#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s24 s TYR 2 N 0.00 3.01 0.25 0.00 2.02 -1.26 -5.01 117.35 116.36 1s24 s TYR 2 Ca 0.00 1.18 0.01 0.00 -0.37 0.00 0.00 57.07 57.90 1s24 s TYR 2 Cb 0.00 -3.77 -0.04 0.00 -0.40 0.00 0.00 41.96 37.75 1s24 s TYR 2 CO 0.00 -2.36 0.43 -0.51 -1.57 0.00 0.00 175.55 171.53 1s24 s LEU 3 N -0.99 4.19 0.27 -1.29 1.02 -1.26 -4.89 118.68 115.73 1s24 s LEU 3 Ca 0.55 0.33 0.11 0.00 0.02 0.00 0.00 54.13 55.14 1s24 s LEU 3 Cb -0.41 -3.13 -0.05 0.00 0.02 0.00 0.00 46.19 42.62 1s24 s LEU 3 CO 0.48 -0.12 -0.18 -0.54 0.02 0.00 0.00 176.35 176.01 1s24 s LYS 4 N -3.76 1.63 -0.05 1.70 3.01 -1.26 -2.90 119.74 118.11 1s24 s LYS 4 Ca 0.38 -1.75 0.00 0.00 -1.01 0.00 0.00 55.97 53.59 1s24 s LYS 4 Cb -0.10 -1.65 0.02 0.00 -1.01 0.00 0.00 37.83 35.10 1s24 s LYS 4 CO 0.31 0.29 -0.03 -1.58 0.51 0.00 0.00 175.35 174.85 1s24 s TRP 5 N -2.60 0.67 -0.18 3.18 0.52 -0.85 -3.36 118.94 116.31 1s24 s TRP 5 Ca 0.29 -0.17 -0.11 0.00 0.02 0.00 0.00 56.10 56.12 1s24 s TRP 5 Cb -0.04 -0.67 -0.05 0.00 -1.15 0.00 0.00 33.47 31.57 1s24 s TRP 5 CO 0.14 -0.22 0.18 -1.50 0.02 0.00 0.00 176.95 175.57 1s24 s ILE 6 N 1.20 5.38 -0.92 2.03 -1.16 0.12 0.59 121.20 128.44 1s24 s ILE 6 Ca -0.07 0.30 -0.24 0.00 -0.51 0.00 0.00 60.65 60.13 1s24 s ILE 6 Cb -0.14 -3.52 0.03 0.00 0.61 0.00 0.00 42.46 39.45 1s24 s ILE 6 CO -0.02 0.43 1.47 0.00 -2.81 0.00 0.00 174.94 174.01 1s24 h ILE 8 N 6.65 0.23 0.00 0.00 3.07 -1.30 1.55 117.51 127.71 1s24 h ILE 8 Ca 0.05 0.00 -0.13 0.00 1.55 0.00 0.00 64.86 66.33 1s24 h ILE 8 Cb 1.03 0.57 -0.02 0.00 -0.27 0.00 0.00 36.82 38.13 1s24 h ILE 8 CO 1.36 0.00 -0.63 0.74 -1.05 0.00 0.00 178.15 178.57 1s24 h THR 9 N 0.00 1.20 0.00 0.16 2.02 -1.88 -3.39 112.91 111.02 1s24 h THR 9 Ca 0.16 -2.40 -0.07 0.00 0.77 0.00 0.00 66.41 64.88 1s24 h THR 9 Cb 1.16 2.40 -0.01 0.00 -1.74 0.00 0.00 68.15 69.95 1s24 h THR 9 CO -0.00 0.62 -1.23 0.00 0.37 0.00 0.00 175.52 175.28 1s24 n GLY 11 N 2.89 2.28 3.77 0.00 0.00 0.46 -5.00 105.19 109.58 1s24 n GLY 11 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 1s24 n GLY 11 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1s24 s HIS 12 N -2.13 2.94 0.12 1.61 5.65 -1.26 -4.60 115.29 117.61 1s24 s HIS 12 Ca 0.00 1.53 0.05 0.00 0.25 0.00 0.00 55.06 56.89 1s24 s HIS 12 Cb 0.00 -3.41 -0.04 0.00 -1.18 0.00 0.00 32.58 27.95 1s24 s HIS 12 CO 0.00 -1.48 0.04 0.42 -0.65 0.00 0.00 174.74 173.06 1s24 s ILE 13 N -1.48 4.12 -0.19 0.89 1.01 -1.26 -0.98 121.20 123.31 1s24 s ILE 13 Ca 0.61 -1.06 -0.08 0.00 0.00 0.00 0.00 60.65 60.12 1s24 s ILE 13 Cb -0.30 -3.01 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 1s24 s ILE 