#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 3.85 -0.09 2.12 1.00 0.10 -4.71 119.30 121.57 1ilo s MET 2 Ca 0.00 0.71 -0.30 0.00 0.00 0.00 0.00 55.69 56.11 1ilo s MET 2 Cb 0.00 -3.83 -0.04 0.00 0.00 0.00 0.00 34.83 30.96 1ilo s MET 2 CO 0.00 -1.13 1.53 0.15 0.00 0.00 0.00 175.02 175.57 1ilo s LYS 3 N 3.95 4.20 -0.09 2.03 1.02 -1.26 -1.35 119.74 128.24 1ilo s LYS 3 Ca 0.45 2.03 0.01 0.00 0.02 0.00 0.00 55.97 58.47 1ilo s LYS 3 Cb -0.10 -3.91 0.02 0.00 -0.52 0.00 0.00 37.83 33.32 1ilo s LYS 3 CO 0.23 -0.80 -0.10 0.42 -0.92 0.00 0.00 175.35 174.19 1ilo s ILE 4 N 3.83 1.08 -0.03 2.17 1.09 -0.16 0.43 121.20 129.62 1ilo s ILE 4 Ca 0.68 -0.38 0.02 0.00 -1.10 0.00 0.00 60.65 59.86 1ilo s ILE 4 Cb -0.30 -1.05 -0.03 0.00 -1.06 0.00 0.00 42.46 40.02 1ilo s ILE 4 CO 0.25 0.36 -0.08 -1.10 -0.10 0.00 0.00 174.94 174.27 1ilo s GLN 5 N 1.20 2.62 -0.18 2.79 -1.52 0.10 -1.46 119.66 123.23 1ilo s GLN 5 Ca -0.04 -0.65 -0.01 0.00 -1.95 0.00 0.00 55.36 52.71 1ilo s GLN 5 Cb -0.14 -2.52 0.05 0.00 -0.22 0.00 0.00 33.01 30.17 1ilo s GLN 5 CO -0.03 0.63 -0.03 0.96 -0.25 0.00 0.00 175.29 176.58 1ilo s ILE 6 N -0.89 0.99 -0.37 1.08 -0.00 -1.13 -2.06 121.20 118.82 1ilo s ILE 6 Ca 0.14 -0.66 -0.13 0.00 -0.00 0.00 0.00 60.65 60.00 1ilo s ILE 6 Cb -0.11 -1.26 0.00 0.00 -0.00 0.00 0.00 42.46 41.09 1ilo s ILE 6 CO 0.04 0.02 0.26 -0.31 -0.00 0.00 0.00 174.94 174.95 1ilo s TYR 7 N 1.67 3.23 0.00 1.37 1.51 -0.19 -2.85 117.35 122.09 1ilo s TYR 7 Ca -0.00 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1ilo s TYR 7 Cb -0.16 -2.51 0.00 0.00 -0.11 0.00 0.00 41.96 39.18 1ilo s TYR 7 CO -0.07 -0.47 0.00 0.41 -1.11 0.00 0.00 175.55 174.31 1ilo n GLY 8 N 5.11 -1.49 2.52 0.71 0.00 -1.26 -2.86 105.19 107.92 1ilo n GLY 8 Ca -0.12 0.66 -0.04 0.00 0.00 0.00 0.00 46.02 46.52 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 0.00-13.25 0.00 2.61 -1.04 -1.25 -4.60 114.28 96.75 1ilo n THR 9 Ca 0.00 2.97 0.00 0.00 -2.04 0.00 0.00 64.05 64.98 1ilo n THR 9 Cb 0.00 -6.44 0.00 0.00 -1.82 0.00 0.00 70.33 62.07 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 1.78 2.05 1.61 3.41 0.00 -1.26 -4.74 105.19 108.03 1ilo n GLY 10 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.85 3.42 -1.03 0.00 0.00 -1.26 -4.90 121.76 116.14 1ilo s ALA 12 Ca 0.00 0.90 0.00 0.00 0.00 0.00 0.00 51.96 52.86 1ilo s ALA 12 Cb 0.00 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1ilo s ALA 12 CO 0.00 -0.39 0.43 0.09 0.00 0.00 0.00 175.76 175.88 1ilo n ASN 13 N 3.18 0.81 0.25 0.00 3.02 -1.26 -3.96 115.26 117.29 1ilo n ASN 13 Ca 0.07 -1.66 0.18 0.00 -0.03 0.00 0.00 54.58 53.14 1ilo n ASN 13 Cb 0.45 -0.40 0.88 0.00 -0.61 0.00 0.00 39.78 40.10 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 0.50 0.62 0.00 -0.00 -1.98 0.11 115.11 114.36 1ilo h GLN 15 