#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys0 h SER 2 N 0.00 -0.53 0.00 1.61 0.87 -2.08 -3.28 113.55 110.14 2ys0 h SER 2 Ca 0.00 0.27 -0.11 0.00 -1.23 0.00 0.00 61.79 60.73 2ys0 h SER 2 Cb 0.00 0.49 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 2ys0 h SER 2 CO 0.00 -0.33 -1.10 -1.20 -0.53 0.00 0.00 176.83 173.67 2ys0 n SER 3 N -5.49 0.98 -0.34 6.23 7.64 -1.26 -5.07 113.62 116.32 2ys0 n SER 3 Ca 0.21 0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.25 2ys0 n SER 3 Cb 0.69 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 2ys0 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ys0 n GLY 4 N 2.52 0.92 4.39 0.23 0.00 -1.24 -4.14 105.19 107.87 2ys0 n GLY 4 Ca -0.14 -0.40 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 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 0.76 -0.89 -4.07 1.61 2.88 -1.26 -4.89 113.62 107.76 2ys0 n SER 5 Ca 0.00 -1.22 -0.09 0.00 -1.33 0.00 0.00 58.87 56.23 2ys0 n SER 5 Cb 0.30 -1.54 -0.09 0.00 -0.75 0.00 0.00 64.21 62.13 2ys0 n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2ys0 s SER 6 N -3.56 0.21 0.00 -3.46 1.04 -1.26 -5.07 113.70 101.61 2ys0 s SER 6 Ca 0.55 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.92 2ys0 s SER 6 Cb -0.32 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.15 2ys0 s SER 6 CO 0.99 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 175.03 2ys0 n GLY 7 N -0.13 0.00 2.07 7.32 0.00 -1.26 -4.98 105.19 108.21 2ys0 n GLY 7 Ca -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.89 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 1.32 -3.73 1.61 5.03 -1.26 -5.01 117.44 115.41 2ys0 n TRP 8 Ca 0.00 -1.80 -0.21 0.00 3.03 0.00 0.00 57.50 58.52 2ys0 n TRP 8 Cb 0.00 -0.25 -0.18 0.00 -1.03 0.00 0.00 31.31 29.85 2ys0 n TRP 8 CO 0.00 0.00 0.00 0.95 -0.03 0.00 0.00 177.69 178.61 2ys0 s THR 9 N -3.31 0.11 0.31 -0.99 -4.23 -1.26 -4.83 115.64 101.44 2ys0 s THR 9 Ca 0.37 0.28 -0.29 0.00 -1.18 0.00 0.00 61.69 60.87 2ys0 s THR 9 Cb 0.37 -0.32 -0.10 0.00 1.34 0.00 0.00 72.50 73.79 2ys0 s THR 9 CO -0.04 0.21 1.32 0.00 -0.54 0.00 0.00 174.62 175.57 2ys0 s ASN 11 N -0.31 2.32 0.00 0.00 0.01 -1.26 -4.84 114.94 110.86 2ys0 s ASN 11 Ca 0.51 -1.55 0.00 0.00 -0.71 0.00 0.00 52.86 51.11 2ys0 s ASN 11 Cb -0.40 0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.55 2ys0 s ASN 11 CO 0.50 -0.82 0.97 0.29 -1.51 0.00 0.00 177.10 176.54 2ys0 n LYS 12 N -0.75 0.00 -0.18 -0.60 4.76 -1.26 -1.65 118.16 118.47 