#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 3.87 -0.59 2.12 1.00 0.30 -4.67 119.30 121.33 1ilo s MET 2 Ca 0.00 1.01 -0.27 0.00 0.00 0.00 0.00 55.69 56.43 1ilo s MET 2 Cb 0.00 -3.87 -0.02 0.00 0.00 0.00 0.00 34.83 30.94 1ilo s MET 2 CO 0.00 -1.18 1.87 0.15 0.00 0.00 0.00 175.02 175.86 1ilo s LYS 3 N 4.20 2.66 -0.10 2.03 1.02 -1.26 -1.00 119.74 127.29 1ilo s LYS 3 Ca 0.52 0.70 -0.01 0.00 0.02 0.00 0.00 55.97 57.20 1ilo s LYS 3 Cb -0.13 -4.38 -0.03 0.00 -0.52 0.00 0.00 37.83 32.77 1ilo s LYS 3 CO 0.24 -2.68 -0.06 0.42 -0.92 0.00 0.00 175.35 172.35 1ilo s ILE 4 N 9.02 3.77 0.00 2.17 1.01 0.27 0.10 121.20 137.53 1ilo s ILE 4 Ca 0.69 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.94 1ilo s ILE 4 Cb -0.13 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 39.72 1ilo s ILE 4 CO 0.22 0.56 -0.08 -1.10 0.00 0.00 0.00 174.94 174.54 1ilo s GLN 5 N -0.31 2.52 -0.32 2.79 -1.52 0.27 -1.41 119.66 121.68 1ilo s GLN 5 Ca 0.05 -0.73 0.01 0.00 -1.95 0.00 0.00 55.36 52.73 1ilo s GLN 5 Cb -0.13 -2.48 0.10 0.00 -0.22 0.00 0.00 33.01 30.28 1ilo s GLN 5 CO 0.02 0.60 0.08 0.42 -0.25 0.00 0.00 175.29 176.16 1ilo s ILE 6 N -0.98 1.42 -0.33 1.08 1.09 -1.11 -2.21 121.20 120.16 1ilo s ILE 6 Ca 0.17 -1.75 -0.17 0.00 -1.10 0.00 0.00 60.65 57.80 1ilo s ILE 6 Cb -0.11 -2.05 -0.01 0.00 -1.06 0.00 0.00 42.46 39.23 1ilo s ILE 6 CO 0.07 -0.63 0.48 -0.31 -0.10 0.00 0.00 174.94 174.45 1ilo s TYR 7 N 1.34 3.20 0.00 3.97 2.02 -0.45 -2.76 117.35 124.68 1ilo s TYR 7 Ca 0.10 0.24 0.00 0.00 -0.37 0.00 0.00 57.07 57.04 1ilo s TYR 7 Cb -0.18 -2.82 0.00 0.00 -0.40 0.00 0.00 41.96 38.56 1ilo s TYR 7 CO -0.18 -0.45 0.00 0.41 -1.57 0.00 0.00 175.55 173.76 1ilo n GLY 8 N 4.75 -2.15 2.43 0.71 0.00 -1.26 -2.79 105.19 106.88 1ilo n GLY 8 Ca -0.06 0.78 -0.09 0.00 0.00 0.00 0.00 46.02 46.66 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 -0.42 0.00 2.61 -1.04 -1.26 -4.76 114.28 109.41 1ilo n THR 9 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1ilo n THR 9 Cb 0.00 -1.27 0.00 0.00 -1.82 0.00 0.00 70.33 67.24 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 -0.71 1.09 2.46 3.41 0.00 -1.26 -4.97 105.19 105.21 1ilo n GLY 10 Ca -0.11 0.50 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.96 1.67 -0.93 0.00 0.00 -1.26 -4.89 121.76 113.40 1ilo s ALA 12 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1ilo s ALA 12 Cb 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1ilo s ALA 12 CO 0.00 0.25 0.43 0.09 0.00 0.00 0.00 175.76 176.53 1ilo n ASN 13 N 3.41 0.93 -0.10 0.00 4.13 -1.26 -4.15 115.26 118.21 1ilo n ASN 13 Ca -0.20 -1.61 0.26 0.00 1.68 0.00 0.00 54.58 54.71 1ilo n ASN 13 Cb 0.52 -0.40 0.72 0.00 -1.54 0.00 0.00 39.78 39.08 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 0.00 0.76 0.04 0.00 