#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 6.81 0.00 4.39 1.11 -1.26 -4.93 116.67 122.79 1ccf s ASP 46 Ca 0.00 0.97 0.00 0.00 0.18 0.00 0.00 52.55 53.70 1ccf s ASP 46 Cb 0.00 -2.32 0.00 0.00 1.07 0.00 0.00 42.92 41.67 1ccf s ASP 46 CO 0.00 0.05 0.00 0.61 1.18 0.00 0.00 175.17 177.01 1ccf n GLY 47 N 2.87 0.38 2.99 0.21 0.00 -1.26 -5.08 105.19 105.29 1ccf n GLY 47 Ca -0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 1ccf n GLY 47 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ccf s ASP 48 N 1.00 2.09 0.00 1.61 1.01 -1.26 -5.00 116.67 116.11 1ccf s ASP 48 Ca 0.00 -0.33 0.24 0.00 0.71 0.00 0.00 52.55 53.17 1ccf s ASP 48 Cb 0.00 -0.90 0.33 0.00 1.01 0.00 0.00 42.92 43.36 1ccf s ASP 48 CO 0.00 -0.03 1.29 0.00 0.21 0.00 0.00 175.17 176.64 1ccf n GLN 49 N 4.35 0.48 -0.04 8.23 3.00 -1.26 -3.93 117.38 128.21 1ccf n GLN 49 Ca -0.18 -0.34 0.02 0.00 -0.01 0.00 0.00 57.00 56.49 1ccf n GLN 49 Cb 0.51 -1.49 0.02 0.00 0.00 0.00 0.00 30.24 29.28 1ccf n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ccf n GLU 51 N -0.53 0.77 -0.15 0.00 2.13 -1.25 -2.31 120.64 119.30 1ccf n GLU 51 Ca 0.03 0.00 0.08 0.00 0.66 0.00 0.00 57.16 57.93 1ccf n GLU 51 Cb 0.39 -1.30 0.15 0.00 0.27 0.00 0.00 31.44 30.95 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 0.15 4.27 3.53 8.31 0.00 -1.26 -5.02 105.19 115.17 1ccf n GLY 52 Ca 0.00 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 1ccf n GLY 52 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ccf n HIS 53 N -0.96 -2.52 0.06 1.61 8.25 -0.98 -4.91 115.22 115.78 1ccf n HIS 53 Ca 0.14 1.03 -0.23 0.00 -0.26 0.00 0.00 57.72 58.41 1ccf n HIS 53 Cb 0.62 -2.64 -0.15 0.00 1.12 0.00 0.00 29.99 28.94 1ccf n HIS 53 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1ccf h PRO 54 N 0.90 0.37 -7.15 -0.41 0.13 -1.91 -3.46 132.00 120.48 1ccf h PRO 54 Ca -0.49 -0.64 -0.48 0.00 -0.87 0.00 0.00 66.00 63.52 1ccf h PRO 54 Cb 1.33 0.24 0.05 0.00 0.13 0.00 0.00 31.00 32.74 1ccf h PRO 54 CO 0.29 1.31 0.38 0.00 -0.23 0.00 0.00 178.00 179.75 1ccf s LEU 56 N -4.09 3.45 -0.78 0.00 1.43 0.56 -4.47 118.68 114.79 1ccf s LEU 56 Ca 0.65 -0.64 -0.19 0.00 -1.03 0.00 0.00 54.13 52.91 1ccf s LEU 56 Cb -0.16 -2.24 0.03 0.00 0.03 0.00 0.00 46.19 43.85 1ccf s LEU 56 CO 0.30 -0.75 0.46 0.59 0.23 0.00 0.00 176.35 177.18 1ccf n ASN 57 N -1.71 -2.94 -3.62 2.29 3.02 -1.26 -2.00 115.26 109.04 1ccf n ASN 57 Ca 0.06 -0.86 -0.27 0.00 -0.03 0.00 0.00 54.58 53.48 1ccf n ASN 57 Cb 0.61 -1.09 0.03 0.00 -0.61 0.00 0.00 39.78 38.72 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 -3.38 -1.26 -2.58 3.52 6.02 -1.26 -4.90 117.38 113.54 1ccf n GLN 58 Ca -0.11 0.61 -0.23 0.00 -0.01 0.00 0.00 57.00 57.26 1ccf n GLN 58 Cb 0.41 -4.09 0.04 0.00 1.02 0.00 0.00 30.24 27.62 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 -3.35 1.74 0.52 1.08 0.00 -0.84 -4.46 107.32 102.00 1ccf s GLY 59 Ca 0.37 -1.14 -0.03 0.00 0.00 0.00 0.00 44.72 43.91 1ccf s GLY 59 CO 0.85 -0.85 0.80 -1.58 0.00 0.00 0.00 173.10 172.32 1ccf s HIS 60 N -2.85 3.26 -0.11 1.90 2.46 0.48 -4.86 115.29 115.56 1ccf s HIS 60 Ca 0.56 0.48 -0.01 0.00 0.47 0.00 0.00 55.06 56.56 1ccf s HIS 60 Cb -0.10 -2.53 0.03 0.00 -0.13 0.00 0.00 32.58 29.84 1ccf s HIS 60 CO 0.40 -0.60 -0.05 0.00 -2.47 0.00 0.00 174.74 172.03 1ccf s LYS 62 N 1.79 2.38 0.00 0.00 2.47 -0.62 -4.95 119.74 120.81 1ccf s LYS 62 Ca 0.04 -0.83 0.00 0.00 -1.56 0.00 0.00 55.97 53.63 1ccf s LYS 62 Cb -0.13 -2.40 0.00 0.00 -1.46 0.00 0.00 37.83 33.84 1ccf s LYS 62 CO -0.07 0.57 0.00 0.41 0.16 0.00 0.00 175.35 176.42 1ccf n GLY 64 N 1.44 1.80 3.54 5.54 0.00 -0.45 -2.52 105.19 114.53 1ccf n GLY 64 Ca -0.15 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.25 4.40 0.00 -0.61 -1.09 -1.26 -4.56 121.20 117.83 1ccf s ILE 65 Ca 0.00 -1.98 0.00 0.00 -2.23 0.00 0.00 60.65 56.44 1ccf s ILE 65 Cb 0.00 -5.08 0.00 0.00 -1.58 0.00 0.00 42.46 35.80 1ccf s ILE 65 CO 0.00 -1.87 0.00 0.61 -1.23 0.00 0.00 174.94 172.45 1ccf n GLY 66 N 5.20 2.09 3.83 6.18 0.00 -1.26 -4.93 105.19 116.30 1ccf n GLY 66 Ca 0.42 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1ccf n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ccf s ASP 67 N 0.00 4.24 0.14 1.61 1.11 -1.26 -4.82 116.67 117.69 1ccf s ASP 67 Ca 0.00 1.01 -0.14 0.00 0.18 0.00 0.00 52.55 53.60 1ccf s ASP 67 Cb 0.00 -1.62 0.02 0.00 1.07 0.00 0.00 42.92 42.38 1ccf s ASP 67 CO 0.00 -2.10 0.37 -0.72 1.18 0.00 0.00 175.17 173.90 1ccf s TYR 68 N -3.34 -0.01 -0.02 4.23 1.13 -1.26 -1.34 117.35 116.73 1ccf s TYR 68 Ca 0.62 -0.34 -0.00 0.00 -1.41 0.00 0.00 57.07 55.94 1ccf s TYR 68 Cb -0.13 0.17 0.03 0.00 -1.10 0.00 0.00 41.96 40.93 1ccf s TYR 68 CO 0.52 -0.72 0.03 0.95 -2.51 0.00 0.00 175.55 173.82 1ccf s THR 69 N -3.86 -0.03 0.02 -3.49 -4.23 -1.05 -4.97 115.64 98.03 1ccf s THR 69 Ca 0.07 0.21 -0.20 0.00 -1.18 0.00 0.00 61.69 60.59 1ccf s THR 69 Cb 0.02 -0.11 -0.06 0.00 1.34 0.00 0.00 72.50 73.69 1ccf s THR 69 CO -0.08 0.10 0.59 0.00 -0.54 0.00 0.00 174.62 174.70 1ccf s THR 71 N -0.46 3.82 0.52 0.00 -4.23 -0.19 -4.92 115.64 110.18 1ccf s THR 71 Ca 0.30 -0.36 -0.18 0.00 -1.18 0.00 0.00 61.69 60.28 1ccf s THR 71 Cb -0.19 -2.72 -0.07 0.00 1.34 0.00 0.00 72.50 70.86 1ccf s THR 71 CO 0.18 0.43 1.02 0.00 -0.54 0.00 0.00 174.62 175.71 1ccf s ALA 73 N -2.37 1.73 -0.77 0.00 0.00 -1.26 -4.78 121.76 114.32 1ccf s ALA 73 Ca 0.63 -0.64 -0.25 0.00 0.00 0.00 0.00 51.96 51.69 1ccf s ALA 73 Cb -0.13 -2.99 -0.05 0.00 0.00 0.00 0.00 23.12 19.95 1ccf s ALA 73 CO 0.28 -2.41 1.98 -2.00 0.00 0.00 0.00 175.76 173.61 1ccf s GLU 74 N -5.36 2.48 0.00 0.00 2.56 -1.26 -1.73 118.70 115.38 1ccf s