#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 0.77 -3.80 1.61 0.02 -2.11 -3.38 113.55 106.66 1u86 h SER 2 Ca 0.00 -0.83 -0.76 0.00 -0.84 0.00 0.00 61.79 59.36 1u86 h SER 2 Cb 0.00 -0.24 -0.30 0.00 0.14 0.00 0.00 62.40 62.00 1u86 h SER 2 CO 0.00 1.53 0.03 -0.89 -1.14 0.00 0.00 176.83 176.36 1u86 s THR 3 N -2.94 5.08 -0.25 -2.27 2.01 -1.26 -4.80 115.64 111.20 1u86 s THR 3 Ca -0.11 -2.95 -0.16 0.00 0.31 0.00 0.00 61.69 58.78 1u86 s THR 3 Cb 0.05 -4.15 -0.15 0.00 0.01 0.00 0.00 72.50 68.26 1u86 s THR 3 CO 0.90 -1.03 -0.16 0.61 -0.69 0.00 0.00 174.62 174.25 1u86 n GLY 4 N 3.40 -0.58 3.68 4.40 0.00 -1.26 -4.83 105.19 110.00 1u86 n GLY 4 Ca 0.15 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.46 4.82 0.31 -0.61 1.09 -1.26 -5.01 121.20 118.07 1u86 s ILE 5 Ca -0.35 1.85 -0.27 0.00 -1.10 0.00 0.00 60.65 60.78 1u86 s ILE 5 Cb 0.12 -4.23 -0.10 0.00 -1.06 0.00 0.00 42.46 37.19 1u86 s ILE 5 CO 0.53 0.00 0.95 -0.54 -0.10 0.00 0.00 174.94 175.78 1u86 s LYS 6 N 2.17 4.62 0.40 2.79 -0.14 -1.26 -4.95 119.74 123.36 1u86 s LYS 6 Ca 0.43 1.37 0.21 0.00 -1.36 0.00 0.00 55.97 56.62 1u86 s LYS 6 Cb -0.17 -2.87 0.74 0.00 -1.68 0.00 0.00 37.83 33.84 1u86 s LYS 6 CO 0.14 0.30 1.75 -1.35 -0.76 0.00 0.00 175.35 175.44 1u86 h PRO 7 N 3.32 0.00 -1.83 -1.68 0.11 -1.96 -3.00 132.00 126.96 1u86 h PRO 7 Ca -0.47 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.14 1u86 h PRO 7 Cb 1.19 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.12 1u86 h PRO 7 CO 0.65 0.30 0.51 1.19 -0.21 0.00 0.00 178.00 180.45 1u86 n PHE 8 N -3.42 1.86 -2.55 0.65 3.01 -1.21 -4.95 117.46 110.83 1u86 n PHE 8 Ca 0.00 -2.07 -0.39 0.00 1.01 0.00 0.00 57.45 56.00 1u86 n PHE 8 Cb 0.49 -1.28 -0.05 0.00 -0.01 0.00 0.00 39.48 38.64 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 -2.16 4.54 -0.17 -1.08 0.74 -1.14 -0.39 119.66 120.01 1u86 s GLN 9 Ca 0.53 1.65 -0.29 0.00 0.05 0.00 0.00 55.36 57.30 1u86 s GLN 9 Cb 0.37 -3.01 -0.00 0.00 1.10 0.00 0.00 33.01 31.47 1u86 s GLN 9 CO -0.18 0.17 1.01 0.00 -0.55 0.00 0.00 175.29 175.73 1u86 n THR 11 N 4.92 0.83 -2.60 0.00 -1.04 -1.26 -3.82 114.28 111.31 1u86 n THR 11 Ca 0.10 -0.35 -0.43 0.00 -2.04 0.00 0.00 64.05 61.32 1u86 n THR 11 Cb 0.47 -0.53 -0.02 0.00 -1.82 0.00 0.00 70.33 68.43 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 -1.29 3.17 0.29 -1.42 -0.11 -1.26 -4.92 118.94 113.39 1u86 s TRP 12 Ca 0.13 1.28 -0.03 0.00 1.22 0.00 0.00 56.10 58.71 1u86 s TRP 12 Cb 0.10 -3.46 0.41 0.00 -1.50 0.00 0.00 33.47 29.01 1u86 s TRP 12 CO 0.04 -0.84 1.93 -1.00 -4.62 0.00 0.00 176.95 172.46 1u86 h PRO 13 N 7.87 1.07 0.11 5.86 0.13 -2.01 0.25 132.00 145.28 1u86 h PRO 13 Ca -0.21 -0.10 -0.28 0.00 -0.87 0.00 0.00 66.00 64.54 1u86 h PRO 13 Cb 1.07 -0.22 0.02 0.00 0.13 0.00 0.00 31.00 