#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 -0.23 0.03 -2.45 -0.07 -4.68 119.30 115.76 1ilo s MET 2 Ca 0.00 0.76 -0.29 0.00 -1.25 0.00 0.00 55.69 54.91 1ilo s MET 2 Cb 0.00 -3.84 -0.03 0.00 1.25 0.00 0.00 34.83 32.21 1ilo s MET 2 CO 0.00 -1.20 1.61 0.15 1.05 0.00 0.00 175.02 176.64 1ilo s LYS 3 N 4.15 3.78 -0.15 4.11 1.02 -1.26 -1.30 119.74 130.08 1ilo s LYS 3 Ca 0.47 1.64 0.01 0.00 0.02 0.00 0.00 55.97 58.10 1ilo s LYS 3 Cb -0.09 -4.04 0.02 0.00 -0.52 0.00 0.00 37.83 33.20 1ilo s LYS 3 CO 0.25 -1.31 -0.16 0.42 -0.92 0.00 0.00 175.35 173.63 1ilo s ILE 4 N 5.25 1.71 -0.16 2.17 1.09 -0.37 -0.66 121.20 130.23 1ilo s ILE 4 Ca 0.71 -0.73 -0.03 0.00 -1.10 0.00 0.00 60.65 59.51 1ilo s ILE 4 Cb -0.25 -1.58 -0.02 0.00 -1.06 0.00 0.00 42.46 39.56 1ilo s ILE 4 CO 0.29 0.48 -0.06 -1.10 -0.10 0.00 0.00 174.94 174.45 1ilo s GLN 5 N 1.36 3.55 -0.32 2.79 -0.21 -0.60 -1.94 119.66 124.29 1ilo s GLN 5 Ca 0.03 -0.58 -0.03 0.00 0.02 0.00 0.00 55.36 54.80 1ilo s GLN 5 Cb -0.13 -2.86 0.05 0.00 1.00 0.00 0.00 33.01 31.07 1ilo s GLN 5 CO -0.10 0.16 0.04 0.96 -2.12 0.00 0.00 175.29 174.23 1ilo s ILE 6 N 0.55 3.20 -0.28 1.08 -4.36 -1.11 -2.26 121.20 118.01 1ilo s ILE 6 Ca -0.04 -1.39 -0.17 0.00 -0.26 0.00 0.00 60.65 58.78 1ilo s ILE 6 Cb -0.15 -2.87 -0.03 0.00 1.25 0.00 0.00 42.46 40.67 1ilo s ILE 6 CO 0.03 -0.18 0.47 -0.31 0.24 0.00 0.00 174.94 175.19 1ilo s TYR 7 N 1.28 3.25 0.00 1.37 1.51 -0.09 -2.54 117.35 122.12 1ilo s TYR 7 Ca -0.03 0.49 0.00 0.00 -1.01 0.00 0.00 57.07 56.52 1ilo s TYR 7 Cb -0.20 -2.70 0.00 0.00 -0.11 0.00 0.00 41.96 38.95 1ilo s TYR 7 CO -0.00 -0.30 0.00 0.41 -1.11 0.00 0.00 175.55 174.54 1ilo n GLY 8 N 4.56 -2.10 3.02 0.71 0.00 -1.25 -1.91 105.19 108.22 1ilo n GLY 8 Ca -0.06 0.74 -0.11 0.00 0.00 0.00 0.00 46.02 46.59 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 -0.28 -9.69 -0.09 2.61 -1.04 -1.26 -4.70 114.28 99.83 1ilo n THR 9 Ca 0.00 0.53 0.00 0.00 -2.04 0.00 0.00 64.05 62.54 1ilo n THR 9 Cb 0.00 -6.57 0.00 0.00 -1.82 0.00 0.00 70.33 61.94 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 -0.63 0.51 5.00 3.41 0.00 -1.26 -4.82 105.19 107.39 1ilo n GLY 10 Ca 0.05 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1ilo n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ilo n ALA 12 N 0.00 0.89 0.82 0.00 0.00 -1.26 -4.82 120.51 116.14 1ilo n ALA 12 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1ilo n ALA 12 Cb 0.00 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.00 1ilo n ALA 12 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ilo n ASN 13 N 5.94 0.96 0.06 0.00 3.02 -1.26 -4.18 115.26 119.80 1ilo n ASN 13 Ca 0.22 -1.64 0.21 0.00 -0.03 0.00 0.00 54.58 53.34 1ilo n ASN 13 Cb 0.28 -0.41 0.73 0.00 -0.61 0.00 0.00 39.78 39.77 