13 CO 0.37 0.03 0.07 -0.47 0.00 0.00 0.00 174.94 174.94 1s24 s TYR 14 N -1.49 3.23 -0.46 3.97 5.04 0.20 -4.89 117.35 122.94 1s24 s TYR 14 Ca 0.28 0.02 -0.13 0.00 -2.44 0.00 0.00 57.07 54.80 1s24 s TYR 14 Cb -0.11 -2.11 0.09 0.00 0.35 0.00 0.00 41.96 40.18 1s24 s TYR 14 CO 0.20 0.09 0.36 0.34 -1.34 0.00 0.00 175.55 175.20 1s24 s ASP 15 N 0.56 5.94 0.62 4.32 -1.08 -1.26 -2.01 116.67 123.76 1s24 s ASP 15 Ca 0.03 -1.51 0.27 0.00 -0.52 0.00 0.00 52.55 50.83 1s24 s ASP 15 Cb -0.13 -2.11 1.42 0.00 -1.46 0.00 0.00 42.92 40.65 1s24 s ASP 15 CO 0.01 -0.65 1.82 -0.33 0.52 0.00 0.00 175.17 176.55 1s24 h GLU 16 N 8.63 0.00 -0.33 4.34 5.08 -1.74 0.65 114.58 131.21 1s24 h GLU 16 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1s24 h GLU 16 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1s24 h GLU 16 CO 0.86 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.87 1s24 n ALA 17 N -2.13 2.54 -2.67 3.43 0.00 -1.26 -1.86 120.51 118.56 1s24 n ALA 17 Ca 0.05 -0.41 -0.05 0.00 0.00 0.00 0.00 53.44 53.03 1s24 n ALA 17 Cb 0.63 -0.99 0.08 0.00 0.00 0.00 0.00 19.45 19.17 1s24 n ALA 17 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1s24 n LEU 18 N 0.14 -1.33 0.00 0.00 0.00 0.23 -4.35 117.00 111.69 1s24 n LEU 18 Ca 0.07 -1.82 0.00 0.00 0.00 0.00 0.00 56.01 54.26 1s24 n LEU 18 Cb 0.24 0.59 0.00 0.00 0.00 0.00 0.00 43.42 44.25 1s24 n LEU 18 CO 0.06 1.59 0.00 0.61 0.00 0.00 0.00 177.39 179.65 1s24 n GLY 19 N 1.45 -2.71 3.95 -3.96 0.00 -1.16 -4.54 105.19 98.22 1s24 n GLY 19 Ca 0.01 -1.01 -0.25 0.00 0.00 0.00 0.00 46.02 44.78 1s24 n GLY 19 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s24 s ASP 20 N -1.86 4.59 -0.03 1.61 1.01 -1.25 -4.93 116.67 115.80 1s24 s ASP 20 Ca 0.00 0.12 0.10 0.00 0.71 0.00 0.00 52.55 53.48 1s24 s ASP 20 Cb 0.00 -0.68 -0.15 0.00 1.01 0.00 0.00 42.92 43.10 1s24 s ASP 20 CO 0.00 -1.71 0.20 1.21 0.21 0.00 0.00 175.17 175.08 1s24 n GLU 21 N -2.88 0.64 0.03 8.23 2.13 -1.26 -2.45 120.64 125.09 1s24 n GLU 21 Ca 0.11 -0.08 -0.03 0.00 0.66 0.00 0.00 57.16 57.82 1s24 n GLU 21 Cb 0.60 -1.24 -0.02 0.00 0.27 0.00 0.00 31.44 31.05 1s24 n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1s24 h ALA 22 N 0.87 -0.20 -0.03 4.31 0.00 -1.97 -3.26 119.26 118.98 1s24 h ALA 22 Ca -0.04 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1s24 h ALA 22 Cb 0.65 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1s24 h ALA 22 CO 0.00 -0.18 0.12 1.49 0.00 0.00 0.00 179.25 180.68 1s24 h GLU 23 N -1.05 0.00 -0.04 0.00 4.57 -2.01 -3.44 114.58 112.60 1s24 h GLU 23 Ca -0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1s24 h GLU 23 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1s24 