#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 3.79 -0.48 3.17 1.00 0.24 -4.74 119.30 122.28 1ilo s MET 2 Ca 0.00 0.57 -0.27 0.00 0.00 0.00 0.00 55.69 55.99 1ilo s MET 2 Cb 0.00 -3.84 -0.02 0.00 0.00 0.00 0.00 34.83 30.97 1ilo s MET 2 CO 0.00 -1.10 1.79 0.21 0.00 0.00 0.00 175.02 175.92 1ilo s LYS 3 N 3.79 3.00 -0.18 2.03 2.20 -1.26 -1.90 119.74 127.43 1ilo s LYS 3 Ca 0.41 0.97 -0.04 0.00 -0.36 0.00 0.00 55.97 56.95 1ilo s LYS 3 Cb -0.10 -4.28 -0.03 0.00 -1.51 0.00 0.00 37.83 31.91 1ilo s LYS 3 CO 0.23 -2.27 -0.02 0.42 -0.36 0.00 0.00 175.35 173.35 1ilo s ILE 4 N 7.86 3.96 -0.18 5.43 1.09 -0.74 -0.58 121.20 138.03 1ilo s ILE 4 Ca 0.72 -0.32 -0.04 0.00 -1.10 0.00 0.00 60.65 59.91 1ilo s ILE 4 Cb -0.17 -2.76 -0.02 0.00 -1.06 0.00 0.00 42.46 38.45 1ilo s ILE 4 CO 0.27 0.46 -0.04 -1.10 -0.10 0.00 0.00 174.94 174.43 1ilo s GLN 5 N 0.64 3.54 -0.55 2.79 -0.21 0.30 -2.53 119.66 123.65 1ilo s GLN 5 Ca -0.01 -0.57 -0.12 0.00 0.02 0.00 0.00 55.36 54.68 1ilo s GLN 5 Cb -0.14 -2.96 0.14 0.00 1.00 0.00 0.00 33.01 31.05 1ilo s GLN 5 CO 0.02 0.05 0.46 0.42 -2.12 0.00 0.00 175.29 174.11 1ilo s ILE 6 N 0.86 4.70 -0.32 1.08 1.09 -1.11 -2.33 121.20 125.17 1ilo s ILE 6 Ca -0.01 -1.83 -0.18 0.00 -1.10 0.00 0.00 60.65 57.53 1ilo s ILE 6 Cb -0.15 -4.04 -0.01 0.00 -1.06 0.00 0.00 42.46 37.20 1ilo s ILE 6 CO 0.01 -0.85 0.50 -0.31 -0.10 0.00 0.00 174.94 174.20 1ilo s TYR 7 N 1.22 3.21 0.00 3.97 2.02 0.10 -1.20 117.35 126.68 1ilo s TYR 7 Ca 0.07 0.34 0.00 0.00 -0.37 0.00 0.00 57.07 57.10 1ilo s TYR 7 Cb -0.25 -2.83 0.00 0.00 -0.40 0.00 0.00 41.96 38.48 1ilo s TYR 7 CO -0.01 -0.43 0.00 0.41 -1.57 0.00 0.00 175.55 173.95 1ilo n GLY 8 N 4.67 1.04 3.75 0.71 0.00 -1.25 -1.40 105.19 112.71 1ilo n GLY 8 Ca -0.05 0.00 -0.68 0.00 0.00 0.00 0.00 46.02 45.29 1ilo n GLY 8 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ilo n THR 9 N -0.16 0.00 0.00 2.61 5.66 -1.26 0.12 114.28 121.25 1ilo n THR 9 Ca 0.00 -0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1ilo n THR 9 Cb 0.00 -0.50 0.00 0.00 -1.55 0.00 0.00 70.33 68.28 1ilo n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ilo n GLY 10 N 3.98 3.05 0.10 1.09 0.00 -1.26 -4.70 105.19 107.44 1ilo n GLY 10 Ca 0.31 -0.83 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.45 3.35 -2.00 0.00 0.00 0.31 -4.95 121.76 116.02 1ilo s ALA 12 Ca -0.16 -0.10 0.03 0.00 0.00 0.00 0.00 51.96 51.73 1ilo s ALA 12 Cb 0.06 -2.71 0.15 0.00 0.00 0.00 0.00 23.12 20.62 1ilo s ALA 12 CO 0.69 0.18 0.91 0.09 0.00 0.00 0.00 175.76 177.62 1ilo n ASN 13 N -0.80 0.00 -0.06 0.00 4.13 -1.26 -3.86 115.26 113.41 1ilo n ASN 13 Ca 0.03 -1.51 0.20 0.00 1.68 0.00 0.00 54.58 54.97 1ilo n ASN 13 Cb 0.53 0.00 0.65 0.00 -1.54 0.00 0.00 39.78 39.43 1ilo n ASN 13 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ilo h GLN 15 N 0.10 0.49 0.63 