#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z99 h LYS 2 N 0.00 1.31 -0.07 -3.48 1.57 -1.96 -0.66 116.57 113.28 1z99 h LYS 2 Ca 0.00 -0.08 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 1z99 h LYS 2 Cb 0.00 -0.30 -0.01 0.00 0.08 0.00 0.00 32.23 32.00 1z99 h LYS 2 CO 0.00 0.87 -0.65 0.37 -0.57 0.00 0.00 179.45 179.47 1z99 h GLN 3 N 1.35 0.28 0.38 3.15 4.15 -1.96 -1.65 115.11 120.82 1z99 h GLN 3 Ca 0.37 -0.21 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 1z99 h GLN 3 Cb -0.14 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 1z99 h GLN 3 CO -0.08 0.84 -0.33 0.00 -1.93 0.00 0.00 178.83 177.32 1z99 h HIS 5 N -0.73 0.04 -0.75 0.00 3.86 -0.18 0.03 115.15 117.41 1z99 h HIS 5 Ca -0.03 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.26 1z99 h HIS 5 Cb 0.64 -0.01 -0.07 0.00 1.06 0.00 0.00 27.41 29.03 1z99 h HIS 5 CO -0.17 0.18 0.42 -0.22 0.86 0.00 0.00 177.93 179.00 1z99 h LYS 6 N 0.04 0.72 0.00 2.45 3.64 -0.98 0.99 116.57 123.42 1z99 h LYS 6 Ca 0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1z99 h LYS 6 Cb 0.27 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1z99 h LYS 6 CO 0.02 0.47 0.00 1.17 -2.27 0.00 0.00 179.45 178.84 1z99 n LYS 7 N -4.77 0.97 -0.79 1.90 3.00 -0.29 -4.86 118.16 113.32 1z99 n LYS 7 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.42 1z99 n LYS 7 Cb 0.23 -1.18 0.00 0.00 0.00 0.00 0.00 35.03 34.08 1z99 n LYS 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1z99 n GLY 8 N 0.65 0.85 3.91 3.14 0.00 0.34 -4.49 105.19 109.58 1z99 n GLY 8 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1z99 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1z99 s GLY 9 N -1.83 2.21 -0.00 -0.02 0.00 -0.16 -2.17 107.32 105.35 1z99 s GLY 9 Ca 0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 44.72 44.01 1z99 s GLY 9 CO 0.00 -0.64 -0.00 1.57 0.00 0.00 0.00 173.10 174.03 1z99 n HIS 10 N 0.34 0.00 0.00 1.90 -0.00 -1.25 -1.63 115.22 114.58 1z99 n HIS 10 Ca -0.05 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.13 1z99 n HIS 10 Cb 0.52 -0.14 0.00 0.00 -0.12 0.00 0.00 29.99 30.25 1z99 n HIS 10 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1z99 s PHE 12 N 0.00 1.30 0.60 0.00 0.08 0.33 -4.97 117.98 115.33 1z99 s PHE 12 Ca 0.00 -0.39 -0.17 0.00 0.12 0.00 0.00 56.93 56.50 1z99 s PHE 12 Cb 0.00 -0.76 -0.03 0.00 -0.57 0.00 0.00 43.02 41.66 1z99 s PHE 12 CO 0.00 0.06 1.10 -1.25 -0.10 0.00 0.00 175.22 175.03 1z99 s PRO 13 N -1.34 3.14 0.25 0.24 0.04 -1.26 -0.29 135.00 135.78 1z99 s PRO 13 Ca 0.01 1.42 -0.03 0.00 0.04 0.00 0.00 61.00 62.45 1z99 s PRO 13 Cb -0.09 -1.99 0.48 0.00 0.04 0.00 0.00 34.50 32.94 1z99 s PRO 13 CO 0.02 -0.98 1.76 -0.22 0.04 0.00 0.00 177.00 177.61 1z99 h LYS 14 N 0.58 0.57 -0.41 4.56 1.63 -1.84 -0.36 116.57 121.29 1z99 h LYS 14 Ca -0.48 -0.03 0.12 0.00 -0.85 0.00 0.00 60.65 59.40 1z99 h LYS 14 Cb 1.24 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.73 1z99 h LYS 14 CO 0.56 0.38 0.36 1.05 -3.45 0.00 0.00 179.45 178.34 1z99 h GLU 15 N 0.58 0.00 -0.44 1.90 4.11 -1.91 -1.90 114.58 116.93 1z99 h GLU 