#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oie s GLU 27 N 0.00 4.05 0.29 -3.48 2.12 -1.26 -4.96 118.70 115.46 1oie s GLU 27 Ca 0.00 0.57 -0.09 0.00 0.36 0.00 0.00 54.97 55.81 1oie s GLU 27 Cb 0.00 -3.08 -0.07 0.00 0.26 0.00 0.00 34.13 31.24 1oie s GLU 27 CO 0.00 0.57 0.61 -1.14 -0.54 0.00 0.00 175.26 174.76 1oie s GLN 28 N -1.53 3.76 0.00 4.30 2.00 -1.26 -4.02 119.66 122.91 1oie s GLN 28 Ca 0.33 0.26 0.00 0.00 -2.00 0.00 0.00 55.36 53.95 1oie s GLN 28 Cb -0.17 -2.57 0.00 0.00 0.80 0.00 0.00 33.01 31.07 1oie s GLN 28 CO 0.18 0.20 0.00 -0.25 -0.50 0.00 0.00 175.29 174.92 1oie n ASP 29 N -0.65 -2.88 -4.76 6.67 10.43 -1.26 -4.97 116.55 119.13 1oie n ASP 29 Ca 0.00 0.00 -0.39 0.00 2.57 0.00 0.00 54.79 56.97 1oie n ASP 29 Cb 0.53 -2.71 -0.05 0.00 1.84 0.00 0.00 41.12 40.73 1oie n ASP 29 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 1oie s LYS 30 N -1.34 4.43 -0.23 -1.24 2.20 -1.26 -4.97 119.74 117.33 1oie s LYS 30 Ca 0.00 0.96 -0.22 0.00 -0.36 0.00 0.00 55.97 56.36 1oie s LYS 30 Cb 0.00 -3.33 -0.02 0.00 -1.51 0.00 0.00 37.83 32.98 1oie s LYS 30 CO 0.00 0.39 0.68 0.99 -0.36 0.00 0.00 175.35 177.05 1oie s THR 31 N -0.39 4.96 0.17 3.43 2.01 -1.26 -4.08 115.64 120.48 1oie s THR 31 Ca 0.35 1.27 0.03 0.00 0.31 0.00 0.00 61.69 63.65 1oie s THR 31 Cb -0.20 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.29 1oie s THR 31 CO 0.22 0.03 0.30 -0.31 -0.69 0.00 0.00 174.62 174.17 1oie s TYR 32 N 2.36 3.47 -0.23 4.92 2.02 0.14 -4.91 117.35 125.12 1oie s TYR 32 Ca 0.29 0.09 -0.02 0.00 -0.37 0.00 0.00 57.07 57.06 1oie s TYR 32 Cb -0.16 -1.64 0.02 0.00 -0.40 0.00 0.00 41.96 39.78 1oie s TYR 32 CO 0.09 0.50 -0.08 0.15 -1.57 0.00 0.00 175.55 174.64 1oie s LYS 33 N -3.38 2.99 -0.14 -0.62 1.02 -1.26 0.70 119.74 119.04 1oie s LYS 33 Ca 0.34 -0.86 0.01 0.00 0.02 0.00 0.00 55.97 55.48 1oie s LYS 33 Cb -0.11 -2.91 -0.00 0.00 -0.52 0.00 0.00 37.83 34.29 1oie s LYS 33 CO 0.28 -0.31 -0.16 0.42 -0.92 0.00 0.00 175.35 174.66 1oie s ILE 34 N 1.35 2.62 -0.18 2.17 -1.09 -0.93 -0.89 121.20 124.25 1oie s ILE 34 Ca 0.02 -0.79 -0.05 0.00 -2.23 0.00 0.00 60.65 57.60 1oie s ILE 34 Cb -0.15 -2.09 -0.03 0.00 -1.58 0.00 0.00 42.46 38.61 1oie s ILE 34 CO -0.06 0.52 0.01 -0.89 -1.23 0.00 0.00 174.94 173.29 1oie s THR 35 N 0.70 4.19 -0.30 2.92 2.01 0.18 -0.24 115.64 125.09 1oie s THR 35 Ca -0.08 -0.24 -0.08 0.00 0.31 0.00 0.00 61.69 61.60 1oie s THR 35 Cb -0.16 -2.88 -0.00 0.00 0.01 0.00 0.00 72.50 69.47 1oie s THR 35 CO 0.02 0.45 0.12 -0.69 -0.69 0.00 0.00 174.62 173.83 1oie s VAL 36 N 0.67 4.34 0.08 3.82 1.01 0.08 -1.29 120.40 129.11 1oie s VAL 36 Ca 0.00 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 1oie s VAL 36 Cb -0.14 -3.21 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 1oie s VAL 36 CO 0.02 0.09 0.33 -0.76 0.00 0.00 0.00 175.10 174.78 1oie s LEU 37 N 1.57 4.33 -0.01 3.92 1.43 0.60 -0.69 118.68 129.84 1oie s LEU 37 Ca 0.04 0.58 -0.19 0.00 -1.03 0.00 0.00 54.13 53.53 1oie s LEU 37 Cb -0.17 -2.99 0.04 0.00 0.03 0.00 0.00 46.19 43.10 1oie s LEU 37 CO 0.05 0.16 0.42 -1.38 0.23 0.00 0.00 176.35 175.82 1oie s HIS 38 N -1.47 -0.31 0.28 0.29 -3.43 -0.65 -1.00 115.29 109.00 1oie s HIS 38 Ca 0.34 0.44 0.04 0.00 -0.80 0.00 0.00 55.06 55.08 1oie s HIS 38 Cb -0.13 0.20 -0.04 0.00 -1.43 0.00 0.00 32.58 31.19 1oie s HIS 38 CO 0.21 -0.49 0.20 0.95 -2.00 0.00 0.00 174.74 173.61 1oie s THR 39 N -1.63 0.09 0.01 -5.38 -4.23 -0.97 -0.71 115.64 102.82 1oie s THR 39 Ca -0.11 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.12 1oie s THR 39 Cb -0.03 -2.50 0.10 0.00 1.34 0.00 0.00 72.50 71.41 1oie s THR 39 CO 0.04 0.00 0.86 0.54 -0.54 0.00 0.00 174.62 175.52 1oie s ASN 40 N -3.31 -0.38 -1.34 3.99 4.22 -1.26 -1.03 114.94 115.82 1oie s ASN 40 Ca 0.39 0.00 -0.01 0.00 -2.14 0.00 0.00 52.86 51.10 1oie s ASN 40 Cb 0.04 0.40 0.01 0.00 1.28 0.00 0.00 41.25 42.99 1oie s ASN 40 CO 0.20 -0.65 0.69 0.47 -2.04 0.00 0.00 177.10 175.77 1oie n ASP 41 N -0.25 -1.38 -0.25 3.54 8.00 0.15 -3.65 116.55 122.70 1oie n ASP 41 Ca -0.10 -0.84 -0.05 0.00 0.71 0.00 0.00 54.79 54.52 1oie n ASP 41 Cb 0.62 -3.92 0.06 0.00 -0.02 0.00 0.00 41.12 37.86 1oie n ASP 41 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 1oie h HIS 42 N -1.88 0.86 -6.50 1.24 -0.00 -1.48 0.17 115.15 107.55 1oie h HIS 42 Ca -0.61 0.02 -0.50 0.00 -0.00 0.00 0.00 60.37 59.28 1oie h HIS 42 Cb 1.36 -0.29 -0.06 0.00 -0.00 0.00 0.00 27.41 28.42 1oie h HIS 42 CO 0.48 0.53 -0.88 0.72 -0.00 0.00 0.00 177.93 178.78 1oie n HIS 43 N -4.61 -1.66 -0.80 5.26 8.25 -0.46 -2.50 115.22 118.69 1oie n HIS 43 Ca 0.06 0.75 0.00 0.00 -0.26 0.00 0.00 57.72 58.28 1oie n HIS 43 Cb 0.03 -3.71 0.00 0.00 1.12 0.00 0.00 29.99 27.43 1oie n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1oie n GLY 44 N -1.95 0.67 2.33 -1.41 0.00 -0.59 -3.54 105.19 100.70 1oie n GLY 44 Ca -0.29 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 1oie n GLY 44 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1oie n HIS 45 N -2.62 1.16 0.15 1.61 8.25 -1.04 -4.49 115.22 118.23 1oie n HIS 45 Ca 0.00 -1.87 0.03 0.00 -0.26 0.00 0.00 57.72 55.61 1oie n HIS 45 Cb 0.00 -1.50 0.39 0.00 1.12 0.00 0.00 29.99 30.00 1oie n HIS 45 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1oie h PHE 46 N 3.12 0.15 -2.63 4.41 -5.15 -1.92 -3.36 116.94 111.56 1oie h PHE 46 Ca 0.36 -0.02 -0.56 0.00 -0.20 0.00 0.00 57.97 57.55 1oie h PHE 46 Cb 0.94 -0.04 -0.03 0.00 0.22 0.00 0.00 35.95 37.04 1oie h PHE 46 CO 1.58 0.36 -0.47 -0.46 -2.00 0.00 0.00 178.31 177.31 1oie s TRP 47 N -4.55 3.49 0.72 6.09 -0.11 -1.26 -0.87 118.94 122.45 1oie s TRP 47 Ca -0.05 0.14 -0.16 0.00 1.22 0.00 0.00 56.10 57.26 1oie s TRP 47 Cb 0.15 -1.69 0.03 0.00 -1.50 0.00 0.00 33.47 30.47 1oie s TRP 47 CO 0.73 0.53 1.24 -0.98 -4.62 0.00 0.00 176.95 173.85 1oie s ARG 48 N -3.07 2.13 0.94 5.86 1.70 -1.26 -3.87 118.95 121.38 1oie s ARG 48 Ca 0.35 1.86 -0.14 0.00 -0.47 0.00 0.00 55.73 57.33 1oie s ARG 48 Cb -0.11 -1.82 0.21 0.00 -0.57 0.00 0.00 34.95 32.66 1oie s ARG 48 CO 0.28 -1.87 1.28 0.27 -1.08 0.00 0.00 175.30 174.19 1oie n ASN 49 N -2.61 0.27 0.00 -2.89 6.94 -0.63 -4.89 115.26 111.45 1oie n ASN 49 Ca 0.14 -1.57 0.10 0.00 -0.02 0.00 0.00 54.58 53.23 1oie n ASN 49 Cb 0.50 -0.96 0.46 0.00 -2.36 0.00 0.00 39.78 37.42 1oie n ASN 49 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 1oie n GLU 50 N -3.67 0.15 -0.44 -3.83 0.28 -1.26 -1.65 120.64 110.23 1oie n GLU 50 Ca 0.17 0.13 0.08 0.00 -0.16 0.00 0.00 57.16 57.38 1oie n GLU 50 Cb 0.58 -1.50 0.28 0.00 1.43 0.00 0.00 31.44 32.22 1oie n GLU 50 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1oie n TYR 51 N -1.39 1.05 -1.03 -1.84 4.01 -1.26 -4.96 117.16 111.75 1oie n TYR 51 Ca 0.07 -0.63 -0.01 0.00 -0.16 0.00 0.00 57.90 57.18 1oie n TYR 51 Cb 0.19 -0.18 -0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1oie n TYR 51 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1oie n GLY 52 N 0.65 0.49 3.86 2.72 0.00 -0.66 -5.00 105.19 107.26 1oie n GLY 52 Ca 0.21 -0.51 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 1oie n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oie s GLU 53 N -1.19 3.85 0.00 1.61 2.02 -1.26 -4.82 118.70 118.91 1oie s GLU 53 Ca 0.00 0.64 0.00 0.00 0.02 0.00 0.00 54.97 55.63 1oie s GLU 53 Cb 0.00 -2.31 0.00 0.00 0.10 0.00 0.00 34.13 31.92 1oie s GLU 53 CO 0.00 -0.10 0.00 2.48 0.02 0.00 0.00 175.26 177.66 1oie n TYR 54 N -1.33 0.00 0.00 1.61 0.18 0.29 -1.61 117.16 116.30 1oie n TYR 54 Ca 0.04 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.82 1oie n TYR 54 Cb 0.54 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.50 1oie n TYR 54 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1oie n GLY 55 N 0.00 0.40 0.23 -7.48 0.00 -1.25 -4.11 105.19 92.98 1oie n GLY 55 Ca 0.00 -1.61 0.15 0.00 0.00 0.00 0.00 46.02 44.55 1oie n GLY 55 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1oie h LEU 56 N 0.00 0.00 -0.45 0.99 3.38 -1.15 -2.86 115.31 115.22 1oie h LEU 56 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1oie h LEU 56 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1oie h LEU 56 CO 0.00 0.00 -0.28 0.00 0.09 0.00 0.00 178.44 178.25 1oie h ALA 57 N 2.07 0.64 -0.24 1.53 0.00 -1.87 0.03 119.26 121.43 1oie h ALA 57 Ca 0.00 -0.42 -0.18 0.00 0.00 0.00 0.00 54.91 54.31 1oie h ALA 57 Cb 0.64 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1oie h ALA 57 CO 0.00 0.67 -0.58 0.00 0.00 0.00 0.00 179.25 179.35 1oie h ALA 58 N 0.83 0.53 -0.88 0.00 0.00 -1.76 -1.67 119.26 116.30 1oie h ALA 58 Ca 0.09 -0.53 0.04 0.00 0.00 0.00 0.00 54.91 54.52 1oie h ALA 58 Cb 0.87 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.54 1oie h ALA 58 CO 0.08 0.69 0.57 0.37 0.00 0.00 0.00 179.25 180.95 1oie h GLN 59 N 0.57 1.04 0.22 0.00 4.15 -1.25 -1.96 115.11 117.87 1oie h GLN 59 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1oie h GLN 59 Cb 1.17 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 28.61 1oie h GLN 59 CO 0.12 0.69 -0.19 -0.22 -1.93 0.00 0.00 178.83 177.30 1oie h LYS 60 N 1.07 -0.41 -0.55 1.69 1.63 -0.88 -0.69 116.57 118.43 1oie h LYS 60 Ca 0.36 0.03 0.08 0.00 -0.85 0.00 0.00 60.65 60.28 1oie h LYS 60 Cb 0.06 0.09 -0.07 0.00 -0.60 0.00 0.00 32.23 31.72 1oie h LYS 60 CO -0.14 -0.28 0.18 1.15 -3.45 0.00 0.00 179.45 176.91 1oie h THR 61 N -0.43 0.77 0.12 1.00 2.02 -1.24 -0.52 112.91 114.63 1oie h THR 61 Ca -0.01 -0.12 0.01 0.00 0.77 0.00 0.00 66.41 67.07 1oie h THR 61 Cb 0.40 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 1oie h THR 61 CO -0.03 0.06 -0.15 0.25 0.37 0.00 0.00 175.52 176.02 1oie h LEU 62 N 0.34 -0.41 -0.53 2.58 5.85 -1.08 -1.96 115.31 120.11 1oie h LEU 62 Ca 0.27 0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.91 1oie h LEU 62 Cb 0.34 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1oie h LEU 62 CO -0.30 -0.22 -0.18 0.58 -0.34 0.00 0.00 178.44 177.98 1oie h VAL 63 N -0.31 1.27 -1.00 1.05 2.07 -0.79 -0.74 116.25 117.79 1oie h VAL 63 Ca 0.01 -1.34 0.03 0.00 0.82 0.00 0.00 66.70 66.23 1oie h VAL 63 Cb 0.31 1.07 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 1oie h VAL 63 CO -0.06 0.47 0.66 0.44 0.02 0.00 0.00 177.57 179.09 1oie h ASP 64 N 0.87 1.10 -0.05 0.57 3.32 -1.04 0.14 116.42 121.34 1oie h ASP 64 Ca 0.12 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 56.97 1oie h ASP 64 Cb 0.75 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 1oie h ASP 64 CO 0.06 0.76 -0.64 1.23 -1.72 0.00 0.00 179.24 178.93 1oie h GLY 65 N 1.28 0.73 1.28 2.75 0.00 -0.63 -0.99 103.07 107.50 1oie h GLY 65 Ca 0.40 -0.93 -0.10 0.00 0.00 0.00 0.00 47.33 46.70 1oie h GLY 65 CO -0.12 0.83 -0.13 -2.22 0.00 0.00 0.00 176.54 174.90 1oie h ILE 66 N 0.49 1.26 -0.24 2.60 2.04 -0.67 -1.17 117.51 121.82 1oie h ILE 66 Ca -0.01 -1.23 -0.00 0.00 1.00 0.00 0.00 64.86 64.62 1oie h ILE 66 Cb 1.23 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.35 1oie h ILE 66 CO 0.13 0.42 0.14 0.03 0.00 0.00 0.00 178.15 178.87 1oie h ARG 67 N 0.76 0.33 -0.81 2.37 3.08 -0.58 -0.72 114.38 118.80 1oie h ARG 67 Ca 0.12 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 1oie h ARG 67 Cb 0.64 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 1oie h ARG 67 CO 0.04 0.28 0.34 -0.22 -1.07 0.00 0.00 179.97 179.34 1oie h LYS 68 N 0.29 1.20 -0.24 0.04 3.64 -0.88 -1.14 116.57 119.49 1oie h LYS 68 Ca 0.08 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.24 1oie h LYS 68 Cb 0.04 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 1oie h LYS 68 CO -0.01 0.96 0.09 1.49 -2.27 0.00 0.00 179.45 179.71 1oie h GLU 69 N 1.18 0.36 -0.21 1.90 4.81 -0.95 -1.17 114.58 120.49 1oie h GLU 69 Ca 0.27 -0.07 -0.18 0.00 -0.13 0.00 0.00 59.36 59.25 1oie h GLU 69 Cb 0.20 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1oie h GLU 69 CO -0.02 0.42 -0.60 0.28 -0.73 0.00 0.00 179.01 178.36 1oie h VAL 70 N 0.23 1.30 -0.08 0.32 2.07 -0.89 -2.61 116.25 116.59 1oie h VAL 70 Ca 0.08 -1.83 -0.08 0.00 0.82 0.00 0.00 66.70 65.69 1oie h VAL 70 Cb 0.20 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1oie h VAL 70 CO -0.01 0.58 -0.33 0.00 0.02 0.00 0.00 177.57 177.84 1oie h ALA 71 N 0.81 1.32 0.00 1.67 0.00 -1.17 -0.99 119.26 120.90 1oie h ALA 71 Ca -0.00 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1oie h ALA 71 Cb 1.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1oie h ALA 71 CO 0.12 0.48 -0.40 0.00 0.00 0.00 0.00 179.25 179.45 1oie h ALA 72 N 1.54 1.14 -0.33 0.00 0.00 -1.02 -2.24 119.26 118.36 1oie h ALA 72 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1oie h ALA 72 Cb 0.64 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1oie h ALA 72 CO 0.05 0.50 0.00 0.39 0.00 0.00 0.00 179.25 180.19 1oie n GLU 73 N -3.78 2.31 -0.91 0.00 1.02 -0.82 -4.94 120.64 113.52 1oie n GLU 73 Ca -0.01 -1.40 0.00 0.00 -0.02 0.00 0.00 57.16 55.73 1oie n GLU 73 Cb 0.47 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 1oie n GLU 73 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1oie n GLY 74 N 0.73 0.09 1.44 0.62 0.00 -0.84 -5.00 105.19 102.23 1oie n GLY 74 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 1oie n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oie n GLY 75 N -0.07 -0.79 3.22 -0.02 0.00 -0.44 -4.85 105.19 102.26 1oie n GLY 75 Ca 0.00 -1.76 -0.23 0.00 0.00 0.00 0.00 46.02 44.03 1oie n GLY 75 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oie s SER 76 N -2.74 2.22 0.06 1.61 0.01 -0.06 -4.28 113.70 110.52 1oie s SER 76 Ca 0.27 -0.54 0.09 0.00 1.31 0.00 0.00 55.95 57.08 1oie s SER 76 Cb -0.01 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 66.03 1oie s SER 76 CO 0.19 0.09 -0.23 -0.69 0.41 0.00 0.00 173.24 173.01 1oie s VAL 77 N -0.92 2.41 -0.03 3.43 1.01 -1.26 0.47 120.40 125.52 1oie s VAL 77 Ca 0.05 -1.38 0.01 0.00 0.00 0.00 0.00 61.98 60.66 1oie s VAL 77 Cb -0.09 -1.99 0.02 0.00 0.00 0.00 0.00 36.38 34.32 1oie s VAL 77 CO 0.02 0.31 -0.02 -0.22 0.00 0.00 0.00 175.10 175.19 1oie s LEU 78 N -1.46 1.37 -0.21 3.92 2.96 -0.41 -4.97 118.68 119.88 1oie s LEU 78 Ca 0.13 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.99 1oie s LEU 78 Cb -0.10 -0.29 0.03 0.00 0.50 0.00 0.00 46.19 46.33 1oie s LEU 78 CO 0.04 -0.06 -0.17 -0.22 -1.32 0.00 0.00 176.35 174.62 1oie s LEU 79 N 0.79 2.58 0.08 -0.68 2.96 -1.26 -0.29 118.68 122.85 1oie s LEU 79 Ca -0.09 -0.90 0.09 0.00 -0.22 0.00 0.00 54.13 53.00 1oie s LEU 79 Cb -0.12 -1.50 -0.03 0.00 0.50 0.00 0.00 46.19 45.04 1oie s LEU 79 CO -0.01 -0.06 -0.23 -0.76 -1.32 0.00 0.00 176.35 173.97 1oie s LEU 80 N 1.23 2.25 -0.06 -0.68 1.43 -0.17 -0.71 118.68 121.97 1oie s LEU 80 Ca 0.00 -0.64 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 1oie s LEU 80 Cb -0.15 -1.02 -0.03 0.00 0.03 0.00 0.00 46.19 45.02 1oie s LEU 80 CO -0.10 0.14 -0.09 -0.55 0.23 0.00 0.00 176.35 175.97 1oie s SER 81 N -1.63 4.43 0.00 2.29 0.15 -0.66 -2.28 113.70 115.99 1oie s SER 81 Ca 0.09 -0.09 0.10 0.00 0.70 0.00 0.00 55.95 56.75 1oie s SER 81 Cb -0.10 -1.05 0.41 0.00 -1.71 0.00 0.00 66.02 63.57 1oie s SER 81 CO 0.04 0.35 1.30 0.61 1.20 0.00 0.00 173.24 176.73 1oie n GLY 82 N 2.20 -0.14 3.89 9.45 0.00 -0.20 -1.31 105.19 119.09 1oie n GLY 82 Ca -0.17 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1oie n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oie n GLY 83 N 0.87 -2.12 3.15 -0.02 0.00 -1.19 -4.26 105.19 101.62 1oie n GLY 83 Ca 0.09 -1.66 -0.12 0.00 0.00 0.00 0.00 46.02 44.34 1oie n GLY 83 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oie n ASP 84 N 0.46 -6.72 0.11 1.61 9.92 -1.26 0.31 116.55 120.97 1oie n ASP 84 Ca 0.00 -0.56 -0.20 0.00 -0.53 0.00 0.00 54.79 53.50 1oie n ASP 84 Cb 0.00 -5.08 -0.15 0.00 -0.64 0.00 0.00 41.12 35.25 1oie n ASP 84 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1oie h ILE 85 N -0.74 1.29 -4.03 0.53 1.08 -1.93 -1.01 117.51 112.71 1oie h ILE 85 Ca -0.47 -2.82 -0.48 0.00 -0.39 0.00 0.00 64.86 60.70 1oie h ILE 85 Cb 1.24 2.93 0.03 0.00 -3.07 0.00 0.00 36.82 37.95 1oie h ILE 85 CO 0.40 0.85 0.41 0.20 -0.69 0.00 0.00 178.15 179.31 1oie s ASN 86 N -7.31 6.41 0.00 1.72 0.01 -1.26 -1.54 114.94 112.97 1oie s ASN 86 Ca -0.08 2.04 0.00 0.00 -0.71 0.00 0.00 52.86 54.11 1oie s ASN 86 Cb 0.06 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.14 1oie s ASN 86 CO 0.90 -0.74 0.00 0.41 -1.51 0.00 0.00 177.10 176.16 1oie n THR 87 N -0.63 -1.71 0.00 1.60 -1.04 -1.26 -4.49 114.28 106.75 1oie n THR 87 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 1oie n THR 87 Cb 0.51 -2.52 0.00 0.00 -1.82 0.00 0.00 70.33 66.50 1oie n THR 87 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1oie n GLY 88 N 0.44 0.19 2.77 3.41 0.00 -1.23 -4.50 105.19 106.26 1oie n GLY 88 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 1oie n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oie s VAL 89 N 0.00 -0.16 0.32 1.61 1.01 -1.24 -4.93 120.40 117.00 1oie s VAL 89 Ca 0.00 0.36 0.08 0.00 0.00 0.00 0.00 61.98 62.42 1oie s VAL 89 Cb 0.00 -0.21 0.31 0.00 0.00 0.00 0.00 36.38 36.48 1oie s VAL 89 CO 0.00 0.15 1.78 -0.65 0.00 0.00 0.00 175.10 176.38 1oie h PRO 90 N 8.22 0.68 0.00 2.72 0.11 -1.96 0.68 132.00 142.45 1oie h PRO 90 Ca -0.18 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.80 1oie h PRO 90 Cb 1.12 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1oie h PRO 90 CO 0.20 0.45 -0.44 0.93 -0.21 0.00 0.00 178.00 178.92 1oie h GLU 91 N 0.70 0.00 0.12 1.05 3.07 -1.92 -1.00 114.58 116.61 1oie h GLU 91 Ca 0.57 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.43 1oie h GLU 91 Cb 0.98 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1oie h GLU 91 CO -0.36 0.44 -0.06 1.03 -1.40 0.00 0.00 179.01 178.67 1oie h SER 92 N 0.00 -0.14 -0.93 1.42 0.87 -1.50 -3.36 113.55 109.91 1oie h SER 92 Ca -0.00 0.00 0.27 0.00 -1.23 0.00 0.00 61.79 60.83 1oie h SER 92 Cb 0.90 0.04 -0.16 0.00 -0.44 0.00 0.00 62.40 62.73 1oie h SER 92 CO 0.06 0.29 0.18 0.44 -0.53 0.00 0.00 176.83 177.27 1oie h ASP 93 N -0.93 -0.16 0.34 6.23 3.32 -0.88 0.27 116.42 124.61 1oie h ASP 93 Ca -0.02 0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1oie h ASP 93 Cb 0.12 0.35 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1oie h ASP 93 CO 0.03 -0.27 0.00 -0.07 -1.72 0.00 0.00 179.24 177.21 1oie h LEU 94 N 0.10 0.00 -2.80 1.55 3.38 -1.36 -2.45 115.31 113.74 1oie h LEU 94 Ca 0.60 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.57 1oie h LEU 94 Cb 1.