#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ilo s MET 2 N 0.00 3.91 -0.42 0.03 1.00 0.11 -4.73 119.30 119.19 1ilo s MET 2 Ca 0.00 0.82 -0.28 0.00 0.00 0.00 0.00 55.69 56.23 1ilo s MET 2 Cb 0.00 -3.81 -0.01 0.00 0.00 0.00 0.00 34.83 31.01 1ilo s MET 2 CO 0.00 -1.09 1.68 0.15 0.00 0.00 0.00 175.02 175.76 1ilo s LYS 3 N 3.93 3.28 -0.19 2.03 1.02 -1.26 -1.55 119.74 127.00 1ilo s LYS 3 Ca 0.45 1.09 -0.02 0.00 0.02 0.00 0.00 55.97 57.52 1ilo s LYS 3 Cb -0.10 -4.18 -0.00 0.00 -0.52 0.00 0.00 37.83 33.03 1ilo s LYS 3 CO 0.22 -1.93 -0.11 0.42 -0.92 0.00 0.00 175.35 173.03 1ilo s ILE 4 N 6.82 2.94 -0.13 2.17 1.01 -0.62 -1.06 121.20 132.33 1ilo s ILE 4 Ca 0.71 -0.66 -0.02 0.00 0.00 0.00 0.00 60.65 60.68 1ilo s ILE 4 Cb -0.18 -2.29 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 1ilo s ILE 4 CO 0.31 0.48 -0.04 -1.10 0.00 0.00 0.00 174.94 174.59 1ilo s GLN 5 N 1.13 3.36 -0.31 2.79 1.11 -0.10 -1.83 119.66 125.82 1ilo s GLN 5 Ca 0.01 -0.51 -0.01 0.00 0.01 0.00 0.00 55.36 54.85 1ilo s GLN 5 Cb -0.14 -2.82 0.06 0.00 -1.01 0.00 0.00 33.01 29.09 1ilo s GLN 5 CO -0.03 0.40 0.01 0.42 0.01 0.00 0.00 175.29 176.10 1ilo s ILE 6 N -0.09 2.94 -0.36 1.08 1.01 -1.11 -2.21 121.20 122.46 1ilo s ILE 6 Ca 0.02 -1.48 -0.16 0.00 0.00 0.00 0.00 60.65 59.03 1ilo s ILE 6 Cb -0.13 -2.73 -0.00 0.00 0.01 0.00 0.00 42.46 39.60 1ilo s ILE 6 CO 0.03 -0.16 0.42 -0.31 0.00 0.00 0.00 174.94 174.92 1ilo s TYR 7 N 1.23 3.19 0.00 3.97 1.51 0.33 -2.05 117.35 125.53 1ilo s TYR 7 Ca -0.04 -0.05 0.00 0.00 -1.01 0.00 0.00 57.07 55.97 1ilo s TYR 7 Cb -0.20 -2.80 0.00 0.00 -0.11 0.00 0.00 41.96 38.85 1ilo s TYR 7 CO -0.02 -0.53 0.00 0.41 -1.11 0.00 0.00 175.55 174.30 1ilo n GLY 8 N 4.95 -0.64 2.98 0.71 0.00 -1.26 -2.58 105.19 109.36 1ilo n GLY 8 Ca -0.07 0.24 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1ilo n GLY 8 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ilo n THR 9 N 0.00 -9.58 0.00 2.61 -1.04 -1.26 -4.45 114.28 100.56 1ilo n THR 9 Ca 0.00 -0.31 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 1ilo n THR 9 Cb 0.00 -6.71 0.00 0.00 -1.82 0.00 0.00 70.33 61.80 1ilo n THR 9 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ilo n GLY 10 N -1.69 1.72 0.11 3.41 0.00 -1.26 -4.48 105.19 103.00 1ilo n GLY 10 Ca -0.01 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 45.82 1ilo n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ilo s ALA 12 N -3.31 3.42 -1.21 0.00 0.00 -1.26 -4.91 121.76 114.49 1ilo s ALA 12 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.88 