#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 4.89 -0.25 1.61 0.15 -1.26 -5.04 113.70 113.80 2ys0 s SER 2 Ca 0.00 -3.81 0.03 0.00 0.70 0.00 0.00 55.95 52.87 2ys0 s SER 2 Cb 0.00 -1.66 0.06 0.00 -1.71 0.00 0.00 66.02 62.71 2ys0 s SER 2 CO 0.00 -0.10 -0.12 -0.55 1.20 0.00 0.00 173.24 173.68 2ys0 s SER 3 N -1.32 4.31 0.00 5.45 0.15 -1.26 -4.87 113.70 116.15 2ys0 s SER 3 Ca 0.25 -1.32 0.00 0.00 0.70 0.00 0.00 55.95 55.57 2ys0 s SER 3 Cb -0.06 -1.53 0.00 0.00 -1.71 0.00 0.00 66.02 62.73 2ys0 s SER 3 CO -0.16 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2ys0 n GLY 4 N 4.46 0.77 3.66 9.45 0.00 -1.26 -5.06 105.19 117.21 2ys0 n GLY 4 Ca -0.15 -0.63 -0.50 0.00 0.00 0.00 0.00 46.02 44.75 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 0.00 2.69 -4.39 1.61 2.88 -1.26 -4.97 113.62 110.18 2ys0 n SER 5 Ca 0.00 1.07 -0.19 0.00 -1.33 0.00 0.00 58.87 58.41 2ys0 n SER 5 Cb 0.00 -1.31 -0.10 0.00 -0.75 0.00 0.00 64.21 62.04 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 1.83 2.09 0.27 -3.46 0.15 -1.26 -5.17 113.70 108.16 2ys0 s SER 6 Ca 0.86 -1.31 0.03 0.00 0.70 0.00 0.00 55.95 56.23 2ys0 s SER 6 Cb -0.81 -0.03 -0.04 0.00 -1.71 0.00 0.00 66.02 63.43 2ys0 s SER 6 CO 0.47 -0.56 0.17 -0.83 1.20 0.00 0.00 173.24 173.69 2ys0 s GLY 7 N -3.40 1.89 -0.11 9.45 0.00 -1.26 -5.10 107.32 108.79 2ys0 s GLY 7 Ca 0.33 -1.81 -0.06 0.00 0.00 0.00 0.00 44.72 43.18 2ys0 s GLY 7 CO 0.13 -1.50 -0.11 1.49 0.00 0.00 0.00 173.10 173.10 2ys0 h TRP 8 N 2.35 0.00 -1.29 1.90 4.06 -2.02 -3.45 115.95 117.50 2ys0 h TRP 8 Ca -0.33 0.00 -0.54 0.00 2.06 0.00 0.00 58.89 60.08 2ys0 h TRP 8 Cb 1.25 0.00 0.12 0.00 -1.00 0.00 0.00 29.16 29.53 2ys0 h TRP 8 CO 0.91 0.00 -0.72 0.25 -3.56 0.00 0.00 178.44 175.31 2ys0 n THR 9 N -4.22 0.84 -3.90 1.49 -2.24 -1.26 -4.78 114.28 100.21 2ys0 n THR 9 Ca -0.05 -0.43 -0.28 0.00 -2.27 0.00 0.00 64.05 61.02 2ys0 n THR 9 Cb 0.17 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.36 2ys0 n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ys0 s ASN 11 N -2.94 5.47 0.24 0.00 -0.87 -1.26 -4.81 114.94 110.77 2ys0 s ASN 11 Ca 0.35 0.20 0.07 0.00 -1.57 0.00 0.00 52.86 51.91 2ys0 s ASN 11 Cb -0.12 -1.62 0.70 0.00 -0.02 0.00 0.00 41.25 40.20 2ys0 s ASN 11 CO 0.28 0.37 1.12 1.17 -2.57 0.00 0.00 177.10 177.47 2ys0 n LYS 12 N 2.19 -0.05 0.02 -0.60 3.00 -1.26 0.13 118.16 121.59 2ys0 n LYS 12 Ca -0.19 1.03 -0.13 0.00 -0.00 0.00 0.00 58.31 59.03 2ys0 n LYS 