#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 4.81 0.01 1.61 0.01 -1.26 -5.09 113.70 113.79 1u86 s SER 2 Ca 0.00 -0.15 -0.30 0.00 1.31 0.00 0.00 55.95 56.80 1u86 s SER 2 Cb 0.00 -1.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.06 1u86 s SER 2 CO 0.00 0.24 1.08 -0.89 0.41 0.00 0.00 173.24 174.08 1u86 s THR 3 N -1.13 4.50 -0.22 1.44 2.01 -1.26 -4.91 115.64 116.08 1u86 s THR 3 Ca 0.20 1.80 0.20 0.00 0.31 0.00 0.00 61.69 64.20 1u86 s THR 3 Cb -0.11 -4.15 0.03 0.00 0.01 0.00 0.00 72.50 68.28 1u86 s THR 3 CO 0.12 0.12 1.16 1.23 -0.69 0.00 0.00 174.62 176.56 1u86 h GLY 4 N 6.97 0.00 -4.24 4.40 0.00 -2.07 -3.44 103.07 104.69 1u86 h GLY 4 Ca -0.40 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.40 1u86 h GLY 4 CO 0.79 0.00 0.39 -0.42 0.00 0.00 0.00 176.54 177.29 1u86 s ILE 5 N -3.14 4.56 0.11 2.60 1.01 -1.26 -5.03 121.20 120.05 1u86 s ILE 5 Ca 0.01 2.00 -0.19 0.00 0.00 0.00 0.00 60.65 62.47 1u86 s ILE 5 Cb 0.08 -4.28 -0.07 0.00 0.01 0.00 0.00 42.46 38.21 1u86 s ILE 5 CO 0.77 0.24 0.59 -0.54 0.00 0.00 0.00 174.94 176.00 1u86 s LYS 6 N 0.41 4.17 0.14 2.79 -0.14 -1.26 -4.99 119.74 120.87 1u86 s LYS 6 Ca 0.50 0.71 0.08 0.00 -1.36 0.00 0.00 55.97 55.90 1u86 s LYS 6 Cb -0.23 -3.14 -0.17 0.00 -1.68 0.00 0.00 37.83 32.61 1u86 s LYS 6 CO 0.29 0.58 1.31 -1.00 -0.76 0.00 0.00 175.35 175.77 1u86 h PRO 7 N 4.22 0.00 -2.38 -1.68 0.13 -1.96 -3.34 132.00 126.99 1u86 h PRO 7 Ca -0.49 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 63.91 1u86 h PRO 7 Cb 1.21 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.15 1u86 h PRO 7 CO 0.64 0.93 1.63 1.19 -0.23 0.00 0.00 178.00 182.17 1u86 n PHE 8 N -3.34 2.52 -2.31 1.56 3.72 -0.58 -4.97 117.46 114.05 1u86 n PHE 8 Ca 0.00 -2.58 -0.41 0.00 -0.05 0.00 0.00 57.45 54.41 1u86 n PHE 8 Cb 0.91 -1.54 -0.03 0.00 -0.94 0.00 0.00 39.48 37.87 1u86 n PHE 8 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1u86 s GLN 9 N -2.34 4.43 0.00 -1.08 0.74 -1.26 -0.24 119.66 119.92 1u86 s GLN 9 Ca 0.50 1.93 -0.30 0.00 0.05 0.00 0.00 55.36 57.54 1u86 s GLN 9 Cb 0.23 -3.25 -0.04 0.00 1.10 0.00 0.00 33.01 31.06 1u86 s GLN 9 CO -0.15 -0.20 1.20 0.00 -0.55 0.00 0.00 175.29 175.59 1u86 n THR 11 N 4.27 2.84 -3.12 0.00 -1.04 -1.26 -3.55 114.28 112.42 1u86 n THR 11 Ca 0.10 -1.62 -0.39 0.00 -2.04 0.00 0.00 64.05 60.10 1u86 n THR 11 Cb 0.46 -0.60 -0.05 0.00 -1.82 0.00 0.00 70.33 68.32 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 -2.72 3.55 0.06 -1.42 -0.11 -1.26 -4.96 118.94 112.08 1u86 s TRP 12 Ca 0.47 1.14 -0.33 0.00 1.22 0.00 0.00 56.10 58.59 1u86 s TRP 12 Cb 0.39 -2.73 -0.18 0.00 -1.50 0.00 0.00 33.47 29.45 1u86 s TRP 12 CO 0.08 0.10 1.50 -1.35 -4.62 0.00 0.00 176.95 172.67 1u86 h PRO 13 N 6.78 -1.10 -0.12 5.86 0.11 -2.00 0.48 132.00 142.01 1u86 h PRO 13 Ca -0.41 0.07 -0.08 