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1oie h LEU 94 CO -0.77 0.00 -0.13 0.00 0.09 0.00 0.00 178.44 177.63 1oie n GLN 95 N -2.39 1.02 -3.94 1.13 6.02 0.90 -4.98 117.38 115.13 1oie n GLN 95 Ca -0.00 -2.28 -0.31 0.00 -0.01 0.00 0.00 57.00 54.40 1oie n GLN 95 Cb 0.13 -1.29 0.02 0.00 1.02 0.00 0.00 30.24 30.11 1oie n GLN 95 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1oie n ASP 96 N -1.12 -4.58 -1.72 1.08 8.00 -0.92 -1.97 116.55 115.31 1oie n ASP 96 Ca 0.13 -0.80 -0.14 0.00 0.71 0.00 0.00 54.79 54.68 1oie n ASP 96 Cb 0.66 -3.67 -0.05 0.00 -0.02 0.00 0.00 41.12 38.04 1oie n ASP 96 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oie n ALA 97 N -4.59 -0.37 -0.09 2.24 0.00 -0.85 -4.89 120.51 111.96 1oie n ALA 97 Ca 0.05 0.20 -0.06 0.00 0.00 0.00 0.00 53.44 53.62 1oie n ALA 97 Cb 0.52 -1.56 0.01 0.00 0.00 0.00 0.00 19.45 18.42 1oie n ALA 97 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1oie h GLU 98 N 0.00 0.19 -0.95 0.00 4.81 -1.65 -1.92 114.58 115.06 1oie h GLU 98 Ca -0.31 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.02 1oie h GLU 98 Cb 1.04 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 30.30 1oie h GLU 98 CO 0.43 0.12 0.61 -1.00 -0.73 0.00 0.00 179.01 178.44 1oie h PRO 99 N 0.19 0.89 -0.22 0.92 0.13 -1.90 -1.13 132.00 130.88 1oie h PRO 99 Ca 0.15 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.19 1oie h PRO 99 Cb 0.16 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.08 1oie h PRO 99 CO -0.19 0.59 -0.01 -0.44 -0.23 0.00 0.00 178.00 177.71 1oie h ASP 100 N 0.92 0.39 -0.36 1.44 3.32 -1.75 0.12 116.42 120.50 1oie h ASP 100 Ca 0.46 -0.32 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 1oie h ASP 100 Cb 0.49 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1oie h ASP 100 CO -0.22 0.62 -0.06 -0.26 -1.72 0.00 0.00 179.24 177.60 1oie h PHE 101 N 0.16 0.75 -0.55 4.55 0.04 -1.23 0.68 116.94 121.33 1oie h PHE 101 Ca 0.06 -0.15 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 1oie h PHE 101 Cb 0.42 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 1oie h PHE 101 CO 0.04 0.81 0.27 0.00 -0.60 0.00 0.00 178.31 178.83 1oie h ARG 102 N 0.47 0.78 -0.83 1.51 3.08 -1.13 -1.64 114.38 116.62 1oie h ARG 102 Ca 0.09 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1oie h ARG 102 Cb 0.55 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.42 1oie h ARG 102 CO 0.03 0.63 0.44 0.78 -1.07 0.00 0.00 179.97 180.78 1oie h GLY 103 N 0.74 1.24 1.60 0.04 0.00 -0.61 -1.54 103.07 104.54 1oie h GLY 103 Ca 0.19 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 1oie h GLY 103 CO -0.03 0.55 0.13 -0.33 0.00 0.00 0.00 176.54 176.86 1oie h MET 104 N 1.16 0.51 -0.46 4.80 2.86 -0.47 -0.22 114.93 123.12 1oie h MET 104 Ca 0.29 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 1oie h MET 104 Cb 0.04 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1oie h MET 104 CO -0.05 0.44 0.24 -0.91 1.06 0.00 0.00 176.91 177.70 1oie h ASN 105 N 0.51 0.59 0.49 1.22 2.35 -0.33 -0.18 115.58 120.22 1oie h ASN 105 Ca 0.13 -0.11 -0.11 0.00 -0.55 0.00 0.00 56.30 55.66 1oie h ASN 105 Cb 0.13 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1oie h ASN 105 CO -0.01 0.53 -0.50 0.25 -1.65 0.00 0.00 177.43 176.05 1oie h LEU 106 N 0.61 0.01 -0.65 1.61 5.85 -0.81 -2.20 115.31 119.73 1oie h LEU 106 Ca 0.16 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.73 1oie h LEU 106 Cb 0.08 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1oie h LEU 106 CO -0.02 0.51 -0.66 0.58 -0.34 0.00 0.00 178.44 178.51 1oie h VAL 107 N 0.01 1.45 -1.22 1.05 2.07 -0.82 -3.48 116.25 115.31 1oie h VAL 107 Ca -0.00 -2.21 0.00 0.00 0.82 0.00 0.00 66.70 65.31 1oie h VAL 107 Cb 0.89 2.18 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1oie h VAL 107 CO 0.07 0.64 0.00 0.61 0.02 0.00 0.00 177.57 178.90 1oie n GLY 108 N 0.37 0.47 3.75 2.17 0.00 -0.12 -4.86 105.19 106.98 1oie n GLY 108 Ca -0.02 -0.30 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1oie n GLY 108 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oie s TYR 109 N -2.24 2.37 -0.15 1.61 1.51 -0.97 -4.73 117.35 114.76 1oie s TYR 109 Ca 0.00 1.45 0.13 0.00 -1.01 0.00 0.00 57.07 57.64 1oie s TYR 109 Cb 0.00 -3.64 -0.24 0.00 -0.11 0.00 0.00 41.96 37.97 1oie s TYR 109 CO 0.00 -2.52 0.27 -0.25 -1.11 0.00 0.00 175.55 171.94 1oie n ASP 110 N -1.21 0.66 -3.57 2.29 8.00 0.12 -4.59 116.55 118.24 1oie n ASP 110 Ca 0.12 0.15 -0.07 0.00 0.71 0.00 0.00 54.79 55.69 1oie n ASP 110 Cb 0.47 0.35 -0.03 0.00 -0.02 0.00 0.00 41.12 41.89 1oie n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oie s ALA 111 N -2.54 -1.97 0.05 2.24 0.00 -1.22 -4.00 121.76 114.33 1oie s ALA 111 Ca -0.12 1.45 0.01 0.00 0.00 0.00 0.00 51.96 53.30 1oie s ALA 111 Cb 0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 1oie s ALA 111 CO 0.80 -0.53 -0.06 0.00 0.00 0.00 0.00 175.76 175.97 1oie s MET 112 N -2.23 0.59 0.34 0.00 0.23 -0.80 -1.66 119.30 115.78 1oie s MET 112 Ca 0.06 -0.95 -0.23 0.00 -1.03 0.00 0.00 55.69 53.54 1oie s MET 112 Cb -0.01 -0.14 -0.10 0.00 -1.53 0.00 0.00 34.83 33.05 1oie s MET 112 CO -0.05 -0.00 0.90 0.00 -2.03 0.00 0.00 175.02 173.84 1oie s ALA 113 N -2.31 3.19 -0.00 3.16 0.00 -0.42 -0.19 121.76 125.19 1oie s ALA 113 Ca -0.03 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 1oie s ALA 113 Cb -0.04 -3.09 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 1oie s ALA 113 CO -0.02 0.19 1.14 0.42 0.00 0.00 0.00 175.76 177.48 1oie s ILE 114 N -1.82 4.35 0.49 0.00 1.01 -0.67 -3.18 121.20 121.38 1oie s ILE 114 Ca 0.53 1.68 0.04 0.00 0.00 0.00 0.00 60.65 62.90 1oie s ILE 114 Cb -0.14 -4.07 0.02 0.00 0.01 0.00 0.00 42.46 38.27 1oie s ILE 114 CO 0.19 0.08 0.69 -0.83 0.00 0.00 0.00 174.94 175.07 1oie s GLY 115 N 1.18 1.86 0.41 6.18 0.00 -1.26 -4.45 107.32 111.24 1oie s GLY 115 Ca 0.56 -1.45 0.10 0.00 0.00 0.00 0.00 44.72 43.92 1oie s GLY 115 CO 0.26 -1.21 2.00 3.45 0.00 0.00 0.00 173.10 177.60 1oie h ASN 116 N 0.31 0.28 0.96 1.64 -1.07 -1.91 -2.54 115.58 113.25 1oie h ASN 116 Ca -0.42 -0.03 0.00 0.00 0.07 0.00 0.00 56.30 55.92 1oie h ASN 116 Cb 1.29 -0.07 0.00 0.00 -2.07 0.00 0.00 38.32 37.47 1oie h ASN 116 CO 0.50 0.32 0.00 1.41 0.07 0.00 0.00 177.43 179.72 1oie n HIS 117 N -4.38 0.44 0.29 4.14 8.25 -1.26 -1.37 115.22 121.33 1oie n HIS 117 Ca 0.00 0.15 0.04 0.00 -0.26 0.00 0.00 57.72 57.65 1oie n HIS 117 Cb 0.17 -0.74 0.20 0.00 1.12 0.00 0.00 29.99 30.74 1oie n HIS 117 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1oie n GLU 118 N -1.88 0.01 -0.57 -0.41 4.71 -0.96 -1.76 120.64 119.78 1oie n GLU 118 Ca 0.05 0.37 0.08 0.00 -0.01 0.00 0.00 57.16 57.64 1oie n GLU 118 Cb 0.30 -1.52 0.31 0.00 -1.01 0.00 0.00 31.44 29.52 1oie n GLU 118 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1oie n PHE 119 N -1.54 1.32 0.59 -0.32 3.72 -0.47 -4.37 117.46 116.39 1oie n PHE 119 Ca 0.02 -0.73 0.12 0.00 -0.05 0.00 0.00 57.45 56.81 1oie n PHE 119 Cb 0.10 -0.31 0.46 0.00 -0.94 0.00 0.00 39.48 38.78 1oie n PHE 119 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1oie n ASP 120 N 0.30 0.56 -4.53 4.37 8.00 -0.72 -4.48 116.55 120.04 1oie n ASP 120 Ca 0.23 0.59 -0.25 0.00 0.71 0.00 0.00 54.79 56.06 1oie n ASP 120 Cb 0.92 -0.72 -0.10 0.00 -0.02 0.00 0.00 41.12 41.19 1oie n ASP 120 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1oie s ASN 121 N -4.05 3.77 0.96 -2.24 0.01 -1.26 -5.00 114.94 107.13 1oie s ASN 121 Ca 0.09 -1.10 -0.11 0.00 -0.71 0.00 0.00 52.86 51.03 1oie s ASN 121 Cb 0.12 -0.37 0.15 0.00 0.41 0.00 0.00 41.25 41.56 1oie s ASN 121 CO 0.49 -0.12 1.02 -2.65 -1.51 0.00 0.00 177.10 174.32 1oie n PRO 122 N -0.76 -0.72 0.23 -0.60 -0.02 -1.26 -4.79 135.00 127.09 1oie n PRO 122 Ca -0.05 -0.15 0.07 0.00 -2.02 0.00 0.00 63.50 61.35 1oie n PRO 122 Cb 0.62 -2.27 0.56 0.00 -0.02 0.00 0.00 33.50 32.39 1oie n PRO 122 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1oie h LEU 123 N -1.97 0.00 -0.75 2.45 5.85 -1.93 -1.60 115.31 117.36 1oie h LEU 123 Ca -0.46 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.43 1oie h LEU 123 Cb 1.28 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.18 1oie h LEU 123 CO 0.41 0.16 0.01 0.74 -0.34 0.00 0.00 178.44 179.42 1oie h THR 124 N 0.00 0.35 -0.14 1.05 2.02 -1.99 0.27 112.91 114.47 1oie h THR 124 Ca -0.00 -0.04 -0.08 0.00 0.77 0.00 0.00 66.41 67.06 1oie h THR 124 Cb 0.31 0.23 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1oie h THR 124 CO 0.02 0.02 -0.23 0.58 0.37 0.00 0.00 175.52 176.28 1oie h VAL 125 N 0.11 1.36 -0.72 3.16 2.07 -1.63 -1.64 116.25 118.97 1oie h VAL 125 Ca 0.41 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.45 1oie h VAL 125 Cb 0.72 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 32.43 1oie h VAL 125 CO -0.66 0.44 0.39 0.25 0.02 0.00 0.00 177.57 178.01 1oie h LEU 126 N 0.02 0.90 -1.22 2.57 5.85 -1.21 0.22 115.31 122.43 1oie h LEU 126 Ca 0.01 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1oie h LEU 126 Cb 0.81 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 1oie h LEU 126 CO 0.05 0.74 0.53 0.03 -0.34 0.00 0.00 178.44 179.46 1oie h ARG 127 N 0.99 1.00 -0.29 1.25 2.47 -0.47 -1.26 114.38 118.06 1oie h ARG 127 Ca 0.25 -0.06 -0.14 0.00 -1.26 0.00 0.00 59.98 58.78 1oie h ARG 127 Cb 0.04 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.13 1oie h ARG 127 CO -0.04 0.66 -0.37 0.37 0.56 0.00 0.00 179.97 181.15 1oie h GLN 128 N 1.03 0.67 -0.38 0.04 5.75 -0.25 -2.22 115.11 119.76 1oie h GLN 128 Ca 0.32 -0.33 -0.06 0.00 -0.15 0.00 0.00 58.65 58.42 1oie h GLN 128 Cb -0.01 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.53 1oie h GLN 128 CO -0.09 0.94 -0.04 1.96 -2.65 0.00 0.00 178.83 178.95 1oie h GLN 129 N 0.56 0.61 -0.60 1.69 4.20 0.04 -1.65 115.11 119.96 1oie h GLN 129 Ca 0.05 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.54 1oie h GLN 129 Cb 0.89 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.57 1oie h GLN 129 CO 0.08 0.66 0.10 0.93 -0.67 0.00 0.00 178.83 179.93 1oie h GLU 130 N 0.58 0.97 -0.58 1.46 5.08 -0.78 -0.18 114.58 121.13 1oie h GLU 130 Ca 0.11 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1oie h GLU 130 Cb 0.42 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1oie h GLU 130 CO 0.02 0.89 0.31 0.87 -1.00 0.00 0.00 179.01 180.10 1oie h LYS 131 N 0.92 0.81 -0.39 2.33 1.57 -0.93 -3.16 116.57 117.72 1oie h LYS 131 Ca 0.19 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.80 1oie h LYS 131 Cb 0.39 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1oie h LYS 131 CO 0.01 0.63 -0.01 -1.49 -0.57 0.00 0.00 179.45 178.02 1oie h TRP 132 N 0.78 0.76 -3.62 -1.35 6.55 -0.95 -3.42 115.95 114.70 1oie h TRP 132 Ca 0.20 -0.14 -0.52 0.00 0.95 0.00 0.00 58.89 59.39 1oie h TRP 132 Cb 0.06 -0.20 0.04 0.00 -0.86 0.00 0.00 29.16 28.20 1oie h TRP 132 CO -0.01 0.79 0.61 0.00 -1.05 0.00 0.00 178.44 178.78 1oie s ALA 133 N -4.97 3.49 -2.64 1.49 0.00 -0.11 -4.83 121.76 114.19 1oie s ALA 133 Ca -0.13 1.11 0.25 0.00 0.00 0.00 0.00 51.96 53.20 1oie s ALA 133 Cb 0.10 -3.45 0.66 0.00 0.00 0.00 0.00 23.12 20.43 1oie s ALA 133 CO 0.79 -0.50 1.52 1.63 0.00 0.00 0.00 175.76 179.21 1oie n LYS 134 N 1.80 1.97 -4.35 0.00 5.02 -1.26 -4.86 118.16 116.48 1oie n LYS 134 Ca 0.03 -1.43 -0.27 0.00 -2.02 0.00 0.00 58.31 54.62 1oie n LYS 134 Cb 0.43 -1.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.87 1oie n LYS 134 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1oie s PHE 135 N -1.93 2.50 0.28 2.13 -0.12 -1.26 -5.06 117.98 114.51 1oie s PHE 135 Ca 0.34 -0.28 -0.29 0.00 -0.05 0.00 0.00 56.93 56.65 1oie s PHE 135 Cb 0.20 -1.23 -0.09 0.00 -0.63 0.00 0.00 43.02 41.27 1oie s PHE 135 CO 0.31 0.51 1.13 -1.25 -0.05 0.00 0.00 175.22 175.87 1oie s PRO 136 N -2.77 4.59 -0.35 1.99 0.04 -1.26 -4.91 135.00 132.34 1oie s PRO 136 Ca 0.23 1.86 -0.14 0.00 0.04 0.00 0.00 61.00 62.99 1oie s PRO 136 Cb -0.08 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.26 1oie s PRO 136 CO 0.13 0.14 0.31 -0.51 0.04 0.00 0.00 177.00 177.11 1oie s LEU 137 N -1.37 4.52 -0.11 -3.56 1.02 -1.26 -1.90 118.68 116.02 1oie s LEU 137 Ca 0.46 -0.36 -0.02 0.00 0.02 0.00 0.00 54.13 54.23 1oie s LEU 137 Cb -0.33 -2.25 -0.03 0.00 0.02 0.00 0.00 46.19 43.60 1oie s LEU 137 CO 0.42 -0.31 -0.03 -0.76 0.02 0.00 0.00 176.35 175.69 1oie s LEU 138 N 1.89 3.34 -0.26 1.79 1.43 0.74 -4.32 118.68 123.28 1oie s LEU 138 Ca 0.09 -0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.06 1oie s LEU 138 Cb -0.17 -1.77 0.10 0.00 0.03 0.00 0.00 46.19 44.38 1oie s LEU 138 CO 0.11 0.29 0.60 -0.55 0.23 0.00 0.00 176.35 177.03 1oie s SER 139 N -0.34 -0.87 0.33 2.29 0.15 -0.32 -1.67 113.70 113.27 1oie s SER 139 Ca 0.06 1.38 0.21 0.00 0.70 0.00 0.00 55.95 58.30 1oie s SER 139 Cb -0.12 1.62 0.17 0.00 -1.71 0.00 0.00 66.02 65.98 1oie s SER 139 CO 0.02 -0.23 1.39 0.00 1.20 0.00 0.00 173.24 175.63 1oie h ALA 140 N 7.52 0.79 -0.43 5.45 0.00 -1.04 -3.37 119.26 128.18 1oie h ALA 140 Ca -0.25 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1oie h ALA 140 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1oie h ALA 140 CO 0.15 0.19 0.00 0.27 0.00 0.00 0.00 179.25 179.87 1oie n ASN 141 N -3.01 3.60 -4.51 0.00 6.94 -1.26 -4.86 115.26 112.15 1oie n ASN 141 Ca 0.02 -2.30 -0.39 0.00 -0.02 0.00 0.00 54.58 51.89 1oie n ASN 141 Cb 0.60 -0.39 -0.11 0.00 -2.36 0.00 0.00 39.78 37.52 1oie n ASN 141 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1oie s ILE 142 N -1.54 5.04 0.20 1.53 1.01 -1.26 -0.54 121.20 125.64 1oie s ILE 142 Ca 0.35 -0.18 0.11 0.00 0.00 0.00 0.00 60.65 60.93 1oie s ILE 142 Cb 0.22 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 1oie s ILE 142 CO 0.18 0.09 -0.23 -0.31 0.00 0.00 0.00 174.94 174.67 1oie s TYR 143 N 1.69 2.22 -0.20 3.97 1.51 0.95 -1.91 117.35 125.60 1oie s TYR 143 Ca 0.06 -0.37 -0.23 0.00 -1.01 0.00 0.00 57.07 55.52 1oie s TYR 143 Cb -0.17 -1.08 -0.02 0.00 -0.11 0.00 0.00 41.96 40.58 1oie s TYR 143 CO 0.09 0.50 0.73 -1.14 -1.11 0.00 0.00 175.55 174.62 1oie s GLN 144 N -2.81 4.23 0.11 -0.62 0.74 -0.60 -0.45 119.66 120.27 1oie s GLN 144 Ca 0.21 0.80 -0.21 0.00 0.05 0.00 0.00 55.36 56.21 1oie s GLN 144 Cb -0.07 -3.59 -0.10 0.00 1.10 0.00 0.00 33.01 30.35 1oie s GLN 144 CO 0.10 -0.31 1.76 0.87 -0.55 0.00 0.00 175.29 177.15 1oie h LYS 145 N 7.47 0.18 0.00 1.67 1.57 -1.60 0.44 116.57 126.30 1oie h LYS 145 Ca -0.29 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.44 1oie h LYS 145 Cb 1.13 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 1oie h LYS 145 CO 0.81 0.13 -0.19 0.66 -0.57 0.00 0.00 179.45 180.29 1oie h SER 146 N 0.18 0.00 0.00 0.86 4.64 -1.94 -3.24 113.55 114.05 1oie h SER 146 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1oie h SER 146 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1oie h SER 146 CO -0.01 0.19 -0.48 0.35 -0.87 0.00 0.00 176.83 176.01 1oie n THR 147 N -3.62 0.00 -1.36 2.95 -2.24 -1.13 -4.99 114.28 103.89 1oie n THR 147 Ca -0.01 -0.32 -0.12 0.00 -2.27 0.00 0.00 64.05 61.33 1oie n THR 147 Cb 0.32 0.84 -0.05 0.00 -2.10 0.00 0.00 70.33 69.33 1oie n THR 147 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oie n GLY 148 N 1.41 1.28 3.74 3.38 0.00 0.13 -5.02 105.19 110.11 1oie n GLY 148 Ca 0.00 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1oie n GLY 148 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oie s GLU 149 N -2.95 2.91 0.32 1.61 0.41 -1.24 -4.85 118.70 114.90 1oie s GLU 149 Ca 0.00 -0.59 -0.28 0.00 -0.41 0.00 0.00 54.97 53.69 1oie s GLU 149 Cb 0.00 -2.75 -0.13 0.00 -1.78 0.00 0.00 34.13 29.47 1oie s GLU 149 CO 0.00 0.62 1.21 0.54 -0.49 0.00 0.00 175.26 177.13 1oie n ARG 150 N 1.05 1.87 0.15 1.61 1.74 -1.26 -1.55 116.66 120.26 1oie n ARG 150 Ca -0.12 0.66 0.08 0.00 -0.77 0.00 0.00 57.85 57.69 1oie n ARG 150 Cb 0.52 -2.17 0.06 0.00 -1.02 0.00 0.00 32.46 29.85 1oie n ARG 150 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1oie h LEU 151 N 2.49 0.00 -8.88 0.55 3.38 -1.71 -3.45 115.31 107.70 1oie h LEU 151 Ca -0.44 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.16 1oie h LEU 151 Cb 1.30 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.91 1oie h LEU 151 CO 0.63 0.20 -0.65 -0.36 0.09 0.00 0.00 178.44 178.34 1oie s PHE 152 N -3.15 1.54 0.18 1.13 0.08 -1.26 -5.11 117.98 111.39 1oie s PHE 152 Ca 0.03 -0.95 -0.30 0.00 0.12 0.00 0.00 56.93 55.83 1oie s PHE 152 Cb 0.07 -0.89 -0.08 0.00 -0.57 0.00 0.00 43.02 41.54 1oie s PHE 152 CO 0.74 -0.07 1.29 0.15 -0.10 0.00 0.00 175.22 177.23 1oie s LYS 153 N -3.88 4.40 0.32 0.44 1.02 -1.26 -4.72 119.74 116.06 1oie s LYS 153 Ca 0.29 2.01 0.14 0.00 0.02 0.00 0.00 55.97 58.43 1oie s LYS 153 Cb 0.06 -3.22 0.53 0.00 -0.52 0.00 0.00 37.83 34.68 1oie s LYS 153 CO 0.09 -0.25 1.69 -1.00 -0.92 0.00 0.00 175.35 174.95 1oie h PRO 154 N 5.63 0.00 -2.84 -1.68 0.13 -1.92 -0.85 132.00 130.48 1oie h PRO 154 Ca -0.44 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.78 1oie h PRO 154 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 1oie h PRO 154 CO 0.78 0.49 0.30 1.67 -0.23 0.00 0.00 178.00 181.01 1oie s TRP 155 N -3.68 -0.15 0.02 1.56 -2.14 -1.26 -2.00 118.94 111.29 1oie s TRP 155 Ca -0.01 -0.28 0.01 0.00 2.66 0.00 0.00 56.10 58.47 1oie s TRP 155 Cb 0.12 0.70 -0.02 0.00 -3.10 0.00 0.00 33.47 31.17 1oie s TRP 155 CO 0.73 -1.16 -0.04 0.00 -2.66 0.00 0.00 176.95 173.81 1oie s ALA 156 N -3.65 0.26 -0.09 2.67 0.00 -0.30 -4.98 121.76 115.67 1oie s ALA 156 Ca 0.12 -0.60 -0.00 0.00 0.00 0.00 0.00 51.96 51.47 1oie s ALA 156 Cb -0.05 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.15 1oie s ALA 156 CO 0.06 -0.10 -0.06 -0.51 0.00 0.00 0.00 175.76 175.15 1oie s LEU 157 N -1.38 3.20 -0.01 0.00 1.43 -1.26 -1.19 118.68 119.47 1oie s LEU 157 Ca -0.13 -0.04 0.05 0.00 -1.03 0.00 0.00 54.13 52.99 1oie s LEU 157 Cb -0.09 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.40 1oie s LEU 157 CO -0.01 0.32 -0.17 -0.36 0.23 0.00 0.00 176.35 176.36 1oie s PHE 158 N -0.56 1.54 -0.30 0.29 0.08 0.59 -4.97 117.98 114.65 1oie s PHE 158 Ca 0.08 -0.30 -0.09 0.00 0.12 0.00 0.00 56.93 56.75 1oie s PHE 158 Cb -0.12 -0.98 -0.01 0.00 -0.57 0.00 0.00 43.02 41.33 1oie s PHE 158 CO 0.02 -0.02 0.14 0.15 -0.10 0.00 0.00 175.22 175.41 1oie s LYS 159 N -0.46 3.44 -0.37 0.44 1.02 -1.26 -1.27 119.74 121.27 1oie s LYS 159 Ca 0.06 -0.65 0.00 0.00 0.02 0.00 0.00 55.97 55.41 1oie s LYS 159 Cb -0.07 -3.53 0.10 0.00 -0.52 0.00 0.00 37.83 33.81 1oie s LYS 159 CO -0.00 -0.36 0.12 1.03 -0.92 0.00 0.00 175.35 175.22 1oie s ARG 160 N 1.63 1.77 7.11 1.68 1.81 -1.04 -4.97 118.95 126.94 1oie s ARG 160 Ca 0.05 -1.82 0.00 0.00 -1.72 0.00 0.00 55.73 52.24 1oie s ARG 160 Cb -0.17 -3.39 0.00 0.00 -0.45 0.00 0.00 34.95 30.95 1oie s ARG 160 CO 0.06 -0.99 0.00 1.04 -0.68 0.00 0.00 175.30 174.73 1oie n GLN 161 N 4.43 0.00 -0.09 3.54 6.02 -1.26 -1.63 117.38 128.39 1oie n GLN 161 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.08 1oie n GLN 161 Cb 0.42 0.00 0.13 0.00 1.02 0.00 0.00 30.24 31.81 1oie n GLN 161 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1oie n ASP 162 N 9.60 2.44 -4.78 1.08 5.75 -1.26 -5.00 116.55 124.38 1oie n ASP 162 Ca 0.00 -2.91 -0.37 0.00 -0.01 0.00 0.00 54.79 51.50 1oie n ASP 162 Cb 0.00 -0.38 -0.06 0.00 -1.03 0.00 0.00 41.12 39.65 1oie n ASP 162 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1oie s LEU 163 N -2.58 4.35 -0.24 -2.12 1.43 -0.64 -4.72 118.68 114.15 1oie s LEU 163 Ca 0.28 1.79 -0.06 0.00 -1.03 0.00 0.00 54.13 55.11 1oie s LEU 163 Cb 0.24 -3.95 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 1oie s LEU 163 CO 0.03 -0.05 0.03 -0.75 0.23 0.00 0.00 176.35 175.85 1oie s LYS 164 N -2.02 3.48 -0.13 1.70 2.20 -1.26 -2.50 119.74 121.22 1oie s LYS 164 Ca 0.49 -0.58 0.03 0.00 -0.36 0.00 0.00 55.97 55.55 1oie s LYS 164 Cb -0.19 -3.22 0.01 0.00 -1.51 0.00 0.00 37.83 32.92 1oie s LYS 164 CO 0.24 -0.22 -0.22 0.42 -0.36 0.00 0.00 175.35 175.20 1oie s ILE 165 N 1.55 2.04 -0.13 5.43 1.01 -0.39 -0.60 121.20 130.11 1oie s ILE 165 Ca 0.06 -0.98 -0.03 0.00 0.00 0.00 0.00 60.65 59.69 1oie s ILE 165 Cb -0.15 -1.79 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 1oie s ILE 165 CO 0.01 0.55 -0.00 0.00 0.00 0.00 0.00 174.94 175.50 1oie s ALA 166 N 0.68 3.20 -0.19 9.38 0.00 0.49 -0.30 121.76 135.03 1oie s ALA 166 Ca -0.10 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.07 1oie s ALA 166 Cb -0.16 -1.58 0.02 0.00 0.00 0.00 0.00 23.12 21.40 1oie s ALA 166 CO 0.01 0.38 -0.19 0.08 0.00 0.00 0.00 175.76 176.04 1oie s VAL 167 N -0.20 2.08 0.05 0.00 1.01 -0.33 -0.52 120.40 122.49 1oie s VAL 167 Ca 0.05 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 1oie s VAL 167 Cb -0.13 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1oie s VAL 167 CO 0.02 0.50 0.22 0.27 0.00 0.00 0.00 175.10 176.11 1oie s ILE 168 N 1.28 5.37 0.09 2.22 -4.36 0.24 -1.15 121.20 124.89 1oie s ILE 168 Ca 0.04 -0.25 0.06 0.00 -0.26 0.00 0.00 60.65 60.24 1oie s ILE 168 Cb -0.14 -3.60 -0.04 0.00 1.25 0.00 0.00 42.46 39.93 1oie s ILE 168 CO -0.12 0.19 -0.05 -0.83 0.24 0.00 0.00 174.94 174.37 1oie s GLY 169 N -2.30 1.85 -0.09 6.27 0.00 -0.85 0.15 107.32 112.35 1oie s GLY 169 Ca 0.33 -1.17 -0.07 0.00 0.00 0.00 0.00 44.72 43.81 1oie s GLY 169 CO 0.24 -1.15 0.23 1.08 0.00 0.00 0.00 173.10 173.51 1oie s LEU 170 N -2.21 0.95 -0.02 0.66 1.43 -0.83 -0.65 118.68 118.01 1oie s LEU 170 Ca 0.23 0.47 0.07 0.00 -1.03 0.00 0.00 54.13 53.88 1oie s LEU 170 Cb -0.11 0.76 -0.02 0.00 0.03 0.00 0.00 46.19 46.85 1oie s LEU 170 CO 0.16 -0.10 -0.25 -0.89 0.23 0.00 0.00 176.35 175.50 1oie s THR 171 N 0.41 1.95 0.32 5.49 2.01 -1.26 -0.91 115.64 123.65 1oie s THR 171 Ca -0.02 -1.05 -0.29 0.00 0.31 0.00 0.00 61.69 60.63 1oie s THR 171 Cb -0.04 -1.62 -0.12 0.00 0.01 0.00 0.00 72.50 70.73 1oie s THR 171 CO -0.02 0.55 1.55 1.07 -0.69 0.00 0.00 174.62 177.08 1oie n THR 172 N 2.55 1.33 1.61 -0.82 5.66 -0.62 -4.65 114.28 119.33 1oie n THR 172 Ca -0.16 -0.33 0.03 0.00 -3.05 0.00 0.00 64.05 60.53 1oie n THR 172 Cb 0.52 -1.93 0.09 0.00 -1.55 0.00 0.00 70.33 67.45 1oie n THR 172 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1oie n ASP 173 N 1.64 0.66 -0.00 1.09 5.75 -1.26 -2.51 116.55 121.92 1oie n ASP 173 Ca 0.06 -1.97 0.14 0.00 -0.01 0.00 0.00 54.79 53.02 1oie n ASP 173 Cb 0.37 -0.08 0.65 0.00 -1.03 0.00 0.00 41.12 41.03 1oie n ASP 173 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1oie n ASP 174 N -0.15 0.01 -0.10 -1.12 8.00 -1.26 -4.50 116.55 117.43 1oie n ASP 174 Ca 0.05 0.33 -0.06 0.00 0.71 0.00 0.00 54.79 55.82 1oie n ASP 174 Cb 0.11 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 1oie n ASP 174 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1oie h THR 175 N 0.00 0.44 -0.06 -3.53 2.02 -1.87 -0.15 112.91 109.76 1oie h THR 175 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1oie h THR 175 Cb 0.45 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1oie h THR 175 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 1oie n ALA 176 N -2.82 2.58 0.64 6.16 0.00 -1.26 -3.79 120.51 122.01 1oie n ALA 176 Ca 0.01 -0.36 0.10 0.00 0.00 0.00 0.00 53.44 53.19 1oie n ALA 176 Cb 0.28 -1.22 -0.14 0.00 0.00 0.00 0.00 19.45 18.37 1oie n ALA 176 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1oie n LYS 177 N -0.17 0.24 -3.49 0.00 5.02 -0.09 -4.75 118.16 114.92 1oie n LYS 177 Ca 0.18 -0.07 -0.38 0.00 -2.02 0.00 0.00 58.31 56.01 1oie n LYS 177 Cb 0.24 -1.51 -0.06 0.00 -0.02 0.00 0.00 35.03 33.69 1oie n LYS 177 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1oie s ILE 178 N -3.19 5.03 0.00 -0.18 1.01 -1.08 -4.93 121.20 117.87 1oie s ILE 178 Ca 0.02 0.85 0.00 0.00 0.00 0.00 0.00 60.65 61.52 1oie s ILE 178 Cb 0.15 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1oie s ILE 178 CO 0.88 0.57 0.00 0.61 0.00 0.00 0.00 174.94 177.00 1oie n GLY 179 N 1.89 2.08 3.22 6.18 0.00 -1.26 -3.84 105.19 113.45 1oie n GLY 179 Ca -0.14 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 1oie n GLY 179 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1oie s ASN 180 N -4.00 5.78 0.32 1.61 3.04 -1.07 -4.51 114.94 116.10 1oie s ASN 180 Ca 0.00 -2.05 -0.28 0.00 0.04 0.00 0.00 52.86 50.56 1oie s ASN 180 Cb 0.00 -2.03 -0.10 0.00 -1.54 0.00 0.00 41.25 37.59 1oie s ASN 180 CO 0.00 -0.67 1.18 -2.16 -3.04 0.00 0.00 177.10 172.41 1oie s PRO 181 N 1.16 4.45 0.03 0.43 0.04 -1.25 -4.92 135.00 134.94 1oie s PRO 181 Ca 0.08 1.94 -0.02 0.00 0.04 0.00 0.00 61.00 63.04 1oie s PRO 181 Cb -0.25 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.22 1oie s PRO 181 CO -0.01 -0.01 -0.04 0.39 0.04 0.00 0.00 177.00 177.37 1oie n GLU 182 N 0.87 0.06 -2.56 4.56 1.02 -1.26 -4.94 120.64 118.39 1oie n GLU 182 Ca 0.00 0.03 -0.34 0.00 -0.02 0.00 0.00 57.16 56.83 1oie n GLU 182 Cb 0.44 -0.61 0.00 0.00 -0.02 0.00 0.00 31.44 31.25 1oie n GLU 182 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1oie n TYR 183 N -3.45 3.32 -1.15 -0.32 4.01 -1.26 -4.65 117.16 113.66 1oie n TYR 183 Ca -0.03 -3.05 0.06 0.00 -0.16 0.00 0.00 57.90 54.72 1oie n TYR 183 Cb 0.23 -0.79 0.22 0.00 -0.31 0.00 0.00 39.34 38.69 1oie n TYR 183 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1oie n PHE 184 N -0.28 0.71 -1.69 -0.72 3.72 -1.26 -4.80 117.46 113.14 1oie n PHE 184 Ca 0.42 -1.10 -0.50 0.00 -0.05 0.00 0.00 57.45 56.22 1oie n PHE 184 Cb 0.36 -0.31 -0.05 0.00 -0.94 0.00 0.00 39.48 38.54 1oie n PHE 184 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1oie n THR 185 N -0.90 0.53 -2.33 4.37 -1.04 -1.26 -1.68 114.28 111.97 1oie n THR 185 Ca 0.23 -0.10 -0.20 0.00 -2.04 0.00 0.00 64.05 61.94 1oie n THR 185 Cb 0.86 -1.76 -0.02 0.00 -1.82 0.00 0.00 70.33 67.59 1oie n THR 185 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1oie n ASP 186 N 6.41 -5.63 -4.21 8.00 2.03 -1.26 -4.99 116.55 116.90 1oie n ASP 186 Ca 0.23 0.06 -0.20 0.00 0.52 0.00 0.00 54.79 55.40 1oie n ASP 186 Cb 0.26 -4.72 -0.12 0.00 -0.72 0.00 0.00 41.12 35.82 1oie n ASP 186 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1oie s ILE 187 N -2.96 1.30 0.07 5.18 1.01 -0.68 -1.59 121.20 123.54 1oie s ILE 187 Ca 0.00 -1.37 -0.10 0.00 0.00 0.00 0.00 60.65 59.18 1oie s ILE 187 Cb 0.00 -1.22 0.01 0.00 0.01 0.00 0.00 42.46 41.25 1oie s ILE 187 CO 0.00 -0.16 0.23 -1.83 0.00 0.00 0.00 174.94 173.17 1oie s GLU 188 N -1.77 0.82 -0.24 2.79 -1.05 0.41 -4.78 118.70 114.88 1oie s GLU 188 Ca 0.01 -0.80 0.01 0.00 -0.15 0.00 0.00 54.97 54.04 1oie s GLU 188 Cb -0.10 0.34 0.04 0.00 -0.44 0.00 0.00 34.13 33.98 1oie s GLU 188 CO 0.03 -0.26 -0.11 -0.06 0.95 0.00 0.00 175.26 175.80 1oie s PHE 189 N -3.37 3.12 0.56 4.83 0.08 -1.26 -0.03 117.98 121.91 1oie s PHE 189 Ca 0.01 -1.99 -0.04 0.00 0.12 0.00 0.00 56.93 55.03 1oie s PHE 189 Cb 0.02 -1.97 0.01 0.00 -0.57 0.00 0.00 43.02 40.51 1oie s PHE 189 CO -0.08 -0.83 0.84 1.03 -0.10 0.00 0.00 175.22 176.08 1oie s ARG 190 N 1.20 2.95 0.06 0.44 0.52 0.29 -4.80 118.95 119.61 1oie s ARG 190 Ca -0.04 -0.13 -0.30 0.00 -0.52 0.00 0.00 55.73 54.74 1oie s ARG 190 Cb -0.18 -2.34 -0.09 0.00 0.52 0.00 0.00 34.95 32.86 1oie s ARG 190 CO -0.06 -0.60 1.95 0.15 0.02 0.00 0.00 175.30 176.76 1oie s LYS 191 N -4.88 4.14 0.22 3.54 1.02 -1.26 -4.63 119.74 117.88 1oie s LYS 191 Ca 0.53 2.62 -0.07 0.00 0.02 0.00 0.00 55.97 59.07 1oie s LYS 191 Cb -0.10 -4.05 0.18 0.00 -0.52 0.00 0.00 37.83 33.34 1oie s LYS 191 CO 0.43 -0.94 1.73 -1.35 -0.92 0.00 0.00 175.35 174.31 1oie h PRO 192 N 10.21 1.06 -1.00 -1.68 0.11 -1.93 -2.20 132.00 136.57 1oie h PRO 192 Ca -0.49 -0.26 0.07 0.00 0.11 0.00 0.00 66.00 65.43 1oie h PRO 192 Cb 1.23 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 32.14 1oie h PRO 192 CO 0.94 0.95 0.64 0.00 -0.21 0.00 0.00 178.00 180.33 1oie h ALA 193 N 1.14 1.43 -0.15 -0.75 0.00 -1.94 -0.05 119.26 118.94 1oie h ALA 193 Ca 0.21 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 1oie h ALA 193 Cb 0.39 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1oie h ALA 193 CO 0.01 0.41 -0.77 -0.44 0.00 0.00 0.00 179.25 178.46 1oie h ASP 194 N 1.15 0.90 -0.57 0.00 3.32 -1.90 -3.01 116.42 116.31 1oie h ASP 194 Ca 0.44 -0.58 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 1oie h ASP 194 Cb 0.20 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 1oie h ASP 194 CO -0.18 1.38 0.21 -0.08 -1.72 0.00 0.00 179.24 178.85 1oie h GLU 195 N 0.52 0.91 -0.47 3.56 4.57 -0.82 -2.82 114.58 120.04 1oie h GLU 195 Ca -0.05 -0.16 0.02 0.00 -1.18 0.00 0.00 59.36 57.99 1oie h GLU 195 Cb 1.39 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.80 1oie h GLU 195 CO 0.16 0.77 0.29 0.00 -1.18 0.00 0.00 179.01 179.04 1oie h ALA 196 N 1.34 0.59 -0.27 2.92 0.00 -0.89 0.14 119.26 123.09 1oie h ALA 196 Ca 0.20 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.16 1oie h ALA 196 Cb 0.23 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1oie h ALA 196 CO -0.01 -0.01 -0.09 0.87 0.00 0.00 0.00 179.25 180.00 1oie h LYS 197 N 0.58 -0.04 -0.59 0.00 1.57 -1.38 0.47 116.57 117.18 1oie h LYS 197 Ca 0.18 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 1oie h LYS 197 Cb -0.01 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1oie h LYS 197 CO -0.07 -0.03 0.29 -0.07 -0.57 0.00 0.00 179.45 179.00 1oie h LEU 198 N -0.04 0.76 -0.22 2.94 3.38 -1.26 -2.38 115.31 118.48 1oie h LEU 198 Ca 0.14 -0.12 -0.21 0.00 0.09 0.00 0.00 57.88 57.77 1oie h LEU 198 Cb 0.25 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.81 1oie h LEU 198 CO -0.30 0.67 -0.77 0.58 0.09 0.00 0.00 178.44 178.71 1oie h VAL 199 N 0.80 1.30 -0.65 1.22 2.07 -0.11 -1.99 116.25 118.89 1oie h VAL 199 Ca 0.20 -2.01 -0.04 0.00 0.82 0.00 0.00 66.70 65.67 1oie h VAL 199 Cb 0.11 2.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1oie h VAL 199 CO -0.03 0.63 0.24 0.40 0.02 0.00 0.00 177.57 178.83 1oie h ILE 200 N 0.48 1.24 -0.33 4.57 2.04 -0.94 -1.52 117.51 123.05 1oie h ILE 200 Ca -0.05 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 1oie h ILE 200 Cb 1.38 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1oie h ILE 200 CO 0.15 0.30 0.07 -0.61 0.00 0.00 0.00 178.15 178.07 1oie h GLN 201 N 0.92 0.54 -0.65 2.37 4.15 -1.21 -0.92 115.11 120.30 1oie h GLN 201 Ca 0.21 -0.13 -0.07 0.00 0.77 0.00 0.00 58.65 59.42 1oie h GLN 201 Cb 0.24 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 1oie h GLN 201 CO -0.01 0.61 0.12 1.49 -1.93 0.00 0.00 178.83 179.10 1oie h GLU 202 N 0.38 1.06 -0.38 1.69 4.81 -1.25 -1.75 114.58 119.14 1oie h GLU 202 Ca 0.10 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 59.03 1oie h GLU 202 Cb 0.32 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1oie h GLU 202 CO 0.00 0.97 0.12 -0.07 -0.73 0.00 0.00 179.01 179.30 1oie h LEU 203 N 1.00 0.55 -0.63 1.64 3.38 -1.09 -1.23 115.31 118.93 1oie h LEU 203 Ca 0.20 -0.20 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1oie h LEU 203 Cb 0.41 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1oie h LEU 203 CO 0.01 0.61 -0.23 1.56 0.09 0.00 0.00 178.44 180.48 1oie h GLN 204 N 0.47 0.84 -0.23 1.13 1.08 -0.93 0.33 115.11 117.80 1oie h GLN 204 Ca 0.12 -0.34 -0.07 0.00 -1.45 0.00 0.00 58.65 56.91 1oie h GLN 204 Cb 0.25 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 1oie h GLN 204 CO -0.00 0.98 -0.14 0.37 -0.95 0.00 0.00 178.83 179.08 1oie h GLN 205 N 0.72 0.50 0.00 1.46 5.75 -1.25 -2.56 115.11 119.73 1oie h GLN 205 Ca 0.10 -0.23 -0.21 0.00 -0.15 0.00 0.00 58.65 58.16 1oie h GLN 205 Cb 0.76 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.26 1oie h GLN 205 CO 0.06 0.79 -1.73 0.25 -2.65 0.00 0.00 178.83 175.55 1oie n THR 206 N -4.48 1.15 0.00 2.39 -2.24 -0.47 -4.68 114.28 105.94 1oie n THR 206 Ca -0.04 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1oie n THR 206 Cb 0.36 -0.63 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1oie n THR 206 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1oie n GLU 207 N -2.80 1.34 -3.95 -0.78 -0.58 0.11 -5.05 120.64 108.93 1oie n GLU 207 Ca -0.15 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.22 1oie n GLU 207 Cb 0.90 -0.90 0.01 0.00 -0.57 0.00 0.00 31.44 30.89 1oie n GLU 207 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1oie n LYS 208 N -1.23 -0.82 -1.83 3.49 4.81 -0.69 -4.84 118.16 117.03 1oie n LYS 208 Ca 0.00 0.38 -0.41 0.00 -0.87 0.00 0.00 58.31 57.41 1oie n LYS 208 Cb 0.03 -2.44 -0.00 0.00 0.02 0.00 0.00 35.03 32.64 1oie n LYS 208 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1oie s PRO 209 N -6.32 4.09 0.35 1.64 0.02 -1.26 -4.89 135.00 128.64 1oie s PRO 209 Ca 0.28 2.52 0.06 0.00 0.02 0.00 0.00 61.00 63.88 1oie s PRO 209 Cb -0.15 -2.95 0.66 0.00 0.02 0.00 0.00 34.50 32.08 1oie s PRO 209 CO 0.94 -0.53 1.87 -0.44 -0.33 0.00 0.00 177.00 178.51 1oie h ASP 210 N 2.97 0.38 -3.61 2.53 3.32 -1.18 -3.43 116.42 117.39 1oie h ASP 210 Ca -0.51 -0.08 -0.24 0.00 0.02 0.00 0.00 57.03 56.22 1oie h ASP 210 Cb 1.24 -0.10 -0.30 0.00 0.22 0.00 0.00 39.33 40.39 1oie h ASP 210 CO 0.64 0.50 -0.65 -0.63 -1.72 0.00 0.00 179.24 177.39 1oie s ILE 211 N -4.81 -0.03 -0.10 0.35 1.01 -1.16 -4.82 121.20 111.64 1oie s ILE 211 Ca -0.07 0.10 0.04 0.00 0.00 0.00 0.00 60.65 60.72 1oie s ILE 211 Cb 0.15 -0.14 -0.00 0.00 0.01 0.00 0.00 42.46 42.48 1oie s ILE 211 CO 0.75 0.04 -0.23 -0.63 0.00 0.00 0.00 174.94 174.88 1oie s ILE 212 N 0.59 2.17 0.07 2.92 1.01 -1.26 -0.38 121.20 126.32 1oie s ILE 212 Ca -0.05 -0.98 0.08 0.00 0.00 0.00 0.00 60.65 59.71 1oie s ILE 212 Cb -0.06 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 1oie s ILE 212 CO -0.02 0.56 -0.23 -0.63 0.00 0.00 0.00 174.94 174.62 1oie s ILE 213 N 0.35 1.83 -0.21 2.92 1.01 0.33 -1.11 121.20 126.31 1oie s ILE 213 Ca -0.18 -1.37 -0.03 0.00 0.00 0.00 0.00 60.65 59.07 1oie s ILE 213 Cb -0.18 -1.61 -0.01 0.00 0.01 0.00 0.00 42.46 40.68 1oie s ILE 213 CO 0.08 0.16 -0.06 0.00 0.00 0.00 0.00 174.94 175.13 1oie s ALA 214 N -0.91 2.76 -0.27 9.38 0.00 -0.83 -0.59 121.76 131.31 1oie s ALA 214 Ca 0.09 -1.16 -0.17 0.00 0.00 0.00 0.00 51.96 50.71 1oie s ALA 214 Cb -0.09 -1.64 -0.03 0.00 0.00 0.00 0.00 23.12 21.36 1oie s ALA 214 CO 0.03 -0.39 0.49 0.00 0.00 0.00 0.00 175.76 175.88 1oie s ALA 215 N 1.41 3.58 0.11 0.00 0.00 0.12 -0.35 121.76 126.64 1oie s ALA 215 Ca 0.05 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.39 1oie s ALA 215 Cb -0.14 -2.86 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 1oie s ALA 215 CO -0.04 -0.75 -0.10 0.95 0.00 0.00 0.00 175.76 175.83 1oie s THR 216 N 2.27 0.98 -0.53 0.00 -4.23 0.17 -1.96 115.64 112.33 1oie s THR 216 Ca 0.20 -1.81 0.07 0.00 -1.18 0.00 0.00 61.69 58.97 1oie s THR 216 Cb -0.16 -1.55 0.30 0.00 1.34 0.00 0.00 72.50 72.43 1oie s THR 216 CO 0.09 -0.66 0.79 1.57 -0.54 0.00 0.00 174.62 175.88 1oie n HIS 217 N 0.25 2.64 0.00 3.99 -0.00 -0.08 -2.57 115.22 119.45 1oie n HIS 217 Ca -0.14 -3.95 0.00 0.00 0.46 0.00 0.00 57.72 54.09 1oie n HIS 217 Cb 0.59 -0.48 0.00 0.00 -0.12 0.00 0.00 29.99 29.98 1oie n HIS 217 CO 0.00 0.00 0.00 -1.33 0.46 0.00 0.00 176.34 175.47 1oie n MET 218 N 0.40 2.80 0.00 1.57 2.81 -1.25 -1.59 117.12 121.86 1oie n MET 218 Ca 0.28 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.17 1oie n MET 218 Cb 0.46 -0.87 0.00 0.00 -0.71 0.00 0.00 33.22 32.10 1oie n MET 218 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1oie n GLY 219 N 2.39 2.38 3.65 3.03 