#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u86 h SER 2 N 0.00 -0.82 -2.58 1.61 4.64 -2.12 -3.31 113.55 110.98 1u86 h SER 2 Ca 0.00 0.07 -0.62 0.00 -0.47 0.00 0.00 61.79 60.77 1u86 h SER 2 Cb 0.00 0.27 -0.41 0.00 -0.31 0.00 0.00 62.40 61.95 1u86 h SER 2 CO 0.00 -0.45 -0.54 0.41 -0.87 0.00 0.00 176.83 175.38 1u86 n THR 3 N -5.43 2.19 -0.10 2.95 -1.04 -1.26 -4.77 114.28 106.82 1u86 n THR 3 Ca -0.10 -5.11 -0.11 0.00 -2.04 0.00 0.00 64.05 56.70 1u86 n THR 3 Cb 0.33 -2.14 -0.15 0.00 -1.82 0.00 0.00 70.33 66.55 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 1.31 -0.90 3.50 3.41 0.00 -1.25 -4.83 105.19 106.43 1u86 n GLY 4 Ca 0.26 -0.31 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.48 5.04 -0.07 -0.61 1.09 -1.26 -5.07 121.20 117.83 1u86 s ILE 5 Ca -0.13 -0.29 -0.01 0.00 -1.10 0.00 0.00 60.65 59.13 1u86 s ILE 5 Cb 0.06 -3.58 -0.03 0.00 -1.06 0.00 0.00 42.46 37.85 1u86 s ILE 5 CO 0.78 0.02 -0.00 -0.54 -0.10 0.00 0.00 174.94 175.10 1u86 s LYS 6 N 1.68 2.94 0.18 2.79 1.02 -1.26 -5.01 119.74 122.08 1u86 s LYS 6 Ca 0.06 -0.44 0.05 0.00 0.02 0.00 0.00 55.97 55.65 1u86 s LYS 6 Cb -0.17 -2.76 0.04 0.00 -0.52 0.00 0.00 37.83 34.41 1u86 s LYS 6 CO 0.09 0.69 1.41 -1.00 -0.92 0.00 0.00 175.35 175.62 1u86 h PRO 7 N 5.06 0.12 -2.24 -1.68 0.13 -1.99 -3.26 132.00 128.13 1u86 h PRO 7 Ca -0.50 -0.13 -0.54 0.00 -0.87 0.00 0.00 66.00 63.96 1u86 h PRO 7 Cb 1.19 0.04 -0.14 0.00 0.13 0.00 0.00 31.00 32.22 1u86 h PRO 7 CO 0.54 0.89 1.08 1.19 -0.23 0.00 0.00 178.00 181.47 1u86 n PHE 8 N -3.63 1.73 -2.61 1.56 3.01 -1.10 -4.95 117.46 111.47 1u86 n PHE 8 Ca -0.02 -2.21 -0.41 0.00 1.01 0.00 0.00 57.45 55.82 1u86 n PHE 8 Cb 0.79 -1.60 -0.04 0.00 -0.01 0.00 0.00 39.48 38.62 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 -0.99 4.60 -0.15 -1.08 0.74 -1.23 0.16 119.66 121.71 1u86 s GLN 9 Ca 0.59 1.57 -0.29 0.00 0.05 0.00 0.00 55.36 57.28 1u86 s GLN 9 Cb 0.31 -3.36 -0.01 0.00 1.10 0.00 0.00 33.01 31.05 1u86 s GLN 9 CO -0.15 0.06 1.18 0.00 -0.55 0.00 0.00 175.29 175.83 1u86 n THR 11 N 5.10 1.45 -2.85 0.00 -2.24 -1.26 -3.69 114.28 110.80 1u86 n THR 11 Ca 0.12 -0.57 -0.41 0.00 -2.27 0.00 0.00 64.05 60.93 1u86 n THR 11 Cb 0.46 -0.69 -0.05 0.00 -2.10 0.00 0.00 70.33 67.95 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 -1.25 3.78 0.00 4.78 -0.11 -1.26 -4.96 118.94 119.91 1u86 s TRP 12 Ca 0.18 1.65 -0.25 0.00 1.22 0.00 0.00 56.10 58.90 1u86 s TRP 12 Cb 0.15 -2.95 -0.18 0.00 -1.50 0.00 0.00 33.47 28.99 1u86 s TRP 12 CO 0.04 0.24 1.31 -1.35 -4.62 0.00 0.00 176.95 172.56 1u86 h PRO 13 N 5.62 -0.12 0.00 5.86 0.11 -2.01 -0.02 132.00 141.45 1u86 h PRO 13 Ca -0.43 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1u86 h PRO 13 Cb 1.21 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1u86 