#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 5.26 -0.35 5.87 -7.23 -1.26 -4.58 120.40 118.11 1nso s VAL 2 Ca 0.00 -0.82 0.02 0.00 -1.81 0.00 0.00 61.98 59.37 1nso s VAL 2 Cb 0.00 -3.82 0.15 0.00 0.56 0.00 0.00 36.38 33.27 1nso s VAL 2 CO 0.00 -0.27 0.36 -1.58 -0.31 0.00 0.00 175.10 173.30 1nso s GLN 3 N -3.75 0.57 -0.58 4.82 2.00 -1.24 -4.98 119.66 116.50 1nso s GLN 3 Ca 0.35 -0.70 -0.26 0.00 -2.00 0.00 0.00 55.36 52.75 1nso s GLN 3 Cb -0.10 -0.71 -0.09 0.00 0.80 0.00 0.00 33.01 32.91 1nso s GLN 3 CO 0.29 -1.16 2.43 -2.30 -0.50 0.00 0.00 175.29 174.06 1nso n PRO 4 N 4.48 0.88 -2.21 1.67 -0.02 -1.26 -3.63 135.00 134.91 1nso n PRO 4 Ca 0.08 -0.16 -0.42 0.00 -2.02 0.00 0.00 63.50 60.98 1nso n PRO 4 Cb 0.45 -3.36 -0.03 0.00 -0.02 0.00 0.00 33.50 30.54 1nso n PRO 4 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1nso s ILE 5 N 12.43 3.51 -0.13 4.25 1.10 -1.26 -4.99 121.20 136.11 1nso s ILE 5 Ca 1.00 1.04 -0.25 0.00 -0.51 0.00 0.00 60.65 61.92 1nso s ILE 5 Cb -0.23 -3.66 -0.02 0.00 0.15 0.00 0.00 42.46 38.69 1nso s ILE 5 CO 0.24 0.05 0.81 0.42 -2.11 0.00 0.00 174.94 174.36 1nso s THR 6 N 1.52 4.92 0.14 4.00 -4.23 -1.26 -4.89 115.64 115.84 1nso s THR 6 Ca 0.64 1.62 0.00 0.00 -1.18 0.00 0.00 61.69 62.77 1nso s THR 6 Cb -0.34 -4.13 0.00 0.00 1.34 0.00 0.00 72.50 69.37 1nso s THR 6 CO 0.29 0.10 0.00 0.00 -0.54 0.00 0.00 174.62 174.47 1nso n ALA 7 N 4.74 -1.58 -2.56 3.99 0.00 -1.26 -4.61 120.51 119.22 1nso n ALA 7 Ca 0.03 0.19 -0.43 0.00 0.00 0.00 0.00 53.44 53.24 1nso n ALA 7 Cb 0.50 -0.55 -0.06 0.00 0.00 0.00 0.00 19.45 19.34 1nso n ALA 7 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1nso s GLN 8 N -1.06 3.55 0.19 0.00 0.00 -1.26 -5.02 119.66 116.07 1nso s GLN 8 Ca 0.00 0.04 -0.11 0.00 -0.00 0.00 0.00 55.36 55.29 1nso s GLN 8 Cb 0.00 -3.88 -0.00 0.00 0.00 0.00 0.00 33.01 29.13 1nso s GLN 8 CO 0.00 -0.96 0.37 0.15 0.00 0.00 0.00 175.29 174.85 1nso s LYS 9 N 3.11 1.30 -0.10 9.60 1.02 -1.26 -5.04 119.74 128.38 1nso s LYS 9 Ca 0.29 -1.15 -0.04 0.00 0.02 0.00 0.00 55.97 55.09 1nso s LYS 9 Cb -0.13 0.42 -0.13 0.00 -0.52 0.00 0.00 37.83 37.47 1nso s LYS 9 CO 0.19 -0.51 3.09 -0.35 -0.92 0.00 0.00 175.35 176.86 1nso n PRO 10 N -0.28 1.88 -3.28 -1.68 -0.05 -1.13 -3.41 135.00 127.04 1nso n PRO 10 Ca -0.06 -1.10 -0.05 0.00 -0.05 0.00 0.00 63.50 62.24 1nso n PRO 10 Cb 0.63 -1.83 -0.05 0.00 -0.05 0.00 0.00 33.50 32.20 1nso n PRO 10 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 175.50 173.91 1nso s SER 11 N 1.60 -0.21 -0.17 3.54 1.04 -1.25 -4.09 113.70 114.15 1nso s SER 11 Ca 0.52 0.23 -0.10 0.00 0.48 0.00 0.00 55.95 57.07 1nso s SER 11 Cb 0.27 1.41 0.06 0.00 0.10 0.00 0.00 66.02 67.85 1nso s SER 11 CO -0.04 -0.30 0.42 -0.22 0.98 0.00 0.00 173.24 174.08 1nso s LEU 12 N 2.63 -0.04 -0.36 2.42 2.96 0.23 -4.59 118.68 121.93 1nso s LEU 12 Ca 0.14 0.90 -0.14 0.00 -0.22 0.00 0.00 54.13 54.81 1nso s LEU 12 Cb -0.14 1.40 -0.01 0.00 0.50 0.00 0.00 46.19 47.94 1nso s LEU 12 CO -0.21 -0.19 0.31 -0.89 -1.32 0.00 0.00 176.35 174.05 1nso s THR 13 N 1.21 5.23 0.25 3.68 2.01 -1.24 -1.06 115.64 125.72 1nso s THR 13 Ca -0.08 -0.22 0.01 0.00 0.31 0.00 0.00 61.69 61.71 1nso s THR 13 Cb -0.07 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 1nso s THR 13 CO -0.11 -0.12 0.13 -0.76 -0.69 0.00 0.00 174.62 173.07 1nso s LEU 14 N 1.84 1.49 0.10 4.42 1.43 0.46 -3.71 118.68 124.71 1nso s LEU 14 Ca 0.08 -1.43 0.01 0.00 -1.03 0.00 0.00 54.13 51.76 1nso s LEU 14 Cb -0.17 0.19 -0.04 