#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yuf n VAL 2 N 0.00 0.00 -1.41 3.34 3.14 -1.26 -5.09 118.33 117.05 1yuf n VAL 2 Ca 0.00 0.00 -0.52 0.00 -2.96 0.00 0.00 64.34 60.86 1yuf n VAL 2 Cb 0.00 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.72 1yuf n VAL 2 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1yuf n SER 3 N 0.00 -0.55 -3.08 6.55 3.41 -1.26 -4.92 113.62 113.77 1yuf n SER 3 Ca 0.00 1.11 -0.18 0.00 -0.26 0.00 0.00 58.87 59.54 1yuf n SER 3 Cb 0.00 -0.91 -0.04 0.00 -0.26 0.00 0.00 64.21 63.01 1yuf n SER 3 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1yuf n HIS 4 N 0.80 -1.68 -3.65 7.33 -0.00 -1.26 -5.09 115.22 111.67 1yuf n HIS 4 Ca 0.19 -2.77 -0.20 0.00 -0.00 0.00 0.00 57.72 54.93 1yuf n HIS 4 Cb 0.15 0.50 -0.02 0.00 -0.00 0.00 0.00 29.99 30.62 1yuf n HIS 4 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.34 176.46 1yuf s PHE 5 N -0.16 2.98 0.00 1.57 2.19 -1.26 -2.52 117.98 120.78 1yuf s PHE 5 Ca 0.33 -0.28 0.00 0.00 0.33 0.00 0.00 56.93 57.31 1yuf s PHE 5 Cb 0.13 -1.91 0.00 0.00 -1.31 0.00 0.00 43.02 39.93 1yuf s PHE 5 CO -0.16 0.08 0.00 0.09 1.83 0.00 0.00 175.22 177.06 1yuf n ASN 6 N -1.50 0.00 -4.45 6.13 3.02 -1.25 -4.94 115.26 112.28 1yuf n ASN 6 Ca -0.01 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.32 1yuf n ASN 6 Cb 0.59 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.66 1yuf n ASN 6 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1yuf s ASP 7 N 1.04 2.95 -0.39 6.41 1.11 -1.26 -4.94 116.67 121.57 1yuf s ASP 7 Ca 0.00 -1.18 -0.05 0.00 0.18 0.00 0.00 52.55 51.50 1yuf s ASP 7 Cb 0.00 -0.20 0.09 0.00 1.07 0.00 0.00 42.92 43.88 1yuf s ASP 7 CO 0.00 -0.30 0.18 0.00 1.18 0.00 0.00 175.17 176.23 1yuf n PRO 9 N 4.70 -1.01 -0.33 0.00 -0.04 -1.26 -4.86 135.00 132.20 1yuf n PRO 9 Ca -0.07 -0.58 0.19 0.00 -0.04 0.00 0.00 63.50 63.00 1yuf n PRO 9 Cb 0.42 -0.46 0.36 0.00 -0.04 0.00 0.00 33.50 33.78 1yuf n PRO 9 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1yuf n ASP 10 N -3.41 0.00 -3.82 3.54 2.03 -1.26 -4.51 116.55 109.12 1yuf n ASP 10 Ca 0.05 1.64 -0.34 0.00 0.52 0.00 0.00 54.79 56.65 1yuf n ASP 10 Cb 0.18 -0.65 0.03 0.00 -0.72 0.00 0.00 41.12 39.96 1yuf n ASP 10 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1yuf n SER 11 N -5.38 -5.31 0.00 1.67 2.88 -1.26 -1.47 113.62 104.75 1yuf n SER 11 Ca 0.26 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 58.05 1yuf n SER 11 Cb 0.88 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 1yuf n SER 11 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yuf n HIS 12 N -2.19 0.00 0.00 0.66 1.44 -1.26 -4.88 115.22 108.99 1yuf n HIS 12 Ca -0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1yuf n HIS 12 Cb 0.51 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.62 1yuf n HIS 12 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1yuf n THR 13 N 0.00 0.00 0.00 