#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nso s VAL 2 N 0.00 5.03 -0.14 -0.99 0.11 -1.26 -4.97 120.40 118.19 1nso s VAL 2 Ca 0.00 0.82 -0.12 0.00 -2.93 0.00 0.00 61.98 59.74 1nso s VAL 2 Cb 0.00 -3.71 0.04 0.00 -1.53 0.00 0.00 36.38 31.18 1nso s VAL 2 CO 0.00 0.56 0.36 -1.58 -3.33 0.00 0.00 175.10 171.11 1nso s GLN 3 N -1.13 0.42 0.69 1.54 0.74 -1.24 -5.06 119.66 115.61 1nso s GLN 3 Ca 0.24 0.51 -0.11 0.00 0.05 0.00 0.00 55.36 56.05 1nso s GLN 3 Cb -0.16 0.20 0.00 0.00 1.10 0.00 0.00 33.01 34.15 1nso s GLN 3 CO 0.14 -0.05 1.06 -1.25 -0.55 0.00 0.00 175.29 174.63 1nso s PRO 4 N 0.22 3.02 -0.11 1.67 0.04 -1.26 -3.46 135.00 135.13 1nso s PRO 4 Ca -0.00 0.89 -0.01 0.00 0.04 0.00 0.00 61.00 61.92 1nso s PRO 4 Cb -0.03 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1nso s PRO 4 CO 0.00 -1.02 -0.04 -1.50 0.04 0.00 0.00 177.00 174.48 1nso s ILE 5 N -3.08 3.89 -0.08 0.56 1.10 -1.26 -4.91 121.20 117.42 1nso s ILE 5 Ca 0.58 -0.39 -0.13 0.00 -0.51 0.00 0.00 60.65 60.19 1nso s ILE 5 Cb -0.13 -2.64 -0.05 0.00 0.15 0.00 0.00 42.46 39.78 1nso s ILE 5 CO 0.55 0.56 0.33 0.28 -2.11 0.00 0.00 174.94 174.54 1nso s THR 6 N -0.35 5.21 0.00 4.00 -1.32 -1.26 -4.96 115.64 116.96 1nso s THR 6 Ca 0.06 0.64 0.00 0.00 -1.21 0.00 0.00 61.69 61.18 1nso s THR 6 Cb -0.12 -3.64 0.00 0.00 -1.51 0.00 0.00 72.50 67.23 1nso s THR 6 CO 0.02 0.52 0.00 0.00 -2.21 0.00 0.00 174.62 172.95 1nso n ALA 7 N 2.48 0.00 -2.59 11.08 0.00 -1.26 -4.56 120.51 125.65 1nso n ALA 7 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.89 1nso n ALA 7 Cb 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 1nso n ALA 7 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1nso s GLN 8 N 0.00 3.15 -0.11 0.00 2.00 -1.26 -5.05 119.66 118.39 1nso s GLN 8 Ca 0.00 -0.88 -0.15 0.00 -2.00 0.00 0.00 55.36 52.33 1nso s GLN 8 Cb 0.00 -3.84 0.04 0.00 0.80 0.00 0.00 33.01 30.01 1nso s GLN 8 CO 0.00 -0.61 0.38 0.21 -0.50 0.00 0.00 175.29 174.78 1nso s LYS 9 N 1.66 0.54 0.00 1.67 2.47 -1.26 -5.04 119.74 119.78 1nso s LYS 9 Ca 0.05 0.34 -0.03 0.00 -1.56 0.00 0.00 55.97 54.77 1nso s LYS 9 Cb -0.18 0.26 -0.13 0.00 -1.46 0.00 0.00 37.83 36.31 1nso s LYS 9 CO 0.09 -0.10 2.08 -0.35 0.16 0.00 0.00 175.35 177.23 1nso n PRO 10 N 2.36 1.03 -3.56 4.03 -0.04 -1.21 -3.93 135.00 133.69 1nso n PRO 10 Ca -0.16 -0.48 -0.06 0.00 -0.04 0.00 0.00 63.50 62.76 1nso n PRO 10 Cb 0.57 -1.71 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 1nso n PRO 10 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1nso s SER 11 N 2.40 -0.42 -0.25 3.54 0.15 -1.25 -3.94 113.70 113.92 1nso s SER 11 Ca 0.32 0.95 -0.08 0.00 0.70 0.00 0.00 55.95 57.84 1nso s SER 11 Cb 0.15 1.55 0.11 0.00 -1.71 0.00 0.00 66.02 66.12 1nso s SER 11 CO 0.00 -0.24 0.54 -0.22 1.20 0.00 0.00 173.24 174.51 1nso s LEU 12 N 2.67 -0.92 -0.37 3.45 2.96 -0.76 -4.72 118.68 120.99 1nso s LEU 12 Ca 0.02 1.26 -0.23 0.00 -0.22 0.00 0.00 54.13 54.96 1nso s LEU 12 Cb -0.13 1.84 0.01 0.00 0.50 0.00 0.00 46.19 48.42 1nso s LEU 12 CO -0.15 -0.23 0.76 -0.89 -1.32 0.00 0.00 176.35 174.52 1nso s THR 13 N 2.76 4.75 0.11 3.68 2.01 -1.22 -2.33 115.64 125.40 1nso s THR 13 Ca -0.03 0.81 -0.02 0.00 0.31 0.00 0.00 61.69 62.75 1nso s THR 13 Cb -0.12 -4.20 -0.03 0.00 0.01 0.00 0.00 72.50 68.15 1nso s THR 13 CO -0.16 -0.44 0.07 -0.76 -0.69 0.00 0.00 174.62 172.64 1nso s LEU 14 N 3.06 1.82 0.30 4.42 1.43 0.54 -3.65 118.68 126.61 1nso s LEU 14 Ca 0.30 -1.09 -0.09 0.00 -1.03 0.00 0.00 54.13 52.22 1nso s LEU 14 Cb -0.13 0.43 -0.07 0.00 0.03 0.00 0.00 46.19 46.45 1nso s LEU 14 CO 0.17 -0.72 0.63 -1.66 0.23 0.00 0.00 176.35 