1ilo s ALA 12 Cb 0.10 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.45 1ilo s ALA 12 CO 0.80 -0.05 0.49 0.09 0.00 0.00 0.00 175.76 177.10 1ilo n ASN 13 N 3.73 0.65 0.23 0.00 3.02 -1.26 -4.06 115.26 117.56 1ilo n ASN 13 Ca -0.05 -1.64 0.18 0.00 -0.03 0.00 0.00 54.58 53.05 1ilo n ASN 13 Cb 0.51 -0.32 0.84 0.00 -0.61 0.00 0.00 39.78 40.20 1ilo n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ilo h GLN 15 N 0.00 0.33 0.73 0.00 3.07 -1.99 0.27 115.11 117.52 1ilo h GLN 15 Ca 0.08 -0.02 -0.04 0.00 0.09 0.00 0.00 58.65 58.77 1ilo h GLN 15 Cb 0.68 -0.07 0.01 0.00 0.08 0.00 0.00 27.48 28.18 1ilo h GLN 15 CO -0.00 0.22 -0.35 1.98 0.09 0.00 0.00 178.83 180.77 1ilo h MET 16 N 0.34 -0.94 0.00 0.06 4.05 -1.57 -2.86 114.93 114.02 1ilo h MET 16 Ca 0.42 0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.87 1ilo h MET 16 Cb 1.11 0.21 -0.00 0.00 -0.80 0.00 0.00 31.60 32.12 1ilo h MET 16 CO -0.13 -0.61 -0.13 1.25 0.23 0.00 0.00 176.91 177.52 1ilo h LEU 17 N -1.20 0.00 -0.22 3.39 7.12 -1.60 -2.72 115.31 120.09 1ilo h LEU 17 Ca -0.10 0.00 0.03 0.00 0.13 0.00 0.00 57.88 57.94 1ilo h LEU 17 Cb 0.77 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.87 1ilo h LEU 17 CO 0.16 0.13 0.04 -0.08 -0.13 0.00 0.00 178.44 178.57 1ilo h GLU 18 N 0.00 0.12 -0.10 1.25 4.81 -0.32 0.46 114.58 120.81 1ilo h GLU 18 Ca -0.00 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1ilo h GLU 18 Cb 0.33 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1ilo h GLU 18 CO 0.02 0.08 -0.07 -0.22 -0.73 0.00 0.00 179.01 178.09 1ilo h LYS 19 N 0.13 0.21 -0.64 1.92 3.64 -1.27 -2.72 116.57 117.84 1ilo h LYS 19 Ca 0.10 -0.10 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1ilo h LYS 19 Cb 0.09 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 1ilo h LYS 19 CO -0.13 0.60 0.41 -0.91 -2.27 0.00 0.00 179.45 177.15 1ilo h ASN 20 N -0.17 0.69 -0.75 4.20 2.35 -1.32 -2.50 115.58 118.07 1ilo h ASN 20 Ca 0.02 -0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.79 1ilo h ASN 20 Cb 0.55 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.72 1ilo h ASN 20 CO 0.02 0.49 0.48 0.00 -1.65 0.00 0.00 177.43 176.76 1ilo h ALA 21 N 1.26 0.98 -0.51 -0.83 0.00 -0.08 0.31 119.26 120.39 1ilo h ALA 21 Ca 0.25 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1ilo h ALA 21 Cb -0.03 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 1ilo h ALA 21 CO -0.08 0.29 0.27 0.00 0.00 0.00 0.00 179.25 179.73 1ilo h ARG 22 N 0.95 0.51 -0.02 0.00 3.08 -1.12 