#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o2g n PHE 1 N 0.00 0.00 -2.64 -1.42 3.72 -1.26 -4.97 117.46 110.89 1o2g n PHE 1 Ca 0.00 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 1o2g n PHE 1 Cb 0.00 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.52 1o2g n PHE 1 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1o2g s GLY 1 N 0.00 1.95 0.00 1.37 0.00 -1.26 -3.49 107.32 105.89 1o2g s GLY 1 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 44.72 45.01 1o2g s GLY 1 CO 0.00 2.12 0.00 1.44 0.00 0.00 0.00 173.10 176.66 1o2g n SER 1 N 5.82 0.00 0.00 1.64 7.64 -1.26 -4.86 113.62 122.59 1o2g n SER 1 Ca 0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.99 1o2g n SER 1 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 1o2g n SER 1 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o2g n GLY 1 N 0.00 0.52 0.32 0.23 0.00 -1.23 -4.72 105.19 100.31 1o2g n GLY 1 Ca 0.00 -1.52 0.20 0.00 0.00 0.00 0.00 46.02 44.70 1o2g n GLY 1 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1o2g h GLU 1 N 0.00 0.12 0.00 1.61 4.22 -1.89 -3.45 114.58 115.19 1o2g h GLU 1 Ca 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.43 1o2g h GLU 1 Cb 0.00 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1o2g h GLU 1 CO 0.00 0.08 0.00 0.00 -2.18 0.00 0.00 179.01 176.91 1o2g n ALA 1 N -2.66 0.00 -0.33 2.92 0.00 -1.26 -4.75 120.51 114.43 1o2g n ALA 1 Ca 0.27 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.77 1o2g n ALA 1 Cb 0.89 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.49 1o2g n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1o2g n ASP 1 N 0.00 2.92 -4.59 0.00 2.03 -1.26 -5.03 116.55 110.62 1o2g n ASP 1 Ca 0.00 -2.22 -0.34 0.00 0.52 0.00 0.00 54.79 52.75 1o2g n ASP 1 Cb 0.00 -0.26 0.12 0.00 -0.72 0.00 0.00 41.12 40.26 1o2g n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1o2g n GLY 2 N 0.96 0.22 3.28 0.00 0.00 -1.26 -4.93 105.19 103.46 1o2g n GLY 2 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1o2g n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1o2g s LEU 3 N 0.00 4.72 -0.00 0.99 1.43 -1.18 -5.02 118.68 119.62 1o2g s LEU 3 Ca 0.00 -1.29 -0.30 0.00 -1.03 0.00 0.00 54.13 51.51 1o2g s LEU 3 Cb 0.00 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 1o2g s LEU 3 CO 0.00 -0.42 1.24 -0.13 0.23 0.00 0.00 176.35 177.27 1o2g s ARG 4 N 1.42 4.37 0.28 1.70 0.52 -1.26 -4.77 118.95 121.21 1o2g s ARG 4 Ca 0.01 1.77 -0.00 0.00 -0.52 0.00 0.00 55.73 56.99 1o2g s ARG 4 Cb -0.21 -3.48 0.64 0.00 0.52 0.00 0.00 34.95 32.42 1o2g s ARG 4 CO 0.03 -0.40 1.65 -1.35 0.02 0.00 0.00 175.30 175.25 1o2g h PRO 5 N 7.27 0.21 -0.01 3.54 0.11 -1.97 -1.22 132.00 139.94 1o2g h PRO 5 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1o2g h PRO 5 Cb 1.18 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1o2g h PRO 5 CO 0.86 0.14 -0.09 1.28 -0.21 0.00 0.00 178.00 179.98 1o2g n LEU 6 N -5.22 0.82 0.00 2.35 4.32 -1.26 -4.14 117.00 113.87 1o2g n LEU 6 Ca 0.19 -0.20 0.00 0.00 -0.02 0.00 0.00 56.01 55.98 1o2g n LEU 6 Cb 0.62 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 42.33 1o2g n LEU 6 CO 0.07 0.14 0.00 0.49 -1.22 0.00 0.00 177.39 176.88 1o2g n PHE 7 N -0.56 0.00 -0.23 -1.77 3.72 -0.54 -4.73 117.46 113.35 1o2g n PHE 7 Ca 0.17 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.61 1o2g n PHE 7 Cb 0.29 0.00 0.15 0.00 -0.94 0.00 0.00 39.48 38.98 1o2g n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1o2g h GLU 8 N 0.00 0.18 0.00 -1.08 3.07 -1.58 0.14 114.58 115.31 1o2g h GLU 8 Ca 0.00 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1o2g h GLU 8 Cb 0.00 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1o2g h GLU 8 CO 0.00 0.12 -0.00 0.87 -1.40 0.00 0.00 179.01 178.60 1o2g h LYS 9 N 0.18 0.00 -0.12 2.33 1.79 -1.54 -1.80 116.57 117.42 1o2g h LYS 9 Ca 0.38 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.85 1o2g h LYS 9 Cb 0.64 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1o2g h LYS 9 CO -0.54 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.46 1o2g n LYS 10 N -3.15 1.42 -3.12 3.15 5.02 0.27 -4.98 118.16 116.77 1o2g n LYS 10 Ca -0.03 -1.38 -0.20 0.00 -2.02 0.00 0.00 58.31 54.67 1o2g n LYS 10 Cb 0.08 -1.16 0.05 0.00 -0.02 0.00 0.00 35.03 33.97 1o2g n LYS 10 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1o2g n SER 11 N 0.29 -5.74 -4.59 4.39 2.88 