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 0.24 0.62 0.00 3.07 -1.98 0.37 115.11 117.42 1ilo h GLN 15 Ca 0.22 -0.03 -0.03 0.00 0.09 0.00 0.00 58.65 58.90 1ilo h GLN 15 Cb 1.21 -0.05 0.01 0.00 0.08 0.00 0.00 27.48 28.73 1ilo h GLN 15 CO -0.00 0.25 -0.30 0.52 0.09 0.00 0.00 178.83 179.40 1ilo h MET 16 N 0.24 -0.80 0.00 0.06 2.86 -1.07 -2.91 114.93 113.32 1ilo h MET 16 Ca 0.06 0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1ilo h MET 16 Cb 0.14 0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 1ilo h MET 16 CO 0.00 -0.53 -0.06 1.25 1.06 0.00 0.00 176.91 178.63 1ilo h LEU 17 N -0.96 0.00 -0.26 1.22 7.12 -1.67 -2.91 115.31 117.85 1ilo h LEU 17 Ca -0.08 0.00 0.03 0.00 0.13 0.00 0.00 57.88 57.95 1ilo h LEU 17 Cb 0.63 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.74 1ilo h LEU 17 CO 0.14 0.06 0.09 -0.08 -0.13 0.00 0.00 178.44 178.52 1ilo h GLU 18 N 0.00 0.20 -0.10 1.25 4.81 -0.80 0.50 114.58 120.44 1ilo h GLU 18 Ca -0.00 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 1ilo h GLU 18 Cb 0.43 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1ilo h GLU 18 CO 0.01 0.13 -0.21 -0.22 -0.73 0.00 0.00 179.01 177.99 1ilo h LYS 19 N 0.21 0.32 -0.66 1.92 3.64 -1.34 -2.84 116.57 117.81 1ilo h LYS 19 Ca 0.12 -0.21 0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1ilo h LYS 19 Cb 0.08 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1ilo h LYS 19 CO -0.12 0.80 0.44 -0.91 -2.27 0.00 0.00 179.45 177.39 1ilo h ASN 20 N -0.13 0.71 0.03 4.20 2.35 -1.33 -2.74 115.58 118.66 1ilo h ASN 20 Ca 0.00 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1ilo h ASN 20 Cb 0.80 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1ilo h ASN 20 CO 0.05 0.50 -0.01 0.00 -1.65 0.00 0.00 177.43 176.31 1ilo h ALA 21 N 1.61 -0.04 -0.88 -0.83 0.00 0.02 -1.32 119.26 117.81 1ilo h ALA 21 Ca 0.26 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.10 1ilo h ALA 21 Cb 0.01 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 1ilo h ALA 21 CO -0.07 -0.35 0.57 -0.09 0.00 0.00 0.00 179.25 179.32 1ilo h ARG 22 N -0.38 0.81 -0.02 0.00 2.43 -1.29 0.33 114.38 116.26 1ilo h ARG 22 Ca -0.00 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1ilo h ARG 22 Cb 0.36 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1ilo h ARG 22 CO 0.01 0.54 -0.15 1.05 -1.51 0.00 0.00 179.97 179.91 1ilo h GLU 23 N 0.84 0.13 0.08 0.20 4.11 -1.45 -2.85 114.58 115.64 1ilo h GLU 23 Ca 0.42 -0.12 -0.00 0.00 0.07 0.00 0.00 59.36 59.73 1ilo h GLU 23 Cb 0.46 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ilo h GLU 23 CO -0.18 0.81 -0.04 0.00 0.07 0.00 0.00 179.01 179.67 1ilo h ALA 24 N 0.32 -0.11 0.07 1.06 0.00 -0.84 0.79 119.26 120.55 1ilo h ALA 24 Ca -0.01 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1ilo