0.00 0.03 0.00 0.00 46.19 46.20 1nso s LEU 14 CO 0.11 -0.81 0.23 -1.66 0.23 0.00 0.00 176.35 174.45 1nso s TRP 15 N -3.84 3.49 -0.06 0.29 1.48 0.50 -0.10 118.94 120.69 1nso s TRP 15 Ca 0.38 0.19 -0.04 0.00 -1.06 0.00 0.00 56.10 55.56 1nso s TRP 15 Cb 0.07 -1.71 0.03 0.00 -1.16 0.00 0.00 33.47 30.69 1nso s TRP 15 CO 0.14 0.56 0.15 -0.48 -4.06 0.00 0.00 176.95 173.26 1nso s LEU 16 N -2.79 1.09 -1.42 -4.66 2.34 0.53 -0.22 118.68 113.54 1nso s LEU 16 Ca 0.35 0.31 -0.06 0.00 0.06 0.00 0.00 54.13 54.78 1nso s LEU 16 Cb -0.12 0.46 0.03 0.00 -0.56 0.00 0.00 46.19 46.00 1nso s LEU 16 CO 0.28 -0.10 0.52 0.47 -1.06 0.00 0.00 176.35 176.47 1nso n ASP 17 N 3.56 -4.98 -2.16 1.48 8.00 -1.12 -1.02 116.55 120.31 1nso n ASP 17 Ca -0.19 -0.31 -0.13 0.00 0.71 0.00 0.00 54.79 54.87 1nso n ASP 17 Cb 0.56 -4.07 0.04 0.00 -0.02 0.00 0.00 41.12 37.63 1nso n ASP 17 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1nso n ASP 18 N -2.39 -4.41 -3.45 -2.24 9.92 -1.26 -5.02 116.55 107.70 1nso n ASP 18 Ca -0.07 -0.28 -0.05 0.00 -0.53 0.00 0.00 54.79 53.86 1nso n ASP 18 Cb 0.59 -3.03 -0.07 0.00 -0.64 0.00 0.00 41.12 37.97 1nso n ASP 18 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1nso s LYS 19 N -5.65 0.41 0.51 -1.24 2.20 -0.18 -5.15 119.74 110.64 1nso s LYS 19 Ca 0.30 0.91 -0.23 0.00 -0.36 0.00 0.00 55.97 56.60 1nso s LYS 19 Cb -0.13 0.17 -0.06 0.00 -1.51 0.00 0.00 37.83 36.30 1nso s LYS 19 CO 0.38 -0.45 1.35 1.41 -0.36 0.00 0.00 175.35 177.68 1nso s MET 20 N 2.68 3.38 0.14 4.03 1.75 -1.26 -0.35 119.30 129.67 1nso s MET 20 Ca 0.07 2.23 -0.18 0.00 -1.25 0.00 0.00 55.69 56.57 1nso s MET 20 Cb -0.14 -2.40 0.06 0.00 2.84 0.00 0.00 34.83 35.20 1nso s MET 20 CO -0.16 -1.00 0.84 0.34 -0.65 0.00 0.00 175.02 174.39 1nso n PHE 21 N -0.71 -1.19 -3.83 4.11 7.35 0.85 -4.80 117.46 119.25 1nso n PHE 21 Ca 0.08 -1.02 -0.22 0.00 -0.76 0.00 0.00 57.45 55.54 1nso n PHE 21 Cb 0.44 0.50 -0.04 0.00 0.35 0.00 0.00 39.48 40.73 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 -2.15 3.08 -0.09 -2.13 2.01 -1.26 -0.41 115.64 114.69 1nso s THR 22 Ca 0.19 -1.46 -0.30 0.00 0.31 0.00 0.00 61.69 60.42 1nso s THR 22 Cb -0.02 -3.07 0.12 0.00 0.01 0.00 0.00 72.50 69.54 1nso s THR 22 CO 0.04 -0.11 0.98 -0.83 -0.69 0.00 0.00 174.62 174.01 1nso s GLY 23 N -3.99 -0.37 -0.27 4.40 0.00 -0.22 -4.87 107.32 102.00 1nso s GLY 23 Ca 0.42 1.46 -0.17 0.00 0.00 0.00 0.00 44.72 46.43 1nso s GLY 23 CO 0.26 0.60 0.46 1.08 0.00 0.00 0.00 173.10 175.50 1nso s LEU 24 N -1.97 4.08 -0.42 0.66 1.02 -1.26 -0.60 118.68 120.18 1nso s LEU 24 Ca 0.04 0.38 -0.21 0.00 0.02 0.00 0.00 54.13 54.36 1nso s LEU 24 Cb -0.01 -2.57 0.02 0.00 0.02 0.00 0.00 46.19 43.65 1nso s LEU 24 CO -0.05 -0.27 0.67 -0.63 0.02 0.00 0.00 176.35 176.09 1nso s ILE 25 N 2.23 4.81 -0.20 -0.59 -1.09 -1.22 -4.80 121.20 120.34 1nso s ILE 25 Ca 0.19 0.26 -0.05 0.00 -2.23 0.00 0.00 60.65 58.81 1nso s ILE 25 Cb -0.16 -4.20 -0.03 0.00 -1.58 0.00 0.00 42.46 36.50 1nso s ILE 25 CO 0.10 -0.56 0.01 0.54 -1.23 0.00 0.00 174.94 173.80 1nso s ASN 26 N 1.98 4.92 0.00 3.58 2.20 -1.26 -2.85 114.94 123.51 1nso s ASN 26 Ca 0.24 -0.18 0.10 0.00 -0.94 0.00 0.00 52.86 52.08 1nso s ASN 26 Cb -0.14 -1.85 0.58 0.00 -2.00 0.00 0.00 41.25 37.84 1nso s ASN 26 CO 0.19 0.06 1.37 1.07 -2.94 0.00 0.00 177.10 176.85 1nso n THR 27 N 4.26 0.02 -1.67 0.54 5.66 -1.26 -3.38 114.28 118.45 1nso n THR 27 Ca -0.17 -0.02 0.03 0.00 -3.05 0.00 0.00 64.05 60.84 1nso n THR 27 Cb 0.52 -0.13 0.19 0.00 -1.55 0.00 0.00 