#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 7.34 -0.82 1.61 1.04 -1.26 -4.95 113.70 116.65 1u86 s SER 2 Ca 0.00 1.95 -0.02 0.00 0.48 0.00 0.00 55.95 58.36 1u86 s SER 2 Cb 0.00 -2.59 0.36 0.00 0.10 0.00 0.00 66.02 63.89 1u86 s SER 2 CO 0.00 -0.19 2.02 0.41 0.98 0.00 0.00 173.24 176.46 1u86 n THR 3 N 2.78 3.59 0.06 2.02 -1.04 -1.26 -4.51 114.28 115.92 1u86 n THR 3 Ca 0.03 -4.14 -0.07 0.00 -2.04 0.00 0.00 64.05 57.84 1u86 n THR 3 Cb 0.48 -1.23 -0.11 0.00 -1.82 0.00 0.00 70.33 67.64 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 2.87 0.00 -5.59 3.41 0.00 -2.06 -3.42 103.07 98.28 1u86 h GLY 4 Ca 0.57 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 47.32 1u86 h GLY 4 CO 1.45 0.00 0.79 -0.42 0.00 0.00 0.00 176.54 178.36 1u86 s ILE 5 N -2.72 4.58 0.00 2.60 1.01 -1.26 -5.03 121.20 120.38 1u86 s ILE 5 Ca 0.01 1.75 0.02 0.00 0.00 0.00 0.00 60.65 62.43 1u86 s ILE 5 Cb 0.10 -4.37 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1u86 s ILE 5 CO 0.82 -0.39 -0.01 -0.54 0.00 0.00 0.00 174.94 174.82 1u86 s LYS 6 N 3.48 2.73 0.19 2.79 1.02 -1.26 -5.02 119.74 123.67 1u86 s LYS 6 Ca 0.44 -0.64 0.05 0.00 0.02 0.00 0.00 55.97 55.84 1u86 s LYS 6 Cb -0.13 -2.63 0.09 0.00 -0.52 0.00 0.00 37.83 34.64 1u86 s LYS 6 CO 0.13 0.62 1.45 -1.00 -0.92 0.00 0.00 175.35 175.62 1u86 h PRO 7 N 4.35 0.15 -1.85 -1.68 0.13 -1.96 -3.15 132.00 127.98 1u86 h PRO 7 Ca -0.49 -0.14 -0.52 0.00 -0.87 0.00 0.00 66.00 63.98 1u86 h PRO 7 Cb 1.17 0.04 -0.19 0.00 0.13 0.00 0.00 31.00 32.15 1u86 h PRO 7 CO 0.57 0.86 0.52 1.19 -0.23 0.00 0.00 178.00 180.90 1u86 n PHE 8 N -3.70 1.88 -2.60 1.56 3.01 -1.11 -4.95 117.46 111.56 1u86 n PHE 8 Ca -0.02 -2.07 -0.41 0.00 1.01 0.00 0.00 57.45 55.95 1u86 n PHE 8 Cb 0.75 -1.28 -0.04 0.00 -0.01 0.00 0.00 39.48 38.89 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 -2.20 4.61 0.03 -1.08 0.74 -1.19 -0.27 119.66 120.30 1u86 s GLN 9 Ca 0.53 1.60 -0.30 0.00 0.05 0.00 0.00 55.36 57.24 1u86 s GLN 9 Cb 0.37 -3.34 -0.05 0.00 1.10 0.00 0.00 33.01 31.10 1u86 s GLN 9 CO -0.20 0.08 1.20 0.00 -0.55 0.00 0.00 175.29 175.81 1u86 n THR 11 N 4.11 0.74 -2.21 0.00 -1.04 -1.26 -3.71 114.28 110.91 1u86 n THR 11 Ca 0.09 -0.61 -0.42 0.00 -2.04 0.00 0.00 64.05 61.08 1u86 n THR 11 Cb 0.46 0.17 -0.03 0.00 -1.82 0.00 0.00 70.33 69.12 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 -1.53 2.96 0.08 -1.42 -0.11 -1.26 -4.90 118.94 112.75 1u86 s TRP 12 Ca 0.29 0.86 -0.32 0.00 1.22 0.00 0.00 56.10 58.14 1u86 s TRP 12 Cb 0.16 -3.67 -0.17 0.00 -1.50 0.00 0.00 33.47 28.30 1u86 s TRP 12 CO 0.18 -2.42 1.63 -1.35 -4.62 0.00 0.00 176.95 170.36 1u86 h PRO 13 N 7.56 -0.81 0.00 5.86 0.11 -2.01 0.26 132.00 142.98 1u86 h PRO 13 Ca -0.39 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1u86 h PRO 13 Cb 1.19 