#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 0.89 -2.83 3.34 -1.51 -2.09 -3.49 116.25 110.57 1yug h VAL 2 Ca 0.00 -1.71 0.00 0.00 -1.23 0.00 0.00 66.70 63.76 1yug h VAL 2 Cb 0.00 2.06 0.00 0.00 -2.13 0.00 0.00 31.29 31.22 1yug h VAL 2 CO 0.00 0.41 -0.43 -1.54 -1.23 0.00 0.00 177.57 174.78 1yug n SER 3 N -3.45 -5.21 -3.67 4.19 3.41 -1.26 -5.10 113.62 102.52 1yug n SER 3 Ca 0.00 0.71 -0.15 0.00 -0.26 0.00 0.00 58.87 59.18 1yug n SER 3 Cb 0.57 -2.83 -0.08 0.00 -0.26 0.00 0.00 64.21 61.61 1yug n SER 3 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1yug s HIS 4 N -0.25 -0.40 0.19 7.33 5.65 -1.26 -5.12 115.29 121.44 1yug s HIS 4 Ca 0.00 0.74 -0.07 0.00 0.25 0.00 0.00 55.06 55.98 1yug s HIS 4 Cb 0.00 0.21 -0.02 0.00 -1.18 0.00 0.00 32.58 31.60 1yug s HIS 4 CO 0.00 -0.44 0.28 -0.59 -0.65 0.00 0.00 174.74 173.35 1yug s PHE 5 N -0.99 0.61 0.20 3.88 -0.12 -1.26 -1.60 117.98 118.70 1yug s PHE 5 Ca -0.10 -0.94 0.00 0.00 -0.05 0.00 0.00 56.93 55.84 1yug s PHE 5 Cb -0.03 -0.14 0.00 0.00 -0.63 0.00 0.00 43.02 42.22 1yug s PHE 5 CO 0.05 -0.76 0.00 -1.71 -0.05 0.00 0.00 175.22 172.75 1yug n ASN 6 N -0.27 -0.87 -2.74 1.98 5.15 -1.21 -4.92 115.26 112.39 1yug n ASN 6 Ca -0.03 0.37 0.00 0.00 -0.60 0.00 0.00 54.58 54.31 1yug n ASN 6 Cb 0.63 0.97 0.00 0.00 -0.53 0.00 0.00 39.78 40.86 1yug n ASN 6 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1yug n ASP 7 N -3.06 -0.24 0.01 1.20 8.00 -1.26 -4.87 116.55 116.32 1yug n ASP 7 Ca 0.00 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.12 1yug n ASP 7 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 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 -2.00 4.31 -0.07 0.00 0.04 -1.26 -4.73 135.00 131.29 1yug s PRO 9 Ca 0.00 2.10 0.10 0.00 0.04 0.00 0.00 61.00 63.24 1yug s PRO 9 Cb 0.00 -3.27 0.15 0.00 0.04 0.00 0.00 34.50 31.42 1yug s PRO 9 CO 0.00 -0.47 1.07 -0.25 0.04 0.00 0.00 177.00 177.39 1yug n ASP 10 N 4.09 2.14 -3.63 6.66 8.00 -1.26 -5.00 116.55 127.55 1yug n ASP 10 Ca 0.12 -2.55 -0.29 0.00 0.71 0.00 0.00 54.79 52.78 1yug n ASP 10 Cb 0.42 -0.22 0.04 0.00 -0.02 0.00 0.00 41.12 41.34 1yug n ASP 10 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1yug n SER 11 N -0.97 -5.53 -2.43 -2.24 3.41 -1.26 -3.93 113.62 100.66 1yug n SER 11 Ca 0.08 -0.95 -0.04 0.00 -0.26 0.00 0.00 58.87 57.71 1yug n SER 11 Cb 0.46 -3.49 0.00 0.00 -0.26 0.00 0.00 64.21 60.92 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 -3.93 -2.65 -3.20 7.33 8.25 -1.26 -5.07 115.22 114.69 1yug n HIS 12 Ca -0.10 1.11 0.04 0.00 -0.26 0.00 0.00 57.72 58.52 1yug n HIS 12 Cb 0.59 -3.35 -0.03 0.00 1.12 0.00 0.00 29.99 28.33 1yug n HIS 12 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1yug s THR 13 N -1.80 -0.22 -1.50 1.59 2.01 -1.25 -4.97 115.64 109.50 