#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u86 n SER 2 N 0.00 7.39 -4.23 1.61 7.64 -1.26 -4.81 113.62 119.96 1u86 n SER 2 Ca 0.00 -3.69 -0.44 0.00 1.01 0.00 0.00 58.87 55.75 1u86 n SER 2 Cb 0.00 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.15 1u86 n SER 2 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1u86 n THR 3 N -0.43 4.69 0.02 0.44 -1.04 -1.26 -4.72 114.28 111.98 1u86 n THR 3 Ca 0.55 -5.32 -0.16 0.00 -2.04 0.00 0.00 64.05 57.08 1u86 n THR 3 Cb 0.44 -2.42 -0.14 0.00 -1.82 0.00 0.00 70.33 66.40 1u86 n THR 3 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1u86 h GLY 4 N 7.01 0.20 -3.98 3.41 0.00 -2.06 -3.46 103.07 104.19 1u86 h GLY 4 Ca 0.23 -0.51 -0.51 0.00 0.00 0.00 0.00 47.33 46.54 1u86 h GLY 4 CO 1.20 0.45 0.49 -0.42 0.00 0.00 0.00 176.54 178.26 1u86 s ILE 5 N -2.59 3.64 0.20 2.60 1.09 -1.26 -4.97 121.20 119.91 1u86 s ILE 5 Ca -0.12 1.50 0.06 0.00 -1.10 0.00 0.00 60.65 60.99 1u86 s ILE 5 Cb 0.07 -3.96 -0.04 0.00 -1.06 0.00 0.00 42.46 37.48 1u86 s ILE 5 CO 0.81 0.30 0.12 -0.54 -0.10 0.00 0.00 174.94 175.53 1u86 s LYS 6 N -0.79 2.78 0.41 2.79 -0.14 -1.26 -5.00 119.74 118.53 1u86 s LYS 6 Ca 0.48 -1.00 0.18 0.00 -1.36 0.00 0.00 55.97 54.27 1u86 s LYS 6 Cb -0.31 -2.54 0.91 0.00 -1.68 0.00 0.00 37.83 34.21 1u86 s LYS 6 CO 0.38 0.45 1.88 -1.35 -0.76 0.00 0.00 175.35 175.94 1u86 h PRO 7 N 2.17 0.00 -2.13 -1.68 0.11 -1.97 -2.83 132.00 125.67 1u86 h PRO 7 Ca -0.48 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 64.98 1u86 h PRO 7 Cb 1.21 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 32.12 1u86 h PRO 7 CO 0.61 0.30 1.00 1.19 -0.21 0.00 0.00 178.00 180.89 1u86 n PHE 8 N -3.86 2.29 -2.63 0.65 3.01 -1.23 -4.96 117.46 110.74 1u86 n PHE 8 Ca -0.02 -2.27 -0.42 0.00 1.01 0.00 0.00 57.45 55.76 1u86 n PHE 8 Cb 0.38 -1.38 -0.03 0.00 -0.01 0.00 0.00 39.48 38.44 1u86 n PHE 8 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 1u86 s GLN 9 N -2.60 4.47 0.10 -1.08 2.00 -1.07 -0.73 119.66 120.76 1u86 s GLN 9 Ca 0.54 1.49 -0.31 0.00 -2.00 0.00 0.00 55.36 55.08 1u86 s GLN 9 Cb 0.34 -3.48 -0.08 0.00 0.80 0.00 0.00 33.01 30.59 1u86 s GLN 9 CO -0.25 -0.22 1.48 0.00 -0.50 0.00 0.00 175.29 175.80 1u86 n THR 11 N 4.17 0.68 -2.53 0.00 -2.24 -1.26 -3.75 114.28 109.35 1u86 n THR 11 Ca 0.13 -0.44 -0.42 0.00 -2.27 0.00 0.00 64.05 61.05 1u86 n THR 11 Cb 0.41 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.51 1u86 n THR 11 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1u86 s TRP 12 N -1.64 3.41 0.07 4.78 -0.11 -1.26 -4.92 118.94 119.28 1u86 s TRP 12 Ca 0.19 1.39 -0.27 0.00 1.22 0.00 0.00 56.10 58.63 1u86 s TRP 12 Cb 0.12 -3.33 -0.17 0.00 -1.50 0.00 0.00 33.47 28.60 1u86 s TRP 12 CO 0.09 -0.89 1.65 -1.35 -4.62 0.00 0.00 176.95 171.83 1u86 h PRO 13 N 7.05 -0.36 0.00 5.86 0.11 -2.01 0.27 132.00 142.92 1u86 h PRO 13 Ca -0.38 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1u86 h