#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ay0 s THR 4 N 0.00 0.31 -0.15 12.58 -4.23 -1.26 -5.16 115.64 117.74 2ay0 s THR 4 Ca 0.00 -1.95 0.01 0.00 -1.18 0.00 0.00 61.69 58.57 2ay0 s THR 4 Cb 0.00 -2.18 0.01 0.00 1.34 0.00 0.00 72.50 71.67 2ay0 s THR 4 CO 0.00 -0.37 -0.19 -0.89 -0.54 0.00 0.00 174.62 172.63 2ay0 s THR 5 N -3.91 2.29 -0.02 3.99 2.01 -1.26 -5.12 115.64 113.62 2ay0 s THR 5 Ca 0.27 -0.90 -0.02 0.00 0.31 0.00 0.00 61.69 61.35 2ay0 s THR 5 Cb 0.07 -1.94 -0.04 0.00 0.01 0.00 0.00 72.50 70.60 2ay0 s THR 5 CO 0.05 0.53 0.15 -0.04 -0.69 0.00 0.00 174.62 174.62 2ay0 s MET 6 N 0.88 3.32 0.07 4.92 1.00 -1.26 -5.11 119.30 123.12 2ay0 s MET 6 Ca -0.05 -0.36 -0.21 0.00 0.00 0.00 0.00 55.69 55.06 2ay0 s MET 6 Cb -0.15 -3.03 -0.07 0.00 0.00 0.00 0.00 34.83 31.59 2ay0 s MET 6 CO -0.02 0.67 0.64 0.20 0.00 0.00 0.00 175.02 176.51 2ay0 s GLY 7 N -1.81 2.72 -0.17 -0.03 0.00 -1.26 -5.07 107.32 101.70 2ay0 s GLY 7 Ca 0.25 0.13 0.01 0.00 0.00 0.00 0.00 44.72 45.11 2ay0 s GLY 7 CO 0.16 0.67 -0.19 0.14 0.00 0.00 0.00 173.10 173.89 2ay0 s VAL 8 N -0.81 1.94 0.01 1.40 1.01 -1.26 -5.12 120.40 117.58 2ay0 s VAL 8 Ca 0.32 -0.87 -0.29 0.00 0.00 0.00 0.00 61.98 61.14 2ay0 s VAL 8 Cb -0.20 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 2ay0 s VAL 8 CO 0.20 0.52 0.93 -0.04 0.00 0.00 0.00 175.10 176.72 2ay0 s MET 9 N 1.31 4.56 -0.09 2.72 1.00 -1.26 -5.05 119.30 122.49 2ay0 s MET 9 Ca 0.04 1.34 0.01 0.00 0.00 0.00 0.00 55.69 57.08 2ay0 s MET 9 Cb -0.13 -3.44 0.02 0.00 0.00 0.00 0.00 34.83 31.28 2ay0 s MET 9 CO -0.12 0.01 -0.09 -0.51 0.00 0.00 0.00 175.02 174.31 2ay0 s LEU 10 N 0.80 1.39 0.63 -0.03 1.43 -1.26 -5.13 118.68 116.51 2ay0 s LEU 10 Ca 0.49 -0.29 -0.18 0.00 -1.03 0.00 0.00 54.13 53.12 2ay0 s LEU 10 Cb -0.21 -0.81 -0.02 0.00 0.03 0.00 0.00 46.19 45.18 2ay0 s LEU 10 CO 0.27 -0.05 1.25 -1.81 0.23 0.00 0.00 176.35 176.24 2ay0 s ASP 11 N 1.22 4.83 0.30 2.29 1.11 -1.26 -4.82 116.67 120.34 2ay0 s ASP 11 Ca -0.04 2.50 -0.01 0.00 0.18 0.00 0.00 52.55 55.17 2ay0 s ASP 11 Cb -0.14 -2.61 0.45 0.00 1.07 0.00 0.00 42.92 41.69 2ay0 s ASP 11 CO -0.03 -1.84 1.91 0.44 1.18 0.00 0.00 175.17 176.83 2ay0 h ASP 12 N 0.63 0.84 -0.80 0.27 3.32 -2.00 -1.53 116.42 117.15 2ay0 h ASP 12 Ca -0.50 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 56.46 2ay0 h ASP 12 Cb 1.32 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 40.61 2ay0 h ASP 12 CO 0.54 0.70 0.49 0.00 -1.72 0.00 0.00 179.24 179.25 2ay0 h ALA 13 N 1.43 1.02 -0.46 3.45 0.00 -1.99 -0.70 119.26 122.01 2ay0 h ALA 13 Ca 0.23 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 2ay0 h ALA 13 Cb 0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2ay0 h ALA 13 CO -0.03 0.47 -0.08 1.15 0.00 0.00 0.00 179.25 180.76 2ay0 h THR 14 N 1.10 1.27 -0.70 0.00 2.02 -1.76 -1.41 112.91 113.42 2ay0 h THR 14 Ca 0.29 -1.19 -0.05 0.00 0.77 0.00 0.00 66.41 66.23 2ay0 h THR 14 Cb -0.06 