#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 -0.87 -0.00 2.12 0.00 -1.26 -4.98 121.76 116.76 1aml s ALA 2 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.10 1aml s ALA 2 Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.20 1aml s ALA 2 CO 0.00 -4.77 0.09 -1.91 0.00 0.00 0.00 175.76 169.17 1aml n GLU 3 N -5.80 0.00 -0.10 0.00 4.07 -1.26 -5.01 120.64 112.55 1aml n GLU 3 Ca 0.14 -0.06 -0.22 0.00 -0.06 0.00 0.00 57.16 56.96 1aml n GLU 3 Cb 0.61 0.48 -0.12 0.00 -0.06 0.00 0.00 31.44 32.34 1aml n GLU 3 CO 0.00 0.00 0.00 1.97 -0.06 0.00 0.00 177.13 179.04 1aml n PHE 4 N -0.00 0.39 -1.62 4.31 -1.74 -1.26 -5.02 117.46 112.51 1aml n PHE 4 Ca -0.02 0.10 0.00 0.00 -0.56 0.00 0.00 57.45 56.98 1aml n PHE 4 Cb 0.29 -1.05 0.00 0.00 1.52 0.00 0.00 39.48 40.24 1aml n PHE 4 CO 0.00 0.00 0.00 -2.13 -0.56 0.00 0.00 176.76 174.07 1aml n ARG 5 N -3.64 3.90 -1.34 3.97 3.00 -1.26 -5.08 116.66 116.21 1aml n ARG 5 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.42 1aml n ARG 5 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.41 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 0.00 -3.53 0.00 -0.14 -0.00 -1.26 -5.06 115.22 105.23 1aml n HIS 6 Ca 0.00 1.85 0.00 0.00 0.46 0.00 0.00 57.72 60.03 1aml n HIS 6 Cb 0.00 -3.08 0.00 0.00 -0.12 0.00 0.00 29.99 26.79 1aml n HIS 6 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 1aml n ASP 7 N -0.05 0.00 -3.15 0.26 2.03 -1.26 -5.11 116.55 109.27 1aml n ASP 7 Ca 0.00 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.37 1aml n ASP 7 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1aml n ASP 7 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1aml s SER 8 N 1.00 -0.14 0.00 1.67 0.15 -1.26 -5.13 113.70 109.99 1aml s SER 8 Ca 0.00 0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.73 1aml s SER 8 Cb 0.00 1.12 0.00 0.00 -1.71 0.00 0.00 66.02 65.43 1aml s SER 8 CO 0.00 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.02 1aml n GLY 9 N 5.46 0.52 0.00 9.45 0.00 -1.26 -5.15 105.19 114.20 1aml n GLY 9 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.09 0.00 0.00 1.61 9.36 -1.26 -5.01 117.16 121.76 1aml n TYR 10 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1aml n TYR 10 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 1aml n TYR 10 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1aml n GLU 11 N 0.00 0.00 0.03 2.98 1.02 -1.26 -4.82 120.64 118.59 1aml n GLU 11 Ca 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.25 1aml n GLU 11 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.48 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 -1.15 0.17 0.08 2.62 0.31 -1.26 -4.35 118.33 114.74 1aml n VAL 12 Ca 0.00 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 1aml n VAL 12 Cb 0.00 0.20 0.00 0.00 -0.91 0.00 0.00 33.84 33.13 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 -1.92 -0.97 -0.55 3.52 -0.00 -1.26 -4.64 115.22 109.39 1aml n HIS 13 Ca 0.02 0.17 0.46 0.00 0.46 0.00 0.00 57.72 58.84 1aml n HIS 13 Cb 0.42 0.27 0.78 0.00 -0.12 0.00 0.00 29.99 31.35 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 0.03 1.57 6.17 -1.87 0.35 115.15 121.39 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 0.12 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.05 1aml h HIS 14 CO 0.00 0.00 -0.01 