#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 6.27 1.36 3.14 1.01 -1.26 -5.07 116.67 122.12 1ccf s ASP 46 Ca 0.00 0.05 -0.19 0.00 0.71 0.00 0.00 52.55 53.12 1ccf s ASP 46 Cb 0.00 -1.83 0.35 0.00 1.01 0.00 0.00 42.92 42.44 1ccf s ASP 46 CO 0.00 -0.06 0.92 0.61 0.21 0.00 0.00 175.17 176.85 1ccf n GLY 47 N -1.36 -3.15 3.75 0.21 0.00 -1.26 -4.96 105.19 98.43 1ccf n GLY 47 Ca -0.09 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.75 6.85 0.00 1.61 1.01 -1.26 -4.93 116.67 117.19 1ccf s ASP 48 Ca 0.68 1.01 0.22 0.00 0.71 0.00 0.00 52.55 55.17 1ccf s ASP 48 Cb -0.18 -2.32 -0.00 0.00 1.01 0.00 0.00 42.92 41.43 1ccf s ASP 48 CO 0.61 0.08 1.07 0.00 0.21 0.00 0.00 175.17 177.14 1ccf n GLN 49 N 3.01 0.40 -0.00 8.23 3.00 -1.26 -4.41 117.38 126.35 1ccf n GLN 49 Ca -0.08 -0.32 0.03 0.00 -0.01 0.00 0.00 57.00 56.62 1ccf n GLN 49 Cb 0.51 -1.49 -0.03 0.00 0.00 0.00 0.00 30.24 29.23 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 -1.17 0.65 -0.74 0.00 -0.58 -1.26 -2.72 120.64 114.82 1ccf n GLU 51 Ca 0.01 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.79 1ccf n GLU 51 Cb 0.09 -1.32 0.07 0.00 -0.57 0.00 0.00 31.44 29.71 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 0.18 2.39 3.10 0.62 0.00 -1.26 -5.04 105.19 105.18 1ccf n GLY 52 Ca 0.00 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.34 -2.61 -0.06 1.61 -0.00 -1.10 -4.93 115.22 107.78 1ccf n HIS 53 Ca 0.09 1.10 -0.12 0.00 0.46 0.00 0.00 57.72 59.25 1ccf n HIS 53 Cb 0.82 -2.70 -0.15 0.00 -0.12 0.00 0.00 29.99 27.84 1ccf n HIS 53 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1ccf n PRO 54 N 0.28 0.67 -2.02 1.57 -0.04 -1.26 -4.98 135.00 129.22 1ccf n PRO 54 Ca 0.01 0.15 -0.30 0.00 -0.04 0.00 0.00 63.50 63.32 1ccf n PRO 54 Cb 0.45 -1.64 0.03 0.00 -0.04 0.00 0.00 33.50 32.30 1ccf n PRO 54 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ccf s LEU 56 N -5.21 2.92 -1.51 0.00 1.43 -0.24 -4.62 118.68 111.45 1ccf s LEU 56 Ca 0.56 -1.19 -0.01 0.00 -1.03 0.00 0.00 54.13 52.45 1ccf s LEU 56 Cb -0.11 -1.29 0.01 0.00 0.03 0.00 0.00 46.19 44.83 1ccf s LEU 56 CO 0.51 -0.70 0.17 0.59 0.23 0.00 0.00 176.35 177.15 1ccf n ASN 57 N -1.35 0.38 -3.57 2.29 3.02 -1.26 -0.11 115.26 114.65 1ccf n ASN 57 Ca -0.04 -1.18 -0.20 0.00 -0.03 0.00 0.00 54.58 53.13 1ccf n ASN 57 Cb 0.65 -2.13 0.07 0.00 -0.61 0.00 0.00 39.78 37.76 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 -4.51 -6.16 -2.46 3.52 3.00 -1.26 -4.88 117.38 104.63 1ccf n GLN 58 Ca -0.31 0.76 -0.28 0.00 -0.01 0.00 0.00 57.00 57.16 1ccf n GLN 58 Cb 0.69 -5.62 0.00 0.00 0.00 0.00 0.00 30.24 25.31 1ccf n GLN 58 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1ccf s GLY 59 N -4.18 1.54 0.45 1.08 0.00 0.84 -4.44 107.32 102.61 1ccf s GLY 59 Ca 0.11 -0.45 -0.06 0.00 0.00 0.00 0.00 44.72 44.32 1ccf s GLY 59 CO 0.76 -0.25 0.76 -1.58 0.00 0.00 0.00 173.10 172.79 1ccf s HIS 60 N -2.85 3.53 -0.09 1.90 2.46 0.76 -4.83 115.29 116.17 1ccf s HIS 60 Ca 0.50 0.85 -0.04 0.00 0.47 0.00 0.00 55.06 56.84 1ccf s HIS 60 Cb -0.10 -2.31 0.04 0.00 -0.13 0.00 0.00 32.58 30.08 1ccf s HIS 60 CO 0.47 -0.19 0.19 0.00 -2.47 0.00 0.00 174.74 172.73 1ccf n LYS 62 N 4.41 0.59 0.00 0.00 3.00 -0.84 -4.98 118.16 120.33 1ccf n LYS 62 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.08 1ccf n LYS 62 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.55 1ccf n LYS 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ccf n GLY 64 N 1.21 1.87 3.42 3.14 0.00 -0.89 -2.01 105.19 111.92 1ccf n GLY 64 Ca 0.00 0.25 -0.45 0.00 0.00 0.00 0.00 46.02 45.83 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 1.85 4.99 0.00 -0.61 1.01 -1.26 -4.69 121.20 122.48 1ccf s ILE 65 Ca 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 60.65 58.77 1ccf s ILE 65 Cb 0.00 -4.70 0.00 0.00 0.01 0.00 0.00 42.46 37.77 1ccf s ILE 65 CO 0.00 -1.38 0.00 0.61 0.00 0.00 0.00 174.94 174.17 1ccf n GLY 66 N 5.01 2.13 1.71 6.18 0.00 -1.26 -4.86 105.19 114.10 1ccf n GLY 66 Ca 0.22 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 1ccf n GLY 66 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ccf n ASP 67 N 3.99 -0.44 -4.18 1.61 2.03 -1.26 -4.83 116.55 113.47 1ccf n ASP 67 Ca 0.00 -1.09 -0.11 0.00 0.52 0.00 0.00 54.79 54.11 1ccf n ASP 67 Cb 0.00 -0.46 -0.10 0.00 -0.72 0.00 0.00 41.12 39.84 1ccf n ASP 67 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1ccf s TYR 68 N -2.19 1.02 0.02 -0.67 1.13 -1.26 -2.09 117.35 113.30 1ccf s TYR 68 Ca 0.34 -1.25 0.03 0.00 -1.41 0.00 0.00 57.07 54.77 1ccf s TYR 68 Cb -0.02 -0.55 -0.01 0.00 -1.10 0.00 0.00 41.96 40.28 1ccf s TYR 68 CO 0.24 -0.51 -0.10 0.95 -2.51 0.00 0.00 175.55 173.62 1ccf s THR 69 N -4.03 0.75 -0.01 -3.49 -4.23 -0.85 -4.90 115.64 98.88 1ccf s THR 69 Ca 0.29 -0.67 0.07 0.00 -1.18 0.00 0.00 61.69 60.20 1ccf s THR 69 Cb 0.07 -0.68 -0.03 0.00 1.34 0.00 0.00 72.50 73.21 1ccf s THR 69 CO 0.06 0.02 -0.21 0.00 -0.54 0.00 0.00 174.62 173.95 1ccf s THR 71 N -0.73 4.08 0.18 0.00 -4.23 -0.53 -4.95 115.64 109.46 1ccf s THR 71 Ca 0.12 -1.36 0.07 0.00 -1.18 0.00 0.00 61.69 59.34 1ccf s THR 71 Cb -0.10 -3.33 -0.04 0.00 1.34 0.00 0.00 72.50 70.37 1ccf s THR 71 CO 0.01 -0.27 -0.01 0.00 -0.54 0.00 0.00 174.62 173.81 1ccf s ALA 73 N -1.75 1.41 -0.61 0.00 0.00 -1.26 -4.77 121.76 114.78 1ccf s ALA 73 Ca 0.27 -0.07 -0.26 0.00 0.00 0.00 0.00 51.96 51.90 1ccf s ALA 73 Cb -0.09 -3.19 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 1ccf s ALA 73 CO 0.18 -2.47 2.19 -2.00 0.00 0.00 0.00 175.76 173.67 1ccf s GLU 74 N -4.91 2.24 