0.40 -0.56 120.40 110.20 2khb s VAL 25 Ca 0.46 -0.09 -0.24 0.00 -1.81 0.00 0.00 61.98 60.29 2khb s VAL 25 Cb 0.38 -0.25 -0.09 0.00 0.56 0.00 0.00 36.38 36.99 2khb s VAL 25 CO 0.07 -0.05 0.83 0.00 -0.31 0.00 0.00 175.10 175.63 2khb s THR 27 N -1.42 0.00 -0.31 0.00 -1.32 0.58 -4.00 115.64 109.16 2khb s THR 27 Ca 0.43 -1.49 -0.16 0.00 -1.21 0.00 0.00 61.69 59.26 2khb s THR 27 Cb -0.20 -2.32 -0.02 0.00 -1.51 0.00 0.00 72.50 68.45 2khb s THR 27 CO 0.24 0.00 0.41 -0.60 -2.21 0.00 0.00 174.62 172.46 2khb s ARG 28 N -3.86 3.77 0.00 7.08 6.06 -1.26 -0.08 118.95 130.67 2khb s ARG 28 Ca 0.25 -0.15 0.22 0.00 -2.50 0.00 0.00 55.73 53.56 2khb s ARG 28 Cb 0.00 -3.74 1.33 0.00 0.06 0.00 0.00 34.95 32.60 2khb s ARG 28 CO 0.11 -0.45 1.70 -1.71 -2.50 0.00 0.00 175.30 172.45