0.49 114.38 118.27 1ilo h ARG 22 Ca 0.30 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 1ilo h ARG 22 Cb -0.01 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.92 1ilo h ARG 22 CO -0.10 0.34 -0.04 1.05 -1.07 0.00 0.00 179.97 180.15 1ilo h GLU 23 N 0.53 0.06 0.04 0.04 4.11 -1.24 -2.81 114.58 115.31 1ilo h GLU 23 Ca 0.22 -0.04 -0.00 0.00 0.07 0.00 0.00 59.36 59.61 1ilo h GLU 23 Cb 0.10 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1ilo h GLU 23 CO -0.14 0.64 -0.02 0.00 0.07 0.00 0.00 179.01 179.56 1ilo h ALA 24 N 0.42 -0.05 0.03 1.06 0.00 -0.82 0.98 119.26 120.88 1ilo h ALA 24 Ca -0.00 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1ilo h ALA 24 Cb 0.64 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1ilo h ALA 24 CO 0.01 -0.47 -0.29 -0.24 0.00 0.00 0.00 179.25 178.26 1ilo h VAL 25 N -0.17 0.35 -0.15 0.00 3.04 -0.13 0.82 116.25 120.01 1ilo h VAL 25 Ca -0.01 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.65 1ilo h VAL 25 Cb 0.15 0.35 -0.00 0.00 -2.01 0.00 0.00 31.29 29.78 1ilo h VAL 25 CO 0.01 0.00 -0.04 0.11 -1.01 0.00 0.00 177.57 176.64 1ilo h LYS 26 N -0.46 0.29 -0.67 4.17 1.57 -1.16 -2.92 116.57 117.38 1ilo h LYS 26 Ca 0.06 -0.11 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1ilo h LYS 26 Cb 0.53 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.77 1ilo h LYS 26 CO -0.23 0.58 0.38 1.49 -0.57 0.00 0.00 179.45 181.10 1ilo h GLU 27 N -0.02 0.70 -0.07 3.15 4.81 0.13 0.03 114.58 123.31 1ilo h GLU 27 Ca 0.04 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1ilo h GLU 27 Cb 0.47 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1ilo h GLU 27 CO 0.02 0.46 0.40 1.25 -0.73 0.00 0.00 179.01 180.40 1ilo h LEU 28 N 0.72 0.00 0.00 1.64 7.12 0.68 -3.43 115.31 122.04 1ilo h LEU 28 Ca 0.30 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.31 1ilo h LEU 28 Cb 0.16 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.29 1ilo h LEU 28 CO -0.17 0.00 0.00 0.61 -0.13 0.00 0.00 178.44 178.75 1ilo n GLY 29 N -1.28 1.38 3.32 3.75 0.00 -0.04 -5.10 105.19 107.22 1ilo n GLY 29 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.04 1ilo n GLY 29 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ilo s ILE 30 N -2.00 -0.48 0.98 -0.61 -4.36 -0.97 -5.04 121.20 108.73 1ilo s ILE 30 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 60.65 60.28 1ilo s ILE 30 Cb 0.00 -1.00 0.18 0.00 1.25 0.00 0.00 42.46 42.89 1ilo s ILE 30 CO 0.00 0.00 1.10 -0.62 0.24 0.00 0.00 174.94 175.66 1ilo s ASP 31 N 2.58 