GLU 74 Ca 0.65 0.19 0.00 0.00 0.00 0.00 0.00 54.97 55.82 1ccf s GLU 74 Cb -0.13 -4.77 0.00 0.00 2.00 0.00 0.00 34.13 31.23 1ccf s GLU 74 CO 0.53 -3.23 0.00 0.41 -0.56 0.00 0.00 175.26 172.42 1ccf n GLY 75 N 6.39 0.93 3.60 -1.50 0.00 -1.26 -5.11 105.19 108.24 1ccf n GLY 75 Ca 0.33 -0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.11 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 2.52 -0.22 1.61 0.40 -0.71 -1.85 117.98 119.74 1ccf s PHE 76 Ca 0.00 -0.40 -0.20 0.00 -0.60 0.00 0.00 56.93 55.73 1ccf s PHE 76 Cb 0.00 -1.37 0.06 0.00 0.51 0.00 0.00 43.02 42.22 1ccf s PHE 76 CO 0.00 0.54 0.58 -2.00 0.70 0.00 0.00 175.22 175.04 1ccf s GLU 77 N -3.67 0.67 0.00 0.44 2.12 -0.75 -4.56 118.70 112.95 1ccf s GLU 77 Ca 0.33 0.81 0.00 0.00 0.36 0.00 0.00 54.97 56.47 1ccf s GLU 77 Cb -0.01 0.32 0.00 0.00 0.26 0.00 0.00 34.13 34.70 1ccf s GLU 77 CO 0.18 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.23 1ccf n GLY 78 N 2.80 3.15 0.33 -1.50 0.00 -1.26 -2.35 105.19 106.36 1ccf n GLY 78 Ca -0.14 -1.54 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 1ccf n GLY 78 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ccf h LYS 79 N 0.00 -0.34 -0.52 1.61 3.64 -2.01 0.18 116.57 119.13 1ccf h LYS 79 Ca 0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1ccf h LYS 79 Cb 0.00 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1ccf h LYS 79 CO 0.00 -0.23 0.00 0.09 -2.27 0.00 0.00 179.45 177.04 1ccf n ASN 80 N -5.41 3.45 -0.60 4.20 3.02 -1.26 -4.70 115.26 113.96 1ccf n ASN 80 Ca -0.02 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 1ccf n ASN 80 Cb 0.32 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 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 0.00 -6.28 0.00 4.81 -1.81 -3.42 114.58 107.88 1ccf h GLU 82 Ca 0.00 0.00 -0.47 0.00 -0.13 0.00 0.00 59.36 58.76 1ccf h GLU 82 Cb 0.93 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 1ccf h GLU 82 CO 0.00 0.00 -0.32 -0.06 -0.73 0.00 0.00 179.01 177.90 1ccf s PHE 83 N -3.20 2.63 -0.64 0.92 0.08 -0.99 -4.98 117.98 111.79 1ccf s PHE 83 Ca 0.07 -0.49 0.05 0.00 0.12 0.00 0.00 56.93 56.67 1ccf s PHE 83 Cb 0.08 -2.23 0.16 0.00 -0.57 0.00 0.00 43.02 40.46 1ccf s PHE 83 CO 0.68 -0.30 0.43 -1.54 -0.10 0.00 0.00 175.22 174.39 1ccf s SER 84 N -4.24 4.55 -0.58 1.36 1.04 -1.26 -1.82 113.70 112.75 1ccf s SER 84 Ca 0.51 -3.61 -0.03 0.00 0.48 0.00 0.00 55.95 53.30 1ccf s SER 84 Cb -0.06 -1.58 0.00 0.00 0.10 0.00 0.00 66.02 64.49 1ccf s SER 84 CO 0.30 -0.12 0.05 0.35 0.98 0.00 0.00 173.24 174.79 1ccf n THR 85 N 2.30 -0.51 1.77 2.02 -2.24 -0.77 -4.88 114.28 111.97 1ccf n THR 85 Ca 0.16 -0.20 0.15 0.00 -2.27 0.00 0.00 64.05 61.89 1ccf n THR 85 Cb 0.35 -0.48 0.75 0.00 -2.10 0.00 0.00 70.33 68.85 1ccf n THR 85 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04