#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 2.03 -1.33 1.61 0.01 -1.26 -5.06 113.70 109.70 1u86 s SER 2 Ca 0.00 -1.15 -0.16 0.00 1.31 0.00 0.00 55.95 55.95 1u86 s SER 2 Cb 0.00 -0.04 0.07 0.00 0.21 0.00 0.00 66.02 66.27 1u86 s SER 2 CO 0.00 -0.41 1.84 0.41 0.41 0.00 0.00 173.24 175.48 1u86 n THR 3 N -0.39 3.87 -0.43 1.44 -1.04 -1.26 -4.42 114.28 112.05 1u86 n THR 3 Ca -0.07 -3.90 0.00 0.00 -2.04 0.00 0.00 64.05 58.04 1u86 n THR 3 Cb 0.63 -2.42 0.00 0.00 -1.82 0.00 0.00 70.33 66.71 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 4.89 -0.28 2.72 3.41 0.00 -1.26 -4.88 105.19 109.79 1u86 n GLY 4 Ca 0.48 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.09 1u86 n GLY 4 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1u86 n ILE 5 N -0.05 3.72 -4.02 -0.61 5.41 -1.26 -4.74 119.36 117.80 1u86 n ILE 5 Ca 0.00 -3.26 -0.29 0.00 1.00 0.00 0.00 62.75 60.20 1u86 n ILE 5 Cb 0.15 -2.55 -0.05 0.00 -0.71 0.00 0.00 39.64 36.47 1u86 n ILE 5 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1u86 s LYS 6 N 2.51 3.05 0.32 0.38 -0.14 -1.26 -5.01 119.74 119.59 1u86 s LYS 6 Ca 0.48 -0.66 0.17 0.00 -1.36 0.00 0.00 55.97 54.59 1u86 s LYS 6 Cb 0.14 -2.80 0.40 0.00 -1.68 0.00 0.00 37.83 33.89 1u86 s LYS 6 CO -0.07 0.56 1.60 -1.00 -0.76 0.00 0.00 175.35 175.68 1u86 h PRO 7 N 2.99 0.00 -1.76 -1.68 0.13 -1.92 -3.09 132.00 126.67 1u86 h PRO 7 Ca -0.47 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.04 1u86 h PRO 7 Cb 1.17 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.07 1u86 h PRO 7 CO 0.68 0.47 0.76 1.19 -0.23 0.00 0.00 178.00 180.86 1u86 n PHE 8 N -3.41 2.46 -2.33 1.56 3.01 -1.11 -4.98 117.46 112.66 1u86 n PHE 8 Ca 0.01 -2.31 -0.39 0.00 1.01 0.00 0.00 57.45 55.77 1u86 n PHE 8 Cb 0.62 -1.27 -0.03 0.00 -0.01 0.00 0.00 39.48 38.79 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 -3.09 4.32 -0.31 -1.08 0.74 -1.17 -0.57 119.66 118.49 1u86 s GLN 9 Ca 0.54 1.89 -0.23 0.00 0.05 0.00 0.00 55.36 57.62 1u86 s GLN 9 Cb 0.41 -2.92 0.00 0.00 1.10 0.00 0.00 33.01 31.60 1u86 s GLN 9 CO -0.24 -0.11 0.76 0.00 -0.55 0.00 0.00 175.29 175.16 1u86 n THR 11 N 5.55 1.18 -2.43 0.00 5.66 -1.26 -3.09 114.28 119.89 1u86 n THR 11 Ca 0.03 -0.52 -0.43 0.00 -3.05 0.00 0.00 64.05 60.09 1u86 n THR 11 Cb 0.48 -0.56 -0.02 0.00 -1.55 0.00 0.00 70.33 68.68 1u86 n THR 11 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 1u86 s TRP 12 N -1.42 2.92 0.19 1.09 -0.11 -1.26 -4.90 118.94 115.45 1u86 s TRP 12 Ca 0.18 1.05 -0.12 0.00 1.22 0.00 0.00 56.10 58.43 1u86 s TRP 12 Cb 0.14 -3.49 0.14 0.00 -1.50 0.00 0.00 33.47 28.76 1u86 s TRP 12 CO 0.05 -1.62 1.84 -1.35 -4.62 0.00 0.00 176.95 171.25 1u86 h PRO 13 N 8.05 0.73 0.00 5.86 0.11 -2.01 0.59 132.00 145.33 1u86 h PRO 13 Ca -0.28 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1u86 h PRO 13 Cb 1.11 