12 Cb 0.54 -1.72 -0.09 0.00 0.00 0.00 0.00 35.03 33.76 2ys0 n LYS 12 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.40 178.14 2ys0 h PHE 13 N 0.00 -0.08 -0.91 5.64 0.04 -1.98 -3.19 116.94 116.45 2ys0 h PHE 13 Ca 0.50 -0.00 0.26 0.00 2.80 0.00 0.00 57.97 61.52 2ys0 h PHE 13 Cb 1.16 0.03 -0.16 0.00 2.20 0.00 0.00 35.95 39.18 2ys0 h PHE 13 CO -0.23 0.36 0.19 0.00 -0.60 0.00 0.00 178.31 178.03 2ys0 h ARG 14 N -0.56 0.12 -4.31 1.51 2.47 0.64 -3.42 114.38 110.84 2ys0 h ARG 14 Ca -0.01 -0.01 -0.60 0.00 -1.26 0.00 0.00 59.98 58.10 2ys0 h ARG 14 Cb 0.48 -0.03 0.02 0.00 -1.65 0.00 0.00 29.97 28.79 2ys0 h ARG 14 CO 0.02 0.08 0.29 0.00 0.56 0.00 0.00 179.97 180.92 2ys0 n GLY 16 N 2.05 -0.46 3.56 0.00 0.00 0.36 -4.94 105.19 105.76 2ys0 n GLY 16 Ca 0.19 0.22 -0.25 0.00 0.00 0.00 0.00 46.02 46.18 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 -4.34 2.02 -0.24 1.61 -1.05 -0.60 -4.95 118.70 111.16 2ys0 s GLU 17 Ca 0.23 -1.40 0.19 0.00 -0.15 0.00 0.00 54.97 53.84 2ys0 s GLU 17 Cb -0.03 -2.08 0.49 0.00 -0.44 0.00 0.00 34.13 32.07 2ys0 s GLU 17 CO 0.54 0.40 1.14 0.36 0.95 0.00 0.00 175.26 178.65 2ys0 n LYS 18 N -0.28 1.95 -4.58 -4.83 0.00 -1.26 -4.45 118.16 104.71 2ys0 n LYS 18 Ca -0.09 -3.48 -0.26 0.00 -0.00 0.00 0.00 58.31 54.47 2ys0 n LYS 18 Cb 0.57 -1.58 -0.10 0.00 -0.00 0.00 0.00 35.03 33.91 2ys0 n LYS 18 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2ys0 s ARG 19 N -3.33 1.89 -1.18 -1.58 0.52 -1.26 -4.83 118.95 109.17 2ys0 s ARG 19 Ca 0.33 -2.08 -0.01 0.00 -0.52 0.00 0.00 55.73 53.45 2ys0 s ARG 19 Cb 0.35 -1.34 -0.01 0.00 0.52 0.00 0.00 34.95 34.47 2ys0 s ARG 19 CO -0.04 -0.15 0.97 1.28 0.02 0.00 0.00 175.30 177.39 2ys0 n LEU 20 N -0.91 -4.23 -0.65 2.53 4.77 -1.26 -4.81 117.00 112.44 2ys0 n LEU 20 Ca -0.06 -0.65 0.50 0.00 -0.03 0.00 0.00 56.01 55.78 2ys0 n LEU 20 Cb 0.67 -3.12 0.78 0.00 -2.33 0.00 0.00 43.42 39.42 2ys0 n LEU 20 CO 0.45 0.34 1.41 0.41 -1.33 0.00 0.00 177.39 178.67 2ys0 n THR 21 N -4.00 -0.07 -1.95 -5.08 -1.04 -1.26 0.68 114.28 101.55 2ys0 n THR 21 Ca -0.26 1.59 -0.40 0.00 -2.04 0.00 0.00 64.05 62.94 2ys0 n THR 21 Cb 0.66 -2.63 0.04 0.00 -1.82 0.00 0.00 70.33 66.58 2ys0 n THR 21 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2ys0 n ARG 22 N -4.16 2.83 -3.97 -2.82 1.85 -1.26 -4.97 116.66 104.17 2ys0 n ARG 22 Ca 0.44 -3.57 -0.35 0.00 -1.00 0.00 0.00 57.85 53.36 2ys0 n ARG 22 Cb 1.90 -2.27 -0.08 0.00 -1.05 0.00 0.00 32.46 30.95 