#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4tgf n VAL 2 N 0.00 4.90 -0.23 3.34 0.31 -1.26 -4.51 118.33 120.88 4tgf n VAL 2 Ca 0.00 -5.08 0.02 0.00 -0.01 0.00 0.00 64.34 59.27 4tgf n VAL 2 Cb 0.00 -2.18 0.04 0.00 -0.91 0.00 0.00 33.84 30.79 4tgf n VAL 2 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 4tgf n SER 3 N 2.49 2.16 0.00 4.52 2.88 -1.26 -4.77 113.62 119.64 4tgf n SER 3 Ca 0.36 -2.22 0.00 0.00 -1.33 0.00 0.00 58.87 55.68 4tgf n SER 3 Cb 0.34 -0.10 0.00 0.00 -0.75 0.00 0.00 64.21 63.69 4tgf n SER 3 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 4tgf n HIS 4 N -0.61 0.00 -1.55 0.66 8.25 -1.26 -4.87 115.22 115.84 4tgf n HIS 4 Ca 0.04 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.20 4tgf n HIS 4 Cb 0.35 0.26 -0.06 0.00 1.12 0.00 0.00 29.99 31.66 4tgf n HIS 4 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 4tgf n PHE 5 N -2.27 1.75 0.00 4.41 3.72 -1.26 -4.63 117.46 119.17 4tgf n PHE 5 Ca 0.00 -2.29 0.00 0.00 -0.05 0.00 0.00 57.45 55.11 4tgf n PHE 5 Cb 0.10 -1.70 0.00 0.00 -0.94 0.00 0.00 39.48 36.94 4tgf n PHE 5 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 4tgf n ASN 6 N 1.75 0.00 -2.61 4.37 6.94 -1.26 -4.58 115.26 119.86 4tgf n ASN 6 Ca 0.56 0.00 -0.04 0.00 -0.02 0.00 0.00 54.58 55.08 4tgf n ASN 6 Cb 0.48 0.00 0.03 0.00 -2.36 0.00 0.00 39.78 37.93 4tgf n ASN 6 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 4tgf n ASP 7 N 0.00 -1.06 -4.39 0.53 8.00 -1.26 -4.21 116.55 114.17 4tgf n ASP 7 Ca 0.00 -0.62 -0.30 0.00 0.71 0.00 0.00 54.79 54.57 4tgf n ASP 7 Cb 0.00 -0.13 -0.14 0.00 -0.02 0.00 0.00 41.12 40.83 4tgf n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4tgf n PRO 9 N 1.59 -4.49 0.00 0.00 -0.04 -1.26 -4.95 135.00 125.84 4tgf n PRO 9 Ca -0.17 -1.51 0.00 0.00 -0.04 0.00 0.00 63.50 61.79 4tgf n PRO 9 Cb 0.52 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 4tgf n PRO 9 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 4tgf n ASP 10 N -5.60 0.00 0.00 3.54 2.03 -1.26 -4.02 116.55 111.24 4tgf n ASP 10 Ca 0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.45 4tgf n ASP 10 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 4tgf n ASP 10 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 4tgf n SER 11 N 0.00 0.00 0.04 1.67 7.64 -1.26 -0.95 113.62 120.76 4tgf n SER 11 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.93 4tgf n SER 11 Cb 0.00 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.42 4tgf n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4tgf n HIS 12 N 0.00 0.21 0.00 1.43 1.44 -1.26 -4.79 115.22 112.25 4tgf n HIS 12 Ca 0.00 0.10 0.00 0.00 -2.01 0.00 0.00 57.72 55.81 4tgf n HIS 12 Cb 0.00 -0.66 0.00 0.00 0.12 0.00 0.00 29.99 29.45 4tgf n HIS 12 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 4tgf n THR 13 N -1.71 0.00 -3.34 0.61 -2.24 -0.13 -3.64 114.28 103.83 4tgf n THR 13 Ca 0.01 0.00 -0.45 0.00 -2.27 0.00 0.00 64.05 61.33 4tgf n THR 13 Cb 0.06 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.23 4tgf n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 4tgf s GLN 14 N 0.00 2.96 0.00 -0.78 -2.07 -1.26 -4.89 119.66 113.61 4tgf s GLN 14 Ca 0.00 -1.62 0.04 0.00 -1.82 0.00 0.00 55.36 51.96 4tgf s GLN 14 Cb 0.00 -4.23 0.24 0.00 -1.09 0.00 0.00 33.01 27.93 4tgf s GLN 14 CO 0.00 -1.25 0.96 0.34 -1.32 0.00 0.00 175.29 174.02 4tgf n PHE 15 N 5.22 0.00 -3.75 9.60 7.35 -1.24 -4.81 117.46 129.84 4tgf n PHE 15 Ca -0.13 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.56 4tgf n PHE 15 Cb 0.41 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.24 4tgf n PHE 15 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 4tgf n PHE 17 N -0.00 0.00 -3.06 0.00 3.72 -1.25 -4.93 117.46 111.94 4tgf n PHE 17 Ca 0.00 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.24 4tgf n PHE 17 Cb 0.00 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.53 4tgf n PHE 17 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 4tgf n HIS 18 N -0.14 0.40 0.00 1.38 8.25 -1.21 -5.02 115.22 118.87 4tgf n HIS 18 Ca 0.00 -3.56 0.00 0.00 -0.26 0.00 0.00 57.72 53.90 4tgf n HIS 18 Cb 0.00 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 30.71 4tgf n HIS 18 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 4tgf n GLY 19 N 0.20 0.37 3.87 -1.41 0.00 -1.26 -4.16 105.19 102.80 4tgf n GLY 19 Ca 0.21 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 4tgf n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4tgf s THR 20 N -2.00 2.76 -0.07 2.61 -4.23 -1.07 -4.84 115.64 108.80 4tgf s THR 20 Ca 0.00 0.25 0.01 0.00 -1.18 0.00 0.00 61.69 60.76 4tgf s THR 20 Cb 0.00 -3.19 -0.03 0.00 1.34 0.00 0.00 72.50 70.62 4tgf s THR 20 CO 0.00 -0.32 -0.08 0.00 -0.54 0.00 0.00 174.62 173.68 4tgf s ARG 22 N -0.67 0.40 -0.31 0.00 1.81 -1.10 -4.80 118.95 114.29 4tgf s ARG 22 Ca 0.10 -0.10 -0.27 0.00 -1.72 0.00 0.00 55.73 53.74 4tgf s ARG 22 Cb -0.11 -1.55 0.01 0.00 -0.45 0.00 0.00 34.95 32.85 4tgf s ARG 22 CO 0.02 -0.52 0.95 0.12 -0.68 0.00 0.00 175.30 175.19 4tgf s PHE 23 N 2.00 3.19 -0.74 -0.53 5.36 -1.26 0.69 117.98 126.69 4tgf s PHE 23 Ca 0.02 1.06 -0.25 0.00 -0.96 0.00 0.00 56.93 56.79 4tgf s PHE 23 Cb -0.15 -3.46 0.05 0.00 -0.34 0.00 0.00 43.02 39.12 4tgf s PHE 23 CO -0.07 -0.66 1.19 -1.17 -1.46 0.00 0.00 175.22 173.05 4tgf s LEU 24 N 3.33 3.61 0.24 6.12 2.96 -0.64 -4.34 118.68 129.95 4tgf s LEU 24 Ca 0.40 -0.71 -0.01 0.00 -0.22 0.00 0.00 54.13 53.58 4tgf s LEU 24 Cb -0.13 -2.51 0.27 0.00 0.50 0.00 0.00 46.19 44.32 4tgf s LEU 24 CO 0.13 -1.68 1.65 0.58 -1.32 0.00 0.00 176.35 175.71 4tgf h VAL 25 N 6.05 1.28 -0.35 1.68 2.07 -1.87 0.63 116.25 125.74 4tgf h VAL 25 Ca -0.24 -1.40 0.04 0.00 0.82 0.00 0.00 66.70 65.92 4tgf h VAL 25 Cb 1.05 1.39 -0.07 0.00 -1.52 0.00 0.00 31.29 32.14 4tgf h VAL 25 CO 1.25 0.45 -0.51 