#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 0.42 0.12 -5.58 1.01 -1.26 -4.99 116.67 106.40 1ccf s ASP 46 Ca 0.00 0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.47 1ccf s ASP 46 Cb 0.00 0.09 0.00 0.00 1.01 0.00 0.00 42.92 44.02 1ccf s ASP 46 CO 0.00 -0.19 0.00 0.61 0.21 0.00 0.00 175.17 175.80 1ccf n GLY 47 N 4.74 -0.65 0.03 0.21 0.00 -1.26 -4.95 105.19 103.31 1ccf n GLY 47 Ca -0.16 0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1ccf n GLY 47 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ccf n ASP 48 N -2.80 0.34 -2.31 1.61 2.03 -1.26 -4.99 116.55 109.16 1ccf n ASP 48 Ca 0.00 -1.23 -0.10 0.00 0.52 0.00 0.00 54.79 53.98 1ccf n ASP 48 Cb 0.00 -0.02 -0.02 0.00 -0.72 0.00 0.00 41.12 40.37 1ccf n ASP 48 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ccf n GLN 49 N -0.09 -1.65 -0.68 -0.67 3.00 -1.26 -4.47 117.38 111.56 1ccf n GLN 49 Ca 0.00 0.03 -0.03 0.00 -0.01 0.00 0.00 57.00 56.99 1ccf n GLN 49 Cb 0.47 -2.70 -0.03 0.00 0.00 0.00 0.00 30.24 27.98 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 0.00 0.81 -0.87 0.00 -0.58 -1.26 -2.80 120.64 115.94 1ccf n GLU 51 Ca -0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 1ccf n GLU 51 Cb 0.48 -1.27 -0.00 0.00 -0.57 0.00 0.00 31.44 30.07 1ccf n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ccf n GLY 52 N 0.31 0.74 3.47 0.62 0.00 -1.26 -5.04 105.19 104.02 1ccf n GLY 52 Ca 0.00 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 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 0.15 -2.70 0.07 1.61 -0.00 -1.12 -4.86 115.22 108.37 1ccf n HIS 53 Ca -0.02 1.12 -0.14 0.00 0.46 0.00 0.00 57.72 59.14 1ccf n HIS 53 Cb 0.80 -2.21 -0.14 0.00 -0.12 0.00 0.00 29.99 28.32 1ccf n HIS 53 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1ccf h PRO 54 N 1.71 0.19 -7.05 1.57 0.10 -1.94 -3.44 132.00 123.14 1ccf h PRO 54 Ca -0.51 -0.32 -0.47 0.00 0.10 0.00 0.00 66.00 64.80 1ccf h PRO 54 Cb 1.36 0.12 0.02 0.00 0.10 0.00 0.00 31.00 32.60 1ccf h PRO 54 CO 0.25 1.09 0.38 0.00 0.10 0.00 0.00 178.00 179.82 1ccf s LEU 56 N -3.28 3.32 -0.90 0.00 1.43 0.32 -4.48 118.68 115.08 1ccf s LEU 56 Ca 0.65 -0.50 -0.18 0.00 -1.03 0.00 0.00 54.13 53.06 1ccf s LEU 56 Cb -0.16 -2.24 0.03 0.00 0.03 0.00 0.00 46.19 43.84 1ccf s LEU 56 CO 0.20 -1.17 0.34 0.59 0.23 0.00 0.00 176.35 176.54 1ccf n ASN 57 N -2.19 -1.87 -3.72 2.29 3.02 -1.26 -1.01 115.26 110.51 1ccf n ASN 57 Ca 0.12 -0.90 -0.26 0.00 -0.03 0.00 0.00 54.58 53.51 1ccf n ASN 57 Cb 0.60 -1.09 0.05 0.00 -0.61 0.00 0.00 39.78 38.74 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 -3.72 -6.56 -1.63 3.52 1.13 -1.26 -4.94 117.38 103.92 1ccf n GLN 58 Ca -0.12 0.72 -0.29 0.00 -1.94 0.00 0.00 57.00 55.37 1ccf n GLN 58 Cb 0.41 -5.65 0.12 0.00 0.11 0.00 0.00 30.24 