#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ccf n ASP 46 N 0.00 1.08 0.00 -5.58 8.00 -1.26 -5.11 116.55 113.68 1ccf n ASP 46 Ca 0.00 -2.23 0.00 0.00 0.71 0.00 0.00 54.79 53.27 1ccf n ASP 46 Cb 0.00 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 1ccf n ASP 46 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ccf n GLY 47 N 0.30 -2.16 3.03 0.44 0.00 -1.26 -4.80 105.19 100.74 1ccf n GLY 47 Ca 0.08 -1.47 -0.31 0.00 0.00 0.00 0.00 46.02 44.32 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 -3.35 3.07 0.00 1.61 1.01 -1.26 -4.97 116.67 112.78 1ccf s ASP 48 Ca 0.00 -0.69 0.22 0.00 0.71 0.00 0.00 52.55 52.79 1ccf s ASP 48 Cb 0.00 -1.27 -0.26 0.00 1.01 0.00 0.00 42.92 42.40 1ccf s ASP 48 CO 0.00 -0.08 0.65 0.00 0.21 0.00 0.00 175.17 175.94 1ccf n GLN 49 N 4.70 0.51 0.11 8.23 3.00 -1.26 -3.96 117.38 128.71 1ccf n GLN 49 Ca -0.17 -0.12 0.13 0.00 -0.01 0.00 0.00 57.00 56.82 1ccf n GLN 49 Cb 0.49 -1.55 0.30 0.00 0.00 0.00 0.00 30.24 29.47 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 -2.34 0.75 -0.16 0.00 4.07 -1.25 -2.69 120.64 119.01 1ccf n GLU 51 Ca 0.05 0.00 0.05 0.00 -0.06 0.00 0.00 57.16 57.20 1ccf n GLU 51 Cb 0.45 -1.35 0.14 0.00 -0.06 0.00 0.00 31.44 30.62 1ccf n GLU 51 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ccf n GLY 52 N 0.17 2.74 3.46 8.31 0.00 -1.20 -4.99 105.19 113.68 1ccf n GLY 52 Ca 0.00 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.52 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 0.43 -2.40 0.03 1.61 -0.00 -1.09 -4.90 115.22 108.90 1ccf n HIS 53 Ca 0.10 0.86 -0.08 0.00 0.46 0.00 0.00 57.72 59.06 1ccf n HIS 53 Cb 0.41 -3.50 -0.13 0.00 -0.12 0.00 0.00 29.99 26.65 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 -0.40 0.02 -6.56 1.57 0.13 -1.87 -3.46 132.00 121.44 1ccf h PRO 54 Ca -0.39 -0.03 -0.52 0.00 -0.87 0.00 0.00 66.00 64.18 1ccf h PRO 54 Cb 1.23 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 1ccf h PRO 54 CO 0.37 0.84 0.02 0.00 -0.23 0.00 0.00 178.00 179.00 1ccf s LEU 56 N -2.54 3.25 -0.73 0.00 1.43 0.27 -4.49 118.68 115.87 1ccf s LEU 56 Ca 0.47 -0.26 -0.19 0.00 -1.03 0.00 0.00 54.13 53.13 1ccf s LEU 56 Cb -0.13 -2.49 0.03 0.00 0.03 0.00 0.00 46.19 43.63 1ccf s LEU 56 CO 0.19 -1.26 0.42 0.59 0.23 0.00 0.00 176.35 176.52 1ccf n ASN 57 N -2.36 -2.67 -3.92 2.29 3.02 -1.26 -0.88 115.26 109.48 1ccf n ASN 57 Ca 0.10 -0.80 -0.29 0.00 -0.03 0.00 0.00 54.58 53.56 1ccf n ASN 57 Cb 0.60 -1.00 0.02 0.00 -0.61 0.00 0.00 39.78 38.79 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 -3.27 -5.14 -1.57 3.52 1.13 -1.26 -4.94 117.38 105.84 1ccf n GLN 58 Ca -0.10 0.57 -0.29 0.00 -1.94 0.00 0.00 57.00 55.24 1ccf n GLN 58 Cb 0.37 -5.37 0.17 0.00 0.11 0.00 0.00 30.24 