h GLU 23 CO 0.03 0.00 0.00 0.41 -1.18 0.00 0.00 179.01 178.27 1s24 n GLY 24 N -1.18 1.56 3.34 1.92 0.00 -1.23 -4.99 105.19 104.61 1s24 n GLY 24 Ca -0.02 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1s24 n GLY 24 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1s24 n PHE 25 N -1.33 4.09 -1.54 1.61 3.01 -1.03 -4.96 117.46 117.31 1s24 n PHE 25 Ca 0.00 -2.71 -0.39 0.00 1.01 0.00 0.00 57.45 55.36 1s24 n PHE 25 Cb 0.09 -2.58 0.04 0.00 -0.01 0.00 0.00 39.48 37.02 1s24 n PHE 25 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 1s24 n THR 26 N 6.17 2.71 -1.68 4.37 5.66 -1.26 -3.59 114.28 126.67 1s24 n THR 26 Ca 0.49 -0.50 -0.46 0.00 -3.05 0.00 0.00 64.05 60.54 1s24 n THR 26 Cb 0.44 -0.90 -0.04 0.00 -1.55 0.00 0.00 70.33 68.28 1s24 n THR 26 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1s24 n PRO 27 N -0.27 2.36 0.00 1.09 -0.02 -1.26 -3.07 135.00 133.83 1s24 n PRO 27 Ca 0.12 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 1s24 n PRO 27 Cb 0.45 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1s24 n PRO 27 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s24 n GLY 28 N 4.12 1.77 3.76 -1.23 0.00 -0.79 -4.91 105.19 107.90 1s24 n GLY 28 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 1s24 n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s24 s THR 29 N -2.00 5.33 -0.04 2.61 2.01 -0.78 -4.99 115.64 117.78 1s24 s THR 29 Ca 0.00 0.45 0.01 0.00 0.31 0.00 0.00 61.69 62.46 1s24 s THR 29 Cb 0.00 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 1s24 s THR 29 CO 0.00 0.46 -0.03 -0.60 -0.69 0.00 0.00 174.62 173.75 1s24 s ARG 30 N 0.04 2.77 0.22 4.92 3.52 -1.26 -4.43 118.95 124.73 1s24 s ARG 30 Ca 0.15 -0.57 -0.10 0.00 -0.13 0.00 0.00 55.73 55.08 1s24 s ARG 30 Cb -0.13 -2.64 0.34 0.00 -1.56 0.00 0.00 34.95 30.96 1s24 s ARG 30 CO 0.04 0.65 1.65 0.35 -0.81 0.00 0.00 175.30 177.17 1s24 h PHE 31 N 4.81 -0.09 -0.57 5.12 3.57 -1.92 0.64 116.94 128.50 1s24 h PHE 31 Ca -0.49 0.05 0.10 0.00 3.53 0.00 0.00 57.97 61.16 1s24 h PHE 31 Cb 1.18 0.14 -0.08 0.00 2.79 0.00 0.00 35.95 39.98 1s24 h PHE 31 CO 0.60 -0.21 0.13 1.49 -2.23 0.00 0.00 178.31 178.09 1s24 h GLU 32 N 0.10 0.27 0.00 1.11 4.57 -1.99 0.48 114.58 119.11 1s24 h GLU 32 Ca 0.35 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.52 1s24 h GLU 32 Cb 0.59 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 1s24 h GLU 32 CO -0.60 0.18 0.00 -3.47 -1.18 0.00 0.00 179.01 173.94 1s24 n ASP 33 N -5.11 0.25 -4.65 1.04 2.03 0.05 -4.65 116.55 105.52 1s24 n ASP 33 Ca 0.08 0.55 -0.41 0.00 0.52 0.00 0.00 54.79 55.53 1s24 n ASP 33 Cb 0.30 -0.61 -0.05 0.00 -0.72 