#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ay0 s THR 3 N 0.00 5.14 0.37 2.61 -4.23 -1.26 -5.13 115.64 113.14 2ay0 s THR 3 Ca 0.00 -0.64 0.04 0.00 -1.18 0.00 0.00 61.69 59.91 2ay0 s THR 3 Cb 0.00 -3.57 -0.05 0.00 1.34 0.00 0.00 72.50 70.22 2ay0 s THR 3 CO 0.00 0.02 0.08 0.42 -0.54 0.00 0.00 174.62 174.60 2ay0 s THR 4 N -1.61 1.02 -0.01 3.99 -4.23 -1.26 -5.16 115.64 108.38 2ay0 s THR 4 Ca 0.34 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.90 2ay0 s THR 4 Cb -0.12 -2.62 -0.03 0.00 1.34 0.00 0.00 72.50 71.08 2ay0 s THR 4 CO 0.27 0.00 -0.17 -0.89 -0.54 0.00 0.00 174.62 173.28 2ay0 s THR 5 N -3.23 2.81 0.02 3.99 2.01 -1.26 -5.13 115.64 114.85 2ay0 s THR 5 Ca 0.30 -0.96 0.07 0.00 0.31 0.00 0.00 61.69 61.41 2ay0 s THR 5 Cb 0.06 -2.12 -0.02 0.00 0.01 0.00 0.00 72.50 70.44 2ay0 s THR 5 CO 0.14 0.49 -0.21 -0.32 -0.69 0.00 0.00 174.62 174.03 2ay0 s MET 6 N -1.00 1.57 0.16 4.92 -2.45 -1.26 -5.14 119.30 116.11 2ay0 s MET 6 Ca 0.13 -0.87 -0.28 0.00 -1.25 0.00 0.00 55.69 53.42 2ay0 s MET 6 Cb -0.10 -1.62 -0.07 0.00 1.25 0.00 0.00 34.83 34.28 2ay0 s MET 6 CO 0.02 0.43 0.87 0.20 1.05 0.00 0.00 175.02 177.59 2ay0 s GLY 7 N -0.87 2.99 -0.17 2.11 0.00 -1.26 -5.06 107.32 105.05 2ay0 s GLY 7 Ca 0.08 0.48 0.00 0.00 0.00 0.00 0.00 44.72 45.29 2ay0 s GLY 7 CO 0.01 1.13 -0.10 0.14 0.00 0.00 0.00 173.10 174.28 2ay0 s VAL 8 N -0.76 1.47 -0.12 1.40 1.01 -1.26 -5.11 120.40 117.04 2ay0 s VAL 8 Ca 0.40 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 2ay0 s VAL 8 Cb -0.24 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 2ay0 s VAL 8 CO 0.28 0.25 1.08 -0.04 0.00 0.00 0.00 175.10 176.67 2ay0 s MET 9 N 1.49 4.37 -0.08 2.72 1.00 -1.26 -5.05 119.30 122.49 2ay0 s MET 9 Ca 0.01 1.47 0.02 0.00 0.00 0.00 0.00 55.69 57.20 2ay0 s MET 9 Cb -0.15 -3.57 0.01 0.00 0.00 0.00 0.00 34.83 31.12 2ay0 s MET 9 CO -0.09 -0.42 -0.14 -0.51 0.00 0.00 0.00 175.02 173.86 2ay0 s LEU 10 N 2.34 1.72 0.71 -0.03 1.43 -1.26 -5.13 118.68 118.46 2ay0 s LEU 10 Ca 0.50 -0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 53.13 2ay0 s LEU 10 Cb -0.20 -0.95 0.02 0.00 0.03 0.00 0.00 46.19 45.09 2ay0 s LEU 10 CO 0.17 0.05 1.07 1.51 0.23 0.00 0.00 176.35 179.38 2ay0 s ASP 11 N 0.66 5.34 0.29 2.29 3.84 -1.26 -4.83 116.67 123.01 2ay0 s ASP 11 Ca -0.14 1.39 0.01 0.00 -0.00 0.00 0.00 52.55 53.81 2ay0 s ASP 11 Cb -0.16 -2.25 0.43 0.00 -1.38 0.00 0.00 42.92 39.56 2ay0 s ASP 11 CO 0.04 -1.44 1.78 0.44 -0.00 0.00 0.00 175.17 176.00 2ay0 h ASP 12 N -0.72 0.61 -0.67 2.11 3.32 -2.01 -1.25 116.42 117.82 2ay0 h ASP 12 Ca -0.45 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.43 2ay0 h ASP 12 Cb 1.23 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.59 2ay0 h ASP 12 CO 0.60 0.73 0.36 0.00 -1.72 0.00 0.00 179.24 179.21 2ay0 h ALA 13 N 1.34 0.86 -0.25 3.45 0.00 -1.99 0.85 119.26 123.53 2ay0 h ALA 13 Ca 0.11 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2ay0 h ALA 13 Cb 0.47 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2ay0 