#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 -3.64 -4.00 2.24 0.00 -1.26 -4.96 120.51 108.89 1aml n ALA 2 Ca 0.00 -1.12 -0.31 0.00 0.00 0.00 0.00 53.44 52.01 1aml n ALA 2 Cb 0.00 -1.64 -0.15 0.00 0.00 0.00 0.00 19.45 17.66 1aml n ALA 2 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1aml s GLU 3 N -3.60 1.59 0.00 0.00 2.02 -1.26 -4.78 118.70 112.67 1aml s GLU 3 Ca 0.58 -2.03 0.00 0.00 0.02 0.00 0.00 54.97 53.54 1aml s GLU 3 Cb -0.15 -3.24 0.00 0.00 0.10 0.00 0.00 34.13 30.83 1aml s GLU 3 CO 0.66 -0.98 0.00 1.97 0.02 0.00 0.00 175.26 176.94 1aml n PHE 4 N 4.03 0.00 -3.61 1.61 -1.74 -1.26 -5.04 117.46 111.46 1aml n PHE 4 Ca 0.04 0.00 -0.39 0.00 -0.56 0.00 0.00 57.45 56.54 1aml n PHE 4 Cb 0.40 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.33 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 -0.99 2.87 0.00 3.97 3.00 -1.26 -5.06 118.95 121.48 1aml s ARG 5 Ca 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 55.73 53.21 1aml s ARG 5 Cb 0.00 -3.94 0.00 0.00 0.00 0.00 0.00 34.95 31.01 1aml s ARG 5 CO 0.00 -1.21 0.00 1.58 0.00 0.00 0.00 175.30 175.67 1aml n HIS 6 N 3.61 -0.19 -0.84 -0.53 -0.00 -1.26 -4.91 115.22 111.10 1aml n HIS 6 Ca 0.10 0.00 -0.35 0.00 0.46 0.00 0.00 57.72 57.93 1aml n HIS 6 Cb 0.40 0.00 0.10 0.00 -0.12 0.00 0.00 29.99 30.38 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 0.00 -3.14 0.00 0.26 9.92 -1.26 -5.01 116.55 117.32 1aml n ASP 7 Ca 0.00 0.07 0.00 0.00 -0.53 0.00 0.00 54.79 54.33 1aml n ASP 7 Cb 0.00 -0.87 0.00 0.00 -0.64 0.00 0.00 41.12 39.61 1aml n ASP 7 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1aml n SER 8 N 0.58 0.00 0.00 -2.24 7.64 -1.26 -5.12 113.62 113.22 1aml n SER 8 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1aml n SER 8 Cb 0.62 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 1aml n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aml n GLY 9 N 5.00 0.10 0.00 0.23 0.00 -1.26 -5.10 105.19 104.17 1aml n GLY 9 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.89 0.00 -3.08 1.61 9.36 -1.26 -5.13 117.16 116.77 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 -0.65 2.98 1.02 -1.26 -4.98 120.64 117.75 1aml n GLU 11 Ca 0.00 0.00 0.51 0.00 -0.02 0.00 0.00 57.16 57.65 1aml n GLU 11 Cb 0.00 0.00 0.79 0.00 -0.02 0.00 0.00 31.44 32.21 1aml n GLU 11 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1aml h VAL 12 N 0.89 0.03 -0.44 2.62 2.07 -2.02 1.54 116.25 120.94 1aml h VAL 12 Ca 0.00 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.22 1aml h VAL 12 Cb 0.00 0.03 -0.13 0.00 -1.52 0.00 0.00 31.29 29.67 1aml h VAL 12 CO 0.00 0.00 0.38 1.57 0.02 0.00 0.00 177.57 179.54 1aml n HIS 13 N -3.90 1.42 0.00 1.57 -0.00 -1.26 -3.53 115.22 109.52 1aml n HIS 13 Ca 0.42 -1.89 0.00 0.00 -0.00 0.00 0.00 57.72 56.24 1aml n HIS 13 Cb 1.94 -0.92 0.00 0.00 -0.00 0.00 0.00 29.99 31.01 1aml n HIS 13 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1aml n HIS 14 N 0.44 -0.92 -0.05 1.57 -0.00 0.52 -4.91 115.22 111.87 1aml n HIS 14 Ca 0.28 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.99 1aml n HIS 14 Cb 0.57 0.20 -0.00 0.00 -0.00 0.00 0.00 29.99 30.76 1aml n HIS 