3.07 -1.99 0.58 115.11 117.57 1ilo h GLN 15 Ca 0.36 -0.05 -0.00 0.00 0.09 0.00 0.00 58.65 59.05 1ilo h GLN 15 Cb 1.54 -0.17 0.00 0.00 0.08 0.00 0.00 27.48 28.93 1ilo h GLN 15 CO -0.00 0.51 -0.02 0.52 0.09 0.00 0.00 178.83 179.92 1ilo h MET 16 N 0.79 -0.05 -0.04 0.06 2.86 -0.97 -2.89 114.93 114.69 1ilo h MET 16 Ca 0.28 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.79 1ilo h MET 16 Cb 0.11 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1ilo h MET 16 CO -0.08 0.37 -0.55 1.25 1.06 0.00 0.00 176.91 178.96 1ilo h LEU 17 N -0.48 0.12 -0.79 1.22 6.46 -1.51 -2.83 115.31 117.50 1ilo h LEU 17 Ca -0.01 -0.06 0.04 0.00 -0.12 0.00 0.00 57.88 57.73 1ilo h LEU 17 Cb 0.44 -0.03 -0.05 0.00 -0.73 0.00 0.00 40.66 40.29 1ilo h LEU 17 CO 0.01 0.65 0.50 -0.08 -0.62 0.00 0.00 178.44 178.90 1ilo h GLU 18 N 0.08 0.94 -0.12 1.25 4.57 0.16 0.46 114.58 121.93 1ilo h GLU 18 Ca -0.00 -0.06 -0.17 0.00 -1.18 0.00 0.00 59.36 57.95 1ilo h GLU 18 Cb 1.00 -0.21 0.01 0.00 -0.16 0.00 0.00 28.75 29.39 1ilo h GLU 18 CO 0.08 0.62 -0.59 -0.22 -1.18 0.00 0.00 179.01 177.71 1ilo h LYS 19 N 0.97 0.61 -0.03 1.92 3.64 -1.42 -2.86 116.57 119.41 1ilo h LYS 19 Ca 0.32 -0.50 -0.20 0.00 -1.27 0.00 0.00 60.65 59.00 1ilo h LYS 19 Cb 0.03 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1ilo h LYS 19 CO -0.12 1.12 -0.84 -2.95 -2.27 0.00 0.00 179.45 174.39 1ilo h ASN 20 N 0.26 0.43 0.03 4.20 7.08 -1.29 -2.95 115.58 123.34 1ilo h ASN 20 Ca -0.04 -0.32 -0.00 0.00 -3.08 0.00 0.00 56.30 52.86 1ilo h ASN 20 Cb 1.24 -0.13 0.00 0.00 -2.08 0.00 0.00 38.32 37.34 1ilo h ASN 20 CO 0.12 1.09 -0.01 0.00 -2.08 0.00 0.00 177.43 176.55 1ilo h ALA 21 N 0.88 -0.04 -0.56 4.14 0.00 -0.16 0.34 119.26 123.86 1ilo h ALA 21 Ca -0.05 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1ilo h ALA 21 Cb 1.45 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1ilo h ALA 21 CO 0.14 -0.37 0.37 -0.09 0.00 0.00 0.00 179.25 179.30 1ilo h ARG 22 N -0.36 0.73 0.01 0.00 2.43 -1.60 0.50 114.38 116.10 1ilo h ARG 22 Ca -0.00 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1ilo h ARG 22 Cb 0.33 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1ilo h ARG 22 CO 0.01 0.49 -0.00 1.49 -1.51 0.00 0.00 179.97 180.44 1ilo h GLU 23 N 0.76 -0.01 0.16 0.20 4.57 -1.52 -2.79 114.58 115.94 1ilo h GLU 23 Ca 0.21 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.38 1ilo h GLU 23 Cb -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.51 1ilo h GLU 23 CO -0.05 0.62 -0.08 0.00 -1.18 0.00 0.00 179.01 178.32 1ilo h ALA 24 N 0.34 -0.22 -0.00 2.92 0.00 -0.26 0.82 119.26 122.85 1ilo h ALA 24 Ca -0.00 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1ilo h ALA 24 Cb 0.63 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.46 1ilo h ALA 24 CO 0.00 -0.56 -0.30 -0.24 0.00 0.00 0.00 179.25 178.15 1ilo h VAL 25 N -0.33 0.34 -0.19 0.00 3.04 -0.12 0.82 116.25 119.81 1ilo h VAL 25 Ca -0.02 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.63 1ilo h VAL 25 Cb 0.26 0.34 -0.01 0.00 -2.01 0.00 0.00 31.29 29.88 1ilo h VAL 25 CO 0.04 0.00 -0.04 0.11 -1.01 0.00 0.00 177.57 176.67 1ilo h LYS 26 N -0.45 0.36 -0.42 4.17 1.57 -1.12 -2.96 116.57 117.72 1ilo h LYS 26 Ca 0.06 -0.13 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1ilo h LYS 26 Cb 0.53 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 1ilo h LYS 26 CO -0.25 0.61 0.24 1.49 -0.57 0.00 0.00 179.45 180.96 1ilo h GLU 27 N 0.07 0.46 -0.15 3.15 4.22 0.94 -0.93 114.58 122.36 1ilo h GLU 27 Ca 0.05 -0.03 0.04 0.00 0.08 0.00 0.00 59.36 59.50 1ilo h GLU 27 Cb 0.47 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1ilo h GLU 27 CO 0.02 0.31 0.43 1.25 -2.18 0.00 0.00 179.01 178.84 1ilo h LEU 28 N 0.48 0.00 0.00 1.64 7.12 0.66 -3.43 115.31 121.78 1ilo h LEU 28 Ca 0.17 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.18 1ilo h LEU 28 Cb 0.04 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.17 1ilo h LEU 28 CO -0.09 0.00 0.00 0.61 -0.13 0.00 0.00 178.44 178.83 1ilo n GLY 29 N -1.33 0.84 0.00 3.75 0.00 -0.38 -5.10 105.19 102.97 1ilo n GLY 29 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1ilo n GLY 29 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1ilo n ILE 30 N 0.00 0.00 -0.76 -0.61 3.06 -1.03 -5.03 119.36 114.99 1ilo n ILE 30 Ca 0.00 0.00 -0.30 0.00 -2.50 0.00 0.00 62.75 59.95 1ilo n ILE 30 Cb 0.00 0.00 0.19 0.00 0.54 0.00 0.00 39.64 40.37 1ilo n ILE 30 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1ilo s ASP 31 N 0.00 2.34 -0.00 9.51 -1.08 -1.26 -2.06 116.67 124.11 1ilo s ASP 31 Ca 0.00 1.78 -0.20 0.00 -0.52 0.00 0.00 52.55 53.61 1ilo s ASP 31 Cb 0.00 -2.39 0.04 0.00 -1.46 0.00 0.00 42.92 39.11 1ilo s ASP 31 CO 0.00 -3.40 0.44 0.00 0.52 0.00 0.00 175.17 172.74 1ilo s ALA 32 N -2.65 -1.13 -0.29 3.66 0.00 -1.26 0.12 121.76 120.22 1ilo s ALA 32 Ca 0.66 0.59 -0.04 0.00 0.00 0.00 0.00 51.96 53.18 1ilo s ALA 32 Cb -0.22 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.07 1ilo s ALA 32 CO 0.60 -0.35 0.02 -1.21 0.00 0.00 0.00 175.76 174.82 1ilo s GLU 33 N -1.66 2.83 -0.43 0.00 2.02 -0.17 -4.76 118.70 116.53 1ilo s GLU 33 Ca -0.10 -1.01 -0.15 0.00 0.02 0.00 0.00 54.97 53.72 1ilo s GLU 33 Cb -0.02 -3.22 0.03 0.00 0.10 0.00 0.00 34.13 31.02 1ilo s GLU 33 CO 0.04 -0.49 0.33 -0.06 0.02 0.00 0.00 175.26 175.10 1ilo s PHE 34 N 1.38 3.24 -0.35 1.61 0.40 -1.25 -0.57 117.98 122.44 1ilo s PHE 34 Ca -0.00 -0.66 -0.08 0.00 -0.60 0.00 0.00 56.93 55.58 1ilo s PHE 34 Cb -0.18 -2.75 0.03 0.00 0.51 0.00 0.00 43.02 40.64 1ilo s PHE 34 CO -0.00 -0.65 0.15 -1.21 0.70 0.00 0.00 175.22 