h ALA 13 CO 0.02 0.38 -0.07 1.15 0.00 0.00 0.00 179.25 180.74 2ay0 h THR 14 N 0.92 1.29 -0.52 0.00 2.02 -1.79 -1.08 112.91 113.75 2ay0 h THR 14 Ca 0.24 -1.09 0.10 0.00 0.77 0.00 0.00 66.41 66.43 2ay0 h THR 14 Cb 0.05 1.49 -0.09 0.00 -1.74 0.00 0.00 68.15 67.86 2ay0 h THR 14 CO -0.04 0.34 -0.08 0.03 0.37 0.00 0.00 175.52 176.14 2ay0 h ARG 15 N 0.22 0.04 -0.40 6.66 2.47 -1.09 -0.16 114.38 122.12 2ay0 h ARG 15 Ca 0.06 -0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.79 2ay0 h ARG 15 Cb 0.54 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.83 2ay0 h ARG 15 CO 0.03 0.03 0.26 0.93 0.56 0.00 0.00 179.97 181.77 2ay0 h GLU 16 N 0.04 0.52 -0.75 0.04 5.08 -0.60 -1.02 114.58 117.89 2ay0 h GLU 16 Ca 0.26 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.61 2ay0 h GLU 16 Cb 0.40 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 2ay0 h GLU 16 CO -0.50 0.34 0.50 0.00 -1.00 0.00 0.00 179.01 178.35 2ay0 h ARG 17 N 0.53 0.93 -0.23 2.33 3.08 -0.74 -1.91 114.38 118.37 2ay0 h ARG 17 Ca 0.15 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 2ay0 h ARG 17 Cb -0.05 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.79 2ay0 h ARG 17 CO -0.04 0.61 -0.13 0.82 -1.07 0.00 0.00 179.97 180.16 2ay0 h ILE 18 N 0.96 1.31 -0.11 2.04 2.04 -0.45 -1.28 117.51 122.01 2ay0 h ILE 18 Ca 0.29 -1.22 -0.00 0.00 1.00 0.00 0.00 64.86 64.93 2ay0 h ILE 18 Cb -0.01 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 2ay0 h ILE 18 CO -0.08 0.38 0.06 0.11 0.00 0.00 0.00 178.15 178.62 2ay0 h LYS 19 N 0.20 0.16 -0.62 2.37 6.56 -0.93 0.23 116.57 124.54 2ay0 h LYS 19 Ca 0.05 -0.02 -0.07 0.00 -1.06 0.00 0.00 60.65 59.55 2ay0 h LYS 19 Cb 0.64 -0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 32.25 2ay0 h LYS 19 CO 0.04 0.21 0.12 0.66 -2.06 0.00 0.00 179.45 178.42 2ay0 h SER 20 N 0.07 0.97 -0.68 0.86 4.64 -1.39 0.26 113.55 118.27 2ay0 h SER 20 Ca 0.04 -0.25 0.04 0.00 -0.47 0.00 0.00 61.79 61.15 2ay0 h SER 20 Cb 0.10 -0.26 -0.05 0.00 -0.31 0.00 0.00 62.40 61.89 2ay0 h SER 20 CO -0.01 0.97 0.42 0.00 -0.87 0.00 0.00 176.83 177.34 2ay0 h ALA 21 N 1.03 0.90 -0.29 5.18 0.00 -1.10 -1.59 119.26 123.39 2ay0 h ALA 21 Ca 0.19 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 2ay0 h ALA 21 Cb 0.40 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2ay0 h ALA 21 CO 0.01 0.16 -0.29 0.00 0.00 0.00 0.00 179.25 179.13 2ay0 h ALA 22 N 1.31 0.42 -0.97 0.00 0.00 -0.54 -2.87 119.26 116.61 2ay0 h ALA 22 Ca 0.28 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.80 2ay0 h ALA 22 Cb 0.07 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2ay0 h ALA 22 CO -0.13 0.44 0.64 1.15 0.00 0.00 0.00 179.25 181.35 2ay0 h THR 23 N 0.45 1.25 -0.49 0.00 2.02 -0.84 0.09 112.91 115.38 2ay0 h THR 23 Ca 0.05 -0.45 0.04 0.00 0.77 0.00 0.00 66.41 66.82 2ay0 h THR 23 Cb 0.85 -0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.05 2ay0 h THR 23 CO 0.07 0.24 0.25 -0.09 0.37 0.00 0.00 175.52 176.36 2ay0 h ARG 24 N 1.31 0.49 -0.51 