14 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.34 178.30 1aml h GLN 15 N 0.00 0.00 -0.77 1.57 4.20 -1.57 -3.16 115.11 115.38 1aml h GLN 15 Ca 0.00 0.00 0.22 0.00 0.06 0.00 0.00 58.65 58.93 1aml h GLN 15 Cb 0.00 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.75 1aml h GLN 15 CO 0.00 0.00 0.80 0.87 -0.67 0.00 0.00 178.83 179.83 1aml h LYS 16 N -0.99 0.00 0.03 1.46 1.79 -1.81 0.63 116.57 117.68 1aml h LYS 16 Ca 0.00 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1aml h LYS 16 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 1aml h LYS 16 CO 0.00 0.00 -0.01 -0.07 -1.08 0.00 0.00 179.45 178.29 1aml h LEU 17 N 0.00 -0.03 0.00 2.94 3.38 -1.76 -2.77 115.31 117.06 1aml h LEU 17 Ca 0.37 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1aml h LEU 17 Cb 1.96 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.72 1aml h LEU 17 CO -0.00 0.35 0.00 0.52 0.09 0.00 0.00 178.44 179.40 1aml n VAL 18 N -4.92 0.00 -0.11 1.22 0.31 0.22 -1.35 118.33 113.69 1aml n VAL 18 Ca -0.08 1.16 0.09 0.00 -0.01 0.00 0.00 64.34 65.50 1aml n VAL 18 Cb 0.21 -1.96 0.17 0.00 -0.91 0.00 0.00 33.84 31.35 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 -1.24 0.35 0.39 3.52 -0.00 -0.95 0.29 117.46 119.82 1aml n PHE 19 Ca 0.00 0.41 -0.16 0.00 -0.00 0.00 0.00 57.45 57.70 1aml n PHE 19 Cb 0.00 -0.84 -0.07 0.00 -0.00 0.00 0.00 39.48 38.57 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 -0.94 -0.87 -5.13 3.04 -0.99 -1.79 116.94 110.25 1aml h PHE 20 Ca 0.27 -0.02 0.23 0.00 3.98 0.00 0.00 57.97 62.42 1aml h PHE 20 Cb 0.67 0.31 -0.15 0.00 2.56 0.00 0.00 35.95 39.34 1aml h PHE 20 CO -0.06 -0.59 0.15 0.00 -2.02 0.00 0.00 178.31 175.80 1aml h ALA 21 N -1.37 1.16 -0.78 2.41 0.00 0.56 0.50 119.26 121.74 1aml h ALA 21 Ca -0.10 0.25 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1aml h ALA 21 Cb 0.78 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 1aml h ALA 21 CO 0.17 -0.48 0.49 0.93 0.00 0.00 0.00 179.25 180.36 1aml h GLU 22 N 0.14 0.93 -0.64 0.00 5.08 -0.86 -1.17 114.58 118.07 1aml h GLU 22 Ca 0.53 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 1aml h GLU 22 Cb 1.07 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1aml h GLU 22 CO -0.71 0.61 0.00 -0.25 -1.00 0.00 0.00 179.01 177.67 1aml n ASP 23 N -4.61 4.00 -4.94 1.42 8.00 0.14 -4.91 116.55 115.63 1aml n ASP 23 Ca 0.09 -2.43 -0.24 0.00 0.71 0.00 0.00 54.79 52.92 1aml n ASP 23 Cb 0.10 -0.54 0.02 0.00 -0.02 0.00 0.00 41.12 40.68 1aml n ASP 23 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1aml s VAL 24 N -1.91 3.82 -0.12 2.53 1.01 0.73 -5.03 120.40 121.42 1aml s VAL 24 Ca 0.40 -0.35 -0.07 0.00 0.00 0.00 0.00 61.98 61.96 1aml s VAL 24 Cb 0.27 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.16 1aml s VAL 24 CO 0.18 -0.36 0.09 1.23 0.00 0.00 0.00 175.10 176.24 1aml h GLY 25 N 0.21 0.00 -5.00 4.51 0.00 -1.90 -3.46 103.07 97.42 1aml h GLY 25 Ca -0.46 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 46.74 1aml h GLY 25 CO 0.58 0.00 -0.02 -1.14 0.00 0.00 0.00 176.54 175.96 1aml n SER 26 N -4.71 -1.46 -0.09 0.19 3.41 -1.26 -5.04 113.62 104.66 1aml n SER 26 Ca -0.04 -2.12 -0.09 