#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 0.16 -0.93 1.55 0.31 -1.26 -5.08 118.33 113.09 1yuf n VAL 2 Ca 0.00 0.05 -0.35 0.00 -0.01 0.00 0.00 64.34 64.04 1yuf n VAL 2 Cb 0.00 -1.20 0.07 0.00 -0.91 0.00 0.00 33.84 31.79 1yuf n VAL 2 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1yuf n SER 3 N -2.97 -4.68 0.00 4.52 7.64 -1.26 -5.01 113.62 111.86 1yuf n SER 3 Ca 0.00 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.11 1yuf n SER 3 Cb 0.28 -0.92 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 1yuf n SER 3 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1yuf n HIS 4 N -2.88 0.00 -3.93 1.43 -0.00 -1.26 -4.91 115.22 103.67 1yuf n HIS 4 Ca 0.01 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.39 1yuf n HIS 4 Cb 0.55 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 30.48 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 -0.04 -1.03 -3.71 -1.40 7.35 -0.39 -4.82 117.46 113.42 1yuf n PHE 5 Ca 0.00 0.54 -0.09 0.00 -0.76 0.00 0.00 57.45 57.14 1yuf n PHE 5 Cb 0.00 -1.51 -0.02 0.00 0.35 0.00 0.00 39.48 38.29 1yuf n PHE 5 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1yuf s ASN 6 N -2.81 -0.35 -0.85 -2.13 3.04 -1.26 -4.76 114.94 105.82 1yuf s ASN 6 Ca 0.66 -0.41 0.00 0.00 0.04 0.00 0.00 52.86 53.15 1yuf s ASN 6 Cb -0.38 0.66 0.00 0.00 -1.54 0.00 0.00 41.25 39.99 1yuf s ASN 6 CO 0.80 -1.18 0.00 0.47 -3.04 0.00 0.00 177.10 174.16 1yuf n ASP 7 N -0.41 -2.50 -3.66 -4.21 9.92 -1.26 -4.87 116.55 109.56 1yuf n ASP 7 Ca -0.09 0.24 -0.21 0.00 -0.53 0.00 0.00 54.79 54.19 1yuf n ASP 7 Cb 0.62 -2.38 0.17 0.00 -0.64 0.00 0.00 41.12 38.88 1yuf n ASP 7 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1yuf n PRO 9 N -2.25 -0.26 -2.98 0.00 -0.04 -1.26 -4.97 135.00 123.24 1yuf n PRO 9 Ca 0.06 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.15 1yuf n PRO 9 Cb 0.42 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.87 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 -2.52 5.86 0.00 3.54 2.03 -1.26 -4.75 116.55 119.46 1yuf n ASP 10 Ca 0.00 -3.54 0.00 0.00 0.52 0.00 0.00 54.79 51.77 1yuf n ASP 10 Cb 0.00 -1.02 0.00 0.00 -0.72 0.00 0.00 41.12 39.38 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 0.62 0.00 -0.39 1.67 2.88 -1.26 -4.80 113.62 112.34 1yuf n SER 11 Ca 0.33 0.00 0.38 0.00 -1.33 0.00 0.00 58.87 58.25 1yuf n SER 11 Cb 0.34 0.00 0.65 0.00 -0.75 0.00 0.00 64.21 64.45 1yuf n SER 11 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 1yuf h HIS 12 N 0.00 0.00 0.00 0.66 3.86 -1.93 1.83 115.15 119.58 1yuf h HIS 12 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1yuf h HIS 12 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1yuf h HIS 12 CO 0.00 0.00 0.00 -2.37 0.86 0.00 0.00 