#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 6.37 -0.43 1.61 0.01 -1.26 -4.83 113.70 115.18 1u86 s SER 2 Ca 0.00 -1.24 0.04 0.00 1.31 0.00 0.00 55.95 56.07 1u86 s SER 2 Cb 0.00 -2.50 0.44 0.00 0.21 0.00 0.00 66.02 64.17 1u86 s SER 2 CO 0.00 -1.48 1.36 0.41 0.41 0.00 0.00 173.24 173.94 1u86 n THR 3 N 6.25 2.73 0.43 1.44 -1.04 -1.26 -4.64 114.28 118.20 1u86 n THR 3 Ca 0.16 -4.21 0.11 0.00 -2.04 0.00 0.00 64.05 58.06 1u86 n THR 3 Cb 0.49 -1.18 -0.11 0.00 -1.82 0.00 0.00 70.33 67.70 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 -0.67 -1.05 3.52 3.41 0.00 -1.26 -4.66 105.19 104.48 1u86 n GLY 4 Ca 0.46 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.29 4.55 0.11 -0.61 1.09 -1.26 -4.76 121.20 117.03 1u86 s ILE 5 Ca -0.00 -2.19 0.10 0.00 -1.10 0.00 0.00 60.65 57.46 1u86 s ILE 5 Cb 0.15 -5.05 -0.04 0.00 -1.06 0.00 0.00 42.46 36.46 1u86 s ILE 5 CO 0.87 -1.82 -0.25 -0.54 -0.10 0.00 0.00 174.94 173.10 1u86 s LYS 6 N 3.00 1.55 0.26 2.79 -0.14 -1.26 -5.03 119.74 120.91 1u86 s LYS 6 Ca 0.48 -1.27 0.11 0.00 -1.36 0.00 0.00 55.97 53.93 1u86 s LYS 6 Cb 0.00 -1.96 0.28 0.00 -1.68 0.00 0.00 37.83 34.48 1u86 s LYS 6 CO 0.03 0.47 1.56 -1.00 -0.76 0.00 0.00 175.35 175.65 1u86 h PRO 7 N 4.00 0.00 -2.02 -1.68 0.13 -1.93 -3.18 132.00 127.33 1u86 h PRO 7 Ca -0.50 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.09 1u86 h PRO 7 Cb 1.17 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.11 1u86 h PRO 7 CO 0.41 0.65 0.53 1.19 -0.23 0.00 0.00 178.00 180.54 1u86 n PHE 8 N -3.64 1.79 -2.56 1.56 3.01 -1.18 -4.95 117.46 111.50 1u86 n PHE 8 Ca -0.01 -2.01 -0.42 0.00 1.01 0.00 0.00 57.45 56.02 1u86 n PHE 8 Cb 0.67 -1.37 -0.03 0.00 -0.01 0.00 0.00 39.48 38.74 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 -2.00 4.40 0.09 -1.08 2.00 -1.20 -0.03 119.66 121.83 1u86 s GLN 9 Ca 0.58 1.56 -0.31 0.00 -2.00 0.00 0.00 55.36 55.19 1u86 s GLN 9 Cb 0.39 -3.52 -0.08 0.00 0.80 0.00 0.00 33.01 30.59 1u86 s GLN 9 CO -0.24 -0.35 1.47 0.00 -0.50 0.00 0.00 175.29 175.66 1u86 n THR 11 N 4.26 1.98 -3.22 0.00 -1.04 -1.26 -4.08 114.28 110.93 1u86 n THR 11 Ca 0.13 -0.94 -0.40 0.00 -2.04 0.00 0.00 64.05 60.80 1u86 n THR 11 Cb 0.42 -0.63 -0.07 0.00 -1.82 0.00 0.00 70.33 68.23 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 -1.80 3.32 0.06 -1.42 -0.11 -1.26 -4.98 118.94 112.75 1u86 s TRP 12 Ca 0.30 0.73 -0.22 0.00 1.22 0.00 0.00 56.10 58.12 1u86 s TRP 12 Cb 0.25 -2.72 -0.14 0.00 -1.50 0.00 0.00 33.47 29.36 1u86 s TRP 12 CO 0.07 -0.21 1.56 -1.35 -4.62 0.00 0.00 176.95 172.39 1u86 h PRO 13 N 7.75 0.13 0.00 5.86 0.11 -2.00 0.36 132.00 144.21 1u86 h PRO 13 Ca -0.31 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1u86 h PRO 13 Cb 1.14 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1u86 h PRO 13 CO 