#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u86 s SER 2 N 0.00 6.67 -0.58 1.61 0.01 -1.26 -4.97 113.70 115.18 1u86 s SER 2 Ca 0.00 0.79 -0.07 0.00 1.31 0.00 0.00 55.95 57.98 1u86 s SER 2 Cb 0.00 -2.21 -0.21 0.00 0.21 0.00 0.00 66.02 63.81 1u86 s SER 2 CO 0.00 0.28 3.38 0.41 0.41 0.00 0.00 173.24 177.72 1u86 n THR 3 N 2.28 3.46 -1.56 1.44 -1.04 -1.26 -4.28 114.28 113.32 1u86 n THR 3 Ca -0.14 -1.88 -0.07 0.00 -2.04 0.00 0.00 64.05 59.93 1u86 n THR 3 Cb 0.53 -2.22 0.17 0.00 -1.82 0.00 0.00 70.33 66.99 1u86 n THR 3 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1u86 n GLY 4 N 2.89 5.20 3.08 3.41 0.00 -1.26 -4.88 105.19 113.62 1u86 n GLY 4 Ca 0.56 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.74 1u86 n GLY 4 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u86 s ILE 5 N -3.51 3.49 0.10 -0.61 -1.09 -1.26 -4.86 121.20 113.47 1u86 s ILE 5 Ca 0.45 -2.91 0.04 0.00 -2.23 0.00 0.00 60.65 56.00 1u86 s ILE 5 Cb 0.41 -3.31 -0.04 0.00 -1.58 0.00 0.00 42.46 37.94 1u86 s ILE 5 CO -0.01 -0.84 -0.12 -0.54 -1.23 0.00 0.00 174.94 172.20 1u86 s LYS 6 N 0.04 0.88 0.27 2.79 -0.14 -1.26 -5.04 119.74 117.28 1u86 s LYS 6 Ca 0.16 -1.14 0.11 0.00 -1.36 0.00 0.00 55.97 53.74 1u86 s LYS 6 Cb -0.21 -0.66 0.33 0.00 -1.68 0.00 0.00 37.83 35.60 1u86 s LYS 6 CO -0.03 0.12 1.59 -1.00 -0.76 0.00 0.00 175.35 175.27 1u86 h PRO 7 N 3.66 0.00 -2.20 -1.68 0.13 -1.98 -3.22 132.00 126.71 1u86 h PRO 7 Ca -0.38 0.00 -0.76 0.00 -0.87 0.00 0.00 66.00 63.99 1u86 h PRO 7 Cb 1.19 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.08 1u86 h PRO 7 CO 0.50 0.63 1.18 1.19 -0.23 0.00 0.00 178.00 181.27 1u86 n PHE 8 N -3.72 2.70 -2.53 1.56 3.01 -1.03 -4.99 117.46 112.46 1u86 n PHE 8 Ca -0.01 -2.47 -0.41 0.00 1.01 0.00 0.00 57.45 55.58 1u86 n PHE 8 Cb 0.64 -1.30 -0.04 0.00 -0.01 0.00 0.00 39.48 38.76 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 -3.59 4.65 -0.05 -1.08 2.00 -1.22 -0.24 119.66 120.13 1u86 s GLN 9 Ca 0.47 1.72 -0.28 0.00 -2.00 0.00 0.00 55.36 55.27 1u86 s GLN 9 Cb 0.28 -3.24 -0.03 0.00 0.80 0.00 0.00 33.01 30.82 1u86 s GLN 9 CO -0.22 0.19 0.91 0.00 -0.50 0.00 0.00 175.29 175.67 1u86 n THR 11 N 4.07 2.43 -3.24 0.00 -1.04 -1.26 -3.94 114.28 111.30 1u86 n THR 11 Ca 0.05 -1.30 -0.38 0.00 -2.04 0.00 0.00 64.05 60.38 1u86 n THR 11 Cb 0.50 -0.86 -0.06 0.00 -1.82 0.00 0.00 70.33 68.10 1u86 n THR 11 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1u86 s TRP 12 N -1.95 3.51 0.05 -1.42 -0.11 -1.26 -4.97 118.94 112.79 1u86 s TRP 12 Ca 0.33 0.96 -0.34 0.00 1.22 0.00 0.00 56.10 58.28 1u86 s TRP 12 Cb 0.28 -2.62 -0.19 0.00 -1.50 0.00 0.00 33.47 29.43 1u86 s TRP 12 CO 0.04 0.12 1.50 -1.35 -4.62 0.00 0.00 176.95 172.65 1u86 h PRO 13 N 6.80 -1.04 -0.20 5.86 0.11 -2.00 0.26 132.00 141.79 1u86 h PRO 13 Ca -0.40 0.07 -0.12 0.00 0.11 0.00 0.00 66.00 65.65 1u86 h PRO 13 Cb 1.18 