#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yug h VAL 2 N 0.00 0.39 -0.64 2.52 2.07 -2.06 -3.36 116.25 115.17 1yug h VAL 2 Ca 0.00 -0.78 -0.59 0.00 0.82 0.00 0.00 66.70 66.16 1yug h VAL 2 Cb 0.00 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.35 1yug h VAL 2 CO 0.00 0.09 1.98 -1.20 0.02 0.00 0.00 177.57 178.46 1yug n SER 3 N -5.07 4.24 -3.02 0.57 7.64 -1.26 -4.59 113.62 112.12 1yug n SER 3 Ca -0.08 -2.84 -0.15 0.00 1.01 0.00 0.00 58.87 56.81 1yug n SER 3 Cb 0.25 -1.71 0.01 0.00 -1.01 0.00 0.00 64.21 61.75 1yug n SER 3 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1yug n HIS 4 N 9.83 -0.98 -4.08 1.43 -0.00 -1.26 -5.11 115.22 115.05 1yug n HIS 4 Ca 0.48 -3.18 -0.10 0.00 -0.00 0.00 0.00 57.72 54.92 1yug n HIS 4 Cb 0.45 0.35 -0.08 0.00 -0.00 0.00 0.00 29.99 30.71 1yug n HIS 4 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 1yug s PHE 5 N -1.39 0.72 0.16 1.57 -0.12 -1.26 -2.66 117.98 115.00 1yug s PHE 5 Ca 0.33 -1.04 0.00 0.00 -0.05 0.00 0.00 56.93 56.18 1yug s PHE 5 Cb 0.32 -0.24 0.00 0.00 -0.63 0.00 0.00 43.02 42.47 1yug s PHE 5 CO -0.07 -0.71 0.00 0.09 -0.05 0.00 0.00 175.22 174.47 1yug n ASN 6 N -0.24 -0.58 -4.53 1.98 3.02 -1.26 -5.00 115.26 108.65 1yug n ASN 6 Ca -0.03 0.29 -0.25 0.00 -0.03 0.00 0.00 54.58 54.56 1yug n ASN 6 Cb 0.64 0.69 0.13 0.00 -0.61 0.00 0.00 39.78 40.63 1yug n ASN 6 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1yug s ASP 7 N -3.73 4.01 0.00 6.41 1.11 -1.26 -4.94 116.67 118.26 1yug s ASP 7 Ca 0.00 -0.18 0.00 0.00 0.18 0.00 0.00 52.55 52.55 1yug s ASP 7 Cb 0.00 -0.11 0.00 0.00 1.07 0.00 0.00 42.92 43.88 1yug s ASP 7 CO 0.00 -2.10 0.00 0.00 1.18 0.00 0.00 175.17 174.25 1yug s PRO 9 N 0.00 4.37 -0.77 0.00 0.04 -1.26 -4.92 135.00 132.45 1yug s PRO 9 Ca 0.00 2.10 -0.01 0.00 0.04 0.00 0.00 61.00 63.13 1yug s PRO 9 Cb 0.00 -3.18 0.37 0.00 0.04 0.00 0.00 34.50 31.73 1yug s PRO 9 CO 0.00 -0.28 1.88 -0.25 0.04 0.00 0.00 177.00 178.39 1yug n ASP 10 N 2.54 7.08 -0.59 6.66 9.92 -1.26 -4.71 116.55 136.19 1yug n ASP 10 Ca 0.06 -3.82 -0.08 0.00 -0.53 0.00 0.00 54.79 50.43 1yug n ASP 10 Cb 0.42 -0.96 -0.03 0.00 -0.64 0.00 0.00 41.12 39.91 1yug n ASP 10 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1yug n SER 11 N -0.55 -3.90 -2.79 -2.24 3.41 -1.26 -4.15 113.62 102.14 1yug n SER 11 Ca 0.52 0.18 -0.02 0.00 -0.26 0.00 0.00 58.87 59.29 1yug n SER 11 Cb 0.33 -2.09 0.00 0.00 -0.26 0.00 0.00 64.21 62.19 1yug n SER 11 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1yug n HIS 12 N -2.80 -3.66 0.00 7.33 -0.00 -1.26 -5.04 115.22 109.79 1yug n HIS 12 Ca -0.08 1.60 0.00 0.00 -0.00 0.00 0.00 57.72 59.24 1yug n HIS 12 Cb 0.26 -3.82 0.00 0.00 -0.00 0.00 0.00 29.99 26.42 1yug n HIS 12 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1yug n THR 13 N 0.55 0.00 -2.75 1.59 -2.24 -1.26 -4.95 114.28 105.22 1yug n