#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ff7 s ASP 46 N 0.00 0.86 0.11 6.43 1.47 -1.26 -5.09 116.67 119.20 1ff7 s ASP 46 Ca 0.00 -1.11 -0.30 0.00 1.18 0.00 0.00 52.55 52.32 1ff7 s ASP 46 Cb 0.00 0.17 -0.07 0.00 -0.34 0.00 0.00 42.92 42.68 1ff7 s ASP 46 CO 0.00 -0.58 1.20 -0.83 0.68 0.00 0.00 175.17 175.63 1ff7 s GLY 47 N -3.07 2.51 -0.30 2.12 0.00 -1.26 -4.99 107.32 102.32 1ff7 s GLY 47 Ca 0.18 0.89 -0.19 0.00 0.00 0.00 0.00 44.72 45.60 1ff7 s GLY 47 CO -0.01 1.96 0.57 0.99 0.00 0.00 0.00 173.10 176.61 1ff7 s ASP 48 N 0.67 6.44 -0.30 1.64 1.01 -1.26 -4.69 116.67 120.17 1ff7 s ASP 48 Ca 0.56 0.35 0.09 0.00 0.71 0.00 0.00 52.55 54.26 1ff7 s ASP 48 Cb -0.31 -2.30 0.54 0.00 1.01 0.00 0.00 42.92 41.87 1ff7 s ASP 48 CO 0.32 -0.43 1.54 0.00 0.21 0.00 0.00 175.17 176.82 1ff7 n GLN 49 N 5.76 2.12 -2.49 8.23 6.02 -1.26 -4.57 117.38 131.19 1ff7 n GLN 49 Ca -0.03 -3.11 -0.13 0.00 -0.01 0.00 0.00 57.00 53.72 1ff7 n GLN 49 Cb 0.49 -1.89 0.03 0.00 1.02 0.00 0.00 30.24 29.89 1ff7 n GLN 49 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ff7 h ALA 51 N 2.51 0.58 -0.01 0.00 0.00 -2.03 -3.34 119.26 116.97 1ff7 h ALA 51 Ca 0.10 -0.80 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 1ff7 h ALA 51 Cb 1.31 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1ff7 h ALA 51 CO 0.51 0.99 -0.09 0.43 0.00 0.00 0.00 179.25 181.09 1ff7 n SER 52 N -3.17 2.30 -3.09 0.00 7.64 -1.26 -5.04 113.62 110.99 1ff7 n SER 52 Ca -0.03 -3.24 -0.16 0.00 1.01 0.00 0.00 58.87 56.45 1ff7 n SER 52 Cb 0.86 -0.45 0.02 0.00 -1.01 0.00 0.00 64.21 63.62 1ff7 n SER 52 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ff7 n SER 53 N -1.34 -6.98 0.17 6.43 7.64 -1.25 -4.87 113.62 113.42 1ff7 n SER 53 Ca 0.17 0.44 0.04 0.00 1.01 0.00 0.00 58.87 60.53 1ff7 n SER 53 Cb 0.66 -3.63 0.28 0.00 -1.01 0.00 0.00 64.21 60.52 1ff7 n SER 53 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1ff7 h PRO 54 N 2.43 0.00 -7.23 1.43 0.13 -1.90 -3.45 132.00 123.41 1ff7 h PRO 54 Ca -0.19 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.45 1ff7 h PRO 54 Cb 0.97 0.00 0.20 0.00 0.13 0.00 0.00 31.00 32.30 1ff7 h PRO 54 CO 0.16 0.43 0.15 0.00 -0.23 0.00 0.00 178.00 178.52 1ff7 s GLN 56 N -4.60 1.68 -1.40 0.00 0.74 0.11 -4.79 119.66 111.40 1ff7 s GLN 56 Ca 0.67 -1.97 -0.05 0.00 0.05 0.00 0.00 55.36 54.06 1ff7 s GLN 56 Cb -0.23 0.27 0.03 0.00 1.10 0.00 0.00 33.01 34.18 1ff7 s GLN 56 CO 0.60 -0.60 0.77 0.09 -0.55 0.00 0.00 175.29 175.60 1ff7 n ASN 57 N -1.33 -2.36 -2.59 6.67 3.02 -1.22 -0.85 115.26 116.60 1ff7 n