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1u86 h PRO 13 CO 0.95 0.49 0.00 0.22 -0.21 0.00 0.00 178.00 179.45 1u86 h ASP 14 N 0.76 0.00 0.00 -2.05 3.58 -1.99 -3.38 116.42 113.33 1u86 h ASP 14 Ca 0.24 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.69 1u86 h ASP 14 Cb -0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1u86 h ASP 14 CO -0.09 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.27 1u86 n ASP 16 N -2.30 -4.83 -4.90 0.00 2.03 0.20 -5.01 116.55 101.75 1u86 n ASP 16 Ca 0.00 -0.54 -0.21 0.00 0.52 0.00 0.00 54.79 54.57 1u86 n ASP 16 Cb 0.00 -4.15 0.07 0.00 -0.72 0.00 0.00 41.12 36.33 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 -4.29 2.13 -0.22 -0.67 3.00 -1.18 -4.91 118.95 112.81 1u86 s ARG 17 Ca 0.28 -1.37 -0.10 0.00 0.00 0.00 0.00 55.73 54.54 1u86 s ARG 17 Cb -0.04 -2.53 0.08 0.00 0.00 0.00 0.00 34.95 32.46 1u86 s ARG 17 CO 0.57 -1.02 0.51 -1.54 0.00 0.00 0.00 175.30 173.82 1u86 s SER 18 N -4.65 -0.62 0.29 0.23 1.04 -1.26 0.14 113.70 108.87 1u86 s SER 18 Ca 0.63 1.15 0.08 0.00 0.48 0.00 0.00 55.95 58.29 1u86 s SER 18 Cb -0.06 1.29 -0.06 0.00 0.10 0.00 0.00 66.02 67.30 1u86 s SER 18 CO 0.40 -0.22 -0.09 -0.36 0.98 0.00 0.00 173.24 173.96 1u86 s PHE 19 N 2.03 2.07 -0.02 5.02 0.40 0.26 -4.92 117.98 122.81 1u86 s PHE 19 Ca -0.07 -0.61 0.01 0.00 -0.60 0.00 0.00 56.93 55.66 1u86 s PHE 19 Cb -0.09 -1.14 -0.01 0.00 0.51 0.00 0.00 43.02 42.28 1u86 s PHE 19 CO -0.15 0.39 0.03 -1.13 0.70 0.00 0.00 175.22 175.06 1u86 n SER 20 N -0.62 2.53 -4.54 1.36 3.41 -1.26 -2.76 113.62 111.74 1u86 n SER 20 Ca -0.06 -0.25 -0.38 0.00 -0.26 0.00 0.00 58.87 57.92 1u86 n SER 20 Cb 0.63 1.02 -0.11 0.00 -0.26 0.00 0.00 64.21 65.49 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 -1.60 3.74 0.30 4.33 3.00 -1.26 -4.97 118.95 122.49 1u86 s ARG 21 Ca -0.00 -0.46 0.06 0.00 0.00 0.00 0.00 55.73 55.33 1u86 s ARG 21 Cb 0.01 -3.62 0.46 0.00 0.00 0.00 0.00 34.95 31.79 1u86 s ARG 21 CO 0.04 -0.26 1.71 0.66 0.00 0.00 0.00 175.30 177.45 1u86 h SER 22 N 8.37 0.28 0.65 0.23 4.64 -1.97 -1.89 113.55 123.86 1u86 h SER 22 Ca -0.35 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1u86 h SER 22 Cb 1.18 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1u86 h SER 22 CO 0.58 0.64 0.00 -0.90 -0.87 0.00 0.00 176.83 176.28 1u86 n ASP 23 N -4.05 0.00 -0.13 4.97 5.75 -1.26 -1.00 116.55 120.83 1u86 n ASP 23 Ca -0.01 0.18 -0.26 0.00 -0.01 0.00 0.00 54.79 54.69 1u86 n ASP 23 Cb 0.46 -0.38 -0.11 0.00 -1.03 0.00 0.00 41.12 40.06 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 -1.38 0.06 0.24 2.11 8.25 -0.91 -3.82 115.22 119.76 1u86 n HIS 24 Ca 0.09 0.02 0.13 0.00 -0.26 0.00 0.00 57.72 57.70 1u86 n HIS 24 Cb 0.24 -1.01 0.44 0.00 1.12 0.00 0.00 29.99 30.79 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 -0.64 0.00 -0.20 2.41 