#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 0.49 -2.39 1.61 7.64 -1.26 -3.64 113.62 116.07 1u86 n SER 2 Ca 0.00 0.35 -0.33 0.00 1.01 0.00 0.00 58.87 59.90 1u86 n SER 2 Cb 0.00 -0.37 0.05 0.00 -1.01 0.00 0.00 64.21 62.88 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 -1.88 3.30 -0.05 0.44 -1.04 -1.26 -4.49 114.28 109.30 1u86 n THR 3 Ca 0.06 -3.62 -0.08 0.00 -2.04 0.00 0.00 64.05 58.37 1u86 n THR 3 Cb 0.39 -1.18 -0.05 0.00 -1.82 0.00 0.00 70.33 67.67 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 -0.77 -0.14 3.55 3.41 0.00 -1.24 -4.90 105.19 105.10 1u86 n GLY 4 Ca 0.55 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.20 3.70 0.58 -0.61 -1.09 -1.26 -4.87 121.20 115.44 1u86 s ILE 5 Ca -0.14 0.38 -0.14 0.00 -2.23 0.00 0.00 60.65 58.53 1u86 s ILE 5 Cb 0.04 -4.86 -0.05 0.00 -1.58 0.00 0.00 42.46 36.01 1u86 s ILE 5 CO 0.23 -1.80 1.01 -0.54 -1.23 0.00 0.00 174.94 172.61 1u86 s LYS 6 N 5.82 3.71 0.51 2.79 -0.14 -1.26 -4.96 119.74 126.20 1u86 s LYS 6 Ca 0.37 0.87 0.30 0.00 -1.36 0.00 0.00 55.97 56.15 1u86 s LYS 6 Cb -0.08 -2.10 0.97 0.00 -1.68 0.00 0.00 37.83 34.94 1u86 s LYS 6 CO 0.15 -0.47 1.84 -1.00 -0.76 0.00 0.00 175.35 175.11 1u86 h PRO 7 N 0.24 0.00 -1.84 -1.68 0.13 -1.95 -3.04 132.00 123.87 1u86 h PRO 7 Ca -0.45 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.96 1u86 h PRO 7 Cb 1.19 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.00 1u86 h PRO 7 CO 0.61 0.00 0.51 1.19 -0.23 0.00 0.00 178.00 180.09 1u86 n PHE 8 N -3.09 3.11 -2.46 1.56 3.01 -0.98 -5.02 117.46 113.60 1u86 n PHE 8 Ca 0.02 -2.57 -0.40 0.00 1.01 0.00 0.00 57.45 55.51 1u86 n PHE 8 Cb 0.39 -0.85 -0.04 0.00 -0.01 0.00 0.00 39.48 38.97 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 -3.91 4.62 -0.13 -1.08 0.74 -1.15 -0.36 119.66 118.39 1u86 s GLN 9 Ca 0.51 1.82 -0.29 0.00 0.05 0.00 0.00 55.36 57.45 1u86 s GLN 9 Cb 0.43 -3.19 -0.01 0.00 1.10 0.00 0.00 33.01 31.34 1u86 s GLN 9 CO -0.34 0.18 1.14 0.00 -0.55 0.00 0.00 175.29 175.73 1u86 n THR 11 N 4.96 1.66 -2.69 0.00 -1.04 -1.26 -3.70 114.28 112.21 1u86 n THR 11 Ca 0.12 -0.77 -0.42 0.00 -2.04 0.00 0.00 64.05 60.93 1u86 n THR 11 Cb 0.46 -0.58 -0.03 0.00 -1.82 0.00 0.00 70.33 68.37 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 -1.67 3.53 0.13 -1.42 -0.11 -1.26 -4.94 118.94 113.19 1u86 s TRP 12 Ca 0.26 1.61 -0.17 0.00 1.22 0.00 0.00 56.10 59.02 1u86 s TRP 12 Cb 0.21 -3.18 -0.02 0.00 -1.50 0.00 0.00 33.47 28.98 1u86 s TRP 12 CO 0.06 -0.20 1.67 -1.35 -4.62 0.00 0.00 176.95 172.52 1u86 h PRO 13 N 7.06 0.54 0.00 5.86 0.11 -2.00 0.28 132.00 143.84 1u86 h PRO 13 Ca -0.32 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1u86 h PRO 13 Cb 1.16 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1u86 h PRO 13 CO 0.84 0.52 -0.22 0.22 -0.21 0.00 