0.00 -0.80 -4.40 105.19 111.44 1oie n GLY 219 Ca 0.00 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.10 1oie n GLY 219 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1oie s HIS 220 N -0.89 3.32 -0.06 1.61 2.46 -1.26 -1.34 115.29 119.13 1oie s HIS 220 Ca 0.00 0.43 0.04 0.00 0.47 0.00 0.00 55.06 56.00 1oie s HIS 220 Cb 0.00 -2.45 -0.00 0.00 -0.13 0.00 0.00 32.58 30.00 1oie s HIS 220 CO 0.00 -0.03 -0.20 0.71 -2.47 0.00 0.00 174.74 172.75 1oie s TYR 221 N 1.39 2.03 0.06 3.88 2.02 -1.26 -4.93 117.35 120.54 1oie s TYR 221 Ca 0.14 -0.67 -0.37 0.00 -0.37 0.00 0.00 57.07 55.80 1oie s TYR 221 Cb -0.15 -1.37 -0.16 0.00 -0.40 0.00 0.00 41.96 39.88 1oie s TYR 221 CO 0.07 -0.25 1.42 -0.25 -1.57 0.00 0.00 175.55 174.98 1oie n ASP 222 N 3.26 1.96 -1.49 2.29 8.00 -1.26 -1.32 116.55 127.99 1oie n ASP 222 Ca -0.19 1.11 -0.17 0.00 0.71 0.00 0.00 54.79 56.25 1oie n ASP 222 Cb 0.53 -1.22 -0.07 0.00 -0.02 0.00 0.00 41.12 40.33 1oie n ASP 222 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1oie n ASN 223 N 2.99 -4.39 -0.13 -2.24 5.15 -1.22 -0.63 115.26 114.79 1oie n ASN 223 Ca 0.19 0.41 -0.02 0.00 -0.60 0.00 0.00 54.58 54.56 1oie n ASN 223 Cb 0.20 -3.97 -0.01 0.00 -0.53 0.00 0.00 39.78 35.47 1oie n ASN 223 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1oie n GLY 224 N -0.31 0.53 3.53 8.20 0.00 -0.43 -4.93 105.19 111.78 1oie n GLY 224 Ca -0.17 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 1oie n GLY 224 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1oie n GLU 225 N -2.61 2.84 0.01 1.61 1.02 0.20 -4.74 120.64 118.97 1oie n GLU 225 Ca -0.02 -3.06 0.13 0.00 -0.02 0.00 0.00 57.16 54.19 1oie n GLU 225 Cb 0.10 -3.53 0.57 0.00 -0.02 0.00 0.00 31.44 28.56 1oie n GLU 225 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 1oie n HIS 226 N 9.49 0.07 -1.18 -0.32 1.44 -1.26 -4.66 115.22 118.79 1oie n HIS 226 Ca 0.48 0.02 0.00 0.00 -2.01 0.00 0.00 57.72 56.21 1oie n HIS 226 Cb 0.46 -0.53 0.00 0.00 0.12 0.00 0.00 29.99 30.03 1oie n HIS 226 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1oie n GLY 227 N 1.29 3.37 0.20 -1.39 0.00 -1.26 -1.45 105.19 105.95 1oie n GLY 227 Ca 0.06 -0.16 0.15 0.00 0.00 0.00 0.00 46.02 46.07 1oie n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oie s ASN 229 N -2.14 5.70 0.39 0.00 -0.87 -0.53 -4.87 114.94 112.62 1oie s ASN 229 Ca 0.39 1.68 -0.27 0.00 -1.57 0.00 0.00 52.86 53.09 1oie s ASN 229 Cb 0.21 -2.51 -0.11 0.00 -0.02 0.00 0.00 41.25 38.82 1oie s ASN 229 CO 0.39 -1.22 1.32 0.00 -2.57 0.00 0.00 177.10 175.02 1oie n ALA 230 N -2.53 1.53 -1.51 0.60 0.00 -1.26 -4.86 120.51 112.48 1oie n ALA 230 Ca 0.08 0.31 -0.40 0.00 0.00 0.00 0.00 53.44 53.43 1oie n ALA 230 Cb 0.53 -2.30 0.02 0.00 0.00 0.00 0.00 19.45 17.71 1oie n ALA 230 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1oie n PRO 231 N 0.26 0.76 0.00 0.00 -0.02 -1.26 -4.94 135.00 129.80 1oie n PRO 231 Ca 0.05 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1oie n PRO 231 Cb 0.38 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1oie n PRO 231 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oie n GLY 232 N 1.59 4.64 0.09 -1.23 0.00 -1.26 -4.93 105.19 104.09 1oie n GLY 232 Ca 0.11 -1.79 -0.11 0.00 0.00 0.00 0.00 46.02 44.24 1oie n GLY 232 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1oie h ASP 233 N 0.00 0.18 0.09 1.61 3.32 -1.46 -2.08 116.42 118.08 1oie h ASP 233 Ca 0.00 -0.14 0.02 0.00 0.02 0.00 0.00 57.03 56.93 1oie h ASP 233 Cb 0.00 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 1oie h ASP 233 CO 0.00 0.27 -0.35 0.58 -1.72 0.00 0.00 179.24 178.02 1oie h VAL 234 N 0.07 0.26 -0.76 -1.35 2.07 -1.88 0.16 116.25 114.82 1oie h VAL 234 Ca 0.04 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.64 1oie h VAL 234 Cb 0.14 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.11 1oie h VAL 234 CO -0.00 0.00 0.43 -0.08 0.02 0.00 0.00 177.57 177.94 1oie h GLU 235 N -0.56 0.75 -0.33 1.57 4.81 -1.88 -0.52 114.58 118.41 1oie h GLU 235 Ca 0.04 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1oie h GLU 235 Cb 0.61 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 1oie h GLU 235 CO -0.23 0.49 0.17 1.98 -0.73 0.00 0.00 179.01 180.70 1oie h MET 236 N 0.77 0.46 -0.60 1.92 4.05 -1.03 -1.44 114.93 119.06 1oie h MET 236 Ca 0.35 -0.06 0.07 0.00 -0.28 0.00 0.00 59.70 59.78 1oie h MET 236 Cb 0.25 -0.09 -0.06 0.00 -0.80 0.00 0.00 31.60 30.91 1oie h MET 236 CO -0.21 0.41 0.29 0.00 0.23 0.00 0.00 176.91 177.63 1oie h ALA 237 N 1.03 0.79 -0.11 0.39 0.00 -0.09 -0.73 119.26 120.54 1oie h ALA 237 Ca 0.11 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1oie h ALA 237 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1oie h ALA 237 CO -0.02 -0.09 -0.17 0.00 0.00 0.00 0.00 179.25 178.98 1oie h ARG 238 N 0.52 0.18 0.00 0.00 3.08 -0.84 -2.99 114.38 114.33 1oie h ARG 238 Ca 0.28 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.21 1oie h ARG 238 Cb 0.26 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1oie h ARG 238 CO -0.23 0.35 -0.81 0.00 -1.07 0.00 0.00 179.97 178.22 1oie h ALA 239 N 1.67 0.68 -2.40 0.04 0.00 -0.21 -3.47 119.26 115.57 1oie h ALA 239 Ca 0.03 -0.38 -0.50 0.00 0.00 0.00 0.00 54.91 54.06 1oie h ALA 239 Cb 0.40 0.06 0.08 0.00 0.00 0.00 0.00 17.79 18.33 1oie h ALA 239 CO 0.03 0.45 0.39 -0.51 0.00 0.00 0.00 179.25 179.61 1oie s LEU 240 N -5.95 2.97 0.36 0.00 1.43 -0.38 -5.00 118.68 112.11 1oie s LEU 240 Ca 0.01 1.34 -0.28 0.00 -1.03 0.00 0.00 54.13 54.17 1oie s LEU 240 Cb 0.08 -4.19 -0.11 0.00 0.03 0.00 0.00 46.19 42.00 1oie s LEU 240 CO 0.76 -1.36 1.48 -2.84 0.23 0.00 0.00 176.35 174.62 1oie s PRO 241 N -5.21 4.14 0.19 1.29 0.02 -1.26 -4.89 135.00 129.28 1oie s PRO 241 Ca 0.58 2.53 -0.33 0.00 0.02 0.00 0.00 61.00 63.80 1oie s PRO 241 Cb -0.12 -2.99 -0.15 0.00 0.02 0.00 0.00 34.50 31.26 1oie s PRO 241 CO 0.54 -0.51 1.35 0.00 -0.33 0.00 0.00 177.00 178.04 1oie n ALA 242 N 0.76 0.29 -1.38 -1.55 0.00 -1.26 -1.76 120.51 115.61 1oie n ALA 242 Ca 0.02 0.45 -0.13 0.00 0.00 0.00 0.00 53.44 53.77 1oie n ALA 242 Cb 0.39 -2.18 -0.06 0.00 0.00 0.00 0.00 19.45 17.60 1oie n ALA 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oie n GLY 243 N 2.35 1.31 0.08 0.00 0.00 -0.63 -4.85 105.19 103.45 1oie n GLY 243 Ca 0.14 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.18 1oie n GLY 243 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1oie n SER 244 N -0.92 0.54 -4.31 1.61 3.41 -0.72 -4.42 113.62 108.80 1oie n SER 244 Ca -0.13 0.59 -0.29 0.00 -0.26 0.00 0.00 58.87 58.77 1oie n SER 244 Cb 0.55 -0.72 -0.15 0.00 -0.26 0.00 0.00 64.21 63.64 1oie n SER 244 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1oie s LEU 245 N -4.08 2.14 0.09 1.04 1.43 -1.26 -4.78 118.68 113.26 1oie s LEU 245 Ca 0.08 -0.54 -0.22 0.00 -1.03 0.00 0.00 54.13 52.42 1oie s LEU 245 Cb 0.12 -1.21 -0.14 0.00 0.03 0.00 0.00 46.19 44.99 1oie s LEU 245 CO 0.47 0.25 1.73 0.00 0.23 0.00 0.00 176.35 179.03 1oie h ALA 246 N 4.98 0.05 -2.84 4.21 0.00 -1.33 -3.42 119.26 120.91 1oie h ALA 246 Ca -0.45 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1oie h ALA 246 Cb 1.14 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.80 1oie h ALA 246 CO 0.44 -0.45 0.01 0.00 0.00 0.00 0.00 179.25 179.25 1oie s MET 247 N -6.14 1.25 -0.22 0.00 0.00 -1.26 -3.13 119.30 109.81 1oie s MET 247 Ca -0.13 -0.77 -0.02 0.00 0.00 0.00 0.00 55.69 54.77 1oie s MET 247 Cb 0.06 0.51 0.01 0.00 0.00 0.00 0.00 34.83 35.41 1oie s MET 247 CO 0.67 -0.52 -0.09 0.42 0.00 0.00 0.00 175.02 175.50 1oie s ILE 248 N -3.84 2.91 -0.47 3.16 1.01 0.19 -1.97 121.20 122.19 1oie s ILE 248 Ca 0.06 -0.76 -0.19 0.00 0.00 0.00 0.00 60.65 59.77 1oie s ILE 248 Cb 0.00 -2.35 0.04 0.00 0.01 0.00 0.00 42.46 40.16 1oie s ILE 248 CO -0.07 0.38 0.57 -0.69 0.00 0.00 0.00 174.94 175.13 1oie s VAL 249 N 1.39 4.93 0.07 2.92 1.01 0.53 -1.09 120.40 130.16 1oie s VAL 249 Ca 0.04 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1oie s VAL 249 Cb -0.15 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.04 1oie s VAL 249 CO -0.06 -0.65 0.06 0.61 0.00 0.00 0.00 175.10 175.06 1oie n GLY 250 N 5.13 2.84 0.00 4.51 0.00 -0.06 -0.66 105.19 116.95 1oie n GLY 250 Ca -0.06 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.78 1oie n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oie n GLY 251 N 4.13 0.94 4.66 -0.02 0.00 -1.06 -4.29 105.19 109.55 1oie n GLY 251 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1oie n GLY 251 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1oie n HIS 252 N 0.00 0.00 0.20 1.61 -0.00 -1.26 -1.90 115.22 113.87 1oie n HIS 252 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.72 57.78 1oie n HIS 252 Cb 0.00 0.00 0.39 0.00 -0.00 0.00 0.00 29.99 30.38 1oie n HIS 252 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1oie h SER 253 N 0.00 0.00 -4.79 0.26 4.64 -1.92 -3.48 113.55 108.26 1oie h SER 253 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1oie h SER 253 Cb 0.00 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.16 1oie h SER 253 CO 0.00 0.34 -0.29 0.00 -0.87 0.00 0.00 176.83 176.02 1oie n GLN 254 N -3.62 -1.29 -4.15 4.77 6.02 -1.26 -5.00 117.38 112.85 1oie n GLN 254 Ca -0.01 0.98 -0.14 0.00 -0.01 0.00 0.00 57.00 57.82 1oie n GLN 254 Cb 0.46 -4.70 -0.11 0.00 1.02 0.00 0.00 30.24 26.91 1oie n GLN 254 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1oie s ASP 255 N -2.99 1.33 -0.40 1.08 1.01 -1.25 -4.84 116.67 110.61 1oie s ASP 255 Ca 0.15 -0.73 -0.29 0.00 0.71 0.00 0.00 52.55 52.40 1oie s ASP 255 Cb -0.02 0.01 0.02 0.00 1.01 0.00 0.00 42.92 43.94 1oie s ASP 255 CO 0.55 -0.23 1.10 -2.16 0.21 0.00 0.00 175.17 174.64 1oie s PRO 256 N -2.37 3.88 -0.91 8.23 0.04 -1.26 -0.92 135.00 141.69 1oie s PRO 256 Ca 0.01 0.79 -0.24 0.00 0.04 0.00 0.00 61.00 61.60 1oie s PRO 256 Cb -0.05 -3.83 0.05 0.00 0.04 0.00 0.00 34.50 30.71 1oie s PRO 256 CO 0.00 -1.14 1.36 0.08 0.04 0.00 0.00 177.00 177.34 1oie s VAL 257 N 4.03 3.90 -0.12 -0.36 1.01 -0.67 -4.82 120.40 123.37 1oie s VAL 257 Ca 0.46 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 1oie s VAL 257 Cb -0.10 -4.99 0.04 0.00 0.00 0.00 0.00 36.38 31.34 1oie s VAL 257 CO 0.24 -1.88 0.01 0.00 0.00 0.00 0.00 175.10 173.47 1oie s MET 259 N 1.90 4.40 0.15 0.00 -1.94 0.18 -0.15 119.30 123.85 1oie s MET 259 Ca 0.03 0.75 0.16 0.00 -1.71 0.00 0.00 55.69 54.92 1oie s MET 259 Cb -0.14 -3.45 -0.06 0.00 2.01 0.00 0.00 34.83 33.19 1oie s MET 259 CO -0.07 0.07 1.09 0.00 -0.01 0.00 0.00 175.02 176.10 1oie h ALA 260 N 6.79 0.65 -2.23 3.03 0.00 -0.75 -3.42 119.26 123.33 1oie h ALA 260 Ca -0.40 -0.67 0.16 0.00 0.00 0.00 0.00 54.91 54.00 1oie h ALA 260 Cb 1.19 0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.98 1oie h ALA 260 CO 0.76 0.78 0.52 0.00 0.00 0.00 0.00 179.25 181.31 1oie s ALA 261 N -2.95 -1.78 0.22 0.00 0.00 -1.02 -4.99 121.76 111.24 1oie s ALA 261 Ca -0.00 0.59 -0.32 0.00 0.00 0.00 0.00 51.96 52.23 1oie s ALA 261 Cb 0.08 0.50 -0.12 0.00 0.00 0.00 0.00 23.12 23.59 1oie s ALA 261 CO 0.79 -0.88 1.70 -2.00 0.00 0.00 0.00 175.76 175.37 1oie s GLU 262 N -3.13 4.12 -1.39 0.00 2.12 -1.26 -0.54 118.70 118.63 1oie s GLU 262 Ca 0.09 2.60 0.00 0.00 0.36 0.00 0.00 54.97 58.02 1oie s GLU 262 Cb -0.01 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.32 1oie s GLU 262 CO -0.03 -0.73 0.00 0.09 -0.54 0.00 0.00 175.26 174.04 1oie n ASN 263 N 3.71 -4.50 -3.62 -1.70 3.02 -1.26 -4.96 115.26 105.94 1oie n ASN 263 Ca 0.15 0.18 -0.25 0.00 -0.03 0.00 0.00 54.58 54.62 1oie n ASN 263 Cb 0.36 -3.86 -0.17 0.00 -0.61 0.00 0.00 39.78 35.50 1oie n ASN 263 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1oie s LYS 264 N -4.66 0.08 0.55 3.52 2.20 0.30 -3.45 119.74 118.28 1oie s LYS 264 Ca 0.00 -0.04 -0.20 0.00 -0.36 0.00 0.00 55.97 55.37 1oie s LYS 264 Cb 0.00 -1.68 -0.05 0.00 -1.51 0.00 0.00 37.83 34.59 1oie s LYS 264 CO 0.00 -0.63 1.19 0.15 -0.36 0.00 0.00 175.35 175.70 1oie s LYS 265 N 2.13 3.24 0.33 4.03 1.02 -1.26 -0.13 119.74 129.10 1oie s LYS 265 Ca 0.02 1.78 -0.29 0.00 0.02 0.00 0.00 55.97 57.51 1oie s LYS 265 Cb -0.16 -2.06 -0.12 0.00 -0.52 0.00 0.00 37.83 34.97 1oie s LYS 265 CO -0.08 -0.98 1.38 1.04 -0.92 0.00 0.00 175.35 175.79 1oie n GLN 266 N -1.26 2.29 -3.37 1.68 6.02 0.79 -4.48 117.38 119.05 1oie n GLN 266 Ca 0.12 0.81 -0.38 0.00 -0.01 0.00 0.00 57.00 57.53 1oie n GLN 266 Cb 0.49 -2.45 -0.06 0.00 1.02 0.00 0.00 30.24 29.24 1oie n GLN 266 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1oie s VAL 267 N -0.81 4.87 -1.30 5.09 1.01 -1.26 -4.42 120.40 123.58 1oie s VAL 267 Ca 0.58 1.06 -0.02 0.00 0.00 0.00 0.00 61.98 63.60 1oie s VAL 267 Cb -0.55 -3.82 0.01 0.00 0.00 0.00 0.00 36.38 32.01 1oie s VAL 267 CO 0.59 0.56 0.87 0.47 0.00 0.00 0.00 175.10 177.58 1oie n ASP 268 N 1.81 -2.24 -4.65 3.32 8.00 -1.26 -4.90 116.55 116.63 1oie n ASP 268 Ca -0.12 -0.73 -0.44 0.00 0.71 0.00 0.00 54.79 54.21 1oie n ASP 268 Cb 0.51 -4.47 -0.02 0.00 -0.02 0.00 0.00 41.12 37.13 1oie n ASP 268 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oie n TYR 269 N -4.33 1.91 -3.91 1.24 9.36 -1.26 -4.96 117.16 115.21 1oie n TYR 269 Ca -0.24 0.56 -0.36 0.00 3.32 0.00 0.00 57.90 61.19 1oie n TYR 269 Cb 0.65 -2.38 -0.12 0.00 -0.63 0.00 0.00 39.34 36.86 1oie n TYR 269 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1oie s VAL 270 N -0.69 4.17 0.29 2.97 1.01 -1.26 -5.07 120.40 121.82 1oie s VAL 270 Ca 0.62 -0.23 -0.29 0.00 0.00 0.00 0.00 61.98 62.08 1oie s VAL 270 Cb -0.65 -2.92 -0.14 0.00 0.00 0.00 0.00 36.38 32.68 1oie s VAL 270 CO 0.57 0.39 1.12 -2.65 0.00 0.00 0.00 175.10 174.52 1oie n PRO 271 N 4.52 1.56 -0.79 2.72 -0.02 -1.26 -2.39 135.00 139.35 1oie n PRO 271 Ca -0.17 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1oie n PRO 271 Cb 0.52 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 1oie n PRO 271 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oie n GLY 272 N 1.27 1.14 3.96 -1.23 0.00 -1.26 -4.93 105.19 104.13 1oie n GLY 272 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1oie n GLY 272 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oie s THR 273 N -3.68 4.95 0.36 2.61 -4.23 -1.01 -5.06 115.64 109.59 1oie s THR 273 Ca 0.00 -0.69 -0.27 0.00 -1.18 0.00 0.00 61.69 59.55 1oie s THR 273 Cb 0.00 -3.78 -0.12 0.00 1.34 0.00 0.00 72.50 69.94 1oie s THR 273 CO 0.00 -0.42 1.24 -2.65 -0.54 0.00 0.00 174.62 172.25 1oie n PRO 274 N -1.68 1.96 -3.99 3.99 -0.02 -1.26 -4.81 135.00 129.19 1oie n PRO 274 Ca -0.05 0.69 -0.30 0.00 -2.02 0.00 0.00 63.50 61.82 1oie n PRO 274 Cb 0.57 -2.28 -0.16 0.00 -0.02 0.00 0.00 33.50 31.60 1oie n PRO 274 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oie s LYS 276 N 1.49 3.41 0.80 0.00 2.20 -1.26 -4.54 119.74 121.84 1oie s LYS 276 Ca 0.02 -0.70 -0.11 0.00 -0.36 0.00 0.00 55.97 54.82 1oie s LYS 276 Cb -0.14 -3.81 0.07 0.00 -1.51 0.00 0.00 37.83 32.44 1oie s LYS 276 CO -0.09 -0.48 1.09 -1.25 -0.36 0.00 0.00 175.35 174.25 1oie s PRO 277 N 1.71 2.01 0.51 4.03 0.04 -1.26 0.50 135.00 142.54 1oie s PRO 277 Ca 0.06 0.95 -0.19 0.00 0.04 0.00 0.00 61.00 61.85 1oie s PRO 277 Cb -0.18 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.40 1oie s PRO 277 CO 0.10 -1.75 1.04 0.34 0.04 0.00 0.00 177.00 176.77 1oie s ASP 278 N -3.54 6.24 -0.05 6.66 -1.08 -0.80 -4.73 116.67 119.37 1oie s ASP 278 Ca 0.61 1.90 -0.01 0.00 -0.52 0.00 0.00 52.55 54.54 1oie s ASP 278 Cb -0.17 -2.55 0.03 0.00 -1.46 0.00 0.00 42.92 38.77 1oie s ASP 278 CO 0.56 -0.85 0.00 -1.58 0.52 0.00 0.00 175.17 173.82 1oie s GLN 279 N -3.41 0.47 -0.09 4.34 0.74 -1.26 -0.17 119.66 120.28 1oie s GLN 279 Ca 0.66 0.10 -0.03 0.00 0.05 0.00 0.00 55.36 56.15 1oie s GLN 279 Cb -0.16 -0.76 0.05 0.00 1.10 0.00 0.00 33.01 33.23 1oie s GLN 279 CO 0.23 -0.23 0.15 -0.65 -0.55 0.00 0.00 175.29 174.24 1oie s GLN 280 N 1.60 0.03 -1.44 1.67 -1.52 -0.45 -4.83 119.66 114.71 1oie s GLN 280 Ca -0.01 0.48 -0.06 0.00 -1.95 0.00 0.00 55.36 53.82 1oie s GLN 280 Cb -0.13 -0.45 0.04 0.00 -0.22 0.00 0.00 33.01 32.25 1oie s GLN 280 CO -0.03 -0.35 0.69 -1.71 -0.25 0.00 0.00 175.29 173.64 1oie n ASN 281 N 5.32 -2.05 -0.37 5.90 5.15 -1.26 -1.08 115.26 126.87 1oie n ASN 281 Ca -0.05 -0.89 -0.05 0.00 -0.60 0.00 0.00 54.58 53.00 1oie n ASN 281 Cb 0.50 -3.56 -0.02 0.00 -0.53 0.00 0.00 39.78 36.17 1oie n ASN 281 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1oie n GLY 282 N -1.71 0.66 3.09 8.20 0.00 -1.26 -1.61 105.19 112.56 1oie n GLY 282 Ca -0.18 -0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 1oie n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oie s ILE 283 N -1.86 1.74 0.20 -0.61 1.01 -0.24 -3.85 121.20 117.58 1oie s ILE 283 Ca 0.00 -0.77 -0.30 0.00 0.00 0.00 0.00 60.65 59.59 1oie s ILE 283 Cb 0.00 -1.58 -0.08 0.00 0.01 0.00 0.00 42.46 40.81 1oie s ILE 283 CO 0.00 0.49 1.15 0.26 0.00 0.00 0.00 174.94 176.84 1oie s TRP 284 N 1.10 3.50 -0.11 3.97 0.52 -1.18 -1.34 118.94 125.39 1oie s TRP 284 Ca -0.02 1.53 0.02 0.00 0.02 0.00 0.00 56.10 57.64 1oie s TRP 284 Cb -0.14 -3.36 0.01 0.00 -1.15 0.00 0.00 33.47 28.83 1oie s TRP 284 CO -0.05 -0.91 -0.16 0.42 0.02 0.00 0.00 176.95 176.27 1oie s ILE 285 N -0.30 1.57 0.19 2.03 1.01 0.76 0.52 121.20 126.99 1oie s ILE 285 Ca 0.50 -0.68 0.09 0.00 0.00 0.00 0.00 60.65 60.56 1oie s ILE 285 Cb -0.31 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.68 1oie s ILE 285 CO 0.37 0.45 -0.18 0.68 0.00 0.00 0.00 174.94 176.27 1oie s VAL 286 N 0.99 1.90 -0.27 2.92 -7.23 -0.25 -1.90 120.40 116.55 1oie s VAL 286 Ca -0.06 -2.07 -0.24 0.00 -1.81 0.00 0.00 61.98 57.79 1oie s VAL 286 Cb -0.15 -1.97 0.09 0.00 0.56 0.00 0.00 36.38 34.90 1oie s VAL 286 CO -0.02 -0.40 0.80 -1.58 -0.31 0.00 0.00 175.10 173.59 1oie s GLN 287 N -3.14 0.74 -0.39 4.82 0.74 -1.26 -0.88 119.66 120.28 1oie s GLN 287 Ca 0.20 0.91 0.05 0.00 0.05 0.00 0.00 55.36 56.57 1oie s GLN 287 Cb -0.04 0.34 0.46 0.00 1.10 0.00 0.00 