#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys0 s SER 2 N 0.00 6.97 -0.77 1.61 1.04 -1.26 -5.00 113.70 116.29 2ys0 s SER 2 Ca 0.00 1.19 0.01 0.00 0.48 0.00 0.00 55.95 57.63 2ys0 s SER 2 Cb 0.00 -2.46 0.19 0.00 0.10 0.00 0.00 66.02 63.85 2ys0 s SER 2 CO 0.00 -0.38 0.60 -0.44 0.98 0.00 0.00 173.24 174.00 2ys0 s SER 3 N 1.14 5.36 -0.54 7.02 0.01 -1.26 -4.92 113.70 120.51 2ys0 s SER 3 Ca 0.39 -3.61 0.04 0.00 1.31 0.00 0.00 55.95 54.08 2ys0 s SER 3 Cb -0.17 -1.79 0.39 0.00 0.21 0.00 0.00 66.02 64.66 2ys0 s SER 3 CO 0.13 -0.17 1.18 0.61 0.41 0.00 0.00 173.24 175.40 2ys0 n GLY 4 N 2.40 5.86 0.32 3.44 0.00 -1.26 -4.71 105.19 111.24 2ys0 n GLY 4 Ca 0.18 -2.74 -0.16 0.00 0.00 0.00 0.00 46.02 43.30 2ys0 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ys0 n SER 5 N -0.41 1.81 -4.07 1.61 2.88 -1.26 -4.86 113.62 109.33 2ys0 n SER 5 Ca 0.39 0.09 -0.35 0.00 -1.33 0.00 0.00 58.87 57.67 2ys0 n SER 5 Cb 0.53 -0.40 -0.10 0.00 -0.75 0.00 0.00 64.21 63.49 2ys0 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2ys0 s SER 6 N -6.15 5.18 0.00 -3.46 0.15 -1.26 -5.04 113.70 103.12 2ys0 s SER 6 Ca -0.23 -3.03 0.00 0.00 0.70 0.00 0.00 55.95 53.40 2ys0 s SER 6 Cb 0.08 -1.82 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 2ys0 s SER 6 CO 0.33 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 175.06 2ys0 n GLY 7 N 3.23 5.77 2.36 9.45 0.00 -1.26 -4.99 105.19 119.74 2ys0 n GLY 7 Ca 0.10 -1.58 -0.17 0.00 0.00 0.00 0.00 46.02 44.36 2ys0 n GLY 7 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2ys0 n TRP 8 N 0.00 2.37 -3.71 1.61 7.02 -1.26 -4.49 117.44 118.98 2ys0 n TRP 8 Ca 0.00 -2.42 -0.18 0.00 -1.02 0.00 0.00 57.50 53.88 2ys0 n TRP 8 Cb 0.00 -0.27 -0.17 0.00 -2.42 0.00 0.00 31.31 28.45 2ys0 n TRP 8 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2ys0 s THR 9 N -4.45 -0.09 0.87 -0.99 -4.23 -1.26 -4.18 115.64 101.31 2ys0 s THR 9 Ca 0.42 0.35 -0.13 0.00 -1.18 0.00 0.00 61.69 61.16 2ys0 s THR 9 Cb 0.39 -0.13 0.12 0.00 1.34 0.00 0.00 72.50 74.22 2ys0 s THR 9 CO -0.02 0.15 1.19 0.00 -0.54 0.00 0.00 174.62 175.39 2ys0 s ASN 11 N -4.45 0.19 0.11 0.00 0.01 -1.26 -4.98 114.94 104.56 2ys0 s ASN 11 Ca 0.64 -1.28 -0.25 0.00 -0.71 0.00 0.00 52.86 51.26 2ys0 s ASN 11 Cb -0.11 0.46 -0.07 0.00 0.41 0.00 0.00 41.25 41.94 2ys0 s ASN 11 CO 0.51 -0.96 1.66 0.11 -1.51 0.00 0.00 177.10 176.91 2ys0 h LYS 12 N 2.47 -0.32 -0.58 -0.60 6.56 -1.98 -2.52 116.57 119.60 2ys0 h LYS 12 Ca -0.32 0.02 0.01 0.00 -1.06 0.00 0.00 60.65 59.30 2ys0 h LYS 12 Cb 1.25 0.07 -0.03 0.00 -0.57 0.00 0.00 32.23 32.95 2ys0 h LYS 12 CO 0.46 -0.22 0.37 0.74 -2.06 0.00 0.00 179.45 178.75 2ys0 h PHE 13 N -0.34 0.70 -0.85 -1.35 0.04 -2.00 -2.53 116.94 110.60 2ys0 h PHE 13 Ca 0.04 0.02 0.22 0.00 2.80 0.00 0.00 57.97 61.05 2ys0 h PHE 13 Cb 0.39 -0.23 -0.14 0.00 2.20 0.00 0.00 35.95 38.17 2ys0 h PHE 13 CO -0.22 0.42 0.21 0.00 -0.60 0.00 0.00 178.31 178.12 2ys0 h ARG 14 N 0.74 0.20 -5.12 1.51 2.47 -1.84 -3.39 114.38 108.96 2ys0 h ARG 14 Ca 0.22 -0.01 -0.48 0.00 -1.26 0.00 0.00 59.98 58.45 2ys0 h ARG 14 Cb -0.04 -0.05 -0.07 0.00 -1.65 0.00 0.00 29.97 28.16 2ys0 h ARG 14 CO -0.07 0.13 1.73 0.00 0.56 0.00 0.00 179.97 182.32 2ys0 n GLY 16 N 6.36 0.87 3.95 0.00 0.00 -1.00 -5.05 105.19 110.32 2ys0 n GLY 16 Ca 0.60 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.36 2ys0 n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2ys0 s GLU 17 N 0.25 1.56 0.66 1.61 4.04 -0.19 -5.03 118.70 121.61 2ys0 s GLU 17 Ca 0.00 -0.53 0.02 0.00 0.04 0.00 0.00 54.97 54.49 2ys0 s GLU 17 Cb 0.00 -2.11 0.10 0.00 0.02 0.00 0.00 34.13 32.14 2ys0 s GLU 17 CO 0.00 -1.67 0.91 -1.59 -1.84 0.00 0.00 175.26 171.07 2ys0 s LYS 18 N -5.43 1.96 -0.80 -4.83 -2.85 -1.26 -4.78 119.74 101.76 2ys0 s LYS 18 Ca 0.66 -1.16 -0.25 0.00 -1.00 0.00 0.00 55.97 54.22 2ys0 s LYS 18 Cb -0.07 -2.42 -0.03 0.00 -2.06 0.00 0.00 37.83 33.25 2ys0 s LYS 18 CO 0.47 -1.20 1.85 0.50 0.10 0.00 0.00 175.35 177.08 2ys0 s ARG 19 N -4.98 2.68 0.29 1.78 3.00 -1.26 -4.96 118.95 115.51 2ys0 s ARG 19 Ca 0.64 -0.02 0.03 0.00 -1.00 0.00 0.00 55.73 55.38 2ys0 s ARG 19 Cb -0.06 -4.80 -0.03 0.00 0.00 0.00 0.00 34.95 30.06 2ys0 s ARG 19 CO 0.42 -3.01 0.45 -0.51 0.00 0.00 0.00 175.30 172.65 2ys0 s LEU 20 N 9.17 4.16 -0.08 -0.88 1.02 -1.26 -5.05 118.68 125.77 2ys0 s LEU 20 Ca 0.66 0.20 -0.04 0.00 0.02 0.00 0.00 54.13 54.96 2ys0 s LEU 20 Cb -0.08 -3.02 -0.04 0.00 0.02 0.00 0.00 46.19 43.06 2ys0 s LEU 20 CO 0.07 -0.20 -0.11 0.35 0.02 0.00 0.00 176.35 176.49 2ys0 n THR 21 N -1.58 0.45 -0.75 5.49 -2.24 -1.26 -4.69 114.28 109.70 2ys0 n THR 21 Ca -0.07 -0.12 -0.07 0.00 -2.27 0.00 0.00 64.05 61.53 2ys0 n THR 21 Cb 0.57 -1.58 -0.05 0.00 -2.10 0.00 0.00 70.33 67.16 2ys0 n THR 21 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2ys0 n ARG 22 N -3.34 1.48 -3.92 -0.78 3.00 -1.26 -4.75 116.66 107.09 2ys0 n ARG 22 Ca -0.16 -0.60 -0.30 0.00 -0.00 0.00 0.00 57.85 56.79 2ys0 n ARG 22 Cb 0.62 -1.45 -0.16 