#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 1.46 -0.31 2.24 0.00 -1.26 -5.05 121.76 118.85 1aml s ALA 2 Ca 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 51.96 51.39 1aml s ALA 2 Cb 0.00 -3.03 0.10 0.00 0.00 0.00 0.00 23.12 20.19 1aml s ALA 2 CO 0.00 -2.56 0.12 -1.21 0.00 0.00 0.00 175.76 172.12 1aml s GLU 3 N -5.23 0.46 0.14 0.00 2.02 -1.26 -4.98 118.70 109.87 1aml s GLU 3 Ca 0.65 -0.84 0.00 0.00 0.02 0.00 0.00 54.97 54.80 1aml s GLU 3 Cb -0.15 -1.57 0.00 0.00 0.10 0.00 0.00 34.13 32.51 1aml s GLU 3 CO 0.55 -1.02 0.00 1.97 0.02 0.00 0.00 175.26 176.78 1aml n PHE 4 N 4.98 -0.67 -2.32 1.61 -1.74 -1.26 -4.89 117.46 113.17 1aml n PHE 4 Ca -0.03 0.12 -0.43 0.00 -0.56 0.00 0.00 57.45 56.55 1aml n PHE 4 Cb 0.42 0.16 0.00 0.00 1.52 0.00 0.00 39.48 41.58 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 -3.46 3.11 -3.56 3.97 3.00 -1.26 -4.85 116.66 113.61 1aml n ARG 5 Ca 0.00 -3.10 -0.21 0.00 -0.00 0.00 0.00 57.85 54.54 1aml n ARG 5 Cb 0.02 -3.39 -0.15 0.00 0.00 0.00 0.00 32.46 28.94 1aml n ARG 5 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1aml s HIS 6 N 3.63 -0.07 1.10 -0.14 2.46 -1.26 -5.14 115.29 115.87 1aml s HIS 6 Ca 0.51 0.06 -0.18 0.00 0.47 0.00 0.00 55.06 55.92 1aml s HIS 6 Cb 0.07 -0.48 0.10 0.00 -0.13 0.00 0.00 32.58 32.14 1aml s HIS 6 CO 0.02 -0.52 0.05 -0.25 -2.47 0.00 0.00 174.74 171.57 1aml n ASP 7 N 5.30 -2.34 -1.41 9.88 8.00 -1.26 -4.89 116.55 129.82 1aml n ASP 7 Ca -0.06 -0.08 -0.07 0.00 0.71 0.00 0.00 54.79 55.29 1aml n ASP 7 Cb 0.49 -0.98 0.21 0.00 -0.02 0.00 0.00 41.12 40.82 1aml n ASP 7 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1aml n SER 8 N -1.64 3.03 -2.74 -2.24 3.41 -1.26 -4.70 113.62 107.47 1aml n SER 8 Ca 0.01 -3.63 -0.08 0.00 -0.26 0.00 0.00 58.87 54.92 1aml n SER 8 Cb 0.61 -0.68 0.05 0.00 -0.26 0.00 0.00 64.21 63.94 1aml n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1aml n GLY 9 N -1.01 -0.14 0.00 5.00 0.00 -1.26 -5.13 105.19 102.65 1aml n GLY 9 Ca 0.38 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.63 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 1.69 0.00 0.00 1.61 9.36 -1.26 -4.36 117.16 124.20 1aml n TYR 10 Ca 0.09 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.31 1aml n TYR 10 Cb 0.63 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.34 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 4.71 -1.26 -2.38 120.64 124.76 1aml n GLU 11 Ca 0.00 0.00 0.19 0.00 -0.01 0.00 0.00 57.16 57.34 1aml n GLU 11 Cb 0.00 0.00 0.57 0.00 -1.01 0.00 0.00 31.44 31.00 1aml n GLU 11 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1aml h VAL 12 N 0.00 0.14 -1.62 2.62 2.07 -1.99 0.62 116.25 118.08 1aml h VAL 12 Ca 0.00 0.00 -0.68 0.00 0.82 0.00 0.00 66.70 66.84 1aml h VAL 12 Cb 0.00 0.37 -0.25 0.00 -1.52 0.00 0.00 31.29 29.89 1aml h VAL 12 CO 0.00 0.00 0.88 1.41 0.02 0.00 0.00 177.57 179.88 1aml n HIS 13 N -3.25 2.66 0.00 1.57 8.25 -1.00 -4.25 115.22 119.19 1aml n HIS 13 Ca 0.10 -2.31 0.00 0.00 -0.26 0.00 0.00 57.72 55.24 1aml n HIS 13 Cb 0.91 -1.26 0.00 0.00 1.12 0.00 0.00 29.99 30.76 1aml n HIS 13 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1aml n HIS 14 N -0.25 0.00 0.16 4.41 -0.00 0.12 -4.98 115.22 114.68 