#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 3.66 -0.62 0.03 1.00 -0.76 -4.76 119.30 117.85 1ilo s MET 2 Ca 0.00 0.37 -0.27 0.00 0.00 0.00 0.00 55.69 55.79 1ilo s MET 2 Cb 0.00 -3.89 -0.01 0.00 0.00 0.00 0.00 34.83 30.93 1ilo s MET 2 CO 0.00 -1.20 1.72 0.15 0.00 0.00 0.00 175.02 175.69 1ilo s LYS 3 N 3.87 2.81 -0.35 2.03 1.02 -1.26 -1.66 119.74 126.19 1ilo s LYS 3 Ca 0.40 0.48 -0.13 0.00 0.02 0.00 0.00 55.97 56.74 1ilo s LYS 3 Cb -0.10 -4.32 -0.01 0.00 -0.52 0.00 0.00 37.83 32.88 1ilo s LYS 3 CO 0.26 -2.53 0.26 0.42 -0.92 0.00 0.00 175.35 172.83 1ilo s ILE 4 N 8.16 5.28 -0.28 2.17 1.09 -0.56 -2.65 121.20 134.41 1ilo s ILE 4 Ca 0.61 -0.26 -0.10 0.00 -1.10 0.00 0.00 60.65 59.80 1ilo s ILE 4 Cb -0.12 -3.75 -0.04 0.00 -1.06 0.00 0.00 42.46 37.49 1ilo s ILE 4 CO 0.20 -0.05 0.16 -1.10 -0.10 0.00 0.00 174.94 174.05 1ilo s GLN 5 N 1.73 3.84 -0.47 2.79 1.11 -0.67 -2.73 119.66 125.25 1ilo s GLN 5 Ca 0.06 -0.38 -0.11 0.00 0.01 0.00 0.00 55.36 54.93 1ilo s GLN 5 Cb -0.18 -3.58 0.11 0.00 -1.01 0.00 0.00 33.01 28.35 1ilo s GLN 5 CO 0.11 -0.20 0.37 0.42 0.01 0.00 0.00 175.29 175.99 1ilo s ILE 6 N 1.72 4.54 -0.57 1.08 -1.09 -1.14 -2.53 121.20 123.21 1ilo s ILE 6 Ca 0.07 -1.56 -0.21 0.00 -2.23 0.00 0.00 60.65 56.71 1ilo s ILE 6 Cb -0.16 -3.89 0.06 0.00 -1.58 0.00 0.00 42.46 36.89 1ilo s ILE 6 CO 0.09 -0.72 0.81 -0.31 -1.23 0.00 0.00 174.94 173.58 1ilo s TYR 7 N 1.46 2.87 0.00 3.97 2.02 -0.37 -1.22 117.35 126.08 1ilo s TYR 7 Ca 0.04 -0.47 0.00 0.00 -0.37 0.00 0.00 57.07 56.27 1ilo s TYR 7 Cb -0.26 -3.96 0.00 0.00 -0.40 0.00 0.00 41.96 37.34 1ilo s TYR 7 CO 0.01 -1.32 0.00 0.41 -1.57 0.00 0.00 175.55 173.08 1ilo n GLY 8 N 5.22 -1.30 3.12 0.71 0.00 -1.26 -2.94 105.19 108.74 1ilo n GLY 8 Ca -0.04 0.44 -0.00 0.00 0.00 0.00 0.00 46.02 46.42 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 0.00 -1.74 0.00 2.61 5.66 -1.22 -3.93 114.28 115.66 1ilo n THR 9 Ca 0.00 0.30 0.00 0.00 -3.05 0.00 0.00 64.05 61.30 1ilo n THR 9 Cb 0.00 -2.84 0.00 0.00 -1.55 0.00 0.00 70.33 65.94 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 1.90 2.62 0.08 1.09 0.00 -1.26 -4.69 105.19 104.94 1ilo n GLY 10 Ca -0.00 -0.73 -0.09 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.62 2.88 -1.49 0.00 0.00 -1.26 -4.99 121.76 114.27 1ilo s ALA 12 Ca -0.05 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.04 1ilo s ALA 12 Cb 0.08 -1.30 0.00 0.00 0.00 0.00 0.00 23.12 21.91 1ilo s ALA 12 CO 0.82 0.40 0.60 0.09 0.00 0.00 0.00 175.76 177.68 1ilo n ASN 13 N 2.89 0.41 0.34 0.00 5.03 -1.26 -3.40 115.26 119.27 1ilo n ASN 13 Ca -0.18 -1.62 0.20 0.00 0.87 0.00 0.00 54.58 53.86 1ilo n ASN 13 Cb 0.53 -0.21 1.09 0.00 -1.02 0.00 0.00 39.78 40.17 1ilo n ASN 13 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ilo h GLN 15 N 0.00 0.00 0.64 0.00 -0.00 -1.97 -2.48 115.11 111.31 1ilo h GLN 15 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.62 1ilo h GLN 15 Cb 0.22 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 27.70 1ilo h GLN 15 CO -0.00 0.00 -0.31 0.52 -0.00 0.00 0.00 178.83 179.04 1ilo h MET 16 N 0.00 -0.83 0.00 0.06 2.86 -1.64 -2.90 114.93 112.48 1ilo h MET 16 Ca 0.01 0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 1ilo h MET 16 Cb 0.26 0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.11 1ilo h MET 16 CO -0.00 -0.56 -0.05 1.25 1.06 0.00 0.00 176.91 178.61 1ilo h LEU 17 N -0.99 0.00 0.15 1.22 5.85 -1.73 -2.88 115.31 116.92 1ilo h LEU 17 Ca -0.09 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.64 1ilo h LEU 17 Cb 0.66 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1ilo h LEU 17 CO 0.15 0.05 -0.24 -0.08 -0.34 0.00 0.00 178.44 177.98 1ilo h GLU 18 N 0.00 -0.45 -0.21 1.25 4.81 -1.25 0.30 114.58 119.03 1ilo h GLU 18 Ca -0.00 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1ilo h GLU 18 Cb 0.24 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1ilo h GLU 18 CO 0.01 -0.30 0.02 -0.22 -0.73 0.00 0.00 179.01 177.79 1ilo h LYS 19 N -0.46 0.36 -0.16 1.92 3.64 -1.35 -2.58 116.57 117.94 1ilo h LYS 19 Ca 0.02 -0.10 0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1ilo h LYS 19 Cb 0.47 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 1ilo h LYS 19 CO -0.11 0.53 -0.12 -0.91 -2.27 0.00 0.00 179.45 176.56 1ilo h ASN 20 N 0.15 -0.40 -0.79 4.20 2.35 -1.37 -1.82 115.58 117.90 1ilo h ASN 20 Ca 0.06 0.08 0.09 0.00 -0.55 0.00 0.00 56.30 55.98 1ilo h ASN 20 Cb 0.35 0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.87 1ilo h ASN 20 CO 0.01 -0.16 0.52 0.00 -1.65 0.00 0.00 177.43 176.14 1ilo h ALA 21 N 0.98 1.72 -0.31 -0.83 0.00 -0.36 -1.01 119.26 119.44 1ilo h ALA 21 Ca 0.10 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1ilo h ALA 21 Cb 0.28 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1ilo h ALA 21 CO -0.24 0.13 0.10 0.00 0.00 0.00 0.00 179.25 179.24 1ilo h ARG 22 N 0.77 0.23 0.01 0.00 3.08 -0.91 0.46 114.38 118.01 1ilo h ARG 22 Ca 0.36 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.39 1ilo h ARG 22 Cb 0.38 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1ilo h ARG 22 CO -0.13 0.15 -0.00 1.49 -1.07 0.00 0.00 179.97 180.40 1ilo h GLU 23 N 0.24 -0.01 0.11 0.04 4.81 -1.24 -2.92 114.58 115.60 1ilo h GLU 23 Ca 0.14 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1ilo h GLU 23 Cb 0.