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 2ay0 h THR 14 CO -0.06 0.41 0.22 -0.09 0.37 0.00 0.00 175.52 176.38 2ay0 h ARG 15 N 0.70 1.07 -0.53 6.66 2.43 -1.12 -0.29 114.38 123.29 2ay0 h ARG 15 Ca 0.12 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 2ay0 h ARG 15 Cb 0.61 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 2ay0 h ARG 15 CO 0.04 0.91 0.02 1.49 -1.51 0.00 0.00 179.97 180.92 2ay0 h GLU 16 N 1.03 0.89 -0.28 0.20 4.57 -0.90 -1.10 114.58 118.99 2ay0 h GLU 16 Ca 0.23 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2ay0 h GLU 16 Cb 0.28 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 2ay0 h GLU 16 CO -0.01 0.87 0.18 -0.09 -1.18 0.00 0.00 179.01 178.78 2ay0 h ARG 17 N 0.83 0.37 -0.43 1.92 2.43 -0.87 0.06 114.38 118.70 2ay0 h ARG 17 Ca 0.16 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2ay0 h ARG 17 Cb 0.46 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 2ay0 h ARG 17 CO 0.02 0.25 0.23 0.82 -1.51 0.00 0.00 179.97 179.79 2ay0 h ILE 18 N 0.37 1.01 -0.28 1.20 2.04 -0.83 0.11 117.51 121.13 2ay0 h ILE 18 Ca 0.10 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 2ay0 h ILE 18 Cb -0.03 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2ay0 h ILE 18 CO -0.02 0.09 0.04 0.50 0.00 0.00 0.00 178.15 178.76 2ay0 h LYS 19 N 0.47 0.47 -0.51 2.37 3.64 -0.96 0.80 116.57 122.84 2ay0 h LYS 19 Ca 0.18 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2ay0 h LYS 19 Cb 0.05 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2ay0 h LYS 19 CO -0.11 0.58 0.26 1.03 -2.27 0.00 0.00 179.45 178.94 2ay0 h SER 20 N 0.28 0.66 -0.40 4.20 0.87 -0.86 -1.76 113.55 116.54 2ay0 h SER 20 Ca 0.09 -0.12 -0.09 0.00 -1.23 0.00 0.00 61.79 60.44 2ay0 h SER 20 Cb 0.34 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 2ay0 h SER 20 CO 0.01 0.59 -0.10 0.00 -0.53 0.00 0.00 176.83 176.79 2ay0 h ALA 21 N 1.10 0.55 -0.24 6.23 0.00 -0.54 -1.89 119.26 124.47 2ay0 h ALA 21 Ca 0.18 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2ay0 h ALA 21 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2ay0 h ALA 21 CO -0.02 0.42 0.09 0.00 0.00 0.00 0.00 179.25 179.73 2ay0 h ALA 22 N 0.84 0.31 -0.81 0.00 0.00 -0.81 -2.93 119.26 115.86 2ay0 h ALA 22 Ca 0.10 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2ay0 h ALA 22 Cb 0.62 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 2ay0 h ALA 22 CO 0.04 -0.08 0.50 1.15 0.00 0.00 0.00 179.25 180.86 2ay0 h THR 23 N 0.22 1.06 -0.79 0.00 2.02 -1.30 0.14 112.91 114.26 2ay0 h THR 23 Ca 0.08 -0.32 0.10 0.00 0.77 0.00 0.00 66.41 67.03 2ay0 h THR 23 Cb 0.20 0.04 -0.05 0.00 -1.74 0.00 0.00 68.15 66.59 2ay0 h THR 23 CO -0.00 0.17 0.52 0.03 0.37 0.00 0.00 175.52 176.60 2ay0 h ARG 24 N 0.94 0.70 -0.63 6.66 3.08 -1.16 -2.03 114.38 121.94 2ay0 h ARG 24 Ca 0.35 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.35 2ay0 h ARG 24 Cb 0.12 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2ay0 