#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hki s HIS 1 N 0.00 -0.11 0.01 -5.13 3.76 -1.26 -5.09 115.29 107.47 3hki s HIS 1 Ca 0.00 0.00 -0.00 0.00 -0.15 0.00 0.00 55.06 54.91 3hki s HIS 1 Cb 0.00 -0.49 0.00 0.00 1.11 0.00 0.00 32.58 33.20 3hki s HIS 1 CO 0.00 -0.59 0.00 0.25 -0.85 0.00 0.00 174.74 173.56 3hki n THR 1 N 5.30 0.00 0.00 1.30 -2.24 -1.26 -5.08 114.28 112.31 3hki n THR 1 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3hki n THR 1 Cb 0.49 -0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 3hki n THR 1 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3hki n PHE 1 N -2.13 0.00 -3.28 4.78 3.01 -1.26 -5.13 117.46 113.44 3hki n PHE 1 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.05 3hki n PHE 1 Cb 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.39 3hki n PHE 1 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 3hki s ASN 1 N 0.00 6.29 0.48 4.37 3.84 -1.26 -4.96 114.94 123.70 3hki s ASN 1 Ca 0.00 -0.03 0.33 0.00 0.21 0.00 0.00 52.86 53.37 3hki s ASN 1 Cb 0.00 -2.25 1.46 0.00 -0.55 0.00 0.00 41.25 39.91 3hki s ASN 1 CO 0.00 -0.43 1.69 -0.33 -2.79 0.00 0.00 177.10 175.24 3hki h GLU 1 N 8.43 0.10 -0.01 0.43 5.08 -1.95 0.23 114.58 126.89 3hki h GLU 1 Ca -0.28 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 3hki h GLU 1 Cb 1.13 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3hki h GLU 1 CO 0.75 0.07 -0.00 0.36 -1.00 0.00 0.00 179.01 179.18 3hki n LYS 1 N -4.40 1.30 0.00 2.33 2.85 -1.26 -0.30 118.16 118.68 3hki n LYS 1 Ca 0.33 -0.45 0.00 0.00 -1.05 0.00 0.00 58.31 57.14 3hki n LYS 1 Cb 1.38 -1.49 0.00 0.00 -0.65 0.00 0.00 35.03 34.27 3hki n LYS 1 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 3hki n THR 1 N -0.46 0.00 0.28 0.58 -2.24 -0.08 -4.71 114.28 107.65 3hki n THR 1 Ca 0.22 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 62.08 3hki n THR 1 Cb 0.23 0.17 -0.13 0.00 -2.10 0.00 0.00 70.33 68.50 3hki n THR 1 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3hki n PHE 1 N -1.59 0.00 -3.14 4.78 -0.00 -0.31 -5.05 117.46 112.15 3hki n PHE 1 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 3hki n PHE 1 Cb 0.11 -0.27 0.00 0.00 -0.00 0.00 0.00 39.48 39.32 3hki n PHE 1 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3hki n GLY 1 N 1.45 -2.12 3.94 7.13 0.00 0.58 -4.94 105.19 111.24 3hki n GLY 1 Ca -0.01 -1.51 -0.25 0.00 0.00 0.00 0.00 46.02 44.25 3hki n GLY 1 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hki s LEU 1 N 0.00 2.93 0.00 0.99 1.43 -1.26 -4.53 118.68 118.23 3hki s LEU 1 Ca 0.00 0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.40 3hki s LEU 1 Cb 0.00 -2.97 0.00 0.00 0.03 0.00 0.00 46.19 43.25 3hki s LEU 1 CO 0.00 -1.54 0.00 0.61 0.23 0.00 0.00 176.35 175.65 3hki n GLY 1 N -2.81 3.11 0.41 -3.19 0.00 -1.26 -5.00 105.19 96.46 3hki n GLY 1 Ca 0.09 -1.06 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 3hki n GLY 1 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hki h GLU 1 N 0.00 -0.22 -1.06 1.61 4.81 -1.94 -1.34 114.58 116.44 3hki h GLU 1 Ca 0.00 0.02 0.29 0.00 -0.13 0.00 0.00 59.36 59.54 3hki