#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emb s SER 2 N 0.00 6.58 0.06 1.61 0.01 -1.26 -5.01 113.70 115.69 2emb s SER 2 Ca 0.00 -2.12 0.07 0.00 1.31 0.00 0.00 55.95 55.22 2emb s SER 2 Cb 0.00 -2.32 -0.03 0.00 0.21 0.00 0.00 66.02 63.89 2emb s SER 2 CO 0.00 -0.92 -0.20 -0.94 0.41 0.00 0.00 173.24 171.59 2emb s SER 3 N 3.14 2.41 0.00 2.44 1.04 -1.26 -5.13 113.70 116.34 2emb s SER 3 Ca 0.23 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.10 2emb s SER 3 Cb -0.11 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 65.84 2emb s SER 3 CO -0.06 0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.89 2emb n GLY 4 N 1.63 4.89 4.39 7.32 0.00 -1.26 -4.92 105.19 117.25 2emb n GLY 4 Ca -0.18 -0.87 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 2emb n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2emb n SER 5 N 0.00 -1.58 -4.56 1.61 3.41 -1.26 -4.92 113.62 106.33 2emb n SER 5 Ca 0.00 -1.18 -0.26 0.00 -0.26 0.00 0.00 58.87 57.16 2emb n SER 5 Cb 0.00 -1.97 -0.10 0.00 -0.26 0.00 0.00 64.21 61.88 2emb n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2emb s SER 6 N -3.54 3.78 -0.21 4.04 1.04 -1.26 -4.95 113.70 112.60 2emb s SER 6 Ca 0.61 -1.21 -0.04 0.00 0.48 0.00 0.00 55.95 55.79 2emb s SER 6 Cb -0.35 -0.37 0.00 0.00 0.10 0.00 0.00 66.02 65.41 2emb s SER 6 CO 0.99 -0.24 0.14 0.61 0.98 0.00 0.00 173.24 175.72 2emb n GLY 7 N -0.83 -2.72 1.76 7.32 0.00 -1.26 -4.86 105.19 104.60 2emb n GLY 7 Ca -0.05 0.39 -0.09 0.00 0.00 0.00 0.00 46.02 46.27 2emb n GLY 7 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2emb n HIS 8 N 0.12 0.67 -2.71 1.61 -0.00 -1.26 -4.92 115.22 108.73 2emb n HIS 8 Ca 0.03 -1.47 -0.40 0.00 -0.00 0.00 0.00 57.72 55.88 2emb n HIS 8 Cb 0.11 -0.84 -0.06 0.00 -0.00 0.00 0.00 29.99 29.20 2emb n HIS 8 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 2emb s THR 9 N -0.89 4.00 -1.25 1.59 -4.23 -1.26 -3.65 115.64 109.94 2emb s THR 9 Ca 0.22 1.99 -0.08 0.00 -1.18 0.00 0.00 61.69 62.64 2emb s THR 9 Cb 0.15 -4.26 0.01 0.00 1.34 0.00 0.00 72.50 69.74 2emb s THR 9 CO -0.02 0.46 1.03 -1.14 -0.54 0.00 0.00 174.62 174.41 2emb n ARG 10 N 1.38 -6.99 0.00 3.99 0.63 -1.26 -4.89 116.66 109.52 2emb n ARG 10 Ca -0.02 0.76 0.04 0.00 -0.92 0.00 0.00 57.85 57.72 2emb n ARG 10 Cb 0.47 -5.57 0.03 0.00 0.45 0.00 0.00 32.46 27.84 2emb n ARG 10 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2emb n LYS 11 N -4.52 0.67 -3.83 -0.14 3.00 -1.24 -5.00 118.16 107.11 2emb n LYS 11 Ca -0.00 -0.93 -0.12 0.00 -0.00 0.00 0.00 58.31 57.25 2emb n LYS 11 Cb 0.56 -1.14 -0.11 0.00 0.00 0.00 0.00 35.03 34.34 2emb n LYS 11 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2emb s ARG 12 N -0.85 0.34 0.22 1.64 0.52 -1.26 -5.12 118.95 114.43 2emb s ARG 12 Ca 0.10 