1aml n HIS 14 Ca 0.53 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 58.11 1aml n HIS 14 Cb 0.36 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 30.29 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 -0.50 -1.33 1.57 1.08 -1.56 0.44 115.11 114.82 1aml h GLN 15 Ca 0.00 0.03 0.39 0.00 -1.45 0.00 0.00 58.65 57.62 1aml h GLN 15 Cb 0.00 0.11 -0.05 0.00 -0.05 0.00 0.00 27.48 27.49 1aml h GLN 15 CO 0.00 -0.33 1.18 0.87 -0.95 0.00 0.00 178.83 179.59 1aml h LYS 16 N -0.52 0.00 0.00 1.46 1.79 -1.74 0.73 116.57 118.29 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 0.50 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1aml h LYS 16 CO -0.08 0.00 -0.10 -0.07 -1.08 0.00 0.00 179.45 178.11 1aml h LEU 17 N 0.00 0.00 0.00 2.94 3.38 -1.26 -3.19 115.31 117.17 1aml h LEU 17 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1aml h LEU 17 Cb 2.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.73 1aml h LEU 17 CO -0.01 0.35 0.00 0.52 0.09 0.00 0.00 178.44 179.39 1aml n VAL 18 N -3.65 0.00 -0.10 1.22 0.31 -0.01 -0.55 118.33 115.55 1aml n VAL 18 Ca -0.01 1.43 0.08 0.00 -0.01 0.00 0.00 64.34 65.83 1aml n VAL 18 Cb 0.05 -2.18 0.15 0.00 -0.91 0.00 0.00 33.84 30.96 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 -2.25 0.31 0.23 3.52 -0.00 0.24 0.28 117.46 119.79 1aml n PHE 19 Ca 0.00 0.36 -0.09 0.00 -0.00 0.00 0.00 57.45 57.72 1aml n PHE 19 Cb 0.00 -0.80 -0.04 0.00 -0.00 0.00 0.00 39.48 38.63 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 -0.56 -0.57 -5.13 3.57 -0.81 -0.82 116.94 112.62 1aml h PHE 20 Ca 0.24 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.84 1aml h PHE 20 Cb 0.60 0.19 -0.10 0.00 2.79 0.00 0.00 35.95 39.42 1aml h PHE 20 CO -0.05 -0.35 -0.08 0.00 -2.23 0.00 0.00 178.31 175.60 1aml h ALA 21 N -1.53 0.45 -0.78 2.41 0.00 0.53 0.37 119.26 120.71 1aml h ALA 21 Ca -0.06 0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1aml h ALA 21 Cb 0.46 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.59 1aml h ALA 21 CO 0.10 -0.42 0.51 0.93 0.00 0.00 0.00 179.25 180.37 1aml h GLU 22 N 0.04 0.87 -0.64 0.00 5.08 -0.49 -0.85 114.58 118.59 1aml h GLU 22 Ca 0.28 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1aml h GLU 22 Cb 0.45 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1aml h GLU 22 CO -0.55 0.57 0.00 -0.25 -1.00 0.00 0.00 179.01 177.79 1aml n ASP 23 N -4.47 5.16 -0.07 1.42 9.92 0.19 -4.27 116.55 124.44 1aml n ASP 23 Ca 0.11 -2.62 -0.22 0.00 -0.53 0.00 0.00 54.79 51.53 1aml n ASP 23 Cb 0.17 -0.62 -0.12 0.00 -0.64 0.00 0.00 41.12 39.91 1aml n ASP 23 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1aml n VAL 24 N 0.99 1.62 0.00 2.53 0.31 0.11 -5.00 118.33 118.88 1aml n VAL 24 Ca 0.27 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1aml n VAL 24 Cb 1.01 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 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 1.70 3.11 2.68 2.92 0.00 -1.21 -4.77 105.19 109.63 1aml n GLY 25 Ca -0.36 -1.01 -0.05 0.00 0.00 0.00 0.00 46.02 44.60 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 0.50 -1.54 -4.57 1.61 3.41 -1.26 -5.07 113.62 106.71 1aml n SER 26 Ca 0.00 -2.37 -0.21 0.00 -0.26 0.00 0.00 58.87 56.03 