#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 -1.49 -4.67 0.99 4.32 -1.26 -4.84 117.00 110.05 2khb n LEU 2 Ca 0.00 1.47 -0.42 0.00 -0.02 0.00 0.00 56.01 57.04 2khb n LEU 2 Cb 0.00 -0.94 -0.03 0.00 -1.62 0.00 0.00 43.42 40.83 2khb n LEU 2 CO 0.00 0.13 1.37 -2.84 -1.22 0.00 0.00 177.39 174.82 2khb s PRO 3 N -4.88 4.19 0.39 3.23 0.02 -1.26 -4.89 135.00 131.81 2khb s PRO 3 Ca 0.00 2.25 0.10 0.00 0.02 0.00 0.00 61.00 63.37 2khb s PRO 3 Cb 0.00 -3.88 0.81 0.00 0.02 0.00 0.00 34.50 31.45 2khb s PRO 3 CO 0.00 -0.81 1.92 -0.39 -0.33 0.00 0.00 177.00 177.39 2khb h VAL 4 N 5.35 1.18 0.00 3.83 -1.51 -1.94 -3.40 116.25 119.76 2khb h VAL 4 Ca -0.41 -0.79 0.00 0.00 -1.23 0.00 0.00 66.70 64.27 2khb h VAL 4 Cb 1.19 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 2khb h VAL 4 CO 0.94 0.24 -0.12 0.00 -1.23 0.00 0.00 177.57 177.41 2khb n GLY 6 N 1.78 1.53 3.69 0.00 0.00 -1.26 -4.98 105.19 105.95 2khb n GLY 6 Ca 0.00 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 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 2.14 -3.48 1.61 1.02 -1.26 -4.83 120.64 115.84 2khb n GLU 7 Ca 0.00 0.76 -0.37 0.00 -0.02 0.00 0.00 57.16 57.52 2khb n GLU 7 Cb 0.00 -2.37 -0.07 0.00 -0.02 0.00 0.00 31.44 28.97 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 -0.71 5.26 -0.31 2.62 -4.23 -1.26 -0.57 115.64 116.45 2khb s THR 8 Ca 0.60 0.59 -0.01 0.00 -1.18 0.00 0.00 61.69 61.69 2khb s THR 8 Cb -0.59 -3.66 0.22 0.00 1.34 0.00 0.00 72.50 69.81 2khb s THR 8 CO 0.58 0.33 1.96 0.00 -0.54 0.00 0.00 174.62 176.95 2khb h VAL 10 N 0.95 1.19 -0.60 0.00 3.04 -1.82 -1.93 116.25 117.08 2khb h VAL 10 Ca 0.29 -0.67 -0.14 0.00 -1.01 0.00 0.00 66.70 65.17 2khb h VAL 10 Cb 1.00 0.75 -0.09 0.00 -2.01 0.00 0.00 31.29 30.95 2khb h VAL 10 CO 0.74 0.24 0.18 0.61 -1.01 0.00 0.00 177.57 178.33 2khb n GLY 11 N -1.01 3.20 3.48 3.17 0.00 -1.26 -4.90 105.19 107.86 2khb n GLY 11 Ca 0.03 -0.83 -0.22 0.00 0.00 0.00 0.00 46.02 45.00 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 0.07 -0.46 3.28 -0.02 0.00 -0.72 -5.00 105.19 102.34 2khb n GLY 12 Ca 0.32 0.20 -0.13 0.00 0.00 0.00 0.00 46.02 46.41 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 0.06 -0.01 2.61 -1.32 -1.26 -5.10 115.64 107.31 2khb s THR 13 Ca 0.50 -0.52 0.01 0.00 -1.21 0.00 0.00 61.69 60.47 2khb s THR 13 Cb -0.22 -0.85 0.01 0.00 -1.51 0.00 0.00 72.50 69.92 2khb s THR 13 CO 0.69 -0.28 -0.01 0.00 -2.21 0.00 0.00 174.62 172.81 2khb n ASN 15 N 3.34 1.95 -4.63 0.00 5.15 -1.26 -4.88 115.26 114.93 2khb n ASN 15 Ca -0.17 0.32 -0.43 0.00 -0.60 0.00 0.00 54.58 53.70 2khb n ASN 15 Cb 