h PRO 13 CO 0.71 0.26 -0.25 -3.47 -0.21 0.00 0.00 178.00 175.04 1u86 n ASP 14 N -4.97 0.32 -0.02 -2.05 -0.08 -1.26 -4.26 116.55 104.23 1u86 n ASP 14 Ca -0.08 0.18 -0.02 0.00 -1.51 0.00 0.00 54.79 53.36 1u86 n ASP 14 Cb 0.22 -0.17 -0.01 0.00 2.34 0.00 0.00 41.12 43.50 1u86 n ASP 14 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1u86 n ASP 16 N -3.05 -3.89 -4.99 0.00 2.03 -0.02 -5.03 116.55 101.60 1u86 n ASP 16 Ca -0.03 -0.56 -0.18 0.00 0.52 0.00 0.00 54.79 54.54 1u86 n ASP 16 Cb 0.11 -4.42 0.01 0.00 -0.72 0.00 0.00 41.12 36.11 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 -4.67 2.65 -0.18 -0.67 3.00 -1.24 -4.97 118.95 112.88 1u86 s ARG 17 Ca 0.18 -1.40 -0.13 0.00 0.00 0.00 0.00 55.73 54.39 1u86 s ARG 17 Cb -0.02 -2.65 0.05 0.00 0.00 0.00 0.00 34.95 32.33 1u86 s ARG 17 CO 0.62 -0.39 0.44 -1.54 0.00 0.00 0.00 175.30 174.43 1u86 s SER 18 N -4.38 -0.52 0.36 0.23 1.04 -1.26 -0.01 113.70 109.16 1u86 s SER 18 Ca 0.55 0.94 0.03 0.00 0.48 0.00 0.00 55.95 57.95 1u86 s SER 18 Cb -0.08 0.87 -0.04 0.00 0.10 0.00 0.00 66.02 66.88 1u86 s SER 18 CO 0.33 -0.18 0.10 -0.36 0.98 0.00 0.00 173.24 174.11 1u86 s PHE 19 N 0.88 1.81 0.00 5.02 0.40 0.12 -4.89 117.98 121.33 1u86 s PHE 19 Ca -0.05 -1.16 0.00 0.00 -0.60 0.00 0.00 56.93 55.11 1u86 s PHE 19 Cb -0.06 -1.17 0.00 0.00 0.51 0.00 0.00 43.02 42.31 1u86 s PHE 19 CO -0.07 -0.20 0.11 -1.13 0.70 0.00 0.00 175.22 174.63 1u86 n SER 20 N -0.99 0.22 -4.51 1.36 3.41 -1.26 -2.70 113.62 109.15 1u86 n SER 20 Ca -0.04 -0.60 -0.39 0.00 -0.26 0.00 0.00 58.87 57.58 1u86 n SER 20 Cb 0.66 0.24 -0.11 0.00 -0.26 0.00 0.00 64.21 64.73 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 -0.24 3.59 0.48 4.33 3.00 -1.26 -4.96 118.95 123.89 1u86 s ARG 21 Ca 0.00 -0.55 0.31 0.00 0.00 0.00 0.00 55.73 55.49 1u86 s ARG 21 Cb 0.00 -3.62 1.26 0.00 0.00 0.00 0.00 34.95 32.58 1u86 s ARG 21 CO 0.00 -0.33 1.91 0.66 0.00 0.00 0.00 175.30 177.55 1u86 h SER 22 N 8.38 0.00 0.06 0.23 4.64 -1.98 -1.52 113.55 123.35 1u86 h SER 22 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1u86 h SER 22 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1u86 h SER 22 CO 0.60 0.00 -0.87 -0.90 -0.87 0.00 0.00 176.83 174.78 1u86 n ASP 23 N -2.89 1.06 -0.13 4.97 5.75 -1.26 -3.52 116.55 120.54 1u86 n ASP 23 Ca 0.01 -0.97 -0.21 0.00 -0.01 0.00 0.00 54.79 53.61 1u86 n ASP 23 Cb 0.29 0.84 -0.10 0.00 -1.03 0.00 0.00 41.12 41.12 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 -1.32 0.00 0.24 2.11 8.25 -0.93 -3.56 115.22 120.01 1u86 n HIS 24 Ca 0.05 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.64 1u86 n HIS 24 Cb 0.35 -0.93 0.49 0.00 1.12 0.00 0.00 29.99 31.01 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 -0.38 0.00 -0.20 2.41 5.85 -1.51 0.55 