#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5o n LYS 2 N 0.00 0.00 -0.06 2.98 3.00 -1.26 -5.03 118.16 117.79 1h5o n LYS 2 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 1h5o n LYS 2 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 34.91 1h5o n LYS 2 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 1h5o h GLN 3 N 0.00 -0.00 -0.09 1.64 4.15 -2.00 -3.26 115.11 115.55 1h5o h GLN 3 Ca 0.00 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.29 1h5o h GLN 3 Cb 0.00 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1h5o h GLN 3 CO 0.00 0.89 -0.54 0.00 -1.93 0.00 0.00 178.83 177.26 1h5o h HIS 5 N 0.20 0.74 -0.53 0.00 -0.00 -1.79 -0.10 115.15 113.68 1h5o h HIS 5 Ca 0.00 -0.16 -0.05 0.00 -0.00 0.00 0.00 60.37 60.16 1h5o h HIS 5 Cb 1.01 -0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 28.22 1h5o h HIS 5 CO 0.02 0.83 0.13 -0.22 -0.00 0.00 0.00 177.93 178.69 1h5o h LYS 6 N 0.58 0.84 -0.10 5.26 3.64 -1.56 -3.17 116.57 122.06 1h5o h LYS 6 Ca 0.08 -0.20 -0.09 0.00 -1.27 0.00 0.00 60.65 59.17 1h5o h LYS 6 Cb 0.70 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1h5o h LYS 6 CO 0.05 0.80 -0.29 0.87 -2.27 0.00 0.00 179.45 178.61 1h5o h LYS 7 N 0.74 0.37 0.00 1.90 1.57 -1.45 -3.49 116.57 116.21 1h5o h LYS 7 Ca 0.17 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1h5o h LYS 7 Cb 0.33 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1h5o h LYS 7 CO 0.00 0.89 0.00 0.41 -0.57 0.00 0.00 179.45 180.18 1h5o n GLY 8 N 0.57 0.67 3.83 3.86 0.00 -0.10 -5.13 105.19 108.89 1h5o n GLY 8 Ca -0.08 -0.47 -0.06 0.00 0.00 0.00 0.00 46.02 45.41 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 0.07 0.03 -0.02 0.00 -0.89 -4.39 107.32 102.13 1h5o s GLY 9 Ca 0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 44.72 44.32 1h5o s GLY 9 CO 0.00 0.24 0.01 -1.58 0.00 0.00 0.00 173.10 171.77 1h5o s HIS 10 N -2.98 0.32 -0.13 1.90 2.46 -0.75 -4.49 115.29 111.61 1h5o s HIS 10 Ca 0.14 -0.68 -0.29 0.00 0.47 0.00 0.00 55.06 54.70 1h5o s HIS 10 Cb -0.04 -0.23 -0.01 0.00 -0.13 0.00 0.00 32.58 32.16 1h5o s HIS 10 CO 0.07 -0.30 1.06 0.00 -2.47 0.00 0.00 174.74 173.09 1h5o s PHE 12 N 2.39 0.82 0.59 0.00 0.08 0.95 -4.97 117.98 117.83 1h5o s PHE 12 Ca 0.49 -0.91 -0.19 0.00 0.12 0.00 0.00 56.93 56.44 1h5o s PHE 12 Cb -0.19 -0.49 -0.05 0.00 -0.57 0.00 0.00 43.02 41.73 1h5o s PHE 12 CO 0.16 -0.18 1.02 -2.30 -0.10 0.00 0.00 175.22 173.82 1h5o n PRO 13 N 0.09 1.00 0.01 0.24 -0.02 -1.26 -0.04 135.00 135.01 1h5o n PRO 13 Ca -0.13 0.38 -0.12 0.00 -2.02 0.00 0.00 63.50 61.61 1h5o n PRO 13 Cb 0.60 -2.22 -0.09 0.00 -0.02 0.00 0.00 33.50 31.77 1h5o n PRO 13 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1h5o h LYS 14 N 0.62 -0.09 0.00 -0.52 3.64 -1.82 -3.30 116.57 115.10 1h5o h LYS 14 Ca -0.49 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.87 1h5o h LYS 14 Cb 1.36 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.19 1h5o h LYS 14 CO 0.52 0.46 -0.15 1.05 -2.27 0.00 0.00 179.45 179.05 1h5o h GLU 15 N -0.75 0.00 -6.98 1.90 4.11 -1.92 -3.44 114.58 