ASN 57 Ca 0.06 -0.83 -0.21 0.00 -0.03 0.00 0.00 54.58 53.57 1ff7 n ASN 57 Cb 0.63 -3.88 0.01 0.00 -0.61 0.00 0.00 39.78 35.93 1ff7 n ASN 57 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ff7 n GLY 58 N -1.65 -0.49 3.80 7.41 0.00 -1.26 -4.95 105.19 108.04 1ff7 n GLY 58 Ca -0.18 0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 1ff7 n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ff7 s GLY 59 N -2.31 2.54 -0.21 -0.02 0.00 -0.03 -4.94 107.32 102.36 1ff7 s GLY 59 Ca 0.11 0.58 -0.20 0.00 0.00 0.00 0.00 44.72 45.21 1ff7 s GLY 59 CO 0.14 0.92 0.60 -0.56 0.00 0.00 0.00 173.10 174.20 1ff7 s SER 60 N -1.93 6.63 -0.04 1.64 0.01 0.88 -4.71 113.70 116.19 1ff7 s SER 60 Ca 0.64 0.77 -0.19 0.00 1.31 0.00 0.00 55.95 58.47 1ff7 s SER 60 Cb -0.16 -2.33 -0.05 0.00 0.21 0.00 0.00 66.02 63.69 1ff7 s SER 60 CO 0.20 -0.27 0.55 0.00 0.41 0.00 0.00 173.24 174.13 1ff7 s LYS 62 N 0.00 1.73 -1.02 0.00 1.02 -0.54 -4.97 119.74 115.95 1ff7 s LYS 62 Ca 0.29 -0.37 -0.23 0.00 0.02 0.00 0.00 55.97 55.68 1ff7 s LYS 62 Cb -0.17 -1.59 0.05 0.00 -0.52 0.00 0.00 37.83 35.60 1ff7 s LYS 62 CO 0.15 -0.13 1.45 -0.51 -0.92 0.00 0.00 175.35 175.39 1ff7 s ASP 63 N 1.20 6.51 0.45 2.83 1.01 -1.26 -1.90 116.67 125.52 1ff7 s ASP 63 Ca -0.04 -1.47 0.00 0.00 0.71 0.00 0.00 52.55 51.75 1ff7 s ASP 63 Cb -0.14 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1ff7 s ASP 63 CO -0.03 -1.50 0.00 0.00 0.21 0.00 0.00 175.17 173.85 1ff7 n GLN 64 N 8.87 0.64 -2.25 8.23 1.13 -1.20 -5.02 117.38 127.78 1ff7 n GLN 64 Ca 0.33 0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 55.02 1ff7 n GLN 64 Cb 0.51 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.85 1ff7 n GLN 64 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1ff7 s LEU 65 N 0.00 3.98 0.00 1.08 2.96 -1.26 -4.45 118.68 120.99 1ff7 s LEU 65 Ca 0.00 2.29 0.00 0.00 -0.22 0.00 0.00 54.13 56.20 1ff7 s LEU 65 Cb 0.00 -4.28 0.00 0.00 0.50 0.00 0.00 46.19 42.41 1ff7 s LEU 65 CO 0.00 -0.96 0.00 0.00 -1.32 0.00 0.00 176.35 174.07 1ff7 n GLN 66 N -0.59 0.00 0.00 1.98 6.02 -1.26 -4.56 117.38 118.97 1ff7 n GLN 66 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1ff7 n GLN 66 Cb 0.48 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.74 1ff7 n GLN 66 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1ff7 n SER 67 N 1.93 0.00 -1.74 1.08 2.88 -1.26 -4.67 113.62 111.84 1ff7 n SER 67 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1ff7 n SER 67 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1ff7 n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ff7 