177.93 176.42 1yuf n THR 13 N -3.66 0.00 0.31 2.45 5.66 -1.26 -3.97 114.28 113.82 1yuf n THR 13 Ca 0.30 0.78 0.07 0.00 -3.05 0.00 0.00 64.05 62.16 1yuf n THR 13 Cb 1.61 -1.45 0.11 0.00 -1.55 0.00 0.00 70.33 69.06 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 -0.47 1.72 -1.61 1.09 -0.00 -0.94 -4.71 117.38 112.46 1yuf n GLN 14 Ca 0.00 -1.70 0.00 0.00 -0.00 0.00 0.00 57.00 55.30 1yuf n GLN 14 Cb 0.00 -1.31 0.00 0.00 -0.00 0.00 0.00 30.24 28.93 1yuf n GLN 14 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1yuf n PHE 15 N 0.85 -2.85 -4.08 2.61 3.72 0.62 -4.95 117.46 113.38 1yuf n PHE 15 Ca 0.11 1.71 -0.10 0.00 -0.05 0.00 0.00 57.45 59.12 1yuf n PHE 15 Cb 0.42 -3.04 -0.07 0.00 -0.94 0.00 0.00 39.48 35.85 1yuf n PHE 15 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yuf n PHE 17 N -0.34 0.00 -2.68 0.00 3.01 -1.18 -4.91 117.46 111.36 1yuf n PHE 17 Ca -0.00 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.43 1yuf n PHE 17 Cb 0.64 -0.35 0.03 0.00 -0.01 0.00 0.00 39.48 39.79 1yuf n PHE 17 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1yuf s HIS 18 N -2.63 -0.32 0.24 1.38 2.46 -1.25 -4.96 115.29 110.21 1yuf s HIS 18 Ca -0.05 -0.10 -0.20 0.00 0.47 0.00 0.00 55.06 55.18 1yuf s HIS 18 Cb 0.06 0.06 0.03 0.00 -0.13 0.00 0.00 32.58 32.60 1yuf s HIS 18 CO 0.47 -0.25 0.64 0.20 -2.47 0.00 0.00 174.74 173.33 1yuf s GLY 19 N 1.05 -0.14 -0.06 1.59 0.00 -1.26 -3.08 107.32 105.43 1yuf s GLY 19 Ca 0.23 -0.19 -0.30 0.00 0.00 0.00 0.00 44.72 44.46 1yuf s GLY 19 CO -0.11 -0.12 1.23 -1.59 0.00 0.00 0.00 173.10 172.51 1yuf s THR 20 N -3.89 4.20 0.28 0.90 2.01 0.52 -4.79 115.64 114.87 1yuf s THR 20 Ca 0.10 1.52 -0.24 0.00 0.31 0.00 0.00 61.69 63.38 1yuf s THR 20 Cb -0.04 -3.98 -0.09 0.00 0.01 0.00 0.00 72.50 68.40 1yuf s THR 20 CO 0.02 -0.01 0.87 0.00 -0.69 0.00 0.00 174.62 174.81 1yuf s ARG 22 N -1.97 0.50 -0.44 0.00 0.52 -0.31 -4.86 118.95 112.38 1yuf s ARG 22 Ca 0.47 0.89 -0.11 0.00 -0.52 0.00 0.00 55.73 56.46 1yuf s ARG 22 Cb -0.18 0.49 0.08 0.00 0.52 0.00 0.00 34.95 35.86 1yuf s ARG 22 CO 0.23 -0.53 0.31 0.12 0.02 0.00 0.00 175.30 175.45 1yuf s PHE 23 N 2.88 3.31 -0.59 -0.53 2.19 -1.26 -2.21 117.98 121.77 1yuf s PHE 23 Ca 0.16 -1.37 -0.22 0.00 0.33 0.00 0.00 56.93 55.83 1yuf s PHE 23 Cb -0.14 -3.09 -0.19 0.00 -1.31 0.00 0.00 43.02 38.29 1yuf s PHE 23 CO -0.19 -0.85 1.84 -0.11 1.83 0.00 0.00 175.22 177.74 1yuf n LEU 24 N 5.01 3.35 -0.33 6.12 -0.00 -0.84 -1.26 117.00 129.06 1yuf n LEU 24 Ca -0.11 -2.53 0.23 0.00 -0.00 0.00 0.00 56.01 53.61 1yuf n LEU 24 Cb 0.43 -0.96 0.44 0.00 -0.00 0.00 0.00 43.42 43.33 1yuf n LEU 24 CO 0.42 -0.67 0.97 1.62 -0.00 0.00 0.00 177.39 179.73 1yuf h VAL 25 N 4.49 0.09 -0.94 1.96 3.04 -1.90 1.74 116.25 