1.96 0.71 0.00 0.00 177.93 180.59 1aml h GLN 15 N 0.00 -0.04 -0.15 5.26 1.08 -1.86 -2.76 115.11 116.64 1aml h GLN 15 Ca 0.79 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 58.04 1aml h GLN 15 Cb 3.22 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 30.65 1aml h GLN 15 CO -0.01 0.59 0.24 0.87 -0.95 0.00 0.00 178.83 179.57 1aml h LYS 16 N -0.71 0.00 0.24 1.46 1.79 -0.59 -1.56 116.57 117.20 1aml h LYS 16 Ca -0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 1aml h LYS 16 Cb 0.64 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1aml h LYS 16 CO 0.01 0.00 -0.11 -0.07 -1.08 0.00 0.00 179.45 178.19 1aml h LEU 17 N 0.00 -0.27 0.00 2.94 3.38 -1.29 -2.99 115.31 117.07 1aml h LEU 17 Ca 0.07 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1aml h LEU 17 Cb 0.55 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1aml h LEU 17 CO -0.00 0.22 0.00 0.52 0.09 0.00 0.00 178.44 179.27 1aml n VAL 18 N -4.99 0.00 -0.10 1.22 0.31 -0.83 -1.00 118.33 112.94 1aml n VAL 18 Ca -0.05 1.18 0.07 0.00 -0.01 0.00 0.00 64.34 65.53 1aml n VAL 18 Cb 0.17 -1.90 0.14 0.00 -0.91 0.00 0.00 33.84 31.34 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 -1.42 0.28 0.33 3.52 7.35 -0.65 0.29 117.46 127.17 1aml n PHE 19 Ca 0.00 0.35 -0.13 0.00 -0.76 0.00 0.00 57.45 56.91 1aml n PHE 19 Cb 0.00 -0.78 -0.06 0.00 0.35 0.00 0.00 39.48 38.99 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 -0.80 -0.85 -5.13 3.57 -0.91 -1.48 116.94 111.33 1aml h PHE 20 Ca 0.22 -0.02 0.21 0.00 3.53 0.00 0.00 57.97 61.91 1aml h PHE 20 Cb 0.55 0.27 -0.15 0.00 2.79 0.00 0.00 35.95 39.40 1aml h PHE 20 CO -0.06 -0.50 -0.01 0.00 -2.23 0.00 0.00 178.31 175.51 1aml h ALA 21 N -1.41 0.90 -0.70 2.41 0.00 0.58 0.46 119.26 121.49 1aml h ALA 21 Ca -0.09 0.29 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1aml h ALA 21 Cb 0.66 0.51 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 1aml h ALA 21 CO 0.15 -0.46 0.43 0.93 0.00 0.00 0.00 179.25 180.29 1aml h GLU 22 N 0.07 0.80 -0.64 0.00 5.08 -0.91 -0.80 114.58 118.17 1aml h GLU 22 Ca 0.48 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1aml h GLU 22 Cb 0.88 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1aml h GLU 22 CO -0.78 0.53 0.00 -0.25 -1.00 0.00 0.00 179.01 177.51 1aml n ASP 23 N -4.69 3.22 0.00 1.42 8.00 0.13 -4.47 116.55 120.17 1aml n ASP 23 Ca 0.08 -2.35 0.00 0.00 0.71 0.00 0.00 54.79 53.23 1aml n ASP 23 Cb 0.10 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 1aml n ASP 23 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1aml n VAL 24 N 0.50 0.00 0.00 2.53 0.31 0.45 -5.03 118.33 117.09 1aml n VAL 24 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.48 1aml n VAL 24 Cb 0.64 -0.71 0.00 0.00 -0.91 0.00 0.00 33.84 32.86 1aml n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1aml n GLY 25 N 3.15 3.34 0.00 2.92 0.00 -1.03 -4.81 105.19 108.77 1aml n GLY 25 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1aml n GLY 25 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1aml n SER 26 N 0.01 0.00 0.03 1.61 7.64 -1.26 -5.08 113.62 116.57 1aml n SER 26 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1aml n SER 26 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1aml n SER 26 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1aml