0.01 -0.32 0.00 -0.52 0.00 0.00 55.73 55.00 2emb s ARG 12 Cb 0.07 0.15 -0.12 0.00 0.52 0.00 0.00 34.95 35.57 2emb s ARG 12 CO 0.13 -0.07 1.66 0.66 0.02 0.00 0.00 175.30 177.70 2emb n TYR 13 N 2.35 2.66 -5.26 -0.53 4.02 -1.25 -4.85 117.16 114.30 2emb n TYR 13 Ca -0.17 0.14 -0.31 0.00 -0.01 0.00 0.00 57.90 57.56 2emb n TYR 13 Cb 0.57 -2.62 -0.16 0.00 -0.02 0.00 0.00 39.34 37.11 2emb n TYR 13 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 2emb s GLU 14 N 0.70 2.17 -0.39 -0.72 2.12 -1.26 -1.85 118.70 119.47 2emb s GLU 14 Ca 0.73 -0.90 -0.28 0.00 0.36 0.00 0.00 54.97 54.89 2emb s GLU 14 Cb -0.54 -2.02 0.02 0.00 0.26 0.00 0.00 34.13 31.85 2emb s GLU 14 CO 0.37 0.50 1.02 0.00 -0.54 0.00 0.00 175.26 176.62 2emb n SER 16 N 7.10 0.00 -0.12 0.00 2.88 -1.26 0.11 113.62 122.33 2emb n SER 16 Ca 0.10 -1.10 -0.24 0.00 -1.33 0.00 0.00 58.87 56.29 2emb n SER 16 Cb 0.48 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.85 2emb n SER 16 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2emb n LYS 17 N -0.78 0.57 0.00 -1.46 4.01 -1.26 -4.64 118.16 114.60 2emb n LYS 17 Ca 0.10 0.36 0.05 0.00 -0.51 0.00 0.00 58.31 58.31 2emb n LYS 17 Cb 0.05 -1.57 -0.01 0.00 -0.51 0.00 0.00 35.03 32.99 2emb n LYS 17 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2emb n GLN 19 N -0.38 -4.57 -3.94 0.00 6.02 0.31 -5.03 117.38 109.80 2emb n GLN 19 Ca 0.04 0.63 -0.26 0.00 -0.01 0.00 0.00 57.00 57.39 2emb n GLN 19 Cb 0.20 -4.95 -0.01 0.00 1.02 0.00 0.00 30.24 26.49 2emb n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2emb s ALA 20 N -3.27 4.36 0.04 -1.58 0.00 -1.18 -4.86 121.76 115.27 2emb s ALA 20 Ca 0.03 -1.27 0.07 0.00 0.00 0.00 0.00 51.96 50.79 2emb s ALA 20 Cb -0.00 -0.68 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 2emb s ALA 20 CO 0.54 -0.40 -0.19 0.95 0.00 0.00 0.00 175.76 176.66 2emb s THR 21 N -2.76 1.51 0.16 0.00 -4.23 -1.26 -1.45 115.64 107.61 2emb s THR 21 Ca 0.33 -1.11 -0.00 0.00 -1.18 0.00 0.00 61.69 59.73 2emb s THR 21 Cb -0.02 -1.32 -0.04 0.00 1.34 0.00 0.00 72.50 72.47 2emb s THR 21 CO 0.20 0.18 0.05 -0.36 -0.54 0.00 0.00 174.62 174.15 2emb s PHE 22 N -0.77 1.03 -0.19 3.99 0.08 -0.77 -5.00 117.98 116.35 2emb s PHE 22 Ca 0.06 -1.18 -0.03 0.00 0.12 0.00 0.00 56.93 55.90 2emb s PHE 22 Cb -0.08 -0.58 -0.10 0.00 -0.57 0.00 0.00 43.02 41.69 2emb s PHE 22 CO 0.01 -0.43 -0.20 0.09 -0.10 0.00 0.00 175.22 174.60 2emb n ASN 23 N -0.18 2.09 -4.67 1.36 4.13 -1.26 -3.82 115.26 112.91 2emb n ASN 23 Ca -0.05 0.04 -0.38 0.00 1.68 0.00 0.00 54.58 55.87 2emb n ASN 23 Cb 0.64 -0.40 -0.08 0.00 -1.54 0.00 0.00 39.78 38.40 2emb n ASN 23 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2emb s LEU 24 N -6.46 4.15 0.63 3.41 1.43 -1.26 -4.88 118.68 115.70 2emb s LEU 24 Ca -0.25 