#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a2c n PHE 1 N 0.00 0.00 -0.19 -1.42 -1.74 -1.26 -4.13 117.46 108.72 1a2c n PHE 1 Ca 0.00 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.81 1a2c n PHE 1 Cb 0.00 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 40.98 1a2c n PHE 1 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1a2c n GLY 1 N 1.96 -0.04 2.62 4.97 0.00 -1.26 -1.15 105.19 112.29 1a2c n GLY 1 Ca 0.00 0.16 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 1a2c n GLY 1 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1a2c n SER 1 N 1.21 -4.06 0.00 1.61 2.88 -1.26 -4.68 113.62 109.32 1a2c n SER 1 Ca 0.08 0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 1a2c n SER 1 Cb -0.00 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.36 1a2c n SER 1 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1a2c n GLY 1 N 0.29 0.52 0.00 0.46 0.00 -0.30 -4.85 105.19 101.31 1a2c n GLY 1 Ca -0.04 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1a2c n GLY 1 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1a2c n GLU 1 N 4.19 2.69 -0.08 1.61 2.13 -1.26 -4.12 120.64 125.81 1a2c n GLU 1 Ca 0.00 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.74 1a2c n GLU 1 Cb 0.00 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 1a2c n GLU 1 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1a2c n ALA 1 N -3.00 1.03 -1.01 4.31 0.00 -1.26 -4.56 120.51 116.01 1a2c n ALA 1 Ca 0.00 -0.75 0.03 0.00 0.00 0.00 0.00 53.44 52.72 1a2c n ALA 1 Cb 0.00 0.05 0.32 0.00 0.00 0.00 0.00 19.45 19.82 1a2c n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1a2c n ASP 1 N -4.36 4.78 -4.66 0.00 2.03 -1.26 -5.03 116.55 108.05 1a2c n ASP 1 Ca -0.13 -3.10 -0.41 0.00 0.52 0.00 0.00 54.79 51.67 1a2c n ASP 1 Cb 0.47 -0.67 0.02 0.00 -0.72 0.00 0.00 41.12 40.23 1a2c n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1a2c n GLY 2 N 1.01 0.20 3.16 0.00 0.00 -1.26 -4.94 105.19 103.35 1a2c n GLY 2 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 1a2c n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a2c s LEU 3 N 0.00 5.03 0.12 0.99 1.43 -1.24 -5.03 118.68 119.99 1a2c s LEU 3 Ca 0.00 -1.79 -0.30 0.00 -1.03 0.00 0.00 54.13 51.01 1a2c s LEU 3 Cb 0.00 -1.85 -0.06 0.00 0.03 0.00 0.00 46.19 44.31 1a2c s LEU 3 CO 0.00 -0.50 1.11 -0.13 0.23 0.00 0.00 176.35 177.05 1a2c s ARG 4 N 1.23 4.55 0.44 1.70 0.52 -1.26 -4.90 118.95 121.23 1a2c s ARG 4 Ca 0.05 1.68 0.13 0.00 -0.52 0.00 0.00 55.73 57.07 1a2c s ARG 4 Cb -0.22 -3.33 1.02 0.00 0.52 0.00 0.00 34.95 32.94 1a2c s ARG 4 CO -0.02 -0.03 2.02 -1.35 0.02 0.00 0.00 175.30 175.94 1a2c h PRO 5 N 5.83 0.38 -0.43 3.54 0.11 -1.97 -1.40 132.00 138.05 1a2c h PRO 5 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1a2c h PRO 5 Cb 1.21 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1a2c h PRO 5 CO 0.75 0.25 0.00 1.28 -0.21 0.00 0.00 178.00 180.07 