#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aml s ALA 2 N 0.00 1.21 -0.35 2.24 0.00 -1.26 -5.03 121.76 118.57 1aml s ALA 2 Ca 0.00 -0.54 0.03 0.00 0.00 0.00 0.00 51.96 51.45 1aml s ALA 2 Cb 0.00 -3.04 0.10 0.00 0.00 0.00 0.00 23.12 20.18 1aml s ALA 2 CO 0.00 -2.75 0.09 -1.21 0.00 0.00 0.00 175.76 171.88 1aml s GLU 3 N -5.17 1.33 0.00 0.00 2.02 -1.26 -4.88 118.70 110.75 1aml s GLU 3 Ca 0.66 -1.76 0.00 0.00 0.02 0.00 0.00 54.97 53.89 1aml s GLU 3 Cb -0.16 -2.89 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1aml s GLU 3 CO 0.56 -0.98 0.00 1.97 0.02 0.00 0.00 175.26 176.83 1aml n PHE 4 N 4.26 0.00 -1.49 1.61 -1.74 -1.26 -4.96 117.46 113.89 1aml n PHE 4 Ca 0.03 0.00 -0.16 0.00 -0.56 0.00 0.00 57.45 56.76 1aml n PHE 4 Cb 0.41 0.00 -0.13 0.00 1.52 0.00 0.00 39.48 41.28 1aml n PHE 4 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 1aml n ARG 5 N -2.06 0.24 -0.42 3.97 3.00 -1.26 -4.55 116.66 115.59 1aml n ARG 5 Ca 0.00 -0.52 0.07 0.00 -0.01 0.00 0.00 57.85 57.39 1aml n ARG 5 Cb 0.29 -2.40 0.12 0.00 0.00 0.00 0.00 32.46 30.47 1aml n ARG 5 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 1aml n HIS 6 N 12.32 0.00 -1.43 -1.55 -0.00 -1.26 -5.05 115.22 118.26 1aml n HIS 6 Ca 0.51 -0.92 0.00 0.00 0.46 0.00 0.00 57.72 57.76 1aml n HIS 6 Cb 0.32 -0.16 0.00 0.00 -0.12 0.00 0.00 29.99 30.03 1aml n HIS 6 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 1aml n ASP 7 N -0.93 0.00 -3.23 0.26 8.00 -1.26 -5.11 116.55 114.28 1aml n ASP 7 Ca 0.13 -0.34 -0.03 0.00 0.71 0.00 0.00 54.79 55.27 1aml n ASP 7 Cb 0.71 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.78 1aml n ASP 7 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1aml s SER 8 N -1.00 -0.61 -0.40 -2.24 1.04 -1.26 -5.04 113.70 104.20 1aml s SER 8 Ca 0.00 -0.08 0.05 0.00 0.48 0.00 0.00 55.95 56.41 1aml s SER 8 Cb 0.00 1.57 0.32 0.00 0.10 0.00 0.00 66.02 68.01 1aml s SER 8 CO 0.00 -0.33 1.25 0.61 0.98 0.00 0.00 173.24 175.76 1aml n GLY 9 N 5.39 -0.38 0.00 7.32 0.00 -1.26 -5.13 105.19 111.13 1aml n GLY 9 Ca 0.03 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1aml n GLY 9 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1aml n TYR 10 N 0.44 0.00 -0.99 1.61 4.19 -1.26 -5.00 117.16 116.14 1aml n TYR 10 Ca 0.01 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.22 1aml n TYR 10 Cb 0.73 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.56 1aml n TYR 10 CO 0.00 0.00 0.00 0.39 0.91 0.00 0.00 176.86 178.16 1aml n GLU 11 N 0.00 -0.05 -0.00 2.98 1.02 -1.26 -4.85 120.64 118.48 1aml n GLU 11 Ca 0.00 0.01 0.10 0.00 -0.02 0.00 0.00 57.16 57.25 1aml n GLU 11 Cb 0.00 -2.92 -0.12 0.00 -0.02 0.00 0.00 31.44 28.38 1aml n GLU 11 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1aml n VAL 12 N -2.66 0.00 0.00 2.62 0.31 -1.26 -4.57 118.33 112.77 1aml n VAL 12 Ca 0.00 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1aml n VAL 12 Cb 0.01 0.81 0.00 0.00 -0.91 0.00 0.00 33.84 33.75 1aml n VAL 12 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1aml n HIS 13 N -1.62 -0.45 0.28 3.52 -0.00 -1.26 -4.85 115.22 110.83 1aml n HIS 13 Ca 0.02 0.00 0.18 0.00 0.46 0.00 0.00 57.72 58.38 1aml n HIS 13 Cb 0.36 0.29 0.95 0.00 -0.12 0.00 0.00 29.99 31.47 1aml n HIS 13 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 1aml h HIS 14 N 0.00 0.00 -0.37 1.57 6.17 -1.96 -1.38 115.15 119.18 1aml h HIS 14 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 