124.73 1yuf h VAL 25 Ca 0.38 -0.03 0.29 0.00 -1.01 0.00 0.00 66.70 66.33 1yuf h VAL 25 Cb 0.61 0.01 -0.16 0.00 -2.01 0.00 0.00 31.29 29.74 1yuf h VAL 25 CO 1.91 0.01 0.28 1.56 -1.01 0.00 0.00 177.57 180.33 1yuf h GLN 26 N 0.08 0.14 -0.05 4.17 4.20 -1.91 0.24 115.11 121.99 1yuf h GLN 26 Ca 0.72 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.42 1yuf h GLN 26 Cb 1.70 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.45 1yuf h GLN 26 CO -0.78 0.09 0.00 0.39 -0.67 0.00 0.00 178.83 177.87 1yuf n GLU 27 N -5.27 2.36 -3.76 1.46 1.02 0.38 -5.01 120.64 111.83 1yuf n GLU 27 Ca 0.26 -2.02 -0.27 0.00 -0.02 0.00 0.00 57.16 55.11 1yuf n GLU 27 Cb 0.84 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 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 -0.76 -4.10 -3.76 1.62 -0.08 0.50 -4.94 116.55 105.02 1yuf n ASP 28 Ca 0.08 -0.95 -0.23 0.00 -1.51 0.00 0.00 54.79 52.18 1yuf n ASP 28 Cb 0.45 -1.41 -0.17 0.00 2.34 0.00 0.00 41.12 42.32 1yuf n ASP 28 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1yuf s LYS 29 N -5.26 0.59 0.08 -0.67 -0.14 -1.14 -4.97 119.74 108.23 1yuf s LYS 29 Ca 0.10 0.07 -0.30 0.00 -1.36 0.00 0.00 55.97 54.48 1yuf s LYS 29 Cb -0.06 -1.06 -0.06 0.00 -1.68 0.00 0.00 37.83 34.98 1yuf s LYS 29 CO 0.82 -0.33 1.16 -1.25 -0.76 0.00 0.00 175.35 174.98 1yuf s PRO 30 N 1.97 4.48 -0.28 -1.68 0.04 -1.26 -1.98 135.00 136.29 1yuf s PRO 30 Ca 0.05 1.72 -0.18 0.00 0.04 0.00 0.00 61.00 62.63 1yuf s PRO 30 Cb -0.13 -3.34 0.10 0.00 0.04 0.00 0.00 34.50 31.17 1yuf s PRO 30 CO -0.05 -0.17 0.80 0.00 0.04 0.00 0.00 177.00 177.61 1yuf s ALA 31 N 0.79 -1.98 -0.04 8.56 0.00 -0.94 -4.62 121.76 123.54 1yuf s ALA 31 Ca 0.56 2.28 0.02 0.00 0.00 0.00 0.00 51.96 54.81 1yuf s ALA 31 Cb -0.29 -1.47 0.02 0.00 0.00 0.00 0.00 23.12 21.38 1yuf s ALA 31 CO 0.30 -0.35 -0.07 0.00 0.00 0.00 0.00 175.76 175.64 1yuf s VAL 33 N 0.66 4.65 0.00 0.00 1.01 0.21 -4.74 120.40 122.19 1yuf s VAL 33 Ca -0.10 0.98 0.00 0.00 0.00 0.00 0.00 61.98 62.86 1yuf s VAL 33 Cb -0.13 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1yuf s VAL 33 CO 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 175.10 174.18 1yuf n HIS 35 N -2.89 0.00 -0.77 0.00 -0.00 -1.18 -2.97 115.22 107.42 1yuf n HIS 35 Ca 0.00 0.00 -0.24 0.00 0.46 0.00 0.00 57.72 57.94 1yuf n HIS 35 Cb 0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 29.85 1yuf n HIS 35 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1yuf n SER 36 N -0.35 4.54 -3.73 0.26 7.64 -1.26 -4.47 113.62 116.25 1yuf n SER 36 Ca 0.00 -2.35 -0.30 0.00 1.01 0.00 0.00 58.87 57.22 1yuf n SER 36 Cb 0.00 -1.09 -0.06 0.00 -1.01 0.00 0.00 64.21 62.06 1yuf n SER 36 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yuf n GLY 