0.00 -0.00 -1.93 0.70 115.11 115.09 1ilo h GLN 15 Ca 0.30 -0.03 -0.03 0.00 -0.00 0.00 0.00 58.65 58.89 1ilo h GLN 15 Cb 1.05 -0.11 0.01 0.00 0.00 0.00 0.00 27.48 28.43 1ilo h GLN 15 CO -0.03 0.33 -0.30 1.98 0.00 0.00 0.00 178.83 180.80 1ilo h MET 16 N 0.51 -0.81 0.00 1.69 4.05 -1.56 -2.93 114.93 115.88 1ilo h MET 16 Ca 0.52 0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.97 1ilo h MET 16 Cb 1.16 0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 32.14 1ilo h MET 16 CO -0.25 -0.54 -0.13 1.25 0.23 0.00 0.00 176.91 177.46 1ilo h LEU 17 N -0.98 0.00 -0.18 3.39 5.85 -1.60 -2.88 115.31 118.91 1ilo h LEU 17 Ca -0.09 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.67 1ilo h LEU 17 Cb 0.64 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1ilo h LEU 17 CO 0.14 0.13 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.22 1ilo h GLU 18 N 0.00 -0.04 -0.19 1.25 4.22 0.50 0.34 114.58 120.66 1ilo h GLU 18 Ca -0.00 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 1ilo h GLU 18 Cb 0.39 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1ilo h GLU 18 CO 0.02 -0.03 0.01 -0.22 -2.18 0.00 0.00 179.01 176.61 1ilo h LYS 19 N -0.05 0.32 -0.63 1.92 3.11 -1.33 -2.83 116.57 117.09 1ilo h LYS 19 Ca 0.10 -0.10 0.07 0.00 -2.81 0.00 0.00 60.65 57.91 1ilo h LYS 19 Cb 0.19 -0.03 -0.06 0.00 -1.00 0.00 0.00 32.23 31.33 1ilo h LYS 19 CO -0.21 0.51 0.32 -0.91 -2.81 0.00 0.00 179.45 176.35 1ilo h ASN 20 N 0.09 0.45 -0.93 4.20 2.35 -1.33 -2.11 115.58 118.30 1ilo h ASN 20 Ca 0.05 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.88 1ilo h ASN 20 Cb 0.36 -0.04 -0.06 0.00 0.05 0.00 0.00 38.32 38.63 1ilo h ASN 20 CO 0.01 0.29 0.60 0.00 -1.65 0.00 0.00 177.43 176.68 1ilo h ALA 21 N 1.35 1.24 -0.35 -0.83 0.00 -0.25 0.77 119.26 121.18 1ilo h ALA 21 Ca 0.29 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1ilo h ALA 21 Cb 0.23 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1ilo h ALA 21 CO -0.21 0.46 0.20 0.00 0.00 0.00 0.00 179.25 179.71 1ilo h ARG 22 N 1.16 0.40 -0.07 0.00 3.08 -1.13 0.42 114.38 118.24 1ilo h ARG 22 Ca 0.38 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.35 1ilo h ARG 22 Cb 0.03 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1ilo h ARG 22 CO -0.13 0.27 -0.17 1.05 -1.07 0.00 0.00 179.97 179.92 1ilo h GLU 23 N 0.42 0.23 0.07 0.04 4.11 -1.27 -2.88 114.58 115.30 1ilo h GLU 23 Ca 0.14 -0.16 -0.00 0.00 0.07 0.00 0.00 59.36 59.41 1ilo h GLU 23 Cb 0.01 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1ilo h GLU 23 CO -0.07 0.76 -0.03 0.00 0.07 0.00 0.00 179.01 179.75 1ilo h ALA 24 N 0.47 -0.09 0.08 1.06 0.00 -0.76 0.86 119.26 120.88 1ilo h ALA 24 Ca -0.00 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ilo h ALA 24 Cb 0.77 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1ilo h ALA 24 CO 0.04 -0.49 -0.33 -0.24 0.00 0.00 0.00 179.25 178.23 1ilo h VAL 25 N -0.21 0.29 -0.01 0.00 3.04 -0.27 0.30 116.25 119.39 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 0.18 0.29 -0.00 0.00 -2.01 0.00 0.00 31.29 29.75 1ilo h VAL 25 CO 0.01 0.00 -0.00 0.11 -1.01 0.00 0.00 177.57 176.68 1ilo h LYS 26 N -0.54 0.01 -0.47 4.17 1.57 -1.18 -2.29 116.57 117.84 1ilo h LYS 26 Ca 0.04 -0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.90 1ilo h LYS 26 Cb 0.58 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.82 1ilo h LYS 26 CO -0.22 0.36 0.04 1.49 -0.57 0.00 0.00 179.45 180.54 1ilo h GLU 27 N -0.34 0.15 -0.09 3.15 4.81 0.92 0.21 114.58 123.39 1ilo h GLU 27 Ca 0.00 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1ilo h GLU 27 Cb 0.35 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1ilo h GLU 27 CO 0.00 0.10 0.40 -0.07 -0.73 0.00 0.00 179.01 178.71 1ilo h LEU 28 N 0.16 0.00 0.00 1.64 3.38 -0.42 -3.43 115.31 116.63 1ilo h LEU 28 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1ilo h LEU 28 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1ilo h LEU 28 CO -0.36 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.78 1ilo n GLY 29 N -1.29 1.93 3.06 0.83 0.00 0.70 -5.11 105.19 105.31 1ilo n GLY 29 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1ilo n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ilo s ILE 30 N -2.00 -0.85 1.01 -0.61 1.01 -0.86 -5.02 121.20 113.88 1ilo s ILE 30 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 60.65 60.49 1ilo s ILE 30 Cb 0.00 -0.95 0.20 0.00 0.01 0.00 0.00 42.46 41.72 1ilo s ILE 30 CO 0.00 -0.06 1.09 -0.62 0.00 0.00 0.00 174.94 175.35 1ilo s ASP 31 N 2.74 2.17 0.32 3.58 -1.08 -1.26 -2.07 116.67 121.07 1ilo s ASP 31 Ca 0.16 1.86 -0.09 0.00 -0.52 0.00 0.00 52.55 53.95 1ilo s ASP 31 Cb -0.14 -2.44 0.01 0.00 -1.46 0.00 0.00 42.92 38.90 1ilo s ASP 31 CO -0.21 -3.51 0.56 0.00 0.52 0.00 0.00 175.17 172.53 1ilo s ALA 32 N -2.60 0.02 -0.17 3.66 0.00 -1.26 0.16 121.76 121.58 1ilo s ALA 32 Ca 0.67 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 1ilo s ALA 32 Cb -0.23 1.00 0.05 0.00 0.00 0.00 0.00 23.12 23.94 1ilo s ALA 32 CO 0.61 -0.87 -0.04 -1.83 0.00 0.00 0.00 175.76 173.63 1ilo s GLU 33 N -3.20 1.33 -0.41 0.00 -1.05 -0.80 -4.75 118.70 109.83 1ilo s GLU 33 Ca 0.24 -0.54 -0.13 0.00 -0.15 0.00 0.00 54.97 54.39 1ilo s GLU 33 Cb -0.02 -2.05 0.04 0.00 -0.44 0.00 0.00 34.13 31.66 1ilo s GLU 33 CO 0.14 -0.47 0.28 -0.06 0.95 0.00 0.00 175.26 176.10 1ilo s PHE 34 N 1.65 3.25 -0.11 4.83 0.40 -1.26 -1.79 117.98 124.94 1ilo s PHE 34 Ca -0.00 -0.85 0.03 0.00 -0.60 0.00 0.00 56.93 55.51 1ilo s PHE 34 Cb -0.16 -2.65 -0.00 0.00 0.51 0.00 0.00 43.02 40.72 1ilo s PHE 34 CO -0.07 -0.66 -0.21 -1.21 0.70 0.00 0.00 175.22 173.77 1ilo s GLU 35 N 1.61 3.14 0.50 0.44 2.02 -1.05 -5.03 118.70 120.33 