#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 2.81 -0.36 -1.67 0.00 -1.26 -4.89 121.76 116.39 1aml s ALA 2 Ca 0.00 1.34 0.08 0.00 0.00 0.00 0.00 51.96 53.38 1aml s ALA 2 Cb 0.00 -3.57 0.71 0.00 0.00 0.00 0.00 23.12 20.26 1aml s ALA 2 CO 0.00 -1.38 1.83 -1.91 0.00 0.00 0.00 175.76 174.29 1aml n GLU 3 N -1.04 3.12 0.00 0.00 2.13 -1.26 -4.50 120.64 119.09 1aml n GLU 3 Ca 0.10 -3.07 0.00 0.00 0.66 0.00 0.00 57.16 54.85 1aml n GLU 3 Cb 0.45 -2.18 0.00 0.00 0.27 0.00 0.00 31.44 29.98 1aml n GLU 3 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1aml n PHE 4 N -0.55 -0.61 -2.59 4.31 -1.74 -1.26 -5.00 117.46 110.01 1aml n PHE 4 Ca 0.47 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.93 1aml n PHE 4 Cb 1.46 0.14 -0.00 0.00 1.52 0.00 0.00 39.48 42.61 1aml n PHE 4 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 1aml s ARG 5 N -1.29 3.97 0.00 3.97 0.52 -1.26 -4.91 118.95 119.95 1aml s ARG 5 Ca 0.00 -1.97 0.00 0.00 -0.52 0.00 0.00 55.73 53.24 1aml s ARG 5 Cb 0.00 -5.51 0.00 0.00 0.52 0.00 0.00 34.95 29.96 1aml s ARG 5 CO 0.00 -2.24 0.00 1.58 0.02 0.00 0.00 175.30 174.66 1aml n HIS 6 N 8.34 -0.10 -1.05 -0.53 -0.00 -1.26 -4.76 115.22 115.86 1aml n HIS 6 Ca 0.48 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.77 1aml n HIS 6 Cb 0.46 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.29 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 -0.13 -5.30 -4.28 0.26 -0.08 -1.26 -4.43 116.55 101.33 1aml n ASP 7 Ca 0.00 0.59 -0.45 0.00 -1.51 0.00 0.00 54.79 53.42 1aml n ASP 7 Cb 0.00 -3.37 -0.04 0.00 2.34 0.00 0.00 41.12 40.05 1aml n ASP 7 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1aml s SER 8 N -5.44 6.43 -0.33 1.67 0.01 -1.26 -4.82 113.70 109.97 1aml s SER 8 Ca 0.00 -2.74 0.17 0.00 1.31 0.00 0.00 55.95 54.68 1aml s SER 8 Cb 0.00 -2.13 0.45 0.00 0.21 0.00 0.00 66.02 64.55 1aml s SER 8 CO 0.00 -0.52 1.08 0.61 0.41 0.00 0.00 173.24 174.82 1aml n GLY 9 N 3.84 1.53 0.00 3.44 0.00 -1.26 -5.09 105.19 107.65 1aml n GLY 9 Ca 0.13 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.30 0.00 -0.96 1.61 9.36 -1.26 -4.93 117.16 120.68 1aml n TYR 10 Ca 0.05 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.27 1aml n TYR 10 Cb 0.83 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.54 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 -0.47 -0.08 2.98 1.02 -1.26 -4.81 120.64 118.01 1aml n GLU 11 Ca 0.00 0.12 -0.09 0.00 -0.02 0.00 0.00 57.16 57.17 1aml n GLU 11 Cb 0.00 -3.49 -0.13 0.00 -0.02 0.00 0.00 31.44 27.79 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 -2.53 1.16 -0.04 2.62 0.31 -1.26 -4.42 118.33 114.18 1aml n VAL 12 Ca 0.00 -0.71 -0.05 0.00 -0.01 0.00 0.00 64.34 63.57 1aml n VAL 12 Cb 0.12 -0.58 -0.03 0.00 -0.91 0.00 0.00 33.84 32.44 1aml n VAL 12 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1aml n HIS 13 N -2.64 0.00 -0.17 3.52 8.25 -1.26 -4.65 115.22 118.27 1aml n HIS 13 Ca -0.28 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.11 1aml n HIS 13 Cb 1.04 -0.28 0.02 0.00 1.12 0.00 0.00 29.99 31.89 1aml n HIS 13 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1aml h HIS 14 N 0.00 0.69 0.00 4.41 6.17 -1.95 -1.15 115.15 123.32 1aml h HIS 14 Ca -0.16 