h GLU 1 Cb 0.00 0.05 -0.12 0.00 0.63 0.00 0.00 28.75 29.31 3hki h GLU 1 CO 0.00 -0.15 0.65 0.00 -0.73 0.00 0.00 179.01 178.78 3hki h ALA 1 N 0.49 2.11 -0.45 2.92 0.00 -1.97 0.18 119.26 122.54 3hki h ALA 1 Ca 0.16 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3hki h ALA 1 Cb 0.56 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3hki h ALA 1 CO -0.71 -0.60 0.00 -3.47 0.00 0.00 0.00 179.25 174.47 3hki n ASP 1 N -4.80 3.84 -4.70 0.00 2.03 -0.86 -4.78 116.55 107.30 3hki n ASP 1 Ca 0.29 -2.41 -0.40 0.00 0.52 0.00 0.00 54.79 52.79 3hki n ASP 1 Cb 0.93 -0.44 0.03 0.00 -0.72 0.00 0.00 41.12 40.92 3hki n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hki n GLY 2 N 0.88 1.16 3.28 0.00 0.00 -1.26 -5.03 105.19 104.21 3hki n GLY 2 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 3hki n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hki s LEU 3 N 0.00 3.52 -0.00 0.99 1.43 -1.23 -5.07 118.68 118.32 3hki s LEU 3 Ca 0.00 -0.78 -0.30 0.00 -1.03 0.00 0.00 54.13 52.02 3hki s LEU 3 Cb 0.00 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 3hki s LEU 3 CO 0.00 -0.16 1.19 -0.13 0.23 0.00 0.00 176.35 177.48 3hki s ARG 4 N 1.42 4.40 0.24 1.70 0.52 -1.26 -4.84 118.95 121.13 3hki s ARG 4 Ca 0.01 1.70 -0.06 0.00 -0.52 0.00 0.00 55.73 56.87 3hki s ARG 4 Cb -0.17 -3.46 0.34 0.00 0.52 0.00 0.00 34.95 32.18 3hki s ARG 4 CO -0.01 -0.34 1.83 -1.35 0.02 0.00 0.00 175.30 175.45 3hki h PRO 5 N 7.15 0.86 -0.13 3.54 0.11 -1.97 -1.92 132.00 139.64 3hki h PRO 5 Ca -0.38 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3hki h PRO 5 Cb 1.19 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3hki h PRO 5 CO 0.84 0.57 0.00 1.28 -0.21 0.00 0.00 178.00 180.48 3hki n LEU 6 N -4.67 2.18 0.00 2.35 4.77 -1.26 -3.90 117.00 116.46 3hki n LEU 6 Ca 0.12 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 3hki n LEU 6 Cb 0.20 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3hki n LEU 6 CO 0.30 0.42 0.00 0.49 -1.33 0.00 0.00 177.39 177.26 3hki n PHE 7 N 0.68 0.00 0.00 -1.77 3.72 -1.07 -4.73 117.46 114.29 3hki n PHE 7 Ca 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.57 3hki n PHE 7 Cb 0.44 0.06 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 3hki n PHE 7 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3hki n GLU 8 N -1.48 0.00 0.31 -1.08 4.71 -0.83 0.61 120.64 122.87 3hki n GLU 8 Ca 0.00 0.57 0.02 0.00 -0.01 0.00 0.00 57.16 57.74 3hki n GLU 8 Cb 0.00 -1.48 0.13 0.00 -1.01 0.00 0.00 31.44 29.08 3hki n GLU 8 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 3hki h LYS 9 N 0.00 0.00 -0.34 3.49 1.57 -1.58 1.34 116.57 121.05 3hki h LYS 9 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hki h LYS 9 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3hki h LYS 9 CO 0.00 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.51 3hki n LYS 10 N -2.45 2.88 -3.84 3.15 5.02 -1.06 -4.97 118.16 116.89 3hki n LYS 10 Ca -0.00 -2.07 -0.25 0.00 -2.02 0.00 0.00 58.31 53.97 3hki n LYS 10 Cb 0.86 -1.28 0.01 0.00 -0.02 0.00 0.00 35.03 34.60 3hki n LYS 10 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3hki