#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 5.05 -0.03 7.83 1.11 -1.26 -4.79 116.67 124.58 1spw s ASP 2 Ca 0.00 -0.12 0.01 0.00 0.18 0.00 0.00 52.55 52.62 1spw s ASP 2 Cb 0.00 -2.54 0.02 0.00 1.07 0.00 0.00 42.92 41.46 1spw s ASP 2 CO 0.00 -2.71 -0.03 -0.63 1.18 0.00 0.00 175.17 172.98 1spw s ILE 3 N 10.21 0.37 -0.71 0.77 1.01 -1.26 -3.37 121.20 128.23 1spw s ILE 3 Ca 0.72 -0.08 0.02 0.00 0.00 0.00 0.00 60.65 61.32 1spw s ILE 3 Cb -0.10 -0.40 0.17 0.00 0.01 0.00 0.00 42.46 42.15 1spw s ILE 3 CO 0.10 0.16 0.51 -0.31 0.00 0.00 0.00 174.94 175.40 1spw s TYR 4 N 0.63 3.56 -0.26 3.97 1.51 -0.74 -3.87 117.35 122.15 1spw s TYR 4 Ca -0.07 -3.16 -0.18 0.00 -1.01 0.00 0.00 57.07 52.65 1spw s TYR 4 Cb -0.11 -2.92 -0.03 0.00 -0.11 0.00 0.00 41.96 38.80 1spw s TYR 4 CO -0.01 -0.66 0.50 0.08 -1.11 0.00 0.00 175.55 174.35 1spw s VAL 5 N -1.05 5.08 0.65 0.71 1.01 -1.24 -2.96 120.40 122.59 1spw s VAL 5 Ca 0.23 0.84 -0.18 0.00 0.00 0.00 0.00 61.98 62.87 1spw s VAL 5 Cb -0.11 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 1spw s VAL 5 CO -0.11 0.09 1.30 0.00 0.00 0.00 0.00 175.10 176.38 1spw n THR 7 N -1.88 1.67 -0.06 0.00 -2.24 -1.25 -2.85 114.28 107.66 1spw n THR 7 Ca 0.16 -1.40 -0.14 0.00 -2.27 0.00 0.00 64.05 60.40 1spw n THR 7 Cb 0.48 0.13 -0.05 0.00 -2.10 0.00 0.00 70.33 68.79 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 0.17 0.88 -0.02 2.28 0.31 -1.26 -4.77 118.33 115.92 1spw n VAL 8 Ca 0.18 -0.12 0.04 0.00 -0.01 0.00 0.00 64.34 64.43 1spw n VAL 8 Cb 0.69 -1.74 -0.10 0.00 -0.91 0.00 0.00 33.84 31.78 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 1.89 0.82 3.13 0.00 0.00 -1.13 -5.04 105.19 104.86 1spw n GLY 10 Ca -0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.31 -4.04 -4.86 1.61 9.36 -1.26 -4.43 117.16 111.23 1spw n TYR 11 Ca 0.00 0.18 -0.27 0.00 3.32 0.00 0.00 57.90 61.13 1spw n TYR 11 Cb 0.00 -1.56 -0.16 0.00 -0.63 0.00 0.00 39.34 36.98 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 -1.69 2.06 0.14 2.98 8.01 -1.26 -1.28 118.70 127.66 1spw s GLU 12 Ca 0.48 -0.62 -0.07 0.00 0.01 0.00 0.00 54.97 54.78 1spw s GLU 12 Cb -0.31 -1.69 -0.02 0.00 -4.31 0.00 0.00 34.13 27.80 1spw s GLU 12 CO 0.75 0.17 0.20 -0.47 0.01 0.00 0.00 175.26 175.92 1spw s TYR 13 N 0.29 0.47 -0.37 1.61 5.04 -1.16 -5.00 117.35 118.25 1spw s TYR 13 Ca -0.11 -0.86 0.00 0.00 -2.44 0.00 0.00 57.07 53.67 1spw s TYR 13 Cb -0.14 -0.17 0.14 0.00 0.35 0.00 0.00 41.96 42.13 1spw s TYR 13 CO 0.04 -0.63 0.21 0.34 -1.34 0.00 0.00 175.55 174.18 1spw s ASP 14 N -2.97 3.10 -0.73 4.32 -1.08 -1.26 -1.80 116.67 116.25 1spw s ASP 14 Ca 0.16 -2.26 -0.19 0.00 -0.52 0.00 0.00 52.55 49.75 1spw s ASP 14 Cb 0.05 -0.52 -0.18 0.00 -1.46 0.00 0.00 42.92 40.81 1spw s ASP 14 CO -0.02 -0.30 1.87 -2.65 0.52 0.00 0.00 175.17 174.59 1spw n PRO 15 N 3.96 0.00 -2.67 4.34 -0.02 -1.22 -4.65 135.00 134.75 