174.20 1ilo s GLU 35 N 1.69 2.76 0.10 0.44 2.02 -0.50 -4.98 118.70 120.23 1ilo s GLU 35 Ca 0.05 -1.10 -0.25 0.00 0.02 0.00 0.00 54.97 53.69 1ilo s GLU 35 Cb -0.20 -3.57 -0.06 0.00 0.10 0.00 0.00 34.13 30.40 1ilo s GLU 35 CO 0.09 -0.65 0.77 0.21 0.02 0.00 0.00 175.26 175.70 1ilo s LYS 36 N 1.48 4.52 0.33 1.61 2.20 -1.26 -2.76 119.74 125.86 1ilo s LYS 36 Ca 0.00 1.11 0.09 0.00 -0.36 0.00 0.00 55.97 56.81 1ilo s LYS 36 Cb -0.19 -3.32 -0.05 0.00 -1.51 0.00 0.00 37.83 32.76 1ilo s LYS 36 CO 0.04 0.40 0.09 0.96 -0.36 0.00 0.00 175.35 176.49 1ilo s ILE 37 N -0.51 2.97 -0.40 5.43 -0.00 -1.11 -4.96 121.20 122.62 1ilo s ILE 37 Ca 0.37 -1.80 0.06 0.00 -0.00 0.00 0.00 60.65 59.29 1ilo s ILE 37 Cb -0.22 -2.91 0.21 0.00 -0.00 0.00 0.00 42.46 39.54 1ilo s ILE 37 CO 0.24 -0.21 0.43 2.29 -0.00 0.00 0.00 174.94 177.70 1ilo n LYS 38 N -1.06 0.43 0.00 0.37 2.85 -1.26 -4.18 118.16 115.31 1ilo n LYS 38 Ca -0.04 -3.15 0.00 0.00 -1.05 0.00 0.00 58.31 54.07 1ilo n LYS 38 Cb 0.61 -1.46 0.00 0.00 -0.65 0.00 0.00 35.03 33.53 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 2.19 0.00 0.15 -1.58 -0.58 -1.26 -4.98 120.64 114.58 1ilo n GLU 39 Ca 0.26 0.00 0.16 0.00 -0.42 0.00 0.00 57.16 57.15 1ilo n GLU 39 Cb 0.51 0.00 0.73 0.00 -0.57 0.00 0.00 31.44 32.10 1ilo n GLU 39 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ilo h MET 40 N 0.00 0.00 -0.91 3.49 -0.00 -1.97 0.23 114.93 115.77 1ilo h MET 40 Ca 0.00 0.00 0.22 0.00 -0.00 0.00 0.00 59.70 59.92 1ilo h MET 40 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 31.54 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 0.29 0.50 -0.10 3.32 -1.99 1.24 116.42 119.69 1ilo h ASP 41 Ca 0.12 0.03 -0.29 0.00 0.02 0.00 0.00 57.03 56.91 1ilo h ASP 41 Cb 0.53 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.03 1ilo h ASP 41 CO -0.00 0.11 -1.59 1.56 -1.72 0.00 0.00 179.24 177.59 1ilo h GLN 42 N 0.28 0.11 0.04 3.56 7.50 -0.95 -3.26 115.11 122.39 1ilo h GLN 42 Ca 0.46 -0.19 -0.00 0.00 0.50 0.00 0.00 58.65 59.42 1ilo h GLN 42 Cb 1.35 0.07 0.00 0.00 0.05 0.00 0.00 27.48 28.95 1ilo h GLN 42 CO -0.14 0.85 -0.02 -0.84 -1.50 0.00 0.00 178.83 177.19 1ilo h ILE 43 N 0.03 1.33 -0.73 2.54 3.07 0.45 -3.21 117.51 120.99 1ilo h ILE 43 Ca -0.25 -1.25 0.07 0.00 1.55 0.00 0.00 64.86 64.98 1ilo h ILE 43 Cb 1.98 2.15 -0.05 0.00 -0.27 0.00 0.00 36.82 40.64 1ilo h ILE 43 CO 0.11 0.31 0.48 0.17 -1.05 0.00 0.00 178.15 178.18 1ilo h LEU 44 N -0.61 0.65 -2.03 0.16 -0.00 0.11 0.85 115.31 114.44 1ilo h LEU 44 Ca -0.01 0.01 0.10 0.00 -0.00 0.00 0.00 57.88 57.98 1ilo h LEU 44 Cb 0.55 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.07 1ilo h LEU 44 CO 0.01 0.41 0.39 -0.33 -0.00 0.00 0.00 178.44 178.92 1ilo h GLU 45 N 0.73 0.00 0.06 0.17 4.39 -1.59 0.48 114.58 118.83 1ilo h GLU 45 Ca 