Ca 0.06 -0.03 -0.03 0.00 -0.00 0.00 0.00 58.65 58.65 1ilo h GLN 15 Cb 0.56 -0.11 0.01 0.00 0.00 0.00 0.00 27.48 27.94 1ilo h GLN 15 CO -0.00 0.34 -0.30 1.98 0.00 0.00 0.00 178.83 180.85 1ilo h MET 16 N 0.51 -0.80 -0.30 1.69 4.05 -1.44 -2.74 114.93 115.90 1ilo h MET 16 Ca 0.14 0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.60 1ilo h MET 16 Cb -0.04 0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 30.93 1ilo h MET 16 CO -0.03 -0.54 0.15 1.25 0.23 0.00 0.00 176.91 177.97 1ilo h LEU 17 N -1.02 0.37 -1.02 3.39 7.12 -1.66 -2.01 115.31 120.48 1ilo h LEU 17 Ca -0.09 -0.02 0.08 0.00 0.13 0.00 0.00 57.88 57.98 1ilo h LEU 17 Cb 0.64 -0.09 -0.07 0.00 -0.53 0.00 0.00 40.66 40.61 1ilo h LEU 17 CO 0.14 0.32 0.64 -0.08 -0.13 0.00 0.00 178.44 179.33 1ilo h GLU 18 N 0.42 1.08 0.08 1.25 4.22 -0.73 0.56 114.58 121.45 1ilo h GLU 18 Ca 0.11 -0.06 -0.00 0.00 0.08 0.00 0.00 59.36 59.48 1ilo h GLU 18 Cb 0.04 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.05 1ilo h GLU 18 CO -0.02 0.71 -0.04 -0.22 -2.18 0.00 0.00 179.01 177.27 1ilo h LYS 19 N 1.11 -0.10 -0.30 1.92 3.64 -1.06 -2.82 116.57 118.96 1ilo h LYS 19 Ca 0.45 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.78 1ilo h LYS 19 Cb 0.27 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1ilo h LYS 19 CO -0.20 0.44 -0.04 -2.95 -2.27 0.00 0.00 179.45 174.44 1ilo h ASN 20 N -0.78 0.44 -0.06 4.20 7.08 -1.30 -2.87 115.58 122.29 1ilo h ASN 20 Ca -0.01 -0.09 -0.00 0.00 -3.08 0.00 0.00 56.30 53.12 1ilo h ASN 20 Cb 0.60 -0.12 -0.00 0.00 -2.08 0.00 0.00 38.32 36.72 1ilo h ASN 20 CO 0.02 0.54 0.03 0.00 -2.08 0.00 0.00 177.43 175.94 1ilo h ALA 21 N 1.52 0.08 -0.96 4.14 0.00 0.05 -0.10 119.26 123.99 1ilo h ALA 21 Ca 0.09 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1ilo h ALA 21 Cb 0.36 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.04 1ilo h ALA 21 CO 0.01 -0.37 0.61 0.00 0.00 0.00 0.00 179.25 179.51 1ilo h ARG 22 N -0.01 0.89 0.01 0.00 3.08 -1.28 0.39 114.38 117.47 1ilo h ARG 22 Ca 0.02 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1ilo h ARG 22 Cb 0.10 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1ilo h ARG 22 CO -0.00 0.59 -0.01 1.49 -1.07 0.00 0.00 179.97 180.97 1ilo h GLU 23 N 0.91 -0.01 0.05 0.04 4.57 -1.33 -2.74 114.58 116.07 1ilo h GLU 23 Ca 0.47 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.65 1ilo h GLU 23 Cb 0.52 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 1ilo h GLU 23 CO -0.24 0.58 -0.02 0.00 -1.18 0.00 0.00 179.01 178.16 1ilo h ALA 24 N 0.35 -0.06 0.08 2.92 0.00 -0.58 0.78 119.26 122.75 1ilo h ALA 24 Ca -0.00 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ilo h ALA 24 Cb 0.60 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1ilo h ALA 24 CO 0.00 -0.47 -0.34 -0.24 0.00 0.00 0.00 179.25 