#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 -0.92 3.34 3.14 -1.26 -4.48 118.33 118.15 1yuf n VAL 2 Ca 0.00 0.00 -0.30 0.00 -2.96 0.00 0.00 64.34 61.08 1yuf n VAL 2 Cb 0.00 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 32.80 1yuf n VAL 2 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1yuf n SER 3 N 1.28 -3.89 -0.29 6.55 2.88 -1.26 -4.53 113.62 114.37 1yuf n SER 3 Ca 0.00 0.35 0.01 0.00 -1.33 0.00 0.00 58.87 57.90 1yuf n SER 3 Cb 0.00 -0.65 -0.00 0.00 -0.75 0.00 0.00 64.21 62.80 1yuf n SER 3 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yuf n HIS 4 N -1.60 -1.48 -3.12 0.66 -0.00 -1.26 -4.61 115.22 103.80 1yuf n HIS 4 Ca 0.03 0.09 -0.39 0.00 -0.00 0.00 0.00 57.72 57.45 1yuf n HIS 4 Cb 0.42 -0.10 -0.06 0.00 -0.00 0.00 0.00 29.99 30.25 1yuf n HIS 4 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 1yuf s PHE 5 N -0.24 3.84 0.00 -1.40 -0.71 -1.21 -3.65 117.98 114.61 1yuf s PHE 5 Ca 0.00 1.46 0.00 0.00 -1.04 0.00 0.00 56.93 57.35 1yuf s PHE 5 Cb 0.00 -2.64 0.00 0.00 -1.21 0.00 0.00 43.02 39.17 1yuf s PHE 5 CO 0.00 0.53 0.00 0.27 -1.34 0.00 0.00 175.22 174.68 1yuf n ASN 6 N 1.55 0.00 -0.30 1.98 6.94 -1.26 -4.66 115.26 119.50 1yuf n ASN 6 Ca -0.07 0.00 0.14 0.00 -0.02 0.00 0.00 54.58 54.62 1yuf n ASN 6 Cb 0.50 0.00 0.63 0.00 -2.36 0.00 0.00 39.78 38.55 1yuf n ASN 6 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1yuf n ASP 7 N 0.00 0.93 -4.14 0.53 8.00 -1.26 -4.88 116.55 115.73 1yuf n ASP 7 Ca 0.00 -1.37 -0.33 0.00 0.71 0.00 0.00 54.79 53.80 1yuf n ASP 7 Cb 0.00 -0.02 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 1yuf n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yuf s PRO 9 N -7.11 4.62 0.00 0.00 0.04 -1.26 -4.21 135.00 127.08 1yuf s PRO 9 Ca 0.13 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.93 1yuf s PRO 9 Cb -0.07 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1yuf s PRO 9 CO 0.96 0.15 0.00 -0.40 0.04 0.00 0.00 177.00 177.75 1yuf n ASP 10 N 1.76 0.00 -1.73 6.66 5.68 -1.26 -5.02 116.55 122.65 1yuf n ASP 10 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.30 1yuf n ASP 10 Cb 0.45 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 1yuf n ASP 10 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1yuf n SER 11 N 0.00 -9.22 0.00 -1.12 2.88 -1.26 -4.68 113.62 100.22 1yuf n SER 11 Ca 0.00 1.34 0.00 0.00 -1.33 0.00 0.00 58.87 58.88 1yuf n SER 11 Cb 0.00 -5.22 0.00 0.00 -0.75 0.00 0.00 64.21 58.24 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 -0.69 0.00 0.00 0.66 8.25 -1.26 -4.92 115.22 117.26 1yuf n HIS 12 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1yuf n HIS 12 Cb 0.00 -0.60 0.00 0.00 1.12 0.00 0.00 29.99 30.51 1yuf n HIS 12 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1yuf n THR 13 