h ARG 24 CO -0.15 0.46 0.00 0.44 -1.07 0.00 0.00 179.97 179.65 2ay0 n ILE 25 N -4.51 1.57 -3.20 2.04 -5.35 -0.89 -4.96 119.36 104.06 2ay0 n ILE 25 Ca 0.13 -1.16 -0.17 0.00 -0.27 0.00 0.00 62.75 61.28 2ay0 n ILE 25 Cb 0.33 0.24 0.05 0.00 -1.74 0.00 0.00 39.64 38.52 2ay0 n ILE 25 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2ay0 n ASP 26 N 1.15 -5.10 -3.53 7.28 2.03 -0.59 -5.01 116.55 112.78 2ay0 n ASP 26 Ca 0.24 -0.35 -0.22 0.00 0.52 0.00 0.00 54.79 54.98 2ay0 n ASP 26 Cb 0.79 -3.73 -0.07 0.00 -0.72 0.00 0.00 41.12 37.38 2ay0 n ASP 26 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2ay0 n ARG 27 N -3.62 0.56 -4.22 -0.67 5.12 0.40 -5.00 116.66 109.22 2ay0 n ARG 27 Ca -0.01 -3.13 -0.23 0.00 -1.93 0.00 0.00 57.85 52.56 2ay0 n ARG 27 Cb 0.55 1.88 -0.06 0.00 -1.16 0.00 0.00 32.46 33.67 2ay0 n ARG 27 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2ay0 s THR 28 N -3.01 3.87 0.25 0.55 -4.23 -1.26 -3.43 115.64 108.37 2ay0 s THR 28 Ca 0.23 -1.70 -0.03 0.00 -1.18 0.00 0.00 61.69 59.00 2ay0 s THR 28 Cb 0.01 -3.08 0.24 0.00 1.34 0.00 0.00 72.50 71.01 2ay0 s THR 28 CO 0.16 -0.36 1.70 -0.65 -0.54 0.00 0.00 174.62 174.93 2ay0 h PRO 29 N 1.72 0.35 -0.61 3.99 0.11 -1.91 -1.47 132.00 134.17 2ay0 h PRO 29 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2ay0 h PRO 29 Cb 1.25 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 2ay0 h PRO 29 CO 0.61 0.23 0.36 0.45 -0.21 0.00 0.00 178.00 179.43 2ay0 h HIS 30 N 0.36 0.82 -0.34 0.65 3.86 -1.97 -1.46 115.15 117.06 2ay0 h HIS 30 Ca 0.44 -0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.70 2ay0 h HIS 30 Cb 0.73 -0.27 -0.05 0.00 1.06 0.00 0.00 27.41 28.89 2ay0 h HIS 30 CO -0.20 0.57 0.04 2.35 0.86 0.00 0.00 177.93 181.55 2ay0 h TRP 31 N 0.83 0.06 -0.66 2.45 7.01 -1.88 -2.33 115.95 121.44 2ay0 h TRP 31 Ca 0.22 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.24 2ay0 h TRP 31 Cb 0.00 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.05 2ay0 h TRP 31 CO -0.02 -0.01 0.42 1.25 -2.79 0.00 0.00 178.44 177.29 2ay0 h LEU 32 N 0.15 0.76 -0.43 0.65 6.46 -0.86 -0.15 115.31 121.89 2ay0 h LEU 32 Ca 0.16 -0.03 -0.07 0.00 -0.12 0.00 0.00 57.88 57.83 2ay0 h LEU 32 Cb 0.20 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.93 2ay0 h LEU 32 CO -0.24 0.56 0.01 0.40 -0.62 0.00 0.00 178.44 178.56 2ay0 h ILE 33 N 0.89 1.26 -0.55 4.05 2.04 -1.19 1.00 117.51 125.01 2ay0 h ILE 33 Ca 0.24 -1.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.04 2ay0 h ILE 33 Cb -0.08 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2ay0 h ILE 33 CO -0.05 0.34 0.16 0.11 0.00 0.00 0.00 178.15 178.71 2ay0 h LYS 34 N 0.59 0.86 -0.74 2.37 1.79 -1.15 -1.57 116.57 118.72 2ay0 h LYS 34 Ca 0.12 -0.19 0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2ay0 h LYS 34 Cb 0.47 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 30.95 2ay0 h LYS 34 CO 0.02 0.80 0.47 0.37 -1.08 