70.33 69.35 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 0.67 5.13 3.77 1.09 0.00 -1.26 -5.06 105.19 109.54 1nso n GLY 28 Ca 0.08 -1.43 -0.39 0.00 0.00 0.00 0.00 46.02 44.28 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 -3.18 3.24 0.00 4.61 0.00 -1.22 -4.92 121.76 120.29 1nso s ALA 29 Ca 0.39 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.51 1nso s ALA 29 Cb 0.37 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 20.04 1nso s ALA 29 CO -0.06 -0.73 0.00 -0.40 0.00 0.00 0.00 175.76 174.57 1nso n ASP 30 N 0.15 0.52 -3.64 0.00 5.75 -1.26 -3.62 116.55 114.45 1nso n ASP 30 Ca 0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.53 1nso n ASP 30 Cb 0.44 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.38 1nso n ASP 30 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1nso s VAL 31 N -1.79 0.36 -0.55 2.12 -7.23 -1.26 -4.58 120.40 107.47 1nso s VAL 31 Ca 0.00 -0.98 -0.28 0.00 -1.81 0.00 0.00 61.98 58.91 1nso s VAL 31 Cb 0.00 -1.25 -0.10 0.00 0.56 0.00 0.00 36.38 35.59 1nso s VAL 31 CO 0.00 -0.65 2.43 1.07 -0.31 0.00 0.00 175.10 177.64 1nso n THR 32 N 5.07 0.01 -4.18 5.32 5.66 -1.17 -4.79 114.28 120.20 1nso n THR 32 Ca -0.05 -0.54 -0.33 0.00 -3.05 0.00 0.00 64.05 60.09 1nso n THR 32 Cb 0.43 -2.16 -0.16 0.00 -1.55 0.00 0.00 70.33 66.89 1nso n THR 32 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1nso s ILE 33 N 10.59 2.17 0.15 1.09 -1.09 0.29 -1.86 121.20 132.53 1nso s ILE 33 Ca 1.08 -0.91 0.06 0.00 -2.23 0.00 0.00 60.65 58.64 1nso s ILE 33 Cb -0.50 -1.91 -0.04 0.00 -1.58 0.00 0.00 42.46 38.43 1nso s ILE 33 CO 0.35 0.53 0.06 -0.51 -1.23 0.00 0.00 174.94 174.14 1nso s ILE 34 N 1.24 4.13 0.57 2.92 1.10 0.42 -0.42 121.20 131.16 1nso s ILE 34 Ca 0.03 -1.17 -0.05 0.00 -0.51 0.00 0.00 60.65 58.96 1nso s ILE 34 Cb -0.13 -3.07 0.01 0.00 0.15 0.00 0.00 42.46 39.42 1nso s ILE 34 CO -0.11 -0.05 0.86 -1.59 -2.11 0.00 0.00 174.94 171.94 1nso s LYS 35 N -2.86 2.92 0.34 3.50 0.00 -1.26 -3.24 119.74 119.14 1nso s LYS 35 Ca 0.29 -0.11 0.04 0.00 0.00 0.00 0.00 55.97 56.19 1nso s LYS 35 Cb -0.10 -2.32 0.61 0.00 0.00 0.00 0.00 37.83 36.02 1nso s LYS 35 CO 0.21 -0.64 1.89 1.25 0.00 0.00 0.00 175.35 178.06 1nso h LEU 36 N -0.08 0.51 -2.58 2.77 6.46 -1.68 -1.79 115.31 118.90 1nso h LEU 36 Ca -0.45 -0.09 0.01 0.00 -0.12 0.00 0.00 57.88 57.23 1nso h LEU 36 Cb 1.26 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 41.05 1nso h LEU 36 CO 0.60 0.55 0.12 -0.33 -0.62 0.00 0.00 178.44 178.77 1nso h GLU 37 N 0.53 0.00 -0.45 1.25 3.07 -1.93 0.13 114.58 117.18 1nso h GLU 37 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 1nso h GLU 37 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1nso h GLU 37 CO 0.01 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.37 1nso n ASP 38 N -3.14 3.60 -4.90 1.42 9.92 -0.68 -4.99 116.55 117.78 1nso n ASP 38 Ca -0.02 -2.26 -0.33 0.00 -0.53 0.00 0.00 54.79 51.65 1nso n ASP 38 Cb 0.19 -0.39 -0.05 0.00 -0.64 0.00 0.00 41.12 40.24 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 -1.47 3.54 0.00 1.24 -0.00 0.46 -4.95 118.94 117.77 1nso s TRP 39 Ca 0.36 0.41 -0.30 0.00 -0.00 0.00 0.00 56.10 56.57 1nso s TRP 39 Cb 0.22 -1.87 -0.06 0.00 -0.00 0.00 0.00 33.47 31.75 1nso s TRP 39 CO 0.19 0.61 1.53 -1.25 -0.00 0.00 0.00 176.95 178.03 1nso s PRO 40 N -2.06 4.23 0.04 5.86 0.04 -1.26 -4.89 135.00 136.96 1nso s PRO 40 Ca 0.30 2.11 0.09 0.00 0.04 0.00 0.00 61.00 63.54 1nso s PRO 40 Cb -0.13 -3.68 0.40 0.00 0.04 0.00 0.00 34.50 