0.61 -2.24 -0.54 -3.54 114.28 108.57 1yuf n THR 13 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1yuf n THR 13 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1yuf n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yuf n GLN 14 N 0.00 0.00 -0.59 -0.78 3.00 -1.26 -4.88 117.38 112.86 1yuf n GLN 14 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1yuf n GLN 14 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1yuf n GLN 14 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1yuf n PHE 15 N 0.00 0.00 -3.61 1.08 7.35 -1.23 -4.89 117.46 116.16 1yuf n PHE 15 Ca 0.00 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.57 1yuf n PHE 15 Cb 0.00 -0.42 -0.07 0.00 0.35 0.00 0.00 39.48 39.35 1yuf n PHE 15 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1yuf h PHE 17 N 3.93 0.00 -0.12 0.00 -1.00 -1.74 -3.41 116.94 114.59 1yuf h PHE 17 Ca -0.26 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.55 1yuf h PHE 17 Cb 1.16 -0.00 -0.15 0.00 3.61 0.00 0.00 35.95 40.57 1yuf h PHE 17 CO 0.34 0.47 -0.09 -1.58 -1.61 0.00 0.00 178.31 175.84 1yuf s HIS 18 N -3.96 -0.20 0.08 -0.55 5.65 -1.26 -5.06 115.29 109.98 1yuf s HIS 18 Ca -0.02 -0.06 0.00 0.00 0.25 0.00 0.00 55.06 55.22 1yuf s HIS 18 Cb 0.14 0.04 0.00 0.00 -1.18 0.00 0.00 32.58 31.58 1yuf s HIS 18 CO 0.74 -0.16 0.10 0.41 -0.65 0.00 0.00 174.74 175.18 1yuf n GLY 19 N 2.61 3.10 3.87 1.59 0.00 -1.26 -4.07 105.19 111.02 1yuf n GLY 19 Ca 0.11 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.35 1yuf n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yuf s THR 20 N -2.47 2.26 0.08 2.61 2.01 0.25 -4.84 115.64 115.54 1yuf s THR 20 Ca 0.07 0.09 0.07 0.00 0.31 0.00 0.00 61.69 62.23 1yuf s THR 20 Cb -0.00 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.47 1yuf s THR 20 CO 0.05 -0.11 -0.19 0.00 -0.69 0.00 0.00 174.62 173.67 1yuf s ARG 22 N -1.69 0.65 -0.23 0.00 0.52 0.45 -4.83 118.95 113.82 1yuf s ARG 22 Ca 0.05 0.85 -0.01 0.00 -0.52 0.00 0.00 55.73 56.11 1yuf s ARG 22 Cb -0.10 0.27 0.06 0.00 0.52 0.00 0.00 34.95 35.71 1yuf s ARG 22 CO 0.03 -0.10 -0.01 0.12 0.02 0.00 0.00 175.30 175.37 1yuf s PHE 23 N 0.56 1.87 -1.22 -0.53 5.36 -1.26 0.80 117.98 123.56 1yuf s PHE 23 Ca -0.02 -1.44 -0.20 0.00 -0.96 0.00 0.00 56.93 54.31 1yuf s PHE 23 Cb -0.05 -1.41 0.03 0.00 -0.34 0.00 0.00 43.02 41.25 1yuf s PHE 23 CO -0.03 -0.72 1.76 -1.17 -1.46 0.00 0.00 175.22 173.59 1yuf s LEU 24 N 1.57 3.58 0.30 6.12 2.96 -0.91 -3.81 118.68 128.51 1yuf s LEU 24 Ca -0.03 -2.06 0.04 0.00 -0.22 0.00 0.00 54.13 51.86 1yuf s LEU 24 Cb -0.18 -2.58 0.79 0.00 0.50 0.00 0.00 46.19 44.72 1yuf s LEU 24 CO -0.08 -1.73 1.61 1.62 -1.32 0.00 0.00 176.35 176.45 1yuf h VAL 25 N 5.95 0.15 -0.98 1.68 3.04 -1.83 1.75 116.25 126.01 1yuf h VAL 25 Ca 0.35 -0.03 0.21 0.00 -1.01 0.00 0.00 66.70 66.21 1yuf h VAL 25 Cb 0.91 0.05 -0.11 0.00 -2.01 0.00 0.00 31.29 30.13 