#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 -2.81 -3.31 3.34 0.31 -1.26 -4.87 118.33 109.73 1yug n VAL 2 Ca 0.00 1.32 -0.38 0.00 -0.01 0.00 0.00 64.34 65.27 1yug n VAL 2 Cb 0.00 -2.04 -0.06 0.00 -0.91 0.00 0.00 33.84 30.84 1yug n VAL 2 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1yug s SER 3 N -4.30 6.73 0.00 4.52 0.01 -1.26 -4.74 113.70 114.66 1yug s SER 3 Ca 0.00 0.87 0.00 0.00 1.31 0.00 0.00 55.95 58.13 1yug s SER 3 Cb 0.00 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.94 1yug s SER 3 CO 0.00 0.04 0.00 0.00 0.41 0.00 0.00 173.24 173.69 1yug n HIS 4 N 3.40 -0.81 0.00 2.43 -0.00 -1.26 -4.73 115.22 114.25 1yug n HIS 4 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.64 1yug n HIS 4 Cb 0.52 0.16 0.00 0.00 -0.00 0.00 0.00 29.99 30.67 1yug n HIS 4 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1yug n PHE 5 N -1.77 0.00 -3.42 -1.40 3.72 -1.26 -4.32 117.46 109.00 1yug n PHE 5 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1yug n PHE 5 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1yug n PHE 5 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1yug n ASN 6 N 0.00 0.00 -4.25 4.37 0.23 -1.09 -4.87 115.26 109.65 1yug n ASN 6 Ca 0.00 -0.96 -0.28 0.00 -0.53 0.00 0.00 54.58 52.80 1yug n ASN 6 Cb 0.00 0.00 0.27 0.00 -2.08 0.00 0.00 39.78 37.97 1yug n ASN 6 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1yug n ASP 7 N -0.52 -2.33 -3.81 0.53 9.92 -1.26 -0.98 116.55 118.10 1yug n ASP 7 Ca 0.00 -0.34 -0.14 0.00 -0.53 0.00 0.00 54.79 53.78 1yug n ASP 7 Cb 0.00 -1.20 -0.15 0.00 -0.64 0.00 0.00 41.12 39.12 1yug n ASP 7 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1yug s PRO 9 N 0.72 4.34 0.07 0.00 0.04 -1.26 -4.89 135.00 134.02 1yug s PRO 9 Ca -0.06 2.09 -0.25 0.00 0.04 0.00 0.00 61.00 62.82 1yug s PRO 9 Cb -0.09 -3.21 -0.16 0.00 0.04 0.00 0.00 34.50 31.07 1yug s PRO 9 CO -0.02 -0.37 1.66 0.38 0.04 0.00 0.00 177.00 178.69 1yug h ASP 10 N 6.14 -0.19 -6.06 6.66 2.03 -2.00 -3.45 116.42 119.56 1yug h ASP 10 Ca -0.43 -0.03 -0.31 0.00 -0.73 0.00 0.00 57.03 55.52 1yug h ASP 10 Cb 1.21 0.05 -0.19 0.00 -0.83 0.00 0.00 39.33 39.57 1yug h ASP 10 CO 0.83 -0.09 -0.45 -1.54 -1.03 0.00 0.00 179.24 176.96 1yug n SER 11 N -5.16 -1.48 0.00 4.15 3.41 -1.26 -4.08 113.62 109.19 1yug n SER 11 Ca -0.09 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.16 1yug n SER 11 Cb 0.13 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 62.73 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 -3.29 0.00 -1.63 7.33 8.25 -1.26 -4.68 115.22 119.95 1yug n HIS 12 Ca 0.06 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.46 1yug n HIS 12 Cb 0.48 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.57 1yug n HIS 12 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1yug n THR 13 N 0.00 -0.10 -3.89 1.59 5.66 -1.26 -0.91 114.28 115.37 1yug n THR 13 