1yug s THR 13 Ca 0.11 0.00 -0.00 0.00 0.31 0.00 0.00 61.69 62.11 1yug s THR 13 Cb -0.03 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.48 1yug s THR 13 CO 0.56 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.49 1yug n GLN 14 N 5.12 -0.94 -4.64 4.92 6.02 -1.26 -4.70 117.38 121.89 1yug n GLN 14 Ca -0.08 0.09 -0.30 0.00 -0.01 0.00 0.00 57.00 56.70 1yug n GLN 14 Cb 0.54 -3.47 -0.09 0.00 1.02 0.00 0.00 30.24 28.25 1yug n GLN 14 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1yug s PHE 15 N -4.34 2.14 0.35 1.08 5.36 -1.26 -4.74 117.98 116.56 1yug s PHE 15 Ca 0.00 -0.83 0.08 0.00 -0.96 0.00 0.00 56.93 55.23 1yug s PHE 15 Cb -0.00 -1.71 -0.04 0.00 -0.34 0.00 0.00 43.02 40.93 1yug s PHE 15 CO 0.97 0.28 0.13 0.00 -1.46 0.00 0.00 175.22 175.14 1yug n PHE 17 N -1.13 0.00 -2.71 0.00 3.01 -1.00 -4.81 117.46 110.81 1yug n PHE 17 Ca -0.03 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.36 1yug n PHE 17 Cb 0.62 -0.38 0.06 0.00 -0.01 0.00 0.00 39.48 39.77 1yug n PHE 17 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 1yug n HIS 18 N -2.08 -2.18 -1.13 1.38 -0.00 -1.26 -5.11 115.22 104.84 1yug n HIS 18 Ca -0.04 -1.34 0.00 0.00 -0.00 0.00 0.00 57.72 56.34 1yug n HIS 18 Cb 0.45 1.38 0.00 0.00 -0.00 0.00 0.00 29.99 31.82 1yug n HIS 18 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1yug n GLY 19 N 1.51 5.44 2.98 1.57 0.00 -1.26 -4.28 105.19 111.16 1yug n GLY 19 Ca 0.06 -1.22 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 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 1.83 2.32 0.09 2.61 -4.23 0.61 -4.92 115.64 113.95 1yug s THR 20 Ca 0.00 -2.64 -0.30 0.00 -1.18 0.00 0.00 61.69 57.56 1yug s THR 20 Cb 0.00 -2.68 -0.06 0.00 1.34 0.00 0.00 72.50 71.10 1yug s THR 20 CO 0.00 -0.67 1.13 0.00 -0.54 0.00 0.00 174.62 174.54 1yug s ARG 22 N 0.60 0.36 -0.62 0.00 0.52 -0.32 -4.89 118.95 114.61 1yug s ARG 22 Ca 0.55 0.34 -0.28 0.00 -0.52 0.00 0.00 55.73 55.82 1yug s ARG 22 Cb -0.28 -0.47 0.02 0.00 0.52 0.00 0.00 34.95 34.74 1yug s ARG 22 CO 0.31 -0.79 1.31 0.12 0.02 0.00 0.00 175.30 176.26 1yug s PHE 23 N 2.52 2.38 -0.28 -0.53 5.36 -0.97 -2.31 117.98 124.15 1yug s PHE 23 Ca 0.11 0.30 -0.29 0.00 -0.96 0.00 0.00 56.93 56.10 1yug s PHE 23 Cb -0.14 -4.50 -0.07 0.00 -0.34 0.00 0.00 43.02 37.97 1yug s PHE 23 CO -0.21 -1.87 2.25 -0.11 -1.46 0.00 0.00 175.22 173.81 1yug n LEU 24 N 9.20 2.93 0.08 6.12 -0.00 0.08 -3.28 117.00 132.13 1yug n LEU 24 Ca 0.08 0.16 -0.08 0.00 -0.00 0.00 0.00 56.01 56.17 1yug n LEU 24 Cb 0.49 -1.50 -0.07 0.00 -0.00 0.00 0.00 43.42 42.34 1yug n LEU 24 CO 0.71 -0.79 0.17 0.58 -0.00 0.00 0.00 177.39 178.06 1yug h VAL 25 N 7.22 1.60 -0.55 1.96 2.07 -1.59 0.44 116.25 127.41 1yug h VAL 25 Ca -0.36 -3.05 0.02 0.00 0.82 0.00 0.00 66.70 64.13 1yug h