#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 -3.65 -3.84 2.24 0.00 -1.26 -4.99 120.51 109.01 1aml n ALA 2 Ca 0.00 -1.33 -0.30 0.00 0.00 0.00 0.00 53.44 51.81 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 -2.00 0.00 0.00 0.00 177.50 175.50 1aml s GLU 3 N -3.92 1.10 0.32 0.00 2.56 -1.26 -5.11 118.70 112.40 1aml s GLU 3 Ca 0.60 -1.01 -0.03 0.00 0.00 0.00 0.00 54.97 54.53 1aml s GLU 3 Cb -0.16 -2.36 -0.00 0.00 2.00 0.00 0.00 34.13 33.60 1aml s GLU 3 CO 0.63 -0.78 0.43 -0.59 -0.56 0.00 0.00 175.26 174.39 1aml s PHE 4 N 1.51 1.03 -0.09 5.30 -0.71 -1.26 -5.05 117.98 118.70 1aml s PHE 4 Ca 0.02 -1.25 -0.06 0.00 -1.04 0.00 0.00 56.93 54.59 1aml s PHE 4 Cb -0.18 -0.13 0.02 0.00 -1.21 0.00 0.00 43.02 41.52 1aml s PHE 4 CO -0.13 -1.06 0.13 0.54 -1.34 0.00 0.00 175.22 173.36 1aml n ARG 5 N -0.52 -3.36 -4.42 1.99 3.00 -1.26 -5.01 116.66 107.07 1aml n ARG 5 Ca 0.01 2.59 -0.24 0.00 -0.01 0.00 0.00 57.85 60.19 1aml n ARG 5 Cb 0.62 -3.41 -0.09 0.00 0.00 0.00 0.00 32.46 29.58 1aml n ARG 5 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1aml s HIS 6 N -0.41 2.45 0.00 -1.55 -3.43 -1.26 -5.14 115.29 105.96 1aml s HIS 6 Ca -0.15 -0.38 0.00 0.00 -0.80 0.00 0.00 55.06 53.73 1aml s HIS 6 Cb 0.01 -1.25 0.00 0.00 -1.43 0.00 0.00 32.58 29.91 1aml s HIS 6 CO 0.40 0.61 0.00 -3.47 -2.00 0.00 0.00 174.74 170.28 1aml n ASP 7 N -0.80 0.00 0.00 7.38 2.03 -1.26 -5.08 116.55 118.83 1aml n ASP 7 Ca -0.05 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.26 1aml n ASP 7 Cb 0.61 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 1aml n ASP 7 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1aml n SER 8 N 0.00 0.00 0.00 1.67 2.88 -1.26 -5.11 113.62 111.80 1aml n SER 8 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1aml n SER 8 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1aml n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1aml n GLY 9 N 5.00 -0.07 0.00 0.46 0.00 -1.26 -5.14 105.19 104.17 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 -2.47 0.00 0.00 1.61 9.36 -1.26 -5.01 117.16 119.39 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 -0.04 2.98 1.02 -1.26 -4.85 120.64 118.49 1aml n GLU 11 Ca 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 1aml n GLU 11 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 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 0.00 1.28 -2.21 2.62 2.07 -1.99 -2.84 116.25 115.17 1aml h VAL 12 Ca 0.00 -1.88 -0.74 0.00 0.82 0.00 0.00 66.70 64.90 1aml h VAL 12 Cb 0.00 1.84 -0.32 0.00 -1.52 0.00 0.00 31.29 31.30 1aml h VAL 12 CO 0.00 0.60 0.53 1.57 0.02 0.00 0.00 177.57 180.30 1aml n HIS 13 N -3.96 3.16 0.04 1.57 -0.00 -1.26 -4.35 115.22 110.42 1aml n HIS 13 Ca -0.06 -2.94 0.00 0.00 0.46 0.00 0.00 57.72 55.18 1aml n HIS 13 Cb 0.70 -0.97 0.00 0.00 -0.12 0.00 0.00 29.99 29.60 1aml n HIS 13 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1aml n HIS 14 N -0.17 -2.21 -0.08 1.57 -0.00 -1.25 -4.81 115.22 108.28 1aml n HIS 14 Ca 0.43 0.28 -0.01 0.00 -0.00 0.00 0.00 57.72 58.42 1aml n HIS 14 Cb 0.31 0.97 0.26 0.00 -0.00 0.00 0.00 29.99 31.53 