175.00 1nso s TRP 15 N -4.00 3.44 -0.02 0.29 1.48 0.33 -0.10 118.94 120.37 1nso s TRP 15 Ca 0.18 0.90 0.00 0.00 -1.06 0.00 0.00 56.10 56.12 1nso s TRP 15 Cb 0.07 -2.30 0.03 0.00 -1.16 0.00 0.00 33.47 30.11 1nso s TRP 15 CO -0.02 0.13 0.02 -1.17 -4.06 0.00 0.00 176.95 171.85 1nso s LEU 16 N -3.28 1.22 -1.00 -4.66 0.20 0.50 -0.75 118.68 110.92 1nso s LEU 16 Ca 0.48 0.02 0.00 0.00 0.69 0.00 0.00 54.13 55.32 1nso s LEU 16 Cb -0.11 -0.09 0.00 0.00 -0.43 0.00 0.00 46.19 45.56 1nso s LEU 16 CO 0.25 -0.10 0.00 -0.67 -0.29 0.00 0.00 176.35 175.54 1nso n ASP 17 N 4.02 -3.72 -0.85 3.68 2.03 -0.96 -0.36 116.55 120.39 1nso n ASP 17 Ca -0.26 0.22 -0.02 0.00 0.52 0.00 0.00 54.79 55.25 1nso n ASP 17 Cb 0.51 -3.18 0.01 0.00 -0.72 0.00 0.00 41.12 37.75 1nso n ASP 17 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1nso n ASP 18 N -1.75 -2.37 -3.28 1.67 2.03 -1.26 -5.05 116.55 106.53 1nso n ASP 18 Ca -0.14 -0.05 -0.05 0.00 0.52 0.00 0.00 54.79 55.07 1nso n ASP 18 Cb 0.60 -0.93 -0.06 0.00 -0.72 0.00 0.00 41.12 40.01 1nso n ASP 18 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1nso s LYS 19 N -5.01 0.42 0.10 -0.67 1.02 0.51 -5.13 119.74 110.99 1nso s LYS 19 Ca 0.05 0.63 -0.33 0.00 0.02 0.00 0.00 55.97 56.35 1nso s LYS 19 Cb -0.02 -0.15 -0.12 0.00 -0.52 0.00 0.00 37.83 37.02 1nso s LYS 19 CO 0.07 -0.68 1.77 -1.33 -0.92 0.00 0.00 175.35 174.25 1nso n MET 20 N 5.38 2.51 -3.55 1.68 2.81 -1.26 -0.37 117.12 124.33 1nso n MET 20 Ca -0.02 0.91 -0.12 0.00 -1.81 0.00 0.00 57.70 56.66 1nso n MET 20 Cb 0.50 -2.76 -0.02 0.00 -0.71 0.00 0.00 33.22 30.23 1nso n MET 20 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1nso n PHE 21 N 5.08 -1.38 -4.33 2.03 7.35 0.86 -4.89 117.46 122.18 1nso n PHE 21 Ca 0.18 -1.92 -0.26 0.00 -0.76 0.00 0.00 57.45 54.70 1nso n PHE 21 Cb 0.33 0.50 -0.13 0.00 0.35 0.00 0.00 39.48 40.53 1nso n PHE 21 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1nso s THR 22 N -2.70 1.94 0.20 -2.13 2.01 -1.26 -0.34 115.64 113.37 1nso s THR 22 Ca 0.23 -1.63 -0.09 0.00 0.31 0.00 0.00 61.69 60.51 1nso s THR 22 Cb -0.01 -1.74 -0.01 0.00 0.01 0.00 0.00 72.50 70.75 1nso s THR 22 CO 0.17 -0.00 0.33 -0.83 -0.69 0.00 0.00 174.62 173.59 1nso s GLY 23 N -1.98 0.69 -0.28 4.40 0.00 -0.98 -4.98 107.32 104.19 1nso s GLY 23 Ca 0.10 -1.04 -0.16 0.00 0.00 0.00 0.00 44.72 43.61 1nso s GLY 23 CO 0.05 -0.87 0.45 1.08 0.00 0.00 0.00 173.10 173.81 1nso s LEU 24 N -3.02 4.11 -0.43 0.66 1.02 -1.26 -1.83 118.68 117.93 1nso s LEU 24 Ca 0.23 0.30 -0.23 0.00 0.02 0.00 0.00 54.13 54.45 1nso s LEU 24 Cb 0.03 -2.53 0.02 0.00 0.02 0.00 0.00 46.19 43.72 1nso s LEU 24 CO 0.06 -0.28 0.79 -0.63 0.02 0.00 0.00 176.35 176.31 1nso s ILE 25 N 2.21 4.67 -0.23 -0.59 -1.09 -1.25 -4.73 121.20 120.19 1nso s ILE 25 Ca 0.18 0.54 -0.06 0.00 -2.23 0.00 0.00 60.65 59.08 1nso s ILE 25 Cb -0.16 -4.30 -0.02 0.00 -1.58 0.00 0.00 42.46 36.40 1nso s ILE 25 CO 0.10 -0.65 0.03 0.54 -1.23 0.00 0.00 174.94 173.73 1nso s ASN 26 N 2.07 4.90 0.00 3.58 2.20 -1.26 -3.29 114.94 123.14 1nso s ASN 26 Ca 0.30 -0.23 0.09 0.00 -0.94 0.00 0.00 52.86 52.09 1nso s ASN 26 Cb -0.12 -1.86 0.54 0.00 -2.00 0.00 0.00 41.25 37.81 1nso s ASN 26 CO 0.21 0.01 1.20 1.07 -2.94 0.00 0.00 177.10 176.65 1nso n THR 27 N 4.63 0.00 -2.93 0.54 5.66 -1.26 -3.61 114.28 117.31 1nso n THR 27 Ca -0.17 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.69 1nso n THR 27 Cb 0.51 -0.26 -0.00 0.00 -1.55 0.00 0.00 70.33 69.03 1nso n THR 27 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1nso n GLY 28 N 0.43 2.83 3.87 1.09 0.00 -1.26 -5.10 105.19 107.04 1nso n GLY 28 Ca 