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 1yug n THR 13 Cb 0.00 -0.68 0.01 0.00 -1.55 0.00 0.00 70.33 68.11 1yug n THR 13 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yug n GLN 14 N -1.84 -1.76 0.00 1.09 6.02 -1.26 -4.97 117.38 114.66 1yug n GLN 14 Ca -0.06 0.34 0.00 0.00 -0.01 0.00 0.00 57.00 57.27 1yug n GLN 14 Cb 0.32 -3.94 0.00 0.00 1.02 0.00 0.00 30.24 27.64 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 -4.45 0.00 -1.81 1.08 7.35 -0.09 -4.92 117.46 114.62 1yug n PHE 15 Ca -0.19 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.10 1yug n PHE 15 Cb 0.63 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.43 1yug n PHE 15 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1yug h PHE 17 N 15.80 0.45 -1.74 0.00 0.04 -1.51 -3.40 116.94 126.59 1yug h PHE 17 Ca -0.30 -0.19 -0.38 0.00 2.80 0.00 0.00 57.97 59.90 1yug h PHE 17 Cb 1.21 -0.08 -0.28 0.00 2.20 0.00 0.00 35.95 39.00 1yug h PHE 17 CO 0.98 0.91 -0.74 -1.58 -0.60 0.00 0.00 178.31 177.27 1yug s HIS 18 N -3.70 -0.19 0.00 -0.55 2.46 -1.24 -5.09 115.29 106.98 1yug s HIS 18 Ca -0.05 -1.44 0.00 0.00 0.47 0.00 0.00 55.06 54.04 1yug s HIS 18 Cb 0.11 -0.34 0.00 0.00 -0.13 0.00 0.00 32.58 32.22 1yug s HIS 18 CO 0.82 -1.03 0.00 0.41 -2.47 0.00 0.00 174.74 172.47 1yug n GLY 19 N 3.02 1.36 3.97 1.59 0.00 -1.26 -4.44 105.19 109.43 1yug n GLY 19 Ca 0.23 -0.38 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 1yug n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yug s THR 20 N -1.31 4.89 -0.02 2.61 -4.23 0.37 -4.98 115.64 112.96 1yug s THR 20 Ca 0.00 -0.89 -0.10 0.00 -1.18 0.00 0.00 61.69 59.52 1yug s THR 20 Cb 0.00 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 70.12 1yug s THR 20 CO 0.00 -0.32 0.22 0.00 -0.54 0.00 0.00 174.62 173.98 1yug s ARG 22 N -1.05 0.71 -0.28 0.00 1.70 -0.79 -4.51 118.95 114.74 1yug s ARG 22 Ca -0.11 0.54 -0.00 0.00 -0.47 0.00 0.00 55.73 55.68 1yug s ARG 22 Cb -0.06 0.34 0.05 0.00 -0.57 0.00 0.00 34.95 34.71 1yug s ARG 22 CO 0.02 -0.15 -0.05 0.12 -1.08 0.00 0.00 175.30 174.17 1yug s PHE 23 N -0.29 3.22 0.05 5.89 5.36 -0.16 -1.05 117.98 131.00 1yug s PHE 23 Ca -0.01 -1.93 -0.30 0.00 -0.96 0.00 0.00 56.93 53.72 1yug s PHE 23 Cb -0.03 -2.05 -0.08 0.00 -0.34 0.00 0.00 43.02 40.53 1yug s PHE 23 CO 0.00 -0.81 1.65 -1.17 -1.46 0.00 0.00 175.22 173.43 1yug s LEU 24 N 1.23 4.36 0.14 6.12 2.96 -0.19 -2.68 118.68 130.62 1yug s LEU 24 Ca -0.05 2.44 0.17 0.00 -0.22 0.00 0.00 54.13 56.47 1yug s LEU 24 Cb -0.19 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 42.89 1yug s LEU 24 CO -0.03 -0.89 1.03 0.58 -1.32 0.00 0.00 176.35 175.72 1yug h VAL 25 N 4.94 0.49 -0.83 1.68 2.07 -1.86 -0.23 116.25 122.52 1yug h VAL 25 Ca -0.42 -1.86 0.01 0.00 0.82 0.00 0.00 66.70 65.24 1yug h VAL 25 Cb 1.20 2.04 -0.04 0.00 -1.52 0.00 0.00 31.29 32.97 1yug h VAL 25 CO 0.93 0.28 0.55 1.56 0.02 