178.20 1ilo h VAL 25 N -0.18 0.28 -0.05 0.00 3.04 -0.34 0.96 116.25 119.96 1ilo h VAL 25 Ca -0.01 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.68 1ilo h VAL 25 Cb 0.16 0.28 -0.00 0.00 -2.01 0.00 0.00 31.29 29.73 1ilo h VAL 25 CO 0.01 0.00 0.01 0.11 -1.01 0.00 0.00 177.57 176.69 1ilo h LYS 26 N -0.54 0.08 -0.44 4.17 1.57 -1.12 -2.47 116.57 117.83 1ilo h LYS 26 Ca 0.04 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1ilo h LYS 26 Cb 0.59 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.84 1ilo h LYS 26 CO -0.23 0.26 0.14 1.49 -0.57 0.00 0.00 179.45 180.55 1ilo h GLU 27 N -0.12 0.30 -0.19 3.15 4.81 0.89 0.18 114.58 123.59 1ilo h GLU 27 Ca 0.02 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1ilo h GLU 27 Cb 0.22 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1ilo h GLU 27 CO -0.00 0.20 0.46 -0.07 -0.73 0.00 0.00 179.01 178.87 1ilo h LEU 28 N 0.31 0.00 0.00 1.64 -0.00 0.10 -3.43 115.31 113.92 1ilo h LEU 28 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 1ilo h LEU 28 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.87 1ilo h LEU 28 CO -0.22 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 178.83 1ilo n GLY 29 N -1.36 1.39 3.23 0.83 0.00 0.02 -5.09 105.19 104.20 1ilo n GLY 29 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.57 1.03 -0.61 -4.36 -0.94 -5.03 121.20 108.72 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 0.21 0.00 1.25 0.00 0.00 42.46 42.92 1ilo s ILE 30 CO 0.00 0.00 1.09 -0.62 0.24 0.00 0.00 174.94 175.65 1ilo s ASP 31 N 2.81 2.05 0.26 4.36 2.15 -1.26 -2.20 116.67 124.84 1ilo s ASP 31 Ca 0.04 1.83 -0.08 0.00 0.43 0.00 0.00 52.55 54.77 1ilo s ASP 31 Cb -0.11 -2.42 -0.01 0.00 -0.30 0.00 0.00 42.92 40.08 1ilo s ASP 31 CO -0.15 -3.59 0.41 0.00 -0.17 0.00 0.00 175.17 171.67 1ilo s ALA 32 N -2.58 0.25 -0.22 3.66 0.00 -1.26 0.14 121.76 121.75 1ilo s ALA 32 Ca 0.67 -1.18 -0.00 0.00 0.00 0.00 0.00 51.96 51.45 1ilo s ALA 32 Cb -0.23 1.15 0.06 0.00 0.00 0.00 0.00 23.12 24.10 1ilo s ALA 32 CO 0.61 -0.79 -0.03 -1.21 0.00 0.00 0.00 175.76 174.35 1ilo s GLU 33 N -3.84 1.32 -0.42 0.00 2.02 -0.45 -4.74 118.70 112.59 1ilo s GLU 33 Ca 0.27 -0.80 -0.15 0.00 0.02 0.00 0.00 54.97 54.32 1ilo s GLU 33 Cb 0.01 -2.42 0.03 0.00 0.10 0.00 0.00 34.13 31.85 1ilo s GLU 33 CO 0.12 -0.60 0.31 -0.06 0.02 0.00 0.00 175.26 175.05 1ilo s PHE 34 N 1.55 3.24 -0.21 1.61 0.40 -1.26 -0.99 117.98 122.33 1ilo s PHE 34 Ca -0.04 -0.70 -0.03 0.00 -0.60 0.00 0.00 56.93 55.56 1ilo s PHE 34 Cb -0.18 -2.70 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 1ilo s PHE 34 CO -0.07 -0.64 -0.07 -1.21 0.70 0.00 0.00 175.22 173.93 1ilo s GLU 35 N 1.66 3.33 -0.02 0.44 0.41 -0.53 -5.02 118.70 118.96 1ilo s GLU 35 Ca 0.05 -0.66 -0.13 0.00 -0.41 0.00 0.00 54.97 53.81 1ilo s GLU 35 Cb -0.20 -2.91 -0.05 0.00 -1.78 0.00 0.00 34.13 29.18 1ilo s GLU 35 CO 0.09 -0.16 0.36 0.15 -0.49 0.00 0.00 175.26 175.22 1ilo s LYS 36 N 1.33 3.85 0.56 1.61 3.01 -1.26 -2.83 119.74 126.02 1ilo s LYS 36 Ca 0.04 0.32 0.07 0.00 -1.01 0.00 0.00 55.97 55.38 1ilo s LYS 36 Cb -0.14 -3.22 0.06 0.00 -1.01 0.00 0.00 37.83 33.51 1ilo s LYS 36 CO -0.04 0.69 0.53 0.96 0.51 0.00 0.00 175.35 178.00 1ilo s ILE 37 N -1.01 1.74 -0.48 2.17 -0.00 -1.13 -4.97 121.20 117.51 1ilo s ILE 37 Ca 0.22 -1.35 0.06 0.00 -0.00 0.00 0.00 60.65 59.59 1ilo s ILE 37 Cb -0.16 -2.09 0.21 0.00 -0.00 0.00 0.00 42.46 40.43 1ilo s ILE 37 CO 0.12 0.00 0.72 2.29 -0.00 0.00 0.00 174.94 178.07 1ilo n LYS 38 N -1.93 0.61 0.00 0.37 0.00 -1.26 -4.43 118.16 111.53 1ilo n LYS 38 Ca 0.03 -2.19 0.00 0.00 -0.00 0.00 0.00 58.31 56.16 1ilo n LYS 38 Cb 0.64 -1.46 0.00 0.00 -0.00 0.00 0.00 35.03 34.20 1ilo n LYS 38 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1ilo n GLU 39 N 2.24 0.00 -0.07 -1.58 4.71 -1.26 -5.00 120.64 119.68 1ilo n GLU 39 Ca 0.16 0.00 0.24 0.00 -0.01 0.00 0.00 57.16 57.56 1ilo n GLU 39 Cb 0.57 0.00 0.72 0.00 -1.01 0.00 0.00 31.44 31.72 1ilo n GLU 39 CO 0.00 0.00 0.00 0.52 0.09 0.00 0.00 177.13 177.74 1ilo h MET 40 N 0.00 0.00 -0.97 3.49 2.86 -1.99 0.52 114.93 118.84 1ilo h MET 40 Ca 0.00 0.00 0.19 0.00 -2.06 0.00 0.00 59.70 57.83 1ilo h MET 40 Cb 0.00 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.57 1ilo h MET 40 CO 0.00 0.00 0.61 0.22 1.06 0.00 0.00 176.91 178.80 1ilo h ASP 41 N 0.00 0.67 0.42 1.22 1.82 -1.99 0.94 116.42 119.50 1ilo h ASP 41 Ca 0.33 0.07 -0.31 0.00 -0.39 0.00 0.00 57.03 56.73 1ilo h ASP 41 Cb 1.37 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 41.31 1ilo h ASP 41 CO -0.00 0.26 -1.64 1.56 -1.61 0.00 0.00 179.24 177.81 1ilo h GLN 42 N 0.66 0.18 0.41 0.28 4.20 -0.42 -3.15 115.11 117.27 1ilo h GLN 42 Ca 0.53 -0.31 -0.02 0.00 0.06 0.00 0.00 58.65 58.91 1ilo h GLN 42 Cb 0.95 0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.85 1ilo h GLN 42 CO -0.29 0.98 -0.20 0.82 -0.67 0.00 0.00 178.83 179.47 1ilo h ILE 43 N 0.05 0.59 -0.33 2.54 2.04 0.69 -2.89 117.51 120.20 1ilo h ILE 43 Ca -0.28 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.30 1ilo h ILE 43 Cb 2.01 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 1ilo h ILE 43 CO 0.13 0.05 0.02 0.17 0.00 0.00 0.00 178.15 178.51 1ilo h LEU 44 N -0.69 0.47 -2.55 1.44 -0.00 0.60 -1.52 115.31 113.06 1ilo h LEU 44 Ca -0.06 -0.08 0.01 0.00 -0.00 0.00 0.00 57.88 57.75 1ilo h LEU 44 Cb 0.50 -0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 41.03 1ilo h LEU 44 CO 0.09 0.53 0.06 -0.08 -0.00 0.00 0.00 178.44 179.04 1ilo h GLU 45 N 0.49 0.00 -0.12 0.17 4.22 -1.48 0.84 114.58 118.71 1ilo h GLU 45 Ca 0.11 0.00 -0.19 0.00 0.08 0.00 0.00 59.36 59.36 1ilo h GLU 45 Cb 0.