1a2c n LEU 6 N -4.47 3.54 0.00 2.35 4.32 -1.26 -4.07 117.00 117.40 1a2c n LEU 6 Ca 0.07 -1.55 0.00 0.00 -0.02 0.00 0.00 56.01 54.51 1a2c n LEU 6 Cb 0.27 -0.28 0.00 0.00 -1.62 0.00 0.00 43.42 41.79 1a2c n LEU 6 CO 0.34 0.78 0.00 0.49 -1.22 0.00 0.00 177.39 177.78 1a2c n PHE 7 N 1.52 0.00 0.31 -1.77 3.72 -0.56 -4.74 117.46 115.95 1a2c n PHE 7 Ca 0.20 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.43 1a2c n PHE 7 Cb 0.61 0.19 -0.09 0.00 -0.94 0.00 0.00 39.48 39.25 1a2c n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1a2c h GLU 8 N 0.00 -0.92 0.00 -1.08 3.07 -1.52 1.68 114.58 115.81 1a2c h GLU 8 Ca 0.00 0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1a2c h GLU 8 Cb 0.00 0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 1a2c h GLU 8 CO 0.00 -0.61 0.22 1.63 -1.40 0.00 0.00 179.01 178.85 1a2c n LYS 9 N -5.54 0.09 0.00 2.33 5.02 -1.10 -1.31 118.16 117.65 1a2c n LYS 9 Ca -0.12 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1a2c n LYS 9 Cb 0.43 -2.01 0.00 0.00 -0.02 0.00 0.00 35.03 33.43 1a2c n LYS 9 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1a2c n LYS 10 N -2.00 0.85 -3.15 1.97 5.02 -0.99 -4.99 118.16 114.88 1a2c n LYS 10 Ca -0.01 -0.26 -0.15 0.00 -2.02 0.00 0.00 58.31 55.87 1a2c n LYS 10 Cb 0.24 -0.73 0.05 0.00 -0.02 0.00 0.00 35.03 34.58 1a2c n LYS 10 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1a2c n SER 11 N -0.20 -4.15 -4.50 4.39 2.88 0.87 -5.01 113.62 107.91 1a2c n SER 11 Ca 0.00 -0.37 -0.32 0.00 -1.33 0.00 0.00 58.87 56.85 1a2c n SER 11 Cb 0.05 -3.53 -0.12 0.00 -0.75 0.00 0.00 64.21 59.86 1a2c n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1a2c s LEU 12 N -5.12 2.81 0.05 2.46 1.43 0.54 -4.98 118.68 115.86 1a2c s LEU 12 Ca 0.29 -0.23 -0.01 0.00 -1.03 0.00 0.00 54.13 53.14 1a2c s LEU 12 Cb -0.13 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 1a2c s LEU 12 CO 0.48 0.31 0.22 -1.61 0.23 0.00 0.00 176.35 175.98 1a2c s GLU 13 N -1.05 3.46 0.60 1.70 2.02 -1.26 -3.63 118.70 120.54 1a2c s GLU 13 Ca 0.13 -0.38 -0.07 0.00 0.02 0.00 0.00 54.97 54.67 1a2c s GLU 13 Cb -0.11 -3.04 -0.00 0.00 0.10 0.00 0.00 34.13 31.08 1a2c s GLU 13 CO 0.03 0.62 0.94 0.16 0.02 0.00 0.00 175.26 177.03 1a2c s ASP 14 N -2.34 5.73 0.49 -0.19 1.47 -1.26 -4.96 116.67 115.61 1a2c s ASP 14 Ca 0.33 0.91 0.33 0.00 1.18 0.00 0.00 52.55 55.30 1a2c s ASP 14 Cb -0.13 -1.91 1.78 0.00 -0.34 0.00 0.00 42.92 42.32 1a2c s ASP 14 CO 0.25 -1.03 2.01 0.11 0.68 0.00 0.00 175.17 177.20 1a2c h LYS 14 N -0.23 0.00 0.00 2.11 1.57 -2.05 -3.27 116.57 114.70 1a2c h LYS 14 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1a2c h LYS 14 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1a2c h LYS 14 CO 0.62 0.00 -0.10 0.25 -0.57 0.00 0.00 179.45 179.64 1a2c n THR 14 N -2.68 0.00 -0.25 -0.16 -2.24 -1.26 -4.70 114.28 103.00 1a2c n THR 14 Ca -0.02 -0.34 0.09 0.00 -2.27 0.00 0.00 64.05 61.52 