0.00 0.00 0.00 0.00 32.46 31.47 2ys0 n ARG 22 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2ys0 s SER 23 N 1.73 3.65 0.24 6.15 1.04 -1.26 -5.01 113.70 120.24 2ys0 s SER 23 Ca 0.28 -1.08 -0.12 0.00 0.48 0.00 0.00 55.95 55.51 2ys0 s SER 23 Cb 0.15 -1.11 0.32 0.00 0.10 0.00 0.00 66.02 65.48 2ys0 s SER 23 CO -0.01 -0.23 1.46 0.18 0.98 0.00 0.00 173.24 175.62 2ys0 n LEU 24 N 4.72 -0.48 -4.57 2.42 4.77 -1.26 -4.60 117.00 118.00 2ys0 n LEU 24 Ca -0.12 1.63 -0.26 0.00 -0.03 0.00 0.00 56.01 57.23 2ys0 n LEU 24 Cb 0.45 -0.43 -0.09 0.00 -2.33 0.00 0.00 43.42 41.01 2ys0 n LEU 24 CO 0.18 -1.51 -0.25 0.00 -1.33 0.00 0.00 177.39 174.47 2ys0 s ALA 26 N -3.07 1.12 -0.25 0.00 0.00 -1.22 -4.87 121.76 113.47 2ys0 s ALA 26 Ca 0.26 -0.61 -0.00 0.00 0.00 0.00 0.00 51.96 51.61 2ys0 s ALA 26 Cb 0.06 -1.05 0.21 0.00 0.00 0.00 0.00 23.12 22.34 2ys0 s ALA 26 CO 0.13 -0.84 1.85 0.00 0.00 0.00 0.00 175.76 176.90 2ys0 s SER 28 N 0.34 4.71 0.20 0.00 0.15 -1.26 -2.36 113.70 115.48 2ys0 s SER 28 Ca 0.26 -0.73 -0.11 0.00 0.70 0.00 0.00 55.95 56.07 2ys0 s SER 28 Cb 0.20 -0.78 0.14 0.00 -1.71 0.00 0.00 66.02 63.88 2ys0 s SER 28 CO 0.01 -0.25 1.87 -0.78 1.20 0.00 0.00 173.24 175.29 2ys0 h ASP 29 N 1.58 0.80 -0.97 5.45 1.82 -1.90 -2.38 116.42 120.82 2ys0 h ASP 29 Ca -0.44 -0.02 0.27 0.00 -0.39 0.00 0.00 57.03 56.46 2ys0 h ASP 29 Cb 1.25 -0.20 -0.14 0.00 0.68 0.00 0.00 39.33 40.93 2ys0 h ASP 29 CO 0.63 0.58 0.51 0.44 -1.61 0.00 0.00 179.24 179.78 2ys0 h ASP 30 N 0.94 0.47 -0.92 2.28 5.19 -1.96 0.14 116.42 122.57 2ys0 h ASP 30 Ca 0.26 0.17 0.26 0.00 -0.62 0.00 0.00 57.03 57.10 2ys0 h ASP 30 Cb -0.10 0.12 -0.15 0.00 0.18 0.00 0.00 39.33 39.38 2ys0 h ASP 30 CO -0.06 -0.05 0.26 0.00 -3.12 0.00 0.00 179.24 176.27 2ys0 h LYS 32 N 0.17 0.29 0.49 0.00 1.79 -0.87 1.99 116.57 120.43 2ys0 h LYS 32 Ca 0.60 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 59.03 2ys0 h LYS 32 Cb 1.28 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 2ys0 h LYS 32 CO -0.70 0.19 -0.23 0.22 -1.08 0.00 0.00 179.45 177.85 2ys0 h ASP 33 N 0.30 -0.55 0.25 0.86 1.82 -0.11 -3.39 116.42 115.60 2ys0 h ASP 33 Ca 0.72 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 57.37 2ys0 h ASP 33 Cb 1.81 0.14 0.00 0.00 0.68 0.00 0.00 39.33 41.97 2ys0 h ASP 33 CO -0.49 -0.19 -0.12 1.56 -1.61 0.00 0.00 179.24 178.38 2ys0 h GLN 34 N -1.06 -0.32 0.00 0.28 1.08 -1.20 -3.49 115.11 110.40 2ys0 h GLN 34 Ca -0.07 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2ys0 