2.45 0.17 4.36 2.15 -1.26 -2.22 116.67 124.89 1ilo s ASP 31 Ca -0.01 1.87 -0.11 0.00 0.43 0.00 0.00 52.55 54.73 1ilo s ASP 31 Cb -0.07 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.11 1ilo s ASP 31 CO -0.16 -3.34 0.33 0.00 -0.17 0.00 0.00 175.17 171.83 1ilo s ALA 32 N -2.64 -0.24 -0.22 3.66 0.00 -1.26 0.22 121.76 121.28 1ilo s ALA 32 Ca 0.66 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.94 1ilo s ALA 32 Cb -0.23 0.83 0.05 0.00 0.00 0.00 0.00 23.12 23.77 1ilo s ALA 32 CO 0.60 -0.67 -0.12 -1.21 0.00 0.00 0.00 175.76 174.36 1ilo s GLU 33 N -3.94 2.23 -0.42 0.00 2.02 -0.60 -4.75 118.70 113.25 1ilo s GLU 33 Ca 0.14 -1.06 -0.16 0.00 0.02 0.00 0.00 54.97 53.91 1ilo s GLU 33 Cb 0.02 -2.65 0.03 0.00 0.10 0.00 0.00 34.13 31.63 1ilo s GLU 33 CO -0.02 -0.47 0.36 -0.06 0.02 0.00 0.00 175.26 175.09 1ilo s PHE 34 N 1.26 3.22 -0.18 1.61 0.40 -1.26 -1.58 117.98 121.44 1ilo s PHE 34 Ca -0.04 -0.56 -0.01 0.00 -0.60 0.00 0.00 56.93 55.72 1ilo s PHE 34 Cb -0.17 -2.76 0.00 0.00 0.51 0.00 0.00 43.02 40.60 1ilo s PHE 34 CO -0.07 -0.65 -0.13 -1.21 0.70 0.00 0.00 175.22 173.85 1ilo s GLU 35 N 1.83 3.23 0.25 0.44 2.02 -0.76 -5.02 118.70 120.69 1ilo s GLU 35 Ca 0.07 -0.72 -0.21 0.00 0.02 0.00 0.00 54.97 54.13 1ilo s GLU 35 Cb -0.19 -2.73 -0.09 0.00 0.10 0.00 0.00 34.13 31.22 1ilo s GLU 35 CO 0.11 -0.08 0.77 0.15 0.02 0.00 0.00 175.26 176.23 1ilo s LYS 36 N 1.09 4.30 -0.07 1.61 1.02 -1.26 -2.76 119.74 123.67 1ilo s LYS 36 Ca 0.00 0.96 0.03 0.00 0.02 0.00 0.00 55.97 56.98 1ilo s LYS 36 Cb -0.14 -2.82 -0.02 0.00 -0.52 0.00 0.00 37.83 34.32 1ilo s LYS 36 CO -0.04 0.35 -0.16 0.96 -0.92 0.00 0.00 175.35 175.55 1ilo s ILE 37 N -1.58 2.91 -0.61 2.17 -0.00 -0.87 -4.92 121.20 118.30 1ilo s ILE 37 Ca 0.46 -0.76 0.06 0.00 -0.00 0.00 0.00 60.65 60.40 1ilo s ILE 37 Cb -0.16 -2.15 0.21 0.00 -0.00 0.00 0.00 42.46 40.35 1ilo s ILE 37 CO 0.21 0.57 0.57 2.29 -0.00 0.00 0.00 174.94 178.58 1ilo n LYS 38 N 2.73 1.76 0.00 0.37 2.85 -1.26 -4.15 118.16 120.47 1ilo n LYS 38 Ca -0.17 -4.26 0.00 0.00 -1.05 0.00 0.00 58.31 52.83 1ilo n LYS 38 Cb 0.52 -2.08 0.00 0.00 -0.65 0.00 0.00 35.03 32.82 1ilo n LYS 38 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1ilo n GLU 39 N 1.60 0.00 0.17 -1.58 1.02 -1.26 -5.00 120.64 115.59 1ilo n GLU 39 Ca 0.25 0.00 0.17 0.00 -0.02 0.00 0.00 57.16 57.56 1ilo n GLU 39 Cb 0.41 0.00 0.79 0.00 -0.02 0.00 0.00 31.44 32.62 1ilo n GLU 39 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ilo h MET 40 N 0.00 0.00 -0.99 3.49 -0.00 -1.96 