1aml n SER 26 Cb 0.00 1.37 -0.07 0.00 -0.26 0.00 0.00 64.21 65.25 1aml n SER 26 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1aml s ASN 27 N -0.50 4.44 0.00 4.04 0.01 -1.26 -4.80 114.94 116.85 1aml s ASN 27 Ca 0.21 -0.73 0.00 0.00 -0.71 0.00 0.00 52.86 51.63 1aml s ASN 27 Cb 0.30 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 39.39 1aml s ASN 27 CO -0.16 -3.52 0.99 0.29 -1.51 0.00 0.00 177.10 173.19 1aml n LYS 28 N 8.60 0.00 -2.10 -0.60 5.02 -1.26 -4.95 118.16 122.86 1aml n LYS 28 Ca 0.43 0.68 -0.02 0.00 -2.02 0.00 0.00 58.31 57.38 1aml n LYS 28 Cb 0.46 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 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 -1.00 -0.82 0.52 0.72 0.00 -1.26 -4.97 105.19 98.38 1aml n GLY 29 Ca 0.00 0.27 -0.04 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.86 1.78 0.01 4.61 0.00 -1.26 -4.32 120.51 120.47 1aml n ALA 30 Ca 0.03 -0.41 0.07 0.00 0.00 0.00 0.00 53.44 53.13 1aml n ALA 30 Cb 0.34 0.11 -0.12 0.00 0.00 0.00 0.00 19.45 19.78 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 -3.84 0.45 -0.04 0.00 -0.00 -1.26 -3.86 119.36 110.81 1aml n ILE 31 Ca -0.07 -0.58 -0.18 0.00 -0.00 0.00 0.00 62.75 61.92 1aml n ILE 31 Cb 0.25 -0.21 -0.14 0.00 -0.00 0.00 0.00 39.64 39.54 1aml n ILE 31 CO 0.00 0.00 0.00 2.30 -0.00 0.00 0.00 176.55 178.85 1aml n ILE 32 N -2.48 1.67 1.64 1.39 -6.64 -1.26 -1.91 119.36 111.77 1aml n ILE 32 Ca -0.08 -0.67 0.11 0.00 -1.77 0.00 0.00 62.75 60.34 1aml n ILE 32 Cb 0.68 -1.49 0.65 0.00 -1.44 0.00 0.00 39.64 38.03 1aml n ILE 32 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1aml n GLY 33 N 1.98 -0.82 1.10 3.28 0.00 -1.26 -3.05 105.19 106.42 1aml n GLY 33 Ca -0.33 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1aml n GLY 33 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1aml n LEU 34 N -0.92 0.03 -0.30 0.99 4.77 -1.25 -4.68 117.00 115.64 1aml n LEU 34 Ca 0.16 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.24 1aml n LEU 34 Cb 0.08 0.00 0.32 0.00 -2.33 0.00 0.00 43.42 41.49 1aml n LEU 34 CO 0.12 -0.05 1.23 0.00 -1.33 0.00 0.00 177.39 177.36 1aml h MET 35 N 0.00 0.79 -1.04 3.23 -0.00 -1.48 0.10 114.93 116.53 1aml h MET 35 Ca 0.00 -0.05 -0.18 0.00 -0.00 0.00 0.00 59.70 59.47 1aml h MET 35 Cb 0.89 -0.18 -0.10 0.00 -0.00 0.00 0.00 31.60 32.20 1aml h MET 35 CO 0.00 0.52 0.23 0.28 -0.00 0.00 0.00 176.91 177.94 1aml n VAL 36 N -4.57 1.79 -0.41 -0.10 0.31 -1.17 -4.36 118.33 109.82 1aml n VAL 36 Ca 0.17 -0.69 -0.14 0.00 -0.01 0.00 0.00 64.34 63.68 1aml n VAL 36 Cb 0.40 -0.85 0.07 0.00 -0.91 0.00 0.00 33.84 32.55 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 -0.01 3.57 0.00 2.92 0.00 0.34 -4.81 105.19 107.20 1aml n GLY 37 Ca 0.20 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.03 0.84 0.94 -0.02 0.00 -1.26 -4.98 105.19 100.68 1aml n GLY 38 Ca 0.29 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.36 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 0.00 1.20 0.90 1.61 0.24 -1.26 -5.24 118.33 115.78 1aml n VAL 39 Ca 0.00 -2.15 0.11 0.00 -2.04 0.00 0.00 64.34 60.26 1aml n VAL 39 Cb 0.00 0.30 0.09 0.00 -1.47 0.00 0.00 33.84 32.76 1aml n VAL 39 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02