2ys0 n LYS 12 Ca -0.03 0.67 -0.05 0.00 -2.87 0.00 0.00 58.31 56.03 2ys0 n LYS 12 Cb 0.65 -1.47 0.01 0.00 -1.84 0.00 0.00 35.03 32.39 2ys0 n LYS 12 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 2ys0 h PHE 13 N 0.00 -0.77 -0.89 2.13 3.04 -2.00 -0.67 116.94 117.78 2ys0 h PHE 13 Ca 0.00 0.06 0.17 0.00 3.98 0.00 0.00 57.97 62.19 2ys0 h PHE 13 Cb 0.00 0.42 -0.17 0.00 2.56 0.00 0.00 35.95 38.76 2ys0 h PHE 13 CO -0.22 -0.36 -0.25 0.00 -2.02 0.00 0.00 178.31 175.46 2ys0 h ARG 14 N -0.15 -0.01 -3.32 1.11 2.47 -1.91 -3.39 114.38 109.17 2ys0 h ARG 14 Ca 0.23 0.00 -0.28 0.00 -1.26 0.00 0.00 59.98 58.67 2ys0 h ARG 14 Cb 0.53 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.78 2ys0 h ARG 14 CO -0.63 -0.01 1.27 0.00 0.56 0.00 0.00 179.97 181.16 2ys0 n GLY 16 N 3.97 0.98 3.94 0.00 0.00 -0.63 -5.06 105.19 108.39 2ys0 n GLY 16 Ca 0.45 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.22 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 0.03 3.50 0.36 1.61 -1.05 -0.53 -4.98 118.70 117.64 2ys0 s GLU 17 Ca 0.00 -0.32 0.07 0.00 -0.15 0.00 0.00 54.97 54.57 2ys0 s GLU 17 Cb 0.00 -2.69 -0.03 0.00 -0.44 0.00 0.00 34.13 30.97 2ys0 s GLU 17 CO 0.00 0.20 0.25 0.15 0.95 0.00 0.00 175.26 176.81 2ys0 s LYS 18 N -4.10 1.85 -1.14 -4.83 1.02 -1.26 -4.16 119.74 107.12 2ys0 s LYS 18 Ca 0.40 -2.10 -0.04 0.00 0.02 0.00 0.00 55.97 54.25 2ys0 s LYS 18 Cb -0.10 0.09 -0.03 0.00 -0.52 0.00 0.00 37.83 37.28 2ys0 s LYS 18 CO 0.34 -0.63 0.91 0.54 -0.92 0.00 0.00 175.35 175.59 2ys0 n ARG 19 N -0.73 -4.10 -3.72 1.68 3.00 -1.26 -4.98 116.66 106.55 2ys0 n ARG 19 Ca 0.04 0.80 -0.38 0.00 -0.01 0.00 0.00 57.85 58.30 2ys0 n ARG 19 Cb 0.63 -5.63 -0.12 0.00 0.00 0.00 0.00 32.46 27.34 2ys0 n ARG 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2ys0 s LEU 20 N -6.00 4.02 0.10 0.55 2.01 -1.26 -5.09 118.68 113.02 2ys0 s LEU 20 Ca 0.23 -0.73 0.10 0.00 0.01 0.00 0.00 54.13 53.75 2ys0 s LEU 20 Cb -0.04 -1.92 -0.04 0.00 0.01 0.00 0.00 46.19 44.21 2ys0 s LEU 20 CO 0.76 -0.22 -0.26 0.28 1.01 0.00 0.00 176.35 177.91 2ys0 s THR 21 N 1.52 2.24 -0.92 5.49 -1.32 -1.26 -4.72 115.64 116.67 2ys0 s THR 21 Ca 0.03 -1.62 -0.12 0.00 -1.21 0.00 0.00 61.69 58.77 2ys0 s THR 21 Cb -0.18 -1.95 0.12 0.00 -1.51 0.00 0.00 72.50 68.98 2ys0 s THR 21 CO 0.04 0.19 0.29 -2.11 -2.21 0.00 0.00 174.62 170.82 2ys0 n ARG 22 N 1.22 -0.95 -3.57 7.08 -4.01 -1.26 -4.81 116.66 110.35 2ys0 n ARG 22 Ca -0.18 0.07 -0.39 0.00 -1.04 0.00 0.00 57.85 56.32 2ys0 n