2ys0 n ARG 22 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2ys0 s SER 23 N -1.15 5.88 0.09 2.89 1.04 0.21 -5.01 113.70 117.66 2ys0 s SER 23 Ca 0.52 0.21 -0.18 0.00 0.48 0.00 0.00 55.95 56.98 2ys0 s SER 23 Cb 0.43 -1.95 -0.04 0.00 0.10 0.00 0.00 66.02 64.56 2ys0 s SER 23 CO -0.41 0.26 1.00 -0.11 0.98 0.00 0.00 173.24 174.96 2ys0 n LEU 24 N 2.98 -0.60 -4.19 2.42 0.00 -1.26 -4.48 117.00 111.86 2ys0 n LEU 24 Ca -0.18 1.14 -0.19 0.00 0.00 0.00 0.00 56.01 56.78 2ys0 n LEU 24 Cb 0.53 -0.19 -0.12 0.00 0.00 0.00 0.00 43.42 43.64 2ys0 n LEU 24 CO 0.34 -0.89 -0.47 0.00 0.00 0.00 0.00 177.39 176.37 2ys0 s ALA 26 N -1.30 3.63 -0.42 0.00 0.00 -1.25 -4.80 121.76 117.62 2ys0 s ALA 26 Ca -0.00 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 51.85 2ys0 s ALA 26 Cb -0.10 -2.48 0.45 0.00 0.00 0.00 0.00 23.12 20.99 2ys0 s ALA 26 CO 0.03 0.46 1.42 0.00 0.00 0.00 0.00 175.76 177.67 2ys0 s SER 28 N -3.07 3.95 -0.08 0.00 1.04 -1.26 0.14 113.70 114.42 2ys0 s SER 28 Ca 0.54 -1.31 0.03 0.00 0.48 0.00 0.00 55.95 55.69 2ys0 s SER 28 Cb 0.43 -0.41 0.22 0.00 0.10 0.00 0.00 66.02 66.36 2ys0 s SER 28 CO -0.02 -0.44 0.93 -0.90 0.98 0.00 0.00 173.24 173.79 2ys0 n ASP 29 N -0.99 2.49 -0.04 7.02 5.68 -1.26 -3.51 116.55 125.94 2ys0 n ASP 29 Ca -0.04 -2.29 -0.04 0.00 -0.50 0.00 0.00 54.79 51.91 2ys0 n ASP 29 Cb 0.66 -0.56 -0.06 0.00 -1.14 0.00 0.00 41.12 40.03 2ys0 n ASP 29 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2ys0 n ASP 30 N 0.15 3.17 0.28 -1.12 8.00 -1.26 -4.54 116.55 121.23 2ys0 n ASP 30 Ca 0.09 -0.01 0.17 0.00 0.71 0.00 0.00 54.79 55.76 2ys0 n ASP 30 Cb 0.58 0.54 0.77 0.00 -0.02 0.00 0.00 41.12 42.99 2ys0 n ASP 30 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ys0 h LYS 32 N 0.00 0.83 0.38 0.00 1.57 -1.80 0.46 116.57 118.01 2ys0 h LYS 32 Ca -0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2ys0 h LYS 32 Cb 0.42 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2ys0 h LYS 32 CO 0.00 0.55 -0.18 -0.44 -0.57 0.00 0.00 179.45 178.81 2ys0 h ASP 33 N 0.86 -0.43 0.87 0.86 3.32 -1.82 -3.36 116.42 116.72 2ys0 h ASP 33 Ca 0.43 -0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.33 2ys0 h ASP 33 Cb 0.49 0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.16 2ys0 h ASP 33 CO -0.20 0.01 -0.46 1.56 -1.72 0.00 0.00 179.24 178.43 2ys0 h GLN 34 N -1.02 -1.18 0.00 3.56 1.08 -1.60 -3.48 115.11 112.47 2ys0 h GLN 34 Ca -0.05 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 