60.37 61.08 1aml h HIS 14 Cb 0.00 0.00 -0.02 0.00 2.52 0.00 0.00 27.41 29.91 1aml h HIS 14 CO 0.00 0.00 0.22 1.96 0.71 0.00 0.00 177.93 180.82 1aml h GLN 15 N 0.00 0.49 -0.22 5.26 1.08 -1.89 -1.80 115.11 118.04 1aml h GLN 15 Ca 0.04 -0.04 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 1aml h GLN 15 Cb 0.29 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 1aml h GLN 15 CO -0.00 0.34 -0.65 0.87 -0.95 0.00 0.00 178.83 178.45 1aml h LYS 16 N 0.50 0.80 0.48 1.46 1.79 -1.61 -2.13 116.57 117.86 1aml h LYS 16 Ca 0.13 -0.57 -0.02 0.00 -2.18 0.00 0.00 60.65 58.01 1aml h LYS 16 Cb -0.02 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1aml h LYS 16 CO -0.03 1.19 -0.23 -0.07 -1.08 0.00 0.00 179.45 179.23 1aml h LEU 17 N 0.59 -0.55 0.00 2.94 3.38 -1.50 -2.25 115.31 117.92 1aml h LEU 17 Ca -0.01 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1aml h LEU 17 Cb 1.26 0.14 0.00 0.00 0.09 0.00 0.00 40.66 42.15 1aml h LEU 17 CO 0.14 -0.28 0.00 0.52 0.09 0.00 0.00 178.44 178.90 1aml n VAL 18 N -5.31 0.00 -0.12 1.22 0.31 -0.73 -1.18 118.33 112.52 1aml n VAL 18 Ca -0.11 1.16 0.10 0.00 -0.01 0.00 0.00 64.34 65.47 1aml n VAL 18 Cb 0.30 -1.90 0.18 0.00 -0.91 0.00 0.00 33.84 31.51 1aml n VAL 18 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1aml n PHE 19 N -1.31 0.36 0.38 3.52 7.35 -0.80 0.28 117.46 127.24 1aml n PHE 19 Ca 0.00 0.43 -0.15 0.00 -0.76 0.00 0.00 57.45 56.96 1aml n PHE 19 Cb 0.00 -0.85 -0.07 0.00 0.35 0.00 0.00 39.48 38.90 1aml n PHE 19 CO 0.00 0.00 0.00 0.35 -0.76 0.00 0.00 176.76 176.35 1aml h PHE 20 N 0.00 -0.91 -0.89 -5.13 3.04 -0.55 -1.98 116.94 110.52 1aml h PHE 20 Ca 0.28 -0.02 0.24 0.00 3.98 0.00 0.00 57.97 62.45 1aml h PHE 20 Cb 0.70 0.30 -0.15 0.00 2.56 0.00 0.00 35.95 39.37 1aml h PHE 20 CO -0.05 -0.56 0.20 0.00 -2.02 0.00 0.00 178.31 175.87 1aml h ALA 21 N -1.23 1.26 -0.70 2.41 0.00 0.56 0.47 119.26 122.03 1aml h ALA 21 Ca -0.10 0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1aml h ALA 21 Cb 0.76 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 1aml h ALA 21 CO 0.17 -0.50 0.44 0.93 0.00 0.00 0.00 179.25 180.29 1aml h GLU 22 N 0.16 0.84 -0.64 0.00 5.08 -0.86 -1.10 114.58 118.07 1aml h GLU 22 Ca 0.56 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.87 1aml h GLU 22 Cb 1.15 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1aml h GLU 22 CO -0.70 0.56 0.00 -0.25 -1.00 0.00 0.00 179.01 177.62 1aml n ASP 23 N -4.66 3.54 -4.96 1.42 9.92 0.14 -4.89 116.55 117.06 1aml n ASP 23 Ca 0.07 -2.38 -0.22 0.00 -0.53 0.00 0.00 54.79 51.73 1aml n ASP 23 Cb 0.08 -0.51 -0.01 0.00 -0.64 0.00 0.00 41.12 40.03 1aml n ASP 23 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1aml s VAL 24 N -1.85 5.05 -0.12 2.53 1.01 0.40 -5.03 120.40 122.39 1aml s VAL 24 Ca 0.34 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.53 1aml s VAL 24 Cb 0.23 -3.82 -0.26 0.00 0.00 0.00 0.00 36.38 32.54 1aml s VAL 24 CO 0.15 -0.44 0.39 1.23 0.00 0.00 0.00 175.10 176.43 1aml h GLY 25 N 0.90 0.28 0.00 4.51 0.00 -1.90 -3.47 103.07 103.39 1aml h GLY 25 Ca -0.50 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.11 1aml h GLY 25 CO 0.60 0.63 0.00 1.44 0.00 0.00 0.00 176.54 179.22 1aml n SER 26 N -3.63 0.00 -0.70 0.19 7.64 -1.26 -5.01 113.62 110.84 1aml n SER 26 Ca -0.31 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.64 1aml n SER 26 Cb 1.00 