#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 5.27 -0.12 1.61 1.04 -1.26 -5.03 113.70 115.21 2emb s SER 2 Ca 0.00 -3.84 -0.32 0.00 0.48 0.00 0.00 55.95 52.28 2emb s SER 2 Cb 0.00 -1.74 0.13 0.00 0.10 0.00 0.00 66.02 64.51 2emb s SER 2 CO 0.00 -0.11 1.06 -0.94 0.98 0.00 0.00 173.24 174.23 2emb s SER 3 N -1.02 -0.26 0.00 7.02 1.04 -1.26 -5.10 113.70 114.12 2emb s SER 3 Ca 0.26 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.77 2emb s SER 3 Cb -0.05 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.32 2emb s SER 3 CO -0.15 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 174.29 2emb n GLY 4 N 0.05 -1.78 2.32 7.32 0.00 -1.26 -4.92 105.19 106.92 2emb n GLY 4 Ca -0.05 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.07 6.29 0.00 1.61 3.41 -1.26 -3.92 113.62 119.68 2emb n SER 5 Ca 0.00 -2.94 0.00 0.00 -0.26 0.00 0.00 58.87 55.67 2emb n SER 5 Cb 0.00 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 62.63 2emb n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2emb n SER 6 N 1.59 2.69 -2.12 4.04 2.88 -1.26 -5.13 113.62 116.30 2emb n SER 6 Ca 0.49 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 58.01 2emb n SER 6 Cb 0.64 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.08 2emb n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2emb n GLY 7 N 2.95 -4.89 3.42 0.46 0.00 -1.25 -4.67 105.19 101.21 2emb n GLY 7 Ca 0.00 0.50 -0.47 0.00 0.00 0.00 0.00 46.02 46.04 2emb n GLY 7 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2emb n HIS 8 N 1.30 0.93 -3.63 1.61 -0.00 -1.26 -4.87 115.22 109.29 2emb n HIS 8 Ca -0.14 0.46 -0.37 0.00 0.46 0.00 0.00 57.72 58.13 2emb n HIS 8 Cb 0.22 -2.39 -0.11 0.00 -0.12 0.00 0.00 29.99 27.59 2emb n HIS 8 CO 0.00 0.00 0.00 -0.08 0.46 0.00 0.00 176.34 176.72 2emb s THR 9 N 8.19 5.19 -1.23 3.57 -1.32 -1.26 -5.02 115.64 123.76 2emb s THR 9 Ca 1.25 0.13 -0.12 0.00 -1.21 0.00 0.00 61.69 61.73 2emb s THR 9 Cb -1.20 -3.45 0.17 0.00 -1.51 0.00 0.00 72.50 66.51 2emb s THR 9 CO 0.52 0.28 1.55 0.54 -2.21 0.00 0.00 174.62 175.31 2emb n ARG 10 N 4.85 3.46 0.00 7.08 5.12 -1.26 -4.49 116.66 131.43 2emb n ARG 10 Ca -0.15 -3.78 0.00 0.00 -1.93 0.00 0.00 57.85 51.99 2emb n ARG 10 Cb 0.52 -2.99 0.00 0.00 -1.16 0.00 0.00 32.46 28.83 2emb n ARG 10 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2emb n LYS 11 N 5.02 0.24 -4.05 5.56 4.81 -1.26 -5.07 118.16 123.41 2emb n LYS 11 Ca 0.37 -0.32 -0.10 0.00 -0.87 0.00 0.00 58.31 57.39 2emb n LYS 11 Cb 0.41 -0.80 -0.07 0.00 0.02 0.00 0.00 35.03 34.59 2emb n LYS 11 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2emb s ARG 12 N -0.13 1.38 -0.07 1.64 0.52 -1.26 -4.98 118.95 116.05 2emb s ARG 12 Ca 0.00 -1.36 -0.02 0.00 -0.52 0.00 0.00 55.73 