#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z99 n LYS 2 N 0.00 0.00 0.03 -3.48 0.00 -1.26 -2.85 118.16 110.60 1z99 n LYS 2 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 58.31 58.40 1z99 n LYS 2 Cb 0.00 0.00 0.52 0.00 0.00 0.00 0.00 35.03 35.55 1z99 n LYS 2 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 1z99 h GLN 3 N 0.00 0.33 0.24 1.64 4.20 -1.96 0.13 115.11 119.69 1z99 h GLN 3 Ca 0.00 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 1z99 h GLN 3 Cb 0.00 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1z99 h GLN 3 CO 0.00 0.22 -0.12 0.00 -0.67 0.00 0.00 178.83 178.26 1z99 h HIS 5 N -0.71 0.00 -0.89 0.00 3.86 -0.50 -1.41 115.15 115.49 1z99 h HIS 5 Ca -0.03 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.29 1z99 h HIS 5 Cb 0.49 0.00 -0.13 0.00 1.06 0.00 0.00 27.41 28.83 1z99 h HIS 5 CO 0.04 0.30 -0.42 1.63 0.86 0.00 0.00 177.93 180.34 1z99 n LYS 6 N -4.06 -0.28 -0.15 2.45 5.02 0.29 -1.05 118.16 120.38 1z99 n LYS 6 Ca -0.02 1.36 0.04 0.00 -2.02 0.00 0.00 58.31 57.67 1z99 n LYS 6 Cb 0.36 -2.02 0.11 0.00 -0.02 0.00 0.00 35.03 33.46 1z99 n LYS 6 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1z99 n LYS 7 N -5.24 1.66 -0.31 1.97 4.76 -0.76 -4.83 118.16 115.42 1z99 n LYS 7 Ca 0.06 -0.90 0.00 0.00 -2.87 0.00 0.00 58.31 54.60 1z99 n LYS 7 Cb 0.31 -1.26 0.00 0.00 -1.84 0.00 0.00 35.03 32.24 1z99 n LYS 7 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1z99 n GLY 8 N 0.80 0.72 3.78 0.72 0.00 -0.22 -4.69 105.19 106.30 1z99 n GLY 8 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.56 2.01 0.00 -0.02 0.00 -0.61 -2.65 107.32 104.49 1z99 s GLY 9 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 43.97 1z99 s GLY 9 CO 0.00 -0.52 0.00 1.42 0.00 0.00 0.00 173.10 174.00 1z99 n HIS 10 N 1.92 0.00 0.00 1.90 8.25 -1.09 -1.98 115.22 124.23 1z99 n HIS 10 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 1z99 n HIS 10 Cb 0.54 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.65 1z99 n HIS 10 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1z99 s PHE 12 N 0.00 0.70 0.59 0.00 0.08 0.25 -4.97 117.98 114.63 1z99 s PHE 12 Ca 0.00 -0.74 -0.17 0.00 0.12 0.00 0.00 56.93 56.14 1z99 s PHE 12 Cb 0.00 -0.42 -0.04 0.00 -0.57 0.00 0.00 43.02 41.99 1z99 s PHE 12 CO 0.00 -0.16 1.11 -1.25 -0.10 0.00 0.00 175.22 174.82 1z99 s PRO 13 N -2.74 3.18 0.27 0.24 0.04 -1.26 -0.59 135.00 134.13 1z99 s PRO 13 Ca 0.00 1.46 -0.00 0.00 0.04 0.00 0.00 61.00 62.49 1z99 s PRO 13 Cb -0.02 -2.00 0.57 0.00 0.04 0.00 0.00 34.50 33.10 1z99 s PRO 13 CO -0.03 -0.96 1.74 -0.22 0.04 0.00 0.00 177.00 177.56 1z99 h LYS 14 N 0.69 0.51 0.00 4.56 1.63 -1.88 -0.89 116.57 121.20 1z99 h LYS 14 Ca -0.48 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 1z99 h LYS 14 Cb 1.25 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.76 1z99 h LYS 14 CO 0.56 0.34 0.08 1.05 -3.45 0.00 0.00 179.45 178.02 1z99 h GLU 15 N 0.52 0.00 -0.16 1.90 -0.00 -1.91 -1.30 114.58 113.63 1z99 h GLU 15 Ca 0.48 0.00 -0.08 0.00 -0.00 0.00 0.00 59.36 59.76 1z99 h GLU 15 Cb 0.76 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.50 1z99 h GLU 15 CO -0.42 0.00 -0.26 1.57 -0.00 0.00 0.00 179.01 179.90 1z99 h LYS 16 N 0.00 0.29 -6.22 1.06 5.09 -1.51 -3.48 116.57 111.80 1z99 h LYS 16 Ca 0.00 -0.10 -0.07 0.00 0.09 0.00 0.00 60.65 60.57 1z99 h LYS 16 Cb 0.15 -0.02 0.00 0.00 0.10 0.00 0.00 32.23 32.46 1z99 h LYS 16 CO 0.00 0.54 -1.02 -0.89 -2.09 0.00 0.00 179.45 175.98 1z99 n ILE 17 N -4.14 -3.88 -1.96 0.07 5.41 -0.49 -4.84 119.36 109.52 1z99 n ILE 17 Ca -0.01 0.61 -0.43 0.00 1.00 0.00 0.00 62.75 63.92 1z99 n ILE 17 Cb 0.38 -3.72 -0.03 0.00 -0.71 0.00 0.00 39.64 35.56 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 4.97 2.25 0.73 0.00 1.02 -1.26 -4.05 118.68 122.34 1z99 s LEU 19 Ca 0.77 -0.58 -0.13 0.00 0.02 0.00 0.00 54.13 54.21 1z99 s LEU 19 Cb -0.31 -0.59 0.04 0.00 0.02 0.00 0.00 46.19 45.35 1z99 s LEU 19 CO 0.32 -0.03 1.12 -2.16 0.02 0.00 0.00 176.35 175.61 1z99 s PRO 20 N -1.60 2.36 -1.50 1.29 0.04 -1.26 -2.52 135.00 131.81 1z99 s PRO 20 Ca 0.00 1.35 -0.13 0.00 0.04 0.00 0.00 61.00 62.26 1z99 s PRO 20 Cb -0.09 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.56 1z99 s PRO 20 CO 0.02 -1.59 2.40 -0.35 0.04 0.00 0.00 177.00 177.53 1z99 n PRO 21 N -3.05 3.06 0.02 0.56 -0.04 -1.26 -4.13 135.00 130.17 1z99 n PRO 21 Ca 0.10 -2.51 -0.02 0.00 -0.04 0.00 0.00 63.50 61.03 1z99 n PRO 21 Cb 0.52 -3.17 -0.01 0.00 -0.04 0.00 0.00 33.50 30.81 1z99 n PRO 21 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1z99 n SER 22 N 5.48 1.10 0.18 3.54 2.88 -1.26 -4.64 113.62 120.90 1z99 n SER 22 Ca 0.58 0.15 0.13 0.00 -1.33 0.00 0.00 58.87 58.40 1z99 n SER 22 Cb 0.35 -0.36 0.64 0.00 -0.75 0.00 0.00 64.21 64.09 1z99 n SER 22 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1z99 h SER 23 N -0.14 0.00 -0.29 -3.46 0.02 -1.94 -3.23 113.55 104.52 1z99 h SER 23 Ca -0.01 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.58 1z99 h SER 23 Cb 0.27 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.73 1z99 h SER 23 CO -0.01 0.00 0.56 -0.67 -1.14 0.00 0.00 176.83 175.57 1z99 n ASP 24 N -2.39 6.18 -0.30 3.07 2.03 -1.26 -4.00 116.55 119.87 1z99 n ASP 24 Ca -0.01 -2.68 0.07 0.00 0.52 0.00 0.00 54.79 52.70 1z99 n ASP 24 Cb 0.11 -1.40 0.23 0.00 -0.72 0.00 0.00 41.12 39.34 1z99 n ASP 24 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1z99 h PHE 25 N 3.39 0.79 0.00 -0.67 -5.15 -1.73 -3.42 116.94 110.15 1z99 h PHE 25 Ca 0.36 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 58.17 1z99 h PHE 25 Cb 1.10 -0.22 0.00 0.00 0.22 0.00 0.00 35.95 37.05 1z99 h PHE 25 CO 1.73 0.19 0.00 0.41 -2.00 0.00 0.00 178.31 178.64 1z99 n GLY 26 N -1.33 0.00 0.00 6.09 0.00 -1.26 -5.10 105.19 103.59 1z99 n GLY 26 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 0.00 1.61 -0.00 -1.26 -4.87 118.16 113.64 1z99 n LYS 27 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1z99 n LYS 27 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 