31.13 1nso s PRO 40 CO 0.20 -0.69 1.28 -2.30 0.04 0.00 0.00 177.00 175.53 1nso n PRO 41 N 5.90 0.02 -0.34 0.56 -0.02 -1.26 -3.25 135.00 136.60 1nso n PRO 41 Ca 0.15 0.41 0.22 0.00 -2.02 0.00 0.00 63.50 62.26 1nso n PRO 41 Cb 0.43 -1.56 0.46 0.00 -0.02 0.00 0.00 33.50 32.80 1nso n PRO 41 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 1nso h ASN 42 N 0.00 0.55 -3.70 2.55 -0.73 -2.05 -3.40 115.58 108.81 1nso h ASN 42 Ca 0.00 0.14 -0.23 0.00 1.87 0.00 0.00 56.30 58.08 1nso h ASN 42 Cb 0.12 0.06 -0.29 0.00 0.27 0.00 0.00 38.32 38.49 1nso h ASN 42 CO 0.00 0.01 -0.68 -1.66 -0.37 0.00 0.00 177.43 174.73 1nso s TRP 43 N -5.65 -0.04 0.37 0.67 -2.14 -1.20 -5.14 118.94 105.81 1nso s TRP 43 Ca -0.10 0.13 -0.27 0.00 2.66 0.00 0.00 56.10 58.52 1nso s TRP 43 Cb 0.28 -0.03 -0.09 0.00 -3.10 0.00 0.00 33.47 30.53 1nso s TRP 43 CO 0.80 -0.04 1.27 -2.14 -2.66 0.00 0.00 176.95 174.18 1nso s PRO 44 N 0.23 4.18 -0.09 3.25 0.02 -1.26 -4.87 135.00 136.46 1nso s PRO 44 Ca -0.02 2.10 -0.17 0.00 0.02 0.00 0.00 61.00 62.94 1nso s PRO 44 Cb -0.03 -2.89 -0.05 0.00 0.02 0.00 0.00 34.50 31.55 1nso s PRO 44 CO -0.01 -0.30 0.43 0.96 -0.33 0.00 0.00 177.00 177.75 1nso s ILE 45 N -1.23 5.15 -0.05 2.83 -5.25 -1.26 -4.95 121.20 116.43 1nso s ILE 45 Ca 0.53 0.86 -0.02 0.00 -0.99 0.00 0.00 60.65 61.03 1nso s ILE 45 Cb -0.37 -3.76 0.04 0.00 2.95 0.00 0.00 42.46 41.32 1nso s ILE 45 CO 0.48 0.41 0.12 0.28 -1.79 0.00 0.00 174.94 174.44 1nso s THR 46 N 0.07 -0.07 -0.08 8.37 -1.32 -1.23 -4.34 115.64 117.03 1nso s THR 46 Ca 0.24 0.21 -0.03 0.00 -1.21 0.00 0.00 61.69 60.90 1nso s THR 46 Cb -0.15 -0.20 0.05 0.00 -1.51 0.00 0.00 72.50 70.68 1nso s THR 46 CO 0.10 0.09 0.15 -0.62 -2.21 0.00 0.00 174.62 172.13 1nso s ASP 47 N 1.28 0.83 -0.80 8.08 2.15 0.16 -4.17 116.67 124.20 1nso s ASP 47 Ca -0.08 0.28 -0.25 0.00 0.43 0.00 0.00 52.55 52.94 1nso s ASP 47 Cb -0.12 0.22 -0.04 0.00 -0.30 0.00 0.00 42.92 42.68 1nso s ASP 47 CO -0.05 -0.25 1.93 0.42 -0.17 0.00 0.00 175.17 177.05 1nso s THR 48 N 2.28 3.40 0.91 1.71 -4.23 -1.26 -0.33 115.64 118.12 1nso s THR 48 Ca 0.03 -0.16 -0.15 0.00 -1.18 0.00 0.00 61.69 60.23 1nso s THR 48 Cb -0.12 -3.96 0.16 0.00 1.34 0.00 0.00 72.50 69.92 1nso s THR 48 CO -0.05 -0.91 1.27 -0.22 -0.54 0.00 0.00 174.62 174.17 1nso s LEU 49 N 9.84 2.64 -0.26 4.79 2.96 -0.99 -4.88 118.68 132.77 1nso s LEU 49 Ca 0.70 0.45 -0.04 0.00 -0.22 0.00 0.00 54.13 55.02 1nso s LEU 49 Cb -0.09 -2.65 0.02 0.00 0.50 0.00 0.00 46.19 43.96 1nso s LEU 49 CO 0.07 -2.44 -0.01 0.42 -1.32 0.00 0.00 176.35 173.07 1nso s THR 50 N -3.78 3.28 -0.53 3.68 -4.23 -1.26 -1.55 115.64 111.24 1nso s THR 50 Ca 0.70 -0.87 0.04 0.00 -1.18 0.00 0.00 61.69 60.38 1nso s THR 50 Cb -0.06 -2.66 0.17 0.00 1.34 0.00 0.00 72.50 71.28 1nso s THR 50 CO 0.52 0.18 0.39 0.21 -0.54 0.00 0.00 174.62 175.38 1nso s ASN 51 N 1.40 3.03 -0.19 3.99 2.47 -0.62 -4.39 114.94 120.63 1nso s ASN 51 Ca 0.01 -3.35 -0.14 0.00 0.42 0.00 0.00 52.86 49.80 1nso s ASN 51 Cb -0.17 -0.98 -0.04 0.00 -1.45 0.00 0.00 41.25 38.61 1nso s ASN 51 CO -0.02 -0.14 0.32 -0.76 -3.72 0.00 0.00 177.10 172.77 1nso s LEU 52 N -0.54 4.18 -0.04 3.21 1.02 -1.20 -0.28 118.68 125.04 1nso s LEU 52 Ca 0.28 0.45 0.13 0.00 0.02 0.00 0.00 54.13 55.01 1nso s LEU 52 Cb -0.02 -2.39 0.45 0.00 0.02 0.00 0.00 46.19 44.25 1nso s LEU 52 CO -0.17 0.01 1.35 0.54 0.02 0.00 0.00 176.35 178.10 1nso n ARG 53 N 4.09 2.47 0.00 1.70 1.74 -0.98 -4.85 116.66 120.83 1nso n ARG 53 Ca -0.11 -1.82 0.00 0.00 -0.77 