n TYR 68 N 0.00 0.02 -3.72 0.66 4.11 -1.26 -3.21 117.16 113.76 1ff7 n TYR 68 Ca 0.00 -0.22 -0.12 0.00 -0.00 0.00 0.00 57.90 57.56 1ff7 n TYR 68 Cb 0.00 -0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.22 1ff7 n TYR 68 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.86 175.36 1ff7 s ILE 69 N -1.60 -0.03 -0.43 -3.48 2.07 -0.80 -4.83 121.20 112.10 1ff7 s ILE 69 Ca 0.02 0.11 -0.17 0.00 -1.41 0.00 0.00 60.65 59.20 1ff7 s ILE 69 Cb 0.00 -0.46 0.03 0.00 0.13 0.00 0.00 42.46 42.16 1ff7 s ILE 69 CO 0.01 0.05 0.41 0.00 -1.91 0.00 0.00 174.94 173.50 1ff7 s PHE 71 N 1.98 3.09 0.00 0.00 0.08 0.16 -4.80 117.98 118.49 1ff7 s PHE 71 Ca 0.09 0.25 0.00 0.00 0.12 0.00 0.00 56.93 57.40 1ff7 s PHE 71 Cb -0.19 -3.36 0.00 0.00 -0.57 0.00 0.00 43.02 38.90 1ff7 s PHE 71 CO 0.11 -0.79 0.00 0.00 -0.10 0.00 0.00 175.22 174.45 1ff7 s LEU 73 N 0.00 3.24 0.01 0.00 1.43 -1.26 -4.95 118.68 117.15 1ff7 s LEU 73 Ca 0.00 0.91 0.12 0.00 -1.03 0.00 0.00 54.13 54.13 1ff7 s LEU 73 Cb 0.00 -3.78 0.50 0.00 0.03 0.00 0.00 46.19 42.94 1ff7 s LEU 73 CO 0.00 -1.01 1.37 -0.81 0.23 0.00 0.00 176.35 176.13 1ff7 n PRO 74 N -2.63 0.01 0.08 1.29 -0.04 -1.26 -2.07 135.00 130.38 1ff7 n PRO 74 Ca 0.04 0.32 0.12 0.00 -0.04 0.00 0.00 63.50 63.94 1ff7 n PRO 74 Cb 0.57 -1.52 0.08 0.00 -0.04 0.00 0.00 33.50 32.58 1ff7 n PRO 74 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ff7 h ALA 75 N 2.37 0.53 -2.55 0.55 0.00 -1.92 -3.47 119.26 114.77 1ff7 h ALA 75 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 1ff7 h ALA 75 Cb 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1ff7 h ALA 75 CO 0.00 0.00 -0.49 -0.06 0.00 0.00 0.00 179.25 178.70 1ff7 s PHE 76 N -3.27 3.38 0.30 0.00 0.08 -0.88 0.08 117.98 117.68 1ff7 s PHE 76 Ca 0.03 0.06 -0.07 0.00 0.12 0.00 0.00 56.93 57.07 1ff7 s PHE 76 Cb 0.11 -1.61 0.00 0.00 -0.57 0.00 0.00 43.02 40.95 1ff7 s PHE 76 CO 0.76 0.51 0.48 -2.00 -0.10 0.00 0.00 175.22 174.87 1ff7 s GLU 77 N -3.28 1.75 0.00 0.44 2.12 0.16 -4.76 118.70 115.13 1ff7 s GLU 77 Ca 0.33 -1.53 0.00 0.00 0.36 0.00 0.00 54.97 54.14 1ff7 s GLU 77 Cb -0.11 0.46 0.00 0.00 0.26 0.00 0.00 34.13 34.74 1ff7 s GLU 77 CO 0.27 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 1ff7 n GLY 78 N -0.47 2.89 0.20 -1.50 0.00 -1.26 -0.93 105.19 104.12 1ff7 n GLY 78 Ca -0.01 -1.96 -0.08 0.00 0.00 0.00 0.00 46.02 43.98 1ff7 n GLY 78 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ff7 h ARG 79 N 0.00 0.63 -0.56 1.61 2.43 -2.01 -2.80 114.38 113.68 1ff7 h ARG 79 Ca 0.00 -0.06 -0.29 0.00 -0.81 0.00 