ARG 22 Cb 0.53 -2.52 -0.11 0.00 -3.04 0.00 0.00 32.46 27.32 2ys0 n ARG 22 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 2ys0 s SER 23 N -2.11 6.03 0.22 2.89 0.15 -1.26 -4.96 113.70 114.66 2ys0 s SER 23 Ca 0.41 -0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.96 2ys0 s SER 23 Cb -0.24 -2.13 0.57 0.00 -1.71 0.00 0.00 66.02 62.51 2ys0 s SER 23 CO 0.50 -0.10 1.10 0.18 1.20 0.00 0.00 173.24 176.12 2ys0 n LEU 24 N 5.08 -0.06 -4.14 3.45 4.77 -1.26 -4.48 117.00 120.36 2ys0 n LEU 24 Ca -0.14 1.19 -0.09 0.00 -0.03 0.00 0.00 56.01 56.94 2ys0 n LEU 24 Cb 0.51 -0.44 -0.10 0.00 -2.33 0.00 0.00 43.42 41.06 2ys0 n LEU 24 CO 0.34 -1.21 -0.33 0.00 -1.33 0.00 0.00 177.39 174.86 2ys0 s ALA 26 N -3.93 0.21 -0.18 0.00 0.00 0.49 -4.84 121.76 113.50 2ys0 s ALA 26 Ca 0.18 0.16 -0.01 0.00 0.00 0.00 0.00 51.96 52.28 2ys0 s ALA 26 Cb 0.07 -0.71 0.08 0.00 0.00 0.00 0.00 23.12 22.56 2ys0 s ALA 26 CO -0.02 -0.61 2.22 0.00 0.00 0.00 0.00 175.76 177.35 2ys0 s SER 28 N 1.03 4.79 0.00 0.00 1.04 -1.26 -1.60 113.70 117.70 2ys0 s SER 28 Ca 0.25 -1.12 -0.19 0.00 0.48 0.00 0.00 55.95 55.38 2ys0 s SER 28 Cb 0.17 0.41 -0.30 0.00 0.10 0.00 0.00 66.02 66.41 2ys0 s SER 28 CO -0.02 -1.21 1.01 -0.78 0.98 0.00 0.00 173.24 173.22 2ys0 h ASP 29 N 0.52 0.66 -0.92 7.02 1.82 -1.90 -3.29 116.42 120.34 2ys0 h ASP 29 Ca -0.34 -0.87 0.14 0.00 -0.39 0.00 0.00 57.03 55.57 2ys0 h ASP 29 Cb 1.30 -0.21 -0.07 0.00 0.68 0.00 0.00 39.33 41.02 2ys0 h ASP 29 CO 0.51 1.48 0.59 -2.24 -1.61 0.00 0.00 179.24 177.96 2ys0 h ASP 30 N -0.05 0.71 -0.89 2.28 2.03 -1.95 -1.03 116.42 117.52 2ys0 h ASP 30 Ca -0.16 0.04 0.19 0.00 -0.73 0.00 0.00 57.03 56.38 2ys0 h ASP 30 Cb 1.75 -0.10 -0.11 0.00 -0.83 0.00 0.00 39.33 40.04 2ys0 h ASP 30 CO 0.19 0.36 0.44 0.00 -1.03 0.00 0.00 179.24 179.20 2ys0 h LYS 32 N 0.52 0.36 0.07 0.00 1.79 -1.34 1.31 116.57 119.28 2ys0 h LYS 32 Ca 0.53 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.98 2ys0 h LYS 32 Cb 0.91 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.48 2ys0 h LYS 32 CO -0.45 0.24 -0.03 0.22 -1.08 0.00 0.00 179.45 178.34 2ys0 h ASP 33 N 0.37 -0.08 0.45 0.86 1.82 -1.05 -3.38 116.42 115.41 2ys0 h ASP 33 Ca 0.42 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 57.06 2ys0 h ASP 33 Cb 0.68 0.02 -0.02 0.00 0.68 0.00 0.00 39.33 40.69 2ys0 h ASP 33 CO -0.45 0.40 -0.47 1.56 -1.61 0.00 0.00 179.24 178.66 2ys0 h GLN 34 N -1.01 -0.90 0.00 0.28 1.08 -0.83 -3.48 115.11 110.25 2ys0 h GLN 34 Ca -0.01 