#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ba6 s ALA 2 N 0.00 -3.26 -0.40 2.24 0.00 -1.26 -5.10 121.76 113.97 1ba6 s ALA 2 Ca 0.00 1.09 0.02 0.00 0.00 0.00 0.00 51.96 53.07 1ba6 s ALA 2 Cb 0.00 -2.73 0.15 0.00 0.00 0.00 0.00 23.12 20.53 1ba6 s ALA 2 CO 0.00 -2.06 0.26 -2.00 0.00 0.00 0.00 175.76 171.96 1ba6 s GLU 3 N 2.65 0.91 0.01 0.00 -6.30 -1.26 -5.10 118.70 109.61 1ba6 s GLU 3 Ca 0.18 -1.78 -0.30 0.00 -2.50 0.00 0.00 54.97 50.57 1ba6 s GLU 3 Cb -0.05 -1.68 -0.07 0.00 0.00 0.00 0.00 34.13 32.33 1ba6 s GLU 3 CO -0.21 -1.24 1.70 -0.59 0.02 0.00 0.00 175.26 174.93 1ba6 s PHE 4 N 0.53 2.06 -0.43 5.30 -0.71 -1.26 -4.93 117.98 118.54 1ba6 s PHE 4 Ca 0.22 0.15 0.06 0.00 -1.04 0.00 0.00 56.93 56.31 1ba6 s PHE 4 Cb -0.16 -3.99 0.20 0.00 -1.21 0.00 0.00 43.02 37.86 1ba6 s PHE 4 CO -0.05 -4.12 0.51 -2.13 -1.34 0.00 0.00 175.22 168.09 1ba6 n ARG 5 N 6.53 0.44 -0.63 1.99 0.63 -1.26 -4.99 116.66 119.37 1ba6 n ARG 5 Ca 0.17 -2.84 -0.05 0.00 -0.92 0.00 0.00 57.85 54.20 1ba6 n ARG 5 Cb 0.42 -1.50 0.01 0.00 0.45 0.00 0.00 32.46 31.84 1ba6 n ARG 5 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 1ba6 n HIS 6 N 2.37 0.47 -4.36 -0.14 1.44 -1.26 -4.98 115.22 108.76 1ba6 n HIS 6 Ca 0.24 -1.30 0.00 0.00 -2.01 0.00 0.00 57.72 54.65 1ba6 n HIS 6 Cb 0.52 -0.65 0.00 0.00 0.12 0.00 0.00 29.99 29.98 1ba6 n HIS 6 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1ba6 n ASP 7 N 1.17 -4.39 -0.51 4.39 2.03 -1.26 -4.94 116.55 113.03 1ba6 n ASP 7 Ca 0.10 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.41 1ba6 n ASP 7 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1ba6 n ASP 7 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1ba6 n SER 8 N -3.13 -3.96 0.00 1.67 3.41 -0.29 -4.81 113.62 106.51 1ba6 n SER 8 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ba6 n SER 8 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1ba6 n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ba6 n GLY 9 N 0.00 0.92 2.46 5.00 0.00 -1.26 -1.85 105.19 110.45 1ba6 n GLY 9 Ca 0.00 0.39 -0.33 0.00 0.00 0.00 0.00 46.02 46.08 1ba6 n GLY 9 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1ba6 n TYR 10 N 0.00 3.10 -3.75 1.61 9.36 -1.26 -4.94 117.16 121.28 1ba6 n TYR 10 Ca 0.00 -2.68 -0.07 0.00 3.32 0.00 0.00 57.90 58.46 1ba6 n TYR 10 Cb 0.00 -0.94 -0.02 0.00 -0.63 0.00 0.00 39.34 37.75 1ba6 n TYR 10 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1ba6 s GLU 11 N -3.81 1.57 1.04 2.98 -6.30 -0.77 -5.16 118.70 108.26 1ba6 s GLU 11 Ca 0.56 -0.82 -0.13 0.00 -2.50 0.00 0.00 54.97 52.08 1ba6 s GLU 11 Cb 0.45 0.57 0.18 0.00 0.00 0.00 0.00 34.13 35.33 1ba6 s GLU 11 CO -0.14 -0.72 0.83 0.28 0.02 0.00 0.00 175.26 175.53 1ba6 n VAL 12 N -0.44 0.00 -1.38 3.70 0.31 -1.26 -3.86 118.33 115.40 1ba6 n VAL 12 Ca -0.07 -0.23 -0.27 0.00 -0.01 0.00 0.00 64.34 63.76 1ba6 n VAL 12 Cb 0.60 -0.88 0.12 0.00 -0.91 0.00 0.00 33.84 32.77 1ba6 n VAL 12 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1ba6 n HIS 13 N -4.44 2.88 -0.83 3.52 -0.00 -1.26 -1.14 115.22 113.96 1ba6 n HIS 13 Ca 0.06 -2.41 -0.11 0.00 0.46 0.00 0.00 57.72 55.72 1ba6 n HIS 13 Cb 0.54 -1.07 -0.01 0.00 -0.12 0.00 0.00 29.99 29.33 1ba6 n HIS 13 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 1ba6 n HIS 14 N -1.00 0.85 0.26 1.57 1.44 -1.26 -4.52 115.22 