#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pyu s ILE 2 N 0.00 5.07 0.04 3.17 -1.09 -1.26 -5.08 121.20 122.05 1pyu s ILE 2 Ca 0.00 0.07 -0.01 0.00 -2.23 0.00 0.00 60.65 58.49 1pyu s ILE 2 Cb 0.00 -3.33 -0.04 0.00 -1.58 0.00 0.00 42.46 37.51 1pyu s ILE 2 CO 0.00 0.40 0.20 -0.13 -1.23 0.00 0.00 174.94 174.18 1pyu s ARG 3 N 0.77 3.42 -0.26 2.79 1.81 -1.26 -5.10 118.95 121.13 1pyu s ARG 3 Ca 0.06 -0.41 -0.09 0.00 -1.72 0.00 0.00 55.73 53.56 1pyu s ARG 3 Cb -0.13 -3.05 -0.04 0.00 -0.45 0.00 0.00 34.95 31.28 1pyu s ARG 3 CO 0.02 0.63 0.13 0.99 -0.68 0.00 0.00 175.30 176.39 1pyu s THR 4 N -1.45 4.86 0.05 0.02 2.01 -1.26 -5.09 115.64 114.78 1pyu s THR 4 Ca 0.33 0.01 0.07 0.00 0.31 0.00 0.00 61.69 62.41 1pyu s THR 4 Cb -0.13 -3.29 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 1pyu s THR 4 CO 0.25 0.30 -0.19 -0.04 -0.69 0.00 0.00 174.62 174.25 1pyu s MET 5 N 1.58 1.28 0.03 4.92 1.00 -1.26 -5.10 119.30 121.75 1pyu s MET 5 Ca 0.07 -0.93 -0.32 0.00 0.00 0.00 0.00 55.69 54.51 1pyu s MET 5 Cb -0.15 -1.39 -0.10 0.00 0.00 0.00 0.00 34.83 33.19 1pyu s MET 5 CO 0.07 0.35 1.90 -0.11 0.00 0.00 0.00 175.02 177.23 1pyu n LEU 6 N 1.78 3.90 0.01 -0.03 7.94 -1.26 -4.88 117.00 124.45 1pyu n LEU 6 Ca -0.18 0.95 -0.21 0.00 -1.11 0.00 0.00 56.01 55.47 1pyu n LEU 6 Cb 0.54 -1.48 -0.14 0.00 0.53 0.00 0.00 43.42 42.86 1pyu n LEU 6 CO 0.23 0.11 -0.26 -0.61 -1.11 0.00 0.00 177.39 175.74 1pyu h GLN 7 N 9.54 0.23 -1.43 1.96 -0.00 -2.05 -3.50 115.11 119.86 1pyu h GLN 7 Ca -0.48 -0.39 0.29 0.00 -0.00 0.00 0.00 58.65 58.07 1pyu h GLN 7 Cb 1.25 0.14 -0.16 0.00 0.00 0.00 0.00 27.48 28.71 1pyu h GLN 7 CO 0.94 1.18 0.83 0.20 0.00 0.00 0.00 178.83 181.99 1pyu s GLY 8 N -4.78 -0.34 0.11 2.39 0.00 -1.26 -5.18 107.32 98.27 1pyu s GLY 8 Ca -0.19 1.24 -0.20 0.00 0.00 0.00 0.00 44.72 45.57 1pyu s GLY 8 CO 0.77 0.37 0.50 -1.59 0.00 0.00 0.00 173.10 173.14 1pyu s LYS 9 N -2.40 1.13 -0.28 2.90 -2.85 -1.26 -5.12 119.74 111.87 1pyu s LYS 9 Ca 0.12 -0.50 -0.10 0.00 -1.00 0.00 0.00 55.97 54.49 1pyu s LYS 9 Cb 0.02 0.51 -0.03 0.00 -2.06 0.00 0.00 37.83 36.26 1pyu s LYS 9 CO -0.04 -0.45 0.14 -0.51 0.10 0.00 0.00 175.35 174.59 1pyu s LEU 10 N -2.55 3.86 -0.39 2.77 1.43 -1.26 -5.07 118.68 117.47 1pyu s LEU 10 Ca 0.00 -0.20 -0.14 0.00 -1.03 0.00 0.00 54.13 52.76 1pyu s LEU 10 Cb 0.00 -2.03 0.01 0.00 0.03 0.00 0.00 46.19 44.20 1pyu s LEU 10 CO -0.09 -0.08 0.28 -2.28 0.23 0.00 0.00 176.35 174.40 1pyu s HIS 11 N 1.68 3.24 -0.89 0.29 2.46 -1.26 -4.54 115.29 116.27 1pyu s HIS 11 Ca 0.06 -0.51 -0.05 0.00 0.47 0.00 0.00 55.06 55.03 1pyu s HIS 11 Cb -0.16 -2.55 -0.06 0.00 -0.13 0.00 0.00 32.58 29.69 1pyu s HIS 11 CO 0.08 -0.53 0.78 0.54 -2.47 0.00 0.00 174.74 173.14 1pyu n ARG 12 N 5.13 -1.89 -3.27 2.88 1.74 -1.26 -5.05 116.66 114.95 1pyu n ARG 12 Ca -0.12 0.79 -0.28 0.00 -0.77 0.00 0.00 57.85 57.48 1pyu n ARG 12 Cb 0.48 -5.24 -0.03 0.00 -1.02 0.00 0.00 32.46 26.65 1pyu n ARG 12 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1pyu s VAL 13 N -3.31 5.02 -0.15 1.55 -7.23 -1.26 -5.10 120.40 109.91 1pyu s VAL 13 Ca 0.37 0.01 -0.08 0.00 -1.81 0.00 0.00 61.98 60.47 1pyu s VAL 13 Cb -0.05 -3.76 -0.04 0.00 0.56 0.00 0.00 36.38 33.09 1pyu s VAL 13 CO 0.64 -0.41 0.12 -1.59 -0.31 0.00 0.00 175.10 173.55 1pyu s LYS 14 N -3.78 3.69 -0.02 4.82 0.00 -1.26 -5.06 119.74 118.12 1pyu s LYS 14 Ca 0.44 -0.20 -0.30 0.00 0.00 0.00 0.00 55.97 55.91 1pyu s LYS 14 Cb -0.10 -3.24 -0.06 0.00 0.00 0.00 0.00 37.83 34.43 1pyu s LYS 14 CO 0.32 0.58 1.52 0.08 0.00 0.00 0.00 175.35 177.85 1pyu s VAL 15 N -0.47 3.61 -0.14 1.79 1.01 -1.26 -4.90 120.40 120.04 1pyu s VAL 15 Ca 0.12 0.90 0.21 0.00 0.00 0.00 0.00 61.98 63.21 1pyu s VAL 15 Cb -0.12 -3.58 -0.31 0.00 0.00 0.00 0.00 36.38 32.37 1pyu s VAL 15 CO 0.02 -0.04 0.51 0.35 0.00 0.00 0.00 175.10 175.94 1pyu n THR 16 N 5.02 0.00 -3.66 3.92 -2.24 -1.26 -4.99 114.28 111.06 1pyu n THR 16 Ca 0.15 -0.42 -0.15 0.00 -2.27 0.00 0.00 64.05 61.36 1pyu n THR 16 Cb 0.43 0.14 -0.08 0.00 -2.10 0.00 0.00 70.33 68.72 1pyu n THR 16 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1pyu s HIS 17 N -3.39 -0.47 -0.26 4.78 5.65 -1.26 -5.14 115.29 115.20 1pyu s HIS 17 Ca -0.06 0.95 -0.01 0.00 0.25 0.00 0.00 55.06 56.20 1pyu s HIS 17 Cb 0.14 0.23 0.15 0.00 -1.18 0.00 0.00 32.58 31.91 1pyu s HIS 17 CO 0.86 -0.42 0.41 0.00 -0.65 0.00 0.00 174.74 174.95 1pyu s ALA 18 N -0.69 -1.26 -0.08 1.58 0.00 -1.26 -5.13 121.76 114.91 1pyu s ALA 18 Ca -0.08 0.80 -0.00 0.00 0.00 0.00 0.00 51.96 52.68 1pyu s ALA 18 Cb -0.03 -1.86 0.02 0.00 0.00 0.00 0.00 23.12 21.25 1pyu s ALA 18 CO 0.05 -1.43 -0.05 0.16 0.00 0.00 0.00 175.76 174.49 1pyu s ASP 19 N 2.58 1.73 0.41 0.00 -4.77 -1.26 -5.00 116.67 110.37 1pyu s ASP 19 Ca 0.13 -0.21 0.18 0.00 -3.30 0.00 0.00 52.55 49.35 1pyu s ASP 19 Cb -0.14 -0.65 1.08 0.00 -1.09 0.00 0.00 42.92 42.12 1pyu s ASP 19 CO -0.21 -0.11 1.84 -0.07 0.70 0.00 0.00 175.17 177.32 1pyu h LEU 20 N 7.90 0.42 -8.62 2.11 3.38 -2.10 -3.37 115.31 115.03 1pyu h LEU 20 Ca -0.28 0.05 -0.55 0.00 0.09 0.00 0.00 57.88 57.19 1pyu h LEU 20 Cb 1.14 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1pyu h LEU 20 CO 0.38 0.15 1.11 -1.00 0.09 0.00 0.00 178.44 179.17 1pyu s HIS 21 N -5.44 2.27 -0.10 1.13 3.76 -1.26 -4.96 115.29 110.68 1pyu s HIS 21 Ca -0.08 0.51 -0.06 0.00 -0.15 0.00 0.00 55.06 55.29 1pyu s HIS 21 Cb 0.23 -4.37 0.04 0.00 1.11 0.00 0.00 32.58 29.60 1pyu s HIS 21 CO 0.79 -2.01 0.24 -0.47 -0.85 0.00 0.00 174.74 172.44 1pyu s TYR 22 N 6.10 -0.32 -0.43 1.40 5.04 -1.26 -5.11 117.35 122.77 1pyu s TYR 22 Ca 0.55 0.76 0.03 0.00 -2.44 0.00 0.00 57.07 55.97 1pyu s TYR 22 Cb -0.11 0.05 0.12 0.00 0.35 0.00 0.00 41.96 42.36 1pyu s TYR 22 CO 0.26 -0.22 0.18 -1.21 -1.34 0.00 0.00 175.55 173.22 1pyu s GLU 23 N 1.13 1.59 0.00 4.97 2.02 -1.26 -5.23 118.70 121.91 1pyu s GLU 23 Ca -0.08 -2.15 0.00 0.00 0.02 0.00 0.00 54.97 52.76 1pyu s GLU 23 Cb -0.09 -2.98 0.00 0.00 0.10 0.00 0.00 34.13 31.16 1pyu s GLU 23 CO -0.07 -1.06 0.00 0.41 0.02 0.00 0.00 175.26 174.56