#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 6.13 -0.07 1.61 1.04 -1.26 -4.86 113.70 116.29 2ys0 s SER 2 Ca 0.00 -2.35 -0.10 0.00 0.48 0.00 0.00 55.95 53.98 2ys0 s SER 2 Cb 0.00 -2.10 -0.03 0.00 0.10 0.00 0.00 66.02 63.99 2ys0 s SER 2 CO 0.00 -0.63 -0.19 -0.24 0.98 0.00 0.00 173.24 173.17 2ys0 n SER 3 N 4.37 1.30 -1.19 7.02 2.88 -1.26 -5.10 113.62 121.65 2ys0 n SER 3 Ca 0.02 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.77 2ys0 n SER 3 Cb 0.42 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 2ys0 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ys0 n GLY 4 N 2.09 5.62 2.84 0.46 0.00 -1.26 -5.13 105.19 109.80 2ys0 n GLY 4 Ca -0.08 -2.12 -0.30 0.00 0.00 0.00 0.00 46.02 43.52 2ys0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ys0 s SER 5 N -0.21 4.22 -0.13 1.61 0.01 -1.26 -5.11 113.70 112.83 2ys0 s SER 5 Ca 0.00 -1.75 -0.21 0.00 1.31 0.00 0.00 55.95 55.30 2ys0 s SER 5 Cb 0.00 -1.12 -0.03 0.00 0.21 0.00 0.00 66.02 65.08 2ys0 s SER 5 CO 0.00 -0.39 0.64 -0.55 0.41 0.00 0.00 173.24 173.35 2ys0 s SER 6 N 1.38 6.81 0.00 2.44 0.15 -1.26 -4.81 113.70 118.41 2ys0 s SER 6 Ca 0.09 0.98 0.00 0.00 0.70 0.00 0.00 55.95 57.71 2ys0 s SER 6 Cb -0.18 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2ys0 s SER 6 CO -0.18 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.70 2ys0 n GLY 7 N 3.42 -1.90 4.09 9.45 0.00 -1.26 -4.96 105.19 114.04 2ys0 n GLY 7 Ca -0.02 0.87 -0.34 0.00 0.00 0.00 0.00 46.02 46.52 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 -1.47 -3.57 1.61 5.03 -1.26 -4.89 117.44 112.88 2ys0 n TRP 8 Ca 0.00 0.61 -0.26 0.00 3.03 0.00 0.00 57.50 60.88 2ys0 n TRP 8 Cb 0.00 -2.14 -0.16 0.00 -1.03 0.00 0.00 31.31 27.98 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 -3.07 -0.11 0.64 -0.99 -4.23 -1.26 -4.86 115.64 101.76 2ys0 s THR 9 Ca 0.67 -0.37 -0.17 0.00 -1.18 0.00 0.00 61.69 60.64 2ys0 s THR 9 Cb -0.38 -0.73 -0.05 0.00 1.34 0.00 0.00 72.50 72.67 2ys0 s THR 9 CO 0.82 -0.43 0.65 0.00 -0.54 0.00 0.00 174.62 175.12 2ys0 s ASN 11 N -1.33 0.45 0.22 0.00 0.01 -1.26 -4.82 114.94 108.20 2ys0 s ASN 11 Ca 0.70 -0.12 -0.01 0.00 -0.71 0.00 0.00 52.86 52.71 2ys0 s ASN 11 Cb -0.40 -0.04 0.47 0.00 0.41 0.00 0.00 41.25 41.70 2ys0 s ASN 11 CO 0.54 0.01 1.13 2.29 -1.51 0.00 0.00 177.10 179.56 2ys0 n LYS 12 N 2.82 -0.06 0.30 -0.60 2.85 -1.26 0.41 118.16 122.62 2ys0 n LYS 12 Ca -0.14 1.10 -0.16 