#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yuf h VAL 2 N 0.00 1.38 -1.08 1.55 -1.51 -2.08 -3.44 116.25 111.08 1yuf h VAL 2 Ca 0.00 -2.07 -0.77 0.00 -1.23 0.00 0.00 66.70 62.63 1yuf h VAL 2 Cb 0.00 2.05 -0.00 0.00 -2.13 0.00 0.00 31.29 31.21 1yuf h VAL 2 CO 0.00 0.62 0.99 -1.54 -1.23 0.00 0.00 177.57 176.41 1yuf n SER 3 N -3.85 1.77 0.04 4.19 3.41 -1.26 -4.75 113.62 113.17 1yuf n SER 3 Ca -0.03 0.94 0.00 0.00 -0.26 0.00 0.00 58.87 59.52 1yuf n SER 3 Cb 0.67 -1.05 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 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 6.02 -0.48 -1.79 7.33 -0.00 -1.26 -5.12 115.22 119.92 1yuf n HIS 4 Ca 0.35 0.09 0.00 0.00 -0.00 0.00 0.00 57.72 58.15 1yuf n HIS 4 Cb 0.06 0.23 0.00 0.00 -0.00 0.00 0.00 29.99 30.28 1yuf n HIS 4 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1yuf n PHE 5 N -2.93 -4.73 -3.77 1.57 7.35 -1.26 -4.96 117.46 108.73 1yuf n PHE 5 Ca 0.00 2.48 -0.13 0.00 -0.76 0.00 0.00 57.45 59.04 1yuf n PHE 5 Cb 0.00 -3.66 -0.11 0.00 0.35 0.00 0.00 39.48 36.06 1yuf n PHE 5 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1yuf s ASN 6 N -2.50 -0.32 0.22 -2.13 -0.87 -0.98 -4.86 114.94 103.50 1yuf s ASN 6 Ca 0.00 0.62 0.00 0.00 -1.57 0.00 0.00 52.86 51.91 1yuf s ASN 6 Cb 0.00 0.63 0.00 0.00 -0.02 0.00 0.00 41.25 41.86 1yuf s ASN 6 CO 0.00 -0.11 0.00 0.47 -2.57 0.00 0.00 177.10 174.89 1yuf n ASP 7 N 2.95 -1.14 -3.65 -1.22 8.00 -1.26 -4.55 116.55 115.68 1yuf n ASP 7 Ca -0.13 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.32 1yuf n ASP 7 Cb 0.58 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.61 1yuf n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yuf n PRO 9 N 1.95 -1.14 0.00 0.00 -0.04 -1.26 -5.04 135.00 129.48 1yuf n PRO 9 Ca -0.12 -0.71 0.00 0.00 -0.04 0.00 0.00 63.50 62.63 1yuf n PRO 9 Cb 0.57 -0.56 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 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 -3.51 0.09 -4.57 3.54 2.03 -1.26 -4.84 116.55 108.03 1yuf n ASP 10 Ca 0.06 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.20 1yuf n ASP 10 Cb 0.22 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.51 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 -2.52 1.70 -1.81 1.67 2.88 -1.26 -4.44 113.62 109.83 1yuf n SER 11 Ca 0.00 -2.53 0.00 0.00 -1.33 0.00 0.00 58.87 55.01 1yuf n SER 11 Cb 0.11 -1.73 0.00 0.00 -0.75 0.00 0.00 64.21 61.84 1yuf n SER 11 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1yuf n HIS 12 N 18.86 -4.67 0.00 0.66 8.25 -1.26 -5.02 115.22 132.03 1yuf n HIS 12 Ca 0.42 2.43 0.00 0.00 -0.26 0.00 0.00 57.72 60.31 1yuf n HIS 12 Cb 0.47 -3.62 0.00 0.00 1.12 0.00 0.00 29.99 27.96 1yuf n HIS 12 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1yuf n THR 13 N 0.49 0.00 0.35 1.59 5.66 -1.26 -4.92 114.28 116.20 1yuf n THR 