#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aml n ALA 2 N 0.00 -1.13 -1.87 2.24 0.00 -1.26 -4.85 120.51 113.64 1aml n ALA 2 Ca 0.00 0.51 0.04 0.00 0.00 0.00 0.00 53.44 54.00 1aml n ALA 2 Cb 0.00 -2.04 0.07 0.00 0.00 0.00 0.00 19.45 17.48 1aml n ALA 2 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1aml n GLU 3 N 2.30 0.57 -1.70 0.00 2.13 -1.26 -4.86 120.64 117.82 1aml n GLU 3 Ca 0.18 -2.05 -0.32 0.00 0.66 0.00 0.00 57.16 55.62 1aml n GLU 3 Cb 0.19 -0.78 0.05 0.00 0.27 0.00 0.00 31.44 31.17 1aml n GLU 3 CO 0.00 0.00 0.00 -0.59 -0.41 0.00 0.00 177.13 176.13 1aml s PHE 4 N -1.22 2.72 0.09 4.31 -0.12 -1.26 -4.69 117.98 117.81 1aml s PHE 4 Ca 0.24 1.53 0.00 0.00 -0.05 0.00 0.00 56.93 58.65 1aml s PHE 4 Cb 0.24 -3.09 0.00 0.00 -0.63 0.00 0.00 43.02 39.54 1aml s PHE 4 CO -0.05 -1.57 0.00 0.54 -0.05 0.00 0.00 175.22 174.09 1aml n ARG 5 N -2.62 -3.34 -1.43 1.99 3.00 -1.26 -4.58 116.66 108.43 1aml n ARG 5 Ca 0.10 2.58 -0.47 0.00 -0.01 0.00 0.00 57.85 60.04 1aml n ARG 5 Cb 0.52 -2.75 -0.12 0.00 0.00 0.00 0.00 32.46 30.12 1aml n ARG 5 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1aml n HIS 6 N 1.15 0.95 -1.64 -1.55 8.25 -1.26 -4.77 115.22 116.35 1aml n HIS 6 Ca 0.00 0.45 0.00 0.00 -0.26 0.00 0.00 57.72 57.91 1aml n HIS 6 Cb 0.00 -2.40 0.00 0.00 1.12 0.00 0.00 29.99 28.71 1aml n HIS 6 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1aml n ASP 7 N 10.14 0.01 -3.56 0.41 -0.08 -1.26 -5.16 116.55 117.04 1aml n ASP 7 Ca 0.57 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.73 1aml n ASP 7 Cb 0.09 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.44 1aml n ASP 7 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1aml s SER 8 N 1.35 0.25 0.24 1.67 1.04 -1.26 -5.03 113.70 111.95 1aml s SER 8 Ca 0.00 0.53 -0.13 0.00 0.48 0.00 0.00 55.95 56.84 1aml s SER 8 Cb 0.00 0.98 0.31 0.00 0.10 0.00 0.00 66.02 67.41 1aml s SER 8 CO 0.00 -0.26 1.59 1.23 0.98 0.00 0.00 173.24 176.78 1aml h GLY 9 N 8.23 0.46 0.00 7.32 0.00 -1.97 -3.45 103.07 113.66 1aml h GLY 9 Ca -0.16 0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1aml h GLY 9 CO 0.18 -0.29 0.00 2.98 0.00 0.00 0.00 176.54 179.41 1aml n TYR 10 N -5.51 0.00 0.00 5.60 9.36 -1.26 -4.98 117.16 120.37 1aml n TYR 10 Ca 0.11 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.33 1aml n TYR 10 Cb 0.40 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.11 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 -0.07 2.98 1.02 -1.26 -4.87 120.64 118.45 1aml n GLU 11 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 1aml n GLU 11 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.29 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 -0.92 1.60 -0.13 2.62 0.31 -1.26 -4.41 118.33 116.15 1aml n VAL 12 Ca 0.00 -0.66 -0.27 0.00 -0.01 0.00 0.00 64.34 63.40 1aml n VAL 12 Cb 0.00 -1.38 -0.09 0.00 -0.91 0.00 0.00 33.84 31.46 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 -3.26 0.00 -0.57 3.52 8.25 -1.26 -4.38 115.22 117.52 1aml n HIS 13 Ca -0.36 0.00 0.47 0.00 -0.26 0.00 0.00 57.72 57.57 1aml n HIS 13 Cb 1.04 -0.91 0.80 0.00 1.12 0.00 0.00 29.99 32.04 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 -0.86 0.00 0.34 4.41 6.17 -1.89 0.21 115.15 123.53 1aml h HIS 14 Ca -0.64 0.00 -0.02 