0.00 -1.05 0.00 0.00 58.31 58.07 2ys0 n LYS 12 Cb 0.58 -1.71 -0.08 0.00 -0.65 0.00 0.00 35.03 33.17 2ys0 n LYS 12 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 177.40 178.09 2ys0 h PHE 13 N 0.00 -0.71 -0.80 5.58 0.04 -1.96 -3.11 116.94 115.98 2ys0 h PHE 13 Ca 0.40 -0.02 0.19 0.00 2.80 0.00 0.00 57.97 61.34 2ys0 h PHE 13 Cb 0.76 0.24 -0.14 0.00 2.20 0.00 0.00 35.95 39.00 2ys0 h PHE 13 CO -0.44 -0.39 0.00 0.00 -0.60 0.00 0.00 178.31 176.89 2ys0 h ARG 14 N -0.95 0.09 -4.00 1.51 3.08 -0.44 -3.41 114.38 110.25 2ys0 h ARG 14 Ca -0.08 -0.01 -0.47 0.00 0.07 0.00 0.00 59.98 59.50 2ys0 h ARG 14 Cb 0.65 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.63 2ys0 h ARG 14 CO 0.13 0.06 1.09 0.00 -1.07 0.00 0.00 179.97 180.18 2ys0 n GLY 16 N 5.08 0.60 3.91 0.00 0.00 -0.84 -5.04 105.19 108.90 2ys0 n GLY 16 Ca 0.43 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.21 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 0.80 2.31 1.26 1.61 -1.05 -0.93 -5.04 118.70 117.67 2ys0 s GLU 17 Ca 0.00 -1.87 -0.17 0.00 -0.15 0.00 0.00 54.97 52.78 2ys0 s GLU 17 Cb 0.00 -2.22 0.31 0.00 -0.44 0.00 0.00 34.13 31.79 2ys0 s GLU 17 CO 0.00 -0.54 1.00 0.15 0.95 0.00 0.00 175.26 176.82 2ys0 s LYS 18 N -4.28 -1.67 0.42 -4.83 1.02 -1.26 -4.57 119.74 104.57 2ys0 s LYS 18 Ca 0.40 0.43 -0.23 0.00 0.02 0.00 0.00 55.97 56.60 2ys0 s LYS 18 Cb -0.03 -1.50 -0.09 0.00 -0.52 0.00 0.00 37.83 35.69 2ys0 s LYS 18 CO 0.25 -4.11 1.01 -0.98 -0.92 0.00 0.00 175.35 170.59 2ys0 s ARG 19 N -4.83 4.15 -0.25 1.68 1.70 -1.26 -4.68 118.95 115.45 2ys0 s ARG 19 Ca 0.69 1.35 -0.04 0.00 -0.47 0.00 0.00 55.73 57.25 2ys0 s ARG 19 Cb -0.18 -2.37 0.01 0.00 -0.57 0.00 0.00 34.95 31.83 2ys0 s ARG 19 CO 0.61 -0.13 -0.01 -0.51 -1.08 0.00 0.00 175.30 174.18 2ys0 s LEU 20 N -2.91 3.27 0.03 -1.89 2.01 -1.26 -5.01 118.68 112.92 2ys0 s LEU 20 Ca 0.60 -0.64 -0.29 0.00 0.01 0.00 0.00 54.13 53.81 2ys0 s LEU 20 Cb -0.17 -1.76 -0.17 0.00 0.01 0.00 0.00 46.19 44.11 2ys0 s LEU 20 CO 0.21 -0.11 1.32 0.74 1.01 0.00 0.00 176.35 179.53 2ys0 h THR 21 N 5.90 0.24 -3.46 5.49 2.02 -1.98 -3.42 112.91 117.69 2ys0 h THR 21 Ca -0.36 -0.25 -0.57 0.00 0.77 0.00 0.00 66.41 66.00 2ys0 h THR 21 Cb 1.13 0.31 -0.39 0.00 -1.74 0.00 0.00 68.15 67.46 2ys0 h THR 21 CO 0.59 0.03 -0.77 -0.60 0.37 0.00 0.00 175.52 175.13 2ys0 s ARG 22 N -5.17 1.17 -0.29 6.66 6.06 -1.26 -5.09 118.95 121.03 2ys0 s ARG 22 Ca -0.16 -0.78 -0.17 0.00 -2.50 0.00 0.00 55.73 52.12 2ys0 s ARG 22 Cb 0.02 -2.37 0.14 0.00 0.06 0.00 0.00 34.95 32.80 2ys0 s ARG 22 CO 0.52 -0.65 0.98 0.45 -2.50 0.00 0.00 175.30 174.11 2ys0 s SER 23 N 1.59 -0.50 0.23 -2.12 0.15 -1.26 -5.04 113.70 106.75 2ys0 s SER 23 Ca -0.03 0.82 -0.05 0.00 0.70 0.00 0.00 55.95 57.39 2ys0 s SER 23 Cb -0.18 1.16 0.43 0.00 -1.71 0.00 0.00 66.02 65.71 2ys0 s SER 23 CO -0.08 -0.13 1.25 0.18 1.20 0.00 0.00 173.24 175.66 2ys0 n LEU 24 N 3.52 -0.24 -4.37 3.45 4.77 -1.26 -4.59 117.00 118.28 2ys0 n LEU 24 Ca -0.18 1.37 -0.21 0.00 -0.03 0.00 0.00 56.01 56.97 2ys0 n LEU 24 Cb 0.57 -0.43 -0.09 0.00 -2.33 0.00 0.00 43.42 41.14 2ys0 n LEU 24 CO 0.02 -1.33 -0.18 0.00 -1.33 0.00 0.00 177.39 174.57 2ys0 s ALA 26 N -3.47 -1.40 -0.36 0.00 0.00 0.96 -4.87 121.76 112.62 2ys0 s ALA 26 Ca 0.34 1.83 -0.02 0.00 0.00 0.00 0.00 51.96 54.11 2ys0 s ALA 26 Cb 0.04 -1.29 0.18 0.00 0.00 0.00 0.00 23.12 22.05 2ys0 s ALA 26 CO 0.19 -0.55 2.22 0.00 0.00 0.00 0.00 175.76 177.62 2ys0 s SER 28 N 0.16 1.53 0.34 0.00 0.15 -1.26 -1.98 113.70 112.63 2ys0 s SER 28 Ca 0.39 -0.79 0.14 0.00 0.70 0.00 0.00 55.95 56.39 2ys0 s SER 28 Cb 0.29 -0.01 1.07 0.00 -1.71 0.00 0.00 66.02 65.66 2ys0 s SER 28 CO -0.06 -0.23 1.67 0.44 1.20 0.00 0.00 173.24 176.26 2ys0 h ASP 29 N 3.63 0.53 -1.08 5.45 3.32 -1.90 0.39 116.42 126.77 2ys0 h ASP 29 Ca -0.38 0.19 0.33 0.00 0.02 0.00 0.00 57.03 57.18 2ys0 h ASP 29 Cb 1.19 0.13 -0.13 0.00 0.22 0.00 0.00 39.33 40.74 2ys0 h ASP 29 CO 0.51 -0.11 0.66 -0.78 -1.72 0.00 0.00 179.24 177.80 2ys0 h ASP 30 N 0.35 0.45 -0.53 6.45 3.58 -1.94 0.48 116.42 125.27 2ys0 h ASP 30 Ca 0.73 0.15 -0.06 0.00 0.42 0.00 0.00 57.03 58.27 2ys0 h ASP 30 Cb 1.64 0.09 -0.02 0.00 1.72 0.00 0.00 39.33 42.76 2ys0 h ASP 30 CO -0.59 -0.07 0.11 0.00 -2.88 0.00 0.00 179.24 175.81 2ys0 h LYS 32 N 0.74 0.34 0.48 0.00 1.57 -0.10 1.50 116.57 121.10 2ys0 h LYS 32 Ca 0.16 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2ys0 h LYS 32 Cb 0.37 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2ys0 h LYS 32 CO 0.01 0.22 -0.23 0.22 -0.57 0.00 0.00 179.45 179.10 2ys0 h ASP 33 N 0.35 -0.55 0.95 0.86 3.58 -1.32 -3.36 116.42 116.92 2ys0 h ASP 33 Ca 0.21 -0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.61 2ys0 h ASP 33 Cb 0.20 0.14 0.01 0.00 1.72 0.00 0.00 39.33 41.40 2ys0 h ASP 33 CO -0.21 -0.13 -0.46 1.56 -2.88 0.00 0.00 179.24 177.13 