PRO 13 Cb 1.19 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1u86 h PRO 13 CO 0.83 -0.22 0.00 0.22 -0.21 0.00 0.00 178.00 178.62 1u86 h ASP 14 N -0.41 0.00 0.00 -2.05 3.58 -1.99 -3.38 116.42 112.17 1u86 h ASP 14 Ca -0.04 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.41 1u86 h ASP 14 Cb 0.31 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.36 1u86 h ASP 14 CO 0.06 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.42 1u86 n ASP 16 N -1.70 -7.35 -4.98 0.00 2.03 0.92 -5.01 116.55 100.46 1u86 n ASP 16 Ca 0.00 -0.29 -0.19 0.00 0.52 0.00 0.00 54.79 54.83 1u86 n ASP 16 Cb 0.00 -5.24 0.03 0.00 -0.72 0.00 0.00 41.12 35.19 1u86 n ASP 16 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1u86 s ARG 17 N -3.48 2.64 -0.07 -0.67 3.00 -1.25 -4.87 118.95 114.25 1u86 s ARG 17 Ca 0.16 -1.05 -0.03 0.00 0.00 0.00 0.00 55.73 54.81 1u86 s ARG 17 Cb -0.02 -2.62 0.04 0.00 0.00 0.00 0.00 34.95 32.35 1u86 s ARG 17 CO 0.74 -0.53 0.15 -1.54 0.00 0.00 0.00 175.30 174.12 1u86 s SER 18 N -4.41 0.21 0.19 0.23 1.04 -1.26 0.98 113.70 110.68 1u86 s SER 18 Ca 0.57 0.31 0.10 0.00 0.48 0.00 0.00 55.95 57.41 1u86 s SER 18 Cb -0.10 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 1u86 s SER 18 CO 0.36 -0.18 -0.21 -0.36 0.98 0.00 0.00 173.24 173.83 1u86 s PHE 19 N 1.60 2.06 -0.35 5.02 0.40 0.09 -4.91 117.98 121.88 1u86 s PHE 19 Ca -0.05 -0.41 0.16 0.00 -0.60 0.00 0.00 56.93 56.03 1u86 s PHE 19 Cb -0.12 -1.00 -0.22 0.00 0.51 0.00 0.00 43.02 42.19 1u86 s PHE 19 CO -0.06 0.44 0.50 -1.13 0.70 0.00 0.00 175.22 175.67 1u86 n SER 20 N 0.16 1.02 -4.57 1.36 3.41 -1.26 -3.48 113.62 110.26 1u86 n SER 20 Ca -0.12 -0.40 -0.37 0.00 -0.26 0.00 0.00 58.87 57.72 1u86 n SER 20 Cb 0.57 1.41 -0.11 0.00 -0.26 0.00 0.00 64.21 65.82 1u86 n SER 20 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1u86 s ARG 21 N -2.85 3.91 0.20 4.33 3.00 -1.26 -4.99 118.95 121.29 1u86 s ARG 21 Ca -0.01 -0.35 0.05 0.00 0.00 0.00 0.00 55.73 55.43 1u86 s ARG 21 Cb 0.11 -3.53 0.12 0.00 0.00 0.00 0.00 34.95 31.65 1u86 s ARG 21 CO 0.67 -0.10 1.47 0.66 0.00 0.00 0.00 175.30 178.00 1u86 h SER 22 N 8.05 0.17 0.48 0.23 4.64 -1.98 -2.37 113.55 122.76 1u86 h SER 22 Ca -0.36 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1u86 h SER 22 Cb 1.18 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1u86 h SER 22 CO 0.59 0.87 -0.19 -0.67 -0.87 0.00 0.00 176.83 176.56 1u86 n ASP 23 N -3.71 0.46 -0.10 4.97 2.03 -1.26 -1.95 116.55 116.99 1u86 n ASP 23 Ca -0.02 -0.36 -0.23 0.00 0.52 0.00 0.00 54.79 54.69 1u86 n ASP 23 Cb 0.73 -0.06 -0.12 0.00 -0.72 0.00 0.00 41.12 40.96 1u86 n ASP 23 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1u86 n HIS 24 N -1.13 0.53 0.20 -0.67 8.25 -1.14 -3.52 115.22 117.73 1u86 n HIS 24 Ca 0.11 0.17 0.07 0.00 -0.26 0.00 0.00 57.72 57.81 1u86 n HIS 24 Cb 0.31 -1.06 0.33 0.00 1.12 0.00 0.00 29.99 30.68 1u86 n HIS 24 