112.55 1ba6 n HIS 14 Ca 0.57 -1.58 0.14 0.00 -2.01 0.00 0.00 57.72 54.84 1ba6 n HIS 14 Cb 1.06 -0.91 0.73 0.00 0.12 0.00 0.00 29.99 30.99 1ba6 n HIS 14 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 1ba6 h GLN 15 N 1.62 0.00 0.00 -1.40 4.20 -1.92 -3.11 115.11 114.50 1ba6 h GLN 15 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1ba6 h GLN 15 Cb 0.98 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.76 1ba6 h GLN 15 CO 0.45 0.00 0.00 1.63 -0.67 0.00 0.00 178.83 180.24 1ba6 n LYS 16 N -2.57 0.00 -0.33 1.46 4.01 -1.26 -3.18 118.16 116.28 1ba6 n LYS 16 Ca -0.02 0.43 0.10 0.00 -0.51 0.00 0.00 58.31 58.31 1ba6 n LYS 16 Cb 0.23 -1.13 0.28 0.00 -0.51 0.00 0.00 35.03 33.90 1ba6 n LYS 16 CO 0.00 0.00 0.00 1.37 -1.11 0.00 0.00 177.40 177.66 1ba6 h LEU 17 N 0.00 0.69 0.81 -0.35 8.10 -1.95 -0.53 115.31 122.07 1ba6 h LEU 17 Ca 0.00 0.09 -0.04 0.00 0.11 0.00 0.00 57.88 58.05 1ba6 h LEU 17 Cb 0.00 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 40.20 1ba6 h LEU 17 CO 0.00 0.26 -0.45 -0.37 -4.11 0.00 0.00 178.44 173.77 1ba6 h VAL 18 N 0.72 0.00 -0.69 0.15 -1.51 -1.70 -3.06 116.25 110.16 1ba6 h VAL 18 Ca 0.53 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.99 1ba6 h VAL 18 Cb 0.79 0.00 -0.03 0.00 -2.13 0.00 0.00 31.29 29.92 1ba6 h VAL 18 CO -0.37 0.00 0.40 -0.26 -1.23 0.00 0.00 177.57 176.10 1ba6 h PHE 19 N -1.16 0.92 0.00 5.19 0.04 -1.47 -0.77 116.94 119.68 1ba6 h PHE 19 Ca -0.11 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.65 1ba6 h PHE 19 Cb 0.92 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.77 1ba6 h PHE 19 CO -0.05 0.63 0.63 0.74 -0.60 0.00 0.00 178.31 179.66 1ba6 h PHE 20 N 0.96 0.00 0.00 -0.55 -1.00 -0.99 0.40 116.94 115.76 1ba6 h PHE 20 Ca 0.25 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.03 1ba6 h PHE 20 Cb -0.01 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.55 1ba6 h PHE 20 CO 0.00 0.00 -0.99 0.00 -1.61 0.00 0.00 178.31 175.72 1ba6 n ALA 21 N -1.71 2.38 0.20 2.45 0.00 -0.98 -4.46 120.51 118.39 1ba6 n ALA 21 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 1ba6 n ALA 21 Cb 0.65 0.49 -0.06 0.00 0.00 0.00 0.00 19.45 20.53 1ba6 n ALA 21 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ba6 h GLU 22 N 0.00 -0.54 -0.59 0.00 5.08 -0.64 -2.57 114.58 115.32 1ba6 h GLU 22 Ca 0.00 0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1ba6 h GLU 22 Cb 0.99 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 1ba6 h GLU 22 CO 0.00 -0.24 0.27 -0.44 -1.00 0.00 0.00 179.01 177.60 1ba6 h ASP 23 N -1.02 0.75 -0.65 1.42 3.32 -0.42 0.78 116.42 120.62 1ba6 h ASP 23 Ca -0.06 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 1ba6 h ASP 23 Cb 0.54 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.87 1ba6 h ASP 23 CO 0.09 0.65 0.20 -0.37 -1.72 0.00 0.00 179.24 178.09 1ba6 h VAL 24 N 0.83 1.25 0.10 -1.35 -1.51 -1.58 -0.36 116.25 113.63 1ba6 h VAL 24 Ca 0.20 -0.86 -0.00 0.00 -1.23 0.00 0.00 66.70 64.81 1ba6 h VAL 24 Cb 0.10 0.52 0.00 0.00 -2.13 0.00 0.00 31.29 29.78 1ba6 h VAL 24 CO -0.03 0.33 -0.05 1.23 -1.23 0.00 0.00 177.57 177.83 1ba6 h GLY 25 N 1.07 -0.14 -3.84 5.19 0.00 -0.88 -2.47 103.07 102.00 1ba6 h GLY 25 Ca 0.22 0.05 -0.39 0.00 0.00 0.00 0.00 47.33 47.21 1ba6 h GLY 25 CO -0.01 -0.05 0.42 -1.26 0.00 0.00 0.00 176.54 175.64 1ba6 n SER 26 