#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1spw n ASP 2 N 0.00 -3.86 -3.86 7.83 9.92 -1.26 -4.95 116.55 120.37 1spw n ASP 2 Ca 0.00 1.17 -0.12 0.00 -0.53 0.00 0.00 54.79 55.31 1spw n ASP 2 Cb 0.00 -3.73 -0.13 0.00 -0.64 0.00 0.00 41.12 36.62 1spw n ASP 2 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1spw s ILE 3 N -0.51 0.01 -0.64 0.53 -1.09 -1.26 -4.45 121.20 113.79 1spw s ILE 3 Ca -0.15 -0.07 0.05 0.00 -2.23 0.00 0.00 60.65 58.24 1spw s ILE 3 Cb 0.01 -0.12 0.15 0.00 -1.58 0.00 0.00 42.46 40.92 1spw s ILE 3 CO 0.47 -0.04 0.41 -0.31 -1.23 0.00 0.00 174.94 174.23 1spw s TYR 4 N -0.09 3.41 -0.27 3.97 2.02 -1.26 -3.96 117.35 121.17 1spw s TYR 4 Ca -0.01 -3.27 -0.22 0.00 -0.37 0.00 0.00 57.07 53.20 1spw s TYR 4 Cb -0.01 -2.73 -0.01 0.00 -0.40 0.00 0.00 41.96 38.80 1spw s TYR 4 CO 0.00 -0.62 0.69 0.08 -1.57 0.00 0.00 175.55 174.13 1spw s VAL 5 N -1.03 4.92 0.53 0.71 1.01 -1.25 -2.54 120.40 122.75 1spw s VAL 5 Ca 0.22 1.18 -0.19 0.00 0.00 0.00 0.00 61.98 63.19 1spw s VAL 5 Cb -0.12 -4.01 -0.09 0.00 0.00 0.00 0.00 36.38 32.15 1spw s VAL 5 CO -0.11 -0.06 0.55 0.00 0.00 0.00 0.00 175.10 175.48 1spw n THR 7 N -1.48 2.02 -0.04 0.00 -2.24 -1.25 -2.74 114.28 108.55 1spw n THR 7 Ca 0.11 -1.51 -0.10 0.00 -2.27 0.00 0.00 64.05 60.28 1spw n THR 7 Cb 0.46 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.62 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 0.75 -0.03 2.28 0.31 -1.26 -4.80 118.33 115.75 1spw n VAL 8 Ca 0.21 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 1spw n VAL 8 Cb 0.85 -1.70 -0.10 0.00 -0.91 0.00 0.00 33.84 31.98 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 2.00 0.85 3.31 0.00 0.00 -1.11 -5.04 105.19 105.20 1spw n GLY 10 Ca -0.11 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.26 -1.51 -4.21 1.61 9.36 -1.25 -4.50 117.16 114.40 1spw n TYR 11 Ca 0.00 0.18 -0.26 0.00 3.32 0.00 0.00 57.90 61.14 1spw n TYR 11 Cb 0.00 -1.63 -0.17 0.00 -0.63 0.00 0.00 39.34 36.92 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 -3.44 1.67 0.33 2.98 2.02 -1.26 -1.06 118.70 119.94 1spw s GLU 12 Ca 0.55 -0.35 0.07 0.00 0.02 0.00 0.00 54.97 55.27 1spw s GLU 12 Cb -0.14 -1.55 -0.02 0.00 0.10 0.00 0.00 34.13 32.51 1spw s GLU 12 CO 0.67 -0.14 0.33 -0.47 0.02 0.00 0.00 175.26 175.68 1spw s TYR 13 N 1.24 2.98 -0.32 1.61 5.04 -1.05 -4.99 117.35 121.85 1spw s TYR 13 Ca -0.03 -0.27 -0.01 0.00 -2.44 0.00 0.00 57.07 54.32 1spw s TYR 13 Cb -0.14 -1.82 0.11 0.00 0.35 0.00 0.00 41.96 40.45 1spw s TYR 13 CO -0.03 0.16 0.14 0.34 -1.34 0.00 0.00 175.55 174.81 1spw s ASP 14 N -4.03 3.72 0.03 4.32 2.15 -1.26 -4.05 116.67 117.55 1spw s ASP 14 Ca 0.41 -1.73 -0.27 0.00 0.43 0.00 0.00 52.55 51.40 1spw s ASP 14 Cb -0.07 -0.69 -0.14 0.00 -0.30 0.00 0.00 42.92 41.73 1spw s ASP 14 CO 0.28 -0.39 0.70 -2.65 -0.17 0.00 0.00 175.17 172.93 1spw n PRO 15 N 4.71 0.00 -1.27 4.34 -0.02 -1.26 -3.79 135.00 137.70 