0.51 0.39 0.00 -1.03 0.00 0.00 54.13 53.75 2emb s LEU 24 Cb 0.08 -2.52 2.14 0.00 0.03 0.00 0.00 46.19 45.92 2emb s LEU 24 CO 0.38 -0.09 2.20 -0.09 0.23 0.00 0.00 176.35 178.99 2emb h ARG 25 N 7.42 0.00 0.00 1.70 2.43 -1.99 0.16 114.38 124.09 2emb h ARG 25 Ca -0.36 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 58.71 2emb h ARG 25 Cb 1.16 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 2emb h ARG 25 CO 0.71 0.00 -0.61 1.57 -1.51 0.00 0.00 179.97 180.13 2emb h LYS 26 N 0.00 0.00 -0.29 0.20 5.09 -2.01 -3.27 116.57 116.29 2emb h LYS 26 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 60.65 60.67 2emb h LYS 26 Cb 0.15 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.47 2emb h LYS 26 CO 0.00 0.41 -0.10 0.45 -2.09 0.00 0.00 179.45 178.12 2emb h HIS 27 N 0.00 0.51 -0.03 0.07 3.86 -1.08 -2.73 115.15 115.75 2emb h HIS 27 Ca -0.03 -0.07 -0.20 0.00 -1.16 0.00 0.00 60.37 58.91 2emb h HIS 27 Cb 1.37 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 29.69 2emb h HIS 27 CO 0.00 0.57 -0.83 1.25 0.86 0.00 0.00 177.93 179.79 2emb h LEU 28 N 0.45 0.43 0.02 2.43 5.85 -1.61 -2.67 115.31 120.21 2emb h LEU 28 Ca 0.09 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.52 2emb h LEU 28 Cb 0.45 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 2emb h LEU 28 CO 0.02 1.09 -0.30 0.40 -0.34 0.00 0.00 178.44 179.32 2emb h ILE 29 N 0.21 0.35 -0.27 4.05 1.08 -1.53 0.19 117.51 121.59 2emb h ILE 29 Ca -0.05 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.31 2emb h ILE 29 Cb 1.43 0.35 -0.01 0.00 -3.07 0.00 0.00 36.82 35.52 2emb h ILE 29 CO 0.14 0.00 -0.29 -0.61 -0.69 0.00 0.00 178.15 176.69 2emb h GLN 30 N -0.45 0.55 0.18 2.37 4.15 -1.62 -3.17 115.11 117.11 2emb h GLN 30 Ca 0.06 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.24 2emb h GLN 30 Cb 0.53 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.20 2emb h GLN 30 CO -0.24 0.79 -0.08 1.25 -1.93 0.00 0.00 178.83 178.61 2emb h HIS 31 N 0.48 -0.22 -0.59 3.99 2.76 -1.04 -2.01 115.15 118.53 2emb h HIS 31 Ca 0.06 -0.01 0.17 0.00 -2.20 0.00 0.00 60.37 58.40 2emb h HIS 31 Cb 0.75 0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.76 2emb h HIS 31 CO 0.03 -0.12 0.95 1.96 -1.30 0.00 0.00 177.93 179.45 2emb h GLN 32 N -0.26 0.00 -0.22 5.26 4.20 -0.62 0.60 115.11 124.07 2emb h GLN 32 Ca -0.02 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 2emb h GLN 32 Cb 0.20 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 2emb h GLN 32 CO 0.04 0.00 0.04 0.87 -0.67 0.00 0.00 178.83 179.11 2emb h LYS 33 N 0.00 0.35 0.00 1.46 1.57 -1.47 -2.21 116.57 116.27 2emb h LYS 33 Ca 0.28 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2emb h LYS 33 Cb 2.17 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.44 