2ys0 h GLN 34 Cb 0.52 0.27 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 2ys0 h GLN 34 CO 0.09 -0.79 0.00 0.41 -0.95 0.00 0.00 178.83 177.59 2ys0 n GLY 35 N -1.62 0.79 0.00 3.46 0.00 0.16 -5.06 105.19 102.92 2ys0 n GLY 35 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2ys0 n GLY 35 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ys0 n ASP 36 N 0.00 4.68 -3.43 1.61 2.03 -1.07 -5.06 116.55 115.32 2ys0 n ASP 36 Ca 0.00 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.88 2ys0 n ASP 36 Cb 0.00 0.75 -0.05 0.00 -0.72 0.00 0.00 41.12 41.10 2ys0 n ASP 36 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ys0 h ILE 39 N 3.01 0.16 -1.42 0.00 2.10 -1.86 0.72 117.51 120.21 2ys0 h ILE 39 Ca -0.45 -0.02 -0.68 0.00 1.08 0.00 0.00 64.86 64.79 2ys0 h ILE 39 Cb 1.28 0.08 -0.33 0.00 -1.09 0.00 0.00 36.82 36.77 2ys0 h ILE 39 CO 0.75 0.01 0.40 -3.20 -1.08 0.00 0.00 178.15 175.03 2ys0 n ASN 40 N -4.39 6.68 -0.01 2.19 5.15 -1.26 -4.66 115.26 118.96 2ys0 n ASN 40 Ca 0.37 -3.79 -0.17 0.00 -0.60 0.00 0.00 54.58 50.39 2ys0 n ASN 40 Cb 1.54 -0.82 -0.13 0.00 -0.53 0.00 0.00 39.78 39.84 2ys0 n ASN 40 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2ys0 h TYR 41 N 2.50 0.28 0.41 1.20 3.20 0.13 -3.25 116.97 121.44 2ys0 h TYR 41 Ca 0.50 -0.19 -0.02 0.00 3.14 0.00 0.00 58.73 62.16 2ys0 h TYR 41 Cb 0.65 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.91 2ys0 h TYR 41 CO 1.14 1.12 -0.20 1.03 -1.64 0.00 0.00 178.16 179.61 2ys0 h SER 42 N -0.64 -0.47 -1.06 -2.11 0.87 -1.83 0.30 113.55 108.62 2ys0 h SER 42 Ca -0.06 0.02 0.39 0.00 -1.23 0.00 0.00 61.79 60.90 2ys0 h SER 42 Cb 1.27 0.12 -0.13 0.00 -0.44 0.00 0.00 62.40 63.22 2ys0 h SER 42 CO 0.07 -0.11 0.65 -0.24 -0.53 0.00 0.00 176.83 176.67 2ys0 n SER 43 N -4.72 0.22 -0.09 6.23 2.88 -1.26 0.75 113.62 117.63 2ys0 n SER 43 Ca -0.07 1.27 -0.19 0.00 -1.33 0.00 0.00 58.87 58.56 2ys0 n SER 43 Cb 0.22 -0.62 -0.11 0.00 -0.75 0.00 0.00 64.21 62.95 2ys0 n SER 43 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2ys0 h VAL 44 N 0.00 0.97 0.00 2.46 2.07 -1.61 -3.33 116.25 116.81 2ys0 h VAL 44 Ca 0.74 -2.08 0.00 0.00 0.82 0.00 0.00 66.70 66.18 2ys0 h VAL 44 Cb 2.24 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 34.20 2ys0 h VAL 44 CO -0.49 0.33 0.00 0.00 0.02 0.00 0.00 177.57 177.43 2ys0 n GLN 46 N -1.48 1.43 0.00 0.00 1.13 0.23 -4.12 117.38 114.58 2ys0 n GLN 46 Ca 0.00 -0.44 -0.00 