0.73 0.30 0.00 0.22 -0.21 0.00 0.00 178.00 179.04 1u86 h ASP 14 N -0.06 0.00 0.00 -2.05 1.82 -2.00 -3.32 116.42 110.81 1u86 h ASP 14 Ca 0.03 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.66 1u86 h ASP 14 Cb 0.22 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.23 1u86 h ASP 14 CO -0.00 0.00 -0.45 0.00 -1.61 0.00 0.00 179.24 177.18 1u86 n ASP 16 N -4.64 -3.27 -4.94 0.00 2.03 0.13 -5.02 116.55 100.84 1u86 n ASP 16 Ca -0.07 -0.55 -0.23 0.00 0.52 0.00 0.00 54.79 54.45 1u86 n ASP 16 Cb 0.24 -4.48 -0.03 0.00 -0.72 0.00 0.00 41.12 36.12 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 -4.86 3.37 -0.11 -0.67 3.00 -1.26 -4.99 118.95 113.44 1u86 s ARG 17 Ca 0.12 -0.72 -0.05 0.00 0.00 0.00 0.00 55.73 55.08 1u86 s ARG 17 Cb -0.02 -2.88 0.05 0.00 0.00 0.00 0.00 34.95 32.10 1u86 s ARG 17 CO 0.63 0.47 0.25 -1.54 0.00 0.00 0.00 175.30 175.10 1u86 s SER 18 N -3.63 -0.20 0.36 0.23 1.04 -1.26 0.25 113.70 110.50 1u86 s SER 18 Ca 0.34 0.54 0.09 0.00 0.48 0.00 0.00 55.95 57.39 1u86 s SER 18 Cb -0.10 0.45 -0.07 0.00 0.10 0.00 0.00 66.02 66.40 1u86 s SER 18 CO 0.28 -0.17 -0.06 -0.36 0.98 0.00 0.00 173.24 173.90 1u86 s PHE 19 N 1.40 2.44 -0.00 5.02 0.40 0.96 -4.91 117.98 123.28 1u86 s PHE 19 Ca -0.08 -0.55 0.00 0.00 -0.60 0.00 0.00 56.93 55.70 1u86 s PHE 19 Cb -0.11 -1.50 -0.00 0.00 0.51 0.00 0.00 43.02 41.92 1u86 s PHE 19 CO -0.09 0.54 0.00 -1.13 0.70 0.00 0.00 175.22 175.25 1u86 n SER 20 N -0.85 2.34 -4.53 1.36 3.41 -1.26 -3.11 113.62 110.98 1u86 n SER 20 Ca -0.05 -0.27 -0.38 0.00 -0.26 0.00 0.00 58.87 57.92 1u86 n SER 20 Cb 0.65 1.00 -0.11 0.00 -0.26 0.00 0.00 64.21 65.48 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 -1.48 3.78 0.36 4.33 3.00 -1.26 -4.97 118.95 122.71 1u86 s ARG 21 Ca 0.00 -0.42 0.18 0.00 0.00 0.00 0.00 55.73 55.48 1u86 s ARG 21 Cb 0.00 -3.56 0.61 0.00 0.00 0.00 0.00 34.95 32.00 1u86 s ARG 21 CO 0.01 -0.22 1.70 0.66 0.00 0.00 0.00 175.30 177.45 1u86 h SER 22 N 8.34 0.00 0.47 0.23 4.64 -1.98 -1.04 113.55 124.21 1u86 h SER 22 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1u86 h SER 22 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1u86 h SER 22 CO 0.57 0.41 -0.28 -0.90 -0.87 0.00 0.00 176.83 175.75 1u86 n ASP 23 N -3.53 0.55 -0.12 4.97 5.75 -1.26 -2.20 116.55 120.71 1u86 n ASP 23 Ca -0.00 -0.38 -0.19 0.00 -0.01 0.00 0.00 54.79 54.21 1u86 n ASP 23 Cb 0.54 0.05 -0.10 0.00 -1.03 0.00 0.00 41.12 40.57 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 -1.17 0.00 0.25 2.11 8.25 -0.98 -4.08 115.22 119.60 1u86 n HIS 24 Ca 0.09 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.69 1u86 n HIS 24 Cb 0.33 -0.90 0.49 0.00 1.12 0.00 0.00 29.99 31.02 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 -0.27 0.00 -0.15 2.41 5.85 -1.32 -0.65 115.31 121.17 1u86 