#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 1.61 -4.20 1.55 -1.51 -2.09 -3.45 116.25 108.17 1yug h VAL 2 Ca 0.00 -2.97 -0.51 0.00 -1.23 0.00 0.00 66.70 61.99 1yug h VAL 2 Cb 0.00 2.62 0.11 0.00 -2.13 0.00 0.00 31.29 31.89 1yug h VAL 2 CO 0.00 0.85 0.38 -0.94 -1.23 0.00 0.00 177.57 176.63 1yug s SER 3 N -6.80 5.02 0.27 4.19 1.04 -1.26 -4.88 113.70 111.28 1yug s SER 3 Ca -0.00 2.04 0.00 0.00 0.48 0.00 0.00 55.95 58.46 1yug s SER 3 Cb 0.11 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.67 1yug s SER 3 CO 0.81 -1.69 0.00 1.57 0.98 0.00 0.00 173.24 174.91 1yug n HIS 4 N -2.44 -3.28 -1.90 5.02 -0.00 -1.26 -5.08 115.22 106.28 1yug n HIS 4 Ca 0.11 0.84 0.00 0.00 -0.00 0.00 0.00 57.72 58.66 1yug n HIS 4 Cb 0.52 2.15 0.00 0.00 -0.00 0.00 0.00 29.99 32.65 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 -3.13 -4.91 -3.66 1.57 7.35 -1.26 -5.00 117.46 108.41 1yug n PHE 5 Ca 0.00 2.57 -0.10 0.00 -0.76 0.00 0.00 57.45 59.16 1yug n PHE 5 Cb 0.00 -3.73 -0.08 0.00 0.35 0.00 0.00 39.48 36.01 1yug n PHE 5 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1yug s ASN 6 N -2.35 -0.73 0.35 -2.13 -0.87 -1.24 -4.93 114.94 103.04 1yug s ASN 6 Ca 0.00 1.25 0.00 0.00 -1.57 0.00 0.00 52.86 52.54 1yug s ASN 6 Cb 0.00 1.16 0.00 0.00 -0.02 0.00 0.00 41.25 42.39 1yug s ASN 6 CO 0.00 -0.22 0.00 0.47 -2.57 0.00 0.00 177.10 174.78 1yug n ASP 7 N 3.88 -8.33 -3.61 -1.22 8.00 -1.26 -4.77 116.55 109.24 1yug n ASP 7 Ca -0.19 1.48 -0.03 0.00 0.71 0.00 0.00 54.79 56.76 1yug n ASP 7 Cb 0.57 -4.17 -0.06 0.00 -0.02 0.00 0.00 41.12 37.44 1yug n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yug s PRO 9 N 2.09 -1.65 0.02 0.00 0.04 -1.26 -5.03 135.00 129.21 1yug s PRO 9 Ca -0.07 -0.12 0.00 0.00 0.04 0.00 0.00 61.00 60.84 1yug s PRO 9 Cb -0.07 -1.55 0.00 0.00 0.04 0.00 0.00 34.50 32.92 1yug s PRO 9 CO -0.18 -3.98 0.00 -3.47 0.04 0.00 0.00 177.00 169.41 1yug n ASP 10 N -4.94 0.11 -4.56 6.66 2.03 -1.26 -4.85 116.55 109.74 1yug n ASP 10 Ca 0.14 0.03 -0.18 0.00 0.52 0.00 0.00 54.79 55.30 1yug n ASP 10 Cb 0.60 -0.02 -0.06 0.00 -0.72 0.00 0.00 41.12 40.91 1yug n ASP 10 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1yug s SER 11 N -5.10 4.31 -0.12 1.67 0.15 -1.26 -4.14 113.70 109.20 1yug s SER 11 Ca 0.00 -0.27 -0.05 0.00 0.70 0.00 0.00 55.95 56.33 1yug s SER 11 Cb 0.00 -2.56 0.02 0.00 -1.71 0.00 0.00 66.02 61.77 1yug s SER 11 CO 0.00 -3.53 0.10 1.41 1.20 0.00 0.00 173.24 172.42 1yug n HIS 12 N 17.09 -2.40 0.00 3.44 8.25 -1.26 -4.99 115.22 135.34 1yug n HIS 12 Ca 0.44 1.30 0.00 0.00 -0.26 0.00 0.00 57.72 59.21 1yug n HIS 12 Cb 0.45 -2.63 0.00 0.00 1.12 0.00 0.00 29.99 28.93 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 1.75 0.00 0.35 1.59 5.66 -1.26 -4.95 114.28 117.41 1yug n THR 13 Ca -0.16 