h ASN 27 N 0.00 -0.11 0.00 6.43 -1.24 -1.97 -3.50 115.58 115.19 1aml h ASN 27 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1aml h ASN 27 Cb 0.00 0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.08 1aml h ASN 27 CO 0.00 0.10 0.00 0.29 -1.29 0.00 0.00 177.43 176.53 1aml n LYS 28 N -3.38 0.00 -3.99 6.67 5.02 -1.26 -5.00 118.16 116.21 1aml n LYS 28 Ca -0.02 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.00 1aml n LYS 28 Cb 0.05 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.04 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 -0.31 -0.27 0.18 0.72 0.00 -1.26 -4.78 105.19 99.47 1aml n GLY 29 Ca 0.00 0.15 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 1aml n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aml h ALA 30 N 0.86 -0.40 0.00 4.61 0.00 -1.94 0.54 119.26 122.93 1aml h ALA 30 Ca -0.62 -0.08 -0.23 0.00 0.00 0.00 0.00 54.91 53.98 1aml h ALA 30 Cb 1.38 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.27 1aml h ALA 30 CO 0.65 -0.37 -1.31 0.82 0.00 0.00 0.00 179.25 179.04 1aml h ILE 31 N -1.00 1.06 0.03 0.00 5.03 -1.99 -3.11 117.51 117.54 1aml h ILE 31 Ca -0.04 -2.76 -0.11 0.00 -0.12 0.00 0.00 64.86 61.83 1aml h ILE 31 Cb 0.28 2.49 -0.01 0.00 -3.03 0.00 0.00 36.82 36.56 1aml h ILE 31 CO 0.06 0.60 -0.58 0.40 -0.68 0.00 0.00 178.15 177.96 1aml h ILE 32 N 0.00 1.46 0.00 -0.67 5.03 -1.95 -2.93 117.51 118.45 1aml h ILE 32 Ca -0.15 -2.34 0.00 0.00 -0.12 0.00 0.00 64.86 62.25 1aml h ILE 32 Cb 1.80 3.01 0.00 0.00 -3.03 0.00 0.00 36.82 38.60 1aml h ILE 32 CO 0.09 0.56 0.00 0.61 -0.68 0.00 0.00 178.15 178.73 1aml n GLY 33 N 1.59 -0.79 0.10 5.37 0.00 0.18 -1.83 105.19 109.82 1aml n GLY 33 Ca -0.18 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 1aml n GLY 33 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1aml n LEU 34 N -1.42 1.86 -0.20 0.99 7.94 -1.17 -3.27 117.00 121.72 1aml n LEU 34 Ca 0.04 0.43 -0.06 0.00 -1.11 0.00 0.00 56.01 55.30 1aml n LEU 34 Cb 0.11 -0.96 0.10 0.00 0.53 0.00 0.00 43.42 43.21 1aml n LEU 34 CO 0.09 0.26 0.94 0.00 -1.11 0.00 0.00 177.39 177.57 1aml h MET 35 N -1.00 1.01 -0.73 1.96 -0.00 -1.32 -1.59 114.93 113.26 1aml h MET 35 Ca -0.35 -0.24 0.00 0.00 -0.00 0.00 0.00 59.70 59.10 1aml h MET 35 Cb 1.29 -0.13 0.00 0.00 -0.00 0.00 0.00 31.60 32.75 1aml h MET 35 CO -0.21 0.92 0.00 0.28 -0.00 0.00 0.00 176.91 177.89 1aml n VAL 36 N -4.23 0.90 -1.86 -0.10 0.31 -0.76 -3.67 118.33 108.92 1aml n VAL 36 Ca 0.04 -0.49 0.03 0.00 -0.01 0.00 0.00 64.34 63.91 1aml n VAL 36 Cb 0.27 -0.29 0.15 0.00 -0.91 0.00 0.00 33.84 33.05 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 0.38 4.31 2.77 2.92 0.00 -0.60 -4.94 105.19 110.03 1aml n GLY 37 Ca 0.10 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.49 1aml n GLY 37 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1aml s GLY 38 N -3.03 1.35 -0.17 -0.02 0.00 -1.24 -4.95 107.32 99.26 1aml s GLY 38 Ca 0.38 -2.04 0.01 0.00 0.00 0.00 0.00 44.72 43.08 1aml s GLY 38 CO -0.08 1.50 0.16 3.33 0.00 0.00 0.00 173.10 178.01 1aml n VAL 39 N 4.42 1.62 1.26 1.40 0.24 -1.26 -5.11 118.33 120.90 1aml n VAL 39 Ca 0.02 -0.66 0.13 0.00 -2.04 0.00 0.00 64.34 61.78 1aml n VAL 39 Cb 0.40 -1.40 0.32 0.00 -1.47 0.00 0.00 33.84 31.69 1aml n VAL 39 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24