0.03 -5.00 113.62 105.87 1o2g n SER 11 Ca 0.06 -0.33 -0.32 0.00 -1.33 0.00 0.00 58.87 56.94 1o2g n SER 11 Cb 0.27 -4.50 -0.11 0.00 -0.75 0.00 0.00 64.21 59.13 1o2g n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1o2g s LEU 12 N -6.20 3.17 0.09 2.46 1.43 -0.39 -4.99 118.68 114.25 1o2g s LEU 12 Ca 0.36 -0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.37 1o2g s LEU 12 Cb -0.16 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 1o2g s LEU 12 CO 0.44 0.29 0.04 -1.61 0.23 0.00 0.00 176.35 175.74 1o2g s GLU 13 N -1.33 2.71 0.64 1.70 2.02 -1.26 -3.76 118.70 119.43 1o2g s GLU 13 Ca 0.16 -0.77 -0.06 0.00 0.02 0.00 0.00 54.97 54.32 1o2g s GLU 13 Cb -0.11 -2.63 0.03 0.00 0.10 0.00 0.00 34.13 31.52 1o2g s GLU 13 CO 0.07 0.55 0.95 0.16 0.02 0.00 0.00 175.26 177.01 1o2g s ASP 14 N -2.36 5.23 0.48 -0.19 1.47 -1.26 -4.98 116.67 115.07 1o2g s ASP 14 Ca 0.28 0.59 0.32 0.00 1.18 0.00 0.00 52.55 54.92 1o2g s ASP 14 Cb -0.12 -1.43 1.65 0.00 -0.34 0.00 0.00 42.92 42.68 1o2g s ASP 14 CO 0.20 -1.31 1.99 0.07 0.68 0.00 0.00 175.17 176.80 1o2g h LYS 14 N -0.37 0.00 0.00 2.11 2.10 -2.06 -3.25 116.57 115.10 1o2g h LYS 14 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1o2g h LYS 14 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1o2g h LYS 14 CO 0.60 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.30 1o2g n THR 14 N -2.69 0.56 0.20 0.07 -2.24 -1.26 -4.76 114.28 104.15 1o2g n THR 14 Ca -0.01 -0.59 0.05 0.00 -2.27 0.00 0.00 64.05 61.22 1o2g n THR 14 Cb 0.12 0.76 0.47 0.00 -2.10 0.00 0.00 70.33 69.58 1o2g n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1o2g h GLU 14 N 0.00 0.06 -0.52 -0.78 4.11 -1.96 -1.78 114.58 113.71 1o2g h GLU 14 Ca 0.00 -0.01 0.07 0.00 0.07 0.00 0.00 59.36 59.49 1o2g h GLU 14 Cb 0.63 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 1o2g h GLU 14 CO 0.00 0.23 0.35 -0.09 0.07 0.00 0.00 179.01 179.57 1o2g h ARG 14 N 0.06 0.38 -0.05 1.06 2.43 -1.86 -2.22 114.38 114.18 1o2g h ARG 14 Ca 0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1o2g h ARG 14 Cb 0.33 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1o2g h ARG 14 CO 0.02 0.25 0.00 -1.91 -1.51 0.00 0.00 179.97 176.83 1o2g n GLU 14 N -4.47 0.00 0.00 0.20 2.13 -0.67 -0.15 120.64 117.68 1o2g n GLU 14 Ca 0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1o2g n GLU 14 Cb 0.30 -0.99 0.00 0.00 0.27 0.00 0.00 31.44 31.02 1o2g n GLU 14 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1o2g n LEU 14 N 0.49 0.00 0.26 4.31 7.99 -0.84 -2.44 117.00 126.76 1o2g n LEU 14 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 56.01 56.15 1o2g n LEU 14 Cb 0.00 0.00 0.60 0.00 -0.11 0.00 0.00 43.42 43.91 1o2g n LEU 14 CO 0.00 0.00 0.93 -0.33 -1.51 0.00 0.00 177.39 176.48 1o2g h GLU 14 N 0.00 0.00 0.00 3.23 5.08 -0.81 -2.57 114.58 119.51 1o2g h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1o2g h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1o2g h GLU 14 CO 0.00 0.08 -0.40 -1.13 -1.00 0.00 0.00 179.01 176.56 1o2g n SER 14 N -3.21 0.55 -3.56 1.42 3.41 -1.02 -3.88 113.62 107.33 1o2g n SER 14 Ca 0.00 0.16 -0.41 0.00 -0.26 0.00 0.00 58.87 58.36 1o2g n SER 14 Cb 0.35 -0.07 -0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1o2g n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1o2g n TYR 14 N -1.88 2.65 -2.33 7.33 4.01 -0.97 -4.77 117.16 121.20 1o2g n TYR 14 Ca 0.05 -2.81 -0.02 0.00 -0.16 0.00 0.00 57.90 54.96 1o2g n TYR 14 Cb 0.39 -1.84 -0.00 0.00 -0.31 0.00 0.00 39.34 37.58 1o2g n TYR 14 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 1o2g n ILE 14 N 1.99 0.00 0.00 -0.72 -5.35 -1.26 -4.67 119.36 109.35 1o2g n ILE 14 Ca 0.58 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 63.06 1o2g n ILE 14 Cb 0.27 -0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.14 1o2g n ILE 14 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1o2g n ASP 14 N -1.33 0.00 -3.28 7.28 5.75 -1.25 -4.90 116.55 118.81 1o2g n ASP 14 Ca 0.01 0.00 -0.26 0.00 -0.01 0.00 0.00 54.79 54.53 1o2g n ASP 14 Cb 0.43 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.45 1o2g n ASP 14 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1o2g n GLY 14 N -1.72 4.61 0.00 6.12 0.00 -1.26 -5.05 105.19 107.88 1o2g n GLY 14 Ca 0.00 -2.54 0.00 0.00 0.00 0.00 0.00 46.02 43.48 1o2g n GLY 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19