0.00 0.00 179.45 180.03 2ay0 h GLN 35 N 0.77 0.90 -0.22 3.15 5.75 -0.77 -0.47 115.11 124.22 2ay0 h GLN 35 Ca 0.18 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.63 2ay0 h GLN 35 Cb 0.30 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 2ay0 h GLN 35 CO -0.00 0.59 0.11 0.00 -2.65 0.00 0.00 178.83 176.88 2ay0 h ALA 36 N 1.31 0.26 -0.01 3.38 0.00 -0.57 -1.64 119.26 122.00 2ay0 h ALA 36 Ca 0.29 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2ay0 h ALA 36 Cb -0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2ay0 h ALA 36 CO -0.10 -0.30 0.00 0.82 0.00 0.00 0.00 179.25 179.67 2ay0 h ILE 37 N 0.24 1.10 -0.07 0.00 2.04 -0.87 -0.80 117.51 119.15 2ay0 h ILE 37 Ca 0.09 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.69 2ay0 h ILE 37 Cb 0.02 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 2ay0 h ILE 37 CO -0.06 0.07 -0.10 -0.26 0.00 0.00 0.00 178.15 177.80 2ay0 h PHE 38 N -0.11 -0.26 -0.14 1.37 0.05 -1.08 -1.74 116.94 115.02 2ay0 h PHE 38 Ca 0.00 0.01 0.03 0.00 3.82 0.00 0.00 57.97 61.84 2ay0 h PHE 38 Cb 0.12 0.13 -0.03 0.00 2.00 0.00 0.00 35.95 38.16 2ay0 h PHE 38 CO -0.04 -0.16 -0.06 1.03 -0.18 0.00 0.00 178.31 178.90 2ay0 h SER 39 N -0.15 -0.20 -0.49 2.17 0.87 -1.28 -1.98 113.55 112.49 2ay0 h SER 39 Ca 0.06 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.71 2ay0 h SER 39 Cb 0.23 0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.28 2ay0 h SER 39 CO -0.16 -0.08 0.27 0.22 -0.53 0.00 0.00 176.83 176.56 2ay0 h TYR 40 N -0.04 0.51 -0.83 2.24 5.03 -1.03 -1.83 116.97 121.02 2ay0 h TYR 40 Ca 0.08 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.38 2ay0 h TYR 40 Cb 0.15 -0.16 -0.04 0.00 1.55 0.00 0.00 36.73 38.24 2ay0 h TYR 40 CO -0.20 0.27 0.44 -0.07 -1.32 0.00 0.00 178.16 177.28 2ay0 h LEU 41 N 0.54 1.05 -0.75 2.82 3.38 -1.12 -1.52 115.31 119.71 2ay0 h LEU 41 Ca 0.20 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 2ay0 h LEU 41 Cb 0.06 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2ay0 h LEU 41 CO -0.11 0.86 -0.02 -0.33 0.09 0.00 0.00 178.44 178.93 2ay0 h GLU 42 N 1.17 0.94 -0.45 1.13 5.08 -1.07 -1.37 114.58 120.02 2ay0 h GLU 42 Ca 0.29 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 2ay0 h GLU 42 Cb 0.06 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2ay0 h GLU 42 CO -0.04 0.94 -0.16 1.96 -1.00 0.00 0.00 179.01 180.70 2ay0 h GLN 43 N 0.86 0.86 -0.30 2.33 7.50 -0.96 -2.75 115.11 122.65 2ay0 h GLN 43 Ca 0.16 -0.32 -0.01 0.00 0.50 0.00 0.00 58.65 58.97 2ay0 h GLN 43 Cb 0.53 -0.05 -0.01 0.00 0.05 0.00 0.00 27.48 28.00 2ay0 h GLN 43 CO 0.03 0.96 0.13 -0.07 -1.50 0.00 0.00 178.83 178.38 2ay0 h LEU 44 N 0.76 0.40 0.00 1.46 3.38 -1.17 -3.51 115.31 116.62 2ay0 h LEU 44 Ca 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2ay0 h LEU 44 Cb 0.68 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2ay0 h LEU 44 CO 0.05 0.43 0.00 -0.62 0.09 0.00 0.00 178.44 178.39