0.00 -0.26 0.00 0.00 58.87 56.35 1aml n SER 26 Cb 0.15 1.17 -0.03 0.00 -0.26 0.00 0.00 64.21 65.24 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 -0.13 1.90 -3.54 4.04 4.05 -1.26 -4.91 115.26 115.41 1aml n ASN 27 Ca -0.12 0.42 -0.29 0.00 0.45 0.00 0.00 54.58 55.03 1aml n ASN 27 Cb 0.72 -0.79 -0.14 0.00 1.23 0.00 0.00 39.78 40.80 1aml n ASN 27 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1aml s LYS 28 N -2.69 0.31 0.00 1.20 2.20 -1.26 -4.86 119.74 114.64 1aml s LYS 28 Ca -0.26 -0.75 0.00 0.00 -0.36 0.00 0.00 55.97 54.61 1aml s LYS 28 Cb 0.04 -1.27 0.00 0.00 -1.51 0.00 0.00 37.83 35.09 1aml s LYS 28 CO 0.38 -1.06 0.00 0.41 -0.36 0.00 0.00 175.35 174.73 1aml n GLY 29 N 4.97 0.38 0.83 5.54 0.00 -1.26 -4.77 105.19 110.88 1aml n GLY 29 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.33 2.63 -0.32 4.61 0.00 -1.26 -4.26 120.51 119.59 1aml n ALA 30 Ca 0.00 -0.02 0.17 0.00 0.00 0.00 0.00 53.44 53.59 1aml n ALA 30 Cb 0.00 0.00 0.41 0.00 0.00 0.00 0.00 19.45 19.86 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 0.65 -0.11 0.00 2.04 -1.99 0.21 117.51 118.32 1aml h ILE 31 Ca 0.00 -0.20 -0.19 0.00 1.00 0.00 0.00 64.86 65.47 1aml h ILE 31 Cb 0.00 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.10 1aml h ILE 31 CO 0.00 0.11 -0.72 0.40 0.00 0.00 0.00 178.15 177.93 1aml h ILE 32 N 0.58 1.35 0.00 -0.67 1.08 -1.89 -2.69 117.51 115.27 1aml h ILE 32 Ca 0.56 -2.07 0.00 0.00 -0.39 0.00 0.00 64.86 62.96 1aml h ILE 32 Cb 1.12 2.05 0.00 0.00 -3.07 0.00 0.00 36.82 36.91 1aml h ILE 32 CO -0.31 0.63 0.00 0.61 -0.69 0.00 0.00 178.15 178.39 1aml n GLY 33 N 0.56 -0.95 0.45 5.37 0.00 0.62 -3.67 105.19 107.57 1aml n GLY 33 Ca -0.05 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.69 1.29 -0.36 0.99 7.94 -0.46 -4.51 117.00 121.21 1aml n LEU 34 Ca 0.09 0.20 0.34 0.00 -1.11 0.00 0.00 56.01 55.53 1aml n LEU 34 Cb 0.04 -0.51 0.70 0.00 0.53 0.00 0.00 43.42 44.18 1aml n LEU 34 CO 0.07 0.38 1.31 0.00 -1.11 0.00 0.00 177.39 178.03 1aml h MET 35 N -0.60 0.08 -1.28 1.96 -0.00 -1.56 0.55 114.93 114.08 1aml h MET 35 Ca -0.44 -0.01 -0.23 0.00 -0.00 0.00 0.00 59.70 59.03 1aml h MET 35 Cb 1.39 -0.02 -0.12 0.00 -0.00 0.00 0.00 31.60 32.86 1aml h MET 35 CO -0.26 0.06 0.29 0.28 -0.00 0.00 0.00 176.91 177.28 1aml n VAL 36 N -4.29 2.21 -0.05 -0.10 0.31 -1.26 -4.36 118.33 110.80 1aml n VAL 36 Ca 0.27 -1.06 -0.00 0.00 -0.01 0.00 0.00 64.34 63.54 1aml n VAL 36 Cb 1.23 -1.06 -0.00 0.00 -0.91 0.00 0.00 33.84 33.10 1aml n VAL 36 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1aml h GLY 37 N 2.74 0.00 0.00 2.92 0.00 -0.16 -3.49 103.07 105.08 1aml h GLY 37 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 1aml h GLY 37 CO 0.52 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.67 1aml n GLY 38 N 1.80 1.78 3.93 4.60 0.00 -1.26 -4.47 105.19 111.57 1aml n GLY 38 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.90 -0.08 -0.06 1.61 0.24 -1.26 -5.27 118.33 112.61 1aml n VAL 39 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1aml n VAL 39 Cb 0.00 -0.47 0.00 0.00 -1.47 0.00 0.00 33.84 31.90 1aml n VAL 39 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24