0.00 -1.94 0.00 0.00 57.00 54.62 2ys0 n GLN 46 Cb 0.00 -1.43 -0.00 0.00 0.11 0.00 0.00 30.24 28.92 2ys0 n GLN 46 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ys0 n GLY 47 N 1.92 -0.05 2.80 1.08 0.00 0.25 -4.49 105.19 106.70 2ys0 n GLY 47 Ca 0.19 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.26 1.25 0.05 1.61 -6.30 -1.26 -5.04 118.70 107.76 2ys0 s GLU 48 Ca -0.01 -1.81 0.00 0.00 -2.50 0.00 0.00 54.97 50.65 2ys0 s GLU 48 Cb 0.00 -2.51 -0.04 0.00 0.00 0.00 0.00 34.13 31.58 2ys0 s GLU 48 CO 0.02 -1.07 0.17 0.21 0.02 0.00 0.00 175.26 174.61 2ys0 s LYS 49 N 0.70 3.28 -0.14 4.30 2.47 -1.26 -5.03 119.74 124.07 2ys0 s LYS 49 Ca 0.14 -0.49 -0.10 0.00 -1.56 0.00 0.00 55.97 53.96 2ys0 s LYS 49 Cb -0.22 -2.96 -0.03 0.00 -1.46 0.00 0.00 37.83 33.16 2ys0 s LYS 49 CO -0.08 0.61 -0.20 0.43 0.16 0.00 0.00 175.35 176.27 2ys0 n SER 50 N 0.44 1.71 -4.52 1.43 7.64 -1.26 -4.69 113.62 114.37 2ys0 n SER 50 Ca -0.07 0.54 -0.43 0.00 1.01 0.00 0.00 58.87 59.93 2ys0 n SER 50 Cb 0.51 -0.82 -0.01 0.00 -1.01 0.00 0.00 64.21 62.89 2ys0 n SER 50 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ys0 s SER 51 N -5.62 6.83 0.00 6.43 0.01 -1.26 -4.97 113.70 115.11 2ys0 s SER 51 Ca -0.17 -2.40 0.00 0.00 1.31 0.00 0.00 55.95 54.70 2ys0 s SER 51 Cb 0.02 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.76 2ys0 s SER 51 CO 0.25 -1.08 0.00 0.61 0.41 0.00 0.00 173.24 173.43 2ys0 n GLY 52 N 5.26 -0.04 0.04 3.44 0.00 -1.26 -4.92 105.19 107.70 2ys0 n GLY 52 Ca 0.39 -1.68 0.08 0.00 0.00 0.00 0.00 46.02 44.82 2ys0 n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ys0 n PRO 53 N 0.00 0.06 -0.23 1.61 -0.04 -1.26 -3.30 135.00 131.84 2ys0 n PRO 53 Ca 0.00 0.31 0.02 0.00 -0.04 0.00 0.00 63.50 63.78 2ys0 n PRO 53 Cb 0.00 -1.61 0.14 0.00 -0.04 0.00 0.00 33.50 31.99 2ys0 n PRO 53 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2ys0 h SER 54 N 0.00 0.30 -3.85 3.54 0.87 -1.95 -3.40 113.55 109.05 2ys0 h SER 54 Ca 0.00 0.08 -0.51 0.00 -1.23 0.00 0.00 61.79 60.13 2ys0 h SER 54 Cb 0.28 0.05 0.03 0.00 -0.44 0.00 0.00 62.40 62.32 2ys0 h SER 54 CO 0.00 0.16 0.51 -0.44 -0.53 0.00 0.00 176.83 176.53 2ys0 s SER 55 N -5.41 7.02 0.00 6.23 0.01 -1.21 -5.25 113.70 115.09 2ys0 s SER 55 Ca -0.13 2.37 0.00 0.00 1.31 0.00 0.00 55.95 59.50 2ys0 s SER 55 Cb 0.18 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.78 2ys0 s SER 55 CO 0.75 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 174.68