h GLN 34 Cb 0.50 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.00 2ys0 h GLN 34 CO 0.11 -0.22 0.00 0.41 -0.95 0.00 0.00 178.83 178.18 2ys0 n GLY 35 N 0.68 0.72 0.01 3.46 0.00 0.67 -5.06 105.19 105.67 2ys0 n GLY 35 Ca -0.04 -0.34 0.05 0.00 0.00 0.00 0.00 46.02 45.69 2ys0 n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ys0 n ASP 36 N 0.00 1.91 -3.75 1.61 8.00 -1.25 -5.02 116.55 118.06 2ys0 n ASP 36 Ca 0.00 0.00 -0.49 0.00 0.71 0.00 0.00 54.79 55.01 2ys0 n ASP 36 Cb 0.00 1.51 -0.07 0.00 -0.02 0.00 0.00 41.12 42.55 2ys0 n ASP 36 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ys0 h ILE 39 N -1.33 1.09 -1.98 0.00 6.09 -1.88 -2.89 117.51 116.60 2ys0 h ILE 39 Ca -0.44 -0.26 -0.64 0.00 -1.37 0.00 0.00 64.86 62.15 2ys0 h ILE 39 Cb 1.37 0.27 -0.38 0.00 0.47 0.00 0.00 36.82 38.56 2ys0 h ILE 39 CO 0.27 0.14 -0.25 -0.46 -3.07 0.00 0.00 178.15 174.78 2ys0 n ASN 40 N -4.46 5.31 0.08 2.19 6.94 -1.26 -4.84 115.26 119.22 2ys0 n ASN 40 Ca 0.07 -3.72 -0.04 0.00 -0.02 0.00 0.00 54.58 50.88 2ys0 n ASN 40 Cb 0.12 -0.67 -0.02 0.00 -2.36 0.00 0.00 39.78 36.86 2ys0 n ASN 40 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 2ys0 h TYR 41 N 3.01 -0.24 -0.38 -2.53 3.20 -1.81 -3.14 116.97 115.08 2ys0 h TYR 41 Ca 0.29 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 62.05 2ys0 h TYR 41 Cb 0.57 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 2ys0 h TYR 41 CO 0.94 -0.15 -0.20 0.66 -1.64 0.00 0.00 178.16 177.76 2ys0 h SER 42 N -0.69 0.74 -0.79 -2.11 4.64 -1.87 0.13 113.55 113.60 2ys0 h SER 42 Ca -0.03 -0.26 0.17 0.00 -0.47 0.00 0.00 61.79 61.20 2ys0 h SER 42 Cb 0.20 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 2ys0 h SER 42 CO 0.04 0.94 0.53 -1.28 -0.87 0.00 0.00 176.83 176.19 2ys0 h SER 43 N 0.65 0.35 0.00 4.97 0.87 -1.71 0.51 113.55 119.18 2ys0 h SER 43 Ca 0.09 0.02 -0.34 0.00 -1.23 0.00 0.00 61.79 60.34 2ys0 h SER 43 Cb 0.70 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.56 2ys0 h SER 43 CO 0.05 0.17 -1.86 0.52 -0.53 0.00 0.00 176.83 175.18 2ys0 n VAL 44 N -4.47 1.53 0.01 2.23 0.31 -1.06 -4.52 118.33 112.36 2ys0 n VAL 44 Ca 0.16 -0.19 -0.01 0.00 -0.01 0.00 0.00 64.34 64.29 2ys0 n VAL 44 Cb 0.60 -1.97 -0.00 0.00 -0.91 0.00 0.00 33.84 31.55 2ys0 n VAL 44 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ys0 s GLN 46 N -1.57 3.86 -0.29 0.00 -1.52 0.18 -4.89 119.66 115.42 2ys0 s GLN 46 Ca -0.01 -1.95 -0.20 0.00 -1.95 0.00 0.00 55.36 51.25 2ys0 s GLN 46 Cb 