0.13 114.93 115.60 1ilo h MET 40 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 59.70 59.89 1ilo h MET 40 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 31.60 31.50 1ilo h MET 40 CO 0.00 0.00 0.61 -0.44 -0.00 0.00 0.00 176.91 177.08 1ilo h ASP 41 N 0.00 0.70 0.41 -0.10 3.32 -1.99 0.95 116.42 119.72 1ilo h ASP 41 Ca 0.12 0.08 -0.31 0.00 0.02 0.00 0.00 57.03 56.94 1ilo h ASP 41 Cb 0.60 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 1ilo h ASP 41 CO -0.00 0.26 -1.66 1.56 -1.72 0.00 0.00 179.24 177.67 1ilo h GLN 42 N 0.69 0.18 0.24 3.56 1.08 -1.18 -3.16 115.11 116.52 1ilo h GLN 42 Ca 0.55 -0.30 -0.01 0.00 -1.45 0.00 0.00 58.65 57.44 1ilo h GLN 42 Cb 0.96 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.51 1ilo h GLN 42 CO -0.33 0.97 -0.12 0.82 -0.95 0.00 0.00 178.83 179.22 1ilo h ILE 43 N 0.05 0.80 -0.55 2.54 2.04 0.19 -2.80 117.51 119.78 1ilo h ILE 43 Ca -0.29 -0.26 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 1ilo h ILE 43 Cb 2.01 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 39.02 1ilo h ILE 43 CO 0.12 0.06 0.16 0.17 0.00 0.00 0.00 178.15 178.66 1ilo h LEU 44 N -0.46 0.76 -2.25 1.44 -0.00 0.64 -1.39 115.31 114.05 1ilo h LEU 44 Ca -0.03 -0.12 0.05 0.00 -0.00 0.00 0.00 57.88 57.77 1ilo h LEU 44 Cb 0.35 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 40.80 1ilo h LEU 44 CO 0.06 0.73 0.18 -0.08 -0.00 0.00 0.00 178.44 179.32 1ilo h GLU 45 N 0.80 0.00 -0.06 0.17 4.81 -1.48 0.18 114.58 119.00 1ilo h GLU 45 Ca 0.18 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.18 1ilo h GLU 45 Cb 0.26 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.64 1ilo h GLU 45 CO -0.01 0.00 -0.88 0.00 -0.73 0.00 0.00 179.01 177.39 1ilo h ALA 46 N 1.79 0.32 0.00 2.92 0.00 -0.99 -3.48 119.26 119.83 1ilo h ALA 46 Ca 0.08 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1ilo h ALA 46 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1ilo h ALA 46 CO -0.00 0.73 0.00 0.41 0.00 0.00 0.00 179.25 180.39 1ilo n GLY 47 N 0.84 0.81 3.81 0.00 0.00 0.64 -4.69 105.19 106.60 1ilo n GLY 47 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 1ilo n GLY 47 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ilo s LEU 48 N 0.00 3.09 -0.01 0.99 -0.00 -1.25 -4.97 118.68 116.54 1ilo s LEU 48 Ca 0.00 1.64 0.05 0.00 -0.00 0.00 0.00 54.13 55.82 1ilo s LEU 48 Cb 0.00 -4.48 -0.07 0.00 -0.00 0.00 0.00 46.19 41.64 1ilo s LEU 48 CO 0.00 -1.58 0.13 0.35 -0.00 0.00 0.00 176.35 175.25 1ilo n THR 49 N -3.22 0.00 -2.75 5.48 -2.24 -1.26 -4.76 114.28 105.53 1ilo n THR 49 Ca 0.08 -0.18 -0.06 0.00 -2.27 0.00 0.00 64.05 61.62 1ilo n THR 49 Cb 0.54 0.54 0.02 0.00 -2.10 0.00 0.00 70.33 69.33 1ilo n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ilo n ALA 50 N -1.53 0.23 -0.04 6.98 0.00 -1.26 -5.01 120.51 119.88 1ilo n ALA 50 Ca -0.00 -0.57 -0.03 0.00 0.00 0.00 0.00 53.44 52.84 1ilo n ALA 50 Cb 0.11 0.13 -0.01 0.00 0.00 0.00 0.00 19.45 19.69 1ilo n ALA 50 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ilo h LEU 51 N 0.00 0.00 -5.58 0.00 4.07 -1.92 -3.41 115.31 108.47 1ilo h LEU 51 Ca -0.08 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.62 1ilo h LEU 51 Cb 0.35 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.10 1ilo h LEU 51 CO 0.10 0.46 2.05 -2.65 -1.08 0.00 0.00 178.44 177.33 1ilo n PRO 52 N -3.76 1.42 -3.17 1.13 -0.02 -1.24 -4.17 135.00 125.20 1ilo n PRO 52 Ca -0.04 -1.14 -0.36 0.00 -2.02 0.00 0.00 63.50 59.94 1ilo n PRO 52 Cb 0.15 -2.29 -0.06 0.00 -0.02 0.00 0.00 33.50 31.28 1ilo n PRO 52 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1ilo s GLY 53 N 3.86 2.58 -0.19 -1.23 0.00 -1.07 -3.61 107.32 107.66 1ilo s GLY 53 Ca 0.27 0.09 -0.04 0.00 0.00 0.00 0.00 44.72 45.05 1ilo s GLY 53 CO -0.02 0.43 0.06 -2.27 0.00 0.00 0.00 173.10 171.30 1ilo s LEU 54 N -1.94 0.88 -0.23 0.66 2.96 -0.46 -0.51 118.68 120.03 1ilo s LEU 54 Ca 0.41 -0.79 -0.10 0.00 -0.22 0.00 0.00 54.13 53.43 1ilo s LEU 54 Cb -0.16 -0.46 -0.05 0.00 0.50 0.00 0.00 46.19 46.02 1ilo s LEU 54 CO 0.20 -0.33 0.14 0.00 -1.32 0.00 0.00 176.35 175.04 1ilo s ALA 55 N 1.96 3.54 -0.04 5.97 0.00 -0.94 -2.51 121.76 129.75 1ilo s ALA 55 Ca 0.01 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.13 1ilo s ALA 55 Cb -0.17 -2.25 -0.02 0.00 0.00 0.00 0.00 23.12 20.68 1ilo s ALA 55 CO -0.10 -0.18 -0.20 0.14 0.00 0.00 0.00 175.76 175.43 1ilo s VAL 56 N 1.03 2.60 -0.68 0.00 -7.23 -1.02 -0.92 120.40 114.17 1ilo s VAL 56 Ca 0.07 -0.89 0.00 0.00 -1.81 0.00 0.00 61.98 59.34 1ilo s VAL 56 Cb -0.14 -1.98 0.00 0.00 0.56 0.00 0.00 36.38 34.83 1ilo s VAL 56 CO 0.04 0.58 0.00 0.47 -0.31 0.00 0.00 175.10 175.88 1ilo n ASP 57 N 2.47 -2.53 -0.46 4.85 8.00 -0.22 0.11 116.55 128.77 1ilo n ASP 57 Ca -0.17 0.28 -0.03 0.00 0.71 0.00 0.00 54.79 55.58 1ilo n ASP 57 Cb 0.52 -2.30 0.00 0.00 -0.02 0.00 0.00 41.12 39.32 1ilo n ASP 57 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ilo n GLY 58 N -0.52 0.41 2.73 0.44 0.00 -1.26 -5.03 105.19 101.95 1ilo n GLY 58 Ca -0.08 -0.72 -0.19 0.00 0.00 0.00 0.00 46.02 