0.00 0.00 177.57 180.91 1yug h GLN 26 N 0.00 1.10 0.00 1.57 4.20 -1.85 -2.90 115.11 117.23 1yug h GLN 26 Ca -0.10 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.55 1yug h GLN 26 Cb 1.43 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1yug h GLN 26 CO 0.04 0.72 -0.05 0.39 -0.67 0.00 0.00 178.83 179.26 1yug n GLU 27 N -4.41 1.69 -4.23 1.46 1.02 -1.25 -4.99 120.64 109.92 1yug n GLU 27 Ca 0.09 -1.71 -0.35 0.00 -0.02 0.00 0.00 57.16 55.17 1yug n GLU 27 Cb 0.02 -1.06 -0.07 0.00 -0.02 0.00 0.00 31.44 30.32 1yug n GLU 27 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1yug n ASP 28 N -0.72 -0.45 -4.21 1.62 5.75 -0.44 -4.92 116.55 113.18 1yug n ASP 28 Ca 0.06 -1.27 -0.29 0.00 -0.01 0.00 0.00 54.79 53.28 1yug n ASP 28 Cb 0.47 -1.56 -0.16 0.00 -1.03 0.00 0.00 41.12 38.84 1yug n ASP 28 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1yug s LYS 29 N -7.35 2.29 0.72 0.11 -0.14 -0.23 -4.97 119.74 110.17 1yug s LYS 29 Ca 0.14 -0.78 -0.13 0.00 -1.36 0.00 0.00 55.97 53.84 1yug s LYS 29 Cb -0.08 -1.93 0.03 0.00 -1.68 0.00 0.00 37.83 34.18 1yug s LYS 29 CO 0.98 0.30 1.11 -1.25 -0.76 0.00 0.00 175.35 175.72 1yug s PRO 30 N -0.01 2.48 -0.18 -1.68 0.04 -1.26 -1.02 135.00 133.38 1yug s PRO 30 Ca -0.06 1.34 -0.10 0.00 0.04 0.00 0.00 61.00 62.23 1yug s PRO 30 Cb -0.13 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.55 1yug s PRO 30 CO 0.04 -1.49 0.43 0.00 0.04 0.00 0.00 177.00 176.02 1yug s ALA 31 N -2.53 -1.11 0.01 8.56 0.00 -0.22 -4.82 121.76 121.65 1yug s ALA 31 Ca 0.65 1.59 0.04 0.00 0.00 0.00 0.00 51.96 54.25 1yug s ALA 31 Cb -0.20 -0.97 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1yug s ALA 31 CO 0.48 -0.28 -0.09 0.00 0.00 0.00 0.00 175.76 175.86 1yug s VAL 33 N -0.97 0.83 0.18 0.00 1.01 -0.82 -5.01 120.40 115.62 1yug s VAL 33 Ca 0.16 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.57 1yug s VAL 33 Cb -0.11 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 1yug s VAL 33 CO 0.07 0.07 -0.11 0.00 0.00 0.00 0.00 175.10 175.13 1yug s HIS 35 N -1.67 3.48 0.36 0.00 3.76 -1.26 -4.84 115.29 115.12 1yug s HIS 35 Ca 0.24 0.29 -0.28 0.00 -0.15 0.00 0.00 55.06 55.16 1yug s HIS 35 Cb -0.09 -1.82 -0.11 0.00 1.11 0.00 0.00 32.58 31.67 1yug s HIS 35 CO 0.14 0.33 1.44 0.45 -0.85 0.00 0.00 174.74 176.25 1yug s SER 36 N -3.49 6.47 0.00 1.40 0.15 -1.26 -3.29 113.70 113.69 1yug s SER 36 Ca 0.38 2.94 0.00 0.00 0.70 0.00 0.00 55.95 59.97 1yug s SER 36 Cb -0.10 -2.66 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 1yug s SER 36 CO 0.31 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.58 1yug n GLY 37 N 0.62 1.95 3.41 9.45 0.00 -1.26 -5.10 105.19 114.27 1yug n GLY 37 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 1yug n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1yug n TYR 38 N -0.18 -1.12 0.01 1.61 4.02 -1.21 -2.71 117.16 117.59 1yug n TYR 38 Ca 