n SER 11 N 0.48 -1.44 -4.42 4.39 7.64 0.46 -4.97 113.62 115.75 3hki n SER 11 Ca 0.12 -0.89 -0.22 0.00 1.01 0.00 0.00 58.87 58.89 3hki n SER 11 Cb 0.44 -3.62 -0.10 0.00 -1.01 0.00 0.00 64.21 59.91 3hki n SER 11 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3hki s LEU 12 N -6.89 2.57 0.01 -3.43 1.02 0.20 -5.02 118.68 107.14 3hki s LEU 12 Ca 0.13 -1.02 0.06 0.00 0.02 0.00 0.00 54.13 53.32 3hki s LEU 12 Cb -0.06 -0.95 -0.02 0.00 0.02 0.00 0.00 46.19 45.18 3hki s LEU 12 CO 0.85 -0.03 -0.18 -0.54 0.02 0.00 0.00 176.35 176.47 3hki s LYS 13 N -3.52 1.33 0.00 1.70 -0.14 -1.26 -3.95 119.74 113.90 3hki s LYS 13 Ca 0.27 -0.71 0.00 0.00 -1.36 0.00 0.00 55.97 54.17 3hki s LYS 13 Cb -0.04 -1.33 0.00 0.00 -1.68 0.00 0.00 37.83 34.79 3hki s LYS 13 CO 0.12 0.35 0.00 -0.40 -0.76 0.00 0.00 175.35 174.66 3hki n ASP 14 N 2.36 0.00 0.00 2.83 5.68 -1.26 -5.04 116.55 121.12 3hki n ASP 14 Ca -0.16 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.13 3hki n ASP 14 Cb 0.54 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 3hki n ASP 14 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3hki n THR 14 N 0.00 0.00 0.32 2.12 -2.24 -1.26 -4.65 114.28 108.57 3hki n THR 14 Ca 0.00 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.94 3hki n THR 14 Cb 0.00 0.00 0.67 0.00 -2.10 0.00 0.00 70.33 68.90 3hki n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3hki h GLU 14 N 0.00 0.00 -0.58 -0.78 4.11 -2.04 -2.33 114.58 112.97 3hki h GLU 14 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 3hki h GLU 14 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 3hki h GLU 14 CO 0.00 0.00 0.26 -0.22 0.07 0.00 0.00 179.01 179.12 3hki h LYS 14 N 0.00 0.85 0.00 1.06 1.63 -2.02 0.13 116.57 118.22 3hki h LYS 14 Ca 0.00 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 3hki h LYS 14 Cb 0.40 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.88 3hki h LYS 14 CO 0.00 0.71 0.00 -1.91 -3.45 0.00 0.00 179.45 174.80 3hki n GLU 14 N -4.51 0.00 0.00 1.90 2.13 -0.88 0.50 120.64 119.78 3hki n GLU 14 Ca 0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.85 3hki n GLU 14 Cb 0.14 -0.87 0.00 0.00 0.27 0.00 0.00 31.44 30.98 3hki n GLU 14 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 3hki n LEU 14 N 0.29 0.00 -0.34 4.31 7.94 0.47 -2.49 117.00 127.18 3hki n LEU 14 Ca 0.00 0.00 0.23 0.00 -1.11 0.00 0.00 56.01 55.13 3hki n LEU 14 Cb 0.00 0.00 0.46 0.00 0.53 0.00 0.00 43.42 44.41 3hki n LEU 14 CO 0.00 0.00 1.14 0.44 -1.11 0.00 0.00 177.39 177.86 3hki h ASP 14 N 0.00 0.54 1.15 1.96 3.45 -0.19 0.44 116.42 123.77 3hki h ASP 14 Ca 0.00 0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.62 3hki h ASP 14 Cb 0.00 0.10 0.00 0.00 -0.56 0.00 0.00 39.33 38.87 3hki h ASP 14 CO 0.00 -0.05 0.00 0.77 -1.57 0.00 0.00 179.24 178.39 3hki h SER 14 N 0.39 0.00 0.00 6.45 4.64 -1.72 -3.54 113.55 119.77 3hki h SER 14 Ca 0.70 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.02 3hki h SER 14 Cb 1.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 3hki h SER 14 CO -0.53 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.21