0.00 0.00 57.85 55.16 1nso n ARG 53 Cb 0.52 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 1nso n ARG 53 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nso n GLY 54 N 1.06 1.47 0.00 -0.13 0.00 -1.26 -2.76 105.19 103.57 1nso n GLY 54 Ca 0.17 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.27 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 -2.32 -0.61 -5.35 -1.26 -4.36 119.36 105.45 1nso n ILE 55 Ca 0.00 -0.21 -0.29 0.00 -0.27 0.00 0.00 62.75 61.97 1nso n ILE 55 Cb 0.00 0.59 0.01 0.00 -1.74 0.00 0.00 39.64 38.50 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 1.41 5.95 3.52 3.28 0.00 -1.11 -5.03 105.19 113.21 1nso n GLY 56 Ca 0.01 -2.70 -0.31 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 -0.52 0.27 -4.31 1.61 -0.00 -1.26 -2.31 117.38 110.85 1nso n GLN 57 Ca 0.43 -0.11 -0.29 0.00 -0.00 0.00 0.00 57.00 57.02 1nso n GLN 57 Cb 0.60 -2.01 -0.05 0.00 -0.00 0.00 0.00 30.24 28.78 1nso n GLN 57 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1nso s SER 58 N 7.37 4.37 -0.03 2.61 0.01 0.61 -4.86 113.70 123.77 1nso s SER 58 Ca 1.22 -1.40 0.07 0.00 1.31 0.00 0.00 55.95 57.15 1nso s SER 58 Cb -0.80 0.32 -0.01 0.00 0.21 0.00 0.00 66.02 65.74 1nso s SER 58 CO 0.42 -0.90 -0.24 0.20 0.41 0.00 0.00 173.24 173.12 1nso s ASN 59 N -4.04 2.87 0.80 2.44 -0.87 -1.23 -1.59 114.94 113.32 1nso s ASN 59 Ca 0.23 -0.46 -0.12 0.00 -1.57 0.00 0.00 52.86 50.94 1nso s ASN 59 Cb 0.01 -0.53 0.07 0.00 -0.02 0.00 0.00 41.25 40.78 1nso s ASN 59 CO 0.13 0.27 1.10 0.20 -2.57 0.00 0.00 177.10 176.23 1nso s ASN 60 N -0.38 4.44 -0.45 -1.22 0.02 -0.60 -4.57 114.94 112.18 1nso s ASN 60 Ca 0.04 1.26 -0.27 0.00 -1.02 0.00 0.00 52.86 52.87 1nso s ASN 60 Cb -0.11 -1.98 -0.04 0.00 0.02 0.00 0.00 41.25 39.13 1nso s ASN 60 CO 0.01 -2.00 2.12 -2.16 0.02 0.00 0.00 177.10 175.10 1nso s PRO 61 N -5.18 2.62 -0.26 -0.60 0.04 -1.26 -2.34 135.00 128.02 1nso s PRO 61 Ca 0.61 1.29 -0.43 0.00 0.04 0.00 0.00 61.00 62.52 1nso s PRO 61 Cb -0.14 -4.43 -0.19 0.00 0.04 0.00 0.00 34.50 29.78 1nso s PRO 61 CO 0.54 -2.70 1.45 0.36 0.04 0.00 0.00 177.00 176.70 1nso n LYS 62 N 8.92 0.34 -4.22 4.56 -0.00 0.55 -4.70 118.16 123.61 1nso n LYS 62 Ca 0.29 0.12 -0.27 0.00 -0.00 0.00 0.00 58.31 58.46 1nso n LYS 62 Cb 0.51 -1.67 -0.08 0.00 -0.00 0.00 0.00 35.03 33.79 1nso n LYS 62 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 1nso s GLN 63 N 2.01 2.37 0.00 -1.58 0.00 -1.09 -2.96 119.66 118.41 1nso s GLN 63 Ca 0.98 -1.13 0.00 0.00 -0.00 0.00 0.00 55.36 55.21 1nso s GLN 63 Cb -1.30 -2.34 0.00 0.00 0.00 0.00 0.00 33.01 29.38 1nso s GLN 63 CO 0.68 0.45 0.00 0.45 0.00 0.00 0.00 175.29 176.88 1nso n SER 64 N -0.11 0.34 -0.02 12.60 2.88 -0.90 0.39 113.62 128.80 1nso n SER 64 Ca -0.10 -0.15 -0.03 0.00 -1.33 0.00 0.00 58.87 57.27 1nso n SER 64 Cb 0.55 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.99 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 -0.40 3.65 -0.35 -3.46 3.41 -1.26 -2.25 113.62 112.97 1nso n SER 65 Ca 0.00 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 1nso n SER 65 Cb 0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1nso n SER 65 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1nso n LYS 66 N -2.62 -0.14 -2.74 4.33 -0.00 -1.26 -2.35 118.16 113.37 1nso n LYS 66 Ca -0.07 0.13 -0.42 0.00 -0.00 0.00 0.00 58.31 57.95 1nso n LYS 66 Cb 0.58 -0.09 -0.03 0.00 -0.00 0.00 0.00 35.03 35.48 1nso n LYS 66 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.40 178.92 1nso