N -2.60 0.00 0.00 1.59 -2.24 -1.26 -1.72 114.28 108.04 1yuf n THR 13 Ca 0.00 1.06 0.00 0.00 -2.27 0.00 0.00 64.05 62.84 1yuf n THR 13 Cb 0.14 -1.43 0.00 0.00 -2.10 0.00 0.00 70.33 66.94 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 -2.48 0.00 -1.01 -0.78 6.02 -1.26 -4.71 117.38 113.16 1yuf n GLN 14 Ca 0.00 0.85 -0.00 0.00 -0.01 0.00 0.00 57.00 57.83 1yuf n GLN 14 Cb 0.00 -1.47 -0.00 0.00 1.02 0.00 0.00 30.24 29.79 1yuf n GLN 14 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1yuf n PHE 15 N -2.64 0.00 -3.67 1.08 7.35 -0.70 -4.52 117.46 114.36 1yuf n PHE 15 Ca 0.00 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.55 1yuf n PHE 15 Cb 0.00 -1.31 -0.13 0.00 0.35 0.00 0.00 39.48 38.38 1yuf n PHE 15 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1yuf n PHE 17 N 5.22 0.00 -2.70 0.00 3.72 -1.26 -3.89 117.46 118.56 1yuf n PHE 17 Ca -0.08 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.26 1yuf n PHE 17 Cb 0.50 -0.09 0.08 0.00 -0.94 0.00 0.00 39.48 39.02 1yuf n PHE 17 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1yuf n HIS 18 N -1.09 -1.64 -3.92 1.38 8.25 -0.96 -4.92 115.22 112.31 1yuf n HIS 18 Ca 0.13 -1.19 -0.01 0.00 -0.26 0.00 0.00 57.72 56.39 1yuf n HIS 18 Cb 0.10 1.32 0.02 0.00 1.12 0.00 0.00 29.99 32.54 1yuf n HIS 18 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1yuf s GLY 19 N -0.80 0.03 0.66 -1.41 0.00 -1.25 -2.11 107.32 102.44 1yuf s GLY 19 Ca 0.26 -0.20 -0.03 0.00 0.00 0.00 0.00 44.72 44.75 1yuf s GLY 19 CO -0.15 3.61 0.93 -1.59 0.00 0.00 0.00 173.10 175.91 1yuf s THR 20 N -2.10 2.38 0.06 0.90 2.01 0.55 -4.74 115.64 114.69 1yuf s THR 20 Ca 0.25 -0.48 0.07 0.00 0.31 0.00 0.00 61.69 61.84 1yuf s THR 20 Cb -0.02 -2.90 -0.03 0.00 0.01 0.00 0.00 72.50 69.56 1yuf s THR 20 CO 0.03 0.00 -0.19 0.00 -0.69 0.00 0.00 174.62 173.77 1yuf s ARG 22 N -1.42 0.38 -0.18 0.00 3.52 -0.34 -4.81 118.95 116.12 1yuf s ARG 22 Ca 0.05 1.01 -0.05 0.00 -0.13 0.00 0.00 55.73 56.62 1yuf s ARG 22 Cb -0.09 0.27 0.06 0.00 -1.56 0.00 0.00 34.95 33.63 1yuf s ARG 22 CO 0.02 -0.22 0.10 0.12 -0.81 0.00 0.00 175.30 174.52 1yuf s PHE 23 N 2.25 0.15 -1.26 5.12 5.36 -1.26 -0.17 117.98 128.17 1yuf s PHE 23 Ca -0.05 -0.27 -0.20 0.00 -0.96 0.00 0.00 56.93 55.46 1yuf s PHE 23 Cb -0.11 -0.66 0.01 0.00 -0.34 0.00 0.00 43.02 41.92 1yuf s PHE 23 CO -0.14 -0.53 1.81 -0.11 -1.46 0.00 0.00 175.22 174.80 1yuf n LEU 24 N 5.28 4.28 -0.33 6.12 7.94 -1.03 -3.32 117.00 135.95 1yuf n LEU 24 Ca -0.07 -3.65 0.28 0.00 -1.11 0.00 0.00 56.01 51.46 1yuf n LEU 24 Cb 0.49 -1.74 0.53 0.00 0.53 0.00 0.00 43.42 43.22 1yuf n LEU 24 CO 0.10 -0.56 1.06 1.62 -1.11 0.00 0.00 177.39 178.49 1yuf h VAL 25 N 5.76 0.10 -0.89 1.96 3.04 -1.87 1.72 116.25 126.08 1yuf h VAL 25 Ca 0.37 -0.04 0.24 0.00 -1.01 0.00 0.00 