h ALA 24 Cb 0.85 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 1ilo h ALA 24 CO 0.03 -0.46 -0.32 -0.24 0.00 0.00 0.00 179.25 178.26 1ilo h VAL 25 N -0.29 0.32 -0.03 0.00 3.04 -0.49 0.95 116.25 119.74 1ilo h VAL 25 Ca -0.01 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.67 1ilo h VAL 25 Cb 0.25 0.32 -0.00 0.00 -2.01 0.00 0.00 31.29 29.85 1ilo h VAL 25 CO 0.02 0.00 -0.00 0.11 -1.01 0.00 0.00 177.57 176.68 1ilo h LYS 26 N -0.51 0.05 -0.70 4.17 1.57 -1.09 -2.80 116.57 117.27 1ilo h LYS 26 Ca 0.04 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 1ilo h LYS 26 Cb 0.57 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.81 1ilo h LYS 26 CO -0.22 0.38 0.38 1.49 -0.57 0.00 0.00 179.45 180.92 1ilo h GLU 27 N -0.28 0.67 -0.15 3.15 4.57 0.78 0.10 114.58 123.43 1ilo h GLU 27 Ca 0.01 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.19 1ilo h GLU 27 Cb 0.36 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 1ilo h GLU 27 CO 0.00 0.45 0.38 1.25 -1.18 0.00 0.00 179.01 179.91 1ilo h LEU 28 N 0.69 0.00 0.00 1.64 5.85 0.98 -3.44 115.31 121.03 1ilo h LEU 28 Ca 0.32 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1ilo h LEU 28 Cb 0.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1ilo h LEU 28 CO -0.20 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.51 1ilo n GLY 29 N -1.32 0.92 0.00 3.75 0.00 0.31 -5.09 105.19 103.77 1ilo n GLY 29 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.06 -0.61 3.06 -0.95 -5.02 119.36 114.77 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 0.16 0.00 0.54 0.00 0.00 39.64 40.34 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 3.06 0.34 9.51 -1.08 -1.26 -1.76 116.67 125.47 1ilo s ASP 31 Ca 0.00 1.55 -0.00 0.00 -0.52 0.00 0.00 52.55 53.58 1ilo s ASP 31 Cb 0.00 -2.22 -0.01 0.00 -1.46 0.00 0.00 42.92 39.24 1ilo s ASP 31 CO 0.00 -2.91 0.42 0.00 0.52 0.00 0.00 175.17 173.20 1ilo s ALA 32 N -2.84 1.01 -0.25 3.66 0.00 -1.26 0.15 121.76 122.21 1ilo s ALA 32 Ca 0.64 -1.64 -0.01 0.00 0.00 0.00 0.00 51.96 50.96 1ilo s ALA 32 Cb -0.19 1.23 0.07 0.00 0.00 0.00 0.00 23.12 24.23 1ilo s ALA 32 CO 0.58 -0.76 0.02 -1.21 0.00 0.00 0.00 175.76 174.40 1ilo s GLU 33 N -3.18 1.06 -0.43 0.00 0.41 -0.42 -4.72 118.70 111.42 1ilo s GLU 33 Ca 0.33 -0.91 -0.16 0.00 -0.41 0.00 0.00 54.97 53.83 1ilo s GLU 33 Cb 0.00 -2.31 0.03 0.00 -1.78 0.00 0.00 34.13 30.07 1ilo s GLU 33 CO 0.21 -0.75 0.34 -0.06 -0.49 0.00 0.00 175.26 174.52 1ilo s PHE 34 N 1.56 3.23 -0.05 1.61 0.40 -1.26 -1.23 117.98 122.24 1ilo s PHE 34 Ca 0.01 -0.62 0.06 0.00 -0.60 0.00 0.00 56.93 55.78 1ilo s PHE 34 Cb -0.18 -2.76 -0.01 0.00 0.51 0.00 0.00 43.02 40.57 1ilo s PHE 34 CO -0.12 -0.65 -0.24 -2.00 0.70 0.00 0.00 175.22 172.90 1ilo s GLU 35 N 1.76 2.48 0.32 0.44 2.56 -0.82 -5.03 118.70 120.42 1ilo s GLU 35 Ca 0.06 -0.89 -0.08 0.00 0.00 0.00 0.00 54.97 54.06 1ilo s GLU 35 Cb -0.20 -2.17 -0.06 0.00 2.00 0.00 0.00 34.13 33.70 1ilo s GLU 35 CO 0.10 0.43 0.64 0.21 -0.56 0.00 0.00 175.26 176.09 1ilo s LYS 36 N -0.28 3.74 -0.56 4.30 2.20 -1.26 -2.76 119.74 125.11 1ilo s LYS 36 Ca 0.00 0.26 0.04 0.00 -0.36 0.00 0.00 55.97 55.91 1ilo s LYS 36 Cb -0.13 -2.54 0.16 0.00 -1.51 0.00 0.00 37.83 33.81 1ilo s LYS 36 CO 0.02 0.13 0.37 0.42 -0.36 0.00 0.00 175.35 175.94 1ilo s ILE 37 N -2.14 1.97 -1.34 5.43 -1.09 -1.05 -4.91 121.20 118.07 1ilo s ILE 37 Ca 0.48 -3.41 -0.15 0.00 -2.23 0.00 0.00 60.65 55.34 1ilo s ILE 37 Cb -0.11 -2.33 0.09 0.00 -1.58 0.00 0.00 42.46 38.53 1ilo s ILE 37 CO 0.28 -1.00 1.88 2.29 -1.23 0.00 0.00 174.94 177.16 1ilo n LYS 38 N 2.67 3.16 0.00 2.79 2.85 -1.26 -4.16 118.16 124.21 1ilo n LYS 38 Ca 0.17 -3.16 0.00 0.00 -1.05 0.00 0.00 58.31 54.27 1ilo n LYS 38 Cb 0.37 -3.29 0.00 0.00 -0.65 0.00 0.00 35.03 31.46 1ilo n LYS 38 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1ilo n GLU 39 N 6.65 0.00 -0.22 -1.58 2.13 -1.26 -5.02 120.64 121.34 1ilo n GLU 39 Ca 0.47 0.00 0.16 0.00 0.66 0.00 0.00 57.16 58.45 1ilo n GLU 39 Cb 0.42 0.00 0.47 0.00 0.27 0.00 0.00 31.44 32.60 1ilo n GLU 39 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ilo h MET 40 N 0.00 0.48 -0.94 5.31 -0.00 -1.96 0.56 114.93 118.37 1ilo h MET 40 Ca 0.00 -0.03 0.21 0.00 -0.00 0.00 0.00 59.70 59.88 1ilo h MET 40 Cb 0.00 -0.11 -0.08 0.00 -0.00 0.00 0.00 31.60 31.42 1ilo h MET 40 CO 0.00 0.32 0.62 0.22 -0.00 0.00 0.00 176.91 178.06 1ilo h ASP 41 N 0.49 0.46 0.41 -0.10 1.82 -1.96 0.58 116.42 118.12 1ilo h ASP 41 Ca 0.42 0.05 -0.31 0.00 -0.39 0.00 0.00 57.03 56.81 1ilo h ASP 41 Cb 0.91 -0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.87 1ilo h ASP 41 CO -0.16 0.17 -1.65 1.56 -1.61 0.00 0.00 179.24 177.55 1ilo h GLN 42 N 0.45 0.19 0.59 0.28 1.08 -0.41 -3.15 115.11 114.14 1ilo h GLN 42 Ca 0.50 -0.33 -0.03 0.00 -1.45 0.00 0.00 58.65 57.35 1ilo h GLN 42 Cb 1.20 0.12 0.01 0.00 -0.05 0.00 0.00 27.48 28.75 1ilo h GLN 42 CO -0.22 1.00 -0.28 0.82 -0.95 0.00 0.00 178.83 179.19 1ilo h ILE 43 N 0.05 0.42 -0.33 2.54 2.04 0.25 -2.69 117.51 119.79 1ilo h ILE 43 Ca -0.28 -0.02 -0.05 0.00 1.00 0.00 0.00 64.86 65.50 1ilo h ILE 43 Cb 2.01 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 38.50 1ilo h ILE 43 CO 0.13 0.00 -0.01 0.17 0.00 0.00 0.00 178.15 178.44 1ilo h LEU 44 N -0.81 0.48 -2.84 1.44 -0.00 -0.22 -1.40 115.31 111.96 1ilo h LEU 44 Ca -0.08 -0.09 -0.00 0.00 -0.00 0.00 0.00 57.88 57.71 1ilo h LEU 44 Cb 0.62 -0.13 -0.00 0.00 -0.00 0.00 0.00 40.66 41.15 1ilo h LEU 44 CO 0.13 0.56 -0.00 -0.08 -0.00 0.00 0.00 178.44 179.05 1ilo h GLU 45 N 0.49 0.00 -0.18 0.17 4.81 -1.47 0.19 