#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yug s VAL 2 N 0.00 4.49 0.52 1.55 1.01 -1.26 -5.02 120.40 121.69 1yug s VAL 2 Ca 0.00 1.44 -0.23 0.00 0.00 0.00 0.00 61.98 63.19 1yug s VAL 2 Cb 0.00 -3.94 -0.06 0.00 0.00 0.00 0.00 36.38 32.39 1yug s VAL 2 CO 0.00 0.27 1.40 -0.94 0.00 0.00 0.00 175.10 175.83 1yug s SER 3 N -1.53 5.41 0.04 3.32 1.04 -1.26 -5.02 113.70 115.71 1yug s SER 3 Ca 0.42 2.85 -0.19 0.00 0.48 0.00 0.00 55.95 59.51 1yug s SER 3 Cb -0.18 -2.64 0.04 0.00 0.10 0.00 0.00 66.02 63.33 1yug s SER 3 CO 0.22 -1.48 0.44 -1.38 0.98 0.00 0.00 173.24 172.02 1yug s HIS 4 N -1.26 -0.31 -0.67 5.02 0.00 -1.26 -4.95 115.29 111.87 1yug s HIS 4 Ca 0.69 0.30 -0.10 0.00 -3.00 0.00 0.00 55.06 52.94 1yug s HIS 4 Cb -0.42 0.25 0.01 0.00 -4.00 0.00 0.00 32.58 28.42 1yug s HIS 4 CO 0.51 -0.59 0.64 0.34 -1.00 0.00 0.00 174.74 174.65 1yug n PHE 5 N 0.49 -2.67 0.00 0.38 7.35 -1.16 -4.89 117.46 116.96 1yug n PHE 5 Ca -0.18 1.07 0.00 0.00 -0.76 0.00 0.00 57.45 57.57 1yug n PHE 5 Cb 0.60 -3.17 0.00 0.00 0.35 0.00 0.00 39.48 37.26 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 -1.55 0.00 -0.30 -2.13 4.13 -1.26 -4.97 115.26 109.17 1yug n ASN 6 Ca -0.12 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.14 1yug n ASN 6 Cb 0.60 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.84 1yug n ASN 6 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1yug n ASP 7 N -0.57 0.00 -1.16 6.41 -0.08 -1.26 -4.93 116.55 114.96 1yug n ASP 7 Ca 0.00 -1.56 0.00 0.00 -1.51 0.00 0.00 54.79 51.72 1yug n ASP 7 Cb 0.00 -0.11 0.00 0.00 2.34 0.00 0.00 41.12 43.35 1yug n ASP 7 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1yug n PRO 9 N 0.06 -3.10 0.29 0.00 -0.04 -1.26 -4.89 135.00 126.06 1yug n PRO 9 Ca 0.00 -1.54 0.18 0.00 -0.04 0.00 0.00 63.50 62.11 1yug n PRO 9 Cb 0.00 -1.49 0.81 0.00 -0.04 0.00 0.00 33.50 32.78 1yug n PRO 9 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1yug h ASP 10 N -2.64 0.00 -1.01 3.54 2.03 -1.98 -2.52 116.42 113.83 1yug h ASP 10 Ca -0.37 0.00 0.25 0.00 -0.73 0.00 0.00 57.03 56.18 1yug h ASP 10 Cb 1.13 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.54 1yug h ASP 10 CO 0.24 0.01 0.66 0.28 -1.03 0.00 0.00 179.24 179.39 1yug h SER 11 N 0.00 0.45 -1.57 4.15 0.02 -2.01 -0.66 113.55 113.93 1yug h SER 11 Ca -0.00 0.07 -0.56 0.00 -0.84 0.00 0.00 61.79 60.47 1yug h SER 11 Cb 0.39 -0.00 -0.42 0.00 0.14 0.00 0.00 62.40 62.51 1yug h SER 11 CO 0.00 0.11 -0.79 1.41 -1.14 0.00 0.00 176.83 176.42 1yug n HIS 12 N -4.60 3.13 0.30 3.45 8.25 -0.95 -4.83 115.22 119.98 1yug n HIS 12 Ca 0.24 -3.21 0.18 0.00 -0.26 0.00 0.00 57.72 54.67 1yug n HIS 12 Cb 0.83 -0.18 0.98 0.00 1.12 0.00 0.00 29.99 32.73 1yug n HIS 12 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yug h THR 13 N 2.65 0.28 0.00 