25.52 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 -3.50 1.64 0.23 1.08 0.00 -0.06 -4.74 107.32 101.97 1ccf s GLY 59 Ca 0.55 -0.82 -0.13 0.00 0.00 0.00 0.00 44.72 44.32 1ccf s GLY 59 CO 0.84 -0.13 0.62 -1.58 0.00 0.00 0.00 173.10 172.84 1ccf s HIS 60 N -3.41 3.49 -0.03 1.90 2.46 0.12 -4.90 115.29 114.91 1ccf s HIS 60 Ca 0.68 1.07 -0.01 0.00 0.47 0.00 0.00 55.06 57.27 1ccf s HIS 60 Cb -0.10 -2.40 0.03 0.00 -0.13 0.00 0.00 32.58 29.97 1ccf s HIS 60 CO 0.54 0.28 0.05 0.00 -2.47 0.00 0.00 174.74 173.13 1ccf n LYS 62 N 4.86 0.57 0.00 0.00 4.76 -0.96 -5.03 118.16 122.36 1ccf n LYS 62 Ca -0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.31 1ccf n LYS 62 Cb 0.50 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.69 1ccf n LYS 62 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ccf n GLY 64 N 0.80 1.87 3.56 0.72 0.00 -0.61 -1.92 105.19 109.60 1ccf n GLY 64 Ca 0.00 0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 0.74 4.07 0.00 -0.61 -1.09 -1.26 -4.59 121.20 118.47 1ccf s ILE 65 Ca 0.00 -1.26 0.00 0.00 -2.23 0.00 0.00 60.65 57.16 1ccf s ILE 65 Cb 0.00 -5.09 0.00 0.00 -1.58 0.00 0.00 42.46 35.79 1ccf s ILE 65 CO 0.00 -1.93 0.00 0.61 -1.23 0.00 0.00 174.94 172.39 1ccf n GLY 66 N 6.21 1.84 3.74 6.18 0.00 -1.26 -4.87 105.19 117.03 1ccf n GLY 66 Ca 0.38 0.03 -0.29 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.93 3.38 0.15 1.61 -4.77 -1.26 -4.77 116.67 110.08 1ccf s ASP 67 Ca 0.00 1.20 0.08 0.00 -3.30 0.00 0.00 52.55 50.53 1ccf s ASP 67 Cb 0.00 -1.86 -0.04 0.00 -1.09 0.00 0.00 42.92 39.93 1ccf s ASP 67 CO 0.00 -2.66 -0.08 -0.72 0.70 0.00 0.00 175.17 172.41 1ccf s TYR 68 N -3.08 2.71 -0.10 2.11 1.13 -1.26 -1.57 117.35 117.28 1ccf s TYR 68 Ca 0.64 -0.18 0.03 0.00 -1.41 0.00 0.00 57.07 56.14 1ccf s TYR 68 Cb -0.17 -1.36 -0.01 0.00 -1.10 0.00 0.00 41.96 39.33 1ccf s TYR 68 CO 0.56 0.48 -0.21 0.95 -2.51 0.00 0.00 175.55 174.82 1ccf s THR 69 N -1.52 2.37 -0.12 -3.49 -4.23 -0.81 -4.90 115.64 102.95 1ccf s THR 69 Ca 0.24 -0.92 -0.04 0.00 -1.18 0.00 0.00 61.69 59.79 1ccf s THR 69 Cb -0.10 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.78 1ccf s THR 69 CO 0.15 0.55 0.04 0.00 -0.54 0.00 0.00 174.62 174.82 1ccf s THR 71 N -0.57 1.91 0.41 0.00 -4.23 0.38 -4.95 115.64 108.59 1ccf s THR 71 Ca 0.10 -1.22 -0.24 0.00 -1.18 0.00 0.00 61.69 59.15 1ccf s THR 71 Cb -0.12 -1.94 -0.08 0.00 1.34 0.00 0.00 72.50 71.69 1ccf s THR 71 CO 0.02 0.17 1.13 0.00 -0.54 0.00 0.00 174.62 175.40 1ccf s ALA 73 N -1.52 3.17 0.46 0.00 0.00 -1.26 -4.85 121.76 117.77 1ccf s ALA 73 Ca 0.58 -0.88 -0.22 0.00 0.00 0.00 0.00 51.96 51.45 1ccf s ALA 73 Cb -0.27 -2.61 -0.10 0.00 0.00 0.00 0.00 23.12 20.13 1ccf s ALA 73 CO 0.34 -1.22 0.81 -1.91 0.00 0.00 0.00 