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 1.11 0.00 0.16 -1.58 2.81 -1.26 -4.92 117.12 113.44 1z99 n MET 28 Ca 0.00 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.01 1z99 n MET 28 Cb 0.00 0.00 0.13 0.00 -0.71 0.00 0.00 33.22 32.64 1z99 n MET 28 CO 0.00 0.00 0.00 0.22 1.51 0.00 0.00 175.97 177.70 1z99 h ASP 29 N 0.00 0.00 -4.00 7.83 3.58 -1.84 -3.47 116.42 118.52 1z99 h ASP 29 Ca 0.00 -0.02 -0.50 0.00 0.42 0.00 0.00 57.03 56.94 1z99 h ASP 29 Cb 0.00 0.00 0.20 0.00 1.72 0.00 0.00 39.33 41.25 1z99 h ASP 29 CO 0.00 0.01 0.17 0.00 -2.88 0.00 0.00 179.24 176.54 1z99 s ARG 31 N -4.61 2.22 0.00 0.00 1.70 -1.26 -4.90 118.95 112.10 1z99 s ARG 31 Ca 0.67 1.31 -0.03 0.00 -0.47 0.00 0.00 55.73 57.22 1z99 s ARG 31 Cb -0.23 -1.88 -0.12 0.00 -0.57 0.00 0.00 34.95 32.15 1z99 s ARG 31 CO 0.60 -1.69 2.33 1.87 -1.08 0.00 0.00 175.30 177.32 1z99 n TRP 32 N -3.30 0.00 -0.31 5.89 -0.00 -1.26 -1.84 117.44 116.62 1z99 n TRP 32 Ca 0.10 -1.00 0.00 0.00 -0.00 0.00 0.00 57.50 56.60 1z99 n TRP 32 Cb 0.52 -0.93 0.00 0.00 -0.00 0.00 0.00 31.31 30.90 1z99 n TRP 32 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 177.69 180.58 1z99 n ARG 33 N 2.15 0.00 -4.65 5.87 1.85 -1.26 -5.13 116.66 115.48 1z99 n ARG 33 Ca 0.18 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.74 1z99 n ARG 33 Cb 0.57 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.89 1z99 n ARG 33 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1z99 s TRP 34 N 0.00 2.16 0.02 2.89 0.52 -0.77 -3.99 118.94 119.78 1z99 s TRP 34 Ca 0.00 -0.85 0.00 0.00 0.02 0.00 0.00 56.10 55.27 1z99 s TRP 34 Cb 0.00 -1.63 -0.00 0.00 -1.15 0.00 0.00 33.47 30.69 1z99 s TRP 34 CO 0.00 0.27 0.02 0.36 0.02 0.00 0.00 176.95 177.63 1z99 n LYS 35 N -1.06 0.03 -3.90 4.98 2.85 0.25 -4.62 118.16 116.69 1z99 n LYS 35 Ca -0.11 -0.20 -0.10 0.00 -1.05 0.00 0.00 58.31 56.85 1z99 n LYS 35 Cb 0.67 0.17 -0.10 0.00 -0.65 0.00 0.00 35.03 35.12 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 0.35 0.02 -3.28 0.00 5.02 -1.26 -2.65 118.16 116.36 1z99 n LYS 38 Ca -0.17 -0.86 -0.07 0.00 -2.02 0.00 0.00 58.31 55.19 1z99 n LYS 38 Cb 0.60 -2.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 1z99 n LYS 38 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1z99 n LYS 39 N 6.73 -0.60 -3.07 1.97 2.85 -1.08 -4.68 118.16 120.27 1z99 n LYS 39 Ca 0.31 -0.15 0.00 0.00 -1.05 0.00 0.00 58.31 57.42 1z99 n LYS 39 Cb 0.41 -0.05 0.00 0.00 -0.65 0.00 0.00 35.03 34.74 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 -0.94 -0.54 2.81 2.58 0.00 -1.26 -5.07 105.19 102.77 1z99 n GLY 40 Ca -0.04 -0.80 -0.01 0.00 0.00 0.00 0.00 46.02 45.16 1z99 n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1z99 s SER 41 N -4.00 -0.78 0.00 1.61 1.04 -1.26 -4.84 113.70 105.46 1z99 s SER 41 Ca 0.00 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.74 1z99 s SER 41 Cb 0.00 1.01 0.00 0.00 0.10 0.00 0.00 66.02 67.13 1z99 s SER 41 CO 0.00 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.78