15 Ca 0.43 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.81 1z99 h GLU 15 Cb 0.60 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1z99 h GLU 15 CO -0.35 0.00 0.06 1.57 0.07 0.00 0.00 179.01 180.36 1z99 h LYS 16 N 0.00 0.67 -6.28 1.06 5.09 -1.41 -3.48 116.57 112.23 1z99 h LYS 16 Ca 0.19 -0.14 -0.08 0.00 0.09 0.00 0.00 60.65 60.72 1z99 h LYS 16 Cb 0.91 -0.10 0.00 0.00 0.10 0.00 0.00 32.23 33.14 1z99 h LYS 16 CO -0.00 0.65 -1.03 -0.89 -2.09 0.00 0.00 179.45 176.08 1z99 n ILE 17 N -4.28 -3.49 -2.31 0.07 5.41 -0.72 -4.86 119.36 109.19 1z99 n ILE 17 Ca 0.03 0.55 -0.41 0.00 1.00 0.00 0.00 62.75 63.91 1z99 n ILE 17 Cb 0.24 -3.56 -0.03 0.00 -0.71 0.00 0.00 39.64 35.58 1z99 n ILE 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1z99 s LEU 19 N -0.13 2.53 0.94 0.00 2.96 -1.26 -4.22 118.68 119.49 1z99 s LEU 19 Ca 0.55 -0.97 -0.11 0.00 -0.22 0.00 0.00 54.13 53.38 1z99 s LEU 19 Cb -0.34 -0.94 0.16 0.00 0.50 0.00 0.00 46.19 45.57 1z99 s LEU 19 CO 0.37 -0.02 1.10 -2.16 -1.32 0.00 0.00 176.35 174.32 1z99 s PRO 20 N -3.27 0.87 -1.28 0.98 0.04 -1.26 -4.64 135.00 126.44 1z99 s PRO 20 Ca 0.24 1.21 -0.17 0.00 0.04 0.00 0.00 61.00 62.32 1z99 s PRO 20 Cb -0.04 -1.73 -0.00 0.00 0.04 0.00 0.00 34.50 32.76 1z99 s PRO 20 CO 0.10 -2.62 2.10 -0.35 0.04 0.00 0.00 177.00 176.27 1z99 n PRO 21 N -4.19 2.55 0.08 0.56 -0.04 -1.26 -3.94 135.00 128.76 1z99 n PRO 21 Ca 0.09 -2.51 0.00 0.00 -0.04 0.00 0.00 63.50 61.04 1z99 n PRO 21 Cb 0.53 -3.25 0.00 0.00 -0.04 0.00 0.00 33.50 30.74 1z99 n PRO 21 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1z99 n SER 22 N 6.97 0.32 -0.18 3.54 7.64 -1.26 -4.79 113.62 125.85 1z99 n SER 22 Ca 0.51 0.25 0.14 0.00 1.01 0.00 0.00 58.87 60.78 1z99 n SER 22 Cb 0.40 0.05 0.61 0.00 -1.01 0.00 0.00 64.21 64.26 1z99 n SER 22 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1z99 n SER 23 N -3.30 0.65 -3.31 6.43 7.64 -1.25 -4.38 113.62 116.09 1z99 n SER 23 Ca 0.00 -0.81 -0.38 0.00 1.01 0.00 0.00 58.87 58.69 1z99 n SER 23 Cb 0.06 -0.03 -0.01 0.00 -1.01 0.00 0.00 64.21 63.22 1z99 n SER 23 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1z99 n ASP 24 N -0.74 7.78 0.00 6.43 2.03 -1.26 -2.74 116.55 128.04 1z99 n ASP 24 Ca 0.16 -3.16 0.00 0.00 0.52 0.00 0.00 54.79 52.31 1z99 n ASP 24 Cb 0.28 -1.34 0.00 0.00 -0.72 0.00 0.00 41.12 39.34 1z99 n ASP 24 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1z99 n PHE 25 N 1.55 0.00 0.00 -0.67 -1.74 -1.25 -4.81 117.46 110.53 1z99 n PHE 25 Ca 0.60 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.49 1z99 n PHE 25 Cb 0.30 -0.49 0.00 0.00 1.52 0.00 0.00 39.48 40.81 1z99 n PHE 25 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1z99 n GLY 26 N -1.00 0.00 0.99 4.97 0.00 -1.26 -5.07 105.19 103.83 1z99 n GLY 26 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1z99 n GLY 26 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1z99 n LYS 27 N 0.00 -1.69 0.00 1.61 -0.00 -1.26 -5.03 118.16 111.80 1z99 n LYS 27 Ca 0.00 1.35 0.00 0.00 -0.00 0.00 0.00 58.31 59.66 1z99 n LYS 27 Cb 0.00 -2.23 0.00 0.00 -0.00 0.00 0.00 35.03 