s TYR 67 N 0.00 3.59 -0.04 5.58 1.13 -1.26 -3.98 117.35 122.37 1nso s TYR 67 Ca 0.00 1.60 -0.06 0.00 -1.41 0.00 0.00 57.07 57.21 1nso s TYR 67 Cb 0.00 -3.11 -0.04 0.00 -1.10 0.00 0.00 41.96 37.71 1nso s TYR 67 CO 0.00 -0.09 0.20 -1.17 -2.51 0.00 0.00 175.55 171.98 1nso s LEU 68 N 1.38 4.38 -0.42 -3.49 2.96 -0.61 -4.87 118.68 118.03 1nso s LEU 68 Ca 0.49 0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 54.83 1nso s LEU 68 Cb -0.20 -2.44 0.11 0.00 0.50 0.00 0.00 46.19 44.17 1nso s LEU 68 CO 0.23 0.31 0.21 0.42 -1.32 0.00 0.00 176.35 176.21 1nso s THR 69 N -1.21 3.30 -0.22 3.68 -4.23 -1.26 -1.90 115.64 113.81 1nso s THR 69 Ca 0.23 -2.09 -0.10 0.00 -1.18 0.00 0.00 61.69 58.54 1nso s THR 69 Cb -0.13 -3.26 -0.05 0.00 1.34 0.00 0.00 72.50 70.40 1nso s THR 69 CO 0.13 -0.70 0.15 0.86 -0.54 0.00 0.00 174.62 174.51 1nso s TRP 70 N 1.09 3.35 -0.05 3.99 -0.00 -0.04 -2.80 118.94 124.48 1nso s TRP 70 Ca 0.09 0.26 -0.07 0.00 -0.00 0.00 0.00 56.10 56.38 1nso s TRP 70 Cb -0.23 -2.22 0.01 0.00 -0.00 0.00 0.00 33.47 31.03 1nso s TRP 70 CO -0.04 0.15 0.17 1.03 -0.00 0.00 0.00 176.95 178.26 1nso s ARG 71 N 0.78 0.29 0.67 5.86 0.52 0.70 -0.28 118.95 127.49 1nso s ARG 71 Ca 0.08 0.05 -0.11 0.00 -0.52 0.00 0.00 55.73 55.23 1nso s ARG 71 Cb -0.12 0.13 -0.01 0.00 0.52 0.00 0.00 34.95 35.47 1nso s ARG 71 CO 0.02 -0.05 1.06 0.34 0.02 0.00 0.00 175.30 176.69 1nso s ASP 72 N -0.35 5.74 0.52 0.23 2.15 0.47 -0.37 116.67 125.06 1nso s ASP 72 Ca -0.04 1.34 0.46 0.00 0.43 0.00 0.00 52.55 54.74 1nso s ASP 72 Cb -0.03 -2.27 1.57 0.00 -0.30 0.00 0.00 42.92 41.89 1nso s ASP 72 CO 0.01 -1.18 1.43 2.29 -0.17 0.00 0.00 175.17 177.55 1nso n LYS 73 N -2.93 0.00 -0.15 4.34 -0.00 -1.26 0.23 118.16 118.39 1nso n LYS 73 Ca 0.07 1.00 -0.02 0.00 -0.00 0.00 0.00 58.31 59.36 1nso n LYS 73 Cb 0.55 -2.32 0.04 0.00 -0.00 0.00 0.00 35.03 33.30 1nso n LYS 73 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1nso n GLU 74 N -3.74 1.32 -3.89 -1.58 2.13 -1.26 -4.85 120.64 108.77 1nso n GLU 74 Ca 0.40 -0.42 -0.31 0.00 0.66 0.00 0.00 57.16 57.49 1nso n GLU 74 Cb 1.85 -1.34 0.01 0.00 0.27 0.00 0.00 31.44 32.23 1nso n GLU 74 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1nso n ASN 75 N 0.20 -2.76 -3.65 4.31 6.94 0.64 -4.96 115.26 115.98 1nso n ASN 75 Ca 0.06 -1.07 -0.02 0.00 -0.02 0.00 0.00 54.58 53.53 1nso n ASN 75 Cb 0.55 -2.90 -0.07 0.00 -2.36 0.00 0.00 39.78 35.01 1nso n ASN 75 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1nso s ASN 76 N -3.90 -0.14 0.00 0.53 2.20 -1.07 -4.85 114.94 107.71 1nso s ASN 76 Ca 0.26 0.25 0.00 0.00 -0.94 0.00 0.00 52.86 52.43 1nso s ASN 76 Cb -0.11 0.54 0.00 0.00 -2.00 0.00 0.00 41.25 39.69 1nso s ASN 76 CO 0.90 -0.04 0.00 -0.24 -2.94 0.00 0.00 177.10 174.77 1nso n SER 77 N 2.25 0.00 0.00 3.54 2.88 -1.25 -0.40 113.62 120.65 1nso n SER 77 Ca -0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.41 1nso n SER 77 Cb 0.57 0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 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 -0.94 4.04 3.22 0.46 0.00 0.62 -1.92 105.19 110.66 1nso n GLY 78 Ca 0.00 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.42 0.28 0.99 0.05 -1.26 -0.86 118.68 117.46 1nso s LEU 79 Ca 0.00 0.89 -0.20 0.00 0.05 0.00 0.00 54.13 54.87 1nso s LEU 79 Cb 0.00 1.24 0.02 0.00 -2.05 0.00 0.00 46.19 45.40 1nso s LEU 79 CO 0.00 -0.22 0.69 0.27 -0.55 0.00 0.00 176.35 176.54 1nso s ILE 80 N 2.22 0.00 -0.56 1.48 -5.25 -0.80 -4.96 121.20 113.34 1nso s ILE 