0.07 -1.58 -0.31 0.00 0.00 0.00 0.00 46.02 44.20 1nso n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nso s ALA 29 N -2.81 3.21 0.00 4.61 0.00 -1.24 -4.99 121.76 120.55 1nso s ALA 29 Ca 0.35 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.21 1nso s ALA 29 Cb 0.40 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 20.61 1nso s ALA 29 CO -0.03 -0.28 0.00 -3.47 0.00 0.00 0.00 175.76 171.98 1nso n ASP 30 N -1.83 1.04 -3.57 0.00 2.03 -1.26 -4.17 116.55 108.79 1nso n ASP 30 Ca 0.04 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.22 1nso n ASP 30 Cb 0.54 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.82 1nso n ASP 30 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1nso s VAL 31 N -1.62 -0.46 -0.13 5.18 0.11 -1.26 -4.72 120.40 117.50 1nso s VAL 31 Ca 0.00 0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 58.88 1nso s VAL 31 Cb 0.00 -0.59 -0.05 0.00 -1.53 0.00 0.00 36.38 34.21 1nso s VAL 31 CO 0.00 0.00 1.81 0.28 -3.33 0.00 0.00 175.10 173.86 1nso s THR 32 N 2.45 3.40 -0.11 5.04 -1.32 -1.22 -4.52 115.64 119.36 1nso s THR 32 Ca 0.04 0.46 -0.01 0.00 -1.21 0.00 0.00 61.69 60.98 1nso s THR 32 Cb -0.13 -3.39 0.03 0.00 -1.51 0.00 0.00 72.50 67.50 1nso s THR 32 CO -0.11 -0.14 -0.06 -0.63 -2.21 0.00 0.00 174.62 171.47 1nso s ILE 33 N 5.38 0.89 -0.18 5.08 -1.09 0.75 -2.41 121.20 129.62 1nso s ILE 33 Ca 0.81 -0.21 -0.01 0.00 -2.23 0.00 0.00 60.65 59.01 1nso s ILE 33 Cb -0.32 -0.95 0.00 0.00 -1.58 0.00 0.00 42.46 39.62 1nso s ILE 33 CO 0.33 0.34 -0.14 -0.51 -1.23 0.00 0.00 174.94 173.73 1nso s ILE 34 N 1.76 2.69 0.99 2.92 1.10 -0.59 -0.26 121.20 129.81 1nso s ILE 34 Ca 0.05 -0.74 -0.12 0.00 -0.51 0.00 0.00 60.65 59.32 1nso s ILE 34 Cb -0.13 -2.16 0.14 0.00 0.15 0.00 0.00 42.46 40.46 1nso s ILE 34 CO -0.08 0.50 0.79 2.29 -2.11 0.00 0.00 174.94 176.33 1nso n LYS 35 N 4.40 -0.87 0.22 3.50 0.00 -1.26 -3.36 118.16 120.79 1nso n LYS 35 Ca -0.19 -0.21 0.07 0.00 -0.00 0.00 0.00 58.31 57.98 1nso n LYS 35 Cb 0.51 -2.12 0.53 0.00 -0.00 0.00 0.00 35.03 33.95 1nso n LYS 35 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1nso h LEU 36 N -1.96 0.00 -2.64 -5.58 6.46 -1.01 -2.19 115.31 108.39 1nso h LEU 36 Ca -0.47 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.28 1nso h LEU 36 Cb 1.29 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.22 1nso h LEU 36 CO 0.40 0.23 -0.01 -0.33 -0.62 0.00 0.00 178.44 178.11 1nso h GLU 37 N 0.00 0.00 -0.46 1.25 5.08 -1.90 -0.72 114.58 117.83 1nso h GLU 37 Ca -0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 1nso h GLU 37 Cb 0.47 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.65 1nso h GLU 37 CO 0.03 0.01 0.08 -0.25 -1.00 0.00 0.00 179.01 177.88 1nso n ASP 38 N -3.39 3.87 -4.92 1.42 9.92 -0.82 -4.99 116.55 117.64 1nso n ASP 38 Ca -0.03 -3.28 -0.30 0.00 -0.53 0.00 0.00 54.79 50.65 1nso n ASP 38 Cb 0.10 -0.64 -0.04 0.00 -0.64 0.00 0.00 41.12 39.90 1nso n ASP 38 CO 0.00 0.00 0.00 0.86 0.13 0.00 0.00 177.20 178.19 1nso s TRP 39 N -3.00 3.50 -0.30 1.24 -0.00 -0.28 -4.95 118.94 115.15 1nso s TRP 39 Ca 0.47 0.22 -0.31 0.00 -0.00 0.00 0.00 56.10 56.48 1nso s TRP 39 Cb 0.39 -1.73 -0.08 0.00 -0.00 0.00 0.00 33.47 32.05 1nso s TRP 39 CO 0.08 0.57 2.23 -2.30 -0.00 0.00 0.00 176.95 177.54 1nso n PRO 40 N 0.14 1.53 0.00 5.86 -0.02 -1.26 -4.82 135.00 136.43 1nso n PRO 40 Ca -0.06 0.39 0.09 0.00 -2.02 0.00 0.00 63.50 61.90 1nso n PRO 40 Cb 0.52 -2.93 0.43 0.00 -0.02 0.00 0.00 33.50 31.50 1nso n PRO 40 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1nso n PRO 41 N 8.56 0.21 -0.29 0.52 -0.04 -1.26 -3.12 135.00 139.58 1nso n PRO 