1spw n PRO 15 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1spw n PRO 15 Cb 0.40 -1.01 0.00 0.00 -0.02 0.00 0.00 33.50 32.87 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 0.87 -1.72 -0.04 3.55 0.00 -1.26 -5.06 120.51 116.85 1spw n ALA 16 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.55 1spw n ALA 16 Cb 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.52 1spw n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1spw n PHE 17 N -0.70 0.35 0.00 0.00 -0.00 -1.25 -5.08 117.46 110.78 1spw n PHE 17 Ca 0.00 0.15 0.00 0.00 -0.00 0.00 0.00 57.45 57.60 1spw n PHE 17 Cb 0.27 -0.45 0.00 0.00 -0.00 0.00 0.00 39.48 39.31 1spw n PHE 17 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 1spw n GLU 18 N -3.54 0.00 -0.13 -4.13 2.13 -1.26 -4.99 120.64 108.73 1spw n GLU 18 Ca -0.05 0.00 -0.27 0.00 0.66 0.00 0.00 57.16 57.50 1spw n GLU 18 Cb 0.19 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.79 1spw n GLU 18 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1spw n ASP 19 N -1.43 1.92 -3.20 4.31 8.00 -1.26 -5.04 116.55 119.86 1spw n ASP 19 Ca 0.00 0.37 -0.24 0.00 0.71 0.00 0.00 54.79 55.62 1spw n ASP 19 Cb 0.00 -0.87 0.02 0.00 -0.02 0.00 0.00 41.12 40.25 1spw n ASP 19 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1spw n LEU 20 N -4.31 -2.61 -4.94 0.64 0.00 -1.26 -4.95 117.00 99.57 1spw n LEU 20 Ca -0.46 0.02 -0.29 0.00 0.00 0.00 0.00 56.01 55.28 1spw n LEU 20 Cb 0.81 -1.46 0.18 0.00 0.00 0.00 0.00 43.42 42.96 1spw n LEU 20 CO 0.09 -0.44 0.84 -2.16 0.00 0.00 0.00 177.39 175.72 1spw s PRO 21 N -1.80 0.72 -0.40 1.96 0.04 -1.26 -4.95 135.00 129.31 1spw s PRO 21 Ca 0.24 -0.54 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1spw s PRO 21 Cb -0.02 -1.91 0.37 0.00 0.04 0.00 0.00 34.50 32.98 1spw s PRO 21 CO 0.53 -2.33 1.87 -0.25 0.04 0.00 0.00 177.00 176.86 1spw n ASP 22 N -3.66 5.58 -2.58 6.66 8.00 -1.26 -3.91 116.55 125.38 1spw n ASP 22 Ca 0.16 -3.26 -0.03 0.00 0.71 0.00 0.00 54.79 52.37 1spw n ASP 22 Cb 0.59 -0.91 0.11 0.00 -0.02 0.00 0.00 41.12 40.90 1spw n ASP 22 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1spw n ASP 23 N -0.35 -1.45 -4.75 -2.24 2.03 -1.26 -5.09 116.55 103.43 1spw n ASP 23 Ca 0.42 -2.15 -0.40 0.00 0.52 0.00 0.00 54.79 53.18 1spw n ASP 23 Cb 0.89 0.74 -0.06 0.00 -0.72 0.00 0.00 41.12 41.97 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 0.13 3.98 -0.01 -0.67 -0.00 -1.25 -4.92 118.94 116.20 1spw s TRP 24 Ca 0.12 1.91 0.06 0.00 -0.00 0.00 0.00 56.10 58.18 1spw s TRP 24 Cb 0.38 -2.97 -0.02 0.00 -0.00 0.00 0.00 33.47 30.86 1spw s TRP 24 CO -0.10 0.46 -0.20 0.00 -0.00 0.00 0.00 176.95 177.11 1spw s ALA 25 N -1.18 1.65 0.20 5.86 0.00 -1.26 0.03 121.76 127.05 1spw s ALA 25 Ca 0.41 -0.86 -0.29 0.00 0.00 0.00 0.00 51.96 51.22 1spw s ALA 25 Cb -0.26 -0.42 -0.17 0.00 0.00 0.00 0.00 23.12 22.28 1spw s ALA 25 CO 0.32 0.40 0.69 0.00 0.00 0.00 0.00 175.76 