1a2c n THR 14 Cb 0.07 0.92 0.19 0.00 -2.10 0.00 0.00 70.33 69.41 1a2c n THR 14 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1a2c n GLU 14 N -0.83 -0.06 -0.33 -0.78 1.02 -1.23 0.28 120.64 118.71 1a2c n GLU 14 Ca 0.00 1.09 0.04 0.00 -0.02 0.00 0.00 57.16 58.27 1a2c n GLU 14 Cb 0.00 -1.71 0.10 0.00 -0.02 0.00 0.00 31.44 29.81 1a2c n GLU 14 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1a2c n ARG 14 N -5.03 -0.12 0.00 3.49 0.00 -1.26 -1.68 116.66 112.06 1a2c n ARG 14 Ca 0.16 1.38 0.00 0.00 -0.00 0.00 0.00 57.85 59.39 1a2c n ARG 14 Cb 0.51 -2.06 0.00 0.00 -0.00 0.00 0.00 32.46 30.92 1a2c n ARG 14 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1a2c n GLU 14 N -5.41 0.00 0.00 2.89 2.13 0.80 -0.62 120.64 120.43 1a2c n GLU 14 Ca 0.13 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.95 1a2c n GLU 14 Cb 0.42 -0.88 0.00 0.00 0.27 0.00 0.00 31.44 31.25 1a2c n GLU 14 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1a2c n LEU 14 N -0.04 0.00 0.22 4.31 7.99 -0.68 -3.31 117.00 125.48 1a2c n LEU 14 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 56.01 56.15 1a2c n LEU 14 Cb 0.00 0.00 0.77 0.00 -0.11 0.00 0.00 43.42 44.08 1a2c n LEU 14 CO 0.00 0.00 0.94 -0.33 -1.51 0.00 0.00 177.39 176.49 1a2c h GLU 14 N 0.00 0.00 0.00 3.23 5.08 -1.12 0.34 114.58 122.11 1a2c h GLU 14 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.04 1a2c h GLU 14 Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 1a2c h GLU 14 CO 0.00 0.00 -2.01 -1.13 -1.00 0.00 0.00 179.01 174.87 1a2c n SER 14 N -2.51 0.46 -1.56 1.42 3.41 -1.21 -3.37 113.62 110.25 1a2c n SER 14 Ca -0.02 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 1a2c n SER 14 Cb 0.06 0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1a2c n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1a2c n TYR 14 N -2.89 0.00 -3.26 7.33 4.01 -1.13 -4.51 117.16 116.70 1a2c n TYR 14 Ca -0.24 -0.79 -0.15 0.00 -0.16 0.00 0.00 57.90 56.56 1a2c n TYR 14 Cb 1.08 -0.44 -0.04 0.00 -0.31 0.00 0.00 39.34 39.63 1a2c n TYR 14 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 1a2c n ILE 14 N 1.54 -0.39 0.00 -0.72 -5.35 -1.26 -4.59 119.36 108.59 1a2c n ILE 14 Ca 0.00 -0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 1a2c n ILE 14 Cb 0.41 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 37.89 1a2c n ILE 14 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1a2c n ASP 14 N -1.08 0.00 -3.48 7.28 9.92 0.12 -4.98 116.55 124.32 1a2c n ASP 14 Ca -0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.14 1a2c n ASP 14 Cb 0.30 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.78 1a2c n ASP 14 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1a2c n GLY 14 N -0.70 -1.73 0.00 0.44 0.00 -1.04 -4.58 105.19 97.58 1a2c n GLY 14 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1a2c n GLY 14 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36