#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ccf s ASP 46 N 0.00 -0.82 0.00 4.39 2.15 -1.26 -5.13 116.67 116.00 1ccf s ASP 46 Ca 0.00 0.90 0.00 0.00 0.43 0.00 0.00 52.55 53.88 1ccf s ASP 46 Cb 0.00 1.86 0.00 0.00 -0.30 0.00 0.00 42.92 44.48 1ccf s ASP 46 CO 0.00 -0.26 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 1ccf n GLY 47 N 5.41 1.44 3.29 2.66 0.00 -1.26 -5.01 105.19 111.72 1ccf n GLY 47 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 1ccf n GLY 47 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ccf s ASP 48 N -1.00 2.81 0.21 1.61 2.15 -1.26 -5.01 116.67 116.18 1ccf s ASP 48 Ca 0.00 -0.51 0.23 0.00 0.43 0.00 0.00 52.55 52.69 1ccf s ASP 48 Cb 0.00 -0.27 0.07 0.00 -0.30 0.00 0.00 42.92 42.42 1ccf s ASP 48 CO 0.00 0.24 1.12 1.56 -0.17 0.00 0.00 175.17 177.92 1ccf h GLN 49 N 5.06 0.00 -0.60 4.34 1.08 -1.92 -3.27 115.11 119.80 1ccf h GLN 49 Ca -0.43 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 1ccf h GLN 49 Cb 1.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.57 1ccf h GLN 49 CO 0.45 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 178.33 1ccf n GLU 51 N 1.07 0.70 -1.25 0.00 2.13 -1.24 -2.79 120.64 119.26 1ccf n GLU 51 Ca 0.20 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 58.00 1ccf n GLU 51 Cb 0.59 -1.22 -0.03 0.00 0.27 0.00 0.00 31.44 31.05 1ccf n GLU 51 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ccf n GLY 52 N 0.48 0.75 3.38 8.31 0.00 -1.26 -5.05 105.19 111.80 1ccf n GLY 52 Ca 0.00 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 1ccf n GLY 52 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ccf n HIS 53 N 0.24 -1.68 0.02 1.61 -0.00 -1.12 -4.87 115.22 109.43 1ccf n HIS 53 Ca -0.11 0.71 -0.03 0.00 0.46 0.00 0.00 57.72 58.75 1ccf n HIS 53 Cb 0.92 -1.49 -0.10 0.00 -0.12 0.00 0.00 29.99 29.20 1ccf n HIS 53 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1ccf h PRO 54 N 2.67 0.00 -6.70 1.57 0.13 -1.90 -3.47 132.00 124.31 1ccf h PRO 54 Ca -0.35 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.33 1ccf h PRO 54 Cb 1.25 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.41 1ccf h PRO 54 CO 0.14 0.38 -0.10 0.00 -0.23 0.00 0.00 178.00 178.19 1ccf s LEU 56 N -4.58 2.79 -0.42 0.00 1.43 0.45 -4.50 118.68 113.84 1ccf s LEU 56 Ca 0.51 -1.26 -0.10 0.00 -1.03 0.00 0.00 54.13 52.25 1ccf s LEU 56 Cb -0.10 -1.20 0.01 0.00 0.03 0.00 0.00 46.19 44.93 1ccf s LEU 56 CO 0.37 -0.82 0.25 0.59 0.23 0.00 0.00 176.35 176.97 1ccf n ASN 57 N -1.44 -1.59 -3.53 2.29 3.02 -1.26 -0.01 115.26 112.74 1ccf n ASN 57 Ca -0.05 -0.46 -0.20 0.00 -0.03 0.00 0.00 54.58 53.84 1ccf n ASN 57 Cb 0.65 -0.59 0.08 0.00 -0.61 0.00 0.00 39.78 39.31 1ccf n ASN 57 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ccf n GLN 58 N -2.21 -6.66 -2.42 3.52 6.02 -1.26 -4.87 117.38 109.50 1ccf n GLN 58 Ca -0.06 0.80 -0.30 0.00 -0.01 0.00 0.00 57.00 57.43 1ccf n GLN 58 Cb 0.22 -5.77 -0.02 0.00 1.02 0.00 