41 Ca 0.35 0.13 -0.06 0.00 -0.04 0.00 0.00 63.50 63.89 1nso n PRO 41 Cb 0.36 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.39 1nso n PRO 41 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1nso h ASN 42 N 0.00 1.10 -4.14 3.54 -1.24 -2.05 -3.44 115.58 109.35 1nso h ASN 42 Ca 0.00 -0.17 -0.42 0.00 0.71 0.00 0.00 56.30 56.42 1nso h ASN 42 Cb 0.18 -0.29 -0.19 0.00 0.73 0.00 0.00 38.32 38.76 1nso h ASN 42 CO 0.00 0.98 -0.76 -1.66 -1.29 0.00 0.00 177.43 174.69 1nso s TRP 43 N -5.55 1.37 0.62 0.67 -2.14 -1.18 -5.15 118.94 107.58 1nso s TRP 43 Ca -0.12 -0.54 -0.13 0.00 2.66 0.00 0.00 56.10 57.97 1nso s TRP 43 Cb 0.16 -0.73 -0.03 0.00 -3.10 0.00 0.00 33.47 29.77 1nso s TRP 43 CO 0.84 0.12 1.04 -2.14 -2.66 0.00 0.00 176.95 174.16 1nso s PRO 44 N -2.48 3.33 0.37 3.25 0.02 -1.26 -4.85 135.00 133.38 1nso s PRO 44 Ca 0.07 1.00 0.05 0.00 0.02 0.00 0.00 61.00 62.13 1nso s PRO 44 Cb -0.06 -2.04 -0.03 0.00 0.02 0.00 0.00 34.50 32.39 1nso s PRO 44 CO 0.03 -0.79 0.18 0.96 -0.33 0.00 0.00 177.00 177.05 1nso s ILE 45 N -2.82 0.36 0.67 2.83 -5.25 -1.26 -5.12 121.20 110.61 1nso s ILE 45 Ca 0.59 -2.00 0.03 0.00 -0.99 0.00 0.00 60.65 58.29 1nso s ILE 45 Cb -0.13 -2.41 0.13 0.00 2.95 0.00 0.00 42.46 43.00 1nso s ILE 45 CO 0.45 0.00 0.92 0.35 -1.79 0.00 0.00 174.94 174.88 1nso n THR 46 N -0.78 0.00 -3.70 8.37 -2.24 -1.25 -4.94 114.28 109.74 1nso n THR 46 Ca -0.01 -1.69 -0.15 0.00 -2.27 0.00 0.00 64.05 59.92 1nso n THR 46 Cb 0.64 -0.76 -0.15 0.00 -2.10 0.00 0.00 70.33 67.96 1nso n THR 46 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nso s ASP 47 N -4.88 0.33 -0.41 3.42 2.15 0.64 -2.97 116.67 114.95 1nso s ASP 47 Ca 0.64 0.33 -0.29 0.00 0.43 0.00 0.00 52.55 53.67 1nso s ASP 47 Cb -0.04 0.26 0.01 0.00 -0.30 0.00 0.00 42.92 42.85 1nso s ASP 47 CO 0.42 -0.20 1.34 0.28 -0.17 0.00 0.00 175.17 176.84 1nso s THR 48 N 1.78 3.99 0.34 1.71 -1.32 -1.19 0.17 115.64 121.13 1nso s THR 48 Ca -0.03 1.02 0.03 0.00 -1.21 0.00 0.00 61.69 61.51 1nso s THR 48 Cb -0.12 -4.28 -0.05 0.00 -1.51 0.00 0.00 72.50 66.54 1nso s THR 48 CO -0.06 -0.78 0.07 -0.22 -2.21 0.00 0.00 174.62 171.42 1nso s LEU 49 N 5.12 2.10 -0.11 9.08 0.20 0.20 -4.75 118.68 130.52 1nso s LEU 49 Ca 0.58 -1.45 0.00 0.00 0.69 0.00 0.00 54.13 53.95 1nso s LEU 49 Cb -0.13 -0.30 -0.02 0.00 -0.43 0.00 0.00 46.19 45.31 1nso s LEU 49 CO 0.31 -0.69 -0.11 -0.89 -0.29 0.00 0.00 176.35 174.68 1nso s THR 50 N -3.31 3.23 -0.54 3.68 2.01 -1.26 -0.11 115.64 119.35 1nso s THR 50 Ca 0.33 -0.61 0.04 0.00 0.31 0.00 0.00 61.69 61.76 1nso s THR 50 Cb 0.07 -2.35 0.17 0.00 0.01 0.00 0.00 72.50 70.40 1nso s THR 50 CO 0.15 0.54 0.40 0.21 -0.69 0.00 0.00 174.62 175.22 1nso s ASN 51 N 0.03 3.02 -0.40 3.53 2.47 -0.78 -4.48 114.94 118.33 1nso s ASN 51 Ca -0.04 -3.36 -0.22 0.00 0.42 0.00 0.00 52.86 49.66 1nso s ASN 51 Cb -0.14 -0.98 0.02 0.00 -1.45 0.00 0.00 41.25 38.70 1nso s ASN 51 CO 0.04 -0.14 0.75 -0.76 -3.72 0.00 0.00 177.10 173.26 1nso s LEU 52 N -0.54 4.22 -0.01 3.21 2.01 -1.18 -1.22 118.68 125.17 1nso s LEU 52 Ca 0.28 0.10 0.02 0.00 0.01 0.00 0.00 54.13 54.54 1nso s LEU 52 Cb -0.02 -2.94 0.08 0.00 0.01 0.00 0.00 46.19 43.32 1nso s LEU 52 CO -0.17 -0.78 0.96 0.54 1.01 0.00 0.00 176.35 177.91 1nso n ARG 53 N 6.45 1.25 0.00 1.70 5.12 -1.03 -4.88 116.66 125.27 1nso n ARG 53 Ca 0.02 -0.31 0.00 0.00 -1.93 0.00 0.00 57.85 55.63 1nso n ARG 53 Cb 0.48 -1.19 0.00 0.00 -1.16 0.00 0.00 32.46 30.59 1nso n ARG 53 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1nso n GLY 54 N 0.50 0.99 0.00 -0.13 0.00 -1.26 -2.81 105.19 102.49 1nso n GLY 54 Ca 0.03 