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 60.90 1aml h HIS 14 Cb 1.25 -0.22 0.00 0.00 2.52 0.00 0.00 27.41 30.96 1aml h HIS 14 CO 0.01 0.51 0.17 1.96 0.71 0.00 0.00 177.93 181.29 1aml h GLN 15 N 0.67 0.00 0.06 5.26 1.08 -1.84 -0.54 115.11 119.80 1aml h GLN 15 Ca 0.18 0.00 -0.38 0.00 -1.45 0.00 0.00 58.65 57.00 1aml h GLN 15 Cb 0.05 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.43 1aml h GLN 15 CO -0.03 0.00 -2.20 1.63 -0.95 0.00 0.00 178.83 177.28 1aml n LYS 16 N -2.41 0.69 0.34 1.46 4.76 -0.49 -3.36 118.16 119.16 1aml n LYS 16 Ca -0.02 0.23 -0.15 0.00 -2.87 0.00 0.00 58.31 55.51 1aml n LYS 16 Cb 0.20 -1.62 -0.07 0.00 -1.84 0.00 0.00 35.03 31.71 1aml n LYS 16 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1aml h LEU 17 N -0.09 -0.77 0.00 -0.35 3.38 -0.68 -2.17 115.31 114.64 1aml h LEU 17 Ca -0.51 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1aml h LEU 17 Cb 1.91 0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.86 1aml h LEU 17 CO -0.04 -0.39 0.00 0.52 0.09 0.00 0.00 178.44 178.62 1aml n VAL 18 N -5.38 0.00 -0.11 1.22 0.31 -0.32 -0.94 118.33 113.11 1aml n VAL 18 Ca -0.12 1.16 0.07 0.00 -0.01 0.00 0.00 64.34 65.45 1aml n VAL 18 Cb 0.37 -1.87 0.13 0.00 -0.91 0.00 0.00 33.84 31.57 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 -1.39 0.28 0.44 3.52 7.35 -1.21 0.30 117.46 126.74 1aml n PHE 19 Ca 0.00 0.39 -0.17 0.00 -0.76 0.00 0.00 57.45 56.90 1aml n PHE 19 Cb 0.00 -0.79 -0.08 0.00 0.35 0.00 0.00 39.48 38.96 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 -1.04 -0.73 -5.13 3.04 -0.35 -0.66 116.94 112.07 1aml h PHE 20 Ca 0.23 -0.02 0.16 0.00 3.98 0.00 0.00 57.97 62.31 1aml h PHE 20 Cb 0.54 0.35 -0.13 0.00 2.56 0.00 0.00 35.95 39.26 1aml h PHE 20 CO -0.10 -0.65 -0.07 0.00 -2.02 0.00 0.00 178.31 175.47 1aml h ALA 21 N -1.38 0.64 -0.71 2.41 0.00 0.59 0.56 119.26 121.38 1aml h ALA 21 Ca -0.12 0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1aml h ALA 21 Cb 0.86 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 1aml h ALA 21 CO 0.19 -0.42 0.47 0.93 0.00 0.00 0.00 179.25 180.42 1aml h GLU 22 N 0.06 0.87 -0.63 0.00 5.08 -0.83 -1.14 114.58 117.98 1aml h GLU 22 Ca 0.38 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1aml h GLU 22 Cb 0.63 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1aml h GLU 22 CO -0.69 0.58 0.00 -0.25 -1.00 0.00 0.00 179.01 177.65 1aml n ASP 23 N -4.44 5.12 -0.04 1.42 8.00 0.10 -4.45 116.55 122.25 1aml n ASP 23 Ca 0.08 -2.61 -0.03 0.00 0.71 0.00 0.00 54.79 52.94 1aml n ASP 23 Cb 0.08 -0.62 -0.01 0.00 -0.02 0.00 0.00 41.12 40.56 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 0.98 0.85 -0.77 2.53 0.31 0.16 -5.01 118.33 117.38 1aml n VAL 24 Ca 0.27 0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.92 1aml n VAL 24 Cb 1.00 -2.