0.00 30.24 25.70 1ccf n GLN 58 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1ccf s GLY 59 N -4.08 1.82 0.41 1.08 0.00 0.99 -4.46 107.32 103.08 1ccf s GLY 59 Ca 0.16 -0.12 -0.10 0.00 0.00 0.00 0.00 44.72 44.66 1ccf s GLY 59 CO 0.75 0.11 0.78 -1.58 0.00 0.00 0.00 173.10 173.15 1ccf s HIS 60 N -2.73 3.48 -0.24 1.90 2.46 0.15 -4.75 115.29 115.55 1ccf s HIS 60 Ca 0.54 1.04 -0.03 0.00 0.47 0.00 0.00 55.06 57.08 1ccf s HIS 60 Cb -0.10 -2.44 0.08 0.00 -0.13 0.00 0.00 32.58 29.98 1ccf s HIS 60 CO 0.40 -0.13 0.08 0.00 -2.47 0.00 0.00 174.74 172.62 1ccf s LYS 62 N 1.86 2.05 0.00 0.00 -0.14 -0.74 -4.97 119.74 117.80 1ccf s LYS 62 Ca 0.04 -1.32 0.00 0.00 -1.36 0.00 0.00 55.97 53.33 1ccf s LYS 62 Cb -0.17 -2.49 0.00 0.00 -1.68 0.00 0.00 37.83 33.49 1ccf s LYS 62 CO -0.19 -1.10 0.00 0.41 -0.76 0.00 0.00 175.35 173.71 1ccf n GLY 64 N -2.51 1.35 3.55 -3.33 0.00 -0.49 -2.20 105.19 101.56 1ccf n GLY 64 Ca 0.14 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1ccf n GLY 64 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ccf s ILE 65 N -0.27 3.86 0.00 -0.61 -1.09 -1.26 -4.49 121.20 117.34 1ccf s ILE 65 Ca 0.00 -0.32 0.00 0.00 -2.23 0.00 0.00 60.65 58.10 1ccf s ILE 65 Cb 0.00 -5.00 0.00 0.00 -1.58 0.00 0.00 42.46 35.88 1ccf s ILE 65 CO 0.00 -1.90 0.00 0.61 -1.23 0.00 0.00 174.94 172.42 1ccf n GLY 66 N 6.26 2.26 3.86 6.18 0.00 -1.26 -4.90 105.19 117.59 1ccf n GLY 66 Ca 0.21 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1ccf n GLY 66 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ccf s ASP 67 N -0.67 3.26 0.11 1.61 2.15 -1.26 -4.85 116.67 117.02 1ccf s ASP 67 Ca 0.00 0.57 0.02 0.00 0.43 0.00 0.00 52.55 53.56 1ccf s ASP 67 Cb 0.00 -0.84 -0.04 0.00 -0.30 0.00 0.00 42.92 41.74 1ccf s ASP 67 CO 0.00 -2.67 -0.05 -0.72 -0.17 0.00 0.00 175.17 171.56 1ccf s TYR 68 N -3.59 0.93 -0.00 -5.34 1.13 -1.26 -1.39 117.35 107.82 1ccf s TYR 68 Ca 0.69 -0.95 0.04 0.00 -1.41 0.00 0.00 57.07 55.43 1ccf s TYR 68 Cb -0.08 -0.54 -0.01 0.00 -1.10 0.00 0.00 41.96 40.23 1ccf s TYR 68 CO 0.52 -0.18 -0.11 0.95 -2.51 0.00 0.00 175.55 174.22 1ccf s THR 69 N -3.66 0.90 -0.21 -3.49 -4.23 -0.93 -4.97 115.64 99.06 1ccf s THR 69 Ca 0.14 -0.55 -0.10 0.00 -1.18 0.00 0.00 61.69 60.01 1ccf s THR 69 Cb 0.06 -0.77 -0.05 0.00 1.34 0.00 0.00 72.50 73.08 1ccf s THR 69 CO -0.03 0.21 0.13 0.00 -0.54 0.00 0.00 174.62 174.39 1ccf s THR 71 N 0.51 3.80 0.64 0.00 -4.23 0.31 -4.93 115.64 111.74 1ccf s THR 71 Ca 0.07 -0.37 -0.14 0.00 -1.18 0.00 0.00 61.69 60.07 1ccf s THR 71 Cb -0.12 -2.76 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 1ccf s THR 71 CO -0.00 0.37 1.08 0.00 -0.54 0.00 0.00 174.62 175.52 1ccf s ALA 73 N -2.53 2.61 -0.52 0.00 0.00 -1.26 -4.78 121.76 115.28 1ccf s ALA 73 Ca 0.64 -0.21 -0.26 0.00 0.00 0.00 0.00 51.96 52.13 1ccf s ALA 73 Cb -0.17 -3.09 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 1ccf s ALA 73 CO 0.42 -1.36 2.21 -2.00 0.00 0.00 0.00 