#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1spw s ASP 2 N 0.00 6.10 -0.02 6.12 2.15 -1.26 -5.08 116.67 124.68 1spw s ASP 2 Ca 0.00 0.64 0.01 0.00 0.43 0.00 0.00 52.55 53.63 1spw s ASP 2 Cb 0.00 -1.98 0.01 0.00 -0.30 0.00 0.00 42.92 40.65 1spw s ASP 2 CO 0.00 -0.59 -0.05 -0.63 -0.17 0.00 0.00 175.17 173.74 1spw s ILE 3 N -2.62 0.46 -0.78 4.11 1.01 -1.26 -3.59 121.20 118.52 1spw s ILE 3 Ca 0.46 -0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.96 1spw s ILE 3 Cb -0.10 -0.44 0.19 0.00 0.01 0.00 0.00 42.46 42.12 1spw s ILE 3 CO 0.41 0.17 0.62 -0.31 0.00 0.00 0.00 174.94 175.83 1spw s TYR 4 N 0.42 3.70 -0.28 3.97 1.51 -0.25 -3.77 117.35 122.64 1spw s TYR 4 Ca -0.05 -3.11 -0.23 0.00 -1.01 0.00 0.00 57.07 52.66 1spw s TYR 4 Cb -0.09 -3.03 -0.00 0.00 -0.11 0.00 0.00 41.96 38.73 1spw s TYR 4 CO -0.00 -0.68 0.77 0.08 -1.11 0.00 0.00 175.55 174.61 1spw s VAL 5 N -1.19 4.84 0.64 0.71 1.01 -1.26 -2.74 120.40 122.40 1spw s VAL 5 Ca 0.25 1.28 -0.18 0.00 0.00 0.00 0.00 61.98 63.33 1spw s VAL 5 Cb -0.09 -4.10 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 1spw s VAL 5 CO -0.12 -0.16 1.22 0.00 0.00 0.00 0.00 175.10 176.04 1spw n THR 7 N -1.92 1.96 -0.04 0.00 -2.24 -1.26 -2.93 114.28 107.85 1spw n THR 7 Ca 0.15 -1.57 -0.09 0.00 -2.27 0.00 0.00 64.05 60.28 1spw n THR 7 Cb 0.48 -0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 1spw n THR 7 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1spw n VAL 8 N -0.04 0.88 -0.01 2.28 0.31 -1.26 -4.79 118.33 115.70 1spw n VAL 8 Ca 0.20 0.02 0.06 0.00 -0.01 0.00 0.00 64.34 64.61 1spw n VAL 8 Cb 0.79 -1.74 -0.10 0.00 -0.91 0.00 0.00 33.84 31.89 1spw n VAL 8 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1spw n GLY 10 N 1.81 0.83 3.18 0.00 0.00 -1.15 -5.03 105.19 104.83 1spw n GLY 10 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 1spw n GLY 10 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1spw n TYR 11 N -2.30 -2.47 -4.09 1.61 9.36 -1.26 -4.35 117.16 113.66 1spw n TYR 11 Ca 0.00 0.52 -0.32 0.00 3.32 0.00 0.00 57.90 61.41 1spw n TYR 11 Cb 0.00 -1.68 -0.15 0.00 -0.63 0.00 0.00 39.34 36.88 1spw n TYR 11 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1spw s GLU 12 N -0.97 2.58 0.23 2.98 0.41 -1.26 -0.43 118.70 122.23 1spw s GLU 12 Ca 0.56 -1.09 0.08 0.00 -0.41 0.00 0.00 54.97 54.11 1spw s GLU 12 Cb -0.54 -2.73 -0.05 0.00 -1.78 0.00 0.00 34.13 29.03 1spw s GLU 12 CO 0.63 -0.40 -0.13 -0.47 -0.49 0.00 0.00 175.26 174.40 1spw s TYR 13 N 1.20 1.82 -0.40 1.61 5.04 -1.11 -5.01 117.35 120.50 1spw s TYR 13 Ca -0.02 -0.58 0.01 0.00 -2.44 0.00 0.00 57.07 54.04 1spw s TYR 13 Cb -0.17 -0.88 0.14 0.00 0.35 0.00 0.00 41.96 41.40 1spw s TYR 13 CO -0.09 0.37 0.22 0.34 -1.34 0.00 0.00 175.55 175.06 1spw s ASP 14 N -3.36 3.38 -0.38 4.32 -1.08 -1.26 -1.09 116.67 117.20 1spw s ASP 14 Ca 0.25 -2.43 -0.32 0.00 -0.52 0.00 0.00 52.55 49.53 1spw s ASP 14 Cb -0.00 -0.77 -0.14 0.00 -1.46 0.00 0.00 42.92 40.55 1spw s ASP 14 CO 0.09 -0.29 1.58 -2.65 0.52 0.00 0.00 175.17 174.42 1spw n PRO 15 N 3.77 0.00 0.00 4.34 -0.02 -1.24 -4.72 135.00 137.14 1spw n PRO 15 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1spw n PRO 15 Cb 0.36 -1.