h LEU 25 Ca -0.56 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.13 1u86 h LEU 25 Cb 1.74 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.76 1u86 h LEU 25 CO -0.17 0.08 -0.01 0.00 -0.34 0.00 0.00 178.44 177.99 1u86 h ALA 26 N 1.92 0.21 -0.05 1.25 0.00 -1.64 0.62 119.26 121.57 1u86 h ALA 26 Ca -0.00 -0.21 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 1u86 h ALA 26 Cb 0.72 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1u86 h ALA 26 CO 0.01 -0.07 -0.70 1.37 0.00 0.00 0.00 179.25 179.86 1u86 h LEU 27 N 0.00 0.30 -1.57 0.00 8.10 -1.67 0.71 115.31 121.18 1u86 h LEU 27 Ca 0.04 -0.19 -0.02 0.00 0.11 0.00 0.00 57.88 57.82 1u86 h LEU 27 Cb 0.41 -0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 40.52 1u86 h LEU 27 CO 0.01 0.90 0.09 -0.74 -4.11 0.00 0.00 178.44 174.59 1u86 h HIS 28 N 0.17 0.37 0.06 0.17 2.76 -0.97 -0.49 115.15 117.22 1u86 h HIS 28 Ca -0.02 -0.01 -0.30 0.00 -2.20 0.00 0.00 60.37 57.85 1u86 h HIS 28 Cb 1.25 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 30.06 1u86 h HIS 28 CO 0.03 0.31 -1.59 0.00 -1.30 0.00 0.00 177.93 175.37 1u86 h ARG 29 N 0.38 0.12 -0.66 5.26 3.08 -0.48 -3.09 114.38 118.99 1u86 h ARG 29 Ca 0.09 -0.20 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 1u86 h ARG 29 Cb 0.10 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1u86 h ARG 29 CO -0.01 0.87 0.12 0.87 -1.07 0.00 0.00 179.97 180.74 1u86 h LYS 30 N 0.03 1.08 0.00 0.04 1.57 -0.45 -2.17 116.57 116.67 1u86 h LYS 30 Ca -0.25 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 1u86 h LYS 30 Cb 1.98 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 34.16 1u86 h LYS 30 CO 0.11 0.99 0.00 0.07 -0.57 0.00 0.00 179.45 180.05 1u86 h ARG 31 N 1.00 0.00 -0.21 3.15 0.11 -1.21 -0.59 114.38 116.63 1u86 h ARG 31 Ca 0.20 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.23 1u86 h ARG 31 Cb 0.43 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.50 1u86 h ARG 31 CO 0.01 0.00 -0.08 0.45 0.10 0.00 0.00 179.97 180.46 1u86 h HIS 32 N 0.00 0.49 -0.23 4.08 3.86 -1.30 -2.57 115.15 119.48 1u86 h HIS 32 Ca 0.00 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1u86 h HIS 32 Cb 0.64 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.00 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 -4.57 1.66 -3.33 2.45 0.00 -1.11 -4.93 117.12 107.29 1u86 n MET 33 Ca -0.05 -1.02 -0.18 0.00 0.00 0.00 0.00 57.70 56.46 1u86 n MET 33 Cb 0.31 -1.30 0.07 0.00 0.00 0.00 0.00 33.22 32.29 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 0.28 -5.16 0.00 3.17 4.32 -0.97 -5.10 117.00 113.54 1u86 n LEU 34 Ca 0.13 -0.76 0.00 0.00 -0.02 0.00 0.00 56.01 55.36 1u86 n LEU 34 Cb 0.27 -3.08 0.00 0.00 -1.62 0.00 0.00 43.42 38.99 1u86 n LEU 34 CO 0.10 0.17 0.02 0.55 -1.22 0.00 0.00 177.39 177.00