N -5.13 6.51 -4.58 0.19 2.88 0.18 -4.98 113.62 108.70 1ba6 n SER 26 Ca -0.08 -3.14 -0.33 0.00 -1.33 0.00 0.00 58.87 53.99 1ba6 n SER 26 Cb 0.10 -1.11 0.12 0.00 -0.75 0.00 0.00 64.21 62.57 1ba6 n SER 26 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1ba6 n ASN 27 N 0.49 -0.22 -1.56 -3.46 0.23 -0.21 -2.48 115.26 108.05 1ba6 n ASN 27 Ca 0.38 0.50 -0.17 0.00 -0.53 0.00 0.00 54.58 54.76 1ba6 n ASN 27 Cb 0.58 -1.38 -0.07 0.00 -2.08 0.00 0.00 39.78 36.83 1ba6 n ASN 27 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1ba6 n LYS 28 N -2.60 -1.41 -0.77 -3.83 5.02 -1.26 -4.79 118.16 108.52 1ba6 n LYS 28 Ca 0.11 1.00 0.01 0.00 -2.02 0.00 0.00 58.31 57.40 1ba6 n LYS 28 Cb 0.51 -5.34 0.28 0.00 -0.02 0.00 0.00 35.03 30.47 1ba6 n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ba6 n GLY 29 N -0.36 3.97 0.95 0.72 0.00 -1.03 -4.24 105.19 105.20 1ba6 n GLY 29 Ca -0.17 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1ba6 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ba6 n ALA 30 N -0.40 0.00 -0.11 4.61 0.00 -1.26 -4.93 120.51 118.41 1ba6 n ALA 30 Ca 0.32 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.98 1ba6 n ALA 30 Cb 1.14 0.00 0.66 0.00 0.00 0.00 0.00 19.45 21.25 1ba6 n ALA 30 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1ba6 h ILE 31 N 0.00 0.67 -0.33 0.00 5.03 -1.95 -1.39 117.51 119.54 1ba6 h ILE 31 Ca 0.00 -0.03 0.10 0.00 -0.12 0.00 0.00 64.86 64.80 1ba6 h ILE 31 Cb 0.00 0.57 -0.01 0.00 -3.03 0.00 0.00 36.82 34.34 1ba6 h ILE 31 CO 0.00 0.02 0.46 -0.29 -0.68 0.00 0.00 178.15 177.65 1ba6 h ILE 32 N 0.10 0.26 0.00 -0.67 2.10 -1.92 -3.19 117.51 114.19 1ba6 h ILE 32 Ca 0.35 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.29 1ba6 h ILE 32 Cb 1.26 0.62 0.00 0.00 -1.09 0.00 0.00 36.82 37.61 1ba6 h ILE 32 CO -0.04 0.00 -0.92 0.61 -1.08 0.00 0.00 178.15 176.72 1ba6 n GLY 33 N -1.43 0.00 1.35 8.18 0.00 -0.65 -5.12 105.19 107.52 1ba6 n GLY 33 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1ba6 n GLY 33 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ba6 n LEU 34 N -2.75 0.00 0.19 0.99 7.94 -0.62 -4.89 117.00 117.86 1ba6 n LEU 34 Ca 0.00 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 54.98 1ba6 n LEU 34 Cb 0.46 -0.10 0.60 0.00 0.53 0.00 0.00 43.42 44.90 1ba6 n LEU 34 CO 0.00 0.00 1.10 1.62 -1.11 0.00 0.00 177.39 179.00 1ba6 h VAL 36 N 0.00 1.00 0.00 1.96 3.04 -2.03 -3.50 116.25 116.72 1ba6 h VAL 36 Ca 0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1ba6 h VAL 36 Cb 0.00 0.87 0.00 0.00 -2.01 0.00 0.00 31.29 30.15 1ba6 h VAL 36 CO 0.00 0.02 0.00 0.61 -1.01 0.00 0.00 177.57 177.19 1ba6 n GLY 37 N -1.53 1.38 3.49 3.17 0.00 -1.26 -4.42 105.19 106.02 1ba6 n GLY 37 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1ba6 n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ba6 n GLY 38 N -1.59 -0.50 1.78 -0.02 0.00 -1.26 -4.84 105.19 98.75 1ba6 n GLY 38 Ca 0.00 0.15 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 1ba6 n GLY 38 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1ba6 n VAL 39 N -4.40 2.41 0.00 1.61 3.14 -1.26 -5.40 118.33 114.43 1ba6 n VAL 39 Ca -0.02 -1.24 0.00 0.00 -2.96 0.00 0.00 64.34 60.12 1ba6 n VAL 39 Cb 0.56 -0.63 0.00 0.00 -1.06 0.00 0.00 33.84 32.71 1ba6 n VAL 39 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89