1ilo s GLU 35 Ca 0.04 -0.82 -0.18 0.00 0.02 0.00 0.00 54.97 54.02 1ilo s GLU 35 Cb -0.20 -2.41 -0.08 0.00 0.10 0.00 0.00 34.13 31.54 1ilo s GLU 35 CO 0.08 0.17 0.99 0.15 0.02 0.00 0.00 175.26 176.66 1ilo s LYS 36 N 0.40 3.93 -0.57 1.61 1.02 -1.26 -2.77 119.74 122.10 1ilo s LYS 36 Ca -0.16 1.05 0.05 0.00 0.02 0.00 0.00 55.97 56.94 1ilo s LYS 36 Cb -0.17 -2.13 0.20 0.00 -0.52 0.00 0.00 37.83 35.20 1ilo s LYS 36 CO 0.07 -0.29 0.51 0.44 -0.92 0.00 0.00 175.35 175.17 1ilo n ILE 37 N -1.36 0.70 -2.07 2.17 -0.00 -0.34 -4.85 119.36 113.61 1ilo n ILE 37 Ca 0.07 -4.44 -0.41 0.00 -0.00 0.00 0.00 62.75 57.97 1ilo n ILE 37 Cb 0.54 -2.00 -0.01 0.00 -0.00 0.00 0.00 39.64 38.17 1ilo n ILE 37 CO 0.00 0.00 0.00 2.29 -0.00 0.00 0.00 176.55 178.84 1ilo n LYS 38 N 1.88 2.68 0.00 6.28 2.85 -1.26 -4.10 118.16 126.49 1ilo n LYS 38 Ca 0.25 -2.79 0.00 0.00 -1.05 0.00 0.00 58.31 54.72 1ilo n LYS 38 Cb 0.42 -3.40 0.00 0.00 -0.65 0.00 0.00 35.03 31.40 1ilo n LYS 38 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1ilo n GLU 39 N 7.48 0.00 0.23 -1.58 0.28 -1.26 -5.02 120.64 120.77 1ilo n GLU 39 Ca 0.49 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.57 1ilo n GLU 39 Cb 0.43 0.00 0.62 0.00 1.43 0.00 0.00 31.44 33.92 1ilo n GLU 39 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ilo h MET 40 N 0.00 0.06 -0.93 3.44 -0.00 -1.98 0.63 114.93 116.16 1ilo h MET 40 Ca 0.00 -0.00 0.23 0.00 -0.00 0.00 0.00 59.70 59.93 1ilo h MET 40 Cb 0.00 -0.01 -0.06 0.00 -0.00 0.00 0.00 31.60 31.52 1ilo h MET 40 CO 0.00 0.04 0.62 -0.44 -0.00 0.00 0.00 176.91 177.14 1ilo h ASP 41 N 0.06 0.30 0.40 -0.10 5.19 -1.95 0.31 116.42 120.62 1ilo h ASP 41 Ca 0.02 0.04 -0.31 0.00 -0.62 0.00 0.00 57.03 56.16 1ilo h ASP 41 Cb 0.01 -0.02 -0.03 0.00 0.18 0.00 0.00 39.33 39.47 1ilo h ASP 41 CO -0.00 0.10 -1.70 1.56 -3.12 0.00 0.00 179.24 176.08 1ilo h GLN 42 N 0.29 0.15 0.13 3.56 1.08 -1.26 -3.18 115.11 115.88 1ilo h GLN 42 Ca 0.48 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.41 1ilo h GLN 42 Cb 1.38 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.91 1ilo h GLN 42 CO -0.15 0.91 -0.06 -0.84 -0.95 0.00 0.00 178.83 177.74 1ilo h ILE 43 N 0.04 0.93 -0.72 2.54 3.07 0.47 -1.64 117.51 122.20 1ilo h ILE 43 Ca -0.30 -0.20 -0.03 0.00 1.55 0.00 0.00 64.86 65.88 1ilo h ILE 43 Cb 2.01 1.06 -0.03 0.00 -0.27 0.00 0.00 36.82 39.58 1ilo h ILE 43 CO 0.11 0.05 0.31 0.17 -1.05 0.00 0.00 178.15 177.74 1ilo h LEU 44 N -0.26 0.97 -2.64 0.16 -0.00 -0.84 -0.63 115.31 112.06 1ilo h LEU 44 Ca -0.02 -0.15 0.01 0.00 -0.00 0.00 0.00 57.88 57.72 1ilo h LEU 44 Cb 0.21 -0.25 -0.00 0.00 -0.00 0.00 0.00 40.66 40.62 1ilo h LEU 44 CO 0.03 0.85 0.06 -0.08 -0.00 0.00 0.00 178.44 179.30 1ilo h GLU 45 N 1.02 0.00 -0.04 0.17 4.81 -1.48 0.51 114.58 119.57 1ilo h GLU 45 Ca 0.24 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 