1.59 1.03 -1.17 -3.39 112.91 113.89 1yug h THR 13 Ca 0.22 -0.17 0.00 0.00 -0.01 0.00 0.00 66.41 66.45 1yug h THR 13 Cb 0.90 1.13 0.00 0.00 -1.07 0.00 0.00 68.15 69.10 1yug h THR 13 CO 0.79 0.03 0.00 0.00 -0.01 0.00 0.00 175.52 176.33 1yug n GLN 14 N -3.43 0.00 -1.24 0.00 6.02 -1.26 -4.90 117.38 112.57 1yug n GLN 14 Ca -0.02 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.88 1yug n GLN 14 Cb 0.13 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.36 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 0.00 -0.00 -3.60 1.08 7.35 -1.26 -4.85 117.46 116.17 1yug n PHE 15 Ca 0.00 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.65 1yug n PHE 15 Cb 0.00 -2.60 -0.02 0.00 0.35 0.00 0.00 39.48 37.21 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 2.00 -0.16 0.00 0.00 3.57 -1.64 -3.43 116.94 117.28 1yug h PHE 17 Ca -0.13 -0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.17 1yug h PHE 17 Cb 1.18 0.05 -0.14 0.00 2.79 0.00 0.00 35.95 39.83 1yug h PHE 17 CO 0.29 0.31 -0.25 -2.39 -2.23 0.00 0.00 178.31 174.04 1yug n HIS 18 N -4.88 -2.07 -3.58 0.41 1.44 -1.26 -5.09 115.22 100.19 1yug n HIS 18 Ca -0.08 -1.68 0.00 0.00 -2.01 0.00 0.00 57.72 53.95 1yug n HIS 18 Cb 0.27 1.51 0.00 0.00 0.12 0.00 0.00 29.99 31.89 1yug n HIS 18 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1yug n GLY 19 N -0.21 5.56 3.89 -1.39 0.00 -1.26 -4.52 105.19 107.26 1yug n GLY 19 Ca -0.05 -2.14 -0.30 0.00 0.00 0.00 0.00 46.02 43.54 1yug n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yug s THR 20 N -0.18 1.97 0.05 2.61 2.01 0.13 -4.86 115.64 117.36 1yug s THR 20 Ca 0.00 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.03 1yug s THR 20 Cb 0.00 -2.95 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 1yug s THR 20 CO 0.00 0.00 -0.10 0.00 -0.69 0.00 0.00 174.62 173.83 1yug s ARG 22 N -1.51 0.99 -0.27 0.00 1.70 -1.00 -4.48 118.95 114.38 1yug s ARG 22 Ca -0.07 0.13 -0.01 0.00 -0.47 0.00 0.00 55.73 55.31 1yug s ARG 22 Cb -0.09 0.46 0.16 0.00 -0.57 0.00 0.00 34.95 34.91 1yug s ARG 22 CO 0.01 -0.31 0.46 0.12 -1.08 0.00 0.00 175.30 174.49 1yug s PHE 23 N -1.36 -1.12 -0.96 5.89 5.36 -1.26 -1.89 117.98 122.64 1yug s PHE 23 Ca -0.11 1.05 -0.24 0.00 -0.96 0.00 0.00 56.93 56.68 1yug s PHE 23 Cb -0.01 0.18 0.01 0.00 -0.34 0.00 0.00 43.02 42.86 1yug s PHE 23 CO 0.08 -0.81 1.65 -1.17 -1.46 0.00 0.00 175.22 173.50 1yug s LEU 24 N 2.65 3.35 0.46 6.12 2.96 -1.01 -2.99 118.68 130.23 1yug s LEU 24 Ca 0.15 -1.08 0.19 0.00 -0.22 0.00 0.00 54.13 53.17 1yug s LEU 24 Cb -0.15 -2.56 1.13 0.00 0.50 0.00 0.00 46.19 45.11 1yug s LEU 24 CO -0.19 -2.03 2.00 0.58 -1.32 0.00 0.00 176.35 175.38 1yug h VAL 25 N 6.96 0.92 0.00 1.68 2.07 -1.90 1.21 116.25 127.20 1yug h VAL 25 Ca 0.14 -0.70 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 