31.99 1u86 h PRO 13 CO 1.00 0.75 -1.21 0.22 -0.23 0.00 0.00 178.00 178.53 1u86 h ASP 14 N 1.09 0.65 0.00 1.44 3.58 -1.98 -3.40 116.42 117.79 1u86 h ASP 14 Ca 0.28 -0.62 0.00 0.00 0.42 0.00 0.00 57.03 57.11 1u86 h ASP 14 Cb -0.04 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 40.81 1u86 h ASP 14 CO -0.05 1.45 -0.02 0.00 -2.88 0.00 0.00 179.24 177.73 1u86 n ASP 16 N -2.86 -3.57 -4.95 0.00 -0.08 0.86 -5.03 116.55 100.92 1u86 n ASP 16 Ca -0.00 -0.51 -0.23 0.00 -1.51 0.00 0.00 54.79 52.54 1u86 n ASP 16 Cb 0.01 -4.09 0.04 0.00 2.34 0.00 0.00 41.12 39.42 1u86 n ASP 16 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1u86 s ARG 17 N -4.62 2.52 -0.10 -0.67 3.00 -1.25 -4.90 118.95 112.92 1u86 s ARG 17 Ca 0.15 -0.55 -0.05 0.00 0.00 0.00 0.00 55.73 55.28 1u86 s ARG 17 Cb -0.02 -2.39 0.05 0.00 0.00 0.00 0.00 34.95 32.59 1u86 s ARG 17 CO 0.56 -0.82 0.24 -1.54 0.00 0.00 0.00 175.30 173.74 1u86 s SER 18 N -4.42 -0.21 0.41 0.23 1.04 -1.26 0.54 113.70 110.03 1u86 s SER 18 Ca 0.57 0.51 0.04 0.00 0.48 0.00 0.00 55.95 57.55 1u86 s SER 18 Cb -0.10 0.40 -0.05 0.00 0.10 0.00 0.00 66.02 66.37 1u86 s SER 18 CO 0.41 -0.17 0.04 -0.36 0.98 0.00 0.00 173.24 174.14 1u86 s PHE 19 N 1.32 2.06 0.00 5.02 0.40 0.48 -4.93 117.98 122.33 1u86 s PHE 19 Ca -0.09 -0.94 0.00 0.00 -0.60 0.00 0.00 56.93 55.30 1u86 s PHE 19 Cb -0.11 -1.48 0.00 0.00 0.51 0.00 0.00 43.02 41.94 1u86 s PHE 19 CO -0.08 0.13 0.00 0.43 0.70 0.00 0.00 175.22 176.39 1u86 n SER 20 N -1.03 1.23 -4.57 1.36 7.64 -1.26 -3.36 113.62 113.62 1u86 n SER 20 Ca -0.08 -0.28 -0.37 0.00 1.01 0.00 0.00 58.87 59.16 1u86 n SER 20 Cb 0.66 0.80 -0.11 0.00 -1.01 0.00 0.00 64.21 64.56 1u86 n SER 20 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1u86 s ARG 21 N -1.04 3.90 0.43 1.43 0.52 -1.26 -4.98 118.95 117.95 1u86 s ARG 21 Ca 0.00 -0.36 0.24 0.00 -0.52 0.00 0.00 55.73 55.09 1u86 s ARG 21 Cb 0.00 -3.45 0.78 0.00 0.52 0.00 0.00 34.95 32.80 1u86 s ARG 21 CO 0.00 -0.04 1.76 0.66 0.02 0.00 0.00 175.30 177.70 1u86 h SER 22 N 7.82 0.00 0.11 0.23 4.64 -1.97 -2.18 113.55 122.20 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 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1u86 h SER 22 CO 0.61 0.20 -0.21 -0.90 -0.87 0.00 0.00 176.83 175.66 1u86 n ASP 23 N -3.28 1.46 -0.12 4.97 5.75 -1.26 -3.03 116.55 121.03 1u86 n ASP 23 Ca 0.01 -1.23 -0.23 0.00 -0.01 0.00 0.00 54.79 53.33 1u86 n ASP 23 Cb 0.47 0.15 -0.10 0.00 -1.03 0.00 0.00 41.12 40.61 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 -0.19 0.00 0.33 2.11 8.25 -1.02 -3.87 115.22 120.82 1u86 n HIS 24 Ca 0.13 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.74 1u86 n HIS 24 Cb 0.39 -0.89 0.51 0.00 1.12 0.00 0.00 29.99 31.12 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 -0.56 