107.50 1h5o h GLU 15 Ca -0.01 0.00 -0.47 0.00 0.07 0.00 0.00 59.36 58.95 1h5o h GLU 15 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1h5o h GLU 15 CO 0.02 0.15 0.38 0.15 0.07 0.00 0.00 179.01 179.78 1h5o s LYS 16 N -4.28 4.21 0.21 1.06 -0.14 -1.24 -4.98 119.74 114.57 1h5o s LYS 16 Ca -0.03 1.38 -0.30 0.00 -1.36 0.00 0.00 55.97 55.66 1h5o s LYS 16 Cb 0.14 -2.46 -0.09 0.00 -1.68 0.00 0.00 37.83 33.74 1h5o s LYS 16 CO 0.62 -0.08 1.24 0.42 -0.76 0.00 0.00 175.35 176.79 1h5o s ILE 17 N -1.80 3.35 -0.33 2.17 1.01 -1.26 -4.89 121.20 119.46 1h5o s ILE 17 Ca 0.58 1.16 -0.17 0.00 0.00 0.00 0.00 60.65 62.23 1h5o s ILE 17 Cb -0.18 -3.74 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 1h5o s ILE 17 CO 0.23 0.20 0.44 0.00 0.00 0.00 0.00 174.94 175.81 1h5o s LEU 19 N 2.22 1.97 0.63 0.00 1.98 -1.26 -2.09 118.68 122.12 1h5o s LEU 19 Ca 0.16 -0.68 -0.12 0.00 -2.89 0.00 0.00 54.13 50.61 1h5o s LEU 19 Cb -0.16 -1.20 -0.03 0.00 0.66 0.00 0.00 46.19 45.46 1h5o s LEU 19 CO 0.12 -0.10 1.04 -2.16 -1.89 0.00 0.00 176.35 173.36 1h5o s PRO 20 N 1.45 3.41 -0.94 0.98 0.04 -1.26 -4.99 135.00 133.68 1h5o s PRO 20 Ca 0.02 0.85 -0.03 0.00 0.04 0.00 0.00 61.00 61.88 1h5o s PRO 20 Cb -0.14 -2.05 0.20 0.00 0.04 0.00 0.00 34.50 32.54 1h5o s PRO 20 CO -0.10 -0.72 2.28 -0.35 0.04 0.00 0.00 177.00 178.16 1h5o n PRO 21 N -2.74 3.92 0.18 0.56 -0.04 -0.89 -4.66 135.00 131.34 1h5o n PRO 21 Ca 0.07 -3.49 -0.08 0.00 -0.04 0.00 0.00 63.50 59.96 1h5o n PRO 21 Cb 0.54 -2.40 -0.04 0.00 -0.04 0.00 0.00 33.50 31.56 1h5o n PRO 21 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1h5o h SER 22 N 3.80 -0.42 -2.73 3.54 4.64 -1.83 -3.44 113.55 117.11 1h5o h SER 22 Ca 0.56 0.01 -0.33 0.00 -0.47 0.00 0.00 61.79 61.57 1h5o h SER 22 Cb 0.36 0.11 -0.36 0.00 -0.31 0.00 0.00 62.40 62.20 1h5o h SER 22 CO 1.24 -0.18 -0.64 -0.44 -0.87 0.00 0.00 176.83 175.94 1h5o s SER 23 N -3.72 1.32 -0.30 4.97 0.01 -1.26 -5.02 113.70 109.70 1h5o s SER 23 Ca -0.07 -0.11 -0.13 0.00 1.31 0.00 0.00 55.95 56.95 1h5o s SER 23 Cb 0.01 0.29 -0.03 0.00 0.21 0.00 0.00 66.02 66.50 1h5o s SER 23 CO 0.22 -0.31 0.28 -1.81 0.41 0.00 0.00 173.24 172.03 1h5o s ASP 24 N 2.30 6.12 0.49 2.44 1.01 -1.26 -0.92 116.67 126.85 1h5o s ASP 24 Ca 0.05 -0.04 -0.00 0.00 0.71 0.00 0.00 52.55 53.27 1h5o s ASP 24 Cb -0.15 -2.16 0.01 0.00 1.01 0.00 0.00 42.92 41.63 1h5o s ASP 24 CO -0.10 -0.17 0.73 -0.36 0.21 0.00 0.00 175.17 175.48 1h5o s PHE 25 N 1.88 3.14 0.00 4.23 0.08 0.14 -4.97 117.98 122.47 1h5o s PHE 25 Ca 0.10 0.23 0.00 0.00 0.12 0.00 0.00 56.93 57.37 1h5o s PHE 25 Cb -0.16 -2.48 0.00 0.00 -0.57 0.00 0.00 43.02 39.81 1h5o s PHE 25 CO 0.11 -0.55 0.00 0.41 -0.10 0.00 0.00 175.22 175.09 1h5o n GLY 26 N -2.21 0.44 3.51 4.36 0.00 -1.26 -3.03 105.19 107.00 1h5o n GLY 26 Ca 0.03 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1h5o n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h5o s LYS 27 N 0.00 3.58 0.00 1.61 1.02 -1.26 -3.18 119.74 121.50 1h5o s LYS 27 Ca 0.00 -1.39 0.00 0.00 0.02 0.00 0.00 55.97 54.60 1h5o s LYS 27 Cb 0.00 -5.12 