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 0.72 -0.34 1.57 1.08 -1.75 -2.39 115.11 114.00 1aml h GLN 15 Ca 0.00 -0.12 -0.11 0.00 -1.45 0.00 0.00 58.65 56.98 1aml h GLN 15 Cb 0.00 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 1aml h GLN 15 CO 0.00 0.62 -0.21 0.87 -0.95 0.00 0.00 178.83 179.16 1aml h LYS 16 N 0.70 0.75 0.17 1.46 1.57 -1.76 -2.55 116.57 116.92 1aml h LYS 16 Ca 0.17 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1aml h LYS 16 Cb 0.20 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 1aml h LYS 16 CO -0.01 0.96 -0.43 -0.07 -0.57 0.00 0.00 179.45 179.33 1aml h LEU 17 N 0.53 -1.27 0.00 2.94 3.38 -1.75 -1.32 115.31 117.82 1aml h LEU 17 Ca 0.07 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1aml h LEU 17 Cb 0.76 0.47 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1aml h LEU 17 CO 0.06 -0.51 0.00 0.52 0.09 0.00 0.00 178.44 178.60 1aml n VAL 18 N -5.48 0.00 -0.16 1.22 0.31 -0.98 -0.54 118.33 112.71 1aml n VAL 18 Ca -0.08 1.21 0.15 0.00 -0.01 0.00 0.00 64.34 65.61 1aml n VAL 18 Cb 0.39 -1.88 0.28 0.00 -0.91 0.00 0.00 33.84 31.71 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 -1.60 0.50 0.37 3.52 -0.00 -0.96 0.28 117.46 119.57 1aml n PHE 19 Ca 0.00 0.50 -0.15 0.00 -0.00 0.00 0.00 57.45 57.80 1aml n PHE 19 Cb 0.00 -0.94 -0.07 0.00 -0.00 0.00 0.00 39.48 38.47 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 -0.91 -0.86 -5.13 3.04 0.38 -2.09 116.94 111.38 1aml h PHE 20 Ca 0.39 -0.02 0.22 0.00 3.98 0.00 0.00 57.97 62.54 1aml h PHE 20 Cb 1.07 0.30 -0.14 0.00 2.56 0.00 0.00 35.95 39.74 1aml h PHE 20 CO -0.00 -0.56 0.17 0.00 -2.02 0.00 0.00 178.31 175.89 1aml h ALA 21 N -1.26 1.15 -0.87 2.41 0.00 0.55 0.39 119.26 121.63 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 0.75 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 1aml h ALA 21 CO 0.16 -0.46 0.56 0.93 0.00 0.00 0.00 179.25 180.44 1aml h GLU 22 N 0.17 1.05 -0.63 0.00 5.08 -0.89 -1.27 114.58 118.08 1aml h GLU 22 Ca 0.52 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1aml h GLU 22 Cb 1.02 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1aml h GLU 22 CO -0.67 0.70 0.00 -3.47 -1.00 0.00 0.00 179.01 174.56 1aml n ASP 23 N -4.54 3.94 -0.07 1.42 2.03 0.11 -4.15 116.55 115.29 1aml n ASP 23 Ca 0.11 -2.40 -0.22 0.00 0.52 0.00 0.00 54.79 52.80 1aml n ASP 23 Cb 0.09 -0.53 -0.12 0.00 -0.72 0.00 0.00 41.12 39.84 1aml n ASP 23 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1aml h VAL 24 N 3.18 0.89 -0.01 5.18 2.07 0.44 -3.49 116.25 124.50 1aml h VAL 24 Ca 0.00 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 65.29 1aml h VAL 24 Cb 1.26 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 33.36 1aml h VAL 24 CO 0.21 0.46 0.00 0.61 0.02 0.00 0.00 177.57 178.87 1aml n GLY 25 N 1.57 1.25 2.37 2.17 0.00 -1.22 -4.48 105.19 106.85 1aml n GLY 25 Ca -0.31 -0.41 -0.01 0.00 0.00 0.00 0.00 46.02 45.29 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 0.91 -5.09 -3.09 1.61 7.64 -1.26 -5.01 113.62 109.33 1aml n SER 26 Ca 0.00 -0.09 -0.16 0.00 1.01 0.00 0.00 58.87 59.63 1aml n SER 26 Cb 0.23 -3.33 -0.01 0.00 -1.01 0.00 0.00 64.21 