53.83 2emb s ARG 12 Cb 0.00 0.39 -0.04 0.00 0.52 0.00 0.00 34.95 35.83 2emb s ARG 12 CO 0.00 -0.53 0.04 0.71 0.02 0.00 0.00 175.30 175.54 2emb s TYR 13 N -4.05 3.26 0.16 -0.53 2.02 -1.07 -4.96 117.35 112.17 2emb s TYR 13 Ca 0.27 0.25 0.09 0.00 -0.37 0.00 0.00 57.07 57.30 2emb s TYR 13 Cb 0.02 -1.79 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 2emb s TYR 13 CO 0.08 0.53 -0.13 -1.21 -1.57 0.00 0.00 175.55 173.26 2emb s GLU 14 N -1.15 1.96 -0.27 -0.62 8.01 -1.26 -0.39 118.70 124.99 2emb s GLU 14 Ca 0.16 -1.24 -0.10 0.00 0.01 0.00 0.00 54.97 53.80 2emb s GLU 14 Cb -0.12 -2.14 -0.05 0.00 -4.31 0.00 0.00 34.13 27.52 2emb s GLU 14 CO 0.06 0.45 0.16 0.00 0.01 0.00 0.00 175.26 175.94 2emb n SER 16 N 4.89 4.89 0.00 0.00 7.64 -1.26 -1.10 113.62 128.68 2emb n SER 16 Ca -0.15 -2.66 0.00 0.00 1.01 0.00 0.00 58.87 57.07 2emb n SER 16 Cb 0.52 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 2emb n SER 16 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2emb n LYS 17 N 0.50 0.44 0.00 1.43 4.01 -1.26 -4.88 118.16 118.39 2emb n LYS 17 Ca 0.18 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.98 2emb n LYS 17 Cb 0.66 -0.67 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 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 -0.09 -3.84 -2.60 0.00 1.13 -0.26 -5.00 117.38 106.73 2emb n GLN 19 Ca 0.00 0.82 -0.25 0.00 -1.94 0.00 0.00 57.00 55.63 2emb n GLN 19 Cb 0.30 -5.42 0.03 0.00 0.11 0.00 0.00 30.24 25.25 2emb n GLN 19 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2emb s ALA 20 N -3.07 3.50 0.15 -1.58 0.00 -1.23 -4.79 121.76 114.74 2emb s ALA 20 Ca 0.22 -0.90 0.09 0.00 0.00 0.00 0.00 51.96 51.38 2emb s ALA 20 Cb -0.10 -2.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 2emb s ALA 20 CO 0.27 -0.69 -0.21 0.95 0.00 0.00 0.00 175.76 176.08 2emb s THR 21 N -2.84 1.98 0.28 0.00 -4.23 -1.26 -0.14 115.64 109.42 2emb s THR 21 Ca 0.53 -1.84 -0.00 0.00 -1.18 0.00 0.00 61.69 59.20 2emb s THR 21 Cb -0.10 -1.86 -0.02 0.00 1.34 0.00 0.00 72.50 71.85 2emb s THR 21 CO 0.42 -0.16 0.29 -0.36 -0.54 0.00 0.00 174.62 174.28 2emb s PHE 22 N -1.63 1.21 -0.10 3.99 0.40 0.48 -4.98 117.98 117.35 2emb s PHE 22 Ca 0.14 -1.36 -0.00 0.00 -0.60 0.00 0.00 56.93 55.11 2emb s PHE 22 Cb -0.08 -0.40 -0.06 0.00 0.51 0.00 0.00 43.02 42.99 2emb s PHE 22 CO 0.07 -0.86 -0.09 0.09 0.70 0.00 0.00 175.22 175.12 2emb n ASN 23 N -0.91 2.86 -4.73 1.36 3.02 -1.26 -2.61 115.26 113.00 2emb n ASN 23 Ca 0.03 -0.02 -0.30 0.00 -0.03 0.00 0.00 54.58 54.26 2emb n ASN 23 Cb 0.63 -0.17 -0.07 0.00 -0.61 0.00 0.00 39.78 39.56 2emb n ASN 23 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2emb s LEU 24 N -5.71 3.61 0.04 3.41 1.43 -1.26 -4.73 118.68 115.48 2emb s LEU 