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.11 1nso n GLY 54 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1nso n ILE 55 N 0.00 0.00 -2.98 -0.61 -5.35 -1.26 -4.62 119.36 104.54 1nso n ILE 55 Ca 0.00 -0.28 -0.30 0.00 -0.27 0.00 0.00 62.75 61.90 1nso n ILE 55 Cb 0.00 0.43 -0.04 0.00 -1.74 0.00 0.00 39.64 38.30 1nso n ILE 55 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nso n GLY 56 N 1.59 5.54 3.51 3.28 0.00 -1.12 -5.03 105.19 112.96 1nso n GLY 56 Ca -0.01 -2.75 -0.25 0.00 0.00 0.00 0.00 46.02 43.01 1nso n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nso n GLN 57 N 0.05 0.15 -4.31 1.61 0.00 -1.26 -2.46 117.38 111.15 1nso n GLN 57 Ca 0.33 -0.14 -0.24 0.00 0.00 0.00 0.00 57.00 56.95 1nso n GLN 57 Cb 0.37 -1.66 -0.08 0.00 0.00 0.00 0.00 30.24 28.87 1nso n GLN 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1nso s SER 58 N 4.17 4.29 -0.11 2.61 0.15 -0.36 -4.91 113.70 119.55 1nso s SER 58 Ca 1.25 -0.84 0.01 0.00 0.70 0.00 0.00 55.95 57.07 1nso s SER 58 Cb -0.78 -0.64 0.02 0.00 -1.71 0.00 0.00 66.02 62.91 1nso s SER 58 CO 0.46 -0.12 -0.14 0.20 1.20 0.00 0.00 173.24 174.84 1nso s ASN 59 N -3.69 2.38 1.18 5.45 -0.87 -1.25 -1.86 114.94 116.29 1nso s ASN 59 Ca 0.33 -0.41 -0.19 0.00 -1.57 0.00 0.00 52.86 51.02 1nso s ASN 59 Cb -0.03 -1.05 0.28 0.00 -0.02 0.00 0.00 41.25 40.42 1nso s ASN 59 CO 0.19 -0.01 1.15 0.20 -2.57 0.00 0.00 177.10 176.07 1nso s ASN 60 N 1.09 1.18 0.32 -1.22 -0.87 0.84 -4.69 114.94 111.59 1nso s ASN 60 Ca -0.05 0.51 -0.01 0.00 -1.57 0.00 0.00 52.86 51.75 1nso s ASN 60 Cb -0.14 -0.68 -0.01 0.00 -0.02 0.00 0.00 41.25 40.40 1nso s ASN 60 CO -0.03 -3.95 -0.05 -2.65 -2.57 0.00 0.00 177.10 167.85 1nso n PRO 61 N -4.63 0.00 -4.34 -0.60 -0.02 -1.22 -3.06 135.00 121.13 1nso n PRO 61 Ca 0.14 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.44 1nso n PRO 61 Cb 0.60 -0.62 -0.15 0.00 -0.02 0.00 0.00 33.50 33.31 1nso n PRO 61 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1nso s LYS 62 N -1.23 0.73 0.59 -0.52 1.02 0.46 0.61 119.74 121.40 1nso s LYS 62 Ca 0.01 -0.29 -0.14 0.00 0.02 0.00 0.00 55.97 55.57 1nso s LYS 62 Cb 0.00 -0.70 -0.04 0.00 -0.52 0.00 0.00 37.83 36.57 1nso s LYS 62 CO 0.02 0.16 1.03 -0.65 -0.92 0.00 0.00 175.35 174.99 1nso s GLN 63 N -0.11 3.54 0.49 1.68 -1.52 -1.26 0.23 119.66 122.72 1nso s GLN 63 Ca 0.02 0.94 -0.19 0.00 -1.95 0.00 0.00 55.36 54.18 1nso s GLN 63 Cb -0.04 -2.07 -0.15 0.00 -0.22 0.00 0.00 33.01 30.53 1nso s GLN 63 CO -0.00 -0.61 -0.03 0.45 -0.25 0.00 0.00 175.29 174.85 1nso n SER 64 N -2.31 -3.28 -0.00 5.90 2.88 -0.57 -4.49 113.62 111.75 1nso n SER 64 Ca 0.07 0.69 0.02 0.00 -1.33 0.00 0.00 58.87 58.32 1nso n SER 64 Cb 0.54 -0.88 -0.03 0.00 -0.75 0.00 0.00 64.21 63.09 1nso n SER 64 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1nso n SER 65 N 2.30 3.78 0.00 -3.46 3.41 -1.25 -0.94 113.62 117.45 1nso n SER 65 Ca 0.09 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1nso n SER 65 Cb 0.46 1.14 0.00 0.00 -0.26 0.00 0.00 64.21 65.55 1nso n SER 65 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1nso n LYS 66 N -1.56 0.00 -1.65 4.33 0.00 -1.26 -2.91 118.16 115.10 1nso n LYS 66 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 58.31 57.89 1nso n LYS 66 Cb 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.09 1nso n LYS 66 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1nso s TYR 67 N 0.00 1.23 -0.54 5.64 1.51 -1.26 -4.05 117.35 119.88 1nso s TYR 67 Ca 0.00 0.77 -0.28 0.00 -1.01 0.00 0.00 57.07 56.55 1nso s TYR 67 Cb 0.00 -3.88 0.02 0.00 -0.11 0.00 0.00 41.96 37.99 1nso s TYR 67 CO 0.00 -3.60 1.34 -1.17 -1.11 0.00 0.00 175.55 171.02 1nso s LEU 68 N 8.99 3.45 -0.60 -1.29 2.96 0.11 -4.81 118.68 127.49 1nso s LEU 68 Ca 0.97 0.33 -0.19 0.00 -0.22 0.00 0.00 54.13 55.02 1nso s LEU 68 Cb -0.28 -3.18 0.11 0.00 0.50 0.00 0.00 46.19 43.34 1nso s LEU 68 CO 0.33 -1.59 0.69 0.42 -1.32 0.00 0.00 176.35 174.88 1nso s THR 69 N 5.61 4.87 -0.28 3.68 -4.23 -1.26 -2.42 115.64 121.61 1nso s THR 69 Ca 0.51 -1.08 -0.06 0.00 -1.18 0.00 0.00 61.69 59.87 1nso s THR 69 Cb -0.10 -4.48 0.00 0.00 1.34 0.00 0.00 72.50 69.26 1nso s THR 69 CO 0.27 -1.11 0.06 0.86 -0.54 0.00 0.00 174.62 174.16 1nso s TRP 70 N 2.54 3.12 0.03 3.99 -0.00 0.53 -2.28 118.94 126.87 1nso s TRP 70 Ca 0.11 -0.93 0.00 0.00 -0.00 0.00 0.00 56.10 55.28 1nso s TRP 70 Cb -0.24 -2.23 -0.02 0.00 -0.00 0.00 0.00 33.47 30.97 1nso s TRP 70 CO 0.05 -0.56 -0.04 1.03 -0.00 0.00 0.00 176.95 177.44 1nso s ARG 71 N 1.50 0.42 0.70 5.86 0.52 0.07 -0.21 118.95 127.82 1nso s ARG 71 Ca 0.03 -0.75 -0.11 0.00 -0.52 0.00 0.00 55.73 54.38 1nso s ARG 71 Cb -0.17 0.02 0.01 0.00 0.52 0.00 0.00 34.95 35.34 1nso s ARG 71 CO 0.02 -0.04 1.08 -0.51 0.02 0.00 0.00 175.30 175.88 1nso s ASP 72 N -1.74 5.46 0.59 0.23 1.01 0.07 -0.51 116.67 121.77 1nso s ASP 72 Ca -0.11 1.24 0.34 0.00 0.71 0.00 0.00 52.55 54.73 1nso s ASP 72 Cb -0.07 -2.08 1.22 0.00 1.01 0.00 0.00 42.92 43.00 1nso s ASP 72 CO -0.02 -1.35 1.46 0.07 0.21 0.00 0.00 175.17 175.54 1nso h LYS 73 N -0.66 0.00 0.00 8.23 5.09 -1.87 1.98 116.57 129.35 1nso h LYS 73 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.29 1nso h LYS 73 Cb 1.24 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.57 1nso h LYS 73 CO 0.62 0.00 0.00 -1.91 -2.09 0.00 0.00 179.45 176.07 1nso n GLU 74 N -3.52 0.77 -2.89 0.07 4.07 -1.26 -4.84 120.64 113.03 1nso n GLU 74 Ca 0.28 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 57.27 1nso n GLU 74 Cb 1.57 -1.21 0.04 0.00 -0.06 0.00 0.00 31.44 31.78 1nso n GLU 74 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1nso n ASN 75 N -0.71 -3.20 -3.64 4.31 5.15 0.67 -5.04 115.26 112.80 1nso n ASN 75 Ca 0.08 -0.28 -0.04 0.00 -0.60 0.00 0.00 54.58 53.73 1nso n ASN 75 Cb 0.04 -2.76 -0.06 0.00 -0.53 0.00 0.00 39.78 36.47 1nso n ASN 75 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1nso s ASN 76 N -3.39 -0.14 0.00 1.20 6.03 -1.09 -4.88 114.94 112.68 1nso s ASN 76 Ca 0.16 0.22 0.00 0.00 -1.03 0.00 0.00 52.86 52.21 1nso s ASN 76 Cb -0.07 0.21 0.00 0.00 -3.03 0.00 0.00 41.25 38.36 1nso s ASN 76 CO 0.36 -0.08 0.00 -0.24 -2.03 0.00 0.00 177.10 175.11 1nso n SER 77 N 1.23 0.00 0.00 3.54 2.88 -1.25 -0.75 113.62 119.26 1nso n SER 77 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1nso n SER 77 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1nso n SER 77 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1nso n GLY 78 N 0.00 2.74 3.48 0.46 0.00 0.71 -1.30 105.19 111.28 1nso n GLY 78 Ca 0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 1nso n GLY 78 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1nso s LEU 79 N 0.00 -0.74 0.38 0.99 0.05 -1.26 -0.35 118.68 117.75 1nso s LEU 79 Ca 0.00 1.28 -0.15 0.00 0.05 0.00 0.00 54.13 55.31 1nso s LEU 79 Cb 0.00 1.92 0.05 0.00 -2.05 0.00 0.00 46.19 46.11 1nso s LEU 79 CO 0.00 -0.22 0.76 0.27 -0.55 0.00 0.00 176.35 176.61 1nso s ILE 80 N 2.08 0.00 -0.46 1.48 -4.36 -1.01 -4.95 121.20 113.98 1nso s ILE 80 Ca -0.07 -1.05 -0.21 0.00 -0.26 0.00 0.00 60.65 59.05 1nso s ILE 80 Cb -0.09 -2.82 0.03 0.00 1.25 0.00 0.00 42.46 40.83 1nso s ILE 80 CO -0.17 0.00 0.70 -1.59 0.24 0.00 0.00 174.94 174.12 1nso s LYS 81 N -2.45 3.30 0.46 0.37 -2.85 -1.26 0.07 