0.00 0.00 2.12 -1.26 -1.31 118.70 115.58 1ccf s GLU 74 Ca 0.64 0.86 0.00 0.00 0.36 0.00 0.00 54.97 56.82 1ccf s GLU 74 Cb -0.18 -4.60 0.00 0.00 0.26 0.00 0.00 34.13 29.61 1ccf s GLU 74 CO 0.57 -3.28 0.00 0.41 -0.54 0.00 0.00 175.26 172.42 1ccf n GLY 75 N 6.10 2.54 3.89 -1.50 0.00 -1.26 -5.11 105.19 109.85 1ccf n GLY 75 Ca 0.33 -0.28 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 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 2.88 -0.28 1.61 0.40 -0.43 -0.63 117.98 121.53 1ccf s PHE 76 Ca 0.00 -0.34 -0.11 0.00 -0.60 0.00 0.00 56.93 55.87 1ccf s PHE 76 Cb 0.00 -1.95 0.11 0.00 0.51 0.00 0.00 43.02 41.69 1ccf s PHE 76 CO 0.00 0.04 0.63 -2.00 0.70 0.00 0.00 175.22 174.60 1ccf s GLU 77 N -4.08 0.59 0.00 0.44 2.12 -0.46 -4.57 118.70 112.74 1ccf s GLU 77 Ca 0.44 1.33 0.00 0.00 0.36 0.00 0.00 54.97 57.11 1ccf s GLU 77 Cb -0.06 0.59 0.00 0.00 0.26 0.00 0.00 34.13 34.92 1ccf s GLU 77 CO 0.28 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 175.22 1ccf n GLY 78 N 5.08 2.11 0.38 -1.50 0.00 -1.26 -3.73 105.19 106.26 1ccf n GLY 78 Ca -0.14 -1.00 -0.06 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.16 -0.37 1.61 3.11 -2.00 -0.72 116.57 118.05 1ccf h LYS 79 Ca 0.00 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1ccf h LYS 79 Cb 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.27 1ccf h LYS 79 CO 0.00 -0.10 0.00 0.09 -2.81 0.00 0.00 179.45 176.63 1ccf n ASN 80 N -5.42 3.32 -0.03 4.20 3.02 -1.26 -4.59 115.26 114.50 1ccf n ASN 80 Ca 0.04 -1.95 -0.00 0.00 -0.03 0.00 0.00 54.58 52.63 1ccf n ASN 80 Cb 0.36 -0.24 -0.00 0.00 -0.61 0.00 0.00 39.78 39.28 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 0.50 0.00 -6.28 0.00 4.81 -1.83 -3.39 114.58 108.39 1ccf h GLU 82 Ca -0.01 0.00 -0.55 0.00 -0.13 0.00 0.00 59.36 58.67 1ccf h GLU 82 Cb 0.05 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 1ccf h GLU 82 CO 0.01 0.00 -0.25 -0.06 -0.73 0.00 0.00 179.01 177.98 1ccf s PHE 83 N -4.75 3.47 0.09 0.92 0.08 -1.24 -4.97 117.98 111.57 1ccf s PHE 83 Ca -0.05 0.58 0.08 0.00 0.12 0.00 0.00 56.93 57.66 1ccf s PHE 83 Cb 0.16 -2.03 -0.04 0.00 -0.57 0.00 0.00 43.02 40.55 1ccf s PHE 83 CO 0.60 0.34 -0.15 -1.54 -0.10 0.00 0.00 175.22 174.37 1ccf s SER 84 N -2.72 4.06 -0.54 1.36 1.04 -1.26 -1.36 113.70 114.27 1ccf s SER 84 Ca 0.42 -0.46 0.01 0.00 0.48 0.00 0.00 55.95 56.40 1ccf s SER 84 Cb -0.11 -0.67 0.53 0.00 0.10 0.00 0.00 66.02 65.87 1ccf s SER 84 CO 0.26 0.20 1.91 0.35 0.98 0.00 0.00 173.24 176.94 1ccf n THR 85 N 0.95 3.35 1.95 2.02 -2.24 0.20 -4.90 114.28 115.61 1ccf n THR 85 Ca -0.15 -2.64 0.16 0.00 -2.27 0.00 0.00 64.05 59.15 1ccf n THR 85 Cb 0.52 -0.86 0.93 0.00 -2.10 0.00 0.00 70.33 68.82 1ccf n THR 85 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04