1.56 0.02 0.00 0.00 177.57 180.34 4tgf h GLN 26 N 0.51 -0.37 -0.54 1.57 4.20 -1.95 -2.21 115.11 116.32 4tgf h GLN 26 Ca 0.06 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.80 4tgf h GLN 26 Cb 0.78 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.64 4tgf h GLN 26 CO 0.06 -0.25 0.00 0.39 -0.67 0.00 0.00 178.83 178.37 4tgf n GLU 27 N -5.16 3.01 -3.34 1.46 1.02 -1.22 -5.00 120.64 111.41 4tgf n GLU 27 Ca -0.03 -2.50 -0.22 0.00 -0.02 0.00 0.00 57.16 54.38 4tgf n GLU 27 Cb 0.32 -1.55 0.02 0.00 -0.02 0.00 0.00 31.44 30.21 4tgf n GLU 27 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 4tgf n ASP 28 N 0.96 -6.33 -3.68 1.62 -0.08 0.21 -5.01 116.55 104.23 4tgf n ASP 28 Ca 0.20 -0.15 -0.10 0.00 -1.51 0.00 0.00 54.79 53.23 4tgf n ASP 28 Cb 0.63 -3.17 -0.10 0.00 2.34 0.00 0.00 41.12 40.81 4tgf n ASP 28 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 4tgf s LYS 29 N -3.14 0.34 -0.14 -0.67 2.20 -0.36 -4.97 119.74 113.00 4tgf s LYS 29 Ca 0.20 0.89 -0.29 0.00 -0.36 0.00 0.00 55.97 56.41 4tgf s LYS 29 Cb -0.03 0.13 -0.07 0.00 -1.51 0.00 0.00 37.83 36.35 4tgf s LYS 29 CO 0.84 -0.21 2.14 -2.30 -0.36 0.00 0.00 175.35 175.45 4tgf n PRO 30 N 4.84 2.24 -0.18 4.03 -0.02 -1.26 -1.63 135.00 143.02 4tgf n PRO 30 Ca -0.16 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 4tgf n PRO 30 Cb 0.52 -3.13 0.00 0.00 -0.02 0.00 0.00 33.50 30.87 4tgf n PRO 30 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 4tgf n ALA 31 N 10.21 0.00 -3.67 3.55 0.00 0.22 -4.92 120.51 125.90 4tgf n ALA 31 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.69 4tgf n ALA 31 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.87 4tgf n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 4tgf s VAL 33 N -2.85 0.82 0.55 0.00 1.01 -0.68 -4.79 120.40 114.45 4tgf s VAL 33 Ca 0.12 -2.50 -0.17 0.00 0.00 0.00 0.00 61.98 59.43 4tgf s VAL 33 Cb 0.01 -1.57 -0.06 0.00 0.00 0.00 0.00 36.38 34.76 4tgf s VAL 33 CO -0.01 -1.05 1.04 0.00 0.00 0.00 0.00 175.10 175.08 4tgf s HIS 35 N -2.35 3.03 -0.36 0.00 3.76 -1.26 -4.99 115.29 113.13 4tgf s HIS 35 Ca 0.64 0.26 -0.29 0.00 -0.15 0.00 0.00 55.06 55.52 4tgf s HIS 35 Cb -0.15 -2.74 -0.01 0.00 1.11 0.00 0.00 32.58 30.79 4tgf s HIS 35 CO 0.31 -0.86 1.64 0.45 -0.85 0.00 0.00 174.74 175.43 4tgf s SER 36 N -4.37 6.09 0.00 1.40 0.15 -1.26 -2.87 113.70 112.83 4tgf s SER 36 Ca 0.55 1.13 0.00 0.00 0.70 0.00 0.00 55.95 58.33 4tgf s SER 36 Cb -0.10 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.67 4tgf s SER 36 CO 0.41 -1.58 0.00 0.61 1.20 0.00 0.00 173.24 173.88 4tgf n GLY 37 N 5.27 1.25 3.72 9.45 0.00 -1.26 -5.10 105.19 118.51 4tgf n GLY 37 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 4tgf n GLY 37 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 4tgf s TYR 38 N -0.00 3.39 0.33 1.61 2.02 -1.14 -1.52 117.35 122.04 4tgf s TYR 38 Ca 0.00 0.31 0.06 0.00 -0.37 0.00 0.00 57.07 