59.22 1ilo h GLU 45 Cb 0.17 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.57 1ilo h GLU 45 CO -0.03 0.00 -0.97 0.00 -0.73 0.00 0.00 179.01 177.28 1ilo h ALA 46 N 1.91 0.19 0.00 2.92 0.00 -0.13 -3.48 119.26 120.66 1ilo h ALA 46 Ca 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1ilo h ALA 46 Cb 0.12 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ilo h ALA 46 CO -0.00 0.69 0.00 0.41 0.00 0.00 0.00 179.25 180.35 1ilo n GLY 47 N 0.98 1.95 3.84 0.00 0.00 0.17 -4.61 105.19 107.52 1ilo n GLY 47 Ca -0.10 0.00 -0.30 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 2.82 -0.02 0.99 -0.00 -1.24 -5.00 118.68 116.23 1ilo s LEU 48 Ca 0.00 1.28 0.05 0.00 -0.00 0.00 0.00 54.13 55.46 1ilo s LEU 48 Cb 0.00 -4.03 -0.07 0.00 -0.00 0.00 0.00 46.19 42.09 1ilo s LEU 48 CO 0.00 -1.58 0.08 0.41 -0.00 0.00 0.00 176.35 175.25 1ilo n THR 49 N -3.18 0.10 -1.82 5.48 -1.04 -1.26 -4.37 114.28 108.19 1ilo n THR 49 Ca 0.07 -0.14 -0.29 0.00 -2.04 0.00 0.00 64.05 61.65 1ilo n THR 49 Cb 0.56 -0.04 0.14 0.00 -1.82 0.00 0.00 70.33 69.17 1ilo n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ilo s ALA 50 N -2.26 2.29 -0.05 2.41 0.00 -1.26 -5.03 121.76 117.86 1ilo s ALA 50 Ca -0.02 -0.85 -0.01 0.00 0.00 0.00 0.00 51.96 51.08 1ilo s ALA 50 Cb 0.03 -2.90 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 1ilo s ALA 50 CO 0.20 -2.13 0.08 -0.07 0.00 0.00 0.00 175.76 173.84 1ilo h LEU 51 N -1.40 -0.04 -5.56 0.00 4.07 -1.90 -3.38 115.31 107.10 1ilo h LEU 51 Ca -0.46 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.28 1ilo h LEU 51 Cb 1.29 0.01 0.01 0.00 1.08 0.00 0.00 40.66 43.05 1ilo h LEU 51 CO 0.54 0.22 1.87 -2.65 -1.08 0.00 0.00 178.44 177.34 1ilo n PRO 52 N -3.49 1.28 -2.79 1.13 -0.02 -1.21 -3.82 135.00 126.08 1ilo n PRO 52 Ca -0.01 -1.04 -0.40 0.00 -2.02 0.00 0.00 63.50 60.03 1ilo n PRO 52 Cb 0.02 -2.23 -0.05 0.00 -0.02 0.00 0.00 33.50 31.21 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 3.87 3.01 -0.35 -1.23 0.00 -0.49 -3.67 107.32 108.47 1ilo s GLY 53 Ca 0.25 0.54 0.01 0.00 0.00 0.00 0.00 44.72 45.52 1ilo s GLY 53 CO -0.02 1.28 0.11 -2.27 0.00 0.00 0.00 173.10 172.20 1ilo s LEU 54 N -0.49 3.24 -0.25 0.66 2.96 0.58 0.02 118.68 125.41 1ilo s LEU 54 Ca 0.43 -2.01 -0.13 0.00 -0.22 0.00 0.00 54.13 52.20 1ilo s LEU 54 Cb -0.24 -1.18 -0.04 0.00 0.50 0.00 0.00 46.19 45.23 1ilo s LEU 54 CO 0.29 -0.38 0.29 0.00 -1.32 0.00 0.00 176.35 175.23 1ilo s ALA 55 N 1.12 3.57 -0.06 5.97 0.00 -0.98 -2.54 121.76 128.84 1ilo s ALA 55 Ca 0.12 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.29 1ilo s ALA 55 Cb -0.19 -2.54 -0.03 0.00 0.00 0.00 0.00 23.12 20.36 1ilo s ALA 55 CO -0.15 -0.42 -0.12 0.14 0.00 0.00 0.00 175.76 175.21 1ilo s VAL 56 N 1.54 3.27 -0.53 0.00 -7.23 -1.11 -0.54 120.40 115.81 1ilo s VAL 56 Ca 0.12 -0.64 