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1ilo h GLU 45 CO 0.01 0.00 -0.71 0.00 -2.18 0.00 0.00 179.01 176.12 1ilo h ALA 46 N 1.92 0.53 0.00 2.92 0.00 -1.07 -3.48 119.26 120.09 1ilo h ALA 46 Ca 0.02 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1ilo h ALA 46 Cb 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.87 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 0.55 1.30 3.77 0.00 0.00 0.29 -4.68 105.19 106.42 1ilo n GLY 47 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 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 3.73 0.05 0.99 -0.00 -1.26 -4.95 118.68 117.25 1ilo s LEU 48 Ca 0.00 2.20 0.22 0.00 -0.00 0.00 0.00 54.13 56.55 1ilo s LEU 48 Cb 0.00 -4.58 -0.20 0.00 -0.00 0.00 0.00 46.19 41.41 1ilo s LEU 48 CO 0.00 -1.27 0.71 0.41 -0.00 0.00 0.00 176.35 176.21 1ilo n THR 49 N -1.35 0.22 -3.07 5.48 -1.04 -1.26 -4.68 114.28 108.57 1ilo n THR 49 Ca 0.12 -0.49 -0.07 0.00 -2.04 0.00 0.00 64.05 61.57 1ilo n THR 49 Cb 0.51 -0.07 0.02 0.00 -1.82 0.00 0.00 70.33 68.97 1ilo n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ilo n ALA 50 N -2.18 0.42 -0.07 2.41 0.00 -1.26 -5.02 120.51 114.80 1ilo n ALA 50 Ca -0.02 -0.73 -0.07 0.00 0.00 0.00 0.00 53.44 52.61 1ilo n ALA 50 Cb 0.55 0.21 -0.04 0.00 0.00 0.00 0.00 19.45 20.17 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 -5.43 0.00 4.07 -1.92 -3.40 115.31 108.64 1ilo h LEU 51 Ca -0.10 -0.17 -0.23 0.00 0.08 0.00 0.00 57.88 57.46 1ilo h LEU 51 Cb 0.44 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1ilo h LEU 51 CO 0.14 0.85 1.77 -2.65 -1.08 0.00 0.00 178.44 177.47 1ilo n PRO 52 N -4.62 1.34 -2.53 1.13 -0.02 -1.23 -4.40 135.00 124.66 1ilo n PRO 52 Ca -0.10 -1.03 -0.35 0.00 -2.02 0.00 0.00 63.50 60.00 1ilo n PRO 52 Cb 0.29 -2.20 -0.04 0.00 -0.02 0.00 0.00 33.50 31.53 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 3.65 2.61 -0.30 -1.23 0.00 -1.14 -3.71 107.32 107.21 1ilo s GLY 53 Ca 0.27 0.66 -0.03 0.00 0.00 0.00 0.00 44.72 45.62 1ilo s GLY 53 CO -0.02 1.02 0.12 -2.27 0.00 0.00 0.00 173.10 171.95 1ilo s LEU 54 N -3.14 1.12 -0.28 0.66 1.98 -0.01 -1.03 118.68 117.98 1ilo s LEU 54 Ca 0.63 -1.40 -0.13 0.00 -2.89 0.00 0.00 54.13 50.34 1ilo s LEU 54 Cb -0.19 -0.53 -0.04 0.00 0.66 0.00 0.00 46.19 46.09 1ilo s LEU 54 CO 0.23 -0.43 0.28 0.00 -1.89 0.00 0.00 176.35 174.55 1ilo s ALA 55 N 1.94 3.54 -0.05 5.97 0.00 -0.88 -1.19 121.76 131.09 1ilo s ALA 55 Ca 0.09 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 51.10 1ilo s ALA 55 Cb -0.16 -2.61 -0.02 0.00 0.00 0.00 0.00 23.12 20.32 1ilo s ALA 55 CO -0.33 -0.66 -0.16 0.14 0.00 0.00 0.00 175.76 174.76 1ilo s VAL 56 N 1.91 2.91 -0.70 0.00 -7.23 -1.11 0.03 120.40 116.22 1ilo s VAL 56 Ca 0.11 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.50 1ilo s VAL 56 