#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yug n VAL 2 N 0.00 0.00 -0.94 3.34 0.24 -1.26 -5.17 118.33 114.54 1yug n VAL 2 Ca 0.00 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.41 1yug n VAL 2 Cb 0.00 -0.41 -0.06 0.00 -1.47 0.00 0.00 33.84 31.89 1yug n VAL 2 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1yug n SER 3 N -3.01 -5.19 -3.92 -1.34 3.41 -1.26 -4.85 113.62 97.46 1yug n SER 3 Ca 0.00 0.93 -0.27 0.00 -0.26 0.00 0.00 58.87 59.27 1yug n SER 3 Cb 0.00 -3.24 0.00 0.00 -0.26 0.00 0.00 64.21 60.72 1yug n SER 3 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1yug n HIS 4 N -3.55 -1.88 -2.66 7.33 -0.00 -1.26 -4.87 115.22 108.33 1yug n HIS 4 Ca -0.06 0.82 -0.04 0.00 -0.00 0.00 0.00 57.72 58.44 1yug n HIS 4 Cb 0.45 -3.84 0.07 0.00 -0.00 0.00 0.00 29.99 26.67 1yug n HIS 4 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1yug n PHE 5 N -4.43 -0.20 0.19 4.41 7.35 -1.26 -1.26 117.46 122.25 1yug n PHE 5 Ca -0.17 -0.57 0.00 0.00 -0.76 0.00 0.00 57.45 55.96 1yug n PHE 5 Cb 0.62 1.03 0.00 0.00 0.35 0.00 0.00 39.48 41.48 1yug n PHE 5 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1yug n ASN 6 N 1.77 -2.64 -4.76 -2.13 4.13 -1.25 -4.87 115.26 105.51 1yug n ASN 6 Ca 0.03 0.70 -0.39 0.00 1.68 0.00 0.00 54.58 56.60 1yug n ASN 6 Cb 0.70 2.56 0.02 0.00 -1.54 0.00 0.00 39.78 41.52 1yug n ASN 6 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 1yug s ASP 7 N -2.85 5.74 -0.09 6.41 1.11 -1.26 -4.44 116.67 121.29 1yug s ASP 7 Ca 0.00 2.74 -0.04 0.00 0.18 0.00 0.00 52.55 55.43 1yug s ASP 7 Cb 0.00 -2.64 0.05 0.00 1.07 0.00 0.00 42.92 41.40 1yug s ASP 7 CO 0.00 -1.25 0.19 0.00 1.18 0.00 0.00 175.17 175.29 1yug s PRO 9 N 1.68 -0.93 -0.13 0.00 0.04 -1.26 -4.98 135.00 129.41 1yug s PRO 9 Ca -0.04 0.13 -0.09 0.00 0.04 0.00 0.00 61.00 61.04 1yug s PRO 9 Cb -0.11 -1.61 -0.06 0.00 0.04 0.00 0.00 34.50 32.75 1yug s PRO 9 CO -0.07 -3.56 0.05 -0.44 0.04 0.00 0.00 177.00 173.02 1yug h ASP 10 N -2.48 0.00 -2.23 6.66 5.19 -1.98 -3.37 116.42 118.22 1yug h ASP 10 Ca -0.48 -0.17 -0.57 0.00 -0.62 0.00 0.00 57.03 55.18 1yug h ASP 10 Cb 1.31 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.82 1yug h ASP 10 CO 0.41 0.76 1.38 -0.55 -3.12 0.00 0.00 179.24 178.12 1yug s SER 11 N -5.84 5.78 0.36 6.45 0.15 -1.26 -3.68 113.70 115.66 1yug s SER 11 Ca -0.11 1.93 0.00 0.00 0.70 0.00 0.00 55.95 58.47 1yug s SER 11 Cb 0.01 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 1yug s SER 11 CO 0.23 -1.70 0.00 0.00 1.20 0.00 0.00 173.24 172.97 1yug n HIS 12 N 10.45 -2.57 0.00 3.44 1.44 -1.26 -4.76 115.22 121.96 1yug n HIS 12 Ca 0.26 1.39 0.00 0.00 -2.01 0.00 0.00 57.72 57.36 1yug n HIS 12 Cb 0.45 -2.35 0.00 0.00 0.12 0.00 0.00 29.99 28.20 1yug n HIS 12 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 1yug n THR 13 N -2.27 0.00 -0.39 0.61 5.66 -1.26 -4.66 114.28 111.97 1yug