119.74 117.39 1nso s LYS 81 Ca 0.16 -0.35 0.04 0.00 -1.00 0.00 0.00 55.97 54.82 1nso s LYS 81 Cb -0.05 -3.97 0.08 0.00 -2.06 0.00 0.00 37.83 31.84 1nso s LYS 81 CO 0.12 -1.10 0.64 -0.35 0.10 0.00 0.00 175.35 174.76 1nso n PRO 82 N 6.46 0.45 -3.91 1.78 -0.04 -1.15 -4.98 135.00 133.61 1nso n PRO 82 Ca -0.01 -2.13 -0.35 0.00 -0.04 0.00 0.00 63.50 60.97 1nso n PRO 82 Cb 0.48 -0.30 -0.13 0.00 -0.04 0.00 0.00 33.50 33.50 1nso n PRO 82 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1nso s PHE 83 N -1.84 3.01 -0.27 0.54 0.08 -1.01 -3.93 117.98 114.55 1nso s PHE 83 Ca 0.46 -0.68 -0.02 0.00 0.12 0.00 0.00 56.93 56.80 1nso s PHE 83 Cb -0.03 -2.13 0.04 0.00 -0.57 0.00 0.00 43.02 40.32 1nso s PHE 83 CO 0.30 -0.42 -0.02 0.08 -0.10 0.00 0.00 175.22 175.05 1nso s VAL 84 N 1.40 3.00 0.11 -0.44 1.01 -0.12 -1.55 120.40 123.82 1nso s VAL 84 Ca 0.05 -1.16 0.09 0.00 0.00 0.00 0.00 61.98 60.96 1nso s VAL 84 Cb -0.15 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1nso s VAL 84 CO -0.00 0.05 -0.24 0.27 0.00 0.00 0.00 175.10 175.19 1nso s ILE 85 N 1.31 1.96 -0.11 2.22 -0.00 -1.24 -1.51 121.20 123.82 1nso s ILE 85 Ca -0.02 -1.64 -0.02 0.00 -0.00 0.00 0.00 60.65 58.97 1nso s ILE 85 Cb -0.18 -1.76 -0.02 0.00 -0.00 0.00 0.00 42.46 40.50 1nso s ILE 85 CO -0.02 0.01 2.50 -0.81 -0.00 0.00 0.00 174.94 176.62 1nso n PRO 86 N 1.01 1.57 0.00 0.37 -0.04 -1.26 -0.44 135.00 136.20 1nso n PRO 86 Ca -0.19 -0.83 0.00 0.00 -0.04 0.00 0.00 63.50 62.45 1nso n PRO 86 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1nso n PRO 86 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1nso n ASN 87 N 1.45 0.57 -2.29 3.54 2.85 -1.26 -4.94 115.26 115.18 1nso n ASN 87 Ca 0.22 -0.89 -0.04 0.00 -0.11 0.00 0.00 54.58 53.76 1nso n ASN 87 Cb 0.63 0.11 0.01 0.00 1.24 0.00 0.00 39.78 41.77 1nso n ASN 87 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 1nso n LEU 88 N -0.11 -5.54 -0.59 1.20 -0.00 -1.24 -4.87 117.00 105.86 1nso n LEU 88 Ca 0.00 0.39 0.00 0.00 -0.00 0.00 0.00 56.01 56.40 1nso n LEU 88 Cb 0.07 -2.42 0.00 0.00 -0.00 0.00 0.00 43.42 41.07 1nso n LEU 88 CO 0.00 -1.47 0.27 -2.65 -0.00 0.00 0.00 177.39 173.54 1nso n PRO 89 N -0.28 0.91 -0.97 1.96 -0.02 -1.26 -4.75 135.00 130.59 1nso n PRO 89 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1nso n PRO 89 Cb 0.24 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1nso n PRO 89 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1nso n VAL 90 N 0.13 0.00 -3.31 -1.45 0.31 -1.26 -4.12 118.33 108.63 1nso n VAL 90 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 1nso n VAL 90 Cb 0.27 -0.05 0.02 0.00 -0.91 0.00 0.00 33.84 33.17 1nso n VAL 90 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1nso n ASN 91 N -0.01 -6.72 -4.94 4.52 2.85 -1.24 -5.00 115.26 104.72 1nso n ASN 91 Ca 0.00 -0.50 -0.25 0.00 -0.11 0.00 0.00 54.58 53.73 1nso n ASN 91 Cb 0.01 -4.44 -0.02 0.00 1.24 0.00 0.00 39.78 36.57 1nso n ASN 91 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1nso s LEU 92 N -4.86 4.06 0.45 1.20 2.01 0.64 -4.79 118.68 117.39 1nso s LEU 92 Ca 0.18 0.45 0.06 0.00 0.01 0.00 0.00 54.13 54.83 1nso s LEU 92 Cb -0.04 -3.29 -0.04 0.00 0.01 0.00 0.00 46.19 42.83 1nso s LEU 92 CO 0.79 -0.24 0.16 0.86 1.01 0.00 0.00 176.35 178.93 1nso s TRP 93 N -2.22 2.33 -0.16 0.29 -0.11 -1.26 -0.18 118.94 117.63 1nso s TRP 93 Ca 0.40 -0.70 -0.08 0.00 1.22 0.00 0.00 56.10 56.94 1nso s TRP 93 Cb -0.10 -1.88 -0.04 0.00 -1.50 0.00 0.00 33.47 29.95 1nso s TRP 93 CO 0.34 0.12 0.12 0.20 -4.62 0.00 0.00 176.95 173.11 1nso s GLY 94 N -3.93 2.07 0.60 5.86 0.00 -1.26 -3.46 107.32 107.19 