0.32 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.90 1ilo h GLU 45 Cb 0.31 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1ilo h GLU 45 CO -0.11 0.00 -0.49 0.00 -1.16 0.00 0.00 179.01 177.25 1ilo h ALA 46 N 1.54 -0.03 0.00 3.43 0.00 -0.91 -3.49 119.26 119.81 1ilo h ALA 46 Ca 0.16 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ilo h ALA 46 Cb 0.94 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1ilo h ALA 46 CO -0.00 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.89 1ilo n GLY 47 N 1.46 1.47 3.76 0.00 0.00 0.16 -4.73 105.19 107.31 1ilo n GLY 47 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 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 3.33 -0.01 0.99 -0.00 -1.26 -4.97 118.68 116.76 1ilo s LEU 48 Ca 0.00 2.01 0.08 0.00 -0.00 0.00 0.00 54.13 56.22 1ilo s LEU 48 Cb 0.00 -4.55 -0.11 0.00 -0.00 0.00 0.00 46.19 41.53 1ilo s LEU 48 CO 0.00 -1.76 0.23 0.41 -0.00 0.00 0.00 176.35 175.23 1ilo n THR 49 N -2.61 0.00 -2.40 5.48 -1.04 -1.26 -4.34 114.28 108.10 1ilo n THR 49 Ca 0.10 -0.23 -0.23 0.00 -2.04 0.00 0.00 64.05 61.65 1ilo n THR 49 Cb 0.52 0.58 0.13 0.00 -1.82 0.00 0.00 70.33 69.74 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 -1.55 -0.24 -0.03 2.41 0.00 -1.26 -5.04 120.51 114.80 1ilo n ALA 50 Ca -0.00 -1.79 -0.01 0.00 0.00 0.00 0.00 53.44 51.64 1ilo n ALA 50 Cb 0.17 0.20 -0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 -4.79 0.00 4.07 -1.92 -3.39 115.31 109.29 1ilo h LEU 51 Ca -0.34 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.53 1ilo h LEU 51 Cb 1.14 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.86 1ilo h LEU 51 CO 0.32 0.36 0.47 -2.65 -1.08 0.00 0.00 178.44 175.86 1ilo n PRO 52 N -3.68 0.85 -2.76 1.13 -0.02 -1.19 -3.97 135.00 125.35 1ilo n PRO 52 Ca -0.02 -0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 60.55 1ilo n PRO 52 Cb 0.06 -1.78 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 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 2.84 1.62 -0.40 -1.23 0.00 -1.12 -3.51 107.32 105.52 1ilo s GLY 53 Ca 0.25 -0.21 -0.10 0.00 0.00 0.00 0.00 44.72 44.67 1ilo s GLY 53 CO -0.00 2.06 0.23 1.08 0.00 0.00 0.00 173.10 176.46 1ilo s LEU 54 N 3.35 4.93 -0.24 0.66 2.01 0.36 -1.34 118.68 128.42 1ilo s LEU 54 Ca 0.40 -1.29 -0.12 0.00 0.01 0.00 0.00 54.13 53.13 1ilo s LEU 54 Cb -0.13 -1.99 -0.05 0.00 0.01 0.00 0.00 46.19 44.03 1ilo s LEU 54 CO 0.14 -0.47 0.24 0.00 1.01 0.00 0.00 176.35 177.27 1ilo s ALA 55 N 1.47 3.58 -0.06 4.21 0.00 -0.94 -2.13 121.76 127.89 1ilo s ALA 55 Ca 0.02 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1ilo s ALA 55 Cb -0.21 -2.47 -0.02 0.00 0.00 0.00 0.00 23.12 20.42 1ilo s ALA 55 CO 0.04 -0.34 -0.15 0.14 0.00 0.00 0.00 175.76 175.45 1ilo s VAL 56 N 1.37 3.02 -0.63 0.00 -7.23 -1.10 0.94 120.40 116.76 1ilo s VAL 56 Ca 0.11 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.54 1ilo s VAL 56 Cb -0.14 -2.19 0.00 0.00 0.56 0.00 0.00 36.38 34.61 1ilo s VAL 56 CO 0.07 0.58 0.00 -0.67 -0.31 0.00 0.00 175.10 174.78 1ilo n ASP 57 N 2.43 -2.48 -1.28 4.85 2.03 0.11 0.11 116.55 122.32 1ilo n ASP 57 Ca -0.17 0.29 -0.07 0.00 0.52 0.00 0.00 54.79 55.36 1ilo n ASP 57 Cb 0.52 -2.24 0.02 0.00 -0.72 0.00 0.00 41.12 38.70 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 -0.55 0.40 2.85 0.27 0.00 -1.26 -5.03 105.19 101.87 1ilo n GLY 58 Ca -0.08 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 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 -5.14 0.37 0.13 1.61 2.02 0.29 -5.10 118.70 112.88 1ilo s GLU 59 Ca 0.14 0.10 -0.34 0.00 0.02 0.00 0.00 54.97 54.88 1ilo s GLU 59 Cb -0.06 -0.48 -0.17 0.00 0.10 0.00 0.00 34.13 33.52 1ilo s GLU 59 CO 0.17 -0.96 1.11 1.28 0.02 0.00 0.00 175.26 176.88 1ilo n LEU 60 N 5.34 0.99 0.00 1.80 7.99 -1.26 -2.73 117.00 129.13 1ilo n LEU 60 Ca -0.01 1.14 0.00 0.00 -0.01 0.00 0.00 56.01 57.13 1ilo n LEU 60 Cb 0.48 -1.13 0.00 0.00 -0.11 0.00 0.00 43.42 42.66 1ilo n LEU 60 CO 0.00 -1.53 -0.11 1.17 -1.51 0.00 0.00 177.39 175.42 1ilo n LYS 61 N 1.77 3.51 -3.34 3.23 3.00 -0.91 -4.90 118.16 120.52 1ilo n LYS 61 Ca 0.17 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.43 1ilo n LYS 61 Cb 0.21 -0.50 -0.06 0.00 0.00 0.00 0.00 35.03 34.68 1ilo n LYS 61 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1ilo s ILE 62 N -0.52 -0.74 0.01 3.15 1.01 -1.21 -5.00 121.20 117.89 1ilo s ILE 62 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 60.65 60.54 1ilo s ILE 62 Cb 0.00 -0.86 0.00 0.00 0.01 0.00 0.00 42.46 41.61 1ilo s ILE 62 CO 0.00 -0.06 0.17 0.00 0.00 0.00 0.00 174.94 175.05 1ilo s MET 63 N 2.66 0.55 0.00 2.79 0.23 -1.23 0.14 119.30 124.44 1ilo s MET 63 Ca 0.13 -0.42 0.00 0.00 -1.03 0.00 0.00 55.69 54.37 1ilo s MET 63 Cb -0.15 0.23 0.00 0.00 -1.53 0.00 0.00 34.83 33.38 1ilo s MET 63 CO -0.17 -0.14 0.00 0.41 -2.03 0.00 0.00 175.02 173.09 1ilo n GLY 64 N 1.28 1.73 0.00 3.16 0.00 -1.24 -4.88 105.19 105.23 1ilo n GLY 64 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.66 1.61 0.63 -1.26 -4.87 116.66 109.11 1ilo n ARG 65 Ca 0.00 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.51 1ilo n ARG 65 Cb 0.00 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 32.91 1ilo n ARG 65 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1ilo n VAL 66 N 0.00 2.17 -3.21 5.15 0.31 -1.26 -4.96 118.33 116.53 1ilo n VAL 66 Ca 0.00 -0.50 -0.37 0.00 -0.01 0.00 0.00 64.34 63.46 1ilo n VAL 66 Cb 0.00 -1.40 -0.06 0.00 -0.91 0.00 0.00 33.84 31.47 1ilo n VAL 66 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ilo s ALA 67 N -1.14 3.52 0.79 3.52 