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.74 1spw n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1spw n ALA 16 N 5.55 0.00 -3.00 3.55 0.00 -1.26 -4.58 120.51 120.77 1spw n ALA 16 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1spw n ALA 16 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1spw n ALA 16 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1spw n PHE 17 N 0.00 -0.04 0.01 0.00 3.01 -1.26 -5.10 117.46 114.08 1spw n PHE 17 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.45 1spw n PHE 17 Cb 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1spw n PHE 17 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1spw n GLU 18 N 0.00 0.03 -2.56 -1.08 2.13 -1.26 -4.94 120.64 112.97 1spw n GLU 18 Ca 0.00 0.01 -0.41 0.00 0.66 0.00 0.00 57.16 57.42 1spw n GLU 18 Cb 0.00 -0.55 -0.03 0.00 0.27 0.00 0.00 31.44 31.13 1spw n GLU 18 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1spw s ASP 19 N -5.47 6.16 -0.46 4.31 -1.08 -1.26 -4.90 116.67 113.98 1spw s ASP 19 Ca -0.02 -0.47 0.03 0.00 -0.52 0.00 0.00 52.55 51.58 1spw s ASP 19 Cb 0.01 -2.56 0.16 0.00 -1.46 0.00 0.00 42.92 39.07 1spw s ASP 19 CO 0.02 -1.83 0.33 -0.22 0.52 0.00 0.00 175.17 174.00 1spw s LEU 20 N 5.70 2.10 1.07 -1.34 0.20 -1.26 -5.12 118.68 120.02 1spw s LEU 20 Ca 0.35 -3.02 -0.19 0.00 0.69 0.00 0.00 54.13 51.96 1spw s LEU 20 Cb -0.08 -0.71 0.06 0.00 -0.43 0.00 0.00 46.19 45.03 1spw s LEU 20 CO 0.15 -0.19 -0.24 -2.65 -0.29 0.00 0.00 176.35 173.13 1spw n PRO 21 N 2.96 -1.45 -1.12 0.98 -0.02 -1.26 -4.83 135.00 130.27 1spw n PRO 21 Ca 0.23 -0.41 -0.26 0.00 -2.02 0.00 0.00 63.50 61.03 1spw n PRO 21 Cb 0.42 -1.51 0.07 0.00 -0.02 0.00 0.00 33.50 32.47 1spw n PRO 21 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1spw n ASP 22 N -0.57 6.62 -2.67 2.55 5.68 -1.26 -4.08 116.55 122.82 1spw n ASP 22 Ca 0.01 -3.45 -0.04 0.00 -0.50 0.00 0.00 54.79 50.81 1spw n ASP 22 Cb 0.59 -0.97 0.02 0.00 -1.14 0.00 0.00 41.12 39.61 1spw n ASP 22 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1spw n ASP 23 N -0.45 -1.32 -4.76 -1.12 5.75 -1.26 -5.13 116.55 108.26 1spw n ASP 23 Ca 0.49 -1.84 -0.41 0.00 -0.01 0.00 0.00 54.79 53.01 1spw n ASP 23 Cb 0.75 1.01 -0.02 0.00 -1.03 0.00 0.00 41.12 41.83 1spw n ASP 23 CO 0.00 0.00 0.00 0.86 -0.11 0.00 0.00 177.20 177.95 1spw s TRP 24 N 0.07 2.99 -0.03 2.11 -0.00 -1.26 -4.92 118.94 117.91 1spw s TRP 24 Ca 0.08 1.21 0.04 0.00 -0.00 0.00 0.00 56.10 57.43 1spw s TRP 24 Cb 0.14 -3.78 -0.00 0.00 -0.00 0.00 0.00 33.47 29.83 1spw s TRP 24 CO -0.03 -2.34 -0.14 0.00 -0.00 0.00 0.00 176.95 174.43 1spw s ALA 25 N -0.59 1.23 0.18 5.86 0.00 -1.26 -1.80 121.76 125.37 1spw s ALA 25 Ca 0.54 -0.57 -0.33 0.00 0.00 0.00 0.00 51.96 51.60 1spw s ALA 25 Cb -0.41 -0.38 -0.15 0.00 0.00 0.00 0.00 23.12 22.18 1spw s ALA 25 CO 0.49 