#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5o h LYS 2 N 0.00 -0.00 0.01 -3.48 1.63 -1.97 -3.16 116.57 109.59 1h5o h LYS 2 Ca 0.00 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.74 1h5o h LYS 2 Cb 0.00 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1h5o h LYS 2 CO 0.00 0.47 -0.24 0.37 -3.45 0.00 0.00 179.45 176.60 1h5o h GLN 3 N -1.00 0.15 -0.73 1.90 5.75 -1.92 -3.32 115.11 115.94 1h5o h GLN 3 Ca -0.00 -0.17 -0.06 0.00 -0.15 0.00 0.00 58.65 58.27 1h5o h GLN 3 Cb 0.48 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.05 1h5o h GLN 3 CO 0.00 0.95 0.23 0.00 -2.65 0.00 0.00 178.83 177.36 1h5o h HIS 5 N 1.09 0.00 -0.04 0.00 -0.00 -1.66 -1.21 115.15 113.33 1h5o h HIS 5 Ca 0.24 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.58 1h5o h HIS 5 Cb 0.31 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.72 1h5o h HIS 5 CO 0.03 0.33 -0.06 -0.22 -0.00 0.00 0.00 177.93 178.00 1h5o h LYS 6 N 0.00 0.11 0.00 5.26 3.64 -1.57 -3.36 116.57 120.66 1h5o h LYS 6 Ca -0.00 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1h5o h LYS 6 Cb 0.60 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1h5o h LYS 6 CO 0.04 0.63 -0.00 0.87 -2.27 0.00 0.00 179.45 178.72 1h5o h LYS 7 N -0.40 -0.01 0.00 1.90 1.57 -1.54 -3.49 116.57 114.61 1h5o h LYS 7 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h5o h LYS 7 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1h5o h LYS 7 CO 0.01 0.63 0.00 0.41 -0.57 0.00 0.00 179.45 179.94 1h5o n GLY 8 N 0.65 0.00 3.60 3.86 0.00 -0.90 -4.73 105.19 107.67 1h5o n GLY 8 Ca -0.09 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.66 1h5o n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h5o s GLY 9 N 0.00 -0.38 0.01 -0.02 0.00 -0.51 -2.92 107.32 103.50 1h5o s GLY 9 Ca 0.00 0.59 0.01 0.00 0.00 0.00 0.00 44.72 45.32 1h5o s GLY 9 CO 0.00 0.18 -0.04 0.30 0.00 0.00 0.00 173.10 173.54 1h5o s HIS 10 N -3.28 0.38 0.10 1.90 3.76 -1.23 -3.88 115.29 113.05 1h5o s HIS 10 Ca 0.07 -0.24 -0.30 0.00 -0.15 0.00 0.00 55.06 54.44 1h5o s HIS 10 Cb -0.01 -0.24 -0.06 0.00 1.11 0.00 0.00 32.58 33.38 1h5o s HIS 10 CO -0.05 -0.05 1.01 0.00 -0.85 0.00 0.00 174.74 174.80 1h5o s PHE 12 N 0.24 0.19 0.70 0.00 0.08 0.15 -4.94 117.98 114.40 1h5o s PHE 12 Ca 0.49 -0.36 -0.16 0.00 0.12 0.00 0.00 56.93 57.01 1h5o s PHE 12 Cb -0.24 -0.14 -0.03 0.00 -0.57 0.00 0.00 43.02 42.03 1h5o s PHE 12 CO 0.30 -0.13 0.67 -2.30 -0.10 0.00 0.00 175.22 173.67 1h5o n PRO 13 N 2.06 0.41 0.29 0.24 -0.02 -1.26 -1.22 135.00 135.50 1h5o n PRO 13 Ca -0.20 0.18 0.18 0.00 -2.02 0.00 0.00 63.50 61.64 1h5o n PRO 13 Cb 0.57 -1.94 0.98 0.00 -0.02 0.00 0.00 33.50 33.08 1h5o n PRO 13 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1h5o h LYS 14 N -0.23 0.00 0.00 -0.52 -0.00 -1.81 -2.88 116.57 111.13 1h5o h LYS 14 Ca -0.46 0.00 -0.10 0.00 -0.00 0.00 0.00 60.65 60.09 1h5o h LYS 14 Cb 1.35 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.56 1h5o h LYS 14 CO 0.45 0.00 -1.20 1.05 -0.00 0.00 0.00 179.45 179.75 1h5o h GLU 15 N 0.00 0.00 -7.23 0.07 4.11 -1.89 -3.48 114.58 106.16 1h5o h GLU 15 Ca 0.02 0.00 -0.48 0.00 0.07 0.00 0.00 59.36 58.97 1h5o h GLU 15 Cb 0.15 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.43 1h5o h GLU 15 CO -0.00 0.19 0.38 0.15 0.07 0.00 0.00 179.01 179.80 1h5o s LYS 16 N -3.09 3.83 0.07 1.06 -0.14 -1.09 -4.98 119.74 115.40 1h5o s LYS 16 Ca -0.02 0.93 -0.30 0.00 -1.36 0.00 0.00 55.97 55.22 1h5o s LYS 16 Cb 0.09 -2.12 -0.06 0.00 -1.68 0.00 0.00 37.83 34.07 1h5o s LYS 16 CO 0.80 -0.37 1.18 0.42 -0.76 0.00 0.00 175.35 176.61 1h5o s ILE 17 N -2.74 4.07 -0.08 2.17 1.01 -1.26 -4.94 121.20 119.42 1h5o s ILE 17 Ca 0.58 1.51 -0.01 0.00 0.00 0.00 0.00 60.65 62.74 1h5o s ILE 17 Cb -0.11 -3.97 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 1h5o s ILE 17 CO 0.37 0.13 -0.04 0.00 0.00 0.00 0.00 174.94 175.40 1h5o s LEU 19 N -0.74 1.32 0.72 0.00 1.98 -1.26 -2.33 118.68 118.37 1h5o s LEU 19 Ca 0.11 -0.79 -0.11 0.00 -2.89 0.00 0.00 54.13 50.46 1h5o s LEU 19 Cb -0.11 -0.67 0.02 0.00 0.66 0.00 0.00 46.19 46.09 1h5o s LEU 19 CO 0.02 -0.28 1.07 -2.16 -1.89 0.00 0.00 176.35 173.11 1h5o s PRO 20 N 1.80 2.69 -0.04 0.98 0.04 -1.26 -5.13 135.00 134.07 1h5o s PRO 20 Ca -0.01 1.08 -0.07 0.00 0.04 0.00 0.00 61.00 62.04 1h5o s PRO 20 Cb -0.17 -1.95 -0.29 0.00 0.04 0.00 0.00 34.50 32.13 1h5o s PRO 20 CO -0.07 -1.30 0.68 -1.00 0.04 0.00 0.00 177.00 175.35 1h5o h PRO 21 N -0.76 0.31 -2.68 0.56 0.13 -1.89 -3.40 132.00 124.27 1h5o h PRO 21 Ca -0.44 -0.53 -0.77 0.00 -0.87 0.00 0.00 66.00 63.39 1h5o h PRO 21 Cb 1.22 0.20 -0.18 0.00 0.13 0.00 0.00 31.00 32.37 1h5o h PRO 21 CO 0.55 1.20 1.85 0.45 -0.23 0.00 0.00 178.00 181.81 1h5o n SER 22 N -3.50 7.29 -3.15 1.44 2.88 -1.26 -4.72 113.62 112.60 1h5o n SER 22 Ca -0.23 -3.31 0.04 0.00 -1.33 0.00 0.00 58.87 54.04 1h5o n SER 22 Cb 1.06 -1.32 -0.00 0.00 -0.75 0.00 0.00 64.21 63.20 1h5o n SER 22 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1h5o s SER 23 N -0.22 -1.42 -0.12 -3.46 1.04 -1.26 -5.11 113.70 103.16 1h5o s SER 23 Ca 0.46 0.02 -0.14 0.00 0.48 0.00 0.00 55.95 56.77 1h5o s SER 23 Cb 0.16 1.88 0.03 0.00 0.10 0.00 0.00 66.02 68.19 1h5o s SER 23 CO -0.07 -0.24 0.37 1.51 0.98 0.00 0.00 173.24 175.79 1h5o s ASP 24 N 2.68 -0.36 0.35 7.02 -4.77 -1.26 -0.83 116.67 119.50 1h5o s ASP 24 Ca 0.14 0.64 0.00 0.00 -3.30 0.00 0.00 52.55 50.03 1h5o s ASP 24 Cb -0.08 0.68 -0.03 0.00 -1.09 0.00 0.00 42.92 42.40 1h5o s ASP 24 CO -0.23 -0.19 0.55 -0.36 0.70 0.00 0.00 175.17 175.64 1h5o s PHE 25 N -0.08 3.50 0.00 2.11 0.08 0.26 -4.83 117.98 119.02 1h5o s PHE 25 Ca -0.02 0.36 0.00 0.00 0.12 0.00 0.00 56.93 57.38 1h5o s PHE 25 Cb -0.03 -1.90 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 1h5o s PHE 25 CO 0.01 0.12 0.00 0.41 -0.10 0.00 0.00 175.22 175.66 1h5o n GLY 26 N -1.78 0.69 3.34 4.36 0.00 -1.26 -2.16 105.19 108.37 1h5o n GLY 26 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1h5o n GLY 26 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1h5o n LYS 27 N 0.00 3.28 0.09 1.61 2.85 -1.26 -2.03 118.16 122.69 1h5o n LYS 27 Ca 0.00 -3.44 -0.04 0.00 -1.05 0.00 0.00 58.31 53.78 1h5o n LYS 27 Cb 0.00 -3.23 -0.02 0.00 -0.65 0.00 0.00 35.03 31.13 1h5o