0.00 -1.26 -4.97 121.76 122.22 1ilo s ALA 67 Ca 0.58 0.08 -0.13 0.00 0.00 0.00 0.00 51.96 52.49 1ilo s ALA 67 Cb -0.58 -2.70 0.07 0.00 0.00 0.00 0.00 23.12 19.91 1ilo s ALA 67 CO 0.60 0.38 1.16 0.45 0.00 0.00 0.00 175.76 178.35 1ilo s SER 68 N -1.39 3.93 0.53 0.00 0.15 -1.26 -4.61 113.70 111.05 1ilo s SER 68 Ca 0.35 2.19 0.29 0.00 0.70 0.00 0.00 55.95 59.48 1ilo s SER 68 Cb -0.18 -2.57 1.43 0.00 -1.71 0.00 0.00 66.02 62.99 1ilo s SER 68 CO 0.21 -2.43 1.92 0.07 1.20 0.00 0.00 173.24 174.20 1ilo h LYS 69 N -0.89 0.03 -0.57 5.44 5.09 -1.97 0.63 116.57 124.33 1ilo h LYS 69 Ca -0.45 -0.00 -0.05 0.00 0.09 0.00 0.00 60.65 60.23 1ilo h LYS 69 Cb 1.27 -0.01 -0.02 0.00 0.10 0.00 0.00 32.23 33.57 1ilo h LYS 69 CO 0.48 0.02 0.15 1.49 -2.09 0.00 0.00 179.45 179.50 1ilo h GLU 70 N 0.03 0.90 -0.45 0.07 4.22 -2.00 -2.10 114.58 115.26 1ilo h GLU 70 Ca 0.38 -0.21 -0.09 0.00 0.08 0.00 0.00 59.36 59.52 1ilo h GLU 70 Cb 1.48 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 1ilo h GLU 70 CO -0.02 0.83 -0.09 1.49 -2.18 0.00 0.00 179.01 179.05 1ilo h GLU 71 N 0.81 0.85 0.25 1.92 4.57 -1.22 -1.85 114.58 119.92 1ilo h GLU 71 Ca 0.18 -0.32 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 1ilo h GLU 71 Cb 0.32 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 1ilo h GLU 71 CO -0.00 0.95 -0.17 0.82 -1.18 0.00 0.00 179.01 179.43 1ilo h ILE 72 N 0.69 0.64 -0.39 2.32 1.08 -1.30 0.28 117.51 120.84 1ilo h ILE 72 Ca 0.12 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.57 1ilo h ILE 72 Cb 0.62 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 34.99 1ilo h ILE 72 CO 0.04 0.00 0.18 0.50 -0.69 0.00 0.00 178.15 178.18 1ilo h LYS 73 N -0.41 0.54 -0.01 2.37 1.63 -1.39 0.02 116.57 119.31 1ilo h LYS 73 Ca -0.02 -0.06 -0.15 0.00 -0.85 0.00 0.00 60.65 59.57 1ilo h LYS 73 Cb 0.35 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 1ilo h LYS 73 CO 0.01 0.43 -0.70 -0.22 -3.45 0.00 0.00 179.45 175.52 1ilo h LYS 74 N 0.54 0.07 0.01 1.90 1.63 -0.86 0.21 116.57 120.07 1ilo h LYS 74 Ca 0.14 -0.06 -0.24 0.00 -0.85 0.00 0.00 60.65 59.64 1ilo h LYS 74 Cb 0.07 0.01 0.01 0.00 -0.60 0.00 0.00 32.23 31.72 1ilo h LYS 74 CO -0.02 0.74 -0.98 0.82 -3.45 0.00 0.00 179.45 176.56 1ilo h ILE 75 N 0.05 1.37 0.08 2.00 1.08 0.42 -3.26 117.51 119.25 1ilo h ILE 75 Ca -0.01 -2.43 -0.26 0.00 -0.39 0.00 0.00 64.86 61.78 1ilo h ILE 75 Cb 1.24 2.44 -0.01 0.00 -3.07 0.00 0.00 36.82 37.41 1ilo h ILE 75 CO 0.10 0.73 -1.20 -0.07 -0.69 0.00 0.00 178.15 177.02 1ilo h LEU 76 N 0.26 0.27 0.00 1.44 -0.00 -0.99 -3.51 115.31 112.79 1ilo h LEU 76 Ca -0.10 -0.30 0.00 0.00 -0.00 0.00 0.00 57.88 57.49 1ilo h LEU 76 Cb 1.63 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 42.20 1ilo h LEU 76 CO 0.18 1.24 0.00 -1.20 -0.00 0.00 0.00 178.44 178.65