0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 2ys0 h GLN 34 Cb 0.07 0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 2ys0 h GLN 34 CO 0.02 -0.60 0.00 0.41 -0.95 0.00 0.00 178.83 177.70 2ys0 n GLY 35 N -1.54 0.96 2.54 3.46 0.00 0.45 -5.05 105.19 106.01 2ys0 n GLY 35 Ca -0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.72 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 3.33 -4.83 1.61 9.92 -1.11 -5.04 116.55 120.42 2ys0 n ASP 36 Ca 0.00 -3.27 -0.33 0.00 -0.53 0.00 0.00 54.79 50.66 2ys0 n ASP 36 Cb 0.00 -0.48 -0.06 0.00 -0.64 0.00 0.00 41.12 39.93 2ys0 n ASP 36 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2ys0 h ILE 39 N -2.96 0.86 -0.62 0.00 2.10 -1.99 -3.05 117.51 111.85 2ys0 h ILE 39 Ca -0.58 -1.30 -0.44 0.00 1.08 0.00 0.00 64.86 63.63 2ys0 h ILE 39 Cb 1.34 1.79 -0.30 0.00 -1.09 0.00 0.00 36.82 38.55 2ys0 h ILE 39 CO 0.43 0.32 -0.40 -0.46 -1.08 0.00 0.00 178.15 176.97 2ys0 n ASN 40 N -3.62 4.50 0.07 2.19 6.94 -1.26 -4.80 115.26 119.27 2ys0 n ASN 40 Ca -0.01 -3.79 -0.03 0.00 -0.02 0.00 0.00 54.58 50.74 2ys0 n ASN 40 Cb 0.44 -0.51 -0.01 0.00 -2.36 0.00 0.00 39.78 37.34 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 1.79 -0.18 -0.02 -2.53 5.03 -1.87 -2.94 116.97 116.26 2ys0 h TYR 41 Ca 0.33 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.62 2ys0 h TYR 41 Cb 1.39 0.06 0.00 0.00 1.55 0.00 0.00 36.73 39.73 2ys0 h TYR 41 CO 0.96 -0.11 -0.07 0.66 -1.32 0.00 0.00 178.16 178.29 2ys0 h SER 42 N -0.22 0.09 -1.28 -2.11 4.64 -1.88 0.19 113.55 112.99 2ys0 h SER 42 Ca -0.02 -0.65 0.37 0.00 -0.47 0.00 0.00 61.79 61.02 2ys0 h SER 42 Cb 0.15 -0.03 -0.05 0.00 -0.31 0.00 0.00 62.40 62.16 2ys0 h SER 42 CO 0.03 0.73 1.14 -1.28 -0.87 0.00 0.00 176.83 176.58 2ys0 h SER 43 N -0.54 0.00 0.00 4.97 0.87 -1.88 0.58 113.55 117.55 2ys0 h SER 43 Ca -0.00 0.00 -0.29 0.00 -1.23 0.00 0.00 61.79 60.27 2ys0 h SER 43 Cb 0.72 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.64 2ys0 h SER 43 CO 0.01 0.00 -1.92 0.52 -0.53 0.00 0.00 176.83 174.91 2ys0 n VAL 44 N -3.65 1.26 0.23 2.23 0.31 -1.11 -3.88 118.33 113.73 2ys0 n VAL 44 Ca 0.28 -0.20 -0.09 0.00 -0.01 0.00 0.00 64.34 64.32 2ys0 n VAL 44 Cb 1.54 -1.89 -0.04 0.00 -0.91 0.00 0.00 33.84 32.53 2ys0 n VAL 44 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ys0 h GLN 46 N -0.83 0.94 0.00 0.00 4.20 -0.14 -3.46 115.11 115.83 2ys0 h GLN 46 Ca -0.06 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.50 2ys0 h GLN 46 Cb 0.47 