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1ilo h GLU 23 CO -0.15 0.59 -0.05 0.00 -0.73 0.00 0.00 179.01 178.67 1ilo h ALA 24 N 0.34 -0.15 0.06 2.92 0.00 -1.12 1.22 119.26 122.52 1ilo h ALA 24 Ca -0.00 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ilo h ALA 24 Cb 0.61 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1ilo h ALA 24 CO 0.00 -0.58 -0.32 -0.24 0.00 0.00 0.00 179.25 178.11 1ilo h VAL 25 N -0.15 0.31 0.02 0.00 3.04 -0.20 0.44 116.25 119.72 1ilo h VAL 25 Ca -0.02 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.67 1ilo h VAL 25 Cb 0.12 0.31 0.00 0.00 -2.01 0.00 0.00 31.29 29.71 1ilo h VAL 25 CO 0.02 0.00 -0.01 0.11 -1.01 0.00 0.00 177.57 176.68 1ilo h LYS 26 N -0.51 -0.03 -0.66 4.17 1.57 -1.17 -2.60 116.57 117.34 1ilo h LYS 26 Ca 0.05 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.95 1ilo h LYS 26 Cb 0.56 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.79 1ilo h LYS 26 CO -0.23 0.33 0.21 1.49 -0.57 0.00 0.00 179.45 180.68 1ilo h GLU 27 N -0.39 0.35 0.00 3.15 4.81 0.17 0.37 114.58 123.04 1ilo h GLU 27 Ca -0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1ilo h GLU 27 Cb 0.37 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.67 1ilo h GLU 27 CO 0.01 0.23 0.34 -0.07 -0.73 0.00 0.00 179.01 178.79 1ilo h LEU 28 N 0.36 0.00 0.00 1.64 -0.00 -0.11 -3.43 115.31 113.76 1ilo h LEU 28 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.23 1ilo h LEU 28 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.18 1ilo h LEU 28 CO -0.39 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 178.66 1ilo n GLY 29 N -1.23 1.71 2.84 0.83 0.00 0.13 -5.10 105.19 104.36 1ilo n GLY 29 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.44 0.92 -0.61 -1.09 -0.92 -5.03 121.20 112.03 1ilo s ILE 30 Ca 0.00 -0.07 -0.11 0.00 -2.23 0.00 0.00 60.65 58.24 1ilo s ILE 30 Cb 0.00 -0.71 0.15 0.00 -1.58 0.00 0.00 42.46 40.31 1ilo s ILE 30 CO 0.00 -0.15 1.10 -1.81 -1.23 0.00 0.00 174.94 172.85 1ilo s ASP 31 N 2.42 3.07 0.00 3.58 1.01 -1.26 -1.90 116.67 123.59 1ilo s ASP 31 Ca 0.09 1.82 0.00 0.00 0.71 0.00 0.00 52.55 55.17 1ilo s ASP 31 Cb -0.15 -2.41 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1ilo s ASP 31 CO -0.13 -2.94 0.00 0.00 0.21 0.00 0.00 175.17 172.30 1ilo n ALA 32 N -4.11 0.00 -3.60 5.23 0.00 -1.26 0.15 120.51 116.92 1ilo n ALA 32 Ca 0.09 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.32 1ilo n ALA 32 Cb 0.53 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.83 1ilo n ALA 32 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1ilo s GLU 33 N -1.80 0.07 -0.38 0.00 -1.05 -0.67 -4.72 118.70 110.16 1ilo s GLU 33 Ca 0.00 0.23 -0.10 0.00 -0.15 0.00 0.00 54.97 54.96 1ilo s GLU 33 Cb 0.00 -1.07 0.04 0.00 -0.44 0.00 0.00 34.13 32.66 1ilo s GLU 33 CO 0.00 -0.53 0.20 -0.06 0.95 0.00 0.00 175.26 175.82 1ilo s PHE 34 N 2.24 3.26 -0.04 4.83 0.40 -1.26 -1.50 117.98 125.91 1ilo s PHE 34 Ca 0.04 -1.15 0.04 0.00 -0.60 0.00 0.00 56.93 55.26 1ilo s PHE 34 Cb -0.14 -2.50 -0.00 0.00 0.51 0.00 0.00 43.02 40.89 1ilo s PHE 34 CO -0.08 -0.70 -0.15 -1.83 0.70 0.00 0.00 175.22 173.16 1ilo s GLU 35 N 1.50 