1yuf h VAL 25 CO 1.39 0.02 0.57 0.06 -1.01 0.00 0.00 177.57 178.60 1yuf h GLN 26 N 0.09 0.63 -0.33 4.17 3.07 -1.79 0.63 115.11 121.57 1yuf h GLN 26 Ca 0.60 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 59.30 1yuf h GLN 26 Cb 1.27 -0.14 0.00 0.00 0.08 0.00 0.00 27.48 28.69 1yuf h GLN 26 CO -0.78 0.42 0.00 0.39 0.09 0.00 0.00 178.83 178.95 1yuf n GLU 27 N -4.85 2.45 -4.02 0.06 1.02 0.51 -4.95 120.64 110.87 1yuf n GLU 27 Ca 0.24 -2.22 -0.27 0.00 -0.02 0.00 0.00 57.16 54.89 1yuf n GLU 27 Cb 0.63 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.47 1yuf n GLU 27 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1yuf n ASP 28 N 1.45 0.48 -3.86 1.62 -0.08 0.33 -4.89 116.55 111.59 1yuf n ASP 28 Ca 0.18 -1.06 -0.12 0.00 -1.51 0.00 0.00 54.79 52.28 1yuf n ASP 28 Cb 0.60 -1.32 -0.14 0.00 2.34 0.00 0.00 41.12 42.59 1yuf n ASP 28 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 1yuf s LYS 29 N -6.59 -0.00 0.46 -0.67 -2.85 -1.19 -5.00 119.74 103.90 1yuf s LYS 29 Ca 0.09 0.02 -0.21 0.00 -1.00 0.00 0.00 55.97 54.87 1yuf s LYS 29 Cb -0.06 -0.02 -0.09 0.00 -2.06 0.00 0.00 37.83 35.61 1yuf s LYS 29 CO 0.83 -0.02 1.04 -1.25 0.10 0.00 0.00 175.35 176.06 1yuf s PRO 30 N 0.10 3.90 -0.30 1.78 0.04 -1.26 -2.13 135.00 137.13 1yuf s PRO 30 Ca -0.01 1.41 -0.02 0.00 0.04 0.00 0.00 61.00 62.42 1yuf s PRO 30 Cb -0.01 -2.22 0.19 0.00 0.04 0.00 0.00 34.50 32.50 1yuf s PRO 30 CO -0.00 -0.36 0.65 0.00 0.04 0.00 0.00 177.00 177.33 1yuf s ALA 31 N -1.88 -2.40 0.43 8.56 0.00 0.24 -4.92 121.76 121.79 1yuf s ALA 31 Ca 0.65 1.76 0.04 0.00 0.00 0.00 0.00 51.96 54.41 1yuf s ALA 31 Cb -0.18 -2.23 0.01 0.00 0.00 0.00 0.00 23.12 20.72 1yuf s ALA 31 CO 0.22 -1.38 0.61 0.00 0.00 0.00 0.00 175.76 175.22 1yuf s VAL 33 N -2.44 1.08 1.04 0.00 1.01 0.26 -4.87 120.40 116.49 1yuf s VAL 33 Ca 0.51 -1.78 -0.17 0.00 0.00 0.00 0.00 61.98 60.54 1yuf s VAL 33 Cb -0.10 -1.53 0.26 0.00 0.00 0.00 0.00 36.38 35.01 1yuf s VAL 33 CO 0.35 -0.59 0.75 0.00 0.00 0.00 0.00 175.10 175.61 1yuf n HIS 35 N -4.75 0.00 -0.07 0.00 -0.00 -1.26 -3.17 115.22 105.96 1yuf n HIS 35 Ca 0.11 -0.46 0.00 0.00 0.46 0.00 0.00 57.72 57.83 1yuf n HIS 35 Cb 0.46 -0.06 0.00 0.00 -0.12 0.00 0.00 29.99 30.27 1yuf n HIS 35 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 1yuf n SER 36 N -0.54 -1.04 -0.73 0.26 3.41 -1.26 -4.92 113.62 108.80 1yuf n SER 36 Ca 0.03 0.07 -0.06 0.00 -0.26 0.00 0.00 58.87 58.64 1yuf n SER 36 Cb 0.40 0.73 -0.00 0.00 -0.26 0.00 0.00 64.21 65.07 1yuf n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yuf n GLY 37 N -1.17 0.11 2.31 5.00 0.00 -1.26 -5.04 105.19 105.14 1yuf n GLY 37 Ca 0.00 -0.62 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 1yuf n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1yuf n TYR 38 N -4.00 -1.69 -0.33 1.61 4.01 -1.26 -2.90 117.16 112.60 1yuf n TYR 38 Ca -0.08 -1.34 0.00 0.00 -0.16 0.00 