57.08 4tgf s TYR 38 Cb 0.00 -2.19 -0.07 0.00 -0.40 0.00 0.00 41.96 39.31 4tgf s TYR 38 CO 0.00 0.24 -0.01 0.14 -1.57 0.00 0.00 175.55 174.35 4tgf s VAL 39 N 0.50 1.65 0.00 0.71 -7.23 -1.08 -4.83 120.40 110.12 4tgf s VAL 39 Ca 0.08 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 4tgf s VAL 39 Cb -0.12 -2.69 0.00 0.00 0.56 0.00 0.00 36.38 34.13 4tgf s VAL 39 CO -0.01 -0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.26 4tgf n GLY 40 N -0.72 2.71 0.23 2.32 0.00 -1.26 -2.46 105.19 106.01 4tgf n GLY 40 Ca -0.04 -2.00 -0.05 0.00 0.00 0.00 0.00 46.02 43.93 4tgf n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4tgf h ALA 41 N 0.00 0.74 -0.63 4.61 0.00 -2.02 -1.13 119.26 120.83 4tgf h ALA 41 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 4tgf h ALA 41 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 4tgf h ALA 41 CO 0.00 0.09 0.00 0.54 0.00 0.00 0.00 179.25 179.88 4tgf n ARG 42 N -4.74 2.47 -3.86 0.00 1.74 -1.26 -4.95 116.66 106.05 4tgf n ARG 42 Ca 0.05 -2.28 -0.33 0.00 -0.77 0.00 0.00 57.85 54.52 4tgf n ARG 42 Cb 0.07 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.03 4tgf n ARG 42 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 4tgf n GLU 44 N -4.44 1.04 -0.38 0.00 0.00 -1.16 -3.29 120.64 112.41 4tgf n GLU 44 Ca -0.17 -0.08 0.00 0.00 0.00 0.00 0.00 57.16 56.91 4tgf n GLU 44 Cb 0.62 -1.33 0.00 0.00 0.00 0.00 0.00 31.44 30.72 4tgf n GLU 44 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 4tgf n HIS 45 N -2.20 -2.76 -3.86 4.31 -0.00 -1.03 -4.91 115.22 104.77 4tgf n HIS 45 Ca -0.10 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.50 4tgf n HIS 45 Cb 0.60 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.47 4tgf n HIS 45 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 4tgf s ALA 46 N -3.04 -0.23 -2.00 -1.41 0.00 -1.26 -2.64 121.76 111.18 4tgf s ALA 46 Ca 0.00 0.13 0.07 0.00 0.00 0.00 0.00 51.96 52.16 4tgf s ALA 46 Cb 0.00 -0.09 0.40 0.00 0.00 0.00 0.00 23.12 23.43 4tgf s ALA 46 CO 0.00 -0.09 0.82 -3.47 0.00 0.00 0.00 175.76 173.03 4tgf n ASP 47 N 2.61 0.00 -4.33 0.00 -0.08 -0.58 -3.70 116.55 110.48 4tgf n ASP 47 Ca -0.15 -0.65 -0.47 0.00 -1.51 0.00 0.00 54.79 52.01 4tgf n ASP 47 Cb 0.58 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 44.02 4tgf n ASP 47 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 4tgf s LEU 48 N -1.48 6.73 -0.60 -2.67 1.02 -1.26 -4.75 118.68 115.67 4tgf s LEU 48 Ca 0.10 -2.66 -0.24 0.00 0.02 0.00 0.00 54.13 51.36 4tgf s LEU 48 Cb 0.05 -2.21 0.04 0.00 0.02 0.00 0.00 46.19 44.08 4tgf s LEU 48 CO 0.08 -0.58 0.64 0.18 0.02 0.00 0.00 176.35 176.69 4tgf n LEU 49 N 4.02 -2.29 0.00 1.79 4.32 -1.26 -5.22 117.00 118.36 4tgf n LEU 49 Ca 0.13 -0.48 0.00 0.00 -0.02 0.00 0.00 56.01 55.63 4tgf n LEU 49 Cb 0.47 -1.62 0.00 0.00 -1.62 0.00 0.00 43.42 40.64 4tgf n LEU 49 CO 0.34 0.13 0.00 0.00 -1.22 0.00 0.00 177.39 176.65