37 N 3.86 -0.27 0.00 0.23 0.00 -1.26 -4.85 105.19 102.90 1yuf n GLY 37 Ca 0.44 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.52 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 -3.14 -0.39 0.00 1.61 4.01 -1.26 -3.86 117.16 114.12 1yuf n TYR 38 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1yuf n TYR 38 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.38 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 -0.39 0.00 0.04 -0.72 0.31 -0.51 -4.10 118.33 112.97 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 3.28 -0.47 0.00 2.92 0.00 -1.26 -4.78 105.19 104.88 1yuf n GLY 40 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.72 0.00 0.84 4.61 0.00 -1.26 -3.60 120.51 118.37 1yuf n ALA 41 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 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 -0.02 0.11 -2.52 0.00 1.74 -1.26 -4.95 116.66 109.76 1yuf n ARG 42 Ca 0.00 -0.01 -0.20 0.00 -0.77 0.00 0.00 57.85 56.86 1yuf n ARG 42 Cb 0.00 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 1yuf n ARG 42 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yuf n GLU 44 N -3.15 0.67 -3.06 0.00 0.28 -1.26 -3.78 120.64 110.34 1yuf n GLU 44 Ca -0.21 0.23 -0.24 0.00 -0.16 0.00 0.00 57.16 56.78 1yuf n GLU 44 Cb 0.66 -1.71 0.00 0.00 1.43 0.00 0.00 31.44 31.83 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 -2.56 3.36 -0.45 -1.84 3.76 -1.26 -4.92 115.29 111.38 1yuf s HIS 45 Ca -0.12 0.35 -0.14 0.00 -0.15 0.00 0.00 55.06 55.01 1yuf s HIS 45 Cb 0.07 -2.18 0.07 0.00 1.11 0.00 0.00 32.58 31.66 1yuf s HIS 45 CO 0.80 -0.19 0.35 0.00 -0.85 0.00 0.00 174.74 174.84 1yuf s ALA 46 N -2.51 3.48 1.00 -1.40 0.00 -1.26 -1.42 121.76 119.64 1yuf s ALA 46 Ca 0.45 -2.10 -0.18 0.00 0.00 0.00 0.00 51.96 50.13 1yuf s ALA 46 Cb -0.10 -2.94 -0.13 0.00 0.00 0.00 0.00 23.12 19.95 1yuf s ALA 46 CO 0.38 -1.69 -0.75 -0.40 0.00 0.00 0.00 175.76 173.30 1yuf n ASP 47 N 5.12 -5.29 -4.97 0.00 5.75 -1.25 -4.86 116.55 111.05 1yuf n ASP 47 Ca -0.12 0.17 -0.23 0.00 -0.01 0.00 0.00 54.79 54.61 1yuf n ASP 47 Cb 0.44 -0.78 0.03 0.00 -1.03 0.00 0.00 41.12 39.77 1yuf n ASP 47 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1yuf s LEU 48 N 6.95 2.93 -0.37 -2.12 2.01 -1.26 -4.96 118.68 121.85 1yuf s LEU 48 Ca 0.42 -1.03 0.02 0.00 0.01 0.00 0.00 54.13 53.54 1yuf s LEU 48 Cb -0.15 -1.45 0.29 0.00 0.01 0.00 0.00 46.19 44.89 1yuf s LEU 48 CO 0.79 -1.20 1.22 -0.11 1.01 0.00 0.00 176.35 178.06 1yuf n LEU 49 N -1.98 -1.65 0.00 1.79 7.94 -1.26 -5.17 117.00 116.67 1yuf n LEU 49 Ca 0.07 -2.25 0.00 0.00 -1.11 0.00 0.00 56.01 52.71 1yuf n LEU 49 Cb 0.63 0.77 0.00 0.00 0.53 0.00 0.00 43.42 45.34 1yuf n LEU 49 CO 0.39 1.70 0.00 0.00 -1.11 0.00 0.00 177.39 178.38