60.10 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 -1.57 0.37 -4.37 6.43 4.13 -1.26 -5.09 115.26 113.90 1aml n ASN 27 Ca -0.01 -3.09 -0.33 0.00 1.68 0.00 0.00 54.58 52.83 1aml n ASN 27 Cb 0.51 -0.22 -0.14 0.00 -1.54 0.00 0.00 39.78 38.39 1aml n ASN 27 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1aml s LYS 28 N -2.05 3.39 0.00 3.52 2.20 -1.26 -4.99 119.74 120.56 1aml s LYS 28 Ca 0.36 -0.67 0.00 0.00 -0.36 0.00 0.00 55.97 55.30 1aml s LYS 28 Cb 0.35 -2.68 0.00 0.00 -1.51 0.00 0.00 37.83 33.99 1aml s LYS 28 CO -0.07 0.17 0.00 0.41 -0.36 0.00 0.00 175.35 175.50 1aml n GLY 29 N 3.66 -0.84 0.54 5.54 0.00 -1.26 -4.82 105.19 108.01 1aml n GLY 29 Ca -0.18 0.60 -0.08 0.00 0.00 0.00 0.00 46.02 46.36 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 0.00 1.91 -0.09 4.61 0.00 -1.26 -4.34 120.51 121.34 1aml n ALA 30 Ca 0.00 -0.47 -0.11 0.00 0.00 0.00 0.00 53.44 52.86 1aml n ALA 30 Cb 0.00 0.18 -0.04 0.00 0.00 0.00 0.00 19.45 19.59 1aml n ALA 30 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1aml n ILE 31 N -3.93 1.49 0.01 0.00 -0.00 -1.26 -4.08 119.36 111.60 1aml n ILE 31 Ca -0.13 0.09 -0.19 0.00 -0.00 0.00 0.00 62.75 62.53 1aml n ILE 31 Cb 0.38 -2.30 -0.09 0.00 -0.00 0.00 0.00 39.64 37.63 1aml n ILE 31 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 1aml h ILE 32 N -1.00 1.29 0.00 1.39 5.03 -2.00 -2.66 117.51 119.56 1aml h ILE 32 Ca -0.08 -2.12 0.00 0.00 -0.12 0.00 0.00 64.86 62.54 1aml h ILE 32 Cb 0.98 2.25 0.00 0.00 -3.03 0.00 0.00 36.82 37.02 1aml h ILE 32 CO -0.05 0.66 0.00 0.61 -0.68 0.00 0.00 178.15 178.69 1aml n GLY 33 N 0.94 -0.71 0.13 5.37 0.00 -1.26 -2.39 105.19 107.27 1aml n GLY 33 Ca -0.10 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.40 1.94 0.32 0.99 7.94 -1.13 -4.25 117.00 121.40 1aml n LEU 34 Ca 0.03 0.36 0.20 0.00 -1.11 0.00 0.00 56.01 55.48 1aml n LEU 34 Cb 0.09 -0.83 1.04 0.00 0.53 0.00 0.00 43.42 44.25 1aml n LEU 34 CO 0.08 0.42 1.16 0.00 -1.11 0.00 0.00 177.39 177.94 1aml h MET 35 N -1.00 0.00 -0.94 1.96 -0.00 -1.35 0.16 114.93 113.76 1aml h MET 35 Ca -0.56 0.00 -0.08 0.00 -0.00 0.00 0.00 59.70 59.05 1aml h MET 35 Cb 1.48 0.00 -0.05 0.00 -0.00 0.00 0.00 31.60 33.03 1aml h MET 35 CO -0.34 0.00 0.11 0.28 -0.00 0.00 0.00 176.91 176.96 1aml n VAL 36 N -3.20 1.29 0.00 -0.10 0.31 -1.00 -4.10 118.33 111.53 1aml n VAL 36 Ca -0.02 -0.52 0.01 0.00 -0.01 0.00 0.00 64.34 63.80 1aml n VAL 36 Cb 0.19 -0.65 0.19 0.00 -0.91 0.00 0.00 33.84 32.66 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 0.09 2.45 1.12 2.92 0.00 0.04 -3.87 105.19 107.94 1aml n GLY 37 Ca 0.14 -0.49 0.11 0.00 0.00 0.00 0.00 46.02 45.78 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 0.20 1.76 0.21 -0.02 0.00 -1.26 -3.99 105.19 102.10 1aml n GLY 38 Ca 0.17 -0.69 0.03 0.00 0.00 0.00 0.00 46.02 45.53 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 1.33 0.07 -0.34 1.61 0.24 -1.25 -5.27 118.33 114.72 1aml n VAL 39 Ca 0.20 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 1aml n VAL 39 Cb 0.55 1.06 0.00 0.00 -1.47 0.00 0.00 33.84 33.98 1aml n VAL 39 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21