0.00 -0.13 2.41 5.85 -1.57 0.18 115.31 121.49 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 1.64 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.68 1u86 h LEU 25 CO -0.27 0.00 -0.66 0.00 -0.34 0.00 0.00 178.44 177.17 1u86 h ALA 26 N 2.11 0.25 -0.14 1.25 0.00 -1.74 -0.55 119.26 120.43 1u86 h ALA 26 Ca 0.00 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 54.22 1u86 h ALA 26 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1u86 h ALA 26 CO 0.00 0.54 -0.43 -0.07 0.00 0.00 0.00 179.25 179.29 1u86 h LEU 27 N 0.34 0.62 -1.19 0.00 3.38 -1.55 -1.14 115.31 115.78 1u86 h LEU 27 Ca -0.05 -0.60 0.04 0.00 0.09 0.00 0.00 57.88 57.36 1u86 h LEU 27 Cb 1.30 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.81 1u86 h LEU 27 CO 0.14 1.11 0.56 -0.74 0.09 0.00 0.00 178.44 179.60 1u86 h HIS 28 N 0.17 1.02 0.00 1.13 2.76 -0.68 0.63 115.15 120.17 1u86 h HIS 28 Ca -0.01 0.03 -0.17 0.00 -2.20 0.00 0.00 60.37 58.01 1u86 h HIS 28 Cb 1.06 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 29.65 1u86 h HIS 28 CO 0.10 0.59 -0.82 0.00 -1.30 0.00 0.00 177.93 176.51 1u86 h ARG 29 N 1.05 0.00 -0.11 5.26 3.08 -1.00 -2.95 114.38 119.71 1u86 h ARG 29 Ca 0.34 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.27 1u86 h ARG 29 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1u86 h ARG 29 CO -0.10 0.82 -0.47 0.87 -1.07 0.00 0.00 179.97 180.01 1u86 h LYS 30 N 0.00 0.28 0.00 0.04 6.56 -0.25 -2.03 116.57 121.17 1u86 h LYS 30 Ca -0.01 -0.15 0.00 0.00 -1.06 0.00 0.00 60.65 59.43 1u86 h LYS 30 Cb 1.47 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 33.14 1u86 h LYS 30 CO 0.11 0.69 0.00 0.54 -2.06 0.00 0.00 179.45 178.73 1u86 n ARG 31 N -3.98 0.37 -0.07 3.15 5.12 0.12 -0.98 116.66 120.39 1u86 n ARG 31 Ca -0.02 0.06 -0.11 0.00 -1.93 0.00 0.00 57.85 55.86 1u86 n ARG 31 Cb 0.53 -1.50 -0.09 0.00 -1.16 0.00 0.00 32.46 30.24 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 0.00 0.00 -1.55 3.86 -1.23 -3.34 115.15 112.89 1u86 h HIS 32 Ca 0.00 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.10 1u86 h HIS 32 Cb 0.19 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.64 1u86 h HIS 32 CO 0.00 0.76 -0.51 0.00 0.86 0.00 0.00 177.93 179.04 1u86 h MET 33 N -1.00 0.00 -5.87 2.45 -0.00 -1.50 -3.48 114.93 105.54 1u86 h MET 33 Ca -0.05 0.00 -0.35 0.00 -0.00 0.00 0.00 59.70 59.30 1u86 h MET 33 Cb 0.76 0.00 0.14 0.00 -0.00 0.00 0.00 31.60 32.50 1u86 h MET 33 CO -0.03 0.51 -0.89 1.28 -0.00 0.00 0.00 176.91 177.77 1u86 n LEU 34 N -3.73 -4.10 0.00 -0.10 4.77 -0.16 -5.14 117.00 108.54 1u86 n LEU 34 Ca -0.01 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 1u86 n LEU 34 Cb 0.56 -2.78 0.00 0.00 -2.33 0.00 0.00 43.42 38.86 1u86 n LEU 34 CO 0.40 0.30 0.00 0.55 -1.33 0.00 0.00 177.39 177.31