0.00 0.11 0.00 0.00 66.00 65.70 1u86 h PRO 13 Cb 1.19 0.25 -0.01 0.00 0.11 0.00 0.00 31.00 32.54 1u86 h PRO 13 CO 0.76 -0.73 -0.27 0.22 -0.21 0.00 0.00 178.00 177.76 1u86 h ASP 14 N -1.14 0.21 0.02 -2.05 3.58 -2.01 -3.32 116.42 111.72 1u86 h ASP 14 Ca -0.11 -0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.28 1u86 h ASP 14 Cb 0.90 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.89 1u86 h ASP 14 CO 0.14 0.49 -0.01 0.00 -2.88 0.00 0.00 179.24 176.98 1u86 n ASP 16 N -2.41 -6.90 -5.02 0.00 2.03 0.17 -5.02 116.55 99.40 1u86 n ASP 16 Ca -0.00 -0.55 -0.20 0.00 0.52 0.00 0.00 54.79 54.55 1u86 n ASP 16 Cb 0.01 -5.13 0.06 0.00 -0.72 0.00 0.00 41.12 35.34 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 -4.08 2.28 -0.23 -0.67 3.00 -1.23 -4.95 118.95 113.07 1u86 s ARG 17 Ca 0.33 -1.71 -0.12 0.00 0.00 0.00 0.00 55.73 54.23 1u86 s ARG 17 Cb -0.05 -2.58 0.08 0.00 0.00 0.00 0.00 34.95 32.40 1u86 s ARG 17 CO 0.75 -0.86 0.55 -1.54 0.00 0.00 0.00 175.30 174.20 1u86 s SER 18 N -4.64 -0.73 0.34 0.23 1.04 -1.26 -0.38 113.70 108.30 1u86 s SER 18 Ca 0.59 1.23 0.04 0.00 0.48 0.00 0.00 55.95 58.29 1u86 s SER 18 Cb -0.05 1.23 -0.06 0.00 0.10 0.00 0.00 66.02 67.23 1u86 s SER 18 CO 0.37 -0.22 0.06 -0.36 0.98 0.00 0.00 173.24 174.07 1u86 s PHE 19 N 1.76 2.02 0.00 5.02 0.40 0.67 -4.88 117.98 122.96 1u86 s PHE 19 Ca -0.09 -0.94 0.00 0.00 -0.60 0.00 0.00 56.93 55.30 1u86 s PHE 19 Cb -0.08 -1.34 0.00 0.00 0.51 0.00 0.00 43.02 42.11 1u86 s PHE 19 CO -0.16 0.05 0.12 -1.13 0.70 0.00 0.00 175.22 174.80 1u86 n SER 20 N -0.76 0.25 -4.47 1.36 3.41 -1.26 -1.53 113.62 110.62 1u86 n SER 20 Ca -0.03 -0.60 -0.39 0.00 -0.26 0.00 0.00 58.87 57.60 1u86 n SER 20 Cb 0.67 0.33 -0.11 0.00 -0.26 0.00 0.00 64.21 64.83 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 -0.33 3.44 0.50 4.33 3.00 -1.26 -4.96 118.95 123.67 1u86 s ARG 21 Ca 0.00 -0.65 0.31 0.00 0.00 0.00 0.00 55.73 55.38 1u86 s ARG 21 Cb 0.00 -3.62 1.12 0.00 0.00 0.00 0.00 34.95 32.45 1u86 s ARG 21 CO 0.00 -0.39 1.88 0.77 0.00 0.00 0.00 175.30 177.56 1u86 h SER 22 N 8.38 0.00 0.19 0.23 0.02 -1.98 -1.66 113.55 118.73 1u86 h SER 22 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1u86 h SER 22 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1u86 h SER 22 CO 0.61 0.00 -1.07 -0.67 -1.14 0.00 0.00 176.83 174.57 1u86 n ASP 23 N -3.01 0.70 -0.10 3.07 -0.08 -1.26 -3.40 116.55 112.47 1u86 n ASP 23 Ca 0.02 -0.55 -0.23 0.00 -1.51 0.00 0.00 54.79 52.52 1u86 n ASP 23 Cb 0.35 0.96 -0.12 0.00 2.34 0.00 0.00 41.12 44.66 1u86 n ASP 23 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1u86 n HIS 24 N -1.73 0.44 0.48 -0.67 8.25 -1.04 -3.49 115.22 117.45 1u86 n HIS 24 Ca 0.03 0.13 0.12 0.00 -0.26 0.00 0.00 57.72 57.74 1u86 n HIS 24 Cb 0.39 -1.05 0.46 0.00 1.12 0.00 0.00 29.99 30.91 