0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.48 1u86 h PRO 13 CO 0.89 -0.54 0.00 -0.40 -0.21 0.00 0.00 178.00 177.74 1u86 n ASP 14 N -5.47 0.00 0.00 -2.05 5.75 -1.26 -4.19 116.55 109.33 1u86 n ASP 14 Ca -0.12 -0.28 0.00 0.00 -0.01 0.00 0.00 54.79 54.37 1u86 n ASP 14 Cb 0.36 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 1u86 n ASP 14 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u86 n ASP 16 N -2.13 -4.49 -4.89 0.00 2.03 0.91 -5.03 116.55 102.96 1u86 n ASP 16 Ca 0.00 -0.49 -0.22 0.00 0.52 0.00 0.00 54.79 54.60 1u86 n ASP 16 Cb 0.00 -3.86 0.06 0.00 -0.72 0.00 0.00 41.12 36.60 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 -4.24 2.27 -0.19 -0.67 3.00 -1.24 -4.91 118.95 112.96 1u86 s ARG 17 Ca 0.25 -0.87 -0.10 0.00 0.00 0.00 0.00 55.73 55.00 1u86 s ARG 17 Cb -0.03 -2.43 0.06 0.00 0.00 0.00 0.00 34.95 32.55 1u86 s ARG 17 CO 0.53 -0.95 0.46 -1.54 0.00 0.00 0.00 175.30 173.80 1u86 s SER 18 N -4.53 -0.59 0.37 0.23 1.04 -1.26 0.20 113.70 109.17 1u86 s SER 18 Ca 0.60 1.02 0.04 0.00 0.48 0.00 0.00 55.95 58.08 1u86 s SER 18 Cb -0.09 0.92 -0.04 0.00 0.10 0.00 0.00 66.02 66.91 1u86 s SER 18 CO 0.40 -0.20 0.08 -0.36 0.98 0.00 0.00 173.24 174.14 1u86 s PHE 19 N 1.51 1.88 0.00 5.02 0.40 0.63 -4.90 117.98 122.51 1u86 s PHE 19 Ca -0.09 -1.10 0.00 0.00 -0.60 0.00 0.00 56.93 55.14 1u86 s PHE 19 Cb -0.08 -1.25 0.00 0.00 0.51 0.00 0.00 43.02 42.20 1u86 s PHE 19 CO -0.14 -0.11 0.14 -1.13 0.70 0.00 0.00 175.22 174.68 1u86 n SER 20 N -0.99 0.28 -4.61 1.36 3.41 -1.26 -2.75 113.62 109.06 1u86 n SER 20 Ca -0.05 -0.62 -0.36 0.00 -0.26 0.00 0.00 58.87 57.58 1u86 n SER 20 Cb 0.66 0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 64.85 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 -0.34 3.95 0.31 4.33 3.00 -1.26 -4.97 118.95 123.97 1u86 s ARG 21 Ca 0.00 -0.34 0.16 0.00 0.00 0.00 0.00 55.73 55.55 1u86 s ARG 21 Cb 0.00 -3.39 0.36 0.00 0.00 0.00 0.00 34.95 31.91 1u86 s ARG 21 CO 0.00 0.07 1.58 0.66 0.00 0.00 0.00 175.30 177.61 1u86 h SER 22 N 7.42 0.00 1.24 0.23 4.64 -1.97 -2.09 113.55 123.01 1u86 h SER 22 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 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 0.65 0.49 -0.72 -0.78 -0.87 0.00 0.00 176.83 175.60 1u86 h ASP 23 N 0.00 0.00 0.07 4.97 3.58 -1.98 -2.53 116.42 120.53 1u86 h ASP 23 Ca -0.00 -0.02 -0.20 0.00 0.42 0.00 0.00 57.03 57.23 1u86 h ASP 23 Cb 1.17 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 1u86 h ASP 23 CO 0.06 0.01 -1.02 0.45 -2.88 0.00 0.00 179.24 175.87 1u86 h HIS 24 N 0.00 0.28 0.00 0.28 3.86 -1.96 -2.88 115.15 114.74 1u86 h HIS 24 Ca 0.00 -0.20 0.00 0.00 -1.16 0.00 0.00 60.37 59.01 1u86 h HIS 24 Cb 0.98 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.43 1u86 h HIS 24 CO 0.00 1.40 0.00 1.25 0.86 0.00 0.00 177.93 181.44 1u86 h LEU 25 