33.01 34.87 1oie s GLN 287 CO 0.08 -0.09 1.46 0.00 -0.55 0.00 0.00 175.29 176.18 1oie n ALA 288 N 2.73 5.25 -0.54 1.58 0.00 -1.24 -1.67 120.51 126.61 1oie n ALA 288 Ca -0.14 -3.61 0.00 0.00 0.00 0.00 0.00 53.44 49.69 1oie n ALA 288 Cb 0.56 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.24 1oie n ALA 288 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1oie n HIS 289 N -0.84 0.00 -3.62 0.00 -0.00 -0.10 -4.22 115.22 106.45 1oie n HIS 289 Ca 0.47 0.00 -0.03 0.00 0.46 0.00 0.00 57.72 58.62 1oie n HIS 289 Cb 0.89 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.75 1oie n HIS 289 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 1oie s GLU 290 N 0.00 0.62 -2.12 1.57 -1.05 -1.25 -3.75 118.70 112.72 1oie s GLU 290 Ca 0.00 -0.29 0.00 0.00 -0.15 0.00 0.00 54.97 54.53 1oie s GLU 290 Cb 0.00 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.93 1oie s GLU 290 CO 0.00 -0.28 0.00 0.91 0.95 0.00 0.00 175.26 176.84 1oie n TRP 291 N -0.32 0.00 -1.33 4.83 7.02 0.59 -1.08 117.44 127.15 1oie n TRP 291 Ca -0.05 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.31 1oie n TRP 291 Cb 0.61 -3.35 -0.05 0.00 -2.42 0.00 0.00 31.31 26.10 1oie n TRP 291 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1oie n GLY 292 N -0.52 1.22 0.37 6.99 0.00 -1.26 -4.54 105.19 107.45 1oie n GLY 292 Ca -0.20 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 45.62 1oie n GLY 292 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oie h LYS 293 N 0.06 0.81 -4.70 1.61 1.57 -1.38 -3.41 116.57 111.13 1oie h LYS 293 Ca -0.23 -0.05 -0.27 0.00 -1.87 0.00 0.00 60.65 58.23 1oie h LYS 293 Cb 0.87 -0.18 -0.18 0.00 0.08 0.00 0.00 32.23 32.82 1oie h LYS 293 CO 0.34 0.54 -0.72 0.71 -0.57 0.00 0.00 179.45 179.75 1oie s TYR 294 N -5.81 0.85 -0.23 -1.35 2.02 -1.26 -0.50 117.35 111.06 1oie s TYR 294 Ca -0.11 -0.69 -0.05 0.00 -0.37 0.00 0.00 57.07 55.85 1oie s TYR 294 Cb 0.22 -0.49 -0.01 0.00 -0.40 0.00 0.00 41.96 41.28 1oie s TYR 294 CO 0.80 -0.09 0.00 0.08 -1.57 0.00 0.00 175.55 174.77 1oie s VAL 295 N -2.45 3.71 0.35 0.71 1.01 0.48 -4.70 120.40 119.52 1oie s VAL 295 Ca 0.02 -0.41 -0.22 0.00 0.00 0.00 0.00 61.98 61.37 1oie s VAL 295 Cb -0.03 -2.72 -0.10 0.00 0.00 0.00 0.00 36.38 33.53 1oie s VAL 295 CO -0.02 0.37 0.89 -0.83 0.00 0.00 0.00 175.10 175.52 1oie s GLY 296 N 1.52 2.56 -0.22 4.51 0.00 0.11 -0.58 107.32 115.22 1oie s GLY 296 Ca 0.06 0.37 -0.03 0.00 0.00 0.00 0.00 44.72 45.12 1oie s GLY 296 CO -0.01 0.71 0.06 -1.60 0.00 0.00 0.00 173.10 172.25 1oie s ARG 297 N -2.61 0.59 -0.38 2.90 3.52 -0.22 -1.63 118.95 121.12 1oie s ARG 297 Ca 0.54 -0.51 -0.09 0.00 -0.13 0.00 0.00 55.73 55.55 1oie s ARG 297 Cb -0.13 -2.00 0.05 0.00 -1.56 0.00 0.00 34.95 31.30 1oie s ARG 297 CO 0.18 -0.72 0.19 0.00 -0.81 0.00 0.00 175.30 174.14 1oie s ALA 298 N 1.86 3.20 -0.18 6.12 0.00 0.14 -2.03 121.76 130.87 1oie s ALA 298 Ca 0.02 -1.89 -0.15 0.00 0.00 0.00 0.00 51.96 49.94 1oie s ALA 298 Cb -0.17 -2.50 -0.04 0.00 0.00 0.00 0.00 23.12 20.41 1oie s ALA 298 CO -0.13 -1.47 0.36 -0.51 0.00 0.00 0.00 175.76 174.01 1oie s ASP 299 N 1.70 6.45 0.18 0.00 1.01 0.05 -0.74 116.67 125.32 1oie s ASP 299 Ca 0.01 0.53 0.08 0.00 0.71 0.00 0.00 52.55 53.88 1oie s ASP 299 Cb -0.21 -2.21 -0.04 0.00 1.01 0.00 0.00 42.92 41.47 1oie s ASP 299 CO 0.04 0.00 -0.17 -0.36 0.21 0.00 0.00 175.17 174.89 1oie s PHE 300 N 0.92 1.81 -0.08 4.23 0.08 0.66 -0.59 117.98 125.01 1oie s PHE 300 Ca 0.18 -0.49 0.04 0.00 0.12 0.00 0.00 56.93 56.78 1oie s PHE 300 Cb -0.14 -0.88 -0.01 0.00 -0.57 0.00 0.00 43.02 41.42 1oie s PHE 300 CO 0.07 0.36 -0.20 -1.83 -0.10 0.00 0.00 175.22 173.51 1oie s GLU 301 N -3.06 2.85 -0.26 0.44 -1.05 0.12 -2.20 118.70 115.55 1oie s GLU 301 Ca 0.18 -0.81 -0.05 0.00 -0.15 0.00 0.00 54.97 54.14 1oie s GLU 301 Cb -0.04 -2.35 -0.00 0.00 -0.44 0.00 0.00 34.13 31.30 1oie s GLU 301 CO 0.07 0.34 0.02 0.12 0.95 0.00 0.00 175.26 176.77 1oie s PHE 302 N -0.04 3.07 -0.03 4.83 5.36 0.22 -1.14 117.98 130.25 1oie s PHE 302 Ca -0.06 -0.92 0.01 0.00 -0.96 0.00 0.00 56.93 55.01 1oie s PHE 302 Cb -0.15 -2.18 0.02 0.00 -0.34 0.00 0.00 43.02 40.37 1oie s PHE 302 CO 0.05 -0.54 -0.02 0.50 -1.46 0.00 0.00 175.22 173.75 1oie s ARG 303 N 1.50 0.47 -1.46 10.12 3.00 -1.01 0.26 118.95 131.83 1oie s ARG 303 Ca 0.04 -0.02 -0.07 0.00 -1.00 0.00 0.00 55.73 54.68 1oie s ARG 303 Cb -0.16 -0.56 0.03 0.00 0.00 0.00 0.00 34.95 34.26 1oie s ARG 303 CO 0.00 -0.08 0.64 0.09 0.00 0.00 0.00 175.30 175.95 1oie n ASN 304 N 3.90 -5.31 0.00 -2.12 5.03 -1.26 -1.74 115.26 113.76 1oie n ASN 304 Ca -0.24 -0.37 0.00 0.00 0.87 0.00 0.00 54.58 54.84 1oie n ASN 304 Cb 0.52 -4.30 0.00 0.00 -1.02 0.00 0.00 39.78 34.97 1oie n ASN 304 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1oie n GLY 305 N -1.46 1.49 3.63 7.41 0.00 -1.26 -5.03 105.19 109.96 1oie n GLY 305 Ca -0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 1oie n GLY 305 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oie s GLU 306 N -0.49 2.29 -0.12 1.61 2.02 -0.71 -4.93 118.70 118.37 1oie s GLU 306 Ca 0.00 -1.11 0.01 0.00 0.02 0.00 0.00 54.97 53.88 1oie s GLU 306 Cb 0.00 -2.32 -0.01 0.00 0.10 0.00 0.00 34.13 31.90 1oie s GLU 306 CO 0.00 0.46 -0.16 -1.64 0.02 0.00 0.00 175.26 173.95 1oie s MET 307 N -2.76 3.31 -0.15 1.61 -1.94 -1.26 -2.40 119.30 115.70 1oie s MET 307 Ca 0.26 -0.73 0.02 0.00 -1.71 0.00 0.00 55.69 53.53 1oie s MET 307 Cb -0.10 -2.56 0.01 0.00 2.01 0.00 0.00 34.83 34.19 1oie s MET 307 CO 0.17 0.20 -0.20 0.21 -0.01 0.00 0.00 175.02 175.39 1oie s LYS 308 N 0.36 3.06 -0.24 2.03 2.20 -0.29 -4.97 119.74 121.89 1oie s LYS 308 Ca -0.13 -0.83 -0.29 0.00 -0.36 0.00 0.00 55.97 54.37 1oie s LYS 308 Cb -0.16 -2.50 -0.00 0.00 -1.51 0.00 0.00 37.83 33.65 1oie s LYS 308 CO 0.06 -0.03 1.23 1.41 -0.36 0.00 0.00 175.35 177.66 1oie s MET 309 N 0.88 4.09 -0.15 4.03 -2.45 -1.26 0.14 119.30 124.58 1oie s MET 309 Ca -0.05 1.39 -0.17 0.00 -1.25 0.00 0.00 55.69 55.61 1oie s MET 309 Cb -0.15 -3.79 -0.15 0.00 1.25 0.00 0.00 34.83 31.99 1oie s MET 309 CO -0.03 -0.89 0.33 0.28 1.05 0.00 0.00 175.02 175.76 1oie h VAL 310 N 5.71 0.91 -3.13 10.11 2.07 -1.17 -3.48 116.25 127.26 1oie h VAL 310 Ca -0.25 -1.79 -0.13 0.00 0.82 0.00 0.00 66.70 65.35 1oie h VAL 310 Cb 1.09 1.83 -0.21 0.00 -1.52 0.00 0.00 31.29 32.48 1oie h VAL 310 CO 1.00 0.31 -0.34 0.21 0.02 0.00 0.00 177.57 178.77 1oie s ASN 311 N -6.13 -0.17 -0.02 0.57 2.47 -1.02 -5.01 114.94 105.63 1oie s ASN 311 Ca -0.16 0.14 0.02 0.00 0.42 0.00 0.00 52.86 53.27 1oie s ASN 311 Cb 0.00 0.35 0.01 0.00 -1.45 0.00 0.00 41.25 40.17 1oie s ASN 311 CO 0.43 -0.35 -0.06 -0.47 -3.72 0.00 0.00 177.10 172.93 1oie s TYR 312 N -1.01 0.67 0.12 0.43 5.04 -1.26 -0.77 117.35 120.58 1oie s TYR 312 Ca -0.11 -0.16 -0.11 0.00 -2.44 0.00 0.00 57.07 54.25 1oie s TYR 312 Cb -0.05 -0.53 0.01 0.00 0.35 0.00 0.00 41.96 41.74 1oie s TYR 312 CO 0.03 -0.10 0.28 1.14 -1.34 0.00 0.00 175.55 175.56 1oie s GLN 313 N 0.39 0.99 -0.23 4.97 -2.07 -0.86 -4.58 119.66 118.27 1oie s GLN 313 Ca -0.05 -0.92 -0.05 0.00 -1.82 0.00 0.00 55.36 52.51 1oie s GLN 313 Cb -0.09 0.39 -0.02 0.00 -1.09 0.00 0.00 33.01 32.21 1oie s GLN 313 CO -0.00 -0.35 0.01 -0.51 -1.32 0.00 0.00 175.29 173.11 1oie s LEU 314 N -2.86 3.15 -0.38 2.60 1.43 -1.26 -1.06 118.68 120.29 1oie s LEU 314 Ca 0.07 -0.30 -0.18 0.00 -1.03 0.00 0.00 54.13 52.69 1oie s LEU 314 Cb 0.03 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.44 1oie s LEU 314 CO -0.09 -0.01 0.50 -0.63 0.23 0.00 0.00 176.35 176.35 1oie s ILE 315 N 1.47 5.01 0.43 -0.59 1.01 0.25 -4.61 121.20 124.17 1oie s ILE 315 Ca 0.05 0.10 -0.25 0.00 0.00 0.00 0.00 60.65 60.55 1oie s ILE 315 Cb -0.15 -4.02 -0.08 0.00 0.01 0.00 0.00 42.46 38.23 1oie s ILE 315 CO 0.00 -0.33 1.33 -2.84 0.00 0.00 0.00 174.94 173.11 1oie s PRO 316 N 2.38 3.83 -0.92 2.79 0.02 -1.26 -0.39 135.00 141.44 1oie s PRO 316 Ca 0.17 2.21 -0.08 0.00 0.02 0.00 0.00 61.00 63.32 1oie s PRO 316 Cb -0.16 -2.68 0.23 0.00 0.02 0.00 0.00 34.50 31.92 1oie s PRO 316 CO 0.14 -0.63 0.86 0.08 -0.33 0.00 0.00 177.00 177.13 1oie s VAL 317 N -1.26 5.29 -1.44 3.83 1.01 0.34 -4.66 120.40 123.50 1oie s VAL 317 Ca 0.59 -3.17 -0.04 0.00 0.00 0.00 0.00 61.98 59.36 1oie s VAL 317 Cb -0.39 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 31.76 1oie s VAL 317 CO 0.50 -1.08 0.32 0.59 0.00 0.00 0.00 175.10 175.43 1oie n ASN 318 N 3.10 -5.11 -4.76 3.32 3.02 -1.26 -0.55 115.26 113.02 1oie n ASN 318 Ca 0.18 -0.15 -0.39 0.00 -0.03 0.00 0.00 54.58 54.19 1oie n ASN 318 Cb 0.41 -4.21 0.02 0.00 -0.61 0.00 0.00 39.78 35.38 1oie n ASN 318 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1oie s LEU 319 N -6.28 4.09 0.04 3.41 1.43 -1.26 -4.14 118.68 115.97 1oie s LEU 319 Ca 0.19 2.82 0.04 0.00 -1.03 0.00 0.00 54.13 56.15 1oie s LEU 319 Cb -0.09 -3.99 -0.02 0.00 0.03 0.00 0.00 46.19 42.11 1oie s LEU 319 CO 0.24 -1.16 -0.11 -0.54 0.23 0.00 0.00 176.35 175.00 1oie s LYS 320 N -2.49 0.72 -0.08 1.70 1.02 -1.26 -2.36 119.74 116.99 1oie s LYS 320 Ca 0.62 -0.73 0.01 0.00 0.02 0.00 0.00 55.97 55.89 1oie s LYS 320 Cb -0.41 -0.65 -0.03 0.00 -0.52 0.00 0.00 37.83 36.22 1oie s LYS 320 CO 0.53 0.15 -0.08 -1.59 -0.92 0.00 0.00 175.35 173.43 1oie s LYS 321 N -1.27 2.83 0.01 1.68 -2.85 -0.16 -4.83 119.74 115.15 1oie s LYS 321 Ca -0.03 -0.58 -0.30 0.00 -1.00 0.00 0.00 55.97 54.06 1oie s LYS 321 Cb -0.08 -2.59 -0.06 0.00 -2.06 0.00 0.00 37.83 33.04 1oie s LYS 321 CO 0.01 0.59 1.49 0.21 0.10 0.00 0.00 175.35 177.76 1oie s LYS 322 N -0.63 4.25 0.00 1.78 2.20 -1.26 -1.10 119.74 124.98 1oie s LYS 322 Ca 0.09 2.08 0.00 0.00 -0.36 0.00 0.00 55.97 57.79 1oie s LYS 322 Cb -0.11 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 32.60 1oie s LYS 322 CO 0.02 -0.64 0.23 1.55 -0.36 0.00 0.00 175.35 176.14 1oie n VAL 323 N 4.74 0.00 -3.42 4.02 3.14 -1.26 -4.98 118.33 120.57 1oie n VAL 323 Ca 0.14 0.00 -0.41 0.00 -2.96 0.00 0.00 64.34 61.11 1oie n VAL 323 Cb 0.43 1.35 -0.10 0.00 -1.06 0.00 0.00 33.84 34.46 1oie n VAL 323 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1oie s SER 330 N 0.00 6.16 0.32 6.55 0.15 -1.26 -4.83 113.70 120.78 1oie s SER 330 Ca 0.00 -0.30 0.01 0.00 0.70 0.00 0.00 55.95 56.36 1oie s SER 330 Cb 0.00 -2.19 -0.01 0.00 -1.71 0.00 0.00 66.02 62.11 1oie s SER 330 CO 0.00 -0.33 0.36 -1.83 1.20 0.00 0.00 173.24 172.64 1oie s GLU 331 N 1.96 1.76 -0.13 5.44 -1.05 -1.26 -5.16 118.70 120.25 1oie s GLU 331 Ca 0.11 -1.82 0.02 0.00 -0.15 0.00 0.00 54.97 53.13 1oie s GLU 331 Cb -0.17 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 33.91 1oie s GLU 331 CO 0.11 -0.69 -0.21 1.03 0.95 0.00 0.00 175.26 176.46 1oie s ARG 332 N -3.37 3.09 -0.01 -4.83 1.81 -1.26 -4.15 118.95 110.24 1oie s ARG 332 Ca 0.35 -0.83 0.06 0.00 -1.72 0.00 0.00 55.73 53.59 1oie s ARG 332 Cb 0.01 -2.45 -0.02 0.00 -0.45 0.00 0.00 34.95 32.05 1oie s ARG 332 CO 0.22 0.06 -0.21 0.14 -0.68 0.00 0.00 175.30 174.83 1oie s VAL 333 N 0.66 1.64 0.67 3.52 -7.23 -0.26 -4.87 120.40 114.53 1oie s VAL 333 Ca -0.10 -0.91 -0.17 0.00 -1.81 0.00 0.00 61.98 58.98 1oie s VAL 333 Cb -0.16 -1.36 0.00 0.00 0.56 0.00 0.00 36.38 35.42 1oie s VAL 333 CO 0.02 0.44 1.28 0.18 -0.31 0.00 0.00 175.10 176.71 1oie n LEU 334 N 2.51 5.79 0.03 1.32 4.77 -1.26 -0.99 117.00 129.17 1oie n LEU 334 Ca -0.15 0.79 -0.15 0.00 -0.03 0.00 0.00 56.01 56.46 1oie n LEU 334 Cb 0.53 -1.55 -0.14 0.00 -2.33 0.00 0.00 43.42 39.93 1oie n LEU 334 CO 0.24 -1.11 -0.47 1.88 -1.33 0.00 0.00 177.39 176.59 1oie h TYR 335 N 0.30 0.33 -4.53 -1.77 0.05 -1.83 -3.45 116.97 106.06 1oie h TYR 335 Ca -0.50 -0.24 -0.37 0.00 0.05 0.00 0.00 58.73 57.66 1oie h TYR 335 Cb 1.33 -0.01 -0.14 0.00 1.01 0.00 0.00 36.73 38.92 1oie h TYR 335 CO 0.42 1.37 -0.56 0.95 -1.05 0.00 0.00 178.16 179.29 1oie s THR 336 N -2.60 0.09 0.38 -2.88 -4.23 -1.26 -4.91 115.64 100.22 1oie s THR 336 Ca -0.11 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.13 1oie s THR 336 Cb 0.07 -2.50 -0.11 0.00 1.34 0.00 0.00 72.50 71.30 1oie s THR 336 CO 0.83 0.00 1.32 -2.65 -0.54 0.00 0.00 174.62 173.58 1oie n PRO 337 N -0.48 2.15 -1.99 3.99 -0.02 -1.26 -4.92 135.00 132.47 1oie n PRO 337 Ca 0.04 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 61.86 1oie n PRO 337 Cb 0.64 -2.41 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 1oie n PRO 337 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1oie s GLU 338 N -2.05 4.25 -0.21 -0.52 2.12 -1.26 -4.78 118.70 116.26 1oie s GLU 338 Ca 0.57 2.34 -0.04 0.00 0.36 0.00 0.00 54.97 58.21 1oie s GLU 338 Cb -0.53 -3.08 -0.01 0.00 0.26 0.00 0.00 34.13 30.77 1oie s GLU 338 CO 0.61 -0.41 -0.04 0.42 -0.54 0.00 0.00 175.26 175.30 1oie s ILE 339 N -0.37 3.49 0.58 -3.70 1.01 -1.26 -5.09 121.20 115.86 1oie s ILE 339 Ca 0.57 -0.46 -0.19 0.00 0.00 0.00 0.00 60.65 60.57 1oie s ILE 339 Cb -0.43 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 1oie s ILE 339 CO 0.48 0.44 1.17 0.00 0.00 0.00 0.00 174.94 177.03 1oie s ALA 340 N 1.23 2.58 -0.18 9.38 0.00 -1.26 -4.83 121.76 128.68 1oie s ALA 340 Ca 0.03 0.91 -0.28 0.00 0.00 0.00 0.00 51.96 52.62 1oie s ALA 340 Cb -0.14 -3.41 -0.00 0.00 0.00 0.00 0.00 23.12 19.56 1oie s ALA 340 CO -0.01 -1.05 0.98 -1.21 0.00 0.00 0.00 175.76 174.47 1oie s GLU 341 N -3.38 4.31 -0.03 0.00 2.02 -1.26 -4.41 118.70 115.95 1oie s GLU 341 Ca 0.75 1.28 -0.35 0.00 0.02 0.00 0.00 54.97 56.68 1oie s GLU 341 Cb -0.27 -3.60 -0.13 0.00 0.10 0.00 0.00 34.13 30.23 1oie s GLU 341 CO 0.32 -0.48 1.77 -1.71 0.02 0.00 0.00 175.26 175.17 1oie n ASN 342 N 5.74 3.18 -0.22 -0.19 2.85 -0.64 -4.88 115.26 121.10 1oie n ASN 342 Ca 0.09 1.02 -0.06 0.00 -0.11 0.00 0.00 54.58 55.52 1oie n ASN 342 Cb 0.47 -1.36 0.04 0.00 1.24 0.00 0.00 39.78 40.18 1oie n ASN 342 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 1oie h GLN 343 N 7.99 0.83 -0.35 1.20 5.75 -1.93 -1.36 115.11 127.24 1oie h GLN 343 Ca -0.47 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 57.92 1oie h GLN 343 Cb 1.27 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.63 1oie h GLN 343 CO 0.93 0.58 0.05 0.37 -2.65 0.00 0.00 178.83 178.11 1oie h GLN 344 N 0.83 0.53 -0.37 1.69 4.15 -1.99 -0.44 115.11 119.51 1oie h GLN 344 Ca 0.22 -0.10 -0.16 0.00 0.77 0.00 0.00 58.65 59.38 1oie h GLN 344 Cb -0.04 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.56 1oie h GLN 344 CO -0.04 0.52 -0.41 1.98 -1.93 0.00 0.00 178.83 178.95 1oie h MET 345 N 0.51 0.93 -0.69 1.69 4.05 -1.83 -1.94 114.93 117.67 1oie h MET 345 Ca 0.12 -0.51 0.00 0.00 -0.28 0.00 0.00 59.70 59.03 1oie h MET 345 Cb 0.26 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.05 1oie h MET 345 CO 0.00 1.16 0.43 0.82 0.23 0.00 0.00 176.91 179.55 1oie h ILE 346 N 0.75 1.19 -0.18 1.77 1.08 -0.44 -0.67 117.51 121.02 1oie h ILE 346 Ca 0.05 -0.39 -0.10 0.00 -0.39 0.00 0.00 64.86 64.03 1oie h ILE 346 Cb 1.01 0.22 -0.01 0.00 -3.07 0.00 0.00 36.82 34.96 1oie h ILE 346 CO 0.10 0.19 -0.33 0.28 -0.69 0.00 0.00 178.15 177.70 1oie h SER 347 N 0.93 0.37 -0.31 1.72 0.02 -1.02 -0.94 113.55 114.33 1oie h SER 347 Ca 0.25 -0.14 -0.08 0.00 -0.84 0.00 0.00 61.79 60.98 1oie h SER 347 Cb -0.06 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1oie h SER 347 CO -0.05 0.68 -0.13 0.25 -1.14 0.00 0.00 176.83 176.45 1oie h LEU 348 N 0.31 0.64 0.01 5.07 5.85 -1.08 -3.38 115.31 122.73 1oie h LEU 348 Ca 0.04 -0.40 -0.29 0.00 0.84 0.00 0.00 57.88 58.07 1oie h LEU 348 Cb 0.74 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.55 1oie h LEU 348 CO 0.06 0.89 -1.68 -0.07 -0.34 0.00 0.00 178.44 177.30 1oie h LEU 349 N 0.38 0.04 -0.75 2.25 3.38 -0.96 -3.38 115.31 116.28 1oie h LEU 349 Ca 0.07 -0.09 0.17 0.00 0.09 0.00 0.00 57.88 58.12 1oie h LEU 349 Cb 0.64 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 41.26 1oie h LEU 349 CO 0.04 1.08 0.10 0.28 0.09 0.00 0.00 178.44 180.03 1oie h SER 350 N 0.01 -0.17 -0.32 -0.43 0.02 -1.35 0.13 113.55 111.43 1oie h SER 350 Ca -0.28 0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1oie h SER 350 Cb 2.00 0.27 -0.02 0.00 0.14 0.00 0.00 62.40 64.80 1oie h SER 350 CO 0.09 -0.12 0.19 -0.65 -1.14 0.00 0.00 176.83 175.20 1oie h PRO 351 N 0.18 0.46 -0.09 3.45 0.11 -1.80 0.18 132.00 134.49 1oie h PRO 351 Ca 0.42 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.44 1oie h PRO 351 Cb 0.75 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.76 1oie h PRO 351 CO -0.59 0.34 -0.14 0.74 -0.21 0.00 0.00 178.00 178.13 1oie h PHE 352 N 0.47 0.31 -0.18 0.65 0.04 -1.07 -0.54 116.94 116.63 1oie h PHE 352 Ca 0.12 -0.11 0.05 0.00 2.80 0.00 0.00 57.97 60.84 1oie h PHE 352 Cb 0.01 -0.06 -0.07 0.00 2.20 0.00 0.00 35.95 38.03 1oie h PHE 352 CO 0.00 0.74 -0.29 0.37 -0.60 0.00 0.00 178.31 178.53 1oie h GLN 353 N -0.21 -0.33 -0.59 1.51 5.75 -0.55 0.83 115.11 121.52 1oie h GLN 353 Ca 0.01 0.02 -0.09 0.00 -0.15 0.00 0.00 58.65 58.44 1oie h GLN 353 Cb 0.71 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.31 1oie h GLN 353 CO 0.03 -0.22 0.02 -0.91 -2.65 0.00 0.00 178.83 175.10 1oie h ASN 354 N -0.34 0.97 -0.06 -0.69 2.35 -0.67 -0.86 115.58 116.28 1oie h ASN 354 Ca 0.11 -0.26 -0.11 0.00 -0.55 0.00 0.00 56.30 55.49 1oie h ASN 354 Cb 0.51 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1oie h ASN 354 CO -0.37 1.02 -0.32 0.50 -1.65 0.00 0.00 177.43 176.61 1oie h LYS 355 N 0.92 0.54 -0.28 0.81 3.64 -0.85 -1.66 116.57 119.69 1oie h LYS 355 Ca 0.17 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1oie h LYS 355 Cb 0.51 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1oie h LYS 355 CO 0.02 0.80 0.18 0.78 -2.27 0.00 0.00 179.45 178.97 1oie h GLY 356 N 1.04 0.40 0.75 5.01 0.00 -0.21 -2.26 103.07 107.79 1oie h GLY 356 Ca 0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1oie h GLY 356 CO 0.06 0.14 0.00 0.50 0.00 0.00 0.00 176.54 177.24 1oie h LYS 357 N 0.38 0.00 -0.96 4.80 1.79 -0.92 -2.73 116.57 118.94 1oie h LYS 357 Ca 0.11 -0.00 0.22 0.00 -2.18 0.00 0.00 60.65 58.80 1oie h LYS 357 Cb -0.04 -0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 30.49 1oie h LYS 357 CO -0.03 0.26 0.52 0.00 -1.08 0.00 0.00 179.45 179.12 1oie h ALA 358 N 0.75 1.63 0.00 3.86 0.00 -1.29 -2.23 119.26 121.98 1oie h ALA 358 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1oie h ALA 358 Cb 0.