13 Ca 0.00 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.11 1yuf n THR 13 Cb 0.00 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 68.63 1yuf n THR 13 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yuf n GLN 14 N 0.00 0.43 -2.98 1.09 0.00 -1.26 -4.59 117.38 110.07 1yuf n GLN 14 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 57.00 56.87 1yuf n GLN 14 Cb 0.00 -1.51 -0.01 0.00 0.00 0.00 0.00 30.24 28.72 1yuf n GLN 14 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 1yuf n PHE 15 N -1.98 -0.63 -3.63 2.61 -1.74 -1.26 -4.60 117.46 106.23 1yuf n PHE 15 Ca -0.01 0.37 -0.05 0.00 -0.56 0.00 0.00 57.45 57.20 1yuf n PHE 15 Cb 0.48 -1.40 -0.06 0.00 1.52 0.00 0.00 39.48 40.01 1yuf n PHE 15 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1yuf n PHE 17 N 4.22 0.06 -2.75 0.00 -0.00 0.01 -4.67 117.46 114.33 1yuf n PHE 17 Ca -0.18 0.02 -0.02 0.00 -0.00 0.00 0.00 57.45 57.26 1yuf n PHE 17 Cb 0.57 -0.26 0.02 0.00 -0.00 0.00 0.00 39.48 39.82 1yuf n PHE 17 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.76 173.38 1yuf s HIS 18 N -3.03 -0.77 0.02 -5.13 -3.43 -0.75 -4.93 115.29 97.26 1yuf s HIS 18 Ca 0.10 -0.19 -0.28 0.00 -0.80 0.00 0.00 55.06 53.89 1yuf s HIS 18 Cb 0.17 0.15 0.10 0.00 -1.43 0.00 0.00 32.58 31.56 1yuf s HIS 18 CO 0.74 -0.59 0.94 0.20 -2.00 0.00 0.00 174.74 174.03 1yuf s GLY 19 N 1.15 -0.40 -0.16 -1.38 0.00 -1.26 -1.06 107.32 104.21 1yuf s GLY 19 Ca 0.23 0.84 -0.29 0.00 0.00 0.00 0.00 44.72 45.50 1yuf s GLY 19 CO -0.09 0.26 1.23 -1.59 0.00 0.00 0.00 173.10 172.91 1yuf s THR 20 N -3.08 4.32 0.12 0.90 2.01 0.37 -4.81 115.64 115.47 1yuf s THR 20 Ca 0.07 1.60 -0.29 0.00 0.31 0.00 0.00 61.69 63.39 1yuf s THR 20 Cb -0.01 -4.03 -0.06 0.00 0.01 0.00 0.00 72.50 68.40 1yuf s THR 20 CO -0.06 -0.13 0.92 0.00 -0.69 0.00 0.00 174.62 174.67 1yuf s ARG 22 N -0.23 0.39 -0.45 0.00 0.52 -0.50 -4.84 118.95 113.83 1yuf s ARG 22 Ca 0.44 0.09 -0.15 0.00 -0.52 0.00 0.00 55.73 55.59 1yuf s ARG 22 Cb -0.23 -0.40 0.05 0.00 0.52 0.00 0.00 34.95 34.89 1yuf s ARG 22 CO 0.29 -1.01 0.37 0.12 0.02 0.00 0.00 175.30 175.09 1yuf s PHE 23 N 2.50 3.24 -1.07 -0.53 5.36 -1.19 -1.56 117.98 124.73 1yuf s PHE 23 Ca 0.10 -0.78 -0.23 0.00 -0.96 0.00 0.00 56.93 55.05 1yuf s PHE 23 Cb -0.13 -2.97 -0.12 0.00 -0.34 0.00 0.00 43.02 39.46 1yuf s PHE 23 CO -0.30 -0.73 1.94 1.28 -1.46 0.00 0.00 175.22 175.95 1yuf n LEU 24 N 5.22 3.07 -0.33 6.12 4.32 -0.71 -2.31 117.00 132.39 1yuf n LEU 24 Ca -0.12 -3.03 0.26 0.00 -0.02 0.00 0.00 56.01 53.10 1yuf n LEU 24 Cb 0.45 -1.59 0.50 0.00 -1.62 0.00 0.00 43.42 41.16 1yuf n LEU 24 CO 0.45 -1.70 1.07 1.62 -1.22 0.00 0.00 177.39 177.61 1yuf h VAL 25 N 5.85 0.17 -0.99 4.08 3.04 -1.84 2.08 116.25 128.64 1yuf h VAL 25 Ca 0.24 -0.06 0.20 0.00 -1.01 0.00 0.00 66.70 66.07 1yuf h VAL 25 Cb 0.89 -0.02 -0.11 0.00 -2.01 