32.80 1z99 n LYS 27 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 1z99 n MET 28 N -3.54 0.00 0.00 -1.58 2.81 -1.26 -4.92 117.12 108.63 1z99 n MET 28 Ca -0.04 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 1z99 n MET 28 Cb 0.43 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.94 1z99 n MET 28 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1z99 n ASP 29 N 0.00 0.00 -4.86 7.83 2.03 -1.26 -4.90 116.55 115.40 1z99 n ASP 29 Ca 0.00 -1.60 -0.31 0.00 0.52 0.00 0.00 54.79 53.40 1z99 n ASP 29 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 1z99 n ASP 29 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1z99 n ARG 31 N -2.93 0.83 0.20 0.00 1.74 -1.26 -4.90 116.66 110.34 1z99 n ARG 31 Ca 0.07 0.30 0.04 0.00 -0.77 0.00 0.00 57.85 57.49 1z99 n ARG 31 Cb 0.54 -1.73 0.40 0.00 -1.02 0.00 0.00 32.46 30.66 1z99 n ARG 31 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 1z99 h TRP 32 N 0.99 0.00 -0.00 -1.55 7.01 -1.98 -1.27 115.95 119.15 1z99 h TRP 32 Ca -0.42 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.58 1z99 h TRP 32 Cb 1.38 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.44 1z99 h TRP 32 CO 0.38 0.33 -0.04 -2.13 -2.79 0.00 0.00 178.44 174.19 1z99 n ARG 33 N -4.05 0.16 -3.84 2.65 0.63 -1.26 -4.87 116.66 106.08 1z99 n ARG 33 Ca -0.02 -0.01 -0.24 0.00 -0.92 0.00 0.00 57.85 56.66 1z99 n ARG 33 Cb 0.38 -1.50 -0.04 0.00 0.45 0.00 0.00 32.46 31.76 1z99 n ARG 33 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 1z99 n TRP 34 N -1.41 0.36 -3.06 -0.14 7.02 -0.48 -3.89 117.44 115.84 1z99 n TRP 34 Ca 0.09 -1.91 0.00 0.00 -1.02 0.00 0.00 57.50 54.66 1z99 n TRP 34 Cb 0.31 -0.29 0.00 0.00 -2.42 0.00 0.00 31.31 28.91 1z99 n TRP 34 CO 0.00 0.00 0.00 0.36 -2.02 0.00 0.00 177.69 176.03 1z99 n LYS 35 N -1.16 0.00 -4.03 -0.99 2.85 0.61 -4.70 118.16 110.74 1z99 n LYS 35 Ca -0.12 0.00 -0.08 0.00 -1.05 0.00 0.00 58.31 57.06 1z99 n LYS 35 Cb 0.50 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.79 1z99 n LYS 35 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1z99 n LYS 38 N -0.10 0.74 -1.68 0.00 4.76 -1.11 -3.80 118.16 116.98 1z99 n LYS 38 Ca -0.11 0.26 -0.48 0.00 -2.87 0.00 0.00 58.31 55.11 1z99 n LYS 38 Cb 0.63 -1.74 -0.05 0.00 -1.84 0.00 0.00 35.03 32.03 1z99 n LYS 38 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1z99 n LYS 39 N 1.78 2.13 -0.14 1.97 2.85 -0.92 -4.33 118.16 121.49 1z99 n LYS 39 Ca 0.17 0.78 0.00 0.00 -1.05 0.00 0.00 58.31 58.21 1z99 n LYS 39 Cb 0.19 -2.60 0.00 0.00 -0.65 0.00 0.00 35.03 31.97 1z99 n LYS 39 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1z99 n GLY 40 N 4.16 0.07 0.26 2.58 0.00 -1.26 -4.94 105.19 106.06 1z99 n GLY 40 Ca 0.21 -0.85 0.18 0.00 0.00 0.00 0.00 46.02 45.56 1z99 n GLY 40 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1z99 h SER 41 N 0.00 0.00 0.00 1.61 4.64 -1.83 -3.49 113.55 114.48 1z99 h SER 41 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1z99 h SER 41 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1z99 h SER 41 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57