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 60.88 1yug n THR 13 Cb 0.33 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.04 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 -1.89 2.84 -2.72 1.09 0.00 -1.26 -4.79 117.38 110.64 1yug n GLN 14 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 57.00 56.95 1yug n GLN 14 Cb 0.00 -1.04 -0.02 0.00 0.00 0.00 0.00 30.24 29.18 1yug n GLN 14 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1yug n PHE 15 N -1.40 -2.42 -3.64 2.61 3.72 -1.26 -4.77 117.46 110.30 1yug n PHE 15 Ca 0.01 1.42 -0.04 0.00 -0.05 0.00 0.00 57.45 58.79 1yug n PHE 15 Cb 0.18 -2.54 -0.07 0.00 -0.94 0.00 0.00 39.48 36.11 1yug n PHE 15 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yug n PHE 17 N 3.82 0.65 -2.46 0.00 3.01 -1.22 -4.54 117.46 116.72 1yug n PHE 17 Ca -0.19 0.28 -0.29 0.00 1.01 0.00 0.00 57.45 58.26 1yug n PHE 17 Cb 0.58 -1.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.04 1yug n PHE 17 CO 0.00 0.00 0.00 -2.39 1.01 0.00 0.00 176.76 175.38 1yug n HIS 18 N -4.39 3.42 -3.69 1.38 1.44 -1.25 -4.96 115.22 107.18 1yug n HIS 18 Ca -0.36 -3.09 -0.14 0.00 -2.01 0.00 0.00 57.72 52.11 1yug n HIS 18 Cb 0.70 -0.32 -0.14 0.00 0.12 0.00 0.00 29.99 30.35 1yug n HIS 18 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1yug s GLY 19 N -3.11 -0.07 -0.58 -1.39 0.00 -1.26 -2.48 107.32 98.43 1yug s GLY 19 Ca 0.48 0.82 -0.36 0.00 0.00 0.00 0.00 44.72 45.67 1yug s GLY 19 CO -0.22 1.64 2.34 -1.30 0.00 0.00 0.00 173.10 175.57 1yug n THR 20 N 5.00 0.05 -2.11 0.90 -2.24 0.28 -4.39 114.28 111.77 1yug n THR 20 Ca -0.12 -0.17 -0.39 0.00 -2.27 0.00 0.00 64.05 61.10 1yug n THR 20 Cb 0.51 -1.13 -0.01 0.00 -2.10 0.00 0.00 70.33 67.59 1yug n THR 20 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yug s ARG 22 N -2.25 0.40 -0.26 0.00 0.52 -0.40 -4.90 118.95 112.07 1yug s ARG 22 Ca 0.57 0.33 -0.03 0.00 -0.52 0.00 0.00 55.73 56.08 1yug s ARG 22 Cb -0.36 0.19 0.08 0.00 0.52 0.00 0.00 34.95 35.38 1yug s ARG 22 CO 0.46 -0.06 0.09 0.12 0.02 0.00 0.00 175.30 175.93 1yug s PHE 23 N -0.06 0.90 -0.68 -0.53 5.36 -1.25 -0.73 117.98 121.00 1yug s PHE 23 Ca -0.02 -1.05 -0.26 0.00 -0.96 0.00 0.00 56.93 54.64 1yug s PHE 23 Cb -0.03 -1.15 -0.03 0.00 -0.34 0.00 0.00 43.02 41.48 1yug s PHE 23 CO 0.01 -0.75 1.93 -1.17 -1.46 0.00 0.00 175.22 173.78 1yug s LEU 24 N 1.90 3.26 0.38 6.12 0.20 -0.42 -3.59 118.68 126.52 1yug s LEU 24 Ca 0.06 0.14 0.13 0.00 0.69 0.00 0.00 54.13 55.15 1yug s LEU 24 Cb -0.17 -2.53 0.76 0.00 -0.43 0.00 0.00 46.19 43.82 1yug s LEU 24 CO -0.22 -2.53 1.84 0.58 -0.29 0.00 0.00 176.35 175.73 1yug h VAL 25 N 7.04 1.23 -0.09 1.68 2.07 -1.86 1.22 116.25 127.55 1yug h VAL 25 Ca -0.17 -1.