45.03 1ilo n GLY 58 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ilo s GLU 59 N -4.43 0.28 0.23 1.61 2.02 0.30 -5.12 118.70 113.59 1ilo s GLU 59 Ca 0.02 -0.12 -0.32 0.00 0.02 0.00 0.00 54.97 54.58 1ilo s GLU 59 Cb -0.01 -0.84 -0.12 0.00 0.10 0.00 0.00 34.13 33.26 1ilo s GLU 59 CO 0.03 -0.94 1.65 1.28 0.02 0.00 0.00 175.26 177.29 1ilo n LEU 60 N 5.30 3.95 0.00 1.80 7.99 -1.26 -2.44 117.00 132.34 1ilo n LEU 60 Ca -0.03 1.10 0.00 0.00 -0.01 0.00 0.00 56.01 57.06 1ilo n LEU 60 Cb 0.46 -1.55 0.00 0.00 -0.11 0.00 0.00 43.42 42.22 1ilo n LEU 60 CO 0.03 0.07 0.01 0.29 -1.51 0.00 0.00 177.39 176.29 1ilo n LYS 61 N 3.19 2.55 -3.76 3.23 5.02 -1.04 -4.94 118.16 122.41 1ilo n LYS 61 Ca 0.13 -0.03 -0.14 0.00 -2.02 0.00 0.00 58.31 56.26 1ilo n LYS 61 Cb 0.34 -0.28 -0.15 0.00 -0.02 0.00 0.00 35.03 34.93 1ilo n LYS 61 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ilo s ILE 62 N -0.37 -0.05 -0.10 -0.18 1.01 -1.23 -5.01 121.20 115.27 1ilo s ILE 62 Ca 0.00 0.18 -0.06 0.00 0.00 0.00 0.00 60.65 60.78 1ilo s ILE 62 Cb 0.00 -0.17 0.04 0.00 0.01 0.00 0.00 42.46 42.34 1ilo s ILE 62 CO 0.00 0.07 0.25 -0.04 0.00 0.00 0.00 174.94 175.22 1ilo s MET 63 N 1.05 0.22 0.00 2.79 -1.94 -1.26 -1.36 119.30 118.80 1ilo s MET 63 Ca -0.08 0.51 0.00 0.00 -1.71 0.00 0.00 55.69 54.41 1ilo s MET 63 Cb -0.11 -0.09 0.00 0.00 2.01 0.00 0.00 34.83 36.63 1ilo s MET 63 CO -0.04 -0.15 0.00 0.41 -0.01 0.00 0.00 175.02 175.23 1ilo n GLY 64 N 4.10 1.38 3.15 -0.03 0.00 -1.24 -4.86 105.19 107.70 1ilo n GLY 64 Ca -0.24 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.84 1ilo n GLY 64 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ilo s ARG 65 N -0.09 0.08 0.60 1.61 3.52 -1.26 -4.82 118.95 118.59 1ilo s ARG 65 Ca 0.00 0.09 -0.19 0.00 -0.13 0.00 0.00 55.73 55.49 1ilo s ARG 65 Cb 0.00 0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.40 1ilo s ARG 65 CO 0.00 -0.14 1.19 1.55 -0.81 0.00 0.00 175.30 177.09 1ilo n VAL 66 N 5.14 4.13 -1.58 7.11 3.14 -1.26 -4.93 118.33 130.08 1ilo n VAL 66 Ca 0.07 -0.50 -0.29 0.00 -2.96 0.00 0.00 64.34 60.65 1ilo n VAL 66 Cb 0.58 -1.41 0.11 0.00 -1.06 0.00 0.00 33.84 32.05 1ilo n VAL 66 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ilo s ALA 67 N -1.40 2.09 0.49 1.55 0.00 -1.26 -4.94 121.76 118.30 1ilo s ALA 67 Ca 0.77 -0.38 0.05 0.00 0.00 0.00 0.00 51.96 52.40 1ilo s ALA 67 Cb -0.41 -3.06 0.03 0.00 0.00 0.00 0.00 23.12 19.68 1ilo s ALA 67 CO 0.46 -1.95 0.67 -1.12 0.00 0.00 0.00 175.76 173.82 1ilo s SER 68 N -4.02 5.44 0.17 