n THR 13 Ca -0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 1yug n THR 13 Cb 0.30 0.00 0.07 0.00 -1.55 0.00 0.00 70.33 69.15 1yug n THR 13 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1yug n GLN 14 N 0.00 1.69 -1.64 1.09 7.27 -1.24 -4.39 117.38 120.16 1yug n GLN 14 Ca 0.00 -1.51 -0.42 0.00 0.07 0.00 0.00 57.00 55.14 1yug n GLN 14 Cb 0.00 -1.59 -0.01 0.00 2.41 0.00 0.00 30.24 31.05 1yug n GLN 14 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1yug n PHE 15 N -0.07 3.30 -3.64 3.69 3.72 -1.26 -4.77 117.46 118.43 1yug n PHE 15 Ca 0.30 -2.88 -0.05 0.00 -0.05 0.00 0.00 57.45 54.77 1yug n PHE 15 Cb 0.89 -2.48 -0.06 0.00 -0.94 0.00 0.00 39.48 36.89 1yug n PHE 15 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yug h PHE 17 N 7.21 0.00 -1.09 0.00 0.04 -1.81 -3.40 116.94 117.89 1yug h PHE 17 Ca -0.26 0.00 -0.38 0.00 2.80 0.00 0.00 57.97 60.12 1yug h PHE 17 Cb 1.19 0.00 -0.26 0.00 2.20 0.00 0.00 35.95 39.08 1yug h PHE 17 CO 0.09 0.86 -0.78 1.58 -0.60 0.00 0.00 178.31 179.45 1yug n HIS 18 N -3.26 -1.99 -3.82 -0.55 -0.00 -1.23 -5.05 115.22 99.32 1yug n HIS 18 Ca -0.02 -2.58 -0.06 0.00 0.46 0.00 0.00 57.72 55.52 1yug n HIS 18 Cb 0.90 0.67 -0.01 0.00 -0.12 0.00 0.00 29.99 31.43 1yug n HIS 18 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1yug s GLY 19 N -1.13 -0.08 0.68 1.57 0.00 -1.26 -3.55 107.32 103.54 1yug s GLY 19 Ca 0.33 -0.20 -0.12 0.00 0.00 0.00 0.00 44.72 44.73 1yug s GLY 19 CO -0.17 0.06 1.06 -1.59 0.00 0.00 0.00 173.10 172.46 1yug s THR 20 N -3.42 4.00 -0.05 0.90 2.01 0.22 -4.89 115.64 114.41 1yug s THR 20 Ca 0.13 0.70 0.05 0.00 0.31 0.00 0.00 61.69 62.88 1yug s THR 20 Cb -0.04 -3.40 -0.01 0.00 0.01 0.00 0.00 72.50 69.06 1yug s THR 20 CO 0.06 -0.80 -0.21 0.00 -0.69 0.00 0.00 174.62 172.98 1yug s ARG 22 N -0.07 1.14 -0.21 0.00 3.52 0.07 -4.81 118.95 118.60 1yug s ARG 22 Ca -0.04 -0.71 -0.06 0.00 -0.13 0.00 0.00 55.73 54.79 1yug s ARG 22 Cb -0.13 0.49 0.10 0.00 -1.56 0.00 0.00 34.95 33.85 1yug s ARG 22 CO 0.03 -0.46 0.42 0.12 -0.81 0.00 0.00 175.30 174.60 1yug s PHE 23 N -3.81 -0.82 -0.16 5.12 2.19 -1.24 -1.03 117.98 118.23 1yug s PHE 23 Ca 0.04 1.44 -0.29 0.00 0.33 0.00 0.00 56.93 58.45 1yug s PHE 23 Cb 0.01 0.28 -0.03 0.00 -1.31 0.00 0.00 43.02 41.97 1yug s PHE 23 CO -0.11 -0.52 1.48 -1.17 1.83 0.00 0.00 175.22 176.73 1yug s LEU 24 N 2.61 4.12 0.15 6.12 0.20 -0.10 -3.93 118.68 127.84 1yug s LEU 24 Ca 0.01 1.79 0.16 0.00 0.69 0.00 0.00 54.13 56.77 1yug s LEU 24 Cb -0.13 -3.54 -0.06 0.00 -0.43 0.00 0.00 46.19 42.04 1yug s LEU 24 CO -0.13 -0.98 1.09 0.58 -0.29 0.00 0.00 176.35 176.61 1yug h VAL 25 N 5.74 0.71 -0.17 1.68 2.07 -1.47 0.11 116.25 124.91 1yug h VAL 25 Ca -0.32 -2.16 -0.11 0.00 0.82 0.00 0.00 66.70 64.93 1yug h VAL 25 Cb 1.14 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 33.12 1yug h VAL 25 CO 0.98 0.40 -0.37 1.56 0.02 0.00 