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1oie h ALA 358 CO 0.00 -0.25 0.00 0.37 0.00 0.00 0.00 179.25 179.37 1oie h GLN 359 N 0.55 0.00 0.00 0.00 5.75 -1.10 -1.40 115.11 118.92 1oie h GLN 359 Ca 0.60 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 59.07 1oie h GLN 359 Cb 1.10 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.64 1oie h GLN 359 CO -0.47 0.00 -0.13 -0.07 -2.65 0.00 0.00 178.83 175.50 1oie h LEU 360 N 0.00 0.00 -0.00 -2.39 3.38 -1.25 -2.93 115.31 112.11 1oie h LEU 360 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1oie h LEU 360 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1oie h LEU 360 CO 0.00 0.13 0.00 -0.33 0.09 0.00 0.00 178.44 178.33 1oie h GLU 361 N 0.00 0.00 -7.03 1.13 4.39 -1.36 -1.56 114.58 110.14 1oie h GLU 361 Ca -0.00 0.00 -0.47 0.00 0.34 0.00 0.00 59.36 59.23 1oie h GLU 361 Cb 0.37 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1oie h GLU 361 CO 0.02 0.00 0.38 0.08 -1.16 0.00 0.00 179.01 178.33 1oie s VAL 362 N -3.12 3.91 0.01 3.13 1.01 -1.11 -4.81 120.40 119.41 1oie s VAL 362 Ca 0.10 1.27 -0.30 0.00 0.00 0.00 0.00 61.98 63.05 1oie s VAL 362 Cb 0.11 -3.56 -0.07 0.00 0.00 0.00 0.00 36.38 32.86 1oie s VAL 362 CO 0.61 -0.18 1.58 -0.75 0.00 0.00 0.00 175.10 176.36 1oie s LYS 363 N -2.98 4.22 -0.01 2.72 2.20 -1.26 -3.99 119.74 120.64 1oie s LYS 363 Ca 0.63 2.18 0.18 0.00 -0.36 0.00 0.00 55.97 58.59 1oie s LYS 363 Cb -0.16 -3.71 -0.22 0.00 -1.51 0.00 0.00 37.83 32.22 1oie s LYS 363 CO 0.21 -0.72 0.65 0.44 -0.36 0.00 0.00 175.35 175.56 1oie n ILE 364 N 4.95 0.00 -1.58 5.43 -5.35 0.33 -4.98 119.36 118.16 1oie n ILE 364 Ca 0.15 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1oie n ILE 364 Cb 0.42 0.74 0.00 0.00 -1.74 0.00 0.00 39.64 39.06 1oie n ILE 364 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1oie n GLY 365 N 1.43 -1.27 3.27 3.28 0.00 -1.12 -4.12 105.19 106.67 1oie n GLY 365 Ca 0.01 -0.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 1oie n GLY 365 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1oie s GLU 366 N -1.09 0.79 0.04 1.61 -1.05 -1.26 0.62 118.70 118.36 1oie s GLU 366 Ca 0.00 -0.37 0.05 0.00 -0.15 0.00 0.00 54.97 54.50 1oie s GLU 366 Cb 0.00 0.35 -0.02 0.00 -0.44 0.00 0.00 34.13 34.02 1oie s GLU 366 CO 0.00 -0.25 -0.13 -0.08 0.95 0.00 0.00 175.26 175.75 1oie s THR 367 N -2.15 1.06 -2.51 1.83 -1.32 -0.36 -0.27 115.64 111.92 1oie s THR 367 Ca -0.08 -0.97 0.26 0.00 -1.21 0.00 0.00 61.69 59.69 1oie s THR 367 Cb -0.02 -0.97 0.49 0.00 -1.51 0.00 0.00 72.50 70.49 1oie s THR 367 CO -0.01 -0.00 1.64 -0.46 -2.21 0.00 0.00 174.62 173.58 1oie n ASN 368 N 1.93 1.75 -3.77 8.08 6.94 -1.12 -1.44 115.26 127.63 1oie n ASN 368 Ca -0.18 -1.61 -0.11 0.00 -0.02 0.00 0.00 54.58 52.66 1oie n ASN 368 Cb 0.55 -0.03 -0.07 0.00 -2.36 0.00 0.00 39.78 37.87 1oie n ASN 368 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1oie s GLY 369 N -1.90 -0.09 0.10 4.83 0.00 -1.26 -4.91 107.32 104.09 1oie s GLY 369 Ca 0.36 -0.07 -0.31 0.00 0.00 0.00 0.00 44.72 44.70 1oie s GLY 369 CO 0.32 -0.28 1.86 -1.60 0.00 0.00 0.00 173.10 173.40 1oie s ARG 370 N -2.62 4.14 -0.37 2.90 3.52 -1.26 -4.25 118.95 121.01 1oie s ARG 370 Ca -0.05 2.59 -0.22 0.00 -0.13 0.00 0.00 55.73 57.92 1oie s ARG 370 Cb -0.01 -3.74 0.01 0.00 -1.56 0.00 0.00 34.95 29.65 1oie s ARG 370 CO -0.04 -0.87 0.72 -0.51 -0.81 0.00 0.00 175.30 173.80 1oie s LEU 371 N 3.19 4.20 -0.44 -0.88 1.43 -0.30 -4.94 118.68 120.95 1oie s LEU 371 Ca 0.83 0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 53.86 1oie s LEU 371 Cb -0.45 -2.92 0.03 0.00 0.03 0.00 0.00 46.19 42.87 1oie s LEU 371 CO 0.37 -0.70 1.14 -0.70 0.23 0.00 0.00 176.35 176.70 1oie s GLU 372 N 2.96 3.80 -0.08 1.70 2.56 -1.26 -1.84 118.70 126.54 1oie s GLU 372 Ca 0.28 0.71 0.12 0.00 0.00 0.00 0.00 54.97 56.08 1oie s GLU 372 Cb -0.14 -3.87 0.18 0.00 2.00 0.00 0.00 34.13 32.30 1oie s GLU 372 CO 0.17 -1.28 1.07 0.41 -0.56 0.00 0.00 175.26 175.07 1oie n GLY 373 N 4.62 3.39 3.77 -1.50 0.00 -1.26 -3.77 105.19 110.45 1oie n GLY 373 Ca 0.12 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 45.06 1oie n GLY 373 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1oie s ASP 374 N -2.12 7.00 0.21 1.61 1.11 -1.26 -3.77 116.67 119.44 1oie s ASP 374 Ca 0.20 2.10 -0.12 0.00 0.18 0.00 0.00 52.55 54.91 1oie s ASP 374 Cb 0.17 -2.60 0.26 0.00 1.07 0.00 0.00 42.92 41.83 1oie s ASP 374 CO 0.02 -0.32 1.66 -0.09 1.18 0.00 0.00 175.17 177.62 1oie h ARG 375 N 3.05 0.09 0.00 8.23 2.43 -1.95 0.23 114.38 126.47 1oie h ARG 375 Ca -0.47 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1oie h ARG 375 Cb 1.21 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1oie h ARG 375 CO 0.64 0.06 0.00 -0.40 -1.51 0.00 0.00 179.97 178.76 1oie n ASP 376 N -5.29 0.00 -0.04 -3.80 5.68 -1.26 -2.18 116.55 109.66 1oie n ASP 376 Ca 0.08 -1.62 -0.10 0.00 -0.50 0.00 0.00 54.79 52.65 1oie n ASP 376 Cb 0.33 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.28 1oie n ASP 376 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1oie n LYS 377 N -0.61 0.25 0.16 0.11 4.76 -0.17 -4.57 118.16 118.10 1oie n LYS 377 Ca 0.05 0.11 0.13 0.00 -2.87 0.00 0.00 58.31 55.72 1oie n LYS 377 Cb 0.02 -0.93 0.56 0.00 -1.84 0.00 0.00 35.03 32.84 1oie n LYS 377 CO 0.00 0.00 0.00 -0.39 -1.37 0.00 0.00 177.40 175.64 1oie h VAL 378 N -0.45 0.00 -0.55 -0.18 -1.51 -0.97 0.41 116.25 113.00 1oie h VAL 378 Ca -0.19 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 1oie h VAL 378 Cb 0.93 0.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.05 1oie h VAL 378 CO -0.11 0.00 0.00 0.54 -1.23 0.00 0.00 177.57 176.77 1oie n ARG 379 N -2.39 2.61 0.00 5.19 1.74 -0.93 -4.32 116.66 118.56 1oie n ARG 379 Ca 0.01 -2.43 0.00 0.00 -0.77 0.00 0.00 57.85 54.67 1oie n ARG 379 Cb 0.20 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 1oie n ARG 379 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1oie n PHE 380 N 1.44 0.00 -4.02 -1.55 3.72 -0.11 -0.58 117.46 116.36 1oie n PHE 380 Ca 0.21 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.51 1oie n PHE 380 Cb 0.59 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.05 1oie n PHE 380 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1oie s VAL 381 N -1.61 0.05 0.22 -4.37 -7.23 -0.05 -4.91 120.40 102.50 1oie s VAL 381 Ca 0.00 -1.52 -0.30 0.00 -1.81 0.00 0.00 61.98 58.35 1oie s VAL 381 Cb 0.00 -2.01 -0.09 0.00 0.56 0.00 0.00 36.38 34.84 1oie s VAL 381 CO 0.00 -0.23 1.38 -1.10 -0.31 0.00 0.00 175.10 174.84 1oie s GLN 382 N -4.01 4.33 0.36 4.82 -1.52 -1.26 -4.30 119.66 118.07 1oie s GLN 382 Ca 0.22 2.18 0.05 0.00 -1.95 0.00 0.00 55.36 55.85 1oie s GLN 382 Cb 0.04 -3.15 -0.07 0.00 -0.22 0.00 0.00 33.01 29.61 1oie s GLN 382 CO 0.03 -0.34 0.04 0.95 -0.25 0.00 0.00 175.29 175.73 1oie s THR 383 N 0.06 1.42 0.39 -0.19 -4.23 -1.26 -4.84 115.64 106.98 1oie s THR 383 Ca 0.58 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.18 1oie s THR 383 Cb -0.39 -2.83 0.19 0.00 1.34 0.00 0.00 72.50 70.80 1oie s THR 383 CO 0.41 0.00 1.95 -0.55 -0.54 0.00 0.00 174.62 175.89 1oie h ASN 384 N 1.98 0.30 -0.22 3.99 -1.07 -1.81 -2.08 115.58 116.68 1oie h ASN 384 Ca -0.42 -0.05 -0.17 0.00 0.07 0.00 0.00 56.30 55.73 1oie h ASN 384 Cb 1.25 -0.08 -0.00 0.00 -2.07 0.00 0.00 38.32 37.41 1oie h ASN 384 CO 0.73 0.38 -0.51 -0.03 0.07 0.00 0.00 177.43 178.07 1oie h MET 385 N 0.32 0.80 -0.56 4.14 4.05 -1.86 -1.27 114.93 120.55 1oie h MET 385 Ca 0.07 -0.48 0.11 0.00 -0.28 0.00 0.00 59.70 59.12 1oie h MET 385 Cb 0.26 0.05 -0.09 0.00 -0.80 0.00 0.00 31.60 31.02 1oie h MET 385 CO 0.01 1.12 0.07 0.78 0.23 0.00 0.00 176.91 179.11 1oie h GLY 386 N 0.81 0.66 1.65 1.39 0.00 -1.68 -1.01 103.07 104.88 1oie h GLY 386 Ca 0.02 0.02 -0.14 0.00 0.00 0.00 0.00 47.33 47.23 1oie h GLY 386 CO 0.11 -0.13 -0.52 3.21 0.00 0.00 0.00 176.54 179.22 1oie h ARG 387 N 0.19 0.37 0.04 4.80 2.47 -1.07 -2.00 114.38 119.18 1oie h ARG 387 Ca 0.29 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1oie h ARG 387 Cb 0.44 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.78 1oie h ARG 387 CO -0.42 0.80 -0.02 1.25 0.56 0.00 0.00 179.97 182.14 1oie h LEU 388 N 0.29 -0.04 0.07 3.04 5.85 -0.99 0.75 115.31 124.27 1oie h LEU 388 Ca 0.01 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.47 1oie h LEU 388 Cb 1.01 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1oie h LEU 388 CO 0.09 0.24 -0.09 0.40 -0.34 0.00 0.00 178.44 178.74 1oie h ILE 389 N -0.33 0.79 -0.50 4.05 2.04 -1.12 -0.50 117.51 121.92 1oie h ILE 389 Ca -0.01 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 1oie h ILE 389 Cb 0.31 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1oie h ILE 389 CO 0.01 0.00 0.06 -0.07 0.00 0.00 0.00 178.15 178.15 1oie h LEU 390 N -0.19 0.76 -0.63 1.44 3.38 -1.38 -0.17 115.31 118.51 1oie h LEU 390 Ca 0.01 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.86 1oie h LEU 390 Cb 0.20 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1oie h LEU 390 CO -0.04 0.79 0.38 0.00 0.09 0.00 0.00 178.44 179.65 1oie h ALA 391 N 1.31 0.83 -0.63 1.53 0.00 -0.58 0.12 119.26 121.84 1oie h ALA 391 Ca 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1oie h ALA 391 Cb 0.37 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1oie h ALA 391 CO 0.01 0.11 0.29 0.00 0.00 0.00 0.00 179.25 179.66 1oie h ALA 392 N 1.29 0.81 -0.27 0.00 0.00 0.12 -1.25 119.26 119.96 1oie h ALA 392 Ca 0.26 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 1oie h ALA 392 Cb 0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1oie h ALA 392 CO -0.12 0.39 -0.43 1.96 0.00 0.00 0.00 179.25 181.04 1oie h GLN 393 N 0.87 0.66 -0.44 0.00 4.20 -0.76 -2.00 115.11 117.64 1oie h GLN 393 Ca 0.22 -0.36 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 1oie h GLN 393 Cb 0.13 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1oie h GLN 393 CO -0.03 0.96 0.13 0.52 -0.67 0.00 0.00 178.83 179.75 1oie h MET 394 N 0.54 0.69 -0.53 1.46 2.86 -0.68 -2.51 114.93 116.75 1oie h MET 394 Ca 0.04 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1oie h MET 394 Cb 0.97 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.50 1oie h MET 394 CO 0.09 0.67 0.32 0.22 1.06 0.00 0.00 176.91 179.26 1oie h ASP 395 N 0.57 0.64 0.26 1.22 3.58 -1.06 -0.27 116.42 121.35 1oie h ASP 395 Ca 0.14 -0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 1oie h ASP 395 Cb 0.27 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 1oie h ASP 395 CO -0.00 0.51 -0.21 -0.09 -2.88 0.00 0.00 179.24 176.57 1oie h ARG 396 N 0.71 0.00 -0.01 0.28 9.65 -1.26 -3.28 114.38 120.48 1oie h ARG 396 Ca 0.19 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.07 1oie h ARG 396 Cb -0.01 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.57 1oie h ARG 396 CO -0.03 0.21 -0.49 0.25 2.80 0.00 0.00 179.97 182.70 1oie n THR 397 N -4.14 0.00 -1.62 0.20 -2.24 -0.96 -2.61 114.28 102.92 1oie n THR 397 Ca -0.02 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.40 1oie n THR 397 Cb 0.28 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.57 1oie n THR 397 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oie n GLY 398 N 1.23 0.76 3.82 3.38 0.00 -0.15 -3.72 105.19 110.51 1oie n GLY 398 Ca 0.05 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 1oie n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oie s ALA 399 N -2.45 2.85 -0.12 4.61 0.00 -0.99 -4.86 121.76 120.81 1oie s ALA 399 Ca 0.00 0.22 0.17 0.00 0.00 0.00 0.00 51.96 52.35 1oie s ALA 399 Cb 0.00 -3.17 -0.18 0.00 0.00 0.00 0.00 23.12 19.77 1oie s ALA 399 CO 0.00 -0.75 0.67 -0.25 0.00 0.00 0.00 175.76 175.44 1oie n ASP 400 N -2.24 0.67 -3.57 0.00 8.00 0.88 -4.83 116.55 115.45 1oie n ASP 400 Ca 0.08 0.30 -0.10 0.00 0.71 0.00 0.00 54.79 55.78 1oie n ASP 400 Cb 0.53 0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 42.02 1oie n ASP 400 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1oie s PHE 401 N -2.89 0.33 0.10 1.24 -0.12 -1.00 -4.71 117.98 110.94 1oie s PHE 401 Ca -0.04 -0.76 -0.24 0.00 -0.05 0.00 0.00 56.93 55.83 1oie s PHE 401 Cb 0.09 0.39 0.06 0.00 -0.63 0.00 0.00 43.02 42.93 1oie s PHE 401 CO 0.82 -1.21 0.59 0.00 -0.05 0.00 0.00 175.22 175.37 1oie s ALA 402 N -3.41 -1.53 -0.03 1.99 0.00 -0.98 -1.51 121.76 116.30 1oie s ALA 402 Ca 0.20 0.61 -0.13 0.00 0.00 0.00 0.00 51.96 52.63 1oie s ALA 402 Cb -0.03 0.64 0.02 0.00 0.00 0.00 0.00 23.12 23.75 1oie s ALA 402 CO 0.11 -0.65 0.29 0.54 0.00 0.00 0.00 175.76 176.06 1oie s VAL 403 N -3.11 0.05 0.23 0.00 0.11 -0.82 -1.24 120.40 115.62 1oie s VAL 403 Ca -0.02 -0.44 -0.11 0.00 -2.93 0.00 0.00 61.98 58.49 1oie s VAL 403 Cb -0.01 -0.57 -0.01 0.00 -1.53 0.00 0.00 36.38 34.26 1oie s VAL 403 CO -0.07 -0.24 0.40 0.00 -3.33 0.00 0.00 175.10 171.86 1oie s MET 404 N -1.14 1.43 0.08 1.54 0.23 -0.70 -4.22 119.30 116.53 1oie s MET 404 Ca -0.12 -1.29 -0.09 0.00 -1.03 0.00 0.00 55.69 53.16 1oie s MET 404 Cb -0.05 0.43 -0.06 0.00 -1.53 0.00 0.00 34.83 33.62 1oie s MET 404 CO 0.03 -0.57 0.40 -1.54 -2.03 0.00 0.00 175.02 171.31 1oie s SER 405 N -3.03 6.63 0.49 -1.18 1.04 -1.26 -0.62 113.70 115.77 1oie s SER 405 Ca 0.24 0.77 0.20 0.00 0.48 0.00 0.00 55.95 57.64 1oie s SER 405 Cb 0.01 -2.17 1.25 0.00 0.10 0.00 0.00 66.02 65.21 1oie s SER 405 CO 0.08 0.16 2.06 1.23 0.98 0.00 0.00 173.24 177.75 1oie h GLY 406 N 3.64 0.00 1.44 7.32 0.00 -0.18 -0.68 103.07 114.61 1oie h GLY 406 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1oie h GLY 406 CO 0.67 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.82 1oie n GLY 407 N -1.04 -0.67 0.23 4.60 0.00 0.85 -2.17 105.19 106.99 1oie n GLY 407 Ca -0.02 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1oie n GLY 407 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oie n GLY 408 N -0.12 -0.61 3.60 -0.02 0.00 -0.26 -4.79 105.19 102.99 1oie n GLY 408 Ca 0.08 -0.49 -0.39 0.00 0.00 0.00 0.00 46.02 45.22 1oie n GLY 408 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oie s ILE 409 N -2.67 5.23 -0.33 -0.61 1.01 -0.92 -4.72 121.20 118.19 1oie s ILE 409 Ca 0.18 0.40 0.03 0.00 0.00 0.00 0.00 60.65 61.25 1oie s ILE 409 Cb 0.18 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 39.06 1oie s ILE 409 CO 0.63 0.20 0.69 0.54 0.00 0.00 0.00 174.94 176.99 1oie n ARG 410 N 5.19 0.12 -3.73 2.79 5.12 -0.66 -4.79 116.66 120.71 1oie n ARG 410 Ca -0.11 -0.87 -0.03 0.00 -1.93 0.00 0.00 57.85 54.91 1oie n ARG 410 Cb 0.51 -1.06 -0.01 0.00 -1.16 0.00 0.00 32.46 30.74 1oie n ARG 410 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1oie s ASP 411 N -0.39 -0.17 0.36 0.55 -1.08 -1.25 -4.74 116.67 109.95 1oie s ASP 411 Ca 0.04 -0.35 0.07 0.00 -0.52 0.00 0.00 52.55 51.79 1oie s ASP 411 Cb 0.03 0.44 -0.01 0.00 -1.46 0.00 0.00 42.92 41.92 1oie s ASP 411 CO 0.04 -0.81 0.44 -0.44 0.52 0.00 0.00 175.17 174.91 1oie s SER 412 N -2.93 5.63 -0.11 -0.34 0.01 -1.26 -4.01 113.70 110.69 1oie s SER 412 Ca 0.12 -0.38 0.01 0.00 1.31 0.00 0.00 55.95 57.01 1oie s SER 412 Cb -0.01 -0.96 0.02 0.00 0.21 0.00 0.00 66.02 65.28 1oie s SER 412 CO 0.01 -0.52 -0.13 -0.63 0.41 0.00 0.00 173.24 172.39 1oie s ILE 413 N -2.28 1.34 0.73 1.44 1.01 -0.76 -4.92 121.20 117.75 1oie s ILE 413 Ca 0.47 -0.53 -0.13 0.00 0.00 0.00 0.00 60.65 60.45 1oie s ILE 413 Cb -0.08 -1.26 0.04 0.00 0.01 0.00 0.00 42.46 41.17 1oie s ILE 413 CO 0.30 0.41 1.12 -1.61 0.00 0.00 0.00 174.94 175.16 1oie s GLU 414 N 1.18 2.39 0.35 2.79 0.41 -1.26 -1.14 118.70 123.42 1oie s GLU 414 Ca -0.03 1.37 -0.28 0.00 -0.41 0.00 0.00 54.97 55.61 1oie s GLU 414 Cb -0.14 -1.90 -0.12 0.00 -1.78 0.00 0.00 34.13 30.19 1oie s GLU 414 CO -0.04 -1.56 1.37 0.00 -0.49 0.00 0.00 175.26 174.53 1oie n ALA 415 N -2.98 1.68 0.00 5.21 0.00 -1.26 -4.68 120.51 118.48 1oie n ALA 415 Ca 0.10 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1oie n ALA 415 Cb 0.52 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1oie n ALA 415 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oie n GLY 416 N 0.74 0.41 3.83 0.00 0.00 -0.52 -4.97 105.19 104.68 1oie n GLY 416 Ca 0.04 -2.05 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 1oie n GLY 416 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1oie s ASP 417 N -4.00 6.91 -0.06 1.61 1.01 -1.26 -1.22 116.67 119.65 1oie s ASP 417 Ca 0.00 1.62 0.04 0.00 0.71 0.00 0.00 52.55 54.92 1oie s ASP 417 Cb 0.00 -2.51 -0.00 0.00 1.01 0.00 0.00 42.92 41.42 1oie s ASP 417 CO 0.00 -0.34 -0.19 -0.63 0.21 0.00 0.00 175.17 174.22 1oie s ILE 418 N -2.16 1.60 0.35 0.77 1.01 0.20 -4.92 121.20 118.05 1oie s ILE 418 Ca 0.61 -0.79 0.08 0.00 0.00 0.00 0.00 60.65 60.55 1oie s ILE 418 Cb -0.09 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 1oie s ILE 418 CO 0.14 0.46 0.20 -0.94 0.00 0.00 0.00 174.94 174.80 1oie s SER 419 N 0.20 4.88 0.27 3.58 1.04 -1.26 -0.51 113.70 121.90 1oie s SER 419 Ca -0.09 -0.70 -0.02 0.00 0.48 0.00 0.00 55.95 55.62 1oie s SER 419 Cb -0.14 -0.78 0.36 0.00 0.10 0.00 0.00 66.02 65.56 1oie s SER 419 CO 0.04 -0.35 1.82 0.22 0.98 0.00 0.00 173.24 175.95 1oie h TYR 420 N 1.42 0.91 -1.00 5.02 5.03 -1.63 -1.91 116.97 124.81 1oie h TYR 420 Ca -0.44 -0.08 0.09 0.00 2.58 0.00 0.00 58.73 60.88 1oie h TYR 420 Cb 1.25 -0.27 -0.08 0.00 1.55 0.00 0.00 36.73 39.19 1oie h TYR 420 CO 0.59 0.75 0.64 -0.22 -1.32 0.00 0.00 178.16 178.59 1oie h LYS 421 N 0.86 1.05 -0.29 1.82 3.64 -1.64 -0.34 116.57 121.66 1oie h LYS 421 Ca 0.19 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.53 1oie h LYS 421 Cb 0.28 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1oie h LYS 421 CO -0.00 0.69 0.15 -0.91 -2.27 0.00 0.00 179.45 177.10 1oie