24 Ca -0.13 -0.12 -0.32 0.00 -1.03 0.00 0.00 54.13 52.53 2emb s LEU 24 Cb 0.04 -2.31 -0.18 0.00 0.03 0.00 0.00 46.19 43.76 2emb s LEU 24 CO 0.21 0.16 1.38 0.03 0.23 0.00 0.00 176.35 178.37 2emb h ARG 25 N 3.29 -1.08 -1.04 1.70 3.08 -2.00 -2.91 114.38 115.42 2emb h ARG 25 Ca -0.47 0.07 0.30 0.00 0.07 0.00 0.00 59.98 59.95 2emb h ARG 25 Cb 1.17 0.24 -0.13 0.00 0.08 0.00 0.00 29.97 31.33 2emb h ARG 25 CO 0.62 -0.71 0.62 1.57 -1.07 0.00 0.00 179.97 181.01 2emb h LYS 26 N -1.25 0.38 -0.48 0.04 2.10 -1.98 0.29 116.57 115.68 2emb h LYS 26 Ca -0.11 -0.02 0.05 0.00 -2.00 0.00 0.00 60.65 58.56 2emb h LYS 26 Cb 0.86 -0.09 -0.05 0.00 -0.90 0.00 0.00 32.23 32.06 2emb h LYS 26 CO 0.19 0.25 0.21 0.45 -2.00 0.00 0.00 179.45 178.55 2emb h HIS 27 N 0.39 0.39 0.24 0.07 3.86 -1.94 -0.83 115.15 117.33 2emb h HIS 27 Ca 0.69 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.91 2emb h HIS 27 Cb 1.60 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.96 2emb h HIS 27 CO -0.01 0.17 -0.12 1.25 0.86 0.00 0.00 177.93 180.09 2emb h LEU 28 N 0.42 -0.27 -1.00 2.43 5.85 -0.35 -2.40 115.31 119.99 2emb h LEU 28 Ca 0.22 -0.25 0.29 0.00 0.84 0.00 0.00 57.88 58.97 2emb h LEU 28 Cb 0.16 0.07 -0.14 0.00 0.37 0.00 0.00 40.66 41.12 2emb h LEU 28 CO -0.18 0.21 0.56 0.40 -0.34 0.00 0.00 178.44 179.09 2emb h ILE 29 N -0.86 0.38 -0.25 4.05 2.04 -1.03 0.33 117.51 122.16 2emb h ILE 29 Ca -0.03 -0.14 -0.12 0.00 1.00 0.00 0.00 64.86 65.57 2emb h ILE 29 Cb 0.51 -0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2emb h ILE 29 CO 0.05 0.07 -0.29 -0.61 0.00 0.00 0.00 178.15 177.38 2emb h GLN 30 N 0.41 0.65 -0.28 2.37 5.75 -1.16 -3.24 115.11 119.60 2emb h GLN 30 Ca 0.70 -0.36 -0.01 0.00 -0.15 0.00 0.00 58.65 58.83 2emb h GLN 30 Cb 1.50 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 30.06 2emb h GLN 30 CO -0.56 0.96 0.13 1.25 -2.65 0.00 0.00 178.83 177.96 2emb h HIS 31 N 0.36 0.41 0.00 3.99 2.76 0.03 -2.06 115.15 120.64 2emb h HIS 31 Ca 0.04 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 2emb h HIS 31 Cb 0.86 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 29.70 2emb h HIS 31 CO 0.08 0.38 0.56 1.96 -1.30 0.00 0.00 177.93 179.61 2emb h GLN 32 N 0.32 0.00 -0.71 5.26 4.20 -0.69 0.36 115.11 123.85 2emb h GLN 32 Ca 0.10 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.74 2emb h GLN 32 Cb 0.13 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 2emb h GLN 32 CO -0.01 0.00 0.17 0.87 -0.67 0.00 0.00 178.83 179.19 2emb h LYS 33 N 0.00 1.14 0.00 1.46 1.79 -1.44 -1.86 116.57 117.66 2emb h LYS 33 Ca 0.00 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.19 2emb h LYS 33 Cb 1.13 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.63 2emb h LYS 33 CO 0.00 