VAL 25 Cb 1.26 2.71 -0.03 0.00 -1.52 0.00 0.00 31.29 33.71 1yug h VAL 25 CO 0.99 0.88 0.36 1.56 0.02 0.00 0.00 177.57 181.39 1yug h GLN 26 N 0.04 0.65 0.00 1.57 4.20 -1.87 -2.44 115.11 117.25 1yug h GLN 26 Ca -0.04 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1yug h GLN 26 Cb 1.67 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 29.31 1yug h GLN 26 CO 0.14 0.43 -0.01 0.39 -0.67 0.00 0.00 178.83 179.11 1yug n GLU 27 N -4.46 2.28 -4.04 1.46 4.71 -1.22 -5.01 120.64 114.36 1yug n GLU 27 Ca 0.06 -1.39 -0.42 0.00 -0.01 0.00 0.00 57.16 55.40 1yug n GLU 27 Cb 0.11 -0.94 0.01 0.00 -1.01 0.00 0.00 31.44 29.61 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 -0.47 -3.58 -4.08 1.62 5.75 0.13 -4.96 116.55 110.97 1yug n ASP 28 Ca 0.01 -1.24 -0.28 0.00 -0.01 0.00 0.00 54.79 53.27 1yug n ASP 28 Cb 0.33 -2.00 -0.17 0.00 -1.03 0.00 0.00 41.12 38.26 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 -7.17 2.26 -0.10 0.11 1.02 0.28 -4.97 119.74 111.17 1yug s LYS 29 Ca 0.42 -0.59 -0.29 0.00 0.02 0.00 0.00 55.97 55.53 1yug s LYS 29 Cb -0.21 -1.86 -0.04 0.00 -0.52 0.00 0.00 37.83 35.19 1yug s LYS 29 CO 0.96 -0.01 1.58 -1.25 -0.92 0.00 0.00 175.35 175.71 1yug s PRO 30 N 0.82 4.13 -0.15 -1.68 0.04 -1.26 -0.74 135.00 136.16 1yug s PRO 30 Ca -0.10 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 1yug s PRO 30 Cb -0.16 -3.96 0.04 0.00 0.04 0.00 0.00 34.50 30.47 1yug s PRO 30 CO 0.01 -0.89 -0.02 0.00 0.04 0.00 0.00 177.00 176.14 1yug s ALA 31 N 4.13 1.19 0.03 8.56 0.00 -0.98 -4.93 121.76 129.76 1yug s ALA 31 Ca 0.70 -0.62 0.07 0.00 0.00 0.00 0.00 51.96 52.11 1yug s ALA 31 Cb -0.30 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 1yug s ALA 31 CO 0.27 -0.77 -0.20 0.00 0.00 0.00 0.00 175.76 175.06 1yug s VAL 33 N -0.85 5.31 0.37 0.00 1.01 -0.50 -4.87 120.40 120.88 1yug s VAL 33 Ca 0.13 0.05 -0.09 0.00 0.00 0.00 0.00 61.98 62.07 1yug s VAL 33 Cb -0.10 -3.58 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 1yug s VAL 33 CO 0.03 0.30 0.71 0.00 0.00 0.00 0.00 175.10 176.14 1yug n HIS 35 N -1.21 0.00 -3.54 0.00 8.25 -1.26 -4.84 115.22 112.62 1yug n HIS 35 Ca 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.37 1yug n HIS 35 Cb 0.54 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.61 1yug n HIS 35 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1yug s SER 36 N -3.73 -0.39 -0.76 0.41 1.04 -1.26 -5.01 113.70 104.00 1yug s SER 36 Ca 0.00 0.24 -0.03 0.00 0.48 0.00 0.00 55.95 56.64 1yug s SER 36 Cb 0.00 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 1yug s SER 36 CO 0.00 -0.49 0.66 0.61 0.98 0.00 0.00 173.24 175.00 1yug n GLY 37 N 0.29 -0.43 3.22 7.32 0.00 -1.26 -5.05 105.19 109.28 1yug n GLY 37 Ca -0.10 0.23 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.27 