6.66 2.43 -1.15 -2.54 114.38 121.07 2ay0 h ARG 24 Ca 0.36 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2ay0 h ARG 24 Cb -0.15 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.29 2ay0 h ARG 24 CO -0.08 0.32 0.00 0.44 -1.51 0.00 0.00 179.97 179.14 2ay0 n ILE 25 N -4.88 0.67 -3.46 1.20 -5.35 -1.08 -4.95 119.36 101.52 2ay0 n ILE 25 Ca 0.04 -0.70 -0.20 0.00 -0.27 0.00 0.00 62.75 61.62 2ay0 n ILE 25 Cb 0.12 0.40 0.08 0.00 -1.74 0.00 0.00 39.64 38.50 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 1.05 -4.22 -3.88 7.28 2.03 -0.42 -5.02 116.55 113.38 2ay0 n ASP 26 Ca 0.18 -0.55 -0.19 0.00 0.52 0.00 0.00 54.79 54.74 2ay0 n ASP 26 Cb 0.45 -4.89 -0.09 0.00 -0.72 0.00 0.00 41.12 35.88 2ay0 n ASP 26 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2ay0 s ARG 27 N -5.80 1.64 0.39 -0.67 1.81 -0.11 -5.03 118.95 111.17 2ay0 s ARG 27 Ca 0.29 -1.94 0.00 0.00 -1.72 0.00 0.00 55.73 52.36 2ay0 s ARG 27 Cb -0.13 -0.04 -0.02 0.00 -0.45 0.00 0.00 34.95 34.31 2ay0 s ARG 27 CO 0.70 -0.49 0.60 0.95 -0.68 0.00 0.00 175.30 176.38 2ay0 s THR 28 N -3.57 4.72 0.24 0.02 -4.23 -1.26 -3.97 115.64 107.59 2ay0 s THR 28 Ca 0.36 -0.44 -0.06 0.00 -1.18 0.00 0.00 61.69 60.37 2ay0 s THR 28 Cb 0.04 -3.73 0.21 0.00 1.34 0.00 0.00 72.50 70.36 2ay0 s THR 28 CO 0.19 -0.50 1.71 -0.65 -0.54 0.00 0.00 174.62 174.83 2ay0 h PRO 29 N 0.61 0.32 -0.69 3.99 0.11 -1.92 -1.25 132.00 133.16 2ay0 h PRO 29 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 2ay0 h PRO 29 Cb 1.23 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 2ay0 h PRO 29 CO 0.60 0.21 0.28 0.45 -0.21 0.00 0.00 178.00 179.33 2ay0 h HIS 30 N 0.33 1.01 -0.23 0.65 3.86 -1.98 -0.70 115.15 118.10 2ay0 h HIS 30 Ca 0.39 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.54 2ay0 h HIS 30 Cb 0.62 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 2ay0 h HIS 30 CO -0.22 0.77 0.14 2.35 0.86 0.00 0.00 177.93 181.82 2ay0 h TRP 31 N 0.99 0.30 -0.71 2.45 7.01 -1.85 -2.24 115.95 121.89 2ay0 h TRP 31 Ca 0.23 -0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.19 2ay0 h TRP 31 Cb 0.17 -0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 27.10 2ay0 h TRP 31 CO 0.01 0.23 0.28 1.25 -2.79 0.00 0.00 178.44 177.42 2ay0 h LEU 32 N 0.28 0.99 -0.47 0.65 6.46 -0.57 -1.32 115.31 121.33 2ay0 h LEU 32 Ca 0.08 -0.18 -0.08 0.00 -0.12 0.00 0.00 57.88 57.59 2ay0 h LEU 32 Cb 0.02 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.67 2ay0 h LEU 32 CO -0.02 0.90 -0.02 0.40 -0.62 0.00 0.00 178.44 179.09 2ay0 h ILE 33 N 1.02 1.26 -0.55 4.05 2.04 -1.09 -0.81 117.51 123.44 2ay0 h ILE 33 Ca 0.24 -1.09 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 2ay0 h ILE 33 Cb 0.22 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 2ay0 h ILE 33 CO -0.02 0.38 0.25 0.11 0.00 0.00 0.00 178.15 178.86 2ay0 h LYS 34 N 0.69 0.81 -0.94 2.37 1.79 -1.24 -1.70 116.57 118.35 2ay0 h LYS 34 Ca 0.13 -0.13 0.06 0.00 -2.18 0.00 0.00 60.65 58.53 2ay0 h LYS 34 Cb 0.53 -0.14 -0.06 0.00 -1.58 0.00 0.00 32.23 30.97 2ay0 h LYS 34 CO 0.03 0.68 0.59 0.37 -1.08 0.00 0.00 179.45 180.04 2ay0 h GLN 35 N 0.75 1.05 -0.39 3.15 5.75 -1.01 -0.35 115.11 124.06 2ay0 h GLN 35 Ca 0.19 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.61 2ay0 h GLN 35 Cb 0.16 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2ay0 h GLN 35 CO -0.02 0.69 0.17 0.00 -2.65 0.00 0.00 178.83 177.02 2ay0 h ALA 36 N 1.43 0.50 0.03 3.38 0.00 -0.83 0.65 119.26 124.42 2ay0 h ALA 36 Ca 0.41 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2ay0 h ALA 36 Cb 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2ay0 h ALA 36 CO -0.17 0.08 -0.02 0.82 0.00 0.00 0.00 179.25 179.96 2ay0 h ILE 37 N 0.48 1.03 -0.28 0.00 2.04 -0.88 -0.42 117.51 119.48 2ay0 h ILE 37 Ca 0.13 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2ay0 h ILE 37 Cb 0.16 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2ay0 h ILE 37 CO -0.01 0.05 0.17 -0.26 0.00 0.00 0.00 178.15 178.10 2ay0 h PHE 38 N -0.13 0.36 -0.75 1.37 0.05 -1.00 -1.13 116.94 115.71 2ay0 h PHE 38 Ca -0.00 0.00 0.01 0.00 3.82 0.00 0.00 57.97 61.79 2ay0 h PHE 38 Cb 0.12 -0.12 -0.04 0.00 2.00 0.00 0.00 35.95 37.91 2ay0 h PHE 38 CO -0.05 0.25 0.49 1.03 -0.18 0.00 0.00 178.31 179.86 2ay0 h SER 39 N 0.36 0.87 -0.40 2.17 0.87 -0.73 -1.83 113.55 114.86 2ay0 h SER 39 Ca 0.10 -0.03 -0.15 0.00 -1.23 0.00 0.00 61.79 60.49 2ay0 h SER 39 Cb -0.01 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 2ay0 h SER 39 CO -0.02 0.63 -0.32 0.22 -0.53 0.00 0.00 176.83 176.81 2ay0 h TYR 40 N 1.02 1.11 -0.44 2.24 5.03 -0.85 -1.13 116.97 123.94 2ay0 h TYR 40 Ca 0.28 -0.31 0.03 0.00 2.58 0.00 0.00 58.73 61.30 2ay0 h TYR 40 Cb -0.11 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 37.89 2ay0 h TYR 40 CO -0.02 1.13 0.24 -0.07 -1.32 0.00 0.00 178.16 178.12 2ay0 h LEU 41 N 0.78 0.38 -0.43 2.82 3.38 -0.98 0.17 115.31 121.43 2ay0 h LEU 41 Ca 0.08 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2ay0 h LEU 41 Cb 0.91 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2ay0 h LEU 41 CO 0.08 0.27 0.26 -0.33 0.09 0.00 0.00 178.44 178.81 2ay0 h GLU 42 N 0.49 0.58 -0.57 1.13 5.08 -1.14 0.37 114.58 120.52 2ay0 h GLU 42 Ca 0.18 -0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.55 2ay0 h GLU 42 Cb 0.05 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.12 2ay0 h GLU 42 CO -0.10 0.43 0.27 1.96 -1.00 0.00 0.00 179.01 180.57 2ay0 h GLN 43 N 0.57 0.49 -0.14 2.33 4.20 -0.94 -2.87 115.11 118.75 2ay0 h GLN 43 Ca 0.15 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.82 2ay0 h GLN 43 Cb -0.00 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 2ay0 h GLN 43 CO -0.03 0.33 0.04 -0.07 -0.67 0.00 0.00 178.83 178.43 2ay0 h LEU 44 N 0.51 0.20 0.00 1.46 3.38 -0.33 -3.51 115.31 117.02 2ay0 h LEU 44 Ca 0.27 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2ay0 h LEU 44 Cb 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2ay0 h LEU 44 CO -0.21 0.36 0.00 -0.62 0.09 0.00 0.00 178.44 178.06