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 64.34 1aml n SER 26 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1aml n ASN 27 N 0.00 2.76 -0.71 6.43 4.13 -1.26 -5.09 115.26 121.51 1aml n ASN 27 Ca 0.00 -1.83 0.04 0.00 1.68 0.00 0.00 54.58 54.47 1aml n ASN 27 Cb 0.00 -0.17 -0.01 0.00 -1.54 0.00 0.00 39.78 38.05 1aml n ASN 27 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1aml n LYS 28 N 0.76 -0.66 -2.60 3.52 5.02 -1.26 -4.48 118.16 118.46 1aml n LYS 28 Ca 0.12 0.44 -0.19 0.00 -2.02 0.00 0.00 58.31 56.65 1aml n LYS 28 Cb 0.42 -0.81 0.01 0.00 -0.02 0.00 0.00 35.03 34.63 1aml n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aml n GLY 29 N -1.03 4.02 0.61 0.72 0.00 -1.26 -4.83 105.19 103.42 1aml n GLY 29 Ca 0.00 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.78 1aml n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aml n ALA 30 N -0.27 2.17 -0.34 4.61 0.00 -1.26 -3.82 120.51 121.60 1aml n ALA 30 Ca 0.26 -0.50 0.14 0.00 0.00 0.00 0.00 53.44 53.34 1aml n ALA 30 Cb 0.72 0.33 0.35 0.00 0.00 0.00 0.00 19.45 20.84 1aml n ALA 30 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1aml h ILE 31 N -0.46 0.69 0.23 0.00 5.03 -1.88 0.18 117.51 121.31 1aml h ILE 31 Ca -0.31 -0.24 -0.32 0.00 -0.12 0.00 0.00 64.86 63.87 1aml h ILE 31 Cb 1.24 -0.08 0.04 0.00 -3.03 0.00 0.00 36.82 34.98 1aml h ILE 31 CO -0.19 0.13 -1.39 0.16 -0.68 0.00 0.00 178.15 176.18 1aml h ILE 32 N 0.71 1.30 0.00 -0.67 -2.65 -1.91 -3.15 117.51 111.14 1aml h ILE 32 Ca 0.57 -2.65 0.00 0.00 1.03 0.00 0.00 64.86 63.81 1aml h ILE 32 Cb 0.96 3.01 0.00 0.00 -2.05 0.00 0.00 36.82 38.74 1aml h ILE 32 CO -0.36 0.79 0.00 0.61 0.03 0.00 0.00 178.15 179.22 1aml n GLY 33 N 1.67 -0.68 0.11 0.16 0.00 -0.28 -2.80 105.19 103.35 1aml n GLY 33 Ca -0.16 -0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 1aml n GLY 33 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1aml h LEU 34 N 0.00 0.05 -0.32 0.99 5.85 -0.67 -3.34 115.31 117.88 1aml h LEU 34 Ca 0.00 -0.59 0.00 0.00 0.84 0.00 0.00 57.88 58.13 1aml h LEU 34 Cb 0.11 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1aml h LEU 34 CO 0.00 1.50 0.00 1.15 -0.34 0.00 0.00 178.44 180.75 1aml n MET 35 N -4.34 0.06 -0.23 1.25 0.00 -1.12 -1.39 117.12 111.35 1aml n MET 35 Ca -0.30 0.38 -0.03 0.00 0.00 0.00 0.00 57.70 57.75 1aml n MET 35 Cb 0.71 -1.64 0.05 0.00 0.00 0.00 0.00 33.22 32.34 1aml n MET 35 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 1aml n VAL 36 N -1.77 1.16 0.00 3.17 0.31 -1.15 -4.68 118.33 115.37 1aml n VAL 36 Ca 0.02 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1aml n VAL 36 Cb 0.14 -0.74 0.00 0.00 -0.91 0.00 0.00 33.84 32.33 1aml n VAL 36 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1aml n GLY 37 N 0.15 0.67 2.56 2.92 0.00 -1.07 -5.08 105.19 105.35 1aml n GLY 37 Ca 0.10 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 1aml n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aml n GLY 38 N 0.00 0.94 0.72 -0.02 0.00 -0.49 -4.96 105.19 101.39 1aml n GLY 38 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1aml n GLY 38 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1aml n VAL 39 N 1.82 0.00 0.26 1.61 0.24 -1.26 -4.84 118.33 116.15 1aml n VAL 39 Ca 0.15 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.48 1aml n VAL 39 Cb 0.58 -0.27 0.03 0.00 -1.47 0.00 0.00 33.84 32.70 1aml n VAL 39 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02