0.00 -2.02 -0.01 0.00 -0.01 0.00 0.00 57.90 55.85 1yug n TYR 38 Cb 0.00 -0.42 -0.00 0.00 -0.02 0.00 0.00 39.34 38.89 1yug n TYR 38 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1yug n VAL 39 N -1.77 0.88 -1.43 -0.72 0.31 -0.87 -4.45 118.33 110.27 1yug n VAL 39 Ca 0.02 0.27 -0.30 0.00 -0.01 0.00 0.00 64.34 64.33 1yug n VAL 39 Cb 0.55 -1.54 0.11 0.00 -0.91 0.00 0.00 33.84 32.05 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 -3.81 1.61 0.23 2.92 0.00 -1.26 -4.93 107.32 102.08 1yug s GLY 40 Ca -0.04 -0.20 0.05 0.00 0.00 0.00 0.00 44.72 44.53 1yug s GLY 40 CO 0.06 0.27 1.53 0.00 0.00 0.00 0.00 173.10 174.96 1yug h ALA 41 N -1.29 0.80 0.00 3.20 0.00 -1.97 -2.50 119.26 117.50 1yug h ALA 41 Ca -0.48 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 53.84 1yug h ALA 41 Cb 1.28 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1yug h ALA 41 CO 0.58 0.78 0.00 0.00 0.00 0.00 0.00 179.25 180.61 1yug h ARG 42 N 0.13 0.00 -1.13 0.00 3.08 -1.92 -3.38 114.38 111.16 1yug h ARG 42 Ca -0.01 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 1yug h ARG 42 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.23 1yug h ARG 42 CO 0.10 0.00 -0.21 0.00 -1.07 0.00 0.00 179.97 178.79 1yug h GLU 44 N 0.00 0.79 -5.91 0.00 4.57 -1.91 -3.40 114.58 108.73 1yug h GLU 44 Ca -0.19 -0.61 -0.65 0.00 -1.18 0.00 0.00 59.36 56.73 1yug h GLU 44 Cb 1.13 0.12 -0.07 0.00 -0.16 0.00 0.00 28.75 29.76 1yug h GLU 44 CO 0.23 1.23 -0.53 -1.58 -1.18 0.00 0.00 179.01 177.17 1yug s HIS 45 N -3.83 3.42 -0.30 0.92 2.46 -1.26 -5.04 115.29 111.66 1yug s HIS 45 Ca -0.11 0.28 0.01 0.00 0.47 0.00 0.00 55.06 55.72 1yug s HIS 45 Cb 0.09 -1.78 0.07 0.00 -0.13 0.00 0.00 32.58 30.82 1yug s HIS 45 CO 0.90 0.60 -0.02 0.00 -2.47 0.00 0.00 174.74 173.74 1yug s ALA 46 N -1.27 2.75 0.59 1.58 0.00 -1.26 -2.05 121.76 122.09 1yug s ALA 46 Ca 0.26 -1.98 0.00 0.00 0.00 0.00 0.00 51.96 50.23 1yug s ALA 46 Cb -0.12 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.17 1yug s ALA 46 CO 0.17 -1.36 0.00 -3.47 0.00 0.00 0.00 175.76 171.09 1yug n ASP 47 N 4.46 -8.25 -1.69 0.00 -0.08 -1.10 -4.52 116.55 105.37 1yug n ASP 47 Ca -0.09 1.35 0.08 0.00 -1.51 0.00 0.00 54.79 54.62 1yug n ASP 47 Cb 0.42 -4.96 0.38 0.00 2.34 0.00 0.00 41.12 39.30 1yug n ASP 47 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1yug n LEU 48 N -4.37 5.29 -3.56 -2.67 7.94 -1.26 -4.81 117.00 113.55 1yug n LEU 48 Ca -0.08 -2.83 -0.19 0.00 -1.11 0.00 0.00 56.01 51.80 1yug n LEU 48 Cb 0.69 -0.64 0.06 0.00 0.53 0.00 0.00 43.42 44.07 1yug n LEU 48 CO 0.04 0.68 0.05 0.18 -1.11 0.00 0.00 177.39 177.22 1yug n LEU 49 N 0.59 -3.60 0.00 -1.96 4.32 -1.26 -5.24 117.00 109.85 1yug n LEU 49 Ca 0.26 -0.70 0.12 0.00 -0.02 0.00 0.00 56.01 55.67 1yug n LEU 49 Cb 1.09 -2.92 0.70 0.00 -1.62 0.00 0.00 43.42 40.67 1yug n LEU 49 CO 0.28 0.41 0.89 0.00 -1.22 0.00 0.00 177.39 177.75