N -0.59 0.00 -0.02 2.43 5.85 -1.51 0.81 115.31 122.28 1u86 h LEU 25 Ca -0.23 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.33 1u86 h LEU 25 Cb 1.50 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.54 1u86 h LEU 25 CO 0.01 0.00 -0.63 0.00 -0.34 0.00 0.00 178.44 177.47 1u86 h ALA 26 N 2.27 0.10 -0.10 1.25 0.00 -1.56 -1.58 119.26 119.64 1u86 h ALA 26 Ca 0.00 -0.57 -0.21 0.00 0.00 0.00 0.00 54.91 54.13 1u86 h ALA 26 Cb 0.76 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1u86 h ALA 26 CO 0.00 0.39 -0.78 1.37 0.00 0.00 0.00 179.25 180.23 1u86 h LEU 27 N -0.01 0.70 -1.56 0.00 8.10 -1.37 -0.06 115.31 121.12 1u86 h LEU 27 Ca -0.07 -0.47 -0.02 0.00 0.11 0.00 0.00 57.88 57.43 1u86 h LEU 27 Cb 1.33 -0.21 -0.01 0.00 -0.44 0.00 0.00 40.66 41.32 1u86 h LEU 27 CO 0.13 1.24 0.10 -0.74 -4.11 0.00 0.00 178.44 175.05 1u86 h HIS 28 N 0.39 0.38 0.02 0.17 2.76 -0.88 -2.45 115.15 115.53 1u86 h HIS 28 Ca -0.05 -0.01 -0.28 0.00 -2.20 0.00 0.00 60.37 57.83 1u86 h HIS 28 Cb 1.39 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 30.19 1u86 h HIS 28 CO 0.07 0.32 -1.57 0.00 -1.30 0.00 0.00 177.93 175.44 1u86 h ARG 29 N 0.39 0.05 -0.05 5.26 3.08 -1.05 -3.28 114.38 118.78 1u86 h ARG 29 Ca 0.10 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 59.98 1u86 h ARG 29 Cb 0.11 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1u86 h ARG 29 CO -0.01 0.71 -0.36 1.57 -1.07 0.00 0.00 179.97 180.81 1u86 h LYS 30 N 0.01 0.10 0.00 0.04 -0.00 -0.73 -1.24 116.57 114.76 1u86 h LYS 30 Ca -0.24 -0.04 0.00 0.00 -0.00 0.00 0.00 60.65 60.37 1u86 h LYS 30 Cb 1.97 -0.01 0.00 0.00 -0.00 0.00 0.00 32.23 34.19 1u86 h LYS 30 CO 0.10 0.46 0.00 2.89 -0.00 0.00 0.00 179.45 182.90 1u86 n ARG 31 N -4.09 0.01 0.09 0.07 1.85 -0.95 -2.44 116.66 111.21 1u86 n ARG 31 Ca -0.02 0.04 -0.05 0.00 -1.00 0.00 0.00 57.85 56.82 1u86 n ARG 31 Cb 0.42 -1.51 0.08 0.00 -1.05 0.00 0.00 32.46 30.40 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 0.23 0.00 2.89 3.86 -1.28 -3.07 115.15 117.78 1u86 h HIS 32 Ca 0.00 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 59.09 1u86 h HIS 32 Cb 0.47 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 28.91 1u86 h HIS 32 CO 0.00 0.82 -0.08 0.52 0.86 0.00 0.00 177.93 180.05 1u86 h MET 33 N 0.12 0.00 -2.79 2.45 2.86 -1.45 -3.38 114.93 112.73 1u86 h MET 33 Ca -0.02 0.00 -0.60 0.00 -2.06 0.00 0.00 59.70 57.02 1u86 h MET 33 Cb 1.25 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 32.51 1u86 h MET 33 CO 0.10 0.08 -0.79 -1.17 1.06 0.00 0.00 176.91 176.19 1u86 s LEU 34 N -6.25 2.28 0.00 1.22 2.96 -1.16 -5.15 118.68 112.57 1u86 s LEU 34 Ca 0.06 -2.73 0.00 0.00 -0.22 0.00 0.00 54.13 51.24 1u86 s LEU 34 Cb 0.06 -0.84 0.00 0.00 0.50 0.00 0.00 46.19 45.91 1u86 s LEU 34 CO 0.67 -0.24 0.08 0.55 -1.32 0.00 0.00 176.35 176.10