1yug h VAL 25 Cb 1.01 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 1yug h VAL 25 CO 1.33 0.19 -0.21 0.06 0.02 0.00 0.00 177.57 178.96 1yug h GLN 26 N 0.00 0.00 0.00 1.57 3.07 -1.92 -2.80 115.11 115.03 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 0.39 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.95 1yug h GLN 26 CO 0.02 0.21 0.00 0.39 0.09 0.00 0.00 178.83 179.54 1yug n GLU 27 N -3.68 1.64 -3.66 0.06 -0.58 -0.63 -5.03 120.64 108.75 1yug n GLU 27 Ca -0.01 -1.07 -0.21 0.00 -0.42 0.00 0.00 57.16 55.45 1yug n GLU 27 Cb 0.33 -0.87 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 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 -0.30 -5.40 -3.65 1.62 2.03 0.40 -4.96 116.55 106.30 1yug n ASP 28 Ca 0.00 -0.81 -0.29 0.00 0.52 0.00 0.00 54.79 54.21 1yug n ASP 28 Cb 0.27 -2.41 -0.13 0.00 -0.72 0.00 0.00 41.12 38.13 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 -4.67 1.14 0.42 -0.67 1.02 -0.36 -4.98 119.74 111.63 1yug s LYS 29 Ca 0.02 -1.89 -0.25 0.00 0.02 0.00 0.00 55.97 53.87 1yug s LYS 29 Cb -0.01 -2.10 -0.08 0.00 -0.52 0.00 0.00 37.83 35.12 1yug s LYS 29 CO 0.87 -1.18 1.21 -1.25 -0.92 0.00 0.00 175.35 174.07 1yug s PRO 30 N 0.45 3.94 0.15 -1.68 0.04 -1.26 -2.39 135.00 134.24 1yug s PRO 30 Ca 0.19 1.92 -0.25 0.00 0.04 0.00 0.00 61.00 62.90 1yug s PRO 30 Cb -0.22 -2.63 0.07 0.00 0.04 0.00 0.00 34.50 31.77 1yug s PRO 30 CO -0.01 -0.44 1.02 0.00 0.04 0.00 0.00 177.00 177.61 1yug s ALA 31 N -1.40 -1.69 0.41 8.56 0.00 -0.79 -4.99 121.76 121.86 1yug s ALA 31 Ca 0.59 0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.61 1yug s ALA 31 Cb -0.32 0.65 -0.02 0.00 0.00 0.00 0.00 23.12 23.42 1yug s ALA 31 CO 0.41 -1.05 0.12 0.00 0.00 0.00 0.00 175.76 175.23 1yug s VAL 33 N -3.20 0.18 0.42 0.00 0.11 -0.46 -4.82 120.40 112.64 1yug s VAL 33 Ca 0.23 -1.51 -0.07 0.00 -2.93 0.00 0.00 61.98 57.71 1yug s VAL 33 Cb 0.03 -1.21 -0.05 0.00 -1.53 0.00 0.00 36.38 33.62 1yug s VAL 33 CO 0.14 -0.83 0.74 0.00 -3.33 0.00 0.00 175.10 171.82 1yug n HIS 35 N -1.75 0.34 -0.42 0.00 8.25 -1.26 -4.29 115.22 116.09 1yug n HIS 35 Ca 0.01 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 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 0.43 0.64 0.00 0.00 176.34 177.41 1yug n SER 36 N 1.38 -3.08 0.00 0.41 7.64 -1.26 -4.95 113.62 113.77 1yug n SER 36 Ca 0.17 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.37 1yug n SER 36 Cb 0.58 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1yug n SER 36 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yug n GLY 37 N -0.88 0.82 3.77 0.23 0.00 -1.26 -5.06 105.19 102.81 1yug n GLY 37 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1yug n GLY 37 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yug s TYR 38 N -2.00 -0.23 0.00 1.61 