0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.52 1u86 h PRO 13 CO 0.76 -0.69 -0.40 0.22 -0.21 0.00 0.00 178.00 177.68 1u86 h ASP 14 N -1.15 0.48 0.00 -2.05 3.58 -2.00 -3.35 116.42 111.93 1u86 h ASP 14 Ca -0.11 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.13 1u86 h ASP 14 Cb 0.84 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.76 1u86 h ASP 14 CO 0.18 0.83 0.00 0.00 -2.88 0.00 0.00 179.24 177.38 1u86 n ASP 16 N -1.54 -6.19 -5.01 0.00 2.03 0.90 -5.02 116.55 101.72 1u86 n ASP 16 Ca 0.00 -0.64 -0.17 0.00 0.52 0.00 0.00 54.79 54.50 1u86 n ASP 16 Cb 0.00 -4.75 0.01 0.00 -0.72 0.00 0.00 41.12 35.66 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 -4.25 2.79 -0.11 -0.67 3.00 -1.25 -4.94 118.95 113.52 1u86 s ARG 17 Ca 0.41 -1.26 -0.05 0.00 0.00 0.00 0.00 55.73 54.83 1u86 s ARG 17 Cb -0.05 -2.75 0.05 0.00 0.00 0.00 0.00 34.95 32.20 1u86 s ARG 17 CO 0.67 -0.32 0.26 -1.54 0.00 0.00 0.00 175.30 174.37 1u86 s SER 18 N -4.37 -0.27 0.34 0.23 1.04 -1.26 0.32 113.70 109.72 1u86 s SER 18 Ca 0.55 0.55 0.06 0.00 0.48 0.00 0.00 55.95 57.60 1u86 s SER 18 Cb -0.10 0.44 -0.07 0.00 0.10 0.00 0.00 66.02 66.39 1u86 s SER 18 CO 0.33 -0.17 -0.00 -0.36 0.98 0.00 0.00 173.24 174.02 1u86 s PHE 19 N 1.29 2.19 0.00 5.02 0.40 0.67 -4.93 117.98 122.61 1u86 s PHE 19 Ca -0.09 -0.75 0.00 0.00 -0.60 0.00 0.00 56.93 55.49 1u86 s PHE 19 Cb -0.10 -1.42 0.00 0.00 0.51 0.00 0.00 43.02 42.01 1u86 s PHE 19 CO -0.09 0.28 0.08 0.43 0.70 0.00 0.00 175.22 176.63 1u86 n SER 20 N -0.77 0.17 -4.48 1.36 7.64 -1.26 -2.46 113.62 113.83 1u86 n SER 20 Ca -0.04 -0.55 -0.40 0.00 1.01 0.00 0.00 58.87 58.89 1u86 n SER 20 Cb 0.66 0.72 -0.11 0.00 -1.01 0.00 0.00 64.21 64.46 1u86 n SER 20 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1u86 s ARG 21 N -0.72 3.36 0.39 1.43 3.00 -1.26 -4.97 118.95 120.19 1u86 s ARG 21 Ca 0.00 -0.72 0.20 0.00 0.00 0.00 0.00 55.73 55.21 1u86 s ARG 21 Cb 0.00 -3.70 0.71 0.00 0.00 0.00 0.00 34.95 31.96 1u86 s ARG 21 CO 0.00 -0.46 1.74 0.66 0.00 0.00 0.00 175.30 177.24 1u86 h SER 22 N 8.43 0.00 0.18 0.23 4.64 -1.97 -1.76 113.55 123.30 1u86 h SER 22 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1u86 h SER 22 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1u86 h SER 22 CO 0.63 0.32 -0.20 -0.90 -0.87 0.00 0.00 176.83 175.82 1u86 n ASP 23 N -3.44 1.14 -0.13 4.97 5.75 -1.26 -2.77 116.55 120.81 1u86 n ASP 23 Ca 0.00 -1.03 -0.26 0.00 -0.01 0.00 0.00 54.79 53.49 1u86 n ASP 23 Cb 0.50 0.10 -0.09 0.00 -1.03 0.00 0.00 41.12 40.61 1u86 n ASP 23 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1u86 n HIS 24 N -0.46 0.00 0.30 2.11 8.25 -1.01 -3.96 115.22 120.46 1u86 n HIS 24 Ca 0.14 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.77 1u86 n HIS 24 Cb 0.35 -0.90 0.78 0.00 1.12 0.00 0.00 29.99 31.34 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 -0.99 0.00 -0.03 2.41 5.85 -1.48 0.29 115.31 121.36 1u86 h LEU 25 Ca -0.57 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.12 1u86 h LEU 25 Cb 1.50 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.53 1u86 h LEU 25 CO -0.35 0.00 -0.09 0.00 -0.34 0.00 0.00 178.44 177.66 1u86 h ALA 26 N 2.05 0.05 -0.07 1.25 0.00 -1.72 -0.67 119.26 120.16 1u86 h ALA 26 Ca 0.00 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.41 1u86 h ALA 26 Cb 0.29 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1u86 h ALA 26 CO 0.00 -0.08 -0.67 1.37 0.00 0.00 0.00 179.25 179.87 1u86 h LEU 27 N -0.44 0.37 -1.39 0.00 8.10 -1.53 0.22 115.31 120.63 1u86 h LEU 27 Ca -0.00 -0.23 0.02 0.00 0.11 0.00 0.00 57.88 57.77 1u86 h LEU 27 Cb 0.70 -0.11 -0.03 0.00 -0.44 0.00 0.00 40.66 40.77 1u86 h LEU 27 CO 0.02 0.94 0.42 -0.74 -4.11 0.00 0.00 178.44 174.97 1u86 h HIS 28 N 0.22 0.77 0.00 0.17 2.76 -0.46 -1.34 115.15 117.28 1u86 h HIS 28 Ca -0.02 0.02 -0.20 0.00 -2.20 0.00 0.00 60.37 57.97 1u86 h HIS 28 Cb 1.22 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.89 1u86 h HIS 28 CO 0.03 0.47 -1.13 0.00 -1.30 0.00 0.00 177.93 176.01 1u86 h ARG 29 N 0.82 0.00 -0.47 5.26 3.08 -0.69 -3.19 114.38 119.20 1u86 h ARG 29 Ca 0.24 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.21 1u86 h ARG 29 Cb -0.03 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1u86 h ARG 29 CO -0.06 0.68 -0.04 0.87 -1.07 0.00 0.00 179.97 180.35 1u86 h LYS 30 N 0.00 0.85 0.00 0.04 6.56 -0.16 -2.48 116.57 121.38 1u86 h LYS 30 Ca -0.10 -0.29 0.00 0.00 -1.06 0.00 0.00 60.65 59.20 1u86 h LYS 30 Cb 1.72 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 33.32 1u86 h LYS 30 CO 0.09 0.92 0.00 2.89 -2.06 0.00 0.00 179.45 181.29 1u86 n ARG 31 N -4.32 0.31 -0.12 3.15 1.85 -0.58 -3.32 116.66 113.64 1u86 n ARG 31 Ca 0.00 0.04 -0.12 0.00 -1.00 0.00 0.00 57.85 56.77 1u86 n ARG 31 Cb 0.34 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 30.25 1u86 n ARG 31 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1u86 h HIS 32 N 0.00 1.08 -0.29 2.89 3.86 -1.42 -2.77 115.15 118.51 1u86 h HIS 32 Ca 0.00 -0.31 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 1u86 h HIS 32 Cb 0.28 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.52 1u86 h HIS 32 CO 0.00 1.12 0.00 0.00 0.86 0.00 0.00 177.93 179.91 1u86 n MET 33 N -4.07 1.92 -2.67 2.45 0.00 -1.21 -4.16 117.12 109.39 1u86 n MET 33 Ca -0.02 -1.14 -0.29 0.00 0.00 0.00 0.00 57.70 56.25 1u86 n MET 33 Cb 0.52 -1.38 -0.01 0.00 0.00 0.00 0.00 33.22 32.35 1u86 n MET 33 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1u86 n LEU 34 N 0.35 5.10 0.00 3.17 4.32 -1.04 -5.16 117.00 123.74 1u86 n LEU 34 Ca 0.10 -5.43 0.00 0.00 -0.02 0.00 0.00 56.01 50.66 1u86 n LEU 34 Cb 0.35 -0.63 0.00 0.00 -1.62 0.00 0.00 43.42 41.52 1u86 n LEU 34 CO 0.08 2.24 0.12 1.33 -1.22 0.00 0.00 177.39 179.95