0.57 -0.87 -0.03 0.00 -0.53 0.00 0.00 39.78 38.92 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 -2.45 3.40 0.14 -0.44 2.01 -1.26 -4.93 115.64 112.12 2khb s THR 16 Ca -0.30 0.46 -0.31 0.00 0.31 0.00 0.00 61.69 61.85 2khb s THR 16 Cb 0.08 -3.40 -0.10 0.00 0.01 0.00 0.00 72.50 69.09 2khb s THR 16 CO 0.61 -0.16 1.73 -2.84 -0.69 0.00 0.00 174.62 173.27 2khb s PRO 17 N 4.91 4.16 0.00 4.92 0.02 -1.26 -1.65 135.00 146.10 2khb s PRO 17 Ca 0.81 2.51 0.00 0.00 0.02 0.00 0.00 61.00 64.34 2khb s PRO 17 Cb -0.31 -3.40 0.00 0.00 0.02 0.00 0.00 34.50 30.81 2khb s PRO 17 CO 0.33 -0.76 0.00 0.41 -0.33 0.00 0.00 177.00 176.65 2khb n GLY 18 N 4.05 2.58 3.67 0.52 0.00 -1.26 -5.06 105.19 109.69 2khb n GLY 18 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 1.84 4.96 0.05 0.00 2.01 0.15 -4.80 115.64 119.84 2khb s THR 20 Ca 0.32 0.60 -0.31 0.00 0.31 0.00 0.00 61.69 62.62 2khb s THR 20 Cb -0.16 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.61 2khb s THR 20 CO 0.12 0.19 1.20 0.00 -0.69 0.00 0.00 174.62 175.44 2khb n SER 22 N 4.03 0.10 -2.54 0.00 7.64 0.10 -4.88 113.62 118.07 2khb n SER 22 Ca 0.09 -2.77 -0.34 0.00 1.01 0.00 0.00 58.87 56.86 2khb n SER 22 Cb 0.46 -0.50 -0.05 0.00 -1.01 0.00 0.00 64.21 63.11 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 1.26 0.44 -1.09 1.43 -0.00 -1.26 -0.87 117.44 117.35 2khb n TRP 23 Ca 0.21 0.60 -0.25 0.00 -0.00 0.00 0.00 57.50 58.05 2khb n TRP 23 Cb 0.55 -1.18 0.12 0.00 -0.00 0.00 0.00 31.31 30.80 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 1.02 2.28 -3.92 5.87 -0.04 -1.26 -5.07 135.00 133.87 2khb n PRO 24 Ca 0.12 -2.79 -0.11 0.00 -0.04 0.00 0.00 63.50 60.69 2khb n PRO 24 Cb 0.03 -2.09 -0.12 0.00 -0.04 0.00 0.00 33.50 31.28 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 -3.51 0.06 -0.07 0.52 -7.23 -0.05 -1.60 120.40 108.53 2khb s VAL 25 Ca 0.54 -0.51 -0.26 0.00 -1.81 0.00 0.00 61.98 59.93 2khb s VAL 25 Cb 0.44 -0.20 -0.03 0.00 0.56 0.00 0.00 36.38 37.15 2khb s VAL 25 CO 0.05 -0.28 0.83 0.00 -0.31 0.00 0.00 175.10 175.39 2khb s THR 27 N 1.19 2.02 0.02 0.00 -1.32 0.93 -4.32 115.64 114.16 2khb s THR 27 Ca 0.43 -1.60 -0.19 0.00 -1.21 0.00 0.00 61.69 59.11 2khb s THR 27 Cb -0.19 -2.63 -0.06 0.00 -1.51 0.00 0.00 72.50 68.12 2khb s THR 27 CO 0.20 0.00 0.56 0.00 -2.21 0.00 0.00 174.62 173.17 2khb s ARG 28 N -4.06 4.23 0.00 7.08 1.70 -1.26 0.30 118.95 126.94 2khb s ARG 28 Ca 0.36 0.69 0.31 0.00 -0.47 0.00 0.00 55.73 56.62 2khb s ARG 28 Cb 0.01 -3.29 1.68 0.00 -0.57 0.00 0.00 34.95 32.77 2khb s ARG 28 CO 0.21 0.51 2.10 -1.71 -1.08 0.00 0.00 175.30 175.33