0.00 0.71 0.00 0.00 60.37 60.42 1aml h HIS 14 Cb 1.58 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.51 1aml h HIS 14 CO -0.08 0.00 -0.16 1.96 0.71 0.00 0.00 177.93 180.36 1aml h GLN 15 N 0.00 -0.43 -0.85 5.26 1.08 -1.77 -2.19 115.11 116.21 1aml h GLN 15 Ca 0.81 0.03 0.25 0.00 -1.45 0.00 0.00 58.65 58.28 1aml h GLN 15 Cb 3.25 0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 30.75 1aml h GLN 15 CO -0.01 -0.12 0.83 0.87 -0.95 0.00 0.00 178.83 179.45 1aml h LYS 16 N -0.77 0.00 0.18 1.46 1.79 -0.78 0.14 116.57 118.58 1aml h LYS 16 Ca -0.05 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 1aml h LYS 16 Cb 0.51 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 1aml h LYS 16 CO 0.08 0.00 -0.09 -0.07 -1.08 0.00 0.00 179.45 178.29 1aml h LEU 17 N 0.00 -0.20 0.00 2.94 3.38 -1.32 -2.93 115.31 117.17 1aml h LEU 17 Ca 0.40 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.38 1aml h LEU 17 Cb 2.06 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.86 1aml h LEU 17 CO -0.00 0.23 0.00 0.52 0.09 0.00 0.00 178.44 179.28 1aml n VAL 18 N -4.76 0.00 -0.12 1.22 0.31 -0.06 -0.98 118.33 113.95 1aml n VAL 18 Ca -0.03 1.21 0.11 0.00 -0.01 0.00 0.00 64.34 65.62 1aml n VAL 18 Cb 0.10 -1.95 0.20 0.00 -0.91 0.00 0.00 33.84 31.27 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 -1.50 0.40 0.36 3.52 -0.00 0.28 0.29 117.46 120.82 1aml n PHE 19 Ca 0.00 0.43 -0.15 0.00 -0.00 0.00 0.00 57.45 57.74 1aml n PHE 19 Cb 0.00 -0.88 -0.07 0.00 -0.00 0.00 0.00 39.48 38.53 1aml n PHE 19 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.76 177.11 1aml h PHE 20 N 0.00 -0.88 -0.75 -5.13 3.57 -0.86 -0.74 116.94 112.16 1aml h PHE 20 Ca 0.30 -0.02 0.15 0.00 3.53 0.00 0.00 57.97 61.93 1aml h PHE 20 Cb 0.77 0.29 -0.14 0.00 2.79 0.00 0.00 35.95 39.66 1aml h PHE 20 CO -0.03 -0.55 -0.18 0.00 -2.23 0.00 0.00 178.31 175.32 1aml h ALA 21 N -1.33 0.50 -0.88 2.41 0.00 0.57 1.36 119.26 121.89 1aml h ALA 21 Ca -0.10 0.29 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1aml h ALA 21 Cb 0.73 0.56 -0.05 0.00 0.00 0.00 0.00 17.79 19.03 1aml h ALA 21 CO 0.16 -0.41 0.58 0.93 0.00 0.00 0.00 179.25 180.51 1aml h GLU 22 N 0.00 1.06 -0.57 0.00 5.08 -0.93 -1.36 114.58 117.86 1aml h GLU 22 Ca 0.36 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1aml h GLU 22 Cb 0.55 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1aml h GLU 22 CO -0.77 0.70 0.00 -0.25 -1.00 0.00 0.00 179.01 177.69 1aml n ASP 23 N -4.45 4.90 0.00 1.42 8.00 0.15 -4.56 116.55 122.01 1aml n ASP 23 Ca 0.12 -2.65 0.00 0.00 0.71 0.00 0.00 54.79 52.97 1aml n ASP 23 Cb 0.12 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 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 0.75 0.00 0.00 2.53 0.31 0.42 -4.99 118.33 117.35 1aml n VAL 24 Ca 0.25 0.43 0.00 0.00 -0.01 0.00 0.00 64.34 65.01 1aml n VAL 24 Cb 0.97 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.54 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 1.86 3.54 2.36 2.92 0.00 -1.22 -4.92 105.19 109.74 1aml n GLY 25 Ca 0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 46.02 45.45 1aml n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1aml n SER 26 N 0.00 -0.97 0.00 1.61 3.41 -1.26 -5.06 113.62 111.35 1aml n SER 26 Ca 0.00 -1.64 