1spw n PRO 15 Ca 0.11 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.55 1spw n PRO 15 Cb 0.37 -1.00 0.07 0.00 -0.02 0.00 0.00 33.50 32.91 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 6.74 -3.58 -2.49 3.55 0.00 -1.26 -4.91 120.51 118.55 1spw n ALA 16 Ca 0.49 -0.28 -0.25 0.00 0.00 0.00 0.00 53.44 53.40 1spw n ALA 16 Cb 0.04 -3.23 -0.08 0.00 0.00 0.00 0.00 19.45 16.18 1spw n ALA 16 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1spw s PHE 17 N 0.19 1.78 0.00 0.00 0.40 -1.26 -5.09 117.98 114.00 1spw s PHE 17 Ca 0.26 -1.34 0.00 0.00 -0.60 0.00 0.00 56.93 55.25 1spw s PHE 17 Cb 0.20 -1.10 0.00 0.00 0.51 0.00 0.00 43.02 42.63 1spw s PHE 17 CO -0.08 -0.38 0.89 0.39 0.70 0.00 0.00 175.22 176.74 1spw n GLU 18 N -0.89 0.00 -4.13 0.44 1.02 -1.26 -4.86 120.64 110.96 1spw n GLU 18 Ca -0.05 0.54 -0.10 0.00 -0.02 0.00 0.00 57.16 57.53 1spw n GLU 18 Cb 0.65 -1.39 -0.10 0.00 -0.02 0.00 0.00 31.44 30.57 1spw n GLU 18 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1spw s ASP 19 N -2.29 0.94 0.01 1.62 3.68 -1.26 -5.16 116.67 114.20 1spw s ASP 19 Ca 0.00 -0.93 0.07 0.00 2.13 0.00 0.00 52.55 53.82 1spw s ASP 19 Cb 0.00 0.11 -0.03 0.00 -1.45 0.00 0.00 42.92 41.55 1spw s ASP 19 CO 0.00 -0.46 -0.22 -0.22 0.13 0.00 0.00 175.17 174.40 1spw s LEU 20 N -2.79 2.34 0.78 -1.34 0.20 -1.26 -5.14 118.68 111.47 1spw s LEU 20 Ca 0.07 -0.44 -0.08 0.00 0.69 0.00 0.00 54.13 54.37 1spw s LEU 20 Cb 0.04 -1.41 0.11 0.00 -0.43 0.00 0.00 46.19 44.50 1spw s LEU 20 CO -0.05 0.29 1.10 -2.16 -0.29 0.00 0.00 176.35 175.24 1spw s PRO 21 N -1.00 1.65 -0.58 0.98 0.04 -1.26 -5.00 135.00 129.83 1spw s PRO 21 Ca 0.12 -0.50 0.01 0.00 0.04 0.00 0.00 61.00 60.67 1spw s PRO 21 Cb -0.10 -2.12 0.42 0.00 0.04 0.00 0.00 34.50 32.74 1spw s PRO 21 CO 0.02 -1.61 1.68 -0.40 0.04 0.00 0.00 177.00 176.72 1spw n ASP 22 N -3.13 6.51 0.00 6.66 5.68 -1.26 -4.49 116.55 126.51 1spw n ASP 22 Ca 0.12 -3.78 0.00 0.00 -0.50 0.00 0.00 54.79 50.63 1spw n ASP 22 Cb 0.60 -0.76 0.00 0.00 -1.14 0.00 0.00 41.12 39.82 1spw n ASP 22 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1spw n ASP 23 N -0.71 0.00 -4.74 -1.12 2.03 -1.26 -5.14 116.55 105.61 1spw n ASP 23 Ca 0.52 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 55.43 1spw n ASP 23 Cb 0.63 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.98 1spw n ASP 23 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1spw s TRP 24 N 0.00 3.83 -0.02 -0.67 -0.00 -1.26 -4.99 118.94 115.83 1spw s TRP 24 Ca 0.00 1.71 0.04 0.00 -0.00 0.00 0.00 56.10 57.86 1spw s TRP 24 Cb 0.00 -2.95 -0.01 0.00 -0.00 0.00 0.00 33.47 30.51 1spw s TRP 24 CO 0.00 0.30 -0.15 0.00 -0.00 0.00 0.00 176.95 177.10 1spw s ALA 25 N -0.34 1.29 0.18 5.86 0.00 -1.26 -1.76 121.76 125.74 1spw s ALA 25 Ca 0.42 -0.64 -0.33 0.00 0.00 0.00 0.00 51.96 51.41 1spw s ALA 25 Cb -0.23 -0.36 -0.14 0.00 0.00 0.00 