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2ys0 h GLN 46 CO 0.10 0.76 0.00 0.41 -0.67 0.00 0.00 178.83 179.43 2ys0 n GLY 47 N -1.03 2.19 3.59 3.46 0.00 0.30 -3.97 105.19 109.74 2ys0 n GLY 47 Ca 0.06 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2ys0 n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ys0 s GLU 48 N 0.00 3.23 -0.15 1.61 -6.30 -1.26 -4.94 118.70 110.89 2ys0 s GLU 48 Ca 0.00 1.42 -0.01 0.00 -2.50 0.00 0.00 54.97 53.88 2ys0 s GLU 48 Cb 0.00 -4.24 0.04 0.00 0.00 0.00 0.00 34.13 29.93 2ys0 s GLU 48 CO 0.00 -1.99 -0.06 0.21 0.02 0.00 0.00 175.26 173.44 2ys0 s LYS 49 N 5.90 1.44 -0.21 4.30 2.20 -1.25 -5.12 119.74 127.00 2ys0 s LYS 49 Ca 0.81 -0.41 -0.11 0.00 -0.36 0.00 0.00 55.97 55.90 2ys0 s LYS 49 Cb -0.22 -1.84 -0.05 0.00 -1.51 0.00 0.00 37.83 34.20 2ys0 s LYS 49 CO 0.32 -0.38 0.16 -1.12 -0.36 0.00 0.00 175.35 173.98 2ys0 s SER 50 N 1.67 6.22 -0.08 1.43 0.01 -1.26 -5.08 113.70 116.61 2ys0 s SER 50 Ca 0.02 0.24 0.02 0.00 1.31 0.00 0.00 55.95 57.55 2ys0 s SER 50 Cb -0.14 -2.11 0.01 0.00 0.21 0.00 0.00 66.02 63.99 2ys0 s SER 50 CO -0.08 0.13 -0.14 -0.44 0.41 0.00 0.00 173.24 173.12 2ys0 s SER 51 N 0.57 2.09 -1.00 2.44 0.01 -1.26 -4.86 113.70 111.70 2ys0 s SER 51 Ca 0.09 -0.36 -0.15 0.00 1.31 0.00 0.00 55.95 56.84 2ys0 s SER 51 Cb -0.12 -0.96 0.01 0.00 0.21 0.00 0.00 66.02 65.17 2ys0 s SER 51 CO 0.01 0.05 0.67 0.61 0.41 0.00 0.00 173.24 174.98 2ys0 n GLY 52 N 3.86 -1.10 3.64 3.44 0.00 -1.26 -4.94 105.19 108.82 2ys0 n GLY 52 Ca -0.21 0.48 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 2ys0 n GLY 52 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ys0 s PRO 53 N -5.76 -0.35 0.31 1.61 0.04 -1.26 -4.88 135.00 124.71 2ys0 s PRO 53 Ca 0.24 0.24 0.03 0.00 0.04 0.00 0.00 61.00 61.55 2ys0 s PRO 53 Cb -0.12 -1.67 0.77 0.00 0.04 0.00 0.00 34.50 33.53 2ys0 s PRO 53 CO 0.90 -3.19 1.53 0.43 0.04 0.00 0.00 177.00 176.71 2ys0 n SER 54 N -4.45 -0.09 -4.76 6.66 7.64 -1.26 -4.19 113.62 113.17 2ys0 n SER 54 Ca 0.08 1.66 -0.39 0.00 1.01 0.00 0.00 58.87 61.23 2ys0 n SER 54 Cb 0.58 -0.61 -0.05 0.00 -1.01 0.00 0.00 64.21 63.12 2ys0 n SER 54 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ys0 s SER 55 N -4.98 7.11 0.00 6.43 0.01 -1.26 -5.30 113.70 115.71 2ys0 s SER 55 Ca -0.12 1.33 0.00 0.00 1.31 0.00 0.00 55.95 58.46 2ys0 s SER 55 Cb 0.29 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 64.10 2ys0 s SER 55 CO 0.76 0.07 0.00 0.61 0.41 0.00 0.00 173.24 175.09