0.00 0.00 -0.26 0.00 0.00 58.87 56.97 1aml n SER 26 Cb 0.00 0.71 0.00 0.00 -0.26 0.00 0.00 64.21 64.66 1aml n SER 26 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1aml n ASN 27 N -0.51 0.00 -0.32 4.04 5.15 -1.26 -4.98 115.26 117.38 1aml n ASN 27 Ca -0.17 0.71 0.00 0.00 -0.60 0.00 0.00 54.58 54.53 1aml n ASN 27 Cb 0.66 -0.21 0.00 0.00 -0.53 0.00 0.00 39.78 39.70 1aml n ASN 27 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1aml n LYS 28 N -1.61 -0.91 0.00 1.20 4.81 -1.26 -5.07 118.16 115.32 1aml n LYS 28 Ca 0.00 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 1aml n LYS 28 Cb 0.00 -0.74 0.00 0.00 0.02 0.00 0.00 35.03 34.31 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 -0.57 -0.35 0.00 3.14 0.00 -1.26 -4.89 105.19 101.25 1aml n GLY 29 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.94 1.17 -0.06 4.61 0.00 -1.26 -4.79 120.51 117.24 1aml n ALA 30 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1aml n ALA 30 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 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 1.35 -0.15 0.00 5.03 -2.00 -3.26 117.51 118.48 1aml h ILE 31 Ca 0.00 -1.46 0.03 0.00 -0.12 0.00 0.00 64.86 63.31 1aml h ILE 31 Cb 0.00 1.91 -0.05 0.00 -3.03 0.00 0.00 36.82 35.64 1aml h ILE 31 CO 0.00 0.44 -0.44 0.40 -0.68 0.00 0.00 178.15 177.86 1aml h ILE 32 N 0.08 0.00 -1.29 -0.67 5.03 -1.97 0.17 117.51 118.86 1aml h ILE 32 Ca 0.02 0.00 0.46 0.00 -0.12 0.00 0.00 64.86 65.22 1aml h ILE 32 Cb 0.81 0.00 -0.15 0.00 -3.03 0.00 0.00 36.82 34.45 1aml h ILE 32 CO 0.06 0.00 0.81 0.61 -0.68 0.00 0.00 178.15 178.94 1aml n GLY 33 N -1.34 -0.81 0.38 5.37 0.00 -1.23 0.26 105.19 107.82 1aml n GLY 33 Ca -0.05 0.76 -0.15 0.00 0.00 0.00 0.00 46.02 46.58 1aml n GLY 33 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1aml h LEU 34 N 0.00 -1.00 -1.95 0.99 3.38 -0.71 -0.42 115.31 115.59 1aml h LEU 34 Ca 0.86 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.92 1aml h LEU 34 Cb 2.69 0.35 -0.00 0.00 0.09 0.00 0.00 40.66 43.79 1aml h LEU 34 CO -0.52 -0.48 -0.04 0.00 0.09 0.00 0.00 178.44 177.48 1aml h MET 35 N -0.69 0.00 -0.99 1.13 -0.00 -0.14 -2.43 114.93 111.80 1aml h MET 35 Ca -0.01 0.00 -0.14 0.00 -0.00 0.00 0.00 59.70 59.55 1aml h MET 35 Cb 0.65 0.00 -0.08 0.00 -0.00 0.00 0.00 31.60 32.17 1aml h MET 35 CO -0.11 0.04 0.17 0.28 -0.00 0.00 0.00 176.91 177.29 1aml n VAL 36 N -3.22 1.57 0.00 -0.10 0.31 -0.18 -4.58 118.33 112.13 1aml n VAL 36 Ca -0.01 -0.55 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 1aml n VAL 36 Cb 0.24 -0.81 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 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 0.03 -1.92 3.94 2.92 0.00 -0.95 -4.97 105.19 104.25 1aml n GLY 37 Ca 0.17 0.57 -0.25 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.94 -0.24 1.61 -0.02 0.00 -1.02 -4.83 105.19 99.75 1aml n GLY 38 Ca 0.00 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.24 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 -4.39 2.37 -0.91 1.61 0.24 -1.26 -5.16 118.33 110.82 1aml n VAL 39 Ca -0.29 -1.41 0.00 0.00 -2.04 0.00 0.00 64.34 60.59 1aml n VAL 39 Cb 0.68 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.92 1aml n VAL 39 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24