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.07 1yug h VAL 25 Cb 1.13 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 1yug h VAL 25 CO 1.21 0.34 -0.27 1.56 0.02 0.00 0.00 177.57 180.43 1yug h GLN 26 N 0.00 0.16 -0.06 1.57 1.08 -1.90 -2.75 115.11 113.21 1yug h GLN 26 Ca -0.00 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1yug h GLN 26 Cb 0.63 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 1yug h GLN 26 CO 0.05 0.42 0.00 0.39 -0.95 0.00 0.00 178.83 178.74 1yug n GLU 27 N -4.16 1.07 -4.14 1.46 -0.58 -0.93 -4.99 120.64 108.37 1yug n GLU 27 Ca -0.01 -1.17 -0.31 0.00 -0.42 0.00 0.00 57.16 55.25 1yug n GLU 27 Cb 0.36 -1.09 -0.05 0.00 -0.57 0.00 0.00 31.44 30.09 1yug n GLU 27 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1yug n ASP 28 N 0.06 -0.34 -4.10 1.62 2.03 0.41 -4.94 116.55 111.30 1yug n ASP 28 Ca 0.03 -1.18 -0.28 0.00 0.52 0.00 0.00 54.79 53.88 1yug n ASP 28 Cb 0.20 -2.15 -0.17 0.00 -0.72 0.00 0.00 41.12 38.28 1yug n ASP 28 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1yug s LYS 29 N -7.07 2.29 0.81 -0.67 -0.14 -0.42 -4.98 119.74 109.57 1yug s LYS 29 Ca 0.08 -0.61 -0.11 0.00 -1.36 0.00 0.00 55.97 53.98 1yug s LYS 29 Cb -0.04 -1.84 0.08 0.00 -1.68 0.00 0.00 37.83 34.34 1yug s LYS 29 CO 0.96 0.04 1.10 -1.25 -0.76 0.00 0.00 175.35 175.43 1yug s PRO 30 N 0.67 1.92 -0.08 -1.68 0.04 -1.26 -1.31 135.00 133.31 1yug s PRO 30 Ca -0.13 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 1yug s PRO 30 Cb -0.16 -1.86 0.10 0.00 0.04 0.00 0.00 34.50 32.62 1yug s PRO 30 CO 0.04 -1.87 0.86 0.00 0.04 0.00 0.00 177.00 176.06 1yug s ALA 31 N -2.88 -1.84 0.01 8.56 0.00 0.10 -4.83 121.76 120.87 1yug s ALA 31 Ca 0.62 1.32 -0.00 0.00 0.00 0.00 0.00 51.96 53.90 1yug s ALA 31 Cb -0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 1yug s ALA 31 CO 0.56 -0.43 -0.00 0.00 0.00 0.00 0.00 175.76 175.89 1yug s VAL 33 N -0.56 3.48 0.63 0.00 1.01 -0.44 -4.94 120.40 119.59 1yug s VAL 33 Ca -0.06 -3.03 -0.16 0.00 0.00 0.00 0.00 61.98 58.73 1yug s VAL 33 Cb -0.04 -3.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.03 1yug s VAL 33 CO -0.00 -0.86 1.11 0.00 0.00 0.00 0.00 175.10 175.34 1yug s HIS 35 N -2.23 3.29 0.73 0.00 3.76 -1.03 -4.88 115.29 114.93 1yug s HIS 35 Ca 0.68 0.23 -0.16 0.00 -0.15 0.00 0.00 55.06 55.66 1yug s HIS 35 Cb -0.21 -1.91 0.00 0.00 1.11 0.00 0.00 32.58 31.57 1yug s HIS 35 CO 0.38 0.43 0.90 -1.13 -0.85 0.00 0.00 174.74 174.47 1yug n SER 36 N 2.54 0.19 -0.00 1.40 3.41 -1.26 -4.27 113.62 115.62 1yug n SER 36 Ca -0.18 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.07 1yug n SER 36 Cb 0.54 -1.