0.00 0.00 -1.81 0.00 0.00 61.98 59.65 1ilo s VAL 56 Cb -0.15 -2.30 0.00 0.00 0.56 0.00 0.00 36.38 34.49 1ilo s VAL 56 CO 0.08 0.59 0.00 0.47 -0.31 0.00 0.00 175.10 175.93 1ilo n ASP 57 N 2.28 -2.12 -1.05 4.85 9.92 0.25 0.90 116.55 131.58 1ilo n ASP 57 Ca -0.17 0.29 -0.05 0.00 -0.53 0.00 0.00 54.79 54.33 1ilo n ASP 57 Cb 0.52 -1.98 0.01 0.00 -0.64 0.00 0.00 41.12 39.04 1ilo n ASP 57 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ilo n GLY 58 N -0.49 0.65 2.82 0.44 0.00 -1.26 -5.03 105.19 102.32 1ilo n GLY 58 Ca -0.07 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 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 -5.19 0.35 0.14 1.61 0.41 0.26 -5.12 118.70 111.16 1ilo s GLU 59 Ca 0.11 -0.00 -0.34 0.00 -0.41 0.00 0.00 54.97 54.32 1ilo s GLU 59 Cb -0.05 -0.54 -0.15 0.00 -1.78 0.00 0.00 34.13 31.61 1ilo s GLU 59 CO 0.13 -1.00 1.39 1.28 -0.49 0.00 0.00 175.26 176.57 1ilo n LEU 60 N 5.33 2.27 0.00 1.80 7.99 -1.26 -2.73 117.00 130.39 1ilo n LEU 60 Ca -0.01 1.12 0.00 0.00 -0.01 0.00 0.00 56.01 57.10 1ilo n LEU 60 Cb 0.48 -1.30 0.00 0.00 -0.11 0.00 0.00 43.42 42.49 1ilo n LEU 60 CO 0.00 -0.78 -0.19 0.29 -1.51 0.00 0.00 177.39 175.20 1ilo n LYS 61 N 2.60 3.07 -3.69 3.23 5.02 -1.05 -4.94 118.16 122.40 1ilo n LYS 61 Ca 0.16 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.35 1ilo n LYS 61 Cb 0.25 -0.61 -0.10 0.00 -0.02 0.00 0.00 35.03 34.54 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 -0.92 -0.02 -0.09 -0.18 1.01 -1.24 -5.01 121.20 114.75 1ilo s ILE 62 Ca 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.65 1ilo s ILE 62 Cb 0.00 -0.66 0.03 0.00 0.01 0.00 0.00 42.46 41.84 1ilo s ILE 62 CO 0.00 0.03 0.22 -0.04 0.00 0.00 0.00 174.94 175.15 1ilo s MET 63 N 1.22 0.22 0.00 2.79 1.00 -1.25 -0.30 119.30 122.97 1ilo s MET 63 Ca -0.08 0.40 0.00 0.00 0.00 0.00 0.00 55.69 56.01 1ilo s MET 63 Cb -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 34.83 34.76 1ilo s MET 63 CO -0.11 -0.09 0.00 0.41 0.00 0.00 0.00 175.02 175.22 1ilo n GLY 64 N 3.57 1.20 0.00 -0.03 0.00 -1.24 -4.83 105.19 103.86 1ilo n GLY 64 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1ilo n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ilo n ARG 65 N -2.00 0.00 -0.70 1.61 5.12 -1.26 -4.79 116.66 114.64 1ilo n ARG 65 Ca 0.00 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.60 1ilo n ARG 65 Cb 0.00 0.00 0.16 0.00 -1.16 0.00 0.00 32.46 31.46 1ilo n ARG 65 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 1ilo n VAL 66 N 0.00 0.00 -1.58 1.55 0.24 -1.26 -4.98 118.33 112.30 1ilo n VAL 66 Ca 0.00 -0.27 -0.11 0.00 -2.04 0.00 0.00 64.34 61.92 1ilo n VAL 66 Cb 0.00 -0.65 0.08 0.00 -1.47 0.00 0.00 33.84 31.79 1ilo n VAL 66 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ilo n ALA 67 N -4.19 -0.48 -2.10 2.33 0.00 -1.26 -5.00 120.51 