1.59 0.55 0.44 -1.05 -1.11 -5.04 118.70 115.58 1ilo s GLU 35 Ca 0.01 -0.52 -0.15 0.00 -0.15 0.00 0.00 54.97 54.16 1ilo s GLU 35 Cb -0.20 -1.39 -0.06 0.00 -0.44 0.00 0.00 34.13 32.04 1ilo s GLU 35 CO 0.05 0.19 1.00 0.15 0.95 0.00 0.00 175.26 177.61 1ilo s LYS 36 N 0.14 3.79 -0.61 -4.83 3.01 -1.26 -2.86 119.74 117.11 1ilo s LYS 36 Ca -0.05 0.94 0.05 0.00 -1.01 0.00 0.00 55.97 55.90 1ilo s LYS 36 Cb -0.11 -2.11 0.17 0.00 -1.01 0.00 0.00 37.83 34.77 1ilo s LYS 36 CO 0.02 -0.41 0.44 0.96 0.51 0.00 0.00 175.35 176.87 1ilo s ILE 37 N -2.73 2.10 -1.34 2.17 -0.00 -0.36 -4.85 121.20 116.20 1ilo s ILE 37 Ca 0.59 -3.76 -0.15 0.00 -0.00 0.00 0.00 60.65 57.32 1ilo s ILE 37 Cb -0.11 -2.39 0.08 0.00 -0.00 0.00 0.00 42.46 40.04 1ilo s ILE 37 CO 0.37 -1.07 1.88 1.17 -0.00 0.00 0.00 174.94 177.29 1ilo n LYS 38 N 2.26 3.15 0.00 0.37 3.00 -1.26 -4.25 118.16 121.43 1ilo n LYS 38 Ca 0.23 -3.15 0.00 0.00 -0.00 0.00 0.00 58.31 55.39 1ilo n LYS 38 Cb 0.39 -3.31 0.00 0.00 0.00 0.00 0.00 35.03 32.11 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 6.79 0.00 -0.09 1.64 -0.58 -1.26 -5.02 120.64 122.12 1ilo n GLU 39 Ca 0.48 0.00 0.20 0.00 -0.42 0.00 0.00 57.16 57.41 1ilo n GLU 39 Cb 0.42 0.00 0.63 0.00 -0.57 0.00 0.00 31.44 31.92 1ilo n GLU 39 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 1ilo h MET 40 N 0.00 0.15 -0.97 3.49 1.85 -1.97 0.32 114.93 117.79 1ilo h MET 40 Ca 0.00 -0.01 0.20 0.00 -0.61 0.00 0.00 59.70 59.28 1ilo h MET 40 Cb 0.00 -0.03 -0.09 0.00 0.43 0.00 0.00 31.60 31.91 1ilo h MET 40 CO 0.00 0.10 0.61 -0.44 -0.40 0.00 0.00 176.91 176.78 1ilo h ASP 41 N 0.15 0.64 0.45 1.39 5.19 -1.96 0.49 116.42 122.78 1ilo h ASP 41 Ca 0.33 0.07 -0.30 0.00 -0.62 0.00 0.00 57.03 56.51 1ilo h ASP 41 Cb 1.07 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 40.52 1ilo h ASP 41 CO -0.05 0.24 -1.63 1.56 -3.12 0.00 0.00 179.24 176.24 1ilo h GLN 42 N 0.63 0.15 0.51 3.56 1.08 -0.81 -3.18 115.11 117.05 1ilo h GLN 42 Ca 0.54 -0.26 -0.02 0.00 -1.45 0.00 0.00 58.65 57.45 1ilo h GLN 42 Cb 1.01 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 1ilo h GLN 42 CO -0.30 0.92 -0.26 0.82 -0.95 0.00 0.00 178.83 179.07 1ilo h ILE 43 N 0.04 0.47 -0.68 2.54 2.04 0.12 -2.71 117.51 119.33 1ilo h ILE 43 Ca -0.27 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 1ilo h ILE 43 Cb 2.00 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 38.52 1ilo h ILE 43 CO 0.12 0.00 0.25 0.17 0.00 0.00 0.00 178.15 178.69 1ilo h LEU 44 N -0.71 0.93 -2.24 1.44 -0.00 -0.34 -1.77 115.31 112.63 1ilo h LEU 44 Ca -0.07 -0.14 0.05 0.00 -0.00 0.00 0.00 57.88 57.72 1ilo h LEU 44 Cb 0.55 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 40.96 1ilo h LEU 44 CO 0.11 0.85 0.23 -0.08 -0.00 0.00 0.00 178.44 179.54 1ilo h GLU 45 N 0.99 0.00 -0.05 0.17 4.81 -1.49 0.27 114.58 