114.58 118.59 1ilo h GLU 45 Ca 0.10 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.14 1ilo h GLU 45 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1ilo h GLU 45 CO 0.01 0.00 -0.68 0.00 -0.73 0.00 0.00 179.01 177.61 1ilo h ALA 46 N 2.00 0.46 0.00 2.92 0.00 -0.92 -3.48 119.26 120.24 1ilo h ALA 46 Ca -0.00 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1ilo h ALA 46 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ilo h ALA 46 CO 0.00 0.70 0.00 0.41 0.00 0.00 0.00 179.25 180.36 1ilo n GLY 47 N 0.53 1.59 3.81 0.00 0.00 0.05 -4.84 105.19 106.33 1ilo n GLY 47 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 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 3.26 -0.00 0.99 -0.00 -1.26 -4.98 118.68 116.69 1ilo s LEU 48 Ca 0.00 1.72 0.13 0.00 -0.00 0.00 0.00 54.13 55.98 1ilo s LEU 48 Cb 0.00 -4.51 -0.15 0.00 -0.00 0.00 0.00 46.19 41.53 1ilo s LEU 48 CO 0.00 -1.42 0.56 1.07 -0.00 0.00 0.00 176.35 176.56 1ilo n THR 49 N -2.77 0.00 -3.20 5.48 5.66 -1.26 -4.58 114.28 113.62 1ilo n THR 49 Ca 0.08 -0.19 -0.11 0.00 -3.05 0.00 0.00 64.05 60.78 1ilo n THR 49 Cb 0.53 0.97 0.03 0.00 -1.55 0.00 0.00 70.33 70.31 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 -1.34 0.62 -0.09 1.79 0.00 -1.26 -5.01 120.51 115.22 1ilo n ALA 50 Ca 0.02 -1.16 -0.14 0.00 0.00 0.00 0.00 53.44 52.16 1ilo n ALA 50 Cb 0.21 0.36 -0.07 0.00 0.00 0.00 0.00 19.45 19.95 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 -4.70 0.00 3.38 -1.93 -3.40 115.31 108.66 1ilo h LEU 51 Ca -0.16 -0.29 -0.15 0.00 0.09 0.00 0.00 57.88 57.38 1ilo h LEU 51 Cb 0.68 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1ilo h LEU 51 CO 0.23 1.15 0.57 -2.65 0.09 0.00 0.00 178.44 177.83 1ilo n PRO 52 N -4.52 1.22 -1.69 1.13 -0.02 -1.22 -3.85 135.00 126.04 1ilo n PRO 52 Ca -0.20 -0.70 -0.32 0.00 -2.02 0.00 0.00 63.50 60.25 1ilo n PRO 52 Cb 0.49 -1.90 0.05 0.00 -0.02 0.00 0.00 33.50 32.11 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 2.71 1.95 -0.29 -1.23 0.00 -0.80 -3.96 107.32 105.71 1ilo s GLY 53 Ca 0.35 0.36 0.02 0.00 0.00 0.00 0.00 44.72 45.45 1ilo s GLY 53 CO -0.01 0.69 0.46 -2.27 0.00 0.00 0.00 173.10 171.98 1ilo s LEU 54 N -5.12 -1.01 -0.23 0.66 0.20 -0.94 -0.92 118.68 111.34 1ilo s LEU 54 Ca 0.63 -0.12 -0.10 0.00 0.69 0.00 0.00 54.13 55.22 1ilo s LEU 54 Cb -0.17 1.38 -0.05 0.00 -0.43 0.00 0.00 46.19 46.92 1ilo s LEU 54 CO 0.46 -0.33 0.15 0.00 -0.29 0.00 0.00 176.35 176.33 1ilo s ALA 55 N 2.63 3.61 -0.02 5.97 0.00 -0.96 -3.16 121.76 129.83 1ilo s ALA 55 Ca 0.11 -0.85 0.07 0.00 0.00 0.00 0.00 51.96 51.28 1ilo s ALA 55 Cb -0.12 -2.27 -0.02 0.00 0.00 0.00 0.00 23.12 20.70 1ilo s ALA 55 CO -0.27 -0.12 -0.22 0.14 0.00 0.00 0.00 175.76 175.29 1ilo s VAL 56 N 0.90 2.40 -0.47 0.00 -7.23 -1.01 -1.56 