66.70 66.26 1yuf h VAL 25 Cb 0.89 -0.01 -0.15 0.00 -2.01 0.00 0.00 31.29 30.01 1yuf h VAL 25 CO 1.38 0.02 0.21 1.56 -1.01 0.00 0.00 177.57 179.73 1yuf h GLN 26 N 0.11 0.17 -0.01 4.17 4.20 -1.86 0.36 115.11 122.25 1yuf h GLN 26 Ca 0.79 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.49 1yuf h GLN 26 Cb 1.97 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.71 1yuf h GLN 26 CO -0.73 0.11 0.00 0.39 -0.67 0.00 0.00 178.83 177.93 1yuf n GLU 27 N -5.27 1.81 -3.81 1.46 -0.58 0.37 -5.01 120.64 109.61 1yuf n GLU 27 Ca 0.22 -2.27 -0.29 0.00 -0.42 0.00 0.00 57.16 54.39 1yuf n GLU 27 Cb 0.70 -1.36 0.01 0.00 -0.57 0.00 0.00 31.44 30.21 1yuf n GLU 27 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1yuf n ASP 28 N -1.14 -4.15 -4.02 1.62 8.00 0.49 -4.90 116.55 112.45 1yuf n ASP 28 Ca 0.12 -1.00 -0.32 0.00 0.71 0.00 0.00 54.79 54.30 1yuf n ASP 28 Cb 0.53 -1.44 -0.14 0.00 -0.02 0.00 0.00 41.12 40.05 1yuf n ASP 28 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1yuf s LYS 29 N -5.55 1.84 -0.09 -1.24 1.02 -1.10 -4.93 119.74 109.69 1yuf s LYS 29 Ca 0.15 -2.19 -0.30 0.00 0.02 0.00 0.00 55.97 53.65 1yuf s LYS 29 Cb -0.08 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.84 1yuf s LYS 29 CO 0.84 -1.04 1.24 -1.25 -0.92 0.00 0.00 175.35 174.23 1yuf s PRO 30 N 0.43 4.30 -0.30 -1.68 0.04 -1.26 -2.46 135.00 134.07 1yuf s PRO 30 Ca 0.13 1.70 -0.05 0.00 0.04 0.00 0.00 61.00 62.82 1yuf s PRO 30 Cb -0.22 -3.64 0.17 0.00 0.04 0.00 0.00 34.50 30.85 1yuf s PRO 30 CO -0.04 -0.56 0.69 0.00 0.04 0.00 0.00 177.00 177.13 1yuf s ALA 31 N 2.74 -2.40 0.09 8.56 0.00 0.77 -5.01 121.76 126.51 1yuf s ALA 31 Ca 0.56 1.91 -0.02 0.00 0.00 0.00 0.00 51.96 54.41 1yuf s ALA 31 Cb -0.24 -2.12 -0.05 0.00 0.00 0.00 0.00 23.12 20.71 1yuf s ALA 31 CO 0.20 -1.24 0.28 0.00 0.00 0.00 0.00 175.76 174.99 1yuf s VAL 33 N -1.55 3.05 0.95 0.00 1.01 0.21 -4.89 120.40 119.19 1yuf s VAL 33 Ca 0.37 -1.45 -0.15 0.00 0.00 0.00 0.00 61.98 60.75 1yuf s VAL 33 Cb -0.13 -3.07 0.17 0.00 0.00 0.00 0.00 36.38 33.36 1yuf s VAL 33 CO 0.26 -0.11 1.23 0.00 0.00 0.00 0.00 175.10 176.48 1yuf n HIS 35 N -3.80 0.00 0.00 0.00 -0.00 -0.90 -2.91 115.22 107.62 1yuf n HIS 35 Ca 0.12 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.30 1yuf n HIS 35 Cb 0.60 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.47 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 -1.56 0.00 0.00 0.26 3.41 -1.26 -4.99 113.62 109.48 1yuf n SER 36 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1yuf n SER 36 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.16 0.77 0.00 5.00 0.00 -1.26 -5.05 105.19 103.50 1yuf n GLY 37 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.39 0.00 0.00 1.61 4.01 -1.26 -4.56 117.16 114.57 1yuf n TYR 38 