175.76 173.78 1ccf n GLU 74 N -2.87 0.96 0.00 0.00 2.13 -1.26 -0.66 120.64 118.94 1ccf n GLU 74 Ca 0.07 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.24 1ccf n GLU 74 Cb 0.60 -1.86 0.00 0.00 0.27 0.00 0.00 31.44 30.45 1ccf n GLU 74 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ccf n GLY 75 N 1.45 3.29 3.11 8.31 0.00 -1.26 -5.00 105.19 115.08 1ccf n GLY 75 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.63 1.06 0.21 1.61 0.08 0.16 -3.11 117.98 115.37 1ccf s PHE 76 Ca 0.00 -0.33 -0.22 0.00 0.12 0.00 0.00 56.93 56.50 1ccf s PHE 76 Cb 0.00 -0.64 0.06 0.00 -0.57 0.00 0.00 43.02 41.88 1ccf s PHE 76 CO 0.00 0.01 0.94 -1.83 -0.10 0.00 0.00 175.22 174.24 1ccf s GLU 77 N -1.02 1.46 0.00 0.44 -1.05 0.83 -4.31 118.70 115.05 1ccf s GLU 77 Ca 0.00 -0.88 0.00 0.00 -0.15 0.00 0.00 54.97 53.94 1ccf s GLU 77 Cb -0.07 0.45 0.00 0.00 -0.44 0.00 0.00 34.13 34.06 1ccf s GLU 77 CO 0.01 -0.68 0.00 0.41 0.95 0.00 0.00 175.26 175.95 1ccf n GLY 78 N -0.56 2.77 0.37 -3.83 0.00 -1.26 0.19 105.19 102.87 1ccf n GLY 78 Ca -0.05 -1.81 0.01 0.00 0.00 0.00 0.00 46.02 44.17 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 -1.89 -0.18 -0.32 1.61 4.81 -1.26 -0.69 118.16 120.24 1ccf n LYS 79 Ca 0.00 1.50 0.08 0.00 -0.87 0.00 0.00 58.31 59.02 1ccf n LYS 79 Cb 0.00 -2.23 0.21 0.00 0.02 0.00 0.00 35.03 33.03 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 -5.48 3.09 -1.07 3.14 3.02 -1.26 -4.91 115.26 111.79 1ccf n ASN 80 Ca 0.12 -3.13 -0.04 0.00 -0.03 0.00 0.00 54.58 51.50 1ccf n ASN 80 Cb 0.42 -0.50 0.01 0.00 -0.61 0.00 0.00 39.78 39.10 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 -0.46 0.00 -5.38 0.00 4.81 -1.70 -3.40 114.58 108.45 1ccf h GLU 82 Ca -0.10 0.00 -0.64 0.00 -0.13 0.00 0.00 59.36 58.50 1ccf h GLU 82 Cb 1.06 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.29 1ccf h GLU 82 CO 0.10 0.49 0.50 -0.06 -0.73 0.00 0.00 179.01 179.31 1ccf s PHE 83 N -2.70 2.71 0.00 0.92 0.08 0.51 -4.72 117.98 114.78 1ccf s PHE 83 Ca -0.03 -0.57 0.00 0.00 0.12 0.00 0.00 56.93 56.45 1ccf s PHE 83 Cb 0.08 -4.25 0.00 0.00 -0.57 0.00 0.00 43.02 38.29 1ccf s PHE 83 CO 0.82 -1.60 0.00 0.43 -0.10 0.00 0.00 175.22 174.77 1ccf n SER 84 N 7.55 0.00 -3.88 1.36 7.64 -1.26 -0.12 113.62 124.91 1ccf n SER 84 Ca -0.04 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.55 1ccf n SER 84 Cb 0.45 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.68 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 -0.76 -2.56 0.98 0.44 -2.24 -1.18 -4.95 114.28 104.01 1ccf n THR 85 Ca 0.00 -0.13 0.08 0.00 -2.27 0.00 0.00 64.05 61.73 1ccf n THR 85 Cb 0.00 -3.00 0.46 0.00 -2.10 0.00 0.00 70.33 65.70 1ccf n THR 85 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04