2ys0 h GLN 34 N -1.15 -1.23 0.00 0.28 4.20 -0.97 -3.48 115.11 112.76 2ys0 h GLN 34 Ca -0.07 0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2ys0 h GLN 34 Cb 0.52 0.28 0.00 0.00 0.30 0.00 0.00 27.48 28.58 2ys0 h GLN 34 CO 0.11 -0.82 0.00 0.41 -0.67 0.00 0.00 178.83 177.86 2ys0 n GLY 35 N -1.51 0.98 2.60 3.46 0.00 0.51 -5.06 105.19 106.17 2ys0 n GLY 35 Ca -0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.71 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 2.59 -4.91 1.61 8.00 -1.04 -5.04 116.55 117.76 2ys0 n ASP 36 Ca 0.00 -3.05 -0.27 0.00 0.71 0.00 0.00 54.79 52.18 2ys0 n ASP 36 Cb 0.00 -0.50 0.02 0.00 -0.02 0.00 0.00 41.12 40.62 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 3.45 0.32 -1.22 0.00 2.10 -1.97 0.40 117.51 120.60 2ys0 h ILE 39 Ca -0.45 -0.03 -0.63 0.00 1.08 0.00 0.00 64.86 64.83 2ys0 h ILE 39 Cb 1.21 0.21 -0.37 0.00 -1.09 0.00 0.00 36.82 36.78 2ys0 h ILE 39 CO 0.70 0.02 -0.08 -0.46 -1.08 0.00 0.00 178.15 177.24 2ys0 n ASN 40 N -4.33 5.96 0.12 2.19 6.94 -1.26 -4.76 115.26 120.12 2ys0 n ASN 40 Ca 0.30 -3.77 -0.09 0.00 -0.02 0.00 0.00 54.58 51.01 2ys0 n ASN 40 Cb 1.32 -0.64 -0.05 0.00 -2.36 0.00 0.00 39.78 38.04 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 2.38 -0.36 -0.21 -2.53 5.03 -0.56 -3.00 116.97 117.72 2ys0 h TYR 41 Ca 0.44 -0.01 -0.15 0.00 2.58 0.00 0.00 58.73 61.60 2ys0 h TYR 41 Cb 0.95 0.12 0.00 0.00 1.55 0.00 0.00 36.73 39.35 2ys0 h TYR 41 CO 1.03 -0.09 -0.44 0.66 -1.32 0.00 0.00 178.16 178.00 2ys0 h SER 42 N -1.03 0.76 -1.00 -2.11 4.64 -1.86 0.22 113.55 113.17 2ys0 h SER 42 Ca -0.04 -0.55 0.20 0.00 -0.47 0.00 0.00 61.79 60.93 2ys0 h SER 42 Cb 0.43 -0.22 -0.11 0.00 -0.31 0.00 0.00 62.40 62.20 2ys0 h SER 42 CO 0.07 1.17 0.61 -1.28 -0.87 0.00 0.00 176.83 176.53 2ys0 h SER 43 N 0.38 0.73 0.00 4.97 0.87 -1.77 1.45 113.55 120.17 2ys0 h SER 43 Ca 0.00 0.10 -0.18 0.00 -1.23 0.00 0.00 61.79 60.48 2ys0 h SER 43 Cb 1.05 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.95 2ys0 h SER 43 CO 0.10 0.24 -1.09 0.58 -0.53 0.00 0.00 176.83 176.13 2ys0 h VAL 44 N 0.70 0.76 0.34 2.23 2.07 -1.49 -3.42 116.25 117.45 2ys0 h VAL 44 Ca 0.58 -1.