119.27 1ilo h GLU 45 Ca 0.23 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.26 1ilo h GLU 45 Cb 0.22 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 1ilo h GLU 45 CO -0.02 0.00 -0.79 0.00 -0.73 0.00 0.00 179.01 177.48 1ilo h ALA 46 N 1.69 0.55 0.00 2.92 0.00 -1.00 -3.48 119.26 119.94 1ilo h ALA 46 Ca 0.08 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1ilo h ALA 46 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ilo h ALA 46 CO -0.00 0.79 0.00 0.41 0.00 0.00 0.00 179.25 180.45 1ilo n GLY 47 N 0.66 0.72 3.87 0.00 0.00 0.97 -4.50 105.19 106.91 1ilo n GLY 47 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 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 3.19 -0.08 0.99 -0.00 -1.26 -5.00 118.68 116.52 1ilo s LEU 48 Ca 0.00 1.41 0.07 0.00 -0.00 0.00 0.00 54.13 55.61 1ilo s LEU 48 Cb 0.00 -4.42 -0.10 0.00 -0.00 0.00 0.00 46.19 41.67 1ilo s LEU 48 CO 0.00 -0.97 0.03 1.07 -0.00 0.00 0.00 176.35 176.48 1ilo n THR 49 N -2.81 0.55 -1.54 5.48 5.66 -1.26 -4.64 114.28 115.72 1ilo n THR 49 Ca 0.06 -0.34 -0.23 0.00 -3.05 0.00 0.00 64.05 60.49 1ilo n THR 49 Cb 0.54 -0.79 0.17 0.00 -1.55 0.00 0.00 70.33 68.71 1ilo n THR 49 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ilo n ALA 50 N -2.30 -1.58 -0.05 1.79 0.00 -1.26 -5.03 120.51 112.08 1ilo n ALA 50 Ca -0.13 -1.36 -0.03 0.00 0.00 0.00 0.00 53.44 51.92 1ilo n ALA 50 Cb 0.76 -0.07 -0.01 0.00 0.00 0.00 0.00 19.45 20.13 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 -5.60 0.00 4.07 -1.90 -3.40 115.31 108.48 1ilo h LEU 51 Ca -0.34 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.38 1ilo h LEU 51 Cb 0.95 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.70 1ilo h LEU 51 CO 0.23 0.53 1.99 -2.65 -1.08 0.00 0.00 178.44 177.47 1ilo n PRO 52 N -4.05 1.35 -3.02 1.13 -0.02 -1.24 -4.36 135.00 124.79 1ilo n PRO 52 Ca -0.04 -1.10 -0.39 0.00 -2.02 0.00 0.00 63.50 59.94 1ilo n PRO 52 Cb 0.16 -2.27 -0.06 0.00 -0.02 0.00 0.00 33.50 31.30 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 3.91 2.88 -0.28 -1.23 0.00 -1.15 -3.82 107.32 107.63 1ilo s GLY 53 Ca 0.26 0.31 -0.00 0.00 0.00 0.00 0.00 44.72 45.29 1ilo s GLY 53 CO -0.02 0.84 0.06 -2.27 0.00 0.00 0.00 173.10 171.70 1ilo s LEU 54 N -1.05 2.50 -0.23 0.66 2.96 -1.16 -1.24 118.68 121.12 1ilo s LEU 54 Ca 0.35 -1.52 -0.10 0.00 -0.22 0.00 0.00 54.13 52.64 1ilo s LEU 54 Cb -0.22 -0.99 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 1ilo s LEU 54 CO 0.25 -0.36 0.14 0.00 -1.32 0.00 0.00 176.35 175.06 1ilo s ALA 55 N 1.51 3.56 -0.05 5.97 0.00 -1.05 -2.12 121.76 129.58 1ilo s ALA 55 Ca 0.06 -0.89 0.04 0.00 0.00 0.00 0.00 51.96 51.17 1ilo s ALA 55 Cb -0.18 -2.