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1u86 h LEU 25 N -0.55 0.00 -0.29 2.41 5.85 -1.52 0.23 115.31 121.44 1u86 h LEU 25 Ca -0.53 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.08 1u86 h LEU 25 Cb 1.69 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.72 1u86 h LEU 25 CO -0.19 0.32 -0.26 0.00 -0.34 0.00 0.00 178.44 177.98 1u86 h ALA 26 N 1.68 0.43 0.06 1.25 0.00 -1.57 0.33 119.26 121.45 1u86 h ALA 26 Ca -0.00 -0.39 -0.26 0.00 0.00 0.00 0.00 54.91 54.26 1u86 h ALA 26 Cb 0.93 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.63 1u86 h ALA 26 CO 0.04 0.42 -1.10 1.37 0.00 0.00 0.00 179.25 179.98 1u86 h LEU 27 N 0.44 0.63 -1.34 0.00 8.10 -1.57 -1.98 115.31 119.60 1u86 h LEU 27 Ca 0.05 -0.56 0.04 0.00 0.11 0.00 0.00 57.88 57.52 1u86 h LEU 27 Cb 0.82 -0.20 -0.04 0.00 -0.44 0.00 0.00 40.66 40.80 1u86 h LEU 27 CO 0.07 1.38 0.47 -0.74 -4.11 0.00 0.00 178.44 175.51 1u86 h HIS 28 N 0.22 0.82 0.03 0.17 2.76 -0.48 0.49 115.15 119.16 1u86 h HIS 28 Ca -0.13 0.02 -0.23 0.00 -2.20 0.00 0.00 60.37 57.83 1u86 h HIS 28 Cb 1.77 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 30.43 1u86 h HIS 28 CO 0.08 0.47 -1.13 0.00 -1.30 0.00 0.00 177.93 176.05 1u86 h ARG 29 N 0.85 0.07 0.00 5.26 3.08 -0.84 -3.06 114.38 119.74 1u86 h ARG 29 Ca 0.29 -0.11 -0.16 0.00 0.07 0.00 0.00 59.98 60.06 1u86 h ARG 29 Cb 0.08 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1u86 h ARG 29 CO -0.08 1.01 -0.76 1.57 -1.07 0.00 0.00 179.97 180.64 1u86 h LYS 30 N 0.02 0.00 0.00 0.04 2.10 -0.83 -2.73 116.57 115.17 1u86 h LYS 30 Ca -0.07 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.57 1u86 h LYS 30 Cb 1.84 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 33.17 1u86 h LYS 30 CO 0.14 0.76 -0.05 0.00 -2.00 0.00 0.00 179.45 178.30 1u86 h ARG 31 N 0.00 0.00 -0.00 0.07 2.47 -0.93 -2.26 114.38 113.73 1u86 h ARG 31 Ca -0.01 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.66 1u86 h ARG 31 Cb 1.35 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.66 1u86 h ARG 31 CO 0.10 0.05 -0.24 0.45 0.56 0.00 0.00 179.97 180.90 1u86 h HIS 32 N 0.00 0.01 0.00 3.04 3.86 -1.37 -1.97 115.15 118.71 1u86 h HIS 32 Ca -0.00 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1u86 h HIS 32 Cb 0.49 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.95 1u86 h HIS 32 CO 0.00 0.24 0.00 -1.33 0.86 0.00 0.00 177.93 177.70 1u86 n MET 33 N -4.26 0.29 -1.08 2.45 2.81 -0.85 -2.53 117.12 113.95 1u86 n MET 33 Ca -0.02 0.05 -0.16 0.00 -1.81 0.00 0.00 57.70 55.76 1u86 n MET 33 Cb 0.29 -1.50 0.20 0.00 -0.71 0.00 0.00 33.22 31.50 1u86 n MET 33 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1u86 n LEU 34 N -1.33 5.92 -0.04 4.03 4.77 -0.74 -5.17 117.00 124.44 1u86 n LEU 34 Ca 0.11 -3.61 0.00 0.00 -0.03 0.00 0.00 56.01 52.48 1u86 n LEU 34 Cb 0.22 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1u86 n LEU 34 CO 0.20 1.08 0.27 0.52 -1.33 0.00 0.00 177.39 178.13