THR 13 Ca 0.02 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.76 1yug n THR 13 Cb 0.13 -0.17 0.04 0.00 -2.10 0.00 0.00 70.33 68.23 1yug n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yug n GLN 14 N 0.00 1.47 0.05 -0.78 6.02 -1.26 -4.90 117.38 117.98 1yug n GLN 14 Ca 0.00 -3.39 0.00 0.00 -0.01 0.00 0.00 57.00 53.60 1yug n GLN 14 Cb 0.00 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 29.82 1yug n GLN 14 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1yug n PHE 15 N -0.35 -0.29 -3.67 1.08 -0.00 -1.26 -4.93 117.46 108.03 1yug n PHE 15 Ca 0.08 0.05 -0.10 0.00 -0.00 0.00 0.00 57.45 57.48 1yug n PHE 15 Cb 0.81 0.08 -0.11 0.00 -0.00 0.00 0.00 39.48 40.26 1yug n PHE 15 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1yug n PHE 17 N 4.95 0.00 -3.71 0.00 7.35 -0.84 -4.69 117.46 120.52 1yug n PHE 17 Ca -0.14 0.00 -0.28 0.00 -0.76 0.00 0.00 57.45 56.27 1yug n PHE 17 Cb 0.52 -0.86 -0.11 0.00 0.35 0.00 0.00 39.48 39.38 1yug n PHE 17 CO 0.00 0.00 0.00 -3.38 -0.76 0.00 0.00 176.76 172.62 1yug s HIS 18 N -2.44 2.66 -0.28 -5.13 -3.43 -0.82 -5.04 115.29 100.81 1yug s HIS 18 Ca -0.30 -2.97 -0.22 0.00 -0.80 0.00 0.00 55.06 50.77 1yug s HIS 18 Cb 0.08 -2.04 0.11 0.00 -1.43 0.00 0.00 32.58 29.30 1yug s HIS 18 CO 0.51 -0.65 0.90 0.20 -2.00 0.00 0.00 174.74 173.70 1yug s GLY 19 N -0.91 -0.27 -0.33 -1.38 0.00 -1.26 -3.44 107.32 99.73 1yug s GLY 19 Ca 0.28 2.61 -0.35 0.00 0.00 0.00 0.00 44.72 47.25 1yug s GLY 19 CO -0.18 2.06 2.16 2.41 0.00 0.00 0.00 173.10 179.55 1yug n THR 20 N 2.95 0.21 -2.96 0.90 -1.04 -0.13 -4.54 114.28 109.67 1yug n THR 20 Ca -0.15 -0.25 -0.41 0.00 -2.04 0.00 0.00 64.05 61.20 1yug n THR 20 Cb 0.57 -1.67 -0.04 0.00 -1.82 0.00 0.00 70.33 67.36 1yug n THR 20 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1yug s ARG 22 N 1.50 -0.02 -0.31 0.00 0.52 -0.05 -4.87 118.95 115.71 1yug s ARG 22 Ca 0.38 0.47 0.02 0.00 -0.52 0.00 0.00 55.73 56.08 1yug s ARG 22 Cb -0.17 -0.37 0.09 0.00 0.52 0.00 0.00 34.95 35.02 1yug s ARG 22 CO 0.16 -0.31 0.05 0.12 0.02 0.00 0.00 175.30 175.34 1yug s PHE 23 N 2.17 2.78 -0.55 -0.53 5.36 -1.21 -0.27 117.98 125.74 1yug s PHE 23 Ca 0.03 -2.35 -0.26 0.00 -0.96 0.00 0.00 56.93 53.39 1yug s PHE 23 Cb -0.12 -2.28 -0.05 0.00 -0.34 0.00 0.00 43.02 40.23 1yug s PHE 23 CO -0.04 -0.90 2.18 -0.51 -1.46 0.00 0.00 175.22 174.49 1yug s LEU 24 N 1.25 3.35 0.48 6.12 1.02 -0.73 -4.24 118.68 125.92 1yug s LEU 24 Ca 0.08 0.75 0.19 0.00 0.02 0.00 0.00 54.13 55.17 1yug s LEU 24 Cb -0.18 -2.51 1.20 0.00 0.02 0.00 0.00 46.19 44.71 1yug s LEU 24 CO -0.15 -2.70 2.05 0.58 0.02 0.00 0.00 176.35 176.16 1yug h VAL 25 N 7.36 0.95 0.00 -1.59 2.07 -1.83 1.33 116.25 124.54 1yug h VAL 25 Ca -0.24 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1yug h VAL 25 Cb 1.22 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1yug h VAL 25 