0.00 177.57 180.16 1yug h GLN 26 N 0.00 0.38 -0.14 1.57 4.20 -1.86 -3.04 115.11 116.22 1yug h GLN 26 Ca -0.09 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1yug h GLN 26 Cb 1.52 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.29 1yug h GLN 26 CO 0.06 0.70 0.00 0.39 -0.67 0.00 0.00 178.83 179.31 1yug n GLU 27 N -4.05 2.79 -3.75 1.46 4.71 -1.24 -5.01 120.64 115.55 1yug n GLU 27 Ca -0.01 -1.69 -0.28 0.00 -0.01 0.00 0.00 57.16 55.17 1yug n GLU 27 Cb 0.47 -1.11 0.01 0.00 -1.01 0.00 0.00 31.44 29.79 1yug n GLU 27 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1yug n ASP 28 N -0.05 -3.73 -3.84 1.62 5.75 0.24 -4.95 116.55 111.59 1yug n ASP 28 Ca 0.05 -0.92 -0.12 0.00 -0.01 0.00 0.00 54.79 53.79 1yug n ASP 28 Cb 0.32 -1.31 -0.11 0.00 -1.03 0.00 0.00 41.12 38.99 1yug n ASP 28 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1yug s LYS 29 N -5.46 0.34 0.81 0.11 0.00 -0.30 -5.01 119.74 110.23 1yug s LYS 29 Ca 0.16 -0.09 -0.11 0.00 0.00 0.00 0.00 55.97 55.93 1yug s LYS 29 Cb -0.09 0.15 0.08 0.00 0.00 0.00 0.00 37.83 37.97 1yug s LYS 29 CO 0.77 -0.07 1.10 -1.25 0.00 0.00 0.00 175.35 175.90 1yug s PRO 30 N -0.65 1.93 -0.29 1.78 0.04 -1.26 -0.92 135.00 135.63 1yug s PRO 30 Ca -0.07 1.15 0.04 0.00 0.04 0.00 0.00 61.00 62.16 1yug s PRO 30 Cb -0.04 -1.86 0.20 0.00 0.04 0.00 0.00 34.50 32.83 1yug s PRO 30 CO 0.01 -1.87 0.64 0.00 0.04 0.00 0.00 177.00 175.82 1yug s ALA 31 N -2.88 -2.58 0.06 8.56 0.00 -0.20 -4.70 121.76 120.03 1yug s ALA 31 Ca 0.62 1.08 0.03 0.00 0.00 0.00 0.00 51.96 53.69 1yug s ALA 31 Cb -0.18 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 1yug s ALA 31 CO 0.56 -1.87 0.06 0.00 0.00 0.00 0.00 175.76 174.52 1yug s VAL 33 N -1.32 1.47 0.55 0.00 1.01 -0.82 -4.98 120.40 116.32 1yug s VAL 33 Ca 0.27 -1.70 -0.08 0.00 0.00 0.00 0.00 61.98 60.47 1yug s VAL 33 Cb -0.12 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 1yug s VAL 33 CO 0.19 -0.33 0.90 0.00 0.00 0.00 0.00 175.10 175.86 1yug n HIS 35 N -2.50 0.61 -0.81 0.00 8.25 -1.23 -4.46 115.22 115.08 1yug n HIS 35 Ca 0.03 -0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 1yug n HIS 35 Cb 0.55 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.66 1yug n HIS 35 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1yug n SER 36 N 0.99 -4.52 -0.02 0.41 2.88 -1.26 -4.84 113.62 107.25 1yug n SER 36 Ca 0.17 0.85 -0.00 0.00 -1.33 0.00 0.00 58.87 58.56 1yug n SER 36 Cb 0.44 -2.06 -0.00 0.00 -0.75 0.00 0.00 64.21 61.84 1yug n SER 36 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1yug n GLY 37 N -1.67 0.45 3.16 0.46 0.00 -1.26 -5.01 105.19 101.32 1yug n GLY 37 Ca 0.00 -0.10 -0.16 0.00 0.00 0.00 0.00 46.02 45.76 1yug n GLY 37 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yug s TYR 38 N -1.89 1.06 0.00 1.61 1.51 -1.26 -0.16 117.35 118.22 1yug s TYR 38 Ca 0.00 -0.56 0.00 0.00 -1.01 0.00 