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 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 1.65 1.14 1.81 2.92 0.00 -1.21 -4.64 105.19 106.85 1aml n GLY 25 Ca -0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 46.02 45.73 1aml n GLY 25 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aml n SER 26 N 0.54 -3.17 0.16 1.61 2.88 -1.26 -4.92 113.62 109.45 1aml n SER 26 Ca 0.00 0.01 0.13 0.00 -1.33 0.00 0.00 58.87 57.68 1aml n SER 26 Cb 0.16 -1.87 0.47 0.00 -0.75 0.00 0.00 64.21 62.22 1aml n SER 26 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 1aml h ASN 27 N 0.14 0.00 -3.89 -3.46 -0.73 -1.94 -3.49 115.58 102.21 1aml h ASN 27 Ca 0.00 0.00 0.10 0.00 1.87 0.00 0.00 56.30 58.27 1aml h ASN 27 Cb 0.87 0.00 -0.06 0.00 0.27 0.00 0.00 38.32 39.40 1aml h ASN 27 CO 0.06 0.00 -0.39 1.17 -0.37 0.00 0.00 177.43 177.89 1aml n LYS 28 N -2.47 -1.04 0.00 6.67 4.81 -1.26 -4.99 118.16 119.87 1aml n LYS 28 Ca 0.03 0.85 0.00 0.00 -0.87 0.00 0.00 58.31 58.33 1aml n LYS 28 Cb 0.33 -1.21 0.00 0.00 0.02 0.00 0.00 35.03 34.17 1aml n LYS 28 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1aml n GLY 29 N -2.69 1.00 0.00 3.14 0.00 -1.26 -4.95 105.19 100.42 1aml n GLY 29 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.07 -0.04 0.33 4.61 0.00 -1.26 -0.34 120.51 123.75 1aml n ALA 30 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1aml n ALA 30 Cb 0.00 0.00 0.50 0.00 0.00 0.00 0.00 19.45 19.95 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 0.00 0.00 0.13 0.00 5.03 -2.00 -2.91 117.51 117.76 1aml h ILE 31 Ca 0.00 -0.55 -0.34 0.00 -0.12 0.00 0.00 64.86 63.84 1aml h ILE 31 Cb 0.00 1.50 -0.01 0.00 -3.03 0.00 0.00 36.82 35.28 1aml h ILE 31 CO 0.00 0.00 -1.81 0.40 -0.68 0.00 0.00 178.15 176.06 1aml h ILE 32 N 0.00 0.84 0.00 -0.67 5.03 -1.97 -3.13 117.51 117.62 1aml h ILE 32 Ca 0.00 -2.52 0.00 0.00 -0.12 0.00 0.00 64.86 62.22 1aml h ILE 32 Cb 0.62 2.63 0.00 0.00 -3.03 0.00 0.00 36.82 37.03 1aml h ILE 32 CO 0.00 0.83 0.00 0.61 -0.68 0.00 0.00 178.15 178.91 1aml n GLY 33 N 1.85 -1.06 0.10 5.37 0.00 0.54 -1.51 105.19 110.48 1aml n GLY 33 Ca -0.25 -0.05 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.54 1.87 0.06 0.99 7.94 -1.11 -3.73 117.00 121.47 1aml n LEU 34 Ca 0.04 0.47 0.02 0.00 -1.11 0.00 0.00 56.01 55.43 1aml n LEU 34 Cb 0.19 -0.89 0.37 0.00 0.53 0.00 0.00 43.42 43.62 1aml n LEU 34 CO 0.15 0.03 0.96 0.00 -1.11 0.00 0.00 177.39 177.42 1aml h MET 35 N -1.00 0.38 -0.90 1.96 -0.00 -1.53 -1.24 114.93 112.60 1aml h MET 35 Ca -0.26 -0.07 -0.10 0.00 -0.00 0.00 0.00 59.70 59.27 1aml h MET 35 Cb 1.07 -0.06 -0.06 0.00 -0.00 0.00 0.00 31.60 32.55 1aml h MET 35 CO -0.16 0.42 0.13 0.28 -0.00 0.00 0.00 176.91 177.58 1aml n VAL 36 N -4.32 1.54 0.00 -0.10 0.31 -0.57 -4.34 118.33 110.85 1aml n VAL 36 Ca 0.01 -0.71 0.00 0.00 -0.01 0.00 0.00 64.34 63.63 1aml n VAL 36 Cb 0.21 -0.57 0.00 0.00 -0.91 0.00 0.00 33.84 32.58 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 0.06 -0.45 2.66 2.92 0.00 -0.47 -4.96 105.19 104.94 1aml n GLY 37 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 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 1.73 -1.46 0.00 -0.02 0.00 -1.26 -5.00 105.19 99.18 1aml n GLY 38 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.85 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 0.45 0.21 0.00 1.61 0.24 -1.26 -5.16 118.33 114.41 1aml n VAL 39 Ca -0.07 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 1aml n VAL 39 Cb 0.76 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 34.16 1aml n VAL 39 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21