80 Ca -0.04 -1.05 -0.22 0.00 -0.99 0.00 0.00 60.65 58.36 1nso s ILE 80 Cb -0.11 -2.03 0.05 0.00 2.95 0.00 0.00 42.46 43.32 1nso s ILE 80 CO -0.12 0.00 0.85 -1.59 -1.79 0.00 0.00 174.94 172.29 1nso s LYS 81 N -3.92 3.23 0.12 0.37 0.00 -1.26 -1.57 119.74 116.70 1nso s LYS 81 Ca 0.12 -0.57 -0.01 0.00 0.00 0.00 0.00 55.97 55.52 1nso s LYS 81 Cb -0.05 -4.10 0.02 0.00 0.00 0.00 0.00 37.83 33.70 1nso s LYS 81 CO 0.07 -1.48 0.16 -0.35 0.00 0.00 0.00 175.35 173.76 1nso n PRO 82 N 7.12 0.33 -3.80 1.78 -0.05 -0.99 -4.89 135.00 134.50 1nso n PRO 82 Ca -0.02 -0.38 -0.36 0.00 -0.05 0.00 0.00 63.50 62.69 1nso n PRO 82 Cb 0.46 -0.13 -0.12 0.00 -0.05 0.00 0.00 33.50 33.67 1nso n PRO 82 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 175.50 175.39 1nso s PHE 83 N -0.56 3.12 -0.30 0.54 0.08 -0.78 -3.99 117.98 116.09 1nso s PHE 83 Ca 0.10 -0.28 -0.05 0.00 0.12 0.00 0.00 56.93 56.82 1nso s PHE 83 Cb -0.00 -2.22 0.02 0.00 -0.57 0.00 0.00 43.02 40.25 1nso s PHE 83 CO 0.07 -0.25 0.05 0.08 -0.10 0.00 0.00 175.22 175.08 1nso s VAL 84 N 1.41 3.63 0.10 -0.44 1.01 -0.95 -0.44 120.40 124.71 1nso s VAL 84 Ca 0.05 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.16 1nso s VAL 84 Cb -0.15 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 1nso s VAL 84 CO 0.04 0.01 -0.18 -0.63 0.00 0.00 0.00 175.10 174.34 1nso s ILE 85 N 1.42 1.47 -0.78 2.22 1.01 -1.20 -2.12 121.20 123.21 1nso s ILE 85 Ca 0.00 -1.49 -0.07 0.00 0.00 0.00 0.00 60.65 59.09 1nso s ILE 85 Cb -0.18 -1.39 -0.16 0.00 0.01 0.00 0.00 42.46 40.74 1nso s ILE 85 CO 0.01 -0.16 3.01 -0.81 0.00 0.00 0.00 174.94 176.98 1nso n PRO 86 N 1.07 2.60 0.00 2.79 -0.04 -1.26 -1.97 135.00 138.18 1nso n PRO 86 Ca -0.19 -1.49 0.00 0.00 -0.04 0.00 0.00 63.50 61.77 1nso n PRO 86 Cb 0.54 -2.36 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 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 3.18 0.04 -1.66 3.54 5.15 -1.26 -5.00 115.26 119.25 1nso n ASN 87 Ca 0.56 -0.00 -0.00 0.00 -0.60 0.00 0.00 54.58 54.53 1nso n ASN 87 Cb 0.49 0.02 0.00 0.00 -0.53 0.00 0.00 39.78 39.76 1nso n ASN 87 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1nso n LEU 88 N -0.02 -2.52 -0.77 1.20 7.94 -1.24 -4.89 117.00 116.71 1nso n LEU 88 Ca 0.00 -0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1nso n LEU 88 Cb 0.00 -1.24 0.00 0.00 0.53 0.00 0.00 43.42 42.71 1nso n LEU 88 CO 0.00 -0.13 0.24 -0.81 -1.11 0.00 0.00 177.39 175.58 1nso n PRO 89 N -1.03 0.62 -0.95 1.96 -0.04 -1.26 -4.69 135.00 129.62 1nso n PRO 89 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1nso n PRO 89 Cb 0.46 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1nso n PRO 89 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1nso n VAL 90 N 0.45 0.00 -3.95 0.52 0.31 -1.26 -4.10 118.33 110.31 1nso n VAL 90 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 1nso n VAL 90 Cb 0.24 -0.14 0.03 0.00 -0.91 0.00 0.00 33.84 33.05 1nso n VAL 90 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1nso n ASN 91 N -0.10 -4.54 -4.88 4.52 6.94 -1.18 -4.94 115.26 111.09 1nso n ASN 91 Ca 0.00 -1.21 -0.37 0.00 -0.02 0.00 0.00 54.58 52.98 1nso n ASN 91 Cb 0.05 -2.20 -0.06 0.00 -2.36 0.00 0.00 39.78 35.21 1nso n ASN 91 CO 0.00 0.00 0.00 -1.48 -1.03 0.00 0.00 177.26 174.75 1nso s LEU 92 N -7.13 4.40 0.00 -4.53 0.05 0.44 -4.89 118.68 107.02 1nso s LEU 92 Ca 0.48 0.51 0.00 0.00 0.05 0.00 0.00 54.13 55.18 1nso s LEU 92 Cb -0.24 -2.19 0.00 0.00 -2.05 0.00 0.00 46.19 41.71 1nso s LEU 92 CO 0.94 0.38 