120.40 113.42 1ilo s VAL 56 Ca 0.07 -1.02 0.00 0.00 -1.81 0.00 0.00 61.98 59.22 1ilo s VAL 56 Cb -0.13 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 34.93 1ilo s VAL 56 CO 0.03 0.55 0.00 0.47 -0.31 0.00 0.00 175.10 175.84 1ilo n ASP 57 N 2.30 -1.99 -0.27 4.85 8.00 0.17 0.11 116.55 129.72 1ilo n ASP 57 Ca -0.16 0.31 -0.00 0.00 0.71 0.00 0.00 54.79 55.64 1ilo n ASP 57 Cb 0.51 -1.86 0.00 0.00 -0.02 0.00 0.00 41.12 39.75 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 -0.48 0.63 2.73 0.44 0.00 -1.26 -5.02 105.19 102.23 1ilo n GLY 58 Ca -0.06 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 44.99 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 -4.48 0.31 0.13 1.61 8.01 0.29 -5.13 118.70 119.44 1ilo s GLU 59 Ca 0.00 -0.20 -0.31 0.00 0.01 0.00 0.00 54.97 54.47 1ilo s GLU 59 Cb -0.00 -0.72 -0.08 0.00 -4.31 0.00 0.00 34.13 29.02 1ilo s GLU 59 CO 0.00 -1.03 1.34 -0.51 0.01 0.00 0.00 175.26 175.07 1ilo s LEU 60 N 2.31 4.38 0.00 1.80 1.02 -1.26 -2.41 118.68 124.52 1ilo s LEU 60 Ca 0.09 2.31 0.00 0.00 0.02 0.00 0.00 54.13 56.55 1ilo s LEU 60 Cb -0.14 -3.59 0.00 0.00 0.02 0.00 0.00 46.19 42.48 1ilo s LEU 60 CO -0.33 -0.59 0.42 1.17 0.02 0.00 0.00 176.35 177.04 1ilo n LYS 61 N 3.55 0.00 -3.99 1.70 4.81 -1.19 -4.99 118.16 118.06 1ilo n LYS 61 Ca 0.10 -0.40 -0.23 0.00 -0.87 0.00 0.00 58.31 56.91 1ilo n LYS 61 Cb 0.43 -0.35 -0.17 0.00 0.02 0.00 0.00 35.03 34.96 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 0.00 0.63 -0.12 3.15 1.09 -1.24 -5.00 121.20 119.72 1ilo s ILE 62 Ca 0.00 -0.09 -0.05 0.00 -1.10 0.00 0.00 60.65 59.41 1ilo s ILE 62 Cb 0.00 -0.69 0.06 0.00 -1.06 0.00 0.00 42.46 40.76 1ilo s ILE 62 CO 0.00 0.28 0.25 -0.04 -0.10 0.00 0.00 174.94 175.33 1ilo s MET 63 N 1.47 0.16 0.00 2.79 -1.94 -1.26 -2.20 119.30 118.32 1ilo s MET 63 Ca -0.02 0.67 0.00 0.00 -1.71 0.00 0.00 55.69 54.63 1ilo s MET 63 Cb -0.13 -0.07 0.00 0.00 2.01 0.00 0.00 34.83 36.63 1ilo s MET 63 CO -0.03 -0.24 0.00 0.41 -0.01 0.00 0.00 175.02 175.14 1ilo n GLY 64 N 4.96 0.34 3.15 -0.03 0.00 -1.25 -4.87 105.19 107.48 1ilo n GLY 64 Ca -0.13 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.95 1ilo n GLY 64 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ilo s ARG 65 N -0.80 0.10 0.40 1.61 1.70 -1.26 -4.88 118.95 115.82 1ilo s ARG 65 Ca 0.00 0.10 -0.26 0.00 -0.47 0.00 0.00 55.73 55.10 1ilo s ARG 65 Cb 0.00 0.05 -0.11 0.00 -0.57 0.00 0.00 34.95 34.32 1ilo s ARG 65 CO 0.00 -0.18 1.27 1.55 -1.08 0.00 0.00 175.30 176.86 1ilo n VAL 66 N 5.09 2.38 -0.67 4.99 3.14 -1.26 -4.92 118.33 127.08 1ilo n VAL 66 Ca 0.09 -0.50 -0.29 0.00 -2.96 0.00 0.00 64.34 60.68 1ilo n VAL 66 Cb 0.58 -1.56 0.25 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 -1.17 -0.25 0.22 1.55 0.00 -1.26 -4.87 121.76 115.98 