0.00 0.00 41.12 40.03 1s24 n ASP 33 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1s24 s ILE 34 N -3.09 4.94 0.65 5.18 1.01 0.17 -4.94 121.20 125.11 1s24 s ILE 34 Ca 0.08 1.34 -0.11 0.00 0.00 0.00 0.00 60.65 61.96 1s24 s ILE 34 Cb 0.11 -4.02 0.16 0.00 0.01 0.00 0.00 42.46 38.73 1s24 s ILE 34 CO 0.37 0.02 0.51 -0.81 0.00 0.00 0.00 174.94 175.04 1s24 n PRO 35 N 5.53 -2.50 0.23 2.79 -0.04 -1.26 -4.92 135.00 134.83 1s24 n PRO 35 Ca 0.02 -0.83 0.13 0.00 -0.04 0.00 0.00 63.50 62.78 1s24 n PRO 35 Cb 0.49 -0.86 0.30 0.00 -0.04 0.00 0.00 33.50 33.39 1s24 n PRO 35 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1s24 h ASP 36 N -2.16 0.00 -1.00 3.54 5.19 -1.96 -3.25 116.42 116.77 1s24 h ASP 36 Ca -0.20 0.00 0.24 0.00 -0.62 0.00 0.00 57.03 56.44 1s24 h ASP 36 Cb 0.64 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 40.05 1s24 h ASP 36 CO 0.13 0.02 0.64 -0.78 -3.12 0.00 0.00 179.24 176.13 1s24 h ASP 37 N 0.00 0.54 -4.27 6.45 1.82 -2.01 -3.40 116.42 115.55 1s24 h ASP 37 Ca -0.00 0.08 -0.50 0.00 -0.39 0.00 0.00 57.03 56.23 1s24 h ASP 37 Cb 0.89 -0.01 0.06 0.00 0.68 0.00 0.00 39.33 40.95 1s24 h ASP 37 CO 0.00 0.15 0.38 0.86 -1.61 0.00 0.00 179.24 179.02 1s24 s TRP 38 N -5.59 3.29 0.00 0.28 -0.00 -1.23 -5.05 118.94 110.63 1s24 s TRP 38 Ca -0.09 1.42 0.00 0.00 -0.00 0.00 0.00 56.10 57.43 1s24 s TRP 38 Cb 0.25 -2.85 0.00 0.00 -0.00 0.00 0.00 33.47 30.87 1s24 s TRP 38 CO 0.80 -0.86 0.00 0.00 -0.00 0.00 0.00 176.95 176.88 1s24 n PRO 41 N 0.31 0.15 0.00 0.00 -0.02 -1.26 -3.19 135.00 130.99 1s24 n PRO 41 Ca 0.02 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1s24 n PRO 41 Cb 0.51 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 1s24 n PRO 41 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1s24 n ASP 42 N -1.98 1.31 0.00 2.55 2.03 -1.26 -4.93 116.55 114.27 1s24 n ASP 42 Ca 0.04 -0.34 0.00 0.00 0.52 0.00 0.00 54.79 55.02 1s24 n ASP 42 Cb 0.31 0.94 0.00 0.00 -0.72 0.00 0.00 41.12 41.64 1s24 n ASP 42 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1s24 n GLY 44 N 3.29 2.00 1.90 0.00 0.00 -1.19 -4.93 105.19 106.26 1s24 n GLY 44 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1s24 n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s24 n ALA 45 N -0.09 0.40 -1.49 4.61 0.00 -1.26 -4.79 120.51 117.89 1s24 n ALA 45 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.33 1s24 n ALA 45 Cb 0.00 0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1s24 n ALA 45 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1s24 n THR 46 N -1.10 0.00 0.23 0.00 -2.24 -1.26 -3.46 114.28 106.45 1s24 n THR 46 Ca -0.02 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.83 