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 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 1.17 0.99 0.49 5.00 0.00 -1.26 -5.10 105.19 106.48 1yug n GLY 37 Ca 0.12 -0.01 -0.01 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 -0.02 -1.09 0.00 1.61 4.11 -1.26 -4.42 117.16 116.09 1yug n TYR 38 Ca 0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 57.90 57.67 1yug n TYR 38 Cb 0.00 0.11 0.00 0.00 -0.00 0.00 0.00 39.34 39.46 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 -0.07 0.00 0.00 -3.48 0.31 -0.85 -4.59 118.33 109.64 1yug n VAL 39 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1yug n VAL 39 Cb 0.08 -0.20 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 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 2.73 -0.57 5.61 2.92 0.00 -1.26 -5.04 105.19 109.58 1yug n GLY 40 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1yug n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yug n ALA 41 N 0.00 0.00 -2.74 4.61 0.00 -1.26 -0.82 120.51 120.30 1yug n ALA 41 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1yug n ALA 41 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 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 0.00 1.30 -2.77 0.00 3.00 -1.26 -4.94 116.66 111.99 1yug n ARG 42 Ca 0.00 -3.01 -0.21 0.00 -0.01 0.00 0.00 57.85 54.62 1yug n ARG 42 Cb 0.00 -1.11 0.01 0.00 0.00 0.00 0.00 32.46 31.37 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 -3.53 0.63 -4.16 0.00 0.28 -1.24 -3.43 120.64 109.18 1yug n GLU 44 Ca -0.16 0.04 -0.17 0.00 -0.16 0.00 0.00 57.16 56.71 1yug n GLU 44 Cb 0.64 -1.73 -0.12 0.00 1.43 0.00 0.00 31.44 31.66 1yug n GLU 44 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1yug s HIS 45 N -3.32 1.14 -0.14 -1.84 2.46 -1.26 -5.06 115.29 107.27 1yug s HIS 45 Ca -0.03 -0.48 -0.04 0.00 0.47 0.00 0.00 55.06 54.98 1yug s HIS 45 Cb 0.11 -0.64 0.07 0.00 -0.13 0.00 0.00 32.58 31.98 1yug s HIS 45 CO 0.83 0.04 0.25 0.00 -2.47 0.00 0.00 174.74 173.38 1yug s ALA 46 N -1.38 -0.47 0.53 1.58 0.00 -1.26 -2.01 121.76 118.75 1yug s ALA 46 Ca -0.02 0.77 -0.23 0.00 0.00 0.00 0.00 51.96 52.49 1yug s ALA 46 Cb -0.09 -1.06 -0.06 0.00 0.00 0.00 0.00 23.12 21.91 1yug s ALA 46 CO 0.02 -0.74 1.38 0.34 0.00 0.00 0.00 175.76 176.76 1yug s ASP 47 N 2.39 5.38 0.00 0.00 2.15 -1.26 -4.83 116.67 120.50 1yug s ASP 47 Ca 0.03 2.81 0.00 0.00 0.43 0.00 0.00 52.55 55.82 1yug s ASP 47 Cb -0.13 -2.64 0.00 0.00 -0.30 0.00 0.00 42.92 39.85 1yug s ASP 47 CO -0.09 -1.50 0.76 0.00 -0.17 0.00 0.00 175.17 174.17 1yug n LEU 48 N -0.85 0.00 -3.08 -1.34 -0.00 -1.26 -4.68 117.00 105.79 1yug n LEU 48 Ca 0.09 -0.99 -0.01 0.00 -0.00 0.00 0.00 56.01 55.10 1yug n LEU 48 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.87 1yug n LEU 48 CO 0.54 0.60 0.33 -0.11 -0.00 0.00 0.00 177.39 178.75 1yug n LEU 49 N 0.00 -6.70 0.00 1.47 0.00 -1.26 -5.27 117.00 105.23 1yug n LEU 49 Ca 0.00 -0.11 0.08 0.00 0.00 0.00 0.00 56.01 55.97 1yug n LEU 49 Cb 0.60 -3.30 0.45 0.00 0.00 0.00 0.00 43.42 41.18 1yug n LEU 49 CO 0.00 -1.05 0.66 0.00 0.00 0.00 0.00 177.39 177.00