CO 1.18 0.13 -0.16 0.06 0.02 0.00 0.00 177.57 178.80 1yug h GLN 26 N 0.00 0.00 0.00 1.57 3.07 -1.86 -2.80 115.11 115.08 1yug h GLN 26 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1yug h GLN 26 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.82 1yug h GLN 26 CO 0.02 0.16 0.00 0.39 0.09 0.00 0.00 178.83 179.49 1yug n GLU 27 N -4.24 1.67 -4.20 0.06 -0.58 -0.72 -5.00 120.64 107.64 1yug n GLU 27 Ca -0.02 -1.06 -0.31 0.00 -0.42 0.00 0.00 57.16 55.35 1yug n GLU 27 Cb 0.23 -0.79 -0.07 0.00 -0.57 0.00 0.00 31.44 30.25 1yug n GLU 27 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1yug n ASP 28 N -0.28 0.16 -4.25 1.62 9.92 0.44 -4.90 116.55 119.26 1yug n ASP 28 Ca 0.00 -1.21 -0.37 0.00 -0.53 0.00 0.00 54.79 52.67 1yug n ASP 28 Cb 0.35 -1.97 -0.12 0.00 -0.64 0.00 0.00 41.12 38.74 1yug n ASP 28 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1yug s LYS 29 N -7.17 2.55 0.54 -1.24 -0.14 -0.44 -4.93 119.74 108.90 1yug s LYS 29 Ca 0.05 -1.26 -0.20 0.00 -1.36 0.00 0.00 55.97 53.19 1yug s LYS 29 Cb -0.02 -3.46 -0.06 0.00 -1.68 0.00 0.00 37.83 32.61 1yug s LYS 29 CO 0.97 -0.72 1.15 -1.25 -0.76 0.00 0.00 175.35 174.75 1yug s PRO 30 N 1.37 3.35 -0.30 -1.68 0.04 -1.26 -1.78 135.00 134.73 1yug s PRO 30 Ca -0.01 1.68 -0.10 0.00 0.04 0.00 0.00 61.00 62.61 1yug s PRO 30 Cb -0.20 -2.06 0.15 0.00 0.04 0.00 0.00 34.50 32.44 1yug s PRO 30 CO 0.02 -0.87 0.77 0.00 0.04 0.00 0.00 177.00 176.96 1yug s ALA 31 N -1.70 -2.38 0.10 8.56 0.00 0.63 -4.94 121.76 122.03 1yug s ALA 31 Ca 0.72 2.11 0.06 0.00 0.00 0.00 0.00 51.96 54.85 1yug s ALA 31 Cb -0.26 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1yug s ALA 31 CO 0.29 -1.05 -0.05 0.00 0.00 0.00 0.00 175.76 174.95 1yug s VAL 33 N -1.26 1.90 0.38 0.00 1.01 -0.29 -4.93 120.40 117.21 1yug s VAL 33 Ca 0.23 -3.03 -0.26 0.00 0.00 0.00 0.00 61.98 58.93 1yug s VAL 33 Cb -0.11 -2.31 -0.09 0.00 0.00 0.00 0.00 36.38 33.87 1yug s VAL 33 CO 0.16 -0.90 1.15 0.00 0.00 0.00 0.00 175.10 175.51 1yug s HIS 35 N -1.39 3.62 0.87 0.00 3.76 -1.22 -4.93 115.29 116.00 1yug s HIS 35 Ca 0.55 0.96 -0.13 0.00 -0.15 0.00 0.00 55.06 56.29 1yug s HIS 35 Cb -0.30 -2.46 0.08 0.00 1.11 0.00 0.00 32.58 31.01 1yug s HIS 35 CO 0.38 0.37 0.91 -1.13 -0.85 0.00 0.00 174.74 174.43 1yug n SER 36 N 2.84 -0.22 0.00 1.40 3.41 -1.26 -4.38 113.62 115.41 1yug n SER 36 Ca -0.10 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 1yug n SER 36 Cb 0.52 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.08 1yug n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yug n GLY 37 N 0.84 1.59 0.00 5.00 0.00 -1.26 -5.11 105.19 106.25 1yug n GLY 37 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1yug n GLY 37 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1yug n TYR 38 N -0.47 -0.84 -0.20 1.61 4.11 -1.26 -4.35 117.16 115.76 1yug n TYR 38 