25.23 1ccf n GLN 58 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1ccf s GLY 59 N -3.52 1.58 -0.09 1.08 0.00 -0.18 -4.71 107.32 101.48 1ccf s GLY 59 Ca 0.51 -0.53 -0.16 0.00 0.00 0.00 0.00 44.72 44.54 1ccf s GLY 59 CO 0.78 0.00 0.41 -1.58 0.00 0.00 0.00 173.10 172.71 1ccf s HIS 60 N -3.34 3.57 -0.48 1.90 2.46 -0.10 -4.90 115.29 114.40 1ccf s HIS 60 Ca 0.63 0.85 -0.16 0.00 0.47 0.00 0.00 55.06 56.84 1ccf s HIS 60 Cb -0.14 -2.42 0.07 0.00 -0.13 0.00 0.00 32.58 29.96 1ccf s HIS 60 CO 0.52 0.33 0.45 0.00 -2.47 0.00 0.00 174.74 173.58 1ccf s LYS 62 N 1.91 3.98 0.00 0.00 -0.14 -0.27 -4.97 119.74 120.24 1ccf s LYS 62 Ca 0.07 0.49 0.00 0.00 -1.36 0.00 0.00 55.97 55.17 1ccf s LYS 62 Cb -0.23 -2.93 0.00 0.00 -1.68 0.00 0.00 37.83 32.99 1ccf s LYS 62 CO 0.08 0.48 0.00 0.41 -0.76 0.00 0.00 175.35 175.56 1ccf n GLY 64 N 0.80 1.25 3.38 -3.33 0.00 -0.72 -2.51 105.19 104.06 1ccf n GLY 64 Ca -0.05 0.21 -0.45 0.00 0.00 0.00 0.00 46.02 45.73 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 1.52 5.44 0.00 -0.61 1.01 -1.26 -4.67 121.20 122.63 1ccf s ILE 65 Ca 0.00 -2.62 0.00 0.00 0.00 0.00 0.00 60.65 58.03 1ccf s ILE 65 Cb 0.00 -4.67 0.00 0.00 0.01 0.00 0.00 42.46 37.80 1ccf s ILE 65 CO 0.00 -1.30 0.00 0.61 0.00 0.00 0.00 174.94 174.25 1ccf n GLY 66 N 3.92 1.89 3.78 6.18 0.00 -1.26 -4.93 105.19 114.77 1ccf n GLY 66 Ca 0.24 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1ccf n GLY 66 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ccf s ASP 67 N 0.00 3.78 0.09 1.61 1.47 -1.26 -4.74 116.67 117.62 1ccf s ASP 67 Ca 0.00 1.16 -0.12 0.00 1.18 0.00 0.00 52.55 54.78 1ccf s ASP 67 Cb 0.00 -1.82 0.01 0.00 -0.34 0.00 0.00 42.92 40.78 1ccf s ASP 67 CO 0.00 -2.40 0.27 -0.72 0.68 0.00 0.00 175.17 173.00 1ccf s TYR 68 N -3.17 -0.00 -0.03 2.11 1.13 -1.26 -1.76 117.35 114.37 1ccf s TYR 68 Ca 0.63 -0.34 0.01 0.00 -1.41 0.00 0.00 57.07 55.95 1ccf s TYR 68 Cb -0.15 0.07 0.02 0.00 -1.10 0.00 0.00 41.96 40.79 1ccf s TYR 68 CO 0.54 -0.58 -0.02 0.95 -2.51 0.00 0.00 175.55 173.93 1ccf s THR 69 N -3.61 0.26 -0.13 -3.49 -4.23 -1.04 -4.99 115.64 98.41 1ccf s THR 69 Ca 0.03 -0.01 -0.19 0.00 -1.18 0.00 0.00 61.69 60.34 1ccf s THR 69 Cb 0.03 -0.32 -0.04 0.00 1.34 0.00 0.00 72.50 73.51 1ccf s THR 69 CO -0.10 0.14 0.50 0.00 -0.54 0.00 0.00 174.62 174.62 1ccf s THR 71 N 0.80 4.11 0.38 0.00 2.01 0.20 -4.92 115.64 118.21 1ccf s THR 71 Ca 0.26 -1.34 -0.27 0.00 0.31 0.00 0.00 61.69 60.66 1ccf s THR 71 Cb -0.15 -3.48 -0.09 0.00 0.01 0.00 0.00 72.50 68.79 1ccf s THR 71 CO 0.11 -0.43 1.23 0.00 -0.69 0.00 0.00 174.62 174.84 1ccf s ALA 73 N -1.29 2.11 0.43 0.00 0.00 -1.26 -4.83 121.76 116.92 1ccf s ALA 73 Ca 0.54 -0.52 -0.25 0.00 0.00 0.00 0.00 51.96 51.74 1ccf s ALA 73 Cb -0.35 -3.02 -0.10 0.00 0.00 0.00 0.00 