175.76 175.03 1ccf s GLU 74 N -5.22 2.33 0.00 0.00 2.12 -1.26 -1.62 118.70 115.05 1ccf s GLU 74 Ca 0.59 1.16 0.00 0.00 0.36 0.00 0.00 54.97 57.08 1ccf s GLU 74 Cb -0.13 -4.51 0.00 0.00 0.26 0.00 0.00 34.13 29.76 1ccf s GLU 74 CO 0.53 -3.04 0.00 0.41 -0.54 0.00 0.00 175.26 172.63 1ccf n GLY 75 N 5.88 2.79 3.68 -1.50 0.00 -1.26 -5.12 105.19 109.66 1ccf n GLY 75 Ca 0.31 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1ccf n GLY 75 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ccf s PHE 76 N 0.00 2.73 -0.08 1.61 0.08 -0.64 -1.43 117.98 120.25 1ccf s PHE 76 Ca 0.00 -0.26 -0.10 0.00 0.12 0.00 0.00 56.93 56.69 1ccf s PHE 76 Cb 0.00 -1.32 0.02 0.00 -0.57 0.00 0.00 43.02 41.15 1ccf s PHE 76 CO 0.00 0.54 0.27 -2.00 -0.10 0.00 0.00 175.22 173.94 1ccf s GLU 77 N -3.73 0.39 0.00 0.44 2.12 -0.46 -4.50 118.70 112.97 1ccf s GLU 77 Ca 0.33 0.22 0.00 0.00 0.36 0.00 0.00 54.97 55.88 1ccf s GLU 77 Cb -0.05 0.18 0.00 0.00 0.26 0.00 0.00 34.13 34.52 1ccf s GLU 77 CO 0.21 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.27 1ccf n GLY 78 N 2.53 4.28 0.35 -1.50 0.00 -1.26 -2.43 105.19 107.15 1ccf n GLY 78 Ca -0.15 -1.37 0.05 0.00 0.00 0.00 0.00 46.02 44.55 1ccf n GLY 78 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ccf n LYS 79 N -1.86 -0.11 0.00 1.61 4.81 -1.26 -0.61 118.16 120.74 1ccf n LYS 79 Ca 0.00 1.50 0.07 0.00 -0.87 0.00 0.00 58.31 59.01 1ccf n LYS 79 Cb 0.00 -2.24 0.02 0.00 0.02 0.00 0.00 35.03 32.83 1ccf n LYS 79 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1ccf n ASN 80 N -5.55 1.72 -0.08 3.14 3.02 -1.26 -4.70 115.26 111.55 1ccf n ASN 80 Ca 0.15 -1.36 0.00 0.00 -0.03 0.00 0.00 54.58 53.34 1ccf n ASN 80 Cb 0.47 0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.95 1ccf n ASN 80 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ccf h GLU 82 N 0.00 0.02 -6.54 0.00 4.81 -1.83 -3.41 114.58 107.63 1ccf h GLU 82 Ca 0.00 -0.02 -0.52 0.00 -0.13 0.00 0.00 59.36 58.69 1ccf h GLU 82 Cb 0.84 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.19 1ccf h GLU 82 CO 0.00 0.66 -0.04 -0.06 -0.73 0.00 0.00 179.01 178.83 1ccf s PHE 83 N -3.57 3.41 0.15 0.92 0.08 -1.02 -4.95 117.98 113.01 1ccf s PHE 83 Ca -0.01 0.97 0.08 0.00 0.12 0.00 0.00 56.93 58.09 1ccf s PHE 83 Cb 0.12 -2.34 -0.04 0.00 -0.57 0.00 0.00 43.02 40.19 1ccf s PHE 83 CO 0.77 0.19 -0.08 -1.54 -0.10 0.00 0.00 175.22 174.46 1ccf s SER 84 N -2.41 4.39 -0.15 1.36 1.04 -1.26 -1.36 113.70 115.31 1ccf s SER 84 Ca 0.49 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.45 1ccf s SER 84 Cb -0.11 -0.81 0.17 0.00 0.10 0.00 0.00 66.02 65.37 1ccf s SER 84 CO 0.21 0.13 1.55 0.35 0.98 0.00 0.00 173.24 176.46 1ccf n THR 85 N 0.24 1.95 1.93 2.02 -2.24 -0.51 -4.92 114.28 112.75 1ccf n THR 85 Ca -0.12 -0.79 0.15 0.00 -2.27 0.00 0.00 64.05 61.03 1ccf n THR 85 Cb 0.54 -1.07 0.92 0.00 -2.10 0.00 0.00 70.33 68.62 1ccf n THR 85 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36