0.00 178.00 179.15 1u86 h ASP 14 N 0.43 0.00 0.00 -2.05 3.58 -1.99 -3.39 116.42 113.00 1u86 h ASP 14 Ca 0.12 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.55 1u86 h ASP 14 Cb 0.18 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.23 1u86 h ASP 14 CO -0.01 0.01 -0.10 0.00 -2.88 0.00 0.00 179.24 176.26 1u86 n ASP 16 N -2.66 -5.22 -4.98 0.00 2.03 0.97 -5.02 116.55 101.68 1u86 n ASP 16 Ca -0.01 -0.63 -0.20 0.00 0.52 0.00 0.00 54.79 54.47 1u86 n ASP 16 Cb 0.05 -4.77 0.03 0.00 -0.72 0.00 0.00 41.12 35.71 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 -4.50 2.67 -0.06 -0.67 3.00 -1.24 -4.92 118.95 113.23 1u86 s ARG 17 Ca 0.32 -0.85 -0.02 0.00 0.00 0.00 0.00 55.73 55.17 1u86 s ARG 17 Cb -0.04 -2.56 0.04 0.00 0.00 0.00 0.00 34.95 32.39 1u86 s ARG 17 CO 0.67 -0.55 0.13 -1.54 0.00 0.00 0.00 175.30 174.00 1u86 s SER 18 N -4.38 0.21 0.38 0.23 1.04 -1.26 0.42 113.70 110.33 1u86 s SER 18 Ca 0.55 0.25 0.06 0.00 0.48 0.00 0.00 55.95 57.30 1u86 s SER 18 Cb -0.10 0.15 -0.07 0.00 0.10 0.00 0.00 66.02 66.09 1u86 s SER 18 CO 0.37 -0.18 0.03 -0.36 0.98 0.00 0.00 173.24 174.08 1u86 s PHE 19 N 1.50 2.30 0.00 5.02 0.40 0.51 -4.91 117.98 122.79 1u86 s PHE 19 Ca -0.05 -0.78 0.00 0.00 -0.60 0.00 0.00 56.93 55.49 1u86 s PHE 19 Cb -0.12 -1.58 0.00 0.00 0.51 0.00 0.00 43.02 41.83 1u86 s PHE 19 CO -0.05 0.28 0.06 -1.13 0.70 0.00 0.00 175.22 175.07 1u86 n SER 20 N -0.86 0.11 -4.62 1.36 3.41 -1.26 -2.32 113.62 109.45 1u86 n SER 20 Ca -0.04 -0.49 -0.35 0.00 -0.26 0.00 0.00 58.87 57.73 1u86 n SER 20 Cb 0.67 0.72 -0.10 0.00 -0.26 0.00 0.00 64.21 65.24 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 -0.72 3.95 0.40 4.33 3.00 -1.26 -4.95 118.95 123.71 1u86 s ARG 21 Ca 0.00 -0.35 0.22 0.00 0.00 0.00 0.00 55.73 55.60 1u86 s ARG 21 Cb 0.00 -3.26 0.28 0.00 0.00 0.00 0.00 34.95 31.98 1u86 s ARG 21 CO 0.00 0.21 1.55 0.66 0.00 0.00 0.00 175.30 177.72 1u86 h SER 22 N 6.92 0.00 0.16 0.23 4.64 -1.97 -2.36 113.55 121.17 1u86 h SER 22 Ca -0.37 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.87 1u86 h SER 22 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1u86 h SER 22 CO 0.69 0.06 -1.92 -0.67 -0.87 0.00 0.00 176.83 174.12 1u86 n ASP 23 N -3.08 0.15 0.05 4.97 2.03 -1.26 -3.00 116.55 116.41 1u86 n ASP 23 Ca 0.03 0.06 -0.20 0.00 0.52 0.00 0.00 54.79 55.21 1u86 n ASP 23 Cb 0.55 1.53 -0.14 0.00 -0.72 0.00 0.00 41.12 42.35 1u86 n ASP 23 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 1u86 h HIS 24 N 0.00 0.61 0.00 -0.67 2.76 -1.98 -1.50 115.15 114.36 1u86 h HIS 24 Ca -0.11 -0.42 0.00 0.00 -2.20 0.00 0.00 60.37 57.65 1u86 h HIS 24 Cb 1.25 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 30.18 1u86 h HIS 24 CO 0.00 1.30 0.00 -0.11 -1.30 0.00 0.00 177.93 177.82 1u86 n LEU 25 N -4.10 0.00 -0.06 0.26 7.94 -0.89 -0.44 117.00 119.70 1u86 n LEU 25 Ca -0.13 0.24 -0.19 0.00 -1.11 0.00 0.00 56.01 54.82 1u86 n LEU 25 Cb 0.82 -0.24 -0.13 0.00 0.53 0.00 0.00 43.42 44.41 1u86 n LEU 25 CO 0.50 -0.01 -0.11 0.00 -1.11 0.00 0.00 177.39 176.66 1u86 h ALA 26 N 3.48 0.13 -0.08 1.96 0.00 -1.43 -2.93 119.26 120.38 1u86 h ALA 26 Ca 0.00 -0.88 -0.18 0.00 0.00 0.00 0.00 54.91 53.85 1u86 h ALA 26 Cb 0.23 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1u86 h ALA 26 CO 0.00 0.43 -0.72 1.37 0.00 0.00 0.00 179.25 180.33 1u86 h LEU 27 N -0.85 0.47 -1.28 0.00 8.10 -1.11 -0.83 115.31 119.79 1u86 h LEU 27 Ca -0.19 -0.31 -0.01 0.00 0.11 0.00 0.00 57.88 57.48 1u86 h LEU 27 Cb 1.27 -0.14 -0.03 0.00 -0.44 0.00 0.00 40.66 41.33 1u86 h LEU 27 CO -0.06 1.04 0.30 -0.74 -4.11 0.00 0.00 178.44 174.86 1u86 h HIS 28 N 0.27 0.77 0.00 0.17 2.76 -0.91 -1.41 115.15 116.80 1u86 h HIS 28 Ca -0.03 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.11 1u86 h HIS 28 Cb 1.29 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 30.00 1u86 h HIS 28 CO 0.04 0.55 -0.24 0.00 -1.30 0.00 0.00 177.93 176.99 1u86 h ARG 29 N 0.79 0.00 -0.25 5.26 3.08 -1.28 -3.16 114.38 118.81 1u86 h ARG 29 Ca 0.20 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.08 1u86 h ARG 29 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1u86 h ARG 29 CO -0.03 0.09 -0.54 0.87 -1.07 0.00 0.00 179.97 179.29 1u86 h LYS 30 N 0.00 0.75 0.00 0.04 6.56 -0.12 -2.58 116.57 121.22 1u86 h LYS 30 Ca -0.00 -0.47 0.00 0.00 -1.06 0.00 0.00 60.65 59.11 1u86 h LYS 30 Cb 1.08 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.79 1u86 h LYS 30 CO 0.01 1.10 0.00 0.54 -2.06 0.00 0.00 179.45 179.04 1u86 n ARG 31 N -3.99 0.07 0.11 3.15 5.12 -0.74 -1.04 116.66 119.34 1u86 n ARG 31 Ca -0.04 0.34 -0.23 0.00 -1.93 0.00 0.00 57.85 55.99 1u86 n ARG 31 Cb 0.62 -1.63 -0.15 0.00 -1.16 0.00 0.00 32.46 30.13 1u86 n ARG 31 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1u86 h HIS 32 N 0.00 0.85 0.00 -1.55 3.86 -1.48 -3.33 115.15 113.50 1u86 h HIS 32 Ca 0.00 -0.62 -0.03 0.00 -1.16 0.00 0.00 60.37 58.56 1u86 h HIS 32 Cb 0.25 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 1u86 h HIS 32 CO 0.00 1.48 -0.77 0.00 0.86 0.00 0.00 177.93 179.49 1u86 h MET 33 N -0.01 0.00 -2.36 2.45 -0.00 -1.39 -3.36 114.93 110.26 1u86 h MET 33 Ca -0.22 0.00 -0.78 0.00 -0.00 0.00 0.00 59.70 58.71 1u86 h MET 33 Cb 1.99 0.00 -0.29 0.00 -0.00 0.00 0.00 31.60 33.29 1u86 h MET 33 CO 0.24 0.08 0.74 1.28 -0.00 0.00 0.00 176.91 179.25 1u86 n LEU 34 N -2.85 6.76 0.00 -0.10 4.77 -0.21 -5.13 117.00 120.24 1u86 n LEU 34 Ca -0.00 -5.40 0.00 0.00 -0.03 0.00 0.00 56.01 50.57 1u86 n LEU 34 Cb 0.60 -1.09 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 1u86 n LEU 34 CO 0.39 2.03 0.00 0.55 -1.33 0.00 0.00 177.39 179.03