1ilo s ALA 67 Ca 0.59 -0.41 0.08 0.00 0.00 0.00 0.00 51.96 52.22 1ilo s ALA 67 Cb -0.53 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 1ilo s ALA 67 CO 0.59 -3.84 0.07 -1.12 0.00 0.00 0.00 175.76 171.46 1ilo s SER 68 N -2.94 5.01 0.26 0.00 0.01 -1.26 -4.08 113.70 110.71 1ilo s SER 68 Ca 0.68 -0.40 -0.02 0.00 1.31 0.00 0.00 55.95 57.53 1ilo s SER 68 Cb -0.20 -1.13 0.47 0.00 0.21 0.00 0.00 66.02 65.37 1ilo s SER 68 CO 0.61 0.02 1.83 0.07 0.41 0.00 0.00 173.24 176.18 1ilo h LYS 69 N 2.08 0.89 -0.92 12.44 2.10 -1.92 -1.17 116.57 130.06 1ilo h LYS 69 Ca -0.47 -0.05 0.01 0.00 -2.00 0.00 0.00 60.65 58.14 1ilo h LYS 69 Cb 1.23 -0.20 -0.05 0.00 -0.90 0.00 0.00 32.23 32.31 1ilo h LYS 69 CO 0.60 0.59 0.60 1.05 -2.00 0.00 0.00 179.45 180.29 1ilo h GLU 70 N 0.91 1.22 -0.53 0.07 4.11 -1.98 -2.17 114.58 116.21 1ilo h GLU 70 Ca 0.44 -0.08 -0.06 0.00 0.07 0.00 0.00 59.36 59.73 1ilo h GLU 70 Cb 0.40 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1ilo h GLU 70 CO -0.25 0.82 0.07 0.93 0.07 0.00 0.00 179.01 180.65 1ilo h GLU 71 N 1.26 0.86 0.47 1.06 5.08 -1.64 -2.49 114.58 119.18 1ilo h GLU 71 Ca 0.34 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1ilo h GLU 71 Cb -0.13 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.01 1ilo h GLU 71 CO -0.07 0.81 -0.24 0.82 -1.00 0.00 0.00 179.01 179.33 1ilo h ILE 72 N 0.81 0.51 -0.52 3.13 1.08 -0.77 -1.12 117.51 120.63 1ilo h ILE 72 Ca 0.17 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.71 1ilo h ILE 72 Cb 0.39 0.51 -0.03 0.00 -3.07 0.00 0.00 36.82 34.61 1ilo h ILE 72 CO 0.01 0.00 0.35 0.50 -0.69 0.00 0.00 178.15 178.32 1ilo h LYS 73 N -0.66 0.38 -0.46 2.37 3.64 -1.41 0.29 116.57 120.73 1ilo h LYS 73 Ca -0.06 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.16 1ilo h LYS 73 Cb 0.51 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1ilo h LYS 73 CO 0.10 0.25 -0.25 0.87 -2.27 0.00 0.00 179.45 178.15 1ilo h LYS 74 N 0.39 0.98 0.00 1.90 1.57 -0.99 0.72 116.57 121.14 1ilo h LYS 74 Ca 0.23 -0.44 -0.25 0.00 -1.87 0.00 0.00 60.65 58.32 1ilo h LYS 74 Cb 0.41 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.72 1ilo h LYS 74 CO -0.06 1.11 -1.01 0.82 -0.57 0.00 0.00 179.45 179.74 1ilo h ILE 75 N 0.82 1.33 -0.53 1.86 2.04 -0.12 -3.16 117.51 119.75 1ilo h ILE 75 Ca 0.10 -2.34 0.00 0.00 1.00 0.00 0.00 64.86 63.62 1ilo h ILE 75 Cb 0.83 2.41 0.00 0.00 -0.74 0.00 0.00 36.82 39.31 1ilo h ILE 75 CO 0.07 0.71 0.00 0.18 0.00 0.00 0.00 178.15 179.11 1ilo n LEU 76 N -3.81 2.96 0.00 1.44 4.77 0.92 -5.11 117.00 118.18 1ilo n LEU 76 Ca -0.09 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.41 1ilo n LEU 76 Cb 0.87 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1ilo n LEU 76 CO 0.54 0.70 0.00 -1.54 -1.33 0.00 0.00 177.39 175.76