2emb h LYS 33 CO -0.00 0.48 0.00 0.25 -0.57 0.00 0.00 179.45 179.61 2emb n THR 34 N -4.74 1.78 -0.49 -0.16 -2.24 0.21 -0.44 114.28 108.20 2emb n THR 34 Ca -0.04 0.52 0.09 0.00 -2.27 0.00 0.00 64.05 62.35 2emb n THR 34 Cb 0.18 -1.51 0.34 0.00 -2.10 0.00 0.00 70.33 67.25 2emb n THR 34 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2emb n HIS 35 N -1.63 1.45 -3.64 4.78 8.25 -0.83 -4.83 115.22 118.76 2emb n HIS 35 Ca -0.00 -0.57 -0.39 0.00 -0.26 0.00 0.00 57.72 56.49 2emb n HIS 35 Cb 0.02 -0.25 -0.11 0.00 1.12 0.00 0.00 29.99 30.77 2emb n HIS 35 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2emb s ALA 36 N -1.87 3.23 -0.03 -1.41 0.00 0.42 -5.05 121.76 117.06 2emb s ALA 36 Ca 0.49 -2.07 -0.29 0.00 0.00 0.00 0.00 51.96 50.09 2emb s ALA 36 Cb 0.32 -2.56 0.09 0.00 0.00 0.00 0.00 23.12 20.97 2emb s ALA 36 CO 0.23 -1.58 0.78 0.00 0.00 0.00 0.00 175.76 175.19 2emb s ALA 37 N 1.41 -1.78 -0.18 0.00 0.00 -1.26 -5.08 121.76 114.87 2emb s ALA 37 Ca 0.02 1.16 -0.19 0.00 0.00 0.00 0.00 51.96 52.96 2emb s ALA 37 Cb -0.22 0.08 -0.16 0.00 0.00 0.00 0.00 23.12 22.82 2emb s ALA 37 CO 0.02 -0.49 0.21 0.87 0.00 0.00 0.00 175.76 176.37 2emb h LYS 38 N 2.52 0.00 -6.28 0.00 1.79 -1.96 -3.46 116.57 109.18 2emb h LYS 38 Ca -0.25 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.66 2emb h LYS 38 Cb 1.20 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.81 2emb h LYS 38 CO 0.35 0.75 0.58 -1.12 -1.08 0.00 0.00 179.45 178.93 2emb s SER 39 N -6.47 7.21 0.00 0.86 0.01 -1.26 -4.66 113.70 109.40 2emb s SER 39 Ca -0.23 1.60 0.00 0.00 1.31 0.00 0.00 55.95 58.63 2emb s SER 39 Cb 0.03 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2emb s SER 39 CO 0.50 -0.46 0.00 0.61 0.41 0.00 0.00 173.24 174.30 2emb n GLY 40 N 3.13 -1.51 3.60 3.44 0.00 -1.26 -5.15 105.19 107.44 2emb n GLY 40 Ca 0.09 0.58 -0.30 0.00 0.00 0.00 0.00 46.02 46.39 2emb n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2emb s PRO 41 N 0.00 -1.11 -0.12 1.61 0.04 -1.26 -5.05 135.00 129.11 2emb s PRO 41 Ca 0.00 -0.03 -0.03 0.00 0.04 0.00 0.00 61.00 60.98 2emb s PRO 41 Cb 0.00 -1.61 -0.03 0.00 0.04 0.00 0.00 34.50 32.90 2emb s PRO 41 CO 0.00 -3.65 0.01 -1.12 0.04 0.00 0.00 177.00 172.29 2emb s SER 42 N -3.86 5.29 -1.50 6.66 0.01 -1.26 -4.52 113.70 114.51 2emb s SER 42 Ca 0.71 0.10 -0.09 0.00 1.31 0.00 0.00 55.95 57.98 2emb s SER 42 Cb -0.10 -1.64 0.06 0.00 0.21 0.00 0.00 66.02 64.55 2emb s SER 42 CO 0.56 0.31 0.75 -0.24 0.41 0.00 0.00 173.24 175.03 2emb n SER 43 N 2.62 -2.69 0.00 2.44 2.88 -1.26 -5.29 113.62 112.32 2emb n SER 43 Ca -0.18 -0.89 0.00 0.00 -1.33 0.00 0.00 58.87 56.47 2emb n SER 43 Cb 0.53 -3.47 0.00 0.00 -0.75 0.00 0.00 64.21 60.52 2emb n SER 43 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42