5.85 -1.35 0.39 115.31 121.77 1u86 h LEU 25 Ca -0.65 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 57.85 1u86 h LEU 25 Cb 1.71 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.75 1u86 h LEU 25 CO -0.30 0.10 -0.86 0.00 -0.34 0.00 0.00 178.44 177.04 1u86 h ALA 26 N 1.90 0.37 0.17 1.25 0.00 -1.27 -0.83 119.26 120.86 1u86 h ALA 26 Ca -0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 54.91 53.96 1u86 h ALA 26 Cb 0.77 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.56 1u86 h ALA 26 CO 0.01 0.75 -1.33 1.37 0.00 0.00 0.00 179.25 180.06 1u86 h LEU 27 N 0.34 0.56 -1.61 0.00 8.10 -1.60 -2.00 115.31 119.11 1u86 h LEU 27 Ca -0.07 -0.60 -0.03 0.00 0.11 0.00 0.00 57.88 57.29 1u86 h LEU 27 Cb 1.49 -0.18 -0.01 0.00 -0.44 0.00 0.00 40.66 41.52 1u86 h LEU 27 CO 0.16 1.47 -0.11 -0.74 -4.11 0.00 0.00 178.44 175.11 1u86 h HIS 28 N 0.10 0.12 0.00 0.17 2.76 -0.24 -2.63 115.15 115.42 1u86 h HIS 28 Ca -0.18 -0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 57.87 1u86 h HIS 28 Cb 2.04 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 30.94 1u86 h HIS 28 CO 0.08 0.23 -1.30 0.54 -1.30 0.00 0.00 177.93 176.18 1u86 n ARG 29 N -4.35 0.62 0.13 5.26 1.74 -0.32 -3.64 116.66 116.09 1u86 n ARG 29 Ca -0.02 0.19 -0.02 0.00 -0.77 0.00 0.00 57.85 57.23 1u86 n ARG 29 Cb 0.22 -1.81 0.14 0.00 -1.02 0.00 0.00 32.46 29.98 1u86 n ARG 29 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1u86 h LYS 30 N 0.00 0.02 -0.00 5.56 -0.00 -1.01 -2.59 116.57 118.55 1u86 h LYS 30 Ca -0.12 -0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.52 1u86 h LYS 30 Cb 1.41 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.64 1u86 h LYS 30 CO 0.03 0.67 -0.11 2.89 -0.00 0.00 0.00 179.45 182.93 1u86 n ARG 31 N -3.77 0.08 0.13 0.07 1.85 -1.04 -3.34 116.66 110.64 1u86 n ARG 31 Ca -0.01 -0.02 -0.01 0.00 -1.00 0.00 0.00 57.85 56.81 1u86 n ARG 31 Cb 0.65 -1.50 0.22 0.00 -1.05 0.00 0.00 32.46 30.78 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 0.04 0.14 0.00 2.89 3.86 -1.53 -3.02 115.15 117.53 1u86 h HIS 32 Ca 0.00 -0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.10 1u86 h HIS 32 Cb 0.47 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 1u86 h HIS 32 CO 0.00 0.59 -0.34 0.52 0.86 0.00 0.00 177.93 179.56 1u86 h MET 33 N 0.09 0.00 -5.38 2.45 2.86 -1.65 -3.48 114.93 109.82 1u86 h MET 33 Ca 0.00 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.39 1u86 h MET 33 Cb 0.92 0.00 0.19 0.00 0.06 0.00 0.00 31.60 32.76 1u86 h MET 33 CO 0.07 0.34 -0.81 1.28 1.06 0.00 0.00 176.91 178.85 1u86 n LEU 34 N -3.60 -5.25 -0.05 1.22 4.32 -1.14 -5.19 117.00 107.31 1u86 n LEU 34 Ca -0.01 -0.67 0.01 0.00 -0.02 0.00 0.00 56.01 55.32 1u86 n LEU 34 Cb 0.46 -3.10 0.00 0.00 -1.62 0.00 0.00 43.42 39.17 1u86 n LEU 34 CO 0.36 0.14 0.27 1.33 -1.22 0.00 0.00 177.39 178.27