0.00 57.07 55.50 1yug s TYR 38 Cb 0.00 -0.59 0.00 0.00 -0.11 0.00 0.00 41.96 41.26 1yug s TYR 38 CO 0.00 0.01 0.00 0.28 -1.11 0.00 0.00 175.55 174.73 1yug n VAL 39 N 0.94 0.00 0.00 0.71 0.31 -0.38 -4.82 118.33 115.09 1yug n VAL 39 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1yug n VAL 39 Cb 0.56 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.49 1yug n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yug n GLY 40 N 0.00 1.77 3.08 2.92 0.00 -1.26 -1.19 105.19 110.51 1yug n GLY 40 Ca 0.00 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 1yug n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yug s ALA 41 N -0.80 2.81 -0.40 4.61 0.00 -1.26 -4.60 121.76 122.12 1yug s ALA 41 Ca 0.00 -2.12 -0.00 0.00 0.00 0.00 0.00 51.96 49.84 1yug s ALA 41 Cb 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 23.12 21.22 1yug s ALA 41 CO 0.00 -1.45 0.04 -2.13 0.00 0.00 0.00 175.76 172.22 1yug n ARG 42 N 4.44 -0.61 -2.98 0.00 0.63 -1.24 -3.41 116.66 113.49 1yug n ARG 42 Ca -0.07 0.23 -0.12 0.00 -0.92 0.00 0.00 57.85 56.97 1yug n ARG 42 Cb 0.42 -3.90 0.05 0.00 0.45 0.00 0.00 32.46 29.48 1yug n ARG 42 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yug n GLU 44 N -3.03 0.65 -3.86 0.00 -0.58 -1.21 -3.55 120.64 109.06 1yug n GLU 44 Ca -0.10 0.24 -0.24 0.00 -0.42 0.00 0.00 57.16 56.64 1yug n GLU 44 Cb 0.58 -1.74 -0.02 0.00 -0.57 0.00 0.00 31.44 29.68 1yug n GLU 44 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1yug s HIS 45 N -2.58 3.47 -0.33 -0.32 2.46 -1.26 -4.92 115.29 111.81 1yug s HIS 45 Ca -0.07 0.13 -0.00 0.00 0.47 0.00 0.00 55.06 55.58 1yug s HIS 45 Cb 0.08 -1.68 0.08 0.00 -0.13 0.00 0.00 32.58 30.92 1yug s HIS 45 CO 0.82 0.43 0.05 0.00 -2.47 0.00 0.00 174.74 173.57 1yug s ALA 46 N -1.90 2.90 0.48 1.58 0.00 -1.26 -1.25 121.76 122.30 1yug s ALA 46 Ca 0.36 -2.14 -0.23 0.00 0.00 0.00 0.00 51.96 49.95 1yug s ALA 46 Cb -0.10 -2.04 -0.07 0.00 0.00 0.00 0.00 23.12 20.92 1yug s ALA 46 CO 0.29 -1.50 1.22 0.34 0.00 0.00 0.00 175.76 176.12 1yug s ASP 47 N 1.33 5.95 0.28 0.00 2.15 0.77 -4.72 116.67 122.43 1yug s ASP 47 Ca 0.01 2.45 0.00 0.00 0.43 0.00 0.00 52.55 55.44 1yug s ASP 47 Cb -0.20 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.80 1yug s ASP 47 CO -0.04 -1.08 0.00 -0.11 -0.17 0.00 0.00 175.17 173.77 1yug n LEU 48 N -0.58 -1.64 0.00 -1.34 7.94 -1.26 -4.74 117.00 115.37 1yug n LEU 48 Ca 0.08 1.62 0.00 0.00 -1.11 0.00 0.00 56.01 56.60 1yug n LEU 48 Cb 0.47 -1.12 0.00 0.00 0.53 0.00 0.00 43.42 43.30 1yug n LEU 48 CO 0.49 0.22 0.00 0.00 -1.11 0.00 0.00 177.39 176.99 1yug n LEU 49 N -0.97 0.00 0.00 -1.96 -0.00 -1.26 -5.11 117.00 107.70 1yug n LEU 49 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1yug n LEU 49 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.43 1yug n LEU 49 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.39 177.39