Cb -0.16 -2.13 0.00 0.00 0.56 0.00 0.00 36.38 34.65 1ilo s VAL 56 CO 0.11 0.58 0.00 -0.67 -0.31 0.00 0.00 175.10 174.81 1ilo n ASP 57 N 2.48 -2.58 -0.89 4.85 2.03 0.17 0.99 116.55 123.59 1ilo n ASP 57 Ca -0.17 0.28 -0.05 0.00 0.52 0.00 0.00 54.79 55.37 1ilo n ASP 57 Cb 0.52 -2.34 0.01 0.00 -0.72 0.00 0.00 41.12 38.59 1ilo n ASP 57 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ilo n GLY 58 N -0.54 0.42 2.80 0.27 0.00 -1.26 -5.02 105.19 101.86 1ilo n GLY 58 Ca -0.09 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.21 1ilo n GLY 58 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ilo s GLU 59 N -4.81 0.34 0.06 1.61 2.12 0.28 -5.13 118.70 113.17 1ilo s GLU 59 Ca 0.07 -0.04 -0.37 0.00 0.36 0.00 0.00 54.97 54.99 1ilo s GLU 59 Cb -0.03 -0.58 -0.17 0.00 0.26 0.00 0.00 34.13 33.61 1ilo s GLU 59 CO 0.09 -1.01 1.35 1.28 -0.54 0.00 0.00 175.26 176.43 1ilo n LEU 60 N 5.32 1.60 0.00 2.70 7.99 -1.26 -2.73 117.00 130.62 1ilo n LEU 60 Ca -0.02 1.12 0.00 0.00 -0.01 0.00 0.00 56.01 57.10 1ilo n LEU 60 Cb 0.47 -1.17 0.00 0.00 -0.11 0.00 0.00 43.42 42.61 1ilo n LEU 60 CO 0.00 -1.06 -0.08 1.17 -1.51 0.00 0.00 177.39 175.91 1ilo n LYS 61 N 2.62 3.43 -3.86 3.23 4.81 -0.33 -4.91 118.16 123.15 1ilo n LYS 61 Ca 0.19 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.49 1ilo n LYS 61 Cb 0.18 -0.42 -0.15 0.00 0.02 0.00 0.00 35.03 34.66 1ilo n LYS 61 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1ilo s ILE 62 N -0.70 0.02 -0.10 3.15 -1.09 -1.19 -4.98 121.20 116.31 1ilo s ILE 62 Ca 0.00 0.07 -0.06 0.00 -2.23 0.00 0.00 60.65 58.43 1ilo s ILE 62 Cb 0.00 -0.07 0.04 0.00 -1.58 0.00 0.00 42.46 40.84 1ilo s ILE 62 CO 0.00 0.05 0.24 -0.04 -1.23 0.00 0.00 174.94 173.96 1ilo s MET 63 N 0.44 0.23 0.00 2.79 -1.94 -1.25 -0.83 119.30 118.73 1ilo s MET 63 Ca -0.04 0.46 0.00 0.00 -1.71 0.00 0.00 55.69 54.40 1ilo s MET 63 Cb -0.06 -0.04 0.00 0.00 2.01 0.00 0.00 34.83 36.74 1ilo s MET 63 CO -0.01 -0.12 0.00 0.41 -0.01 0.00 0.00 175.02 175.29 1ilo n GLY 64 N 3.81 1.93 0.00 -0.03 0.00 -1.24 -4.86 105.19 104.80 1ilo n GLY 64 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1ilo n GLY 64 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ilo n ARG 65 N -2.00 0.00 -1.11 1.61 0.63 -1.25 -4.78 116.66 109.76 1ilo n ARG 65 Ca 0.00 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.57 1ilo n ARG 65 Cb 0.00 0.00 0.07 0.00 0.45 0.00 0.00 32.46 32.98 1ilo n ARG 65 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1ilo n VAL 66 N 0.00 0.87 -0.57 5.15 3.14 -1.25 -4.95 118.33 120.73 1ilo n VAL 66 Ca 0.00 -0.38 -0.30 0.00 -2.96 0.00 0.00 64.34 60.70 1ilo n VAL 66 Cb 0.00 -0.51 0.28 0.00 -1.06 0.00 0.00 33.84 32.55 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 -2.05 -0.37 0.41 1.55 0.00 -1.26 -4.96 121.76 115.07 1ilo