1.13 -1.26 -4.23 117.35 112.38 1yug s TYR 38 Ca 0.00 -0.16 0.00 0.00 -1.41 0.00 0.00 57.07 55.50 1yug s TYR 38 Cb 0.00 0.67 0.00 0.00 -1.10 0.00 0.00 41.96 41.53 1yug s TYR 38 CO 0.00 -1.08 0.00 1.33 -2.51 0.00 0.00 175.55 173.29 1yug n VAL 39 N -0.44 0.00 0.00 -3.49 0.24 0.62 -4.87 118.33 110.39 1yug n VAL 39 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1yug n VAL 39 Cb 0.60 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 1yug n VAL 39 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yug n GLY 40 N 0.00 0.96 4.89 7.63 0.00 -1.26 -0.16 105.19 117.25 1yug n GLY 40 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.40 4.61 0.00 -1.26 -3.78 120.51 119.67 1yug n ALA 41 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1yug n ALA 41 Cb 0.00 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.64 1yug n ALA 41 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1yug n ARG 42 N 0.00 2.92 -2.26 0.00 0.63 -1.26 -4.99 116.66 111.69 1yug n ARG 42 Ca 0.00 -2.29 -0.02 0.00 -0.92 0.00 0.00 57.85 54.63 1yug n ARG 42 Cb 0.00 -1.44 0.00 0.00 0.45 0.00 0.00 32.46 31.47 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 -0.99 0.00 -3.20 0.00 0.28 -0.48 -3.10 120.64 113.16 1yug n GLU 44 Ca 0.03 0.00 -0.39 0.00 -0.16 0.00 0.00 57.16 56.64 1yug n GLU 44 Cb 0.39 -0.45 -0.06 0.00 1.43 0.00 0.00 31.44 32.75 1yug n GLU 44 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 1yug s HIS 45 N -1.37 3.70 -0.38 -1.84 3.76 0.77 -4.93 115.29 115.00 1yug s HIS 45 Ca 0.00 1.22 -0.12 0.00 -0.15 0.00 0.00 55.06 56.02 1yug s HIS 45 Cb 0.00 -2.61 0.03 0.00 1.11 0.00 0.00 32.58 31.10 1yug s HIS 45 CO 0.00 0.37 0.22 0.00 -0.85 0.00 0.00 174.74 174.48 1yug s ALA 46 N -0.25 3.31 0.49 -1.40 0.00 -1.26 -0.27 121.76 122.37 1yug s ALA 46 Ca 0.31 -1.71 -0.22 0.00 0.00 0.00 0.00 51.96 50.34 1yug s ALA 46 Cb -0.18 -2.64 -0.09 0.00 0.00 0.00 0.00 23.12 20.21 1yug s ALA 46 CO 0.18 -1.39 0.92 -3.47 0.00 0.00 0.00 175.76 172.00 1yug n ASP 47 N 5.02 0.77 0.03 0.00 2.03 -1.26 -4.94 116.55 118.21 1yug n ASP 47 Ca -0.12 0.93 -0.01 0.00 0.52 0.00 0.00 54.79 56.11 1yug n ASP 47 Cb 0.46 -1.33 -0.00 0.00 -0.72 0.00 0.00 41.12 39.53 1yug n ASP 47 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1yug n LEU 48 N 0.19 1.20 -2.81 -2.67 4.32 -1.26 -4.96 117.00 111.01 1yug n LEU 48 Ca 0.11 0.16 -0.11 0.00 -0.02 0.00 0.00 56.01 56.15 1yug n LEU 48 Cb 0.42 -0.38 0.07 0.00 -1.62 0.00 0.00 43.42 41.91 1yug n LEU 48 CO 0.54 -0.68 0.23 -0.11 -1.22 0.00 0.00 177.39 176.15 1yug n LEU 49 N -3.61 -1.84 0.00 2.23 -0.00 -1.26 -5.26 117.00 107.26 1yug n LEU 49 Ca -0.02 -3.91 0.00 0.00 -0.00 0.00 0.00 56.01 52.08 1yug n LEU 49 Cb 0.08 0.89 0.00 0.00 -0.00 0.00 0.00 43.42 44.39 1yug n LEU 49 CO 0.03 2.11 0.00 0.00 -0.00 0.00 0.00 177.39 179.52