0.00 -5.22 0.16 0.00 -0.22 0.00 0.00 33.01 27.72 2ys0 s GLN 46 CO 0.02 -1.99 1.12 0.20 -0.25 0.00 0.00 175.29 174.38 2ys0 s GLY 47 N 3.83 0.12 -0.51 3.09 0.00 -1.17 -4.11 107.32 108.57 2ys0 s GLY 47 Ca 0.44 3.18 -0.26 0.00 0.00 0.00 0.00 44.72 48.08 2ys0 s GLY 47 CO -0.02 2.28 2.43 -2.21 0.00 0.00 0.00 173.10 175.58 2ys0 n GLU 48 N 2.80 1.01 -4.26 2.90 0.00 -1.26 -4.93 120.64 116.90 2ys0 n GLU 48 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 57.16 56.72 2ys0 n GLU 48 Cb 0.57 -3.36 -0.10 0.00 0.00 0.00 0.00 31.44 28.55 2ys0 n GLU 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.13 175.54 2ys0 s LYS 49 N 8.29 2.00 -0.10 5.31 0.00 -1.26 -5.12 119.74 128.86 2ys0 s LYS 49 Ca 1.00 -1.10 -0.16 0.00 0.00 0.00 0.00 55.97 55.71 2ys0 s LYS 49 Cb -0.23 -2.23 -0.05 0.00 0.00 0.00 0.00 37.83 35.33 2ys0 s LYS 49 CO 0.27 0.49 0.39 -1.12 0.00 0.00 0.00 175.35 175.38 2ys0 s SER 50 N -2.26 6.62 -0.82 0.03 0.01 -1.26 -4.99 113.70 111.04 2ys0 s SER 50 Ca 0.21 0.74 -0.25 0.00 1.31 0.00 0.00 55.95 57.95 2ys0 s SER 50 Cb -0.11 -2.24 -0.10 0.00 0.21 0.00 0.00 66.02 63.79 2ys0 s SER 50 CO 0.13 0.12 2.22 -0.55 0.41 0.00 0.00 173.24 175.57 2ys0 s SER 51 N 0.13 4.42 -0.25 2.44 0.15 -1.26 -4.82 113.70 114.50 2ys0 s SER 51 Ca 0.22 -0.18 -0.27 0.00 0.70 0.00 0.00 55.95 56.42 2ys0 s SER 51 Cb -0.15 -2.55 0.14 0.00 -1.71 0.00 0.00 66.02 61.75 2ys0 s SER 51 CO 0.09 -3.37 1.12 -0.83 1.20 0.00 0.00 173.24 171.44 2ys0 s GLY 52 N 9.78 -0.08 0.48 9.45 0.00 -1.26 -5.16 107.32 120.53 2ys0 s GLY 52 Ca 0.84 2.63 -0.22 0.00 0.00 0.00 0.00 44.72 47.97 2ys0 s GLY 52 CO 0.06 1.55 1.15 2.56 0.00 0.00 0.00 173.10 178.42 2ys0 s PRO 53 N -0.31 3.66 0.15 2.90 0.04 -1.26 -5.06 135.00 135.12 2ys0 s PRO 53 Ca 0.03 1.73 0.10 0.00 0.04 0.00 0.00 61.00 62.90 2ys0 s PRO 53 Cb -0.03 -2.30 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 2ys0 s PRO 53 CO -0.06 -0.62 -0.24 0.45 0.04 0.00 0.00 177.00 176.58 2ys0 s SER 54 N -1.47 3.13 0.48 6.66 0.15 -1.26 -5.15 113.70 116.24 2ys0 s SER 54 Ca 0.66 -0.80 0.08 0.00 0.70 0.00 0.00 55.95 56.59 2ys0 s SER 54 Cb -0.27 -0.21 0.03 0.00 -1.71 0.00 0.00 66.02 63.86 2ys0 s SER 54 CO 0.32 0.11 0.56 -0.94 1.20 0.00 0.00 173.24 174.49 2ys0 s SER 55 N -2.35 5.17 0.00 5.45 1.04 -1.26 -5.35 113.70 116.40 2ys0 s SER 55 Ca 0.15 -0.76 0.28 0.00 0.48 0.00 0.00 55.95 56.10 2ys0 s SER 55 Cb -0.09 -0.18 1.66 0.00 0.10 0.00 0.00 66.02 67.51 2ys0 s SER 55 CO 0.07 -0.96 2.00 0.61 0.98 0.00 0.00 173.24 175.95