1.00 0.00 -2.37 -1.08 0.00 0.00 179.45 177.00 2emb n THR 34 N -4.23 1.51 -0.72 -0.16 5.66 0.13 -0.96 114.28 115.51 2emb n THR 34 Ca 0.05 0.38 0.07 0.00 -3.05 0.00 0.00 64.05 61.51 2emb n THR 34 Cb 0.26 -1.31 0.38 0.00 -1.55 0.00 0.00 70.33 68.11 2emb n THR 34 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2emb n HIS 35 N -1.43 1.82 -3.08 1.09 8.25 -0.70 -4.92 115.22 116.24 2emb n HIS 35 Ca 0.01 -0.66 -0.40 0.00 -0.26 0.00 0.00 57.72 56.42 2emb n HIS 35 Cb 0.04 -0.41 -0.05 0.00 1.12 0.00 0.00 29.99 30.68 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 -2.40 3.51 -0.66 -1.41 0.00 -0.14 -4.96 121.76 115.70 2emb s ALA 36 Ca 0.51 -0.16 -0.02 0.00 0.00 0.00 0.00 51.96 52.29 2emb s ALA 36 Cb 0.37 -3.00 0.33 0.00 0.00 0.00 0.00 23.12 20.82 2emb s ALA 36 CO 0.18 -0.49 2.14 0.00 0.00 0.00 0.00 175.76 177.60 2emb n ALA 37 N 4.85 6.28 0.00 0.00 0.00 -1.26 -4.27 120.51 126.11 2emb n ALA 37 Ca -0.01 -3.42 0.00 0.00 0.00 0.00 0.00 53.44 50.02 2emb n ALA 37 Cb 0.50 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.08 2emb n ALA 37 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2emb n LYS 38 N -0.35 0.00 -4.05 0.00 2.85 -1.26 -5.08 118.16 110.27 2emb n LYS 38 Ca 0.53 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 57.51 2emb n LYS 38 Cb 0.48 -0.54 -0.06 0.00 -0.65 0.00 0.00 35.03 34.26 2emb n LYS 38 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2emb s SER 39 N -4.53 5.65 0.05 -5.58 0.01 -1.26 -5.12 113.70 102.92 2emb s SER 39 Ca 0.00 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.24 2emb s SER 39 Cb 0.00 -1.54 -0.04 0.00 0.21 0.00 0.00 66.02 64.65 2emb s SER 39 CO 0.00 0.12 0.15 -0.83 0.41 0.00 0.00 173.24 173.08 2emb s GLY 40 N -2.78 2.11 -0.22 3.44 0.00 -1.26 -4.96 107.32 103.66 2emb s GLY 40 Ca 0.31 -0.89 -0.29 0.00 0.00 0.00 0.00 44.72 43.85 2emb s GLY 40 CO 0.24 -0.84 1.61 2.56 0.00 0.00 0.00 173.10 176.66 2emb s PRO 41 N -2.28 3.81 0.80 2.90 0.04 -1.26 -5.01 135.00 134.00 2emb s PRO 41 Ca 0.30 1.67 -0.11 0.00 0.04 0.00 0.00 61.00 62.90 2emb s PRO 41 Cb -0.13 -4.03 0.08 0.00 0.04 0.00 0.00 34.50 30.46 2emb s PRO 41 CO 0.23 -1.28 1.16 -1.54 0.04 0.00 0.00 177.00 175.61 2emb s SER 42 N 4.17 4.54 -0.24 6.66 1.04 -1.26 -5.09 113.70 123.52 2emb s SER 42 Ca 0.71 0.73 -0.04 0.00 0.48 0.00 0.00 55.95 57.83 2emb s SER 42 Cb -0.25 -1.25 0.13 0.00 0.10 0.00 0.00 66.02 64.75 2emb s SER 42 CO 0.29 -1.87 0.43 -0.44 0.98 0.00 0.00 173.24 172.64 2emb s SER 43 N -4.57 -0.21 0.00 7.02 0.01 -1.26 -5.35 113.70 109.35 2emb s SER 43 Ca 0.62 0.61 0.00 0.00 1.31 0.00 0.00 55.95 58.48 2emb s SER 43 Cb -0.11 1.39 0.00 0.00 0.21 0.00 0.00 66.02 67.51 2emb s SER 43 CO 0.48 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.47