0.25 1.28 0.00 0.00 0.00 0.00 175.76 177.78 1spw n PRO 27 N 2.04 0.59 0.00 0.00 -0.04 -1.26 -2.13 135.00 134.20 1spw n PRO 27 Ca 0.15 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1spw n PRO 27 Cb 0.26 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.22 1spw n PRO 27 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1spw n VAL 28 N -1.03 0.00 -0.27 0.52 0.31 -1.26 -4.82 118.33 111.77 1spw n VAL 28 Ca 0.14 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.56 1spw n VAL 28 Cb 0.08 -0.10 0.22 0.00 -0.91 0.00 0.00 33.84 33.13 1spw n VAL 28 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1spw n GLY 30 N -1.37 0.35 3.51 0.00 0.00 -0.90 -5.02 105.19 101.75 1spw n GLY 30 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1spw n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1spw n ALA 31 N -1.72 -2.26 -1.93 4.61 0.00 -1.26 -4.23 120.51 113.71 1spw n ALA 31 Ca 0.00 -0.87 -0.29 0.00 0.00 0.00 0.00 53.44 52.28 1spw n ALA 31 Cb 0.00 -1.98 0.17 0.00 0.00 0.00 0.00 19.45 17.64 1spw n ALA 31 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1spw s SER 32 N -2.35 3.40 -0.14 0.00 1.04 -1.26 -0.15 113.70 114.24 1spw s SER 32 Ca 0.64 0.28 -0.06 0.00 0.48 0.00 0.00 55.95 57.30 1spw s SER 32 Cb -0.22 -0.41 -0.19 0.00 0.10 0.00 0.00 66.02 65.29 1spw s SER 32 CO 0.63 -2.55 3.42 2.29 0.98 0.00 0.00 173.24 178.01 1spw n LYS 33 N -3.63 2.14 -0.03 4.02 0.00 -0.75 -3.67 118.16 116.25 1spw n LYS 33 Ca 0.14 -1.33 -0.05 0.00 -0.00 0.00 0.00 58.31 57.07 1spw n LYS 33 Cb 0.60 -2.05 -0.03 0.00 -0.00 0.00 0.00 35.03 33.55 1spw n LYS 33 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1spw n ASP 34 N 2.17 2.56 0.22 -5.58 2.03 -1.26 -4.60 116.55 112.09 1spw n ASP 34 Ca 0.45 0.00 0.09 0.00 0.52 0.00 0.00 54.79 55.85 1spw n ASP 34 Cb 0.82 -0.12 0.48 0.00 -0.72 0.00 0.00 41.12 41.57 1spw n ASP 34 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1spw h ALA 35 N -0.07 1.10 -2.72 -1.67 0.00 -1.96 -3.43 119.26 110.51 1spw h ALA 35 Ca -0.14 -0.24 -0.53 0.00 0.00 0.00 0.00 54.91 54.01 1spw h ALA 35 Cb 1.18 -0.04 0.06 0.00 0.00 0.00 0.00 17.79 18.99 1spw h ALA 35 CO -0.05 0.32 0.81 -0.06 0.00 0.00 0.00 179.25 180.28 1spw s PHE 36 N -3.81 2.99 -0.06 0.00 0.40 -1.26 -4.13 117.98 112.11 1spw s PHE 36 Ca -0.01 0.88 -0.03 0.00 -0.60 0.00 0.00 56.93 57.17 1spw s PHE 36 Cb 0.11 -3.88 0.03 0.00 0.51 0.00 0.00 43.02 39.79 1spw s PHE 36 CO 0.65 -3.00 0.15 -2.00 0.70 0.00 0.00 175.22 171.72 1spw s GLU 37 N 0.02 0.11 0.27 0.44 2.12 -1.25 -5.02 118.70 115.40 1spw s GLU 37 Ca 0.63 0.34 -0.30 0.00 0.36 0.00 0.00 54.97 56.00 1spw s GLU 37 Cb -0.43 -0.12 -0.13 0.00 0.26 0.00 0.00 34.13 33.70 1spw s GLU 37 CO 0.41 -0.13 1.28 1.17 -0.54 0.00 0.00 175.26 177.45 1spw n LYS 38 N 3.95 1.88 0.00 4.30 0.00 -1.26 -4.23 118.16 122.79 1spw n LYS 38 Ca -0.23 0.66 0.00 0.00 0.00 0.00 0.00 58.31 58.74 1spw n LYS 38 Cb 0.53 -2.23 0.00 0.00 0.00 0.00 0.00 35.03 33.33 1spw n LYS 38 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34