109.81 1ilo n ALA 67 Ca 0.03 -0.72 -0.19 0.00 0.00 0.00 0.00 53.44 52.56 1ilo n ALA 67 Cb 0.58 -0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.05 1ilo n ALA 67 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ilo s SER 68 N -2.92 5.62 0.09 0.00 0.15 -1.26 -4.64 113.70 110.74 1ilo s SER 68 Ca 0.30 -0.23 -0.29 0.00 0.70 0.00 0.00 55.95 56.44 1ilo s SER 68 Cb -0.01 -0.87 -0.14 0.00 -1.71 0.00 0.00 66.02 63.30 1ilo s SER 68 CO 0.21 -0.80 1.65 0.50 1.20 0.00 0.00 173.24 176.00 1ilo h LYS 69 N 0.51 -0.53 -0.98 5.44 3.64 -1.97 -2.35 116.57 120.34 1ilo h LYS 69 Ca -0.42 0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.09 1ilo h LYS 69 Cb 1.28 0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 33.15 1ilo h LYS 69 CO 0.49 -0.35 0.63 1.49 -2.27 0.00 0.00 179.45 179.43 1ilo h GLU 70 N -0.55 1.02 -0.75 1.90 4.81 -2.00 -1.61 114.58 117.41 1ilo h GLU 70 Ca -0.02 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.20 1ilo h GLU 70 Cb 0.47 -0.23 -0.06 0.00 0.63 0.00 0.00 28.75 29.57 1ilo h GLU 70 CO -0.00 0.68 0.44 0.93 -0.73 0.00 0.00 179.01 180.33 1ilo h GLU 71 N 1.06 0.79 0.37 1.92 5.08 -1.86 0.11 114.58 122.05 1ilo h GLU 71 Ca 0.45 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.75 1ilo h GLU 71 Cb 0.31 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1ilo h GLU 71 CO -0.20 0.52 -0.27 0.82 -1.00 0.00 0.00 179.01 178.88 1ilo h ILE 72 N 0.81 0.43 -0.59 3.13 1.08 -0.78 0.81 117.51 122.40 1ilo h ILE 72 Ca 0.33 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.79 1ilo h ILE 72 Cb 0.18 0.43 -0.03 0.00 -3.07 0.00 0.00 36.82 34.33 1ilo h ILE 72 CO -0.18 0.00 0.30 0.50 -0.69 0.00 0.00 178.15 178.08 1ilo h LYS 73 N -0.64 0.81 0.00 2.37 3.64 -1.31 -0.07 116.57 121.38 1ilo h LYS 73 Ca -0.03 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.12 1ilo h LYS 73 Cb 0.55 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 1ilo h LYS 73 CO 0.00 0.62 -0.64 -0.22 -2.27 0.00 0.00 179.45 176.94 1ilo h LYS 74 N 0.82 0.00 0.00 1.90 3.64 -0.38 -0.85 116.57 121.70 1ilo h LYS 74 Ca 0.21 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.36 1ilo h LYS 74 Cb 0.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1ilo h LYS 74 CO -0.03 0.64 -0.95 0.82 -2.27 0.00 0.00 179.45 177.66 1ilo h ILE 75 N 0.00 1.40 0.03 2.00 1.08 0.15 -3.24 117.51 118.93 1ilo h ILE 75 Ca -0.01 -2.46 -0.22 0.00 -0.39 0.00 0.00 64.86 61.78 1ilo h ILE 75 Cb 1.20 2.43 -0.02 0.00 -3.07 0.00 0.00 36.82 37.36 1ilo h ILE 75 CO 0.08 0.73 -1.00 -0.07 -0.69 0.00 0.00 178.15 177.21 1ilo h LEU 76 N 0.23 0.17 0.00 1.44 4.07 -0.98 -3.51 115.31 116.73 1ilo h LEU 76 Ca -0.08 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1ilo h LEU 76 Cb 1.59 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.27 1ilo h LEU 76 CO 0.16 1.06 0.00 -1.54 -1.08 0.00 0.00 178.44 177.05