0.00 57.90 56.32 1yuf n TYR 38 Cb 0.56 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 1yuf n TYR 38 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1yuf n VAL 39 N -1.50 0.00 0.00 -0.72 0.31 -0.84 -4.32 118.33 111.26 1yuf n VAL 39 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1yuf n VAL 39 Cb 0.37 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.30 1yuf n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yuf n GLY 40 N 0.00 2.29 3.16 2.92 0.00 -1.26 -4.24 105.19 108.07 1yuf n GLY 40 Ca 0.00 0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 1yuf n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yuf s ALA 41 N -0.91 -0.59 0.00 4.61 0.00 -1.26 -4.82 121.76 118.78 1yuf s ALA 41 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.30 1yuf s ALA 41 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.02 1yuf s ALA 41 CO 0.00 -0.19 0.00 -2.13 0.00 0.00 0.00 175.76 173.44 1yuf n ARG 42 N 1.95 0.00 -0.94 0.00 0.63 -1.26 -2.27 116.66 114.77 1yuf n ARG 42 Ca -0.19 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.74 1yuf n ARG 42 Cb 0.57 -2.80 0.00 0.00 0.45 0.00 0.00 32.46 30.68 1yuf n ARG 42 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yuf h GLU 44 N 0.19 -0.18 -7.13 0.00 5.08 -1.68 -3.03 114.58 107.83 1yuf h GLU 44 Ca 0.00 0.01 -0.45 0.00 -1.00 0.00 0.00 59.36 57.92 1yuf h GLU 44 Cb 0.00 0.04 0.07 0.00 0.50 0.00 0.00 28.75 29.36 1yuf h GLU 44 CO 0.00 0.20 0.14 -1.01 -1.00 0.00 0.00 179.01 177.34 1yuf s HIS 45 N -4.45 2.92 -0.06 4.33 3.76 -1.26 -4.52 115.29 116.01 1yuf s HIS 45 Ca -0.15 0.31 -0.17 0.00 -0.15 0.00 0.00 55.06 54.90 1yuf s HIS 45 Cb 0.02 -3.01 0.04 0.00 1.11 0.00 0.00 32.58 30.73 1yuf s HIS 45 CO 0.60 -1.19 0.40 0.00 -0.85 0.00 0.00 174.74 173.70 1yuf s ALA 46 N -3.07 -1.02 1.00 -1.40 0.00 -1.26 -1.98 121.76 114.03 1yuf s ALA 46 Ca 0.59 0.73 -0.19 0.00 0.00 0.00 0.00 51.96 53.09 1yuf s ALA 46 Cb -0.11 -0.16 -0.13 0.00 0.00 0.00 0.00 23.12 22.73 1yuf s ALA 46 CO 0.43 -0.26 -0.77 -0.40 0.00 0.00 0.00 175.76 174.76 1yuf n ASP 47 N 1.66 -4.85 -4.16 0.00 5.75 -1.14 -4.77 116.55 109.04 1yuf n ASP 47 Ca -0.19 0.15 -0.11 0.00 -0.01 0.00 0.00 54.79 54.64 1yuf n ASP 47 Cb 0.56 -0.78 -0.10 0.00 -1.03 0.00 0.00 41.12 39.78 1yuf n ASP 47 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 1yuf s LEU 48 N 6.50 1.35 0.00 -2.12 -0.00 -1.26 -5.03 118.68 118.12 1yuf s LEU 48 Ca 0.42 -1.28 0.00 0.00 -0.00 0.00 0.00 54.13 53.27 1yuf s LEU 48 Cb -0.13 0.43 0.00 0.00 -0.00 0.00 0.00 46.19 46.49 1yuf s LEU 48 CO 0.77 -0.81 0.00 0.18 -0.00 0.00 0.00 176.35 176.49 1yuf n LEU 49 N -0.20 0.00 0.00 1.48 4.77 -1.26 -5.27 117.00 116.52 1yuf n LEU 49 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1yuf n LEU 49 Cb 0.65 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1yuf n LEU 49 CO 0.31 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.37