h ASN 422 N 1.08 0.22 -0.77 4.20 -0.26 -1.64 -2.65 115.58 115.76 1oie h ASN 422 Ca 0.46 0.01 0.06 0.00 -0.56 0.00 0.00 56.30 56.28 1oie h ASN 422 Cb 0.33 -0.03 -0.06 0.00 -1.06 0.00 0.00 38.32 37.50 1oie h ASN 422 CO -0.22 0.16 0.45 0.58 -1.06 0.00 0.00 177.43 177.35 1oie h VAL 423 N 0.31 1.00 0.00 2.81 2.07 -0.83 -2.38 116.25 119.23 1oie h VAL 423 Ca 0.12 -0.28 -0.05 0.00 0.82 0.00 0.00 66.70 67.31 1oie h VAL 423 Cb 0.04 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1oie h VAL 423 CO -0.08 0.15 -0.22 -0.07 0.02 0.00 0.00 177.57 177.37 1oie h LEU 424 N 0.83 0.00 -0.36 2.57 3.38 -1.00 0.31 115.31 121.04 1oie h LEU 424 Ca 0.34 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.14 1oie h LEU 424 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1oie h LEU 424 CO -0.18 0.22 -0.49 0.11 0.09 0.00 0.00 178.44 178.19 1oie h LYS 425 N 0.00 0.87 -0.28 1.13 1.79 -1.07 -2.66 116.57 116.34 1oie h LYS 425 Ca -0.00 -0.51 -0.13 0.00 -2.18 0.00 0.00 60.65 57.83 1oie h LYS 425 Cb 0.50 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 1oie h LYS 425 CO 0.03 1.15 -0.35 0.28 -1.08 0.00 0.00 179.45 179.48 1oie h VAL 426 N 0.68 1.29 -2.78 0.50 2.07 -1.01 -3.34 116.25 113.66 1oie h VAL 426 Ca 0.03 -1.50 -0.61 0.00 0.82 0.00 0.00 66.70 65.45 1oie h VAL 426 Cb 1.08 1.45 -0.40 0.00 -1.52 0.00 0.00 31.29 31.90 1oie h VAL 426 CO 0.11 0.48 -0.77 -1.10 0.02 0.00 0.00 177.57 176.31 1oie s GLN 427 N -4.35 1.59 0.00 1.57 -1.52 0.03 -1.65 119.66 115.32 1oie s GLN 427 Ca -0.08 -2.55 0.22 0.00 -1.95 0.00 0.00 55.36 51.00 1oie s GLN 427 Cb 0.12 -2.39 -0.01 0.00 -0.22 0.00 0.00 33.01 30.51 1oie s GLN 427 CO 0.83 -1.30 1.03 -0.35 -0.25 0.00 0.00 175.29 175.26 1oie n PRO 428 N 2.68 0.05 0.00 2.91 -0.04 -1.00 -4.48 135.00 135.12 1oie n PRO 428 Ca 0.21 -0.01 0.13 0.00 -0.04 0.00 0.00 63.50 63.79 1oie n PRO 428 Cb 0.40 -1.51 0.33 0.00 -0.04 0.00 0.00 33.50 32.68 1oie n PRO 428 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1oie n PHE 429 N -1.57 0.00 -2.56 0.54 3.72 -1.26 -4.94 117.46 111.39 1oie n PHE 429 Ca 0.04 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.29 1oie n PHE 429 Cb 0.35 -0.01 0.01 0.00 -0.94 0.00 0.00 39.48 38.89 1oie n PHE 429 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oie n GLY 430 N 1.27 -0.18 3.74 1.37 0.00 -1.26 -4.97 105.19 105.16 1oie n GLY 430 Ca 0.16 -0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 1oie n GLY 430 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1oie s ASN 431 N -2.61 4.90 -0.17 1.61 0.02 -1.26 -4.84 114.94 112.60 1oie s ASN 431 Ca 0.12 2.39 -0.09 0.00 -1.02 0.00 0.00 52.86 54.27 1oie s ASN 431 Cb -0.05 -2.60 -0.05 0.00 0.02 0.00 0.00 41.25 38.58 1oie s ASN 431 CO 0.15 -1.79 0.13 -0.69 0.02 0.00 0.00 177.10 174.91 1oie s VAL 432 N -1.69 5.41 0.07 1.60 1.01 -1.26 -0.36 120.40 125.18 1oie s VAL 432 Ca 0.77 0.18 -0.31 0.00 0.00 0.00 0.00 61.98 62.63 1oie s VAL 432 Cb -0.31 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.60 1oie s VAL 432 CO 0.37 0.52 1.21 -0.69 0.00 0.00 0.00 175.10 176.50 1oie s VAL 433 N -0.22 3.97 0.32 2.92 1.01 -0.15 -0.87 120.40 127.38 1oie s VAL 433 Ca 0.11 1.43 0.03 0.00 0.00 0.00 0.00 61.98 63.55 1oie s VAL 433 Cb -0.11 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1oie s VAL 433 CO 0.01 0.12 0.13 0.68 0.00 0.00 0.00 175.10 176.04 1oie s VAL 434 N 0.98 0.52 0.08 2.92 -7.23 -0.11 -2.64 120.40 114.91 1oie s VAL 434 Ca 0.58 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.63 1oie s VAL 434 Cb -0.30 -2.54 0.02 0.00 0.56 0.00 0.00 36.38 34.12 1oie s VAL 434 CO 0.30 0.00 0.28 -0.72 -0.31 0.00 0.00 175.10 174.65 1oie s TYR 435 N -3.52 -0.03 -0.04 2.82 -0.85 -0.44 -1.33 117.35 113.96 1oie s TYR 435 Ca 0.34 -0.26 0.02 0.00 -0.52 0.00 0.00 57.07 56.65 1oie s TYR 435 Cb 0.05 0.08 0.01 0.00 0.38 0.00 0.00 41.96 42.49 1oie s TYR 435 CO 0.16 -0.57 -0.07 0.00 -1.52 0.00 0.00 175.55 173.55 1oie s ALA 436 N -3.34 0.84 -0.21 9.51 0.00 -0.16 -0.73 121.76 127.66 1oie s ALA 436 Ca 0.01 -0.21 -0.29 0.00 0.00 0.00 0.00 51.96 51.47 1oie s ALA 436 Cb 0.02 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.74 1oie s ALA 436 CO -0.08 0.07 1.03 -0.51 0.00 0.00 0.00 175.76 176.27 1oie s ASP 437 N 0.61 7.12 0.07 0.00 1.01 -1.00 -1.38 116.67 123.09 1oie s ASP 437 Ca -0.10 1.40 0.04 0.00 0.71 0.00 0.00 52.55 54.60 1oie s ASP 437 Cb -0.13 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 41.23 1oie s ASP 437 CO 0.01 -0.64 -0.11 0.00 0.21 0.00 0.00 175.17 174.64 1oie s MET 438 N 3.05 0.72 0.79 8.23 0.23 0.30 -4.78 119.30 127.84 1oie s MET 438 Ca 0.44 -0.95 -0.11 0.00 -1.03 0.00 0.00 55.69 54.04 1oie s MET 438 Cb -0.15 -0.54 0.07 0.00 -1.53 0.00 0.00 34.83 32.68 1oie s MET 438 CO 0.07 0.10 1.09 0.95 -2.03 0.00 0.00 175.02 175.20 1oie s THR 439 N -1.71 3.26 0.31 3.16 -4.23 -1.26 0.39 115.64 115.56 1oie s THR 439 Ca -0.02 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 60.90 1oie s THR 439 Cb -0.08 -2.94 0.27 0.00 1.34 0.00 0.00 72.50 71.10 1oie s THR 439 CO 0.01 -0.53 1.95 1.23 -0.54 0.00 0.00 174.62 176.73 1oie h GLY 440 N -1.17 1.18 0.91 3.99 0.00 -0.73 0.37 103.07 107.62 1oie h GLY 440 Ca -0.45 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 46.46 1oie h GLY 440 CO 0.53 0.34 0.11 1.70 0.00 0.00 0.00 176.54 179.22 1oie h LYS 441 N 1.02 0.46 -0.05 4.80 1.63 -1.82 0.82 116.57 123.42 1oie h LYS 441 Ca 0.34 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 60.02 1oie h LYS 441 Cb 0.06 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.62 1oie h LYS 441 CO -0.10 0.49 -0.10 0.93 -3.45 0.00 0.00 179.45 177.22 1oie h GLU 442 N 0.33 0.07 -0.50 1.90 5.08 -1.73 -1.32 114.58 118.42 1oie h GLU 442 Ca 0.10 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 1oie h GLU 442 Cb 0.22 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1oie h GLU 442 CO -0.01 0.18 0.01 0.28 -1.00 0.00 0.00 179.01 178.48 1oie h VAL 443 N 0.07 1.26 -0.27 3.13 2.07 -0.24 -1.02 116.25 121.26 1oie h VAL 443 Ca 0.02 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1oie h VAL 443 Cb 0.23 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1oie h VAL 443 CO 0.01 0.37 0.13 0.40 0.02 0.00 0.00 177.57 178.51 1oie h ILE 444 N 0.73 1.14 -0.29 4.57 2.04 -0.10 -1.97 117.51 123.63 1oie h ILE 444 Ca 0.14 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.46 1oie h ILE 444 Cb 0.49 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1oie h ILE 444 CO 0.02 0.14 -0.39 0.44 0.00 0.00 0.00 178.15 178.36 1oie h ASP 445 N 0.30 0.73 -0.22 1.72 3.32 -1.22 -0.89 116.42 120.17 1oie h ASP 445 Ca 0.09 -0.32 -0.07 0.00 0.02 0.00 0.00 57.03 56.75 1oie h ASP 445 Cb 0.11 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1oie h ASP 445 CO -0.01 1.04 -0.13 0.22 -1.72 0.00 0.00 179.24 178.63 1oie h TYR 446 N 0.56 0.55 -0.36 4.55 3.20 -1.08 -2.09 116.97 122.30 1oie h TYR 446 Ca 0.05 -0.14 -0.16 0.00 3.14 0.00 0.00 58.73 61.61 1oie h TYR 446 Cb 0.92 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.06 1oie h TYR 446 CO 0.04 0.77 -0.41 -0.07 -1.64 0.00 0.00 178.16 176.85 1oie h LEU 447 N 0.17 0.95 -0.28 2.82 3.38 -1.30 0.04 115.31 121.09 1oie h LEU 447 Ca 0.04 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.61 1oie h LEU 447 Cb 0.64 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1oie h LEU 447 CO 0.04 1.23 0.02 0.74 0.09 0.00 0.00 178.44 180.56 1oie h THR 448 N 0.72 0.83 -0.64 0.22 2.02 -1.16 0.25 112.91 115.14 1oie h THR 448 Ca 0.05 -0.04 -0.06 0.00 0.77 0.00 0.00 66.41 67.13 1oie h THR 448 Cb 1.00 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 1oie h THR 448 CO 0.10 0.02 0.16 0.00 0.37 0.00 0.00 175.52 176.16 1oie h ALA 449 N 1.23 1.06 -0.16 6.16 0.00 -1.02 -3.00 119.26 123.53 1oie h ALA 449 Ca 0.13 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.60 1oie h ALA 449 Cb 0.16 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.71 1oie h ALA 449 CO -0.20 0.62 -0.71 0.28 0.00 0.00 0.00 179.25 179.24 1oie h VAL 450 N 0.96 1.29 -0.02 0.00 2.07 -0.10 -2.20 116.25 118.25 1oie h VAL 450 Ca 0.20 -1.92 0.01 0.00 0.82 0.00 0.00 66.70 65.81 1oie h VAL 450 Cb 0.34 1.99 -0.00 0.00 -1.52 0.00 0.00 31.29 32.10 1oie h VAL 450 CO 0.00 0.61 0.44 0.00 0.02 0.00 0.00 177.57 178.63 1oie h ALA 451 N 0.55 1.47 0.00 1.67 0.00 -0.42 -1.20 119.26 121.32 1oie h ALA 451 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1oie h ALA 451 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1oie h ALA 451 CO 0.15 -0.45 0.00 1.96 0.00 0.00 0.00 179.25 180.91 1oie h GLN 452 N 0.00 0.00 -6.95 0.00 1.08 -1.26 -3.45 115.11 104.53 1oie h GLN 452 Ca 0.01 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.71 1oie h GLN 452 Cb 0.88 0.00 0.05 0.00 -0.05 0.00 0.00 27.48 28.36 1oie h GLN 452 CO -0.00 0.00 0.49 -1.64 -0.95 0.00 0.00 178.83 176.73 1oie s MET 453 N -3.47 4.03 0.06 1.46 -1.94 -0.45 -4.97 119.30 114.03 1oie s MET 453 Ca 0.03 1.80 0.02 0.00 -1.71 0.00 0.00 55.69 55.83 1oie s MET 453 Cb 0.09 -2.63 -0.04 0.00 2.01 0.00 0.00 34.83 34.25 1oie s MET 453 CO 0.53 -0.32 0.09 0.15 -0.01 0.00 0.00 175.02 175.46 1oie s LYS 454 N -2.36 2.97 1.03 2.03 -0.14 -1.26 -4.76 119.74 117.25 1oie s LYS 454 Ca 0.58 -0.63 -0.16 0.00 -1.36 0.00 0.00 55.97 54.40 1oie s LYS 454 Cb -0.29 -2.78 0.05 0.00 -1.68 0.00 0.00 37.83 33.12 1oie s LYS 454 CO 0.37 0.58 0.11 -2.30 -0.76 0.00 0.00 175.35 173.35 1oie n PRO 455 N 0.55 -0.84 -2.16 -1.68 -0.02 -1.26 -3.21 135.00 126.38 1oie n PRO 455 Ca -0.09 -0.22 -0.21 0.00 -2.02 0.00 0.00 63.50 60.97 1oie n PRO 455 Cb 0.52 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.25 1oie n PRO 455 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1oie n ASP 456 N -1.08 -5.79 -4.18 2.55 2.03 0.25 -4.98 116.55 105.35 1oie n ASP 456 Ca 0.03 0.14 -0.11 0.00 0.52 0.00 0.00 54.79 55.37 1oie n ASP 456 Cb 0.58 -4.89 -0.10 0.00 -0.72 0.00 0.00 41.12 35.99 1oie n ASP 456 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1oie s SER 457 N -2.27 0.79 0.40 1.67 1.04 -1.20 -5.03 113.70 109.11 1oie s SER 457 Ca 0.00 -1.15 0.29 0.00 0.48 0.00 0.00 55.95 55.56 1oie s SER 457 Cb 0.00 0.19 1.29 0.00 0.10 0.00 0.00 66.02 67.61 1oie s SER 457 CO 0.00 -0.62 1.86 1.23 0.98 0.00 0.00 173.24 176.69 1oie h GLY 458 N 2.83 0.00 1.43 7.32 0.00 -1.91 -2.63 103.07 110.12 1oie h GLY 458 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1oie h GLY 458 CO 0.62 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 177.14 1oie n ALA 459 N -1.91 2.55 -1.71 3.60 0.00 -1.26 -0.10 120.51 121.68 1oie n ALA 459 Ca 0.01 -0.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 1oie n ALA 459 Cb 0.21 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.16 1oie n ALA 459 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1oie n TYR 460 N -1.22 2.72 -3.10 0.00 9.36 -0.99 -4.69 117.16 119.23 1oie n TYR 460 Ca 0.15 -0.05 -0.39 0.00 3.32 0.00 0.00 57.90 60.92 1oie n TYR 460 Cb 0.24 -2.70 -0.05 0.00 -0.63 0.00 0.00 39.34 36.19 1oie n TYR 460 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1oie s PRO 461 N 1.82 4.40 -0.15 2.98 0.04 -1.26 -0.02 135.00 142.81 1oie s PRO 461 Ca 0.78 0.87 -0.18 0.00 0.04 0.00 0.00 61.00 62.51 1oie s PRO 461 Cb -0.49 -3.37 -0.04 0.00 0.04 0.00 0.00 34.50 30.65 1oie s PRO 461 CO 0.34 0.29 0.47 -0.65 0.04 0.00 0.00 177.00 177.49 1oie s GLN 462 N 0.02 4.28 0.21 4.56 -1.52 0.21 -4.84 119.66 122.59 1oie s GLN 462 Ca 0.35 0.39 0.10 0.00 -1.95 0.00 0.00 55.36 54.25 1oie s GLN 462 Cb -0.19 -3.48 -0.04 0.00 -0.22 0.00 0.00 33.01 29.08 1oie s GLN 462 CO 0.19 0.06 -0.12 -0.06 -0.25 0.00 0.00 175.29 175.11 1oie s PHE 463 N 0.96 2.54 0.02 0.91 0.08 -1.26 -1.72 117.98 119.51 1oie s PHE 463 Ca 0.24 -0.26 0.03 0.00 0.12 0.00 0.00 56.93 57.06 1oie s PHE 463 Cb -0.15 -1.20 -0.01 0.00 -0.57 0.00 0.00 43.02 41.09 1oie s PHE 463 CO 0.09 0.56 -0.08 0.00 -0.10 0.00 0.00 175.22 175.69 1oie s ALA 464 N -1.94 0.66 -1.66 5.36 0.00 -0.37 -4.77 121.76 119.05 1oie s ALA 464 Ca 0.26 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.70 1oie s ALA 464 Cb -0.08 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.95 1oie s ALA 464 CO 0.15 0.10 0.00 0.09 0.00 0.00 0.00 175.76 176.10 1oie n ASN 465 N 2.31 -4.94 -4.35 0.00 3.02 -1.26 -2.31 115.26 107.73 1oie n ASN 465 Ca -0.17 0.32 -0.32 0.00 -0.03 0.00 0.00 54.58 54.38 1oie n ASN 465 Cb 0.56 -3.91 -0.15 0.00 -0.61 0.00 0.00 39.78 35.67 1oie n ASN 465 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1oie s VAL 466 N -2.65 2.68 0.03 2.41 1.01 -1.26 -1.01 120.40 121.62 1oie s VAL 466 Ca 0.00 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.19 1oie s VAL 466 Cb 0.00 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 1oie s VAL 466 CO 0.00 0.55 -0.10 -0.94 0.00 0.00 0.00 175.10 174.62 1oie s SER 467 N 0.02 1.13 0.02 3.32 1.04 -0.30 -4.34 113.70 114.59 1oie s SER 467 Ca -0.06 -0.38 -0.29 0.00 0.48 0.00 0.00 55.95 55.70 1oie s SER 467 Cb -0.15 -0.06 0.11 0.00 0.10 0.00 0.00 66.02 66.03 1oie s SER 467 CO 0.05 -0.03 1.21 0.72 0.98 0.00 0.00 173.24 176.17 1oie s PHE 468 N -0.79 -0.07 -0.23 5.02 -0.12 -0.29 -0.87 117.98 120.63 1oie s PHE 468 Ca -0.02 -0.08 0.02 0.00 -0.05 0.00 0.00 56.93 56.80 1oie s PHE 468 Cb -0.07 0.57 0.05 0.00 -0.63 0.00 0.00 43.02 42.94 1oie s PHE 468 CO 0.01 -0.41 -0.13 0.08 -0.05 0.00 0.00 175.22 174.72 1oie s VAL 469 N -2.63 2.02 0.02 -2.49 1.01 -0.74 -2.32 120.40 115.26 1oie s VAL 469 Ca 0.13 -1.35 -0.30 0.00 0.00 0.00 0.00 61.98 60.46 1oie s VAL 469 Cb 0.03 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1oie s VAL 469 CO -0.02 0.13 1.05 0.00 0.00 0.00 0.00 175.10 176.25 1oie s ALA 470 N 1.21 3.23 -0.10 5.51 0.00 0.10 -1.24 121.76 130.48 1oie s ALA 470 Ca -0.04 0.63 -0.03 0.00 0.00 0.00 0.00 51.96 52.52 1oie s ALA 470 Cb -0.18 -3.37 0.05 0.00 0.00 0.00 0.00 23.12 19.62 1oie s ALA 470 CO -0.07 -0.29 0.12 0.15 0.00 0.00 0.00 175.76 175.67 1oie s LYS 471 N 1.03 0.02 -0.94 0.00 1.02 -0.55 -0.97 119.74 119.35 1oie s LYS 471 Ca 0.54 0.35 -0.00 0.00 0.02 0.00 0.00 55.97 56.88 1oie s LYS 471 Cb -0.24 -0.73 -0.01 0.00 -0.52 0.00 0.00 37.83 36.34 1oie s LYS 471 CO 0.28 -0.42 0.79 -0.25 -0.92 0.00 0.00 175.35 174.84 1oie n ASP 472 N 5.31 -2.38 -1.33 2.83 8.00 -1.26 -2.60 116.55 125.11 1oie n ASP 472 Ca -0.05 -0.50 -0.17 0.00 0.71 0.00 0.00 54.79 54.78 1oie n ASP 472 Cb 0.50 -4.19 -0.07 0.00 -0.02 0.00 0.00 41.12 37.33 1oie n ASP 472 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oie n GLY 473 N -1.12 1.68 3.00 0.44 0.00 -1.26 -4.97 105.19 102.96 1oie n GLY 473 Ca -0.21 -0.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.56 1oie n GLY 473 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oie s LYS 474 N -3.45 0.72 -0.29 1.61 2.20 -1.07 -4.97 119.74 114.49 1oie s LYS 474 Ca 0.00 -0.28 -0.16 0.00 -0.36 0.00 0.00 55.97 55.17 1oie s LYS 474 Cb 0.00 -0.70 -0.02 0.00 -1.51 0.00 0.00 37.83 35.60 1oie s LYS 474 CO 0.00 0.15 0.44 -0.51 -0.36 0.00 0.00 175.35 175.07 1oie s LEU 475 N -0.04 4.14 0.13 5.43 1.43 -1.26 -1.48 118.68 127.03 1oie s LEU 475 Ca 0.01 0.25 -0.09 0.00 -1.03 0.00 0.00 54.13 53.27 1oie s LEU 475 Cb -0.05 -2.52 -0.06 0.00 0.03 0.00 0.00 46.19 43.59 1oie s LEU 475 CO -0.00 -0.29 0.43 0.20 0.23 0.00 0.00 176.35 176.92 1oie s ASN 476 N 1.65 6.61 -1.52 2.29 0.01 -0.37 -4.43 114.94 119.17 1oie s ASN 476 Ca 0.17 0.78 -0.04 0.00 -0.71 0.00 0.00 52.86 53.06 1oie s ASN 476 Cb -0.16 -2.17 0.04 0.00 0.41 0.00 0.00 41.25 39.37 1oie s ASN 476 CO 0.11 0.08 0.34 0.47 -1.51 0.00 0.00 177.10 176.58 1oie n ASP 477 N 0.45 -0.37 -4.68 -1.22 8.00 -1.26 -1.78 116.55 115.68 1oie n ASP 477 Ca -0.04 -1.11 -0.42 0.00 0.71 0.00 0.00 54.79 53.92 1oie n ASP 477 Cb 0.52 -2.44 -0.03 0.00 -0.02 0.00 0.00 41.12 39.15 1oie n ASP 477 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1oie s LEU 478 N -7.17 4.35 0.05 0.64 2.96 -1.26 -4.30 118.68 113.96 1oie s LEU 478 Ca 0.15 2.37 0.04 0.00 -0.22 0.00 0.00 54.13 56.47 1oie s LEU 478 Cb -0.08 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 1oie s LEU 478 CO 0.94 -0.87 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.43 1oie s LYS 479 N 3.01 0.79 -0.17 1.98 1.02 -0.05 -3.02 119.74 123.31 1oie s LYS 479 Ca 0.73 -0.83 -0.00 0.00 0.02 0.00 0.00 55.97 55.89 1oie s LYS 479 Cb -0.37 -0.76 0.00 0.00 -0.52 0.00 0.00 37.83 36.19 1oie s LYS 479 CO 0.31 0.17 -0.15 0.42 -0.92 0.00 0.00 175.35 175.19 1oie s ILE 480 N -1.11 2.67 -1.52 2.17 -1.09 0.23 -1.15 121.20 121.40 1oie s ILE 480 Ca -0.02 -0.76 -0.10 0.00 -2.23 0.00 0.00 60.65 57.54 1oie s ILE 480 Cb -0.09 -2.14 0.07 0.00 -1.58 0.00 0.00 42.46 38.73 1oie s ILE 480 CO 0.02 0.51 0.73 0.29 -1.23 0.00 0.00 174.94 175.26 1oie n LYS 481 N 4.22 -4.13 -0.79 2.79 5.02 -0.18 -1.46 118.16 123.64 1oie n LYS 481 Ca -0.19 0.48 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 1oie n LYS 481 Cb 0.51 -5.07 0.00 0.00 -0.02 0.00 0.00 35.03 30.46 1oie n LYS 481 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oie n GLY 482 N -1.67 0.81 3.11 0.72 0.00 -1.26 -5.02 105.19 101.88 1oie n GLY 482 Ca -0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 1oie n GLY 482 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oie s GLU 483 N -0.21 1.38 0.55 1.61 0.41 -0.53 -5.03 118.70 116.89 1oie s GLU 483 Ca 0.00 -0.53 -0.21 0.00 -0.41 0.00 0.00 54.97 53.82 1oie s GLU 483 Cb 0.00 -1.27 -0.05 0.00 -1.78 0.00 0.00 34.13 31.02 1oie s GLU 483 CO 0.00 0.27 1.26 -0.35 -0.49 0.00 0.00 175.26 175.95 1oie n PRO 484 N 2.95 1.50 -2.38 0.39 -0.04 -1.26 -0.60 135.00 135.56 1oie n PRO 484 Ca -0.16 0.55 -0.42 0.00 -0.04 0.00 0.00 63.50 63.43 1oie n PRO 484 Cb 0.54 -2.46 -0.03 0.00 -0.04 0.00 0.00 33.50 31.52 1oie n PRO 484 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1oie s VAL 485 N -1.33 4.12 -0.37 0.52 1.01 -1.17 -4.77 120.40 118.42 1oie s VAL 485 Ca 0.72 1.43 -0.13 0.00 0.00 0.00 0.00 61.98 64.00 1oie s VAL 485 Cb -0.43 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1oie