0.70 -0.08 1.61 2.02 -1.26 -4.21 117.35 112.86 1yug s TYR 38 Ca 0.24 -1.07 -0.01 0.00 -0.37 0.00 0.00 57.07 55.86 1yug s TYR 38 Cb -0.03 -0.33 -0.01 0.00 -0.40 0.00 0.00 41.96 41.19 1yug s TYR 38 CO 0.51 -0.59 0.04 0.28 -1.57 0.00 0.00 175.55 174.23 1yug h VAL 39 N 2.75 0.00 0.00 0.71 2.07 -1.66 -3.30 116.25 116.82 1yug h VAL 39 Ca -0.34 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1yug h VAL 39 Cb 1.21 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1yug h VAL 39 CO 0.55 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.75 1yug n GLY 40 N 1.72 -0.00 0.00 2.17 0.00 -1.26 -4.87 105.19 102.94 1yug n GLY 40 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 0.20 0.96 4.61 0.00 -1.26 -4.96 120.51 120.06 1yug n ALA 41 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1yug n ALA 41 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 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 0.03 -2.35 0.00 3.00 -1.26 -4.99 116.66 111.09 1yug n ARG 42 Ca 0.00 -0.01 -0.06 0.00 -0.01 0.00 0.00 57.85 57.77 1yug n ARG 42 Cb 0.00 -1.50 0.03 0.00 0.00 0.00 0.00 32.46 30.99 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 -2.12 0.19 -4.14 0.00 2.13 -1.26 -2.37 120.64 113.07 1yug n GLU 44 Ca -0.07 0.05 -0.23 0.00 0.66 0.00 0.00 57.16 57.57 1yug n GLU 44 Cb 0.55 -1.06 -0.05 0.00 0.27 0.00 0.00 31.44 31.15 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 -2.15 3.04 -0.38 4.31 2.46 -1.26 -4.92 115.29 116.39 1yug s HIS 45 Ca -0.11 -0.11 -0.02 0.00 0.47 0.00 0.00 55.06 55.29 1yug s HIS 45 Cb 0.03 -1.39 0.10 0.00 -0.13 0.00 0.00 32.58 31.19 1yug s HIS 45 CO 0.17 0.53 0.15 0.00 -2.47 0.00 0.00 174.74 173.13 1yug s ALA 46 N -2.07 3.07 0.57 1.58 0.00 -1.26 -1.77 121.76 121.88 1yug s ALA 46 Ca 0.32 -2.37 0.00 0.00 0.00 0.00 0.00 51.96 49.91 1yug s ALA 46 Cb -0.08 -2.29 0.00 0.00 0.00 0.00 0.00 23.12 20.75 1yug s ALA 46 CO 0.24 -1.68 0.00 -3.47 0.00 0.00 0.00 175.76 170.84 1yug n ASP 47 N 4.58 -8.28 -0.82 0.00 2.03 -1.25 -4.82 116.55 108.00 1yug n ASP 47 Ca -0.04 1.30 0.00 0.00 0.52 0.00 0.00 54.79 56.57 1yug n ASP 47 Cb 0.42 -4.92 0.00 0.00 -0.72 0.00 0.00 41.12 35.89 1yug n ASP 47 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1yug n LEU 48 N -4.36 -1.20 -2.84 -2.67 -0.00 -1.26 -4.80 117.00 99.88 1yug n LEU 48 Ca -0.07 1.53 -0.10 0.00 -0.00 0.00 0.00 56.01 57.36 1yug n LEU 48 Cb 0.69 -1.11 0.02 0.00 -0.00 0.00 0.00 43.42 43.02 1yug n LEU 48 CO 0.04 -0.14 0.10 0.00 -0.00 0.00 0.00 177.39 177.39 1yug n LEU 49 N -1.59 -2.45 0.00 1.47 -0.00 -1.26 -4.91 117.00 108.27 1yug n LEU 49 Ca 0.00 -3.50 0.00 0.00 -0.00 0.00 0.00 56.01 52.51 1yug n LEU 49 Cb 0.14 0.79 0.00 0.00 -0.00 0.00 0.00 43.42 44.35 1yug n LEU 49 CO 0.00 2.00 0.00 0.00 -0.00 0.00 0.00 177.39 179.39