177.17 1spw n PRO 27 N 1.02 1.69 0.00 0.00 -0.04 -1.26 -2.42 135.00 133.99 1spw n PRO 27 Ca 0.16 -0.69 0.00 0.00 -0.04 0.00 0.00 63.50 62.93 1spw n PRO 27 Cb 0.25 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 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 0.09 0.00 0.30 0.52 0.31 -1.26 -4.84 118.33 113.44 1spw n VAL 28 Ca 0.06 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.57 1spw n VAL 28 Cb 0.33 -0.02 0.92 0.00 -0.91 0.00 0.00 33.84 34.16 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 -0.72 -0.19 3.89 0.00 0.00 -1.02 -4.98 105.19 102.18 1spw n GLY 30 Ca -0.02 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 1spw n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1spw s ALA 31 N -3.02 3.75 0.74 4.61 0.00 -1.26 -4.70 121.76 121.88 1spw s ALA 31 Ca 0.23 -1.33 -0.15 0.00 0.00 0.00 0.00 51.96 50.72 1spw s ALA 31 Cb -0.10 -1.51 0.05 0.00 0.00 0.00 0.00 23.12 21.56 1spw s ALA 31 CO 0.29 0.25 1.24 -1.54 0.00 0.00 0.00 175.76 176.00 1spw s SER 32 N -3.90 4.00 -0.22 0.00 1.04 -1.26 0.15 113.70 113.51 1spw s SER 32 Ca 0.33 2.45 -0.05 0.00 0.48 0.00 0.00 55.95 59.17 1spw s SER 32 Cb -0.08 -2.60 -0.10 0.00 0.10 0.00 0.00 66.02 63.34 1spw s SER 32 CO 0.27 -2.40 3.14 2.29 0.98 0.00 0.00 173.24 177.52 1spw n LYS 33 N -2.76 2.15 -0.03 4.02 -0.00 0.10 -3.76 118.16 117.88 1spw n LYS 33 Ca 0.14 -1.61 -0.05 0.00 -0.00 0.00 0.00 58.31 56.79 1spw n LYS 33 Cb 0.50 -2.03 -0.03 0.00 -0.00 0.00 0.00 35.03 33.47 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 1.66 3.06 0.10 -5.58 2.03 -1.26 -4.51 116.55 112.05 1spw n ASP 34 Ca 0.44 -0.02 0.08 0.00 0.52 0.00 0.00 54.79 55.82 1spw n ASP 34 Cb 0.73 -0.12 0.40 0.00 -0.72 0.00 0.00 41.12 41.41 1spw n ASP 34 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1spw n ALA 35 N -2.78 1.27 -1.98 -1.67 0.00 -1.25 -4.67 120.51 109.44 1spw n ALA 35 Ca -0.12 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.00 1spw n ALA 35 Cb 0.62 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.79 1spw n ALA 35 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1spw s PHE 36 N -3.29 3.15 -0.13 0.00 0.40 -1.26 -3.79 117.98 113.06 1spw s PHE 36 Ca 0.01 1.04 -0.23 0.00 -0.60 0.00 0.00 56.93 57.16 1spw s PHE 36 Cb 0.06 -3.73 0.05 0.00 0.51 0.00 0.00 43.02 39.92 1spw s PHE 36 CO 0.21 -2.41 0.56 -2.00 0.70 0.00 0.00 175.22 172.28 1spw s GLU 37 N 0.13 0.80 0.18 0.44 2.56 -1.25 -5.00 118.70 116.56 1spw s GLU 37 Ca 0.60 0.44 -0.29 0.00 0.00 0.00 0.00 54.97 55.73 1spw s GLU 37 Cb -0.39 0.38 -0.17 0.00 2.00 0.00 0.00 34.13 35.95 1spw s GLU 37 CO 0.38 -0.18 0.57 1.17 -0.56 0.00 0.00 175.26 176.63 1spw n LYS 38 N 1.88 0.00 0.00 4.30 0.00 -1.25 -3.85 118.16 119.23 1spw n LYS 38 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.14 1spw n LYS 38 Cb 0.56 -1.04 0.00 0.00 0.00 0.00 0.00 35.03 34.55 1spw n LYS 38 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34