0.00 0.01 -1.26 -4.33 113.70 109.70 1ilo s SER 68 Ca 0.62 -0.29 -0.15 0.00 1.31 0.00 0.00 55.95 57.44 1ilo s SER 68 Cb -0.14 -0.66 0.09 0.00 0.21 0.00 0.00 66.02 65.51 1ilo s SER 68 CO 0.53 -0.97 1.78 0.07 0.41 0.00 0.00 173.24 175.06 1ilo h LYS 69 N 0.36 0.41 -0.35 12.44 2.10 -1.95 -0.71 116.57 128.87 1ilo h LYS 69 Ca -0.40 -0.02 -0.06 0.00 -2.00 0.00 0.00 60.65 58.16 1ilo h LYS 69 Cb 1.29 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 32.51 1ilo h LYS 69 CO 0.47 0.27 -0.04 1.49 -2.00 0.00 0.00 179.45 179.65 1ilo h GLU 70 N 0.42 0.57 -0.30 0.07 4.81 -1.99 -2.05 114.58 116.12 1ilo h GLU 70 Ca 0.19 -0.14 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 1ilo h GLU 70 Cb 0.11 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 1ilo h GLU 70 CO -0.14 0.62 -0.01 0.93 -0.73 0.00 0.00 179.01 179.68 1ilo h GLU 71 N 0.54 0.53 0.05 1.92 3.07 -1.73 -1.22 114.58 117.74 1ilo h GLU 71 Ca 0.11 -0.18 -0.00 0.00 -0.50 0.00 0.00 59.36 58.79 1ilo h GLU 71 Cb 0.40 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1ilo h GLU 71 CO 0.02 0.69 -0.02 0.82 -1.40 0.00 0.00 179.01 179.11 1ilo h ILE 72 N 0.32 1.03 -0.54 3.13 1.08 -0.93 -0.14 117.51 121.46 1ilo h ILE 72 Ca 0.08 -0.25 0.02 0.00 -0.39 0.00 0.00 64.86 64.33 1ilo h ILE 72 Cb 0.45 1.19 -0.03 0.00 -3.07 0.00 0.00 36.82 35.37 1ilo h ILE 72 CO 0.02 0.06 0.36 0.50 -0.69 0.00 0.00 178.15 178.40 1ilo h LYS 73 N -0.18 0.64 -0.08 2.37 3.64 -1.36 0.11 116.57 121.72 1ilo h LYS 73 Ca -0.01 -0.04 -0.15 0.00 -1.27 0.00 0.00 60.65 59.19 1ilo h LYS 73 Cb 0.15 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1ilo h LYS 73 CO 0.01 0.43 -0.59 -0.22 -2.27 0.00 0.00 179.45 176.80 1ilo h LYS 74 N 0.66 0.27 0.01 1.90 3.64 -0.81 0.67 116.57 122.91 1ilo h LYS 74 Ca 0.21 -0.18 -0.22 0.00 -1.27 0.00 0.00 60.65 59.19 1ilo h LYS 74 Cb 0.03 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1ilo h LYS 74 CO -0.05 0.79 -0.93 0.82 -2.27 0.00 0.00 179.45 177.80 1ilo h ILE 75 N 0.20 1.45 0.11 2.00 2.04 0.14 -3.26 117.51 120.20 1ilo h ILE 75 Ca -0.00 -2.58 -0.27 0.00 1.00 0.00 0.00 64.86 63.01 1ilo h ILE 75 Cb 1.10 2.48 0.01 0.00 -0.74 0.00 0.00 36.82 39.67 1ilo h ILE 75 CO 0.09 0.76 -1.20 -0.07 0.00 0.00 0.00 178.15 177.73 1ilo h LEU 76 N 0.16 0.48 -1.84 1.44 3.38 -0.72 -3.51 115.31 114.71 1ilo h LEU 76 Ca -0.07 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1ilo h LEU 76 Cb 1.57 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.17 1ilo h LEU 76 CO 0.15 1.36 0.00 -1.54 0.09 0.00 0.00 178.44 178.50