23.12 19.66 1ccf s ALA 73 CO 0.45 -2.01 1.19 -1.91 0.00 0.00 0.00 175.76 173.48 1ccf n GLU 74 N -3.58 1.72 0.00 0.00 0.00 -1.26 -0.66 120.64 116.86 1ccf n GLU 74 Ca 0.07 0.62 0.00 0.00 0.00 0.00 0.00 57.16 57.85 1ccf n GLU 74 Cb 0.59 -2.29 0.00 0.00 0.00 0.00 0.00 31.44 29.74 1ccf n GLU 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1ccf n GLY 75 N 0.93 3.30 3.10 8.31 0.00 -1.26 -5.02 105.19 114.54 1ccf n GLY 75 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.99 1.05 0.26 1.61 0.08 0.16 -3.15 117.98 115.00 1ccf s PHE 76 Ca 0.00 -0.30 -0.20 0.00 0.12 0.00 0.00 56.93 56.56 1ccf s PHE 76 Cb 0.00 -0.64 0.07 0.00 -0.57 0.00 0.00 43.02 41.88 1ccf s PHE 76 CO 0.00 0.00 0.93 -1.83 -0.10 0.00 0.00 175.22 174.23 1ccf s GLU 77 N -0.82 1.67 0.00 0.44 -1.05 0.67 -4.29 118.70 115.31 1ccf s GLU 77 Ca 0.01 -1.06 0.00 0.00 -0.15 0.00 0.00 54.97 53.77 1ccf s GLU 77 Cb -0.06 0.47 0.00 0.00 -0.44 0.00 0.00 34.13 34.10 1ccf s GLU 77 CO 0.01 -0.78 0.00 0.41 0.95 0.00 0.00 175.26 175.85 1ccf n GLY 78 N -0.62 1.89 0.35 -3.83 0.00 -1.26 0.23 105.19 101.94 1ccf n GLY 78 Ca -0.05 -1.99 0.02 0.00 0.00 0.00 0.00 46.02 44.00 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 -1.66 -0.16 -0.11 1.61 4.81 -1.26 -1.07 118.16 120.32 1ccf n LYS 79 Ca 0.00 1.44 0.10 0.00 -0.87 0.00 0.00 58.31 58.98 1ccf n LYS 79 Cb 0.00 -2.15 0.15 0.00 0.02 0.00 0.00 35.03 33.05 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 -5.44 2.40 -0.74 3.14 3.02 -1.26 -4.91 115.26 111.47 1ccf n ASN 80 Ca 0.12 -3.12 -0.00 0.00 -0.03 0.00 0.00 54.58 51.55 1ccf n ASN 80 Cb 0.42 -0.44 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 n GLU 82 N -0.77 0.65 -2.89 0.00 2.13 -0.64 -4.43 120.64 114.69 1ccf n GLU 82 Ca -0.00 0.24 -0.43 0.00 0.66 0.00 0.00 57.16 57.63 1ccf n GLU 82 Cb 0.50 -1.74 -0.04 0.00 0.27 0.00 0.00 31.44 30.43 1ccf n GLU 82 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1ccf s PHE 83 N -2.58 2.73 0.00 4.31 0.08 0.62 -4.73 117.98 118.41 1ccf s PHE 83 Ca -0.07 -0.63 0.00 0.00 0.12 0.00 0.00 56.93 56.35 1ccf s PHE 83 Cb 0.08 -4.27 0.00 0.00 -0.57 0.00 0.00 43.02 38.26 1ccf s PHE 83 CO 0.82 -1.61 0.00 0.43 -0.10 0.00 0.00 175.22 174.76 1ccf n SER 84 N 7.52 0.00 -3.92 1.36 7.64 -1.26 -0.24 113.62 124.73 1ccf n SER 84 Ca -0.03 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.57 1ccf n SER 84 Cb 0.45 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.66 1ccf n SER 84 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1ccf n THR 85 N -0.68 -2.67 -1.59 0.44 -2.24 -1.19 -4.93 114.28 101.43 1ccf n THR 85 Ca 0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1ccf n THR 85 Cb 0.00 -2.85 0.00 0.00 -2.10 0.00 0.00 70.33 65.38 1ccf n THR 85 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36