1u86 n HIS 24 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1u86 n LEU 25 N -3.77 0.72 -0.03 2.41 7.94 -0.65 -0.85 117.00 122.76 1u86 n LEU 25 Ca -0.43 0.63 -0.14 0.00 -1.11 0.00 0.00 56.01 54.96 1u86 n LEU 25 Cb 0.93 -0.49 -0.10 0.00 0.53 0.00 0.00 43.42 44.29 1u86 n LEU 25 CO 0.22 -0.43 0.50 0.00 -1.11 0.00 0.00 177.39 176.57 1u86 h ALA 26 N 2.36 0.09 -0.08 1.96 0.00 -1.69 -1.21 119.26 120.68 1u86 h ALA 26 Ca 0.00 -0.39 -0.18 0.00 0.00 0.00 0.00 54.91 54.34 1u86 h ALA 26 Cb 0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1u86 h ALA 26 CO 0.00 0.04 -0.73 1.37 0.00 0.00 0.00 179.25 179.93 1u86 h LEU 27 N -0.34 0.48 -1.62 0.00 8.10 -1.53 0.21 115.31 120.61 1u86 h LEU 27 Ca -0.01 -0.31 0.03 0.00 0.11 0.00 0.00 57.88 57.70 1u86 h LEU 27 Cb 0.82 -0.14 -0.02 0.00 -0.44 0.00 0.00 40.66 40.88 1u86 h LEU 27 CO 0.04 1.05 0.30 -0.74 -4.11 0.00 0.00 178.44 174.98 1u86 h HIS 28 N 0.27 0.48 0.00 0.17 2.76 -1.02 -1.55 115.15 116.26 1u86 h HIS 28 Ca -0.03 0.01 -0.19 0.00 -2.20 0.00 0.00 60.37 57.96 1u86 h HIS 28 Cb 1.30 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 30.07 1u86 h HIS 28 CO 0.04 0.28 -1.47 0.54 -1.30 0.00 0.00 177.93 176.02 1u86 n ARG 29 N -4.48 0.62 -0.11 5.26 1.74 -0.46 -3.22 116.66 116.02 1u86 n ARG 29 Ca 0.05 0.24 -0.12 0.00 -0.77 0.00 0.00 57.85 57.25 1u86 n ARG 29 Cb 0.14 -1.81 -0.03 0.00 -1.02 0.00 0.00 32.46 29.75 1u86 n ARG 29 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1u86 h LYS 30 N 0.00 0.68 0.00 5.56 6.56 0.09 -2.43 116.57 127.03 1u86 h LYS 30 Ca -0.19 -0.28 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 1u86 h LYS 30 Cb 1.67 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 33.30 1u86 h LYS 30 CO 0.05 0.87 0.00 2.89 -2.06 0.00 0.00 179.45 181.21 1u86 n ARG 31 N -4.37 0.02 -0.12 3.15 1.85 -0.65 -3.18 116.66 113.35 1u86 n ARG 31 Ca -0.02 0.08 -0.10 0.00 -1.00 0.00 0.00 57.85 56.80 1u86 n ARG 31 Cb 0.37 -1.53 -0.02 0.00 -1.05 0.00 0.00 32.46 30.24 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 0.67 -0.17 2.89 3.86 -1.40 -2.57 115.15 118.43 1u86 h HIS 32 Ca 0.00 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1u86 h HIS 32 Cb 0.45 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1u86 h HIS 32 CO 0.00 0.69 0.00 0.00 0.86 0.00 0.00 177.93 179.48 1u86 n MET 33 N -4.53 1.43 -2.53 2.45 0.00 -1.19 -3.97 117.12 108.78 1u86 n MET 33 Ca -0.01 -0.66 -0.33 0.00 0.00 0.00 0.00 57.70 56.70 1u86 n MET 33 Cb 0.25 -1.19 0.00 0.00 0.00 0.00 0.00 33.22 32.28 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 0.00 5.86 -0.55 3.17 4.32 -0.97 -5.14 117.00 123.69 1u86 n LEU 34 Ca 0.08 -5.31 0.14 0.00 -0.02 0.00 0.00 56.01 50.90 1u86 n LEU 34 Cb 0.17 -0.78 0.47 0.00 -1.62 0.00 0.00 43.42 41.66 1u86 n LEU 34 CO 0.06 2.13 0.84 1.33 -1.22 0.00 0.00 177.39 180.52