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.66 1ilo s ALA 55 CO -0.17 -0.17 -0.16 0.14 0.00 0.00 0.00 175.76 175.41 1ilo s VAL 56 N 1.00 2.93 -0.68 0.00 -7.23 -1.09 -1.67 120.40 113.66 1ilo s VAL 56 Ca 0.07 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 1ilo s VAL 56 Cb -0.13 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.67 1ilo s VAL 56 CO 0.04 0.59 0.00 0.47 -0.31 0.00 0.00 175.10 175.88 1ilo n ASP 57 N 2.40 -2.51 -0.84 4.85 8.00 -1.09 0.10 116.55 127.47 1ilo n ASP 57 Ca -0.17 0.28 -0.05 0.00 0.71 0.00 0.00 54.79 55.56 1ilo n ASP 57 Cb 0.52 -2.29 0.01 0.00 -0.02 0.00 0.00 41.12 39.34 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 0.39 2.70 0.44 0.00 -1.26 -5.03 105.19 101.91 1ilo n GLY 58 Ca -0.08 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.14 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 -4.74 0.24 0.13 1.61 2.56 0.29 -5.11 118.70 113.68 1ilo s GLU 59 Ca 0.06 -0.13 -0.34 0.00 0.00 0.00 0.00 54.97 54.56 1ilo s GLU 59 Cb -0.03 -0.97 -0.17 0.00 2.00 0.00 0.00 34.13 34.96 1ilo s GLU 59 CO 0.08 -0.90 1.13 -0.11 -0.56 0.00 0.00 175.26 174.89 1ilo n LEU 60 N 5.30 1.07 -0.00 2.70 -0.00 -1.26 -2.68 117.00 122.13 1ilo n LEU 60 Ca -0.04 1.14 0.00 0.00 -0.00 0.00 0.00 56.01 57.11 1ilo n LEU 60 Cb 0.46 -1.14 -0.01 0.00 -0.00 0.00 0.00 43.42 42.73 1ilo n LEU 60 CO 0.04 -1.49 -0.53 1.17 -0.00 0.00 0.00 177.39 176.58 1ilo n LYS 61 N 1.80 1.42 -3.62 1.96 3.00 -0.90 -4.91 118.16 116.91 1ilo n LYS 61 Ca 0.17 -0.01 -0.13 0.00 -0.00 0.00 0.00 58.31 58.34 1ilo n LYS 61 Cb 0.21 -1.04 -0.06 0.00 0.00 0.00 0.00 35.03 34.14 1ilo n LYS 61 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 1ilo s ILE 62 N -2.08 0.04 -0.11 3.15 -5.25 -1.25 -4.99 121.20 110.72 1ilo s ILE 62 Ca -0.01 -0.36 -0.05 0.00 -0.99 0.00 0.00 60.65 59.24 1ilo s ILE 62 Cb 0.01 -0.97 0.05 0.00 2.95 0.00 0.00 42.46 44.50 1ilo s ILE 62 CO 0.06 -0.20 0.25 -0.04 -1.79 0.00 0.00 174.94 173.22 1ilo s MET 63 N -2.51 0.21 0.00 0.37 -1.94 -1.26 -2.98 119.30 111.19 1ilo s MET 63 Ca -0.05 0.56 0.00 0.00 -1.71 0.00 0.00 55.69 54.49 1ilo s MET 63 Cb -0.01 -0.11 0.00 0.00 2.01 0.00 0.00 34.83 36.72 1ilo s MET 63 CO -0.02 -0.17 0.00 0.41 -0.01 0.00 0.00 175.02 175.22 1ilo n GLY 64 N 4.33 3.33 3.15 -0.03 0.00 -1.25 -4.89 105.19 109.84 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 -0.68 0.01 0.98 1.61 6.06 -1.25 -4.63 118.95 121.04 1ilo s ARG 65 Ca 0.00 0.01 -0.14 0.00 -2.50 0.00 0.00 55.73 53.10 1ilo s ARG 65 Cb 0.00 0.01 0.03 0.00 0.06 0.00 0.00 34.95 35.05 1ilo s ARG 65 CO 0.00 -0.01 0.23 1.33 -2.50 0.00 0.00 175.30 174.36 1ilo n VAL 66 N 5.28 0.00 -0.12 7.11 0.24 -1.25 -4.96 118.33 124.63 1ilo n VAL 66 Ca -0.09 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 61.98 1ilo n VAL 66 Cb 0.55 -0.56 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 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 -3.64 0.00 -2.61 2.33 0.00 -1.26 -4.96 120.51 