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1yug n TYR 38 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.34 1yug n TYR 38 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 1yug n VAL 39 N 0.00 0.00 -3.43 -3.48 0.31 -1.02 -4.67 118.33 106.04 1yug n VAL 39 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 1yug n VAL 39 Cb 0.00 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.86 1yug n VAL 39 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1yug s GLY 40 N 0.00 -0.51 0.00 2.92 0.00 -1.26 -4.90 107.32 103.57 1yug s GLY 40 Ca 0.00 1.31 0.00 0.00 0.00 0.00 0.00 44.72 46.03 1yug s GLY 40 CO 0.00 2.72 0.00 0.00 0.00 0.00 0.00 173.10 175.82 1yug n ALA 41 N 5.39 0.00 -1.30 3.20 0.00 -1.26 -4.93 120.51 121.61 1yug n ALA 41 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.44 1yug n ALA 41 Cb 0.50 0.00 0.08 0.00 0.00 0.00 0.00 19.45 20.03 1yug n ALA 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1yug n ARG 42 N -0.47 0.93 -3.51 0.00 3.00 -1.26 -4.98 116.66 110.37 1yug n ARG 42 Ca 0.00 -1.89 -0.19 0.00 -0.01 0.00 0.00 57.85 55.76 1yug n ARG 42 Cb 0.00 -1.09 0.08 0.00 0.00 0.00 0.00 32.46 31.45 1yug n ARG 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1yug n GLU 44 N -4.33 4.47 -4.17 0.00 2.13 -1.26 -1.94 120.64 115.55 1yug n GLU 44 Ca -0.23 -0.03 -0.17 0.00 0.66 0.00 0.00 57.16 57.39 1yug n GLU 44 Cb 0.65 -0.85 -0.12 0.00 0.27 0.00 0.00 31.44 31.39 1yug n GLU 44 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1yug s HIS 45 N -1.64 1.18 -0.13 4.31 2.46 -1.26 -5.00 115.29 115.21 1yug s HIS 45 Ca 0.03 -0.50 -0.05 0.00 0.47 0.00 0.00 55.06 55.00 1yug s HIS 45 Cb 0.05 -0.66 0.06 0.00 -0.13 0.00 0.00 32.58 31.91 1yug s HIS 45 CO 0.29 0.05 0.27 0.00 -2.47 0.00 0.00 174.74 172.88 1yug s ALA 46 N -1.58 -0.61 0.45 1.58 0.00 -1.26 -2.44 121.76 117.91 1yug s ALA 46 Ca 0.00 1.01 -0.24 0.00 0.00 0.00 0.00 51.96 52.73 1yug s ALA 46 Cb -0.08 -0.92 -0.09 0.00 0.00 0.00 0.00 23.12 22.03 1yug s ALA 46 CO 0.02 -0.50 1.25 -3.47 0.00 0.00 0.00 175.76 173.06 1yug n ASP 47 N 4.98 2.40 -0.81 0.00 2.03 -1.26 -4.87 116.55 119.02 1yug n ASP 47 Ca -0.13 1.06 0.02 0.00 0.52 0.00 0.00 54.79 56.26 1yug n ASP 47 Cb 0.51 -1.50 0.01 0.00 -0.72 0.00 0.00 41.12 39.42 1yug n ASP 47 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1yug n LEU 48 N -0.03 0.40 -2.84 -2.67 0.00 -1.26 -4.78 117.00 105.81 1yug n LEU 48 Ca 0.08 -1.39 -0.11 0.00 0.00 0.00 0.00 56.01 54.58 1yug n LEU 48 Cb 0.41 -0.01 0.02 0.00 0.00 0.00 0.00 43.42 43.84 1yug n LEU 48 CO 0.57 0.35 0.10 -0.11 0.00 0.00 0.00 177.39 178.30 1yug n LEU 49 N 0.12 -2.34 0.00 -1.96 -0.00 -1.26 -5.29 117.00 106.26 1yug n LEU 49 Ca 0.02 -3.56 0.10 0.00 -0.00 0.00 0.00 56.01 52.58 1yug n LEU 49 Cb 0.84 0.80 0.59 0.00 -0.00 0.00 0.00 43.42 45.65 1yug n LEU 49 CO -0.01 2.01 0.79 0.00 -0.00 0.00 0.00 177.39 180.17