s VAL 485 CO 0.49 -0.04 0.25 -0.62 0.00 0.00 0.00 175.10 175.18 1oie s ASP 486 N 1.79 6.00 0.48 3.32 -1.08 -1.26 -4.93 116.67 120.98 1oie s ASP 486 Ca 0.58 -0.67 0.32 0.00 -0.52 0.00 0.00 52.55 52.26 1oie s ASP 486 Cb -0.26 -2.12 1.73 0.00 -1.46 0.00 0.00 42.92 40.81 1oie s ASP 486 CO 0.21 -0.33 1.97 -0.65 0.52 0.00 0.00 175.17 176.90 1oie h PRO 487 N 8.52 0.00 0.00 4.34 0.11 -1.94 0.16 132.00 143.19 1oie h PRO 487 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1oie h PRO 487 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1oie h PRO 487 CO 0.67 0.00 -0.04 0.00 -0.21 0.00 0.00 178.00 178.42 1oie n ALA 488 N -1.91 2.41 -2.93 -0.75 0.00 -1.26 -3.66 120.51 112.41 1oie n ALA 488 Ca -0.02 -0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.10 1oie n ALA 488 Cb 0.06 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 1oie n ALA 488 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1oie s LYS 489 N -3.02 3.31 -0.15 0.00 1.02 0.54 -4.92 119.74 116.52 1oie s LYS 489 Ca 0.13 -0.82 -0.07 0.00 0.02 0.00 0.00 55.97 55.23 1oie s LYS 489 Cb 0.18 -2.81 -0.04 0.00 -0.52 0.00 0.00 37.83 34.63 1oie s LYS 489 CO 0.56 0.43 0.09 0.99 -0.92 0.00 0.00 175.35 176.50 1oie s THR 490 N -2.00 5.10 0.03 2.17 2.01 -1.26 -0.33 115.64 121.36 1oie s THR 490 Ca 0.34 0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.48 1oie s THR 490 Cb -0.09 -3.26 -0.02 0.00 0.01 0.00 0.00 72.50 69.14 1oie s THR 490 CO 0.28 0.53 -0.22 -0.31 -0.69 0.00 0.00 174.62 174.21 1oie s TYR 491 N -0.28 1.96 -0.20 4.92 2.02 0.16 -4.92 117.35 121.02 1oie s TYR 491 Ca 0.10 -0.38 -0.09 0.00 -0.37 0.00 0.00 57.07 56.33 1oie s TYR 491 Cb -0.12 -1.20 -0.05 0.00 -0.40 0.00 0.00 41.96 40.20 1oie s TYR 491 CO 0.01 0.06 0.10 0.50 -1.57 0.00 0.00 175.55 174.65 1oie s ARG 492 N -0.99 4.07 -0.11 -0.62 3.52 -1.26 -0.54 118.95 123.01 1oie s ARG 492 Ca 0.09 -0.29 -0.00 0.00 -0.13 0.00 0.00 55.73 55.40 1oie s ARG 492 Cb -0.09 -3.33 -0.02 0.00 -1.56 0.00 0.00 34.95 29.95 1oie s ARG 492 CO 0.01 0.26 -0.10 1.41 -0.81 0.00 0.00 175.30 176.07 1oie s MET 493 N 0.44 3.21 0.03 5.12 -2.45 -0.48 -0.08 119.30 125.08 1oie s MET 493 Ca 0.06 -0.63 -0.03 0.00 -1.25 0.00 0.00 55.69 53.83 1oie s MET 493 Cb -0.12 -2.65 -0.04 0.00 1.25 0.00 0.00 34.83 33.27 1oie s MET 493 CO -0.00 0.36 0.23 0.00 1.05 0.00 0.00 175.02 176.66 1oie s ALA 494 N -0.01 3.92 0.00 4.11 0.00 -0.57 -0.99 121.76 128.22 1oie s ALA 494 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.23 1oie s ALA 494 Cb -0.14 -1.95 0.00 0.00 0.00 0.00 0.00 23.12 21.04 1oie s ALA 494 CO 0.04 0.73 0.00 -2.37 0.00 0.00 0.00 175.76 174.16 1oie n THR 495 N 0.76 0.00 -4.36 0.00 5.66 -0.45 -1.95 114.28 113.95 1oie n THR 495 Ca -0.09 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.64 1oie n THR 495 Cb 0.52 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.20 1oie n THR 495 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1oie s LEU 496 N 0.00 2.71 0.32 1.09 1.43 -1.26 -0.94 118.68 122.03 1oie s LEU 496 Ca 0.00 -0.72 0.05 0.00 -1.03 0.00 0.00 54.13 52.42 1oie s LEU 496 Cb 0.00 -1.42 0.68 0.00 0.03 0.00 0.00 46.19 45.48 1oie s LEU 496 CO 0.00 0.11 1.86 -0.55 0.23 0.00 0.00 176.35 178.00 1oie h ASN 497 N 3.02 0.80 -0.22 2.29 -1.07 -1.34 0.57 115.58 119.62 1oie h ASN 497 Ca -0.46 0.04 0.05 0.00 0.07 0.00 0.00 56.30 56.00 1oie h ASN 497 Cb 1.21 -0.12 -0.06 0.00 -2.07 0.00 0.00 38.32 37.28 1oie h ASN 497 CO 0.51 0.42 -0.16 0.15 0.07 0.00 0.00 177.43 178.42 1oie h PHE 498 N 0.85 -0.41 -0.09 4.14 3.57 -1.95 0.52 116.94 123.57 1oie h PHE 498 Ca 0.47 0.03 -0.21 0.00 3.53 0.00 0.00 57.97 61.78 1oie h PHE 498 Cb 0.58 0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.54 1oie h PHE 498 CO -0.00 -0.24 -0.81 -0.91 -2.23 0.00 0.00 178.31 174.12 1oie h ASN 499 N -0.16 0.70 0.19 0.41 4.21 -1.70 0.18 115.58 119.41 1oie h ASN 499 Ca 0.13 -0.48 -0.02 0.00 1.21 0.00 0.00 56.30 57.13 1oie h ASN 499 Cb 0.35 -0.21 -0.00 0.00 -1.12 0.00 0.00 38.32 37.34 1oie h ASN 499 CO -0.31 1.26 -0.11 0.00 -1.29 0.00 0.00 177.43 176.97 1oie h ALA 500 N 0.72 1.57 -0.35 -0.83 0.00 -0.16 -1.99 119.26 118.22 1oie h ALA 500 Ca -0.06 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1oie h ALA 500 Cb 1.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1oie h ALA 500 CO 0.15 0.14 0.00 0.25 0.00 0.00 0.00 179.25 179.79 1oie n THR 501 N -4.06 0.45 0.00 0.00 -2.24 0.10 -0.18 114.28 108.36 1oie n THR 501 Ca -0.02 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1oie n THR 501 Cb 0.20 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1oie n THR 501 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oie n GLY 502 N 1.29 1.10 3.70 3.38 0.00 -0.75 -4.88 105.19 109.05 1oie n GLY 502 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1oie n GLY 502 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oie n GLY 503 N -1.27 0.60 2.41 -0.02 0.00 0.63 -1.65 105.19 105.90 1oie n GLY 503 Ca 0.00 0.27 -0.18 0.00 0.00 0.00 0.00 46.02 46.10 1oie n GLY 503 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oie n ASP 504 N 0.53 -5.20 -0.19 1.61 8.00 -1.26 -2.37 116.55 117.67 1oie n ASP 504 Ca 0.05 0.16 -0.02 0.00 0.71 0.00 0.00 54.79 55.69 1oie n ASP 504 Cb 0.38 -4.43 -0.01 0.00 -0.02 0.00 0.00 41.12 37.04 1oie n ASP 504 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oie n GLY 505 N -0.78 0.46 3.74 0.44 0.00 -0.66 -4.88 105.19 103.50 1oie n GLY 505 Ca -0.21 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1oie n GLY 505 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oie s TYR 506 N -1.68 2.17 0.33 1.61 1.51 -1.00 -4.94 117.35 115.34 1oie s TYR 506 Ca 0.00 1.47 -0.29 0.00 -1.01 0.00 0.00 57.07 57.24 1oie s TYR 506 Cb 0.00 -3.67 -0.11 0.00 -0.11 0.00 0.00 41.96 38.07 1oie s TYR 506 CO 0.00 -2.79 1.48 -2.14 -1.11 0.00 0.00 175.55 170.99 1oie s PRO 507 N -3.30 4.17 0.14 -1.71 0.02 -1.26 -4.10 135.00 128.95 1oie s PRO 507 Ca 0.80 2.48 -0.31 0.00 0.02 0.00 0.00 61.00 63.99 1oie s PRO 507 Cb -0.37 -3.02 -0.09 0.00 0.02 0.00 0.00 34.50 31.04 1oie s PRO 507 CO 0.39 -0.49 1.56 1.03 -0.33 0.00 0.00 177.00 179.17 1oie s ARG 508 N -1.38 4.22 -0.01 5.54 0.52 -1.26 -4.60 118.95 121.99 1oie s ARG 508 Ca 0.56 2.32 0.10 0.00 -0.52 0.00 0.00 55.73 58.19 1oie s ARG 508 Cb -0.45 -3.26 -0.14 0.00 0.52 0.00 0.00 34.95 31.62 1oie s ARG 508 CO 0.55 -0.61 0.31 1.28 0.02 0.00 0.00 175.30 176.85 1oie n LEU 509 N 4.31 0.21 0.17 2.53 4.77 0.75 -4.76 117.00 124.98 1oie n LEU 509 Ca 0.14 -0.22 0.13 0.00 -0.03 0.00 0.00 56.01 56.03 1oie n LEU 509 Cb 0.39 0.00 0.58 0.00 -2.33 0.00 0.00 43.42 42.06 1oie n LEU 509 CO 0.61 0.05 0.88 -2.24 -1.33 0.00 0.00 177.39 175.36 1oie h ASP 510 N 0.00 0.00 -0.05 -1.43 2.03 -1.89 -0.64 116.42 114.45 1oie h ASP 510 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1oie h ASP 510 Cb 0.37 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.87 1oie h ASP 510 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 178.80 1oie n ASN 511 N -2.37 2.52 -4.75 4.15 5.03 -1.26 -4.94 115.26 113.65 1oie n ASN 511 Ca 0.01 -1.84 -0.40 0.00 0.87 0.00 0.00 54.58 53.21 1oie n ASN 511 Cb 0.16 -0.01 -0.05 0.00 -1.02 0.00 0.00 39.78 38.86 1oie n ASN 511 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1oie s LYS 512 N -1.97 4.69 0.01 3.52 2.20 -0.25 -4.96 119.74 122.98 1oie s LYS 512 Ca 0.32 1.69 -0.30 0.00 -0.36 0.00 0.00 55.97 57.32 1oie s LYS 512 Cb 0.20 -3.24 -0.06 0.00 -1.51 0.00 0.00 37.83 33.23 1oie s LYS 512 CO 0.31 0.27 1.47 0.00 -0.36 0.00 0.00 175.35 177.04 1oie n GLY 514 N 3.76 0.59 3.72 0.00 0.00 -1.26 -4.85 105.19 107.16 1oie n GLY 514 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1oie n GLY 514 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1oie s TYR 515 N -2.00 3.61 -0.08 1.61 5.04 -0.89 -2.38 117.35 122.26 1oie s TYR 515 Ca 0.00 1.58 -0.00 0.00 -2.44 0.00 0.00 57.07 56.21 1oie s TYR 515 Cb 0.00 -3.24 0.02 0.00 0.35 0.00 0.00 41.96 39.10 1oie s TYR 515 CO 0.00 -0.50 -0.05 0.08 -1.34 0.00 0.00 175.55 173.74 1oie s VAL 516 N 0.40 0.74 -0.28 3.14 1.01 0.09 -4.98 120.40 120.53 1oie s VAL 516 Ca 0.52 -0.15 -0.25 0.00 0.00 0.00 0.00 61.98 62.10 1oie s VAL 516 Cb -0.27 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.32 1oie s VAL 516 CO 0.31 0.31 0.86 0.21 0.00 0.00 0.00 175.10 176.78 1oie s ASN 517 N 1.51 6.78 0.32 3.32 3.84 -1.26 -1.32 114.94 128.13 1oie s ASN 517 Ca -0.00 0.87 0.23 0.00 0.21 0.00 0.00 52.86 54.17 1oie s ASN 517 Cb -0.13 -2.44 0.17 0.00 -0.55 0.00 0.00 41.25 38.30 1oie s ASN 517 CO -0.04 -0.62 1.33 0.71 -2.79 0.00 0.00 177.10 175.68 1oie h THR 518 N 5.56 0.01 0.00 -5.21 1.35 -1.88 -3.48 112.91 109.26 1oie h THR 518 Ca -0.23 -1.01 0.00 0.00 -0.55 0.00 0.00 66.41 64.62 1oie h THR 518 Cb 1.09 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1oie h THR 518 CO 0.91 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.79 1oie n GLY 519 N 1.14 0.79 3.78 5.82 0.00 -1.26 -5.02 105.19 110.45 1oie n GLY 519 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1oie n GLY 519 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oie s PHE 520 N -3.05 3.67 0.16 1.61 0.08 -1.26 -4.79 117.98 114.41 1oie s PHE 520 Ca 0.00 1.07 -0.27 0.00 0.12 0.00 0.00 56.93 57.85 1oie s PHE 520 Cb 0.00 -2.48 -0.08 0.00 -0.57 0.00 0.00 43.02 39.90 1oie s PHE 520 CO 0.00 0.43 0.84 0.42 -0.10 0.00 0.00 175.22 176.81 1oie s ILE 521 N -0.40 4.35 0.30 0.64 -1.09 -1.26 -0.98 121.20 122.77 1oie s ILE 521 Ca 0.27 1.84 0.03 0.00 -2.23 0.00 0.00 60.65 60.56 1oie s ILE 521 Cb -0.17 -4.21 0.36 0.00 -1.58 0.00 0.00 42.46 36.86 1oie s ILE 521 CO 0.14 0.47 1.61 -2.24 -1.23 0.00 0.00 174.94 173.69 1oie h ASP 522 N 4.61 -0.19 0.30 3.58 3.04 -1.02 -1.33 116.42 125.41 1oie h ASP 522 Ca -0.46 0.24 -0.20 0.00 -3.24 0.00 0.00 57.03 53.37 1oie h ASP 522 Cb 1.20 0.37 -0.00 0.00 -1.04 0.00 0.00 39.33 39.86 1oie h ASP 522 CO 0.68 -0.27 -0.82 0.00 -2.04 0.00 0.00 179.24 176.78 1oie h ALA 523 N 1.89 0.49 -0.48 4.15 0.00 -1.83 -0.94 119.26 122.54 1oie h ALA 523 Ca 0.59 -0.66 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1oie h ALA 523 Cb 1.26 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1oie h ALA 523 CO -0.78 0.79 -0.18 1.49 0.00 0.00 0.00 179.25 180.57 1oie h GLU 524 N 0.25 0.94 -0.48 0.00 4.22 -1.68 -1.16 114.58 116.68 1oie h GLU 524 Ca -0.05 -0.38 -0.12 0.00 0.08 0.00 0.00 59.36 58.89 1oie h GLU 524 Cb 1.43 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 1oie h GLU 524 CO 0.14 1.04 -0.19 0.28 -2.18 0.00 0.00 179.01 178.11 1oie h VAL 525 N 0.83 1.27 -0.31 0.32 2.07 -1.06 -0.26 116.25 119.10 1oie h VAL 525 Ca 0.12 -1.34 -0.10 0.00 0.82 0.00 0.00 66.70 66.20 1oie h VAL 525 Cb 0.74 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1oie h VAL 525 CO 0.06 0.46 -0.18 0.25 0.02 0.00 0.00 177.57 178.18 1oie h LEU 526 N 0.82 0.70 -0.20 2.57 5.85 -1.06 -2.34 115.31 121.64 1oie h LEU 526 Ca 0.11 -0.42 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 1oie h LEU 526 Cb 0.76 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1oie h LEU 526 CO 0.06 0.97 0.11 0.50 -0.34 0.00 0.00 178.44 179.74 1oie h LYS 527 N 0.43 0.28 -0.54 1.25 3.64 -1.10 0.17 116.57 120.69 1oie h LYS 527 Ca 0.07 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 1oie h LYS 527 Cb 0.72 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 1oie h LYS 527 CO 0.05 0.25 0.09 0.00 -2.27 0.00 0.00 179.45 177.57 1oie h ALA 528 N 1.01 1.13 -0.36 5.00 0.00 -1.07 0.17 119.26 125.13 1oie h ALA 528 Ca 0.07 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 1oie h ALA 528 Cb 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1oie h ALA 528 CO -0.01 0.57 -0.25 -0.92 0.00 0.00 0.00 179.25 178.65 1oie h TYR 529 N 0.82 0.95 -0.27 0.00 3.20 -1.20 -2.17 116.97 118.30 1oie h TYR 529 Ca 0.17 -0.26 -0.00 0.00 3.14 0.00 0.00 58.73 61.78 1oie h TYR 529 Cb 0.37 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1oie h TYR 529 CO 0.02 1.02 0.16 0.82 -1.64 0.00 0.00 178.16 178.54 1oie h ILE 530 N 0.60 1.10 -0.69 1.81 2.04 -0.64 -0.14 117.51 121.61 1oie h ILE 530 Ca 0.07 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 1oie h ILE 530 Cb 0.81 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1oie h ILE 530 CO 0.07 0.10 0.40 -0.61 0.00 0.00 0.00 178.15 178.11 1oie h GLN 531 N 0.34 0.94 0.00 2.37 4.15 -0.50 -0.80 115.11 121.60 1oie h GLN 531 Ca 0.10 -0.10 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 1oie h GLN 531 Cb 0.03 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.52 1oie h GLN 531 CO -0.02 0.69 -0.22 1.57 -1.93 0.00 0.00 178.83 178.92 1oie h LYS 532 N 0.94 0.00 0.00 1.69 2.10 -1.26 -3.29 116.57 116.75 1oie h LYS 532 Ca 0.24 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.89 1oie h LYS 532 Cb -0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1oie h LYS 532 CO -0.04 0.16 -0.86 0.43 -2.00 0.00 0.00 179.45 177.13 1oie n SER 533 N -3.12 0.66 -4.77 7.07 7.64 -0.08 -4.96 113.62 116.06 1oie n SER 533 Ca 0.03 -0.02 -0.37 0.00 1.01 0.00 0.00 58.87 59.52 1oie n SER 533 Cb 0.60 0.51 -0.01 0.00 -1.01 0.00 0.00 64.21 64.30 1oie n SER 533 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1oie s SER 534 N -4.16 6.13 0.24 6.43 0.15 -0.34 -4.21 113.70 117.94 1oie s SER 534 Ca 0.04 2.27 -0.30 0.00 0.70 0.00 0.00 55.95 58.67 1oie s SER 534 Cb 0.14 -2.60 -0.09 0.00 -1.71 0.00 0.00 66.02 61.76 1oie s SER 534 CO 0.77 -0.94 1.13 -2.16 1.20 0.00 0.00 173.24 173.24 1oie s PRO 535 N -2.78 4.58 0.07 5.44 0.04 -1.26 -4.99 135.00 136.10 1oie s PRO 535 Ca 0.65 1.83 -0.24 0.00 0.04 0.00 0.00 61.00 63.27 1oie s PRO 535 Cb -0.27 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 30.99 1oie s PRO 535 CO 0.33 0.10 0.74 -0.51 0.04 0.00 0.00 177.00 177.70 1oie s LEU 536 N -0.99 4.48 -0.43 -3.56 1.43 0.62 -5.00 118.68 115.24 1oie s LEU 536 Ca 0.47 1.45 -0.14 0.00 -1.03 0.00 0.00 54.13 54.89 1oie s LEU 536 Cb -0.32 -3.20 0.04 0.00 0.03 0.00 0.00 46.19 42.75 1oie s LEU 536 CO 0.40 0.08 0.31 -0.62 0.23 0.00 0.00 176.35 176.75 1oie s ASP 537 N -0.37 6.03 0.52 2.29 2.15 -1.26 -2.79 116.67 123.24 1oie s ASP 537 Ca 0.37 -1.10 0.30 0.00 0.43 0.00 0.00 52.55 52.55 1oie s ASP 537 Cb -0.21 -2.13 1.31 0.00 -0.30 0.00 0.00 42.92 41.59 1oie s ASP 537 CO 0.23 -0.51 1.98 -0.37 -0.17 0.00 0.00 175.17 176.33 1oie h VAL 538 N 5.74 0.29 -0.74 1.11 -1.51 -1.92 -2.78 116.25 116.44 1oie h VAL 538 Ca -0.27 -0.68 0.16 0.00 -1.23 0.00 0.00 66.70 64.68 1oie h VAL 538 Cb 1.11 1.53 -0.05 0.00 -2.13 0.00 0.00 31.29 31.75 1oie h VAL 538 CO 0.77 0.10 0.50 0.77 -1.23 0.00 0.00 177.57 178.48 1oie h SER 539 N 0.00 0.31 0.52 4.19 4.64 -1.98 0.56 113.55 121.79 1oie h SER 539 Ca -0.00 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1oie h SER 539 Cb 0.52 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1oie h SER 539 CO 0.01 0.16 -0.01 0.58 -0.87 0.00 0.00 176.83 176.70 1oie h VAL 540 N 0.33 0.07 -0.62 0.95 2.07 -1.93 -1.91 116.25 115.20 1oie h VAL 540 Ca 0.36 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1oie h VAL 540 Cb 0.94 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1oie h VAL 540 CO -0.10 0.01 0.00 -1.22 0.02 0.00 0.00 177.57 176.28 1oie n TYR 541 N -3.15 0.83 -2.86 1.57 4.01 0.18 -4.95 117.16 112.79 1oie n TYR 541 Ca -0.01 -0.47 -0.41 0.00 -0.16 0.00 0.00 57.90 56.85 1oie n TYR 541 Cb 0.20 -0.01 -0.04 0.00 -0.31 0.00 0.00 39.34 39.19 1oie n TYR 541 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1oie s GLU 542 N -1.05 4.33 0.50 -0.72 0.41 -0.72 -4.00 118.70 117.45 1oie s GLU 542 Ca 0.43 1.08 -0.23 0.00 -0.41 0.00 0.00 54.97 55.84 1oie s GLU 542 Cb 0.23 -3.56 -0.06 0.00 -1.78 0.00 0.00 34.13 28.96 1oie s GLU 542 CO 0.30 -0.29 1.30 -2.14 -0.49 0.00 0.00 175.26 173.94 1oie s PRO 543 N 2.00 3.45 -0.35 0.39 0.02 -1.26 -4.97 135.00 134.29 1oie s PRO 543 Ca 0.40 2.11 0.12 0.00 0.02 0.00 0.00 61.00 63.65 1oie s PRO 543 Cb -0.17 -2.39 0.45 0.00 0.02 0.00 0.00 34.50 32.42 1oie s PRO 543 CO 0.14 -0.90 1.08 1.63 -0.33 0.00 0.00 177.00 178.62 1oie n LYS 544 N -0.68 2.56 -1.09 5.54 5.02 -1.26 -4.96 118.16 123.28 1oie n LYS 544 Ca 0.08 -3.93 -0.03 0.00 -2.02 0.00 0.00 58.31 52.41 1oie n LYS 544 Cb 0.45 -1.87 -0.01 0.00 -0.02 0.00 0.00 35.03 33.58 1oie n LYS 544 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oie n GLY 545 N -0.43 0.62 0.35 0.72 0.00 -1.26 -4.90 105.19 100.30 1oie n GLY 545 Ca 0.27 -0.71 0.06 0.00 0.00 0.00 0.00 46.02 45.64 1oie n GLY 545 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1oie h GLU 546 N 0.17 0.91 -6.49 1.61 3.07 -1.91 -3.40 114.58 108.54 1oie h GLU 546 Ca -0.06 -0.05 -0.68 0.00 -0.50 0.00 0.00 59.36 58.06 1oie h GLU 546 Cb 0.24 -0.21 -0.21 0.00 -0.84 0.00 0.00 28.75 27.74 1oie h GLU 546 CO 0.09 0.60 -0.78 0.14 -1.40 0.00 0.00 179.01 177.67 1oie s VAL 547 N -5.97 3.00 0.11 3.13 -7.23 -1.26 -1.14 120.40 111.05 1oie s VAL 547 Ca -0.12 -1.06 -0.19 0.00 -1.81 0.00 0.00 61.98 58.79 1oie s VAL 547 Cb 0.22 -2.27 0.05 0.00 0.56 0.00 0.00 36.38 34.93 1oie s VAL 547 CO 0.80 0.36 0.48 -0.94 -0.31 0.00 0.00 175.10 175.50 1oie s SER 548 N -1.40 -0.37 -0.04 4.85 1.04 -0.98 -4.96 113.70 111.84 1oie s SER 548 Ca 0.15 -0.11 0.04 0.00 0.48 0.00 0.00 55.95 56.51 1oie s SER 548 Cb -0.11 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.52 1oie s SER 548 CO 0.06 -0.85 -0.15 0.26 0.98 0.00 0.00 173.24 173.54 1oie s TRP 549 N -3.44 1.51 0.21 5.02 0.51 -1.26 0.02 118.94 121.51 1oie s TRP 549 Ca 0.00 -0.41 0.09 0.00 -2.12 0.00 0.00 56.10 53.66 1oie s TRP 549 Cb 0.00 -1.02 -0.05 0.00 -0.81 0.00 0.00 33.47 31.59 1oie s TRP 549 CO -0.10 -0.14 -0.17 -0.65 -0.51 0.00 0.00 176.95 175.39 1oie s GLN 550 N 0.05 1.40 0.00 4.98 -0.21 -0.14 -4.94 119.66 120.80 1oie s GLN 550 Ca -0.03 -1.59 0.00 0.00 0.02 0.00 0.00 55.36 53.76 1oie s GLN 550 Cb -0.10 -1.32 0.00 0.00 1.00 0.00 0.00 33.01 32.58 1oie s GLN 550 CO 0.02 0.24 0.00 -1.91 -2.12 0.00 0.00 175.29 171.51