n LYS 27 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 177.40 177.87 1h5o h MET 28 N 6.97 -0.26 -0.72 -1.58 2.86 -1.89 -3.42 114.93 116.89 1h5o h MET 28 Ca 0.41 0.02 -0.32 0.00 -2.06 0.00 0.00 59.70 57.75 1h5o h MET 28 Cb 0.81 0.06 -0.40 0.00 0.06 0.00 0.00 31.60 32.13 1h5o h MET 28 CO 1.46 -0.17 -1.13 -3.47 1.06 0.00 0.00 176.91 174.66 1h5o n ASP 29 N -3.84 1.77 -2.34 1.22 2.03 -1.26 -4.81 116.55 109.33 1h5o n ASP 29 Ca -0.03 -2.44 -0.09 0.00 0.52 0.00 0.00 54.79 52.75 1h5o n ASP 29 Cb 0.11 -0.49 -0.00 0.00 -0.72 0.00 0.00 41.12 40.01 1h5o n ASP 29 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1h5o n ARG 31 N -0.39 -1.05 0.36 0.00 1.85 -1.26 -4.92 116.66 111.25 1h5o n ARG 31 Ca -0.02 -1.61 -0.18 0.00 -1.00 0.00 0.00 57.85 55.04 1h5o n ARG 31 Cb 0.41 -1.08 -0.09 0.00 -1.05 0.00 0.00 32.46 30.66 1h5o n ARG 31 CO 0.00 0.00 0.00 2.35 -0.01 0.00 0.00 177.63 179.97 1h5o h TRP 32 N -1.62 -0.83 0.00 2.89 2.91 -2.01 -3.07 115.95 114.21 1h5o h TRP 32 Ca -0.34 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.66 1h5o h TRP 32 Cb 0.93 0.28 0.00 0.00 -0.51 0.00 0.00 29.16 29.86 1h5o h TRP 32 CO 0.00 -0.50 0.00 0.54 -1.03 0.00 0.00 178.44 177.45 1h5o n ARG 33 N -5.46 0.48 -4.14 2.65 5.12 -1.26 -4.81 116.66 109.24 1h5o n ARG 33 Ca -0.13 0.03 -0.28 0.00 -1.93 0.00 0.00 57.85 55.54 1h5o n ARG 33 Cb 0.37 -1.50 -0.07 0.00 -1.16 0.00 0.00 32.46 30.10 1h5o n ARG 33 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1h5o s TRP 34 N -2.44 2.99 0.03 -1.55 0.52 -1.16 -2.25 118.94 115.08 1h5o s TRP 34 Ca 0.28 -0.06 -0.01 0.00 0.02 0.00 0.00 56.10 56.34 1h5o s TRP 34 Cb 0.18 -1.48 -0.03 0.00 -1.15 0.00 0.00 33.47 31.00 1h5o s TRP 34 CO 0.38 0.51 -0.02 -1.59 0.02 0.00 0.00 176.95 176.24 1h5o s LYS 35 N -2.76 0.42 -0.20 4.98 -2.85 -0.36 -4.49 119.74 114.49 1h5o s LYS 35 Ca 0.28 -0.82 -0.19 0.00 -1.00 0.00 0.00 55.97 54.24 1h5o s LYS 35 Cb -0.10 0.15 -0.03 0.00 -2.06 0.00 0.00 37.83 35.78 1h5o s LYS 35 CO 0.20 -0.07 0.54 0.00 0.10 0.00 0.00 175.35 176.12 1h5o s LYS 38 N -4.35 3.34 0.23 0.00 2.20 -0.01 -3.50 119.74 117.66 1h5o s LYS 38 Ca 0.59 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 55.49 1h5o s LYS 38 Cb -0.11 -2.62 0.00 0.00 -1.51 0.00 0.00 37.83 33.59 1h5o s LYS 38 CO 0.38 0.18 0.00 0.36 -0.36 0.00 0.00 175.35 175.90 1h5o n LYS 39 N 3.62 0.00 0.00 4.03 2.85 -1.15 -4.66 118.16 122.85 1h5o n LYS 39 Ca -0.18 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.08 1h5o n LYS 39 Cb 0.53 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.91 1h5o n LYS 39 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1h5o n GLY 40 N 0.61 3.99 2.58 2.58 0.00 -1.19 -5.01 105.19 108.74 1h5o n GLY 40 Ca 0.00 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.89 1h5o n GLY 40 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h5o n SER 41 N 0.00 6.69 0.00 1.61 3.41 -1.26 -4.61 113.62 119.46 1h5o n SER 41 Ca 0.00 -2.93 0.00 0.00 -0.26 0.00 0.00 58.87 55.68 1h5o n SER 41 Cb 0.00 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.45 1h5o n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49