110.37 1ilo n ALA 67 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.21 1ilo n ALA 67 Cb 0.55 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.90 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 -1.80 4.00 0.10 0.00 0.15 -1.26 -4.67 113.70 110.23 1ilo s SER 68 Ca 0.00 -1.36 -0.31 0.00 0.70 0.00 0.00 55.95 54.98 1ilo s SER 68 Cb 0.00 -0.29 -0.12 0.00 -1.71 0.00 0.00 66.02 63.90 1ilo s SER 68 CO 0.00 -0.52 1.61 0.50 1.20 0.00 0.00 173.24 176.03 1ilo h LYS 69 N 1.65 -0.68 -0.08 5.44 3.64 -1.97 -1.60 116.57 122.97 1ilo h LYS 69 Ca -0.44 0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.00 1ilo h LYS 69 Cb 1.25 0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 33.22 1ilo h LYS 69 CO 0.78 -0.46 0.05 1.49 -2.27 0.00 0.00 179.45 179.05 1ilo h GLU 70 N -0.71 0.07 -0.32 1.90 4.81 -1.99 -2.19 114.58 116.15 1ilo h GLU 70 Ca -0.01 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1ilo h GLU 70 Cb 0.66 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.01 1ilo h GLU 70 CO -0.10 0.05 0.17 1.49 -0.73 0.00 0.00 179.01 179.89 1ilo h GLU 71 N 0.07 0.46 0.41 1.92 4.57 -1.72 0.12 114.58 120.41 1ilo h GLU 71 Ca 0.03 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 1ilo h GLU 71 Cb 0.03 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.54 1ilo h GLU 71 CO -0.00 0.40 -0.21 0.82 -1.18 0.00 0.00 179.01 178.83 1ilo h ILE 72 N 0.39 0.57 -0.41 2.32 1.08 -0.71 0.81 117.51 121.56 1ilo h ILE 72 Ca 0.11 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.62 1ilo h ILE 72 Cb 0.08 0.57 -0.02 0.00 -3.07 0.00 0.00 36.82 34.38 1ilo h ILE 72 CO -0.02 0.00 0.28 0.50 -0.69 0.00 0.00 178.15 178.22 1ilo h LYS 73 N -0.57 0.41 -0.18 2.37 1.63 -1.45 0.30 116.57 119.08 1ilo h LYS 73 Ca -0.05 -0.02 -0.17 0.00 -0.85 0.00 0.00 60.65 59.55 1ilo h LYS 73 Cb 0.45 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 31.98 1ilo h LYS 73 CO 0.08 0.27 -0.60 -0.22 -3.45 0.00 0.00 179.45 175.53 1ilo h LYS 74 N 0.42 0.59 -0.00 1.90 3.64 -0.50 0.23 116.57 122.85 1ilo h LYS 74 Ca 0.17 -0.40 -0.25 0.00 -1.27 0.00 0.00 60.65 58.90 1ilo h LYS 74 Cb 0.16 0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1ilo h LYS 74 CO -0.04 1.02 -1.00 0.82 -2.27 0.00 0.00 179.45 177.98 1ilo h ILE 75 N 0.44 1.32 -0.01 2.00 2.04 0.21 -3.14 117.51 120.38 1ilo h ILE 75 Ca -0.00 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.54 1ilo h ILE 75 Cb 1.17 2.38 0.00 0.00 -0.74 0.00 0.00 36.82 39.63 1ilo h ILE 75 CO 0.12 0.71 0.00 0.18 0.00 0.00 0.00 178.15 179.15 1ilo n LEU 76 N -3.82 1.21 0.00 1.44 4.77 0.95 -5.10 117.00 116.46 1ilo n LEU 76 Ca -0.09 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 1ilo n LEU 76 Cb 0.86 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.95 1ilo n LEU 76 CO 0.54 0.20 0.23 -0.24 -1.33 0.00 0.00 177.39 176.80