0.00 23.12 22.39 1spw s ALA 25 CO 0.28 0.29 1.42 0.00 0.00 0.00 0.00 175.76 177.75 1spw n PRO 27 N 2.52 0.47 0.00 0.00 -0.04 -1.26 -1.96 135.00 134.74 1spw n PRO 27 Ca 0.15 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.65 1spw n PRO 27 Cb 0.28 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 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 -1.09 0.00 -0.17 0.52 0.31 -1.26 -4.82 118.33 111.81 1spw n VAL 28 Ca 0.12 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.43 1spw n VAL 28 Cb 0.09 -0.21 0.05 0.00 -0.91 0.00 0.00 33.84 32.86 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 0.56 3.47 0.00 0.00 -0.83 -5.02 105.19 102.00 1spw n GLY 30 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.26 -2.51 -1.77 4.61 0.00 -1.26 -4.26 120.51 114.06 1spw n ALA 31 Ca 0.00 -0.86 -0.29 0.00 0.00 0.00 0.00 53.44 52.28 1spw n ALA 31 Cb 0.00 -1.90 0.14 0.00 0.00 0.00 0.00 19.45 17.69 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 -2.24 3.65 -0.41 0.00 1.04 -1.26 -1.03 113.70 113.45 1spw s SER 32 Ca 0.62 0.67 -0.06 0.00 0.48 0.00 0.00 55.95 57.66 1spw s SER 32 Cb -0.21 -1.04 -0.17 0.00 0.10 0.00 0.00 66.02 64.70 1spw s SER 32 CO 0.64 -2.43 3.33 2.29 0.98 0.00 0.00 173.24 178.05 1spw n LYS 33 N -3.64 2.47 -0.03 4.02 2.85 -0.72 -3.67 118.16 119.44 1spw n LYS 33 Ca 0.10 -1.53 -0.04 0.00 -1.05 0.00 0.00 58.31 55.79 1spw n LYS 33 Cb 0.60 -2.19 -0.03 0.00 -0.65 0.00 0.00 35.03 32.76 1spw n LYS 33 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1spw n ASP 34 N 2.40 3.56 0.21 -5.58 2.03 -1.26 -4.56 116.55 113.34 1spw n ASP 34 Ca 0.51 -0.03 0.14 0.00 0.52 0.00 0.00 54.79 55.93 1spw n ASP 34 Cb 0.71 -0.05 0.45 0.00 -0.72 0.00 0.00 41.12 41.52 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 0.01 1.00 -2.71 -1.67 0.00 -1.96 -3.44 119.26 110.48 1spw h ALA 35 Ca -0.13 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.25 1spw h ALA 35 Cb 1.21 0.00 0.05 0.00 0.00 0.00 0.00 17.79 19.06 1spw h ALA 35 CO -0.02 0.00 0.79 -0.06 0.00 0.00 0.00 179.25 179.97 1spw s PHE 36 N -3.39 3.01 -0.03 0.00 0.40 -1.26 -3.96 117.98 112.75 1spw s PHE 36 Ca 0.05 0.92 -0.02 0.00 -0.60 0.00 0.00 56.93 57.27 1spw s PHE 36 Cb 0.08 -3.86 0.01 0.00 0.51 0.00 0.00 43.02 39.76 1spw s PHE 36 CO 0.57 -2.89 0.08 -2.00 0.70 0.00 0.00 175.22 171.67 1spw s GLU 37 N -0.01 0.08 0.13 0.44 -6.30 -1.22 -5.00 118.70 106.82 1spw s GLU 37 Ca 0.62 0.13 -0.31 0.00 -2.50 0.00 0.00 54.97 52.91 1spw s GLU 37 Cb -0.43 0.01 -0.09 0.00 0.00 0.00 0.00 34.13 33.62 1spw s GLU 37 CO 0.41 -0.03 1.61 0.21 0.02 0.00 0.00 175.26 177.47 1spw s LYS 38 N 0.19 4.20 0.00 4.30 2.20 -1.25 -3.68 119.74 125.70 1spw s LYS 38 Ca -0.01 2.36 0.00 0.00 -0.36 0.00 0.00 55.97 57.96 1spw s LYS 38 Cb -0.02 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.98 1spw s LYS 38 CO -0.01 -0.66 0.00 1.04 -0.36 0.00 0.00 175.35 175.36