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.13 2ys0 h VAL 44 Cb 1.00 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 2ys0 h VAL 44 CO -0.38 0.26 -0.16 0.00 0.02 0.00 0.00 177.57 177.31 2ys0 n GLN 46 N -4.37 2.30 -3.60 0.00 1.13 0.49 -4.83 117.38 108.50 2ys0 n GLN 46 Ca -0.06 -2.74 -0.10 0.00 -1.94 0.00 0.00 57.00 52.17 2ys0 n GLN 46 Cb 0.18 -3.54 0.01 0.00 0.11 0.00 0.00 30.24 27.00 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 5.41 1.39 2.89 1.08 0.00 -1.25 -4.41 105.19 110.29 2ys0 n GLY 47 Ca 0.47 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.27 1.16 -0.48 1.61 2.56 -1.26 -4.99 118.70 115.03 2ys0 s GLU 48 Ca 0.18 -1.45 -0.02 0.00 0.00 0.00 0.00 54.97 53.68 2ys0 s GLU 48 Cb -0.03 -2.62 0.27 0.00 2.00 0.00 0.00 34.13 33.74 2ys0 s GLU 48 CO 0.13 -0.93 2.14 0.36 -0.56 0.00 0.00 175.26 176.40 2ys0 n LYS 49 N 4.55 2.22 -3.45 4.30 2.85 -1.26 -4.78 118.16 122.58 2ys0 n LYS 49 Ca 0.00 -2.32 -0.20 0.00 -1.05 0.00 0.00 58.31 54.73 2ys0 n LYS 49 Cb 0.42 -1.94 0.08 0.00 -0.65 0.00 0.00 35.03 32.94 2ys0 n LYS 49 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2ys0 n SER 50 N -0.01 -4.91 -4.55 -5.58 7.64 -1.26 -4.90 113.62 100.05 2ys0 n SER 50 Ca 0.44 -0.51 -0.38 0.00 1.01 0.00 0.00 58.87 59.43 2ys0 n SER 50 Cb 0.58 -4.68 -0.03 0.00 -1.01 0.00 0.00 64.21 59.07 2ys0 n SER 50 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2ys0 s SER 51 N -3.56 5.84 0.00 6.43 0.15 -1.26 -4.84 113.70 116.45 2ys0 s SER 51 Ca 0.39 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.52 2ys0 s SER 51 Cb -0.17 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 2ys0 s SER 51 CO 0.67 -2.06 0.00 0.61 1.20 0.00 0.00 173.24 173.66 2ys0 n GLY 52 N 6.07 3.52 3.61 9.45 0.00 -1.26 -5.17 105.19 121.42 2ys0 n GLY 52 Ca 0.21 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.62 -0.77 -0.17 1.61 0.04 -1.26 -4.98 135.00 127.86 2ys0 s PRO 53 Ca 0.00 0.11 -0.28 0.00 0.04 0.00 0.00 61.00 60.86 2ys0 s PRO 53 Cb 0.00 -1.63 -0.00 0.00 0.04 0.00 0.00 34.50 32.90 2ys0 s PRO 53 CO 0.00 -3.44 0.97 -1.54 0.04 0.00 0.00 177.00 173.03 2ys0 s SER 54 N -3.75 7.12 0.07 6.66 1.04 -1.26 -4.95 113.70 118.63 2ys0 s SER 54 Ca 0.69 1.38 -0.25 0.00 0.48 0.00 0.00 55.95 58.25 2ys0 s SER 54 Cb -0.13 -2.52 -0.14 0.00 0.10 0.00 0.00 66.02 63.33 2ys0 s SER 54 CO 0.57 -0.51 0.58 -1.54 0.98 0.00 0.00 173.24 173.32 2ys0 n SER 55 N 5.53 -0.47 0.00 7.02 3.41 -1.26 -5.35 113.62 122.50 2ys0 n SER 55 Ca 0.09 0.84 0.00 0.00 -0.26 0.00 0.00 58.87 59.54 2ys0 n SER 55 Cb 0.48 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 2ys0 n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49