s ALA 67 Ca 0.58 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.74 1ilo s ALA 67 Cb -0.30 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 1ilo s ALA 67 CO 0.65 -4.35 0.28 -1.12 0.00 0.00 0.00 175.76 171.22 1ilo s SER 68 N -3.38 4.76 0.17 0.00 0.01 -1.26 -4.34 113.70 109.66 1ilo s SER 68 Ca 0.69 -0.89 -0.14 0.00 1.31 0.00 0.00 55.95 56.93 1ilo s SER 68 Cb -0.12 -0.55 0.08 0.00 0.21 0.00 0.00 66.02 65.65 1ilo s SER 68 CO 0.57 -0.58 1.80 0.50 0.41 0.00 0.00 173.24 175.94 1ilo h LYS 69 N 1.24 0.51 0.00 12.44 3.64 -1.94 0.24 116.57 132.69 1ilo h LYS 69 Ca -0.42 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 58.79 1ilo h LYS 69 Cb 1.26 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1ilo h LYS 69 CO 0.63 0.33 -0.64 1.49 -2.27 0.00 0.00 179.45 178.99 1ilo h GLU 70 N 0.52 0.00 -0.05 1.90 4.81 -1.99 -2.82 114.58 116.95 1ilo h GLU 70 Ca 0.19 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.35 1ilo h GLU 70 Cb 0.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1ilo h GLU 70 CO -0.10 0.64 -0.26 0.93 -0.73 0.00 0.00 179.01 179.49 1ilo h GLU 71 N 0.00 0.27 -0.34 1.92 3.07 -1.80 -2.32 114.58 115.38 1ilo h GLU 71 Ca -0.01 -0.22 -0.01 0.00 -0.50 0.00 0.00 59.36 58.63 1ilo h GLU 71 Cb 1.15 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 29.09 1ilo h GLU 71 CO 0.08 0.87 0.19 0.97 -1.40 0.00 0.00 179.01 179.71 1ilo h ILE 72 N -0.26 1.14 -0.20 3.13 -0.00 -0.59 -0.34 117.51 120.39 1ilo h ILE 72 Ca -0.02 -0.38 -0.05 0.00 -0.00 0.00 0.00 64.86 64.41 1ilo h ILE 72 Cb 0.91 0.76 -0.01 0.00 -0.00 0.00 0.00 36.82 38.49 1ilo h ILE 72 CO 0.05 0.15 -0.11 0.50 -0.00 0.00 0.00 178.15 178.74 1ilo h LYS 73 N 0.43 0.32 0.00 2.19 3.64 -1.59 -1.71 116.57 119.86 1ilo h LYS 73 Ca 0.12 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 1ilo h LYS 73 Cb 0.07 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1ilo h LYS 73 CO -0.02 0.44 -0.57 0.87 -2.27 0.00 0.00 179.45 177.90 1ilo h LYS 74 N 0.30 0.00 -0.00 1.90 1.57 -0.94 -1.49 116.57 117.91 1ilo h LYS 74 Ca 0.06 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.62 1ilo h LYS 74 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1ilo h LYS 74 CO 0.02 0.57 -0.93 0.82 -0.57 0.00 0.00 179.45 179.36 1ilo h ILE 75 N 0.00 1.41 0.02 1.86 1.08 -0.39 -3.23 117.51 118.25 1ilo h ILE 75 Ca -0.01 -2.45 -0.22 0.00 -0.39 0.00 0.00 64.86 61.80 1ilo h ILE 75 Cb 1.15 2.41 -0.01 0.00 -3.07 0.00 0.00 36.82 37.31 1ilo h ILE 75 CO 0.07 0.73 -0.95 0.25 -0.69 0.00 0.00 178.15 177.56 1ilo h LEU 76 N 0.22 0.33 0.00 1.44 6.46 -1.27 -3.51 115.31 118.99 1ilo h LEU 76 Ca -0.08 -0.29 0.00 0.00 -0.12 0.00 0.00 57.88 57.40 1ilo h LEU 76 Cb 1.56 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 41.39 1ilo h LEU 76 CO 0.16 1.11 0.00 -0.24 -0.62 0.00 0.00 178.44 178.85