0.00 0.00 -0.52 0.00 0.00 37.83 32.19 1h5o s LYS 27 CO 0.00 -2.00 0.00 -1.33 -0.92 0.00 0.00 175.35 171.10 1h5o n MET 28 N 7.81 0.00 -2.76 1.68 2.81 -1.26 -4.84 117.12 120.56 1h5o n MET 28 Ca 0.28 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.73 1h5o n MET 28 Cb 0.50 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.01 1h5o n MET 28 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1h5o n ASP 29 N 0.00 5.30 -4.02 7.83 8.00 -1.26 -4.95 116.55 127.45 1h5o n ASP 29 Ca 0.00 -3.07 -0.10 0.00 0.71 0.00 0.00 54.79 52.33 1h5o n ASP 29 Cb 0.00 -1.49 -0.07 0.00 -0.02 0.00 0.00 41.12 39.54 1h5o n ASP 29 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h5o s ARG 31 N -4.02 -0.57 0.07 0.00 3.52 -1.26 -4.89 118.95 111.80 1h5o s ARG 31 Ca 0.23 -0.21 -0.34 0.00 -0.13 0.00 0.00 55.73 55.29 1h5o s ARG 31 Cb 0.02 -1.69 -0.17 0.00 -1.56 0.00 0.00 34.95 31.56 1h5o s ARG 31 CO 0.06 -3.25 1.52 2.35 -0.81 0.00 0.00 175.30 175.17 1h5o h TRP 32 N -2.25 -1.30 -0.58 5.12 -0.00 -2.01 -2.61 115.95 112.33 1h5o h TRP 32 Ca -0.44 0.00 -0.16 0.00 -0.00 0.00 0.00 58.89 58.29 1h5o h TRP 32 Cb 1.27 0.49 -0.10 0.00 -0.00 0.00 0.00 29.16 30.83 1h5o h TRP 32 CO -1.82 -0.65 0.21 0.54 -0.00 0.00 0.00 178.44 176.72 1h5o n ARG 33 N -5.34 3.21 -4.18 2.65 1.74 -1.26 -4.95 116.66 108.53 1h5o n ARG 33 Ca -0.12 -2.40 -0.23 0.00 -0.77 0.00 0.00 57.85 54.33 1h5o n ARG 33 Cb 0.44 -2.03 -0.07 0.00 -1.02 0.00 0.00 32.46 29.79 1h5o n ARG 33 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1h5o s TRP 34 N -2.44 2.70 0.33 -1.55 0.52 -0.98 -2.73 118.94 114.78 1h5o s TRP 34 Ca 0.43 -0.33 0.05 0.00 0.02 0.00 0.00 56.10 56.27 1h5o s TRP 34 Cb 0.34 -1.49 -0.07 0.00 -1.15 0.00 0.00 33.47 31.11 1h5o s TRP 34 CO 0.11 0.44 0.01 -1.59 0.02 0.00 0.00 176.95 175.94 1h5o s LYS 35 N -3.78 1.68 -0.14 4.98 -2.85 0.94 -4.49 119.74 116.08 1h5o s LYS 35 Ca 0.35 -1.91 -0.04 0.00 -1.00 0.00 0.00 55.97 53.37 1h5o s LYS 35 Cb -0.03 -1.12 -0.03 0.00 -2.06 0.00 0.00 37.83 34.58 1h5o s LYS 35 CO 0.22 -0.09 0.00 0.00 0.10 0.00 0.00 175.35 175.58 1h5o s LYS 38 N -1.36 3.56 0.53 0.00 2.20 -0.09 -1.82 119.74 122.76 1h5o s LYS 38 Ca 0.12 -0.23 -0.06 0.00 -0.36 0.00 0.00 55.97 55.44 1h5o s LYS 38 Cb -0.10 -2.83 0.12 0.00 -1.51 0.00 0.00 37.83 33.50 1h5o s LYS 38 CO 0.03 0.42 0.73 0.36 -0.36 0.00 0.00 175.35 176.52 1h5o n LYS 39 N -0.38 -0.36 0.00 4.03 0.00 -1.26 -4.13 118.16 116.06 1h5o n LYS 39 Ca -0.04 -1.45 0.00 0.00 -0.00 0.00 0.00 58.31 56.82 1h5o n LYS 39 Cb 0.53 -0.64 0.00 0.00 -0.00 0.00 0.00 35.03 34.91 1h5o n LYS 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1h5o n GLY 40 N -0.06 0.48 3.40 2.58 0.00 -1.26 -4.66 105.19 105.66 1h5o n GLY 40 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 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 5.28 0.00 1.61 3.41 -1.26 -5.10 113.62 117.56 1h5o n SER 41 Ca 0.00 -3.00 0.00 0.00 -0.26 0.00 0.00 58.87 55.61 1h5o n SER 41 Cb 0.00 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 62.42 1h5o n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49