0.00 59.98 58.82 1ff7 h ARG 79 Cb 0.00 -0.13 -0.17 0.00 -0.42 0.00 0.00 29.97 29.25 1ff7 h ARG 79 CO 0.00 0.46 0.15 0.09 -1.51 0.00 0.00 179.97 179.16 1ff7 n ASN 80 N -4.72 2.88 -3.62 -3.80 5.03 -1.26 -4.75 115.26 105.02 1ff7 n ASN 80 Ca 0.02 -3.73 -0.23 0.00 0.87 0.00 0.00 54.58 51.50 1ff7 n ASN 80 Cb 0.05 -0.70 0.04 0.00 -1.02 0.00 0.00 39.78 38.15 1ff7 n ASN 80 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ff7 n GLU 82 N -4.06 1.71 -3.75 0.00 0.28 -1.02 -3.40 120.64 110.41 1ff7 n GLU 82 Ca -0.20 -2.97 -0.24 0.00 -0.16 0.00 0.00 57.16 53.59 1ff7 n GLU 82 Cb 0.64 -1.65 -0.17 0.00 1.43 0.00 0.00 31.44 31.69 1ff7 n GLU 82 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1ff7 s THR 83 N -3.06 0.35 -1.00 3.84 2.01 -0.10 -4.99 115.64 112.68 1ff7 s THR 83 Ca 0.38 -0.01 -0.22 0.00 0.31 0.00 0.00 61.69 62.15 1ff7 s THR 83 Cb 0.34 -0.61 0.06 0.00 0.01 0.00 0.00 72.50 72.31 1ff7 s THR 83 CO -0.00 0.14 1.39 -2.28 -0.69 0.00 0.00 174.62 173.18 1ff7 s HIS 84 N 1.97 2.64 -1.22 4.92 2.46 -1.26 0.37 115.29 125.17 1ff7 s HIS 84 Ca 0.04 -0.94 -0.15 0.00 0.47 0.00 0.00 55.06 54.47 1ff7 s HIS 84 Cb -0.13 -4.63 0.14 0.00 -0.13 0.00 0.00 32.58 27.83 1ff7 s HIS 84 CO -0.06 -1.86 1.51 0.15 -2.47 0.00 0.00 174.74 172.02 1ff7 s LYS 85 N 4.57 4.04 -0.45 2.88 -0.14 0.11 -4.77 119.74 125.98 1ff7 s LYS 85 Ca 0.44 -2.36 0.04 0.00 -1.36 0.00 0.00 55.97 52.73 1ff7 s LYS 85 Cb -0.01 -5.21 0.64 0.00 -1.68 0.00 0.00 37.83 31.57 1ff7 s LYS 85 CO -0.10 -1.92 1.88 -3.47 -0.76 0.00 0.00 175.35 170.98 1ff7 n ASP 86 N 6.55 3.92 -3.81 2.83 2.03 -1.25 -4.51 116.55 122.32 1ff7 n ASP 86 Ca 0.40 -3.64 -0.27 0.00 0.52 0.00 0.00 54.79 51.80 1ff7 n ASP 86 Cb 0.44 -0.83 -0.17 0.00 -0.72 0.00 0.00 41.12 39.85 1ff7 n ASP 86 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1ff7 s ASP 87 N -1.48 2.50 0.00 1.67 -1.08 -1.26 -5.03 116.67 111.99 1ff7 s ASP 87 Ca 0.56 -0.55 0.00 0.00 -0.52 0.00 0.00 52.55 52.04 1ff7 s ASP 87 Cb 0.47 -0.67 0.00 0.00 -1.46 0.00 0.00 42.92 41.26 1ff7 s ASP 87 CO 0.09 -0.23 0.00 0.61 0.52 0.00 0.00 175.17 176.16 1ff7 n GLY 88 N 5.01 0.20 1.80 2.66 0.00 -1.26 -5.09 105.19 108.51 1ff7 n GLY 88 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1ff7 n GLY 88 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ff7 n SER 89 N -0.53 0.02 0.00 1.61 7.64 -1.26 -5.33 113.62 115.77 1ff7 n SER 89 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ff7 n SER 89 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1ff7 n SER 89 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03