115.31 122.03 1u86 h LEU 25 Ca -0.59 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 57.94 1u86 h LEU 25 Cb 1.73 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.77 1u86 h LEU 25 CO -0.21 0.09 -0.63 0.00 -0.34 0.00 0.00 178.44 177.35 1u86 h ALA 26 N 1.91 0.34 -0.14 1.25 0.00 -1.75 0.68 119.26 121.56 1u86 h ALA 26 Ca -0.00 -0.55 -0.13 0.00 0.00 0.00 0.00 54.91 54.23 1u86 h ALA 26 Cb 0.71 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1u86 h ALA 26 CO 0.01 0.62 -0.41 -0.07 0.00 0.00 0.00 179.25 179.40 1u86 h LEU 27 N 0.52 0.61 -1.00 0.00 3.38 -1.49 0.11 115.31 117.43 1u86 h LEU 27 Ca -0.02 -0.59 0.05 0.00 0.09 0.00 0.00 57.88 57.41 1u86 h LEU 27 Cb 1.26 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.77 1u86 h LEU 27 CO 0.13 1.09 0.65 -0.74 0.09 0.00 0.00 178.44 179.67 1u86 h HIS 28 N 0.16 1.21 0.00 1.13 2.76 0.10 -0.01 115.15 120.49 1u86 h HIS 28 Ca -0.01 0.03 -0.14 0.00 -2.20 0.00 0.00 60.37 58.05 1u86 h HIS 28 Cb 1.03 -0.40 -0.02 0.00 1.55 0.00 0.00 27.41 29.57 1u86 h HIS 28 CO 0.10 0.66 -0.69 0.00 -1.30 0.00 0.00 177.93 176.70 1u86 h ARG 29 N 1.21 0.00 -0.51 5.26 3.08 -0.77 -3.11 114.38 119.54 1u86 h ARG 29 Ca 0.42 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.41 1u86 h ARG 29 Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 1u86 h ARG 29 CO -0.15 0.69 0.08 0.87 -1.07 0.00 0.00 179.97 180.39 1u86 h LYS 30 N 0.00 0.84 0.00 0.04 6.56 0.21 -1.98 116.57 122.25 1u86 h LYS 30 Ca -0.01 -0.23 -0.01 0.00 -1.06 0.00 0.00 60.65 59.35 1u86 h LYS 30 Cb 1.45 -0.10 -0.00 0.00 -0.57 0.00 0.00 32.23 33.01 1u86 h LYS 30 CO 0.09 0.83 -0.03 0.00 -2.06 0.00 0.00 179.45 178.29 1u86 h ARG 31 N 0.72 0.00 -0.04 3.15 3.08 -0.99 0.30 114.38 120.59 1u86 h ARG 31 Ca 0.15 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 1u86 h ARG 31 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1u86 h ARG 31 CO 0.01 0.03 -0.19 0.45 -1.07 0.00 0.00 179.97 179.20 1u86 h HIS 32 N 0.00 0.27 0.00 3.04 3.86 -1.30 -3.31 115.15 117.71 1u86 h HIS 32 Ca -0.00 -0.12 -0.05 0.00 -1.16 0.00 0.00 60.37 59.04 1u86 h HIS 32 Cb 0.12 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 1u86 h HIS 32 CO 0.00 0.83 -0.45 0.00 0.86 0.00 0.00 177.93 179.17 1u86 h MET 33 N -0.37 0.00 -2.79 2.45 -0.00 -1.05 -3.35 114.93 109.82 1u86 h MET 33 Ca -0.01 0.00 -0.77 0.00 -0.00 0.00 0.00 59.70 58.92 1u86 h MET 33 Cb 0.85 0.00 -0.18 0.00 -0.00 0.00 0.00 31.60 32.26 1u86 h MET 33 CO 0.04 0.21 1.81 1.28 -0.00 0.00 0.00 176.91 180.25 1u86 n LEU 34 N -3.07 7.36 -0.72 -0.10 4.32 0.97 -5.11 117.00 120.65 1u86 n LEU 34 Ca 0.01 -4.99 0.09 0.00 -0.02 0.00 0.00 56.01 51.11 1u86 n LEU 34 Cb 0.64 -1.33 0.07 0.00 -1.62 0.00 0.00 43.42 41.18 1u86 n LEU 34 CO 0.38 1.85 0.53 1.33 -1.22 0.00 0.00 177.39 180.26