1s24 n THR 46 Cb 0.32 -1.34 0.31 0.00 -2.10 0.00 0.00 70.33 67.52 1s24 n THR 46 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1s24 n LYS 47 N 0.00 0.07 -0.25 -0.78 0.00 -1.26 -3.11 118.16 112.83 1s24 n LYS 47 Ca 0.00 0.46 0.06 0.00 0.00 0.00 0.00 58.31 58.83 1s24 n LYS 47 Cb 0.00 -1.69 0.19 0.00 0.00 0.00 0.00 35.03 33.53 1s24 n LYS 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1s24 h GLU 48 N 0.00 0.22 0.00 1.64 5.08 -2.02 0.37 114.58 119.87 1s24 h GLU 48 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1s24 h GLU 48 Cb 0.13 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1s24 h GLU 48 CO 0.00 0.15 0.00 0.38 -1.00 0.00 0.00 179.01 178.54 1s24 h ASP 49 N 0.23 0.00 -3.36 1.42 3.04 -1.91 -3.44 116.42 112.41 1s24 h ASP 49 Ca 0.43 0.00 -0.59 0.00 -3.24 0.00 0.00 57.03 53.63 1s24 h ASP 49 Cb 0.76 0.00 -0.10 0.00 -1.04 0.00 0.00 39.33 38.95 1s24 h ASP 49 CO -0.55 0.00 -0.22 -0.31 -2.04 0.00 0.00 179.24 176.11 1s24 s TYR 50 N -3.22 3.45 0.27 4.15 2.02 0.13 -0.81 117.35 123.35 1s24 s TYR 50 Ca 0.07 0.70 0.09 0.00 -0.37 0.00 0.00 57.07 57.57 1s24 s TYR 50 Cb 0.06 -2.47 -0.05 0.00 -0.40 0.00 0.00 41.96 39.10 1s24 s TYR 50 CO 0.65 0.14 -0.14 0.08 -1.57 0.00 0.00 175.55 174.72 1s24 s VAL 51 N 0.76 2.04 -0.42 0.71 1.01 0.50 -4.85 120.40 120.15 1s24 s VAL 51 Ca 0.21 -2.26 -0.29 0.00 0.00 0.00 0.00 61.98 59.64 1s24 s VAL 51 Cb -0.14 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 33.94 1s24 s VAL 51 CO 0.07 -0.40 1.34 -0.22 0.00 0.00 0.00 175.10 175.89 1s24 s LEU 52 N -3.46 3.62 0.42 3.92 1.98 -1.26 0.11 118.68 124.01 1s24 s LEU 52 Ca 0.28 0.77 -0.24 0.00 -2.89 0.00 0.00 54.13 52.05 1s24 s LEU 52 Cb -0.01 -3.54 -0.11 0.00 0.66 0.00 0.00 46.19 43.19 1s24 s LEU 52 CO 0.12 -1.37 0.91 0.00 -1.89 0.00 0.00 176.35 174.12 1s24 n TYR 53 N 8.51 0.81 -3.69 5.38 9.36 -1.22 -4.87 117.16 131.44 1s24 n TYR 53 Ca 0.15 0.57 -0.11 0.00 3.32 0.00 0.00 57.90 61.83 1s24 n TYR 53 Cb 0.48 -2.17 -0.10 0.00 -0.63 0.00 0.00 39.34 36.92 1s24 n TYR 53 CO 0.00 0.00 0.00 -1.83 0.22 0.00 0.00 176.86 175.25 1s24 s GLU 54 N -1.93 0.53 -0.69 2.98 -1.05 -1.26 -4.97 118.70 112.30 1s24 s GLU 54 Ca 0.64 0.79 -0.27 0.00 -0.15 0.00 0.00 54.97 55.98 1s24 s GLU 54 Cb -0.57 0.15 0.02 0.00 -0.44 0.00 0.00 34.13 33.29 1s24 s GLU 54 CO 0.57 -0.11 1.39 -2.00 0.95 0.00 0.00 175.26 176.06 1s24 s GLU 55 N 0.86 3.11 0.00 -4.83 2.12 -1.26 -5.24 118.70 113.46 1s24 s GLU 55 Ca -0.05 0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.28 1s24 s GLU 55 Cb -0.05 -4.20 0.00 0.00 0.26 0.00 0.00 34.13 30.13 1s24 s GLU 55 CO -0.07 -2.21 0.00 1.63 -0.54 0.00 0.00 175.26 174.07