0.00 0.00 31.29 30.03 1yuf h VAL 25 CO 1.37 0.03 0.59 1.56 -1.01 0.00 0.00 177.57 180.10 1yuf h GLN 26 N 0.18 0.67 -0.26 4.17 1.08 -1.90 0.64 115.11 119.68 1yuf h GLN 26 Ca 0.76 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.92 1yuf h GLN 26 Cb 1.84 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 29.12 1yuf h GLN 26 CO -0.69 0.44 0.00 0.39 -0.95 0.00 0.00 178.83 178.03 1yuf n GLU 27 N -4.82 2.83 -4.09 1.46 -0.58 0.54 -4.97 120.64 111.01 1yuf n GLU 27 Ca 0.24 -1.90 -0.31 0.00 -0.42 0.00 0.00 57.16 54.77 1yuf n GLU 27 Cb 0.61 -1.21 -0.08 0.00 -0.57 0.00 0.00 31.44 30.20 1yuf n GLU 27 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1yuf n ASP 28 N 0.29 -0.18 -4.20 1.62 2.03 0.58 -4.89 116.55 111.80 1yuf n ASP 28 Ca 0.09 -1.09 -0.31 0.00 0.52 0.00 0.00 54.79 54.00 1yuf n ASP 28 Cb 0.38 -1.37 -0.17 0.00 -0.72 0.00 0.00 41.12 39.24 1yuf n ASP 28 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1yuf s LYS 29 N -6.60 2.82 0.15 -0.67 1.02 -1.14 -4.97 119.74 110.36 1yuf s LYS 29 Ca 0.30 -0.82 -0.30 0.00 0.02 0.00 0.00 55.97 55.17 1yuf s LYS 29 Cb -0.18 -2.17 -0.07 0.00 -0.52 0.00 0.00 37.83 34.89 1yuf s LYS 29 CO 0.87 0.18 1.13 -1.25 -0.92 0.00 0.00 175.35 175.36 1yuf s PRO 30 N 0.32 4.55 -0.29 -1.68 0.04 -1.26 -1.74 135.00 134.94 1yuf s PRO 30 Ca -0.17 1.74 0.04 0.00 0.04 0.00 0.00 61.00 62.65 1yuf s PRO 30 Cb -0.17 -3.29 0.20 0.00 0.04 0.00 0.00 34.50 31.28 1yuf s PRO 30 CO 0.08 -0.01 0.61 0.00 0.04 0.00 0.00 177.00 177.72 1yuf s ALA 31 N 0.03 -2.42 -0.18 8.56 0.00 -0.60 -4.86 121.76 122.28 1yuf s ALA 31 Ca 0.51 1.22 -0.04 0.00 0.00 0.00 0.00 51.96 53.66 1yuf s ALA 31 Cb -0.30 -2.48 -0.02 0.00 0.00 0.00 0.00 23.12 20.33 1yuf s ALA 31 CO 0.34 -1.74 -0.04 0.00 0.00 0.00 0.00 175.76 174.32 1yuf s VAL 33 N 0.88 4.12 0.87 0.00 1.01 0.59 -4.76 120.40 123.10 1yuf s VAL 33 Ca -0.01 1.13 -0.17 0.00 0.00 0.00 0.00 61.98 62.93 1yuf s VAL 33 Cb -0.15 -4.52 -0.15 0.00 0.00 0.00 0.00 36.38 31.56 1yuf s VAL 33 CO 0.01 -0.98 -0.62 0.00 0.00 0.00 0.00 175.10 173.52 1yuf s HIS 35 N -2.00 3.41 0.61 0.00 3.76 -0.22 -4.32 115.29 116.52 1yuf s HIS 35 Ca 0.45 -1.71 -0.15 0.00 -0.15 0.00 0.00 55.06 53.49 1yuf s HIS 35 Cb -0.27 -3.65 -0.13 0.00 1.11 0.00 0.00 32.58 29.64 1yuf s HIS 35 CO 0.78 -1.00 -0.34 -1.13 -0.85 0.00 0.00 174.74 172.21 1yuf n SER 36 N 4.81 -4.03 -0.07 1.40 3.41 -1.26 -4.21 113.62 113.67 1yuf n SER 36 Ca -0.06 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1yuf n SER 36 Cb 0.41 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 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 2.54 1.05 0.00 5.00 0.00 -1.26 -5.08 105.19 107.44 1yuf n GLY 37 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1yuf n GLY 37 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1yuf n TYR 38 N -0.47 0.00 0.00 1.61 4.11 -1.26 -4.63 117.16 116.52 1yuf n TYR 38 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1yuf n TYR 38 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.42 1yuf n TYR 38 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.86 177.14 1yuf n VAL 39 N 0.00 0.00 0.00 -3.48 0.31 0.18 -3.68 118.33 111.66 1yuf n VAL 39 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1yuf n VAL 39 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 5.00 2.56 5.75 2.92 0.00 -1.25 -4.97 105.19 115.20 1yuf n GLY 40 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1yuf n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yuf n ALA 41 N -3.00 0.00 -1.35 4.61 0.00 -1.26 -1.72 120.51 117.79 1yuf n ALA 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yuf n ALA 41 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yuf n ALA 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1yuf n ARG 42 N 0.00 0.12 -2.43 0.00 3.00 -1.26 -4.99 116.66 111.10 1yuf n ARG 42 Ca 0.00 -0.77 -0.04 0.00 -0.01 0.00 0.00 57.85 57.03 1yuf n ARG 42 Cb 0.00 -0.54 0.02 0.00 0.00 0.00 0.00 32.46 31.94 1yuf n ARG 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1yuf n GLU 44 N -1.67 2.52 -4.05 0.00 0.28 -1.25 -0.81 120.64 115.65 1yuf n GLU 44 Ca -0.05 0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.62 1yuf n GLU 44 Cb 0.53 -1.07 -0.07 0.00 1.43 0.00 0.00 31.44 32.27 1yuf n GLU 44 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 1yuf s HIS 45 N -2.06 3.36 -0.07 -1.84 3.76 -1.26 -4.95 115.29 112.22 1yuf s HIS 45 Ca -0.02 0.26 -0.02 0.00 -0.15 0.00 0.00 55.06 55.12 1yuf s HIS 45 Cb 0.01 -1.77 0.04 0.00 1.11 0.00 0.00 32.58 31.96 1yuf s HIS 45 CO 0.10 0.58 0.05 0.00 -0.85 0.00 0.00 174.74 174.62 1yuf s ALA 46 N -1.20 0.42 0.92 -1.40 0.00 -1.26 0.51 121.76 119.75 1yuf s ALA 46 Ca 0.23 -0.01 -0.13 0.00 0.00 0.00 0.00 51.96 52.05 1yuf s ALA 46 Cb -0.12 -0.74 0.02 0.00 0.00 0.00 0.00 23.12 22.28 1yuf s ALA 46 CO 0.14 -0.61 0.37 -3.47 0.00 0.00 0.00 175.76 172.19 1yuf n ASP 47 N 5.24 -2.16 -0.04 0.00 2.03 -1.24 -4.74 116.55 115.64 1yuf n ASP 47 Ca -0.05 0.35 0.01 0.00 0.52 0.00 0.00 54.79 55.63 1yuf n ASP 47 Cb 0.50 -1.19 -0.00 0.00 -0.72 0.00 0.00 41.12 39.71 1yuf n ASP 47 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1yuf n LEU 48 N -0.97 0.61 -2.13 -2.67 -0.00 -1.26 -4.78 117.00 105.79 1yuf n LEU 48 Ca 0.07 -0.73 -0.03 0.00 -0.00 0.00 0.00 56.01 55.31 1yuf n LEU 48 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 1yuf n LEU 48 CO 0.51 0.14 0.05 0.18 -0.00 0.00 0.00 177.39 178.27 1yuf n LEU 49 N -0.50 -4.60 0.00 1.47 4.77 -1.26 -5.24 117.00 111.64 1yuf n LEU 49 Ca 0.01 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1yuf n LEU 49 Cb 0.04 -2.08 0.00 0.00 -2.33 0.00 0.00 43.42 39.05 1yuf n LEU 49 CO 0.03 -0.96 0.19 0.00 -1.33 0.00 0.00 177.39 175.32