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1yuf n TYR 38 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 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 0.00 0.00 -0.74 -0.72 0.31 -0.91 -4.30 118.33 111.97 1yuf n VAL 39 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.08 1yuf n VAL 39 Cb 0.00 -0.11 -0.02 0.00 -0.91 0.00 0.00 33.84 32.81 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 -0.49 -0.96 0.30 2.92 0.00 -1.16 -4.69 105.19 101.11 1yuf n GLY 40 Ca 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1yuf n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yuf h ALA 41 N 0.52 -0.17 0.00 4.61 0.00 -2.00 0.20 119.26 122.43 1yuf h ALA 41 Ca -0.15 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1yuf h ALA 41 Cb 0.77 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1yuf h ALA 41 CO 0.30 -0.70 0.00 0.54 0.00 0.00 0.00 179.25 179.40 1yuf n ARG 42 N -5.39 0.24 -1.31 0.00 3.00 -1.26 -4.92 116.66 107.01 1yuf n ARG 42 Ca -0.01 0.22 0.00 0.00 -0.01 0.00 0.00 57.85 58.05 1yuf n ARG 42 Cb 0.31 -1.79 0.00 0.00 0.00 0.00 0.00 32.46 30.98 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 -1.02 2.29 -3.93 0.00 2.13 -1.26 -2.27 120.64 116.58 1yuf n GLU 44 Ca 0.00 0.01 -0.32 0.00 0.66 0.00 0.00 57.16 57.51 1yuf n GLU 44 Cb 0.39 -1.15 -0.05 0.00 0.27 0.00 0.00 31.44 30.90 1yuf n GLU 44 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1yuf s HIS 45 N -2.15 3.49 -0.83 4.31 3.76 -1.26 -4.98 115.29 117.63 1yuf s HIS 45 Ca -0.05 0.27 -0.14 0.00 -0.15 0.00 0.00 55.06 54.99 1yuf s HIS 45 Cb 0.02 -1.77 0.22 0.00 1.11 0.00 0.00 32.58 32.16 1yuf s HIS 45 CO 0.22 0.60 0.77 0.00 -0.85 0.00 0.00 174.74 175.49 1yuf s ALA 46 N -1.43 4.10 0.41 -1.40 0.00 -1.26 -2.14 121.76 120.03 1yuf s ALA 46 Ca 0.32 -3.35 0.00 0.00 0.00 0.00 0.00 51.96 48.93 1yuf s ALA 46 Cb -0.13 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1yuf s ALA 46 CO 0.24 -2.27 0.00 -3.47 0.00 0.00 0.00 175.76 170.26 1yuf n ASP 47 N 3.90 -6.63 -1.41 0.00 2.03 -1.26 -3.58 116.55 109.60 1yuf n ASP 47 Ca 0.14 0.88 0.00 0.00 0.52 0.00 0.00 54.79 56.34 1yuf n ASP 47 Cb 0.46 -4.06 0.21 0.00 -0.72 0.00 0.00 41.12 37.01 1yuf n ASP 47 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1yuf n LEU 48 N -3.86 4.11 -2.72 -2.67 4.77 -1.26 -3.97 117.00 111.39 1yuf n LEU 48 Ca -0.04 -2.10 -0.09 0.00 -0.03 0.00 0.00 56.01 53.74 1yuf n LEU 48 Cb 0.62 -0.63 0.04 0.00 -2.33 0.00 0.00 43.42 41.12 1yuf n LEU 48 CO 0.02 0.55 -0.00 -0.11 -1.33 0.00 0.00 177.39 176.52 1yuf n LEU 49 N 0.18 0.67 0.00 2.23 -0.00 -1.26 -5.26 117.00 113.56 1yuf n LEU 49 Ca 0.20 -3.79 0.00 0.00 -0.00 0.00 0.00 56.01 52.43 1yuf n LEU 49 Cb 0.89 0.39 0.00 0.00 -0.00 0.00 0.00 43.42 44.71 1yuf n LEU 49 CO 0.23 1.71 0.00 0.00 -0.00 0.00 0.00 177.39 179.32