1nso s GLY 94 Ca 0.33 -0.68 0.28 0.00 0.00 0.00 0.00 44.72 44.66 1nso s GLY 94 CO 0.19 -0.14 1.73 0.07 0.00 0.00 0.00 173.10 174.95 1nso h ARG 95 N 5.85 0.00 -0.57 2.90 0.11 -1.85 0.28 114.38 121.10 1nso h ARG 95 Ca -0.47 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.54 1nso h ARG 95 Cb 1.19 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.25 1nso h ARG 95 CO 0.66 0.00 0.07 -0.44 0.10 0.00 0.00 179.97 180.37 1nso h ASP 96 N 0.00 0.93 1.44 0.08 5.19 -1.93 0.19 116.42 122.32 1nso h ASP 96 Ca 0.28 -0.27 -0.11 0.00 -0.62 0.00 0.00 57.03 56.31 1nso h ASP 96 Cb 1.64 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 40.88 1nso h ASP 96 CO -0.00 0.96 -0.53 -0.07 -3.12 0.00 0.00 179.24 176.48 1nso h LEU 97 N 0.85 0.00 0.06 1.55 4.07 -0.78 -2.77 115.31 118.30 1nso h LEU 97 Ca 0.17 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.95 1nso h LEU 97 Cb 0.44 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.20 1nso h LEU 97 CO 0.01 0.53 -0.75 -0.07 -1.08 0.00 0.00 178.44 177.09 1nso h LEU 98 N 0.00 0.55 -0.38 1.67 -0.00 -1.18 0.28 115.31 116.25 1nso h LEU 98 Ca -0.01 -0.84 0.03 0.00 -0.00 0.00 0.00 57.88 57.06 1nso h LEU 98 Cb 1.40 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 41.85 1nso h LEU 98 CO 0.07 1.33 0.19 0.28 -0.00 0.00 0.00 178.44 180.31 1nso h SER 99 N -0.16 0.28 -0.24 -0.43 0.02 -0.70 -2.42 113.55 109.91 1nso h SER 99 Ca -0.11 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.76 1nso h SER 99 Cb 1.50 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 64.00 1nso h SER 99 CO 0.14 0.21 -0.23 1.56 -1.14 0.00 0.00 176.83 177.37 1nso h GLN 100 N 0.39 0.57 -0.55 3.45 4.20 -1.55 0.19 115.11 121.81 1nso h GLN 100 Ca 0.16 -0.30 0.05 0.00 0.06 0.00 0.00 58.65 58.62 1nso h GLN 100 Cb 0.06 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.79 1nso h GLN 100 CO -0.11 0.89 -0.32 -0.12 -0.67 0.00 0.00 178.83 178.50 1nso n MET 101 N -4.38 -0.24 -1.09 1.46 1.56 0.97 -4.53 117.12 110.87 1nso n MET 101 Ca -0.05 1.15 -0.01 0.00 -0.27 0.00 0.00 57.70 58.53 1nso n MET 101 Cb 0.43 -1.70 0.00 0.00 2.15 0.00 0.00 33.22 34.10 1nso n MET 101 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1nso n LYS 102 N -4.27 0.08 0.00 2.12 4.81 -1.06 -4.85 118.16 114.99 1nso n LYS 102 Ca 0.01 -0.13 -0.00 0.00 -0.87 0.00 0.00 58.31 57.32 1nso n LYS 102 Cb 0.14 0.28 -0.00 0.00 0.02 0.00 0.00 35.03 35.47 1nso n LYS 102 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1nso n ILE 103 N -0.09 0.19 -2.11 3.15 2.08 -0.93 -5.03 119.36 116.63 1nso n ILE 103 Ca -0.03 0.17 -0.41 0.00 0.56 0.00 0.00 62.75 63.04 1nso n ILE 103 Cb 0.42 -1.23 -0.02 0.00 -0.75 0.00 0.00 39.64 38.06 1nso n ILE 103 CO 0.00 0.00 0.00 -0.32 0.56 0.00 0.00 176.55 176.79 1nso s MET 104 N -1.18 4.34 -0.60 0.38 1.75 0.63 -4.88 119.30 119.73 1nso s MET 104 Ca -0.01 2.21 -0.26 0.00 -1.25 0.00 0.00 55.69 56.38 1nso s MET 104 Cb 0.00 -3.11 -0.08 0.00 2.84 0.00 0.00 34.83 34.49 1nso s MET 104 CO 0.02 -0.26 2.29 0.00 -0.65 0.00 0.00 175.02 176.42 1nso s MET 105 N -1.07 2.09 -0.06 4.11 0.23 -1.26 -4.73 119.30 118.61 1nso s MET 105 Ca 0.53 0.97 -0.23 0.00 -1.03 0.00 0.00 55.69 55.94 1nso s MET 105 Cb -0.40 -4.63 -0.04 0.00 -1.53 0.00 0.00 34.83 28.24 1nso s MET 105 CO 0.47 -3.46 0.67 0.00 -2.03 0.00 0.00 175.02 170.67 1nso s ALA 106 N 12.17 3.37 0.00 3.16 0.00 -1.26 -5.15 121.76 134.05 1nso s ALA 106 Ca 0.90 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.96 1nso s ALA 106 Cb -0.15 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 20.07 1nso s ALA 106 CO 0.20 -0.05 0.45 0.45 0.00 0.00 0.00 175.76 176.81