0.00 0.79 -0.55 0.00 0.00 176.35 177.91 1nso n TRP 93 N 1.85 -3.58 -4.20 3.48 5.03 -1.26 0.10 117.44 118.85 1nso n TRP 93 Ca -0.18 0.00 -0.30 0.00 3.03 0.00 0.00 57.50 60.05 1nso n TRP 93 Cb 0.54 0.00 -0.09 0.00 -1.03 0.00 0.00 31.31 30.73 1nso n TRP 93 CO 0.00 0.00 0.00 0.20 -0.03 0.00 0.00 177.69 177.86 1nso s GLY 94 N -2.72 1.83 0.62 6.99 0.00 -1.26 -3.03 107.32 109.74 1nso s GLY 94 Ca 0.00 -1.22 0.26 0.00 0.00 0.00 0.00 44.72 43.77 1nso s GLY 94 CO 0.00 -1.20 1.70 -0.09 0.00 0.00 0.00 173.10 173.51 1nso h ARG 95 N 3.56 0.00 -0.08 2.90 2.43 -1.81 0.17 114.38 121.56 1nso h ARG 95 Ca -0.49 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 58.60 1nso h ARG 95 Cb 1.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 1nso h ARG 95 CO 0.54 0.00 -0.30 0.38 -1.51 0.00 0.00 179.97 179.08 1nso h ASP 96 N 0.00 0.39 -0.32 -3.80 2.03 -1.94 -0.41 116.42 112.38 1nso h ASP 96 Ca 0.21 -0.63 -0.18 0.00 -0.73 0.00 0.00 57.03 55.70 1nso h ASP 96 Cb 1.51 -0.12 -0.00 0.00 -0.83 0.00 0.00 39.33 39.89 1nso h ASP 96 CO -0.00 0.96 -0.49 -0.07 -1.03 0.00 0.00 179.24 178.61 1nso h LEU 97 N -0.15 0.99 -0.10 0.15 3.38 -1.01 -2.76 115.31 115.81 1nso h LEU 97 Ca -0.02 -0.50 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 1nso h LEU 97 Cb 0.94 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 1nso h LEU 97 CO 0.06 1.30 -0.11 -0.07 0.09 0.00 0.00 178.44 179.71 1nso h LEU 98 N 0.71 0.27 -0.53 1.67 -0.00 -1.39 0.14 115.31 116.17 1nso h LEU 98 Ca 0.03 -0.50 0.11 0.00 -0.00 0.00 0.00 57.88 57.52 1nso h LEU 98 Cb 1.10 -0.08 -0.10 0.00 -0.00 0.00 0.00 40.66 41.58 1nso h LEU 98 CO 0.11 0.71 -0.14 -1.28 -0.00 0.00 0.00 178.44 177.84 1nso h SER 99 N -0.17 -0.52 0.03 -0.43 0.87 -1.10 -0.88 113.55 111.35 1nso h SER 99 Ca 0.01 0.16 -0.20 0.00 -1.23 0.00 0.00 61.79 60.54 1nso h SER 99 Cb 0.64 0.34 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1nso h SER 99 CO 0.03 -0.18 -0.71 1.56 -0.53 0.00 0.00 176.83 176.99 1nso h GLN 100 N -0.01 0.61 -0.61 2.24 4.20 -1.50 0.20 115.11 120.24 1nso h GLN 100 Ca 0.25 -0.47 0.06 0.00 0.06 0.00 0.00 58.65 58.55 1nso h GLN 100 Cb 0.40 0.09 -0.08 0.00 0.30 0.00 0.00 27.48 28.19 1nso h GLN 100 CO -0.55 1.09 -0.42 1.98 -0.67 0.00 0.00 178.83 180.26 1nso h MET 101 N 0.43 -0.07 0.00 1.46 4.05 0.73 -3.41 114.93 118.12 1nso h MET 101 Ca -0.03 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.34 1nso h MET 101 Cb 1.30 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 32.07 1nso h MET 101 CO 0.14 -0.05 -0.11 1.17 0.23 0.00 0.00 176.91 178.29 1nso n LYS 102 N -4.62 0.21 -0.01 0.39 3.00 -1.06 -4.84 118.16 111.23 1nso n LYS 102 Ca 0.00 -0.42 -0.02 0.00 -0.00 0.00 0.00 58.31 57.87 1nso n LYS 102 Cb 0.20 0.37 -0.01 0.00 0.00 0.00 0.00 35.03 35.59 1nso n LYS 102 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1nso n ILE 103 N -0.24 0.54 -1.29 3.15 -0.00 -0.90 -5.03 119.36 115.59 1nso n ILE 103 Ca -0.09 0.28 -0.34 0.00 -0.00 0.00 0.00 62.75 62.61 1nso n ILE 103 Cb 0.51 -1.60 0.11 0.00 -0.00 0.00 0.00 39.64 38.66 1nso n ILE 103 CO 0.00 0.00 0.00 -0.32 -0.00 0.00 0.00 176.55 176.23 1nso s MET 104 N -1.61 1.93 -1.24 0.38 1.75 0.66 -4.89 119.30 116.27 1nso s MET 104 Ca -0.07 1.73 -0.16 0.00 -1.25 0.00 0.00 55.69 55.93 1nso s MET 104 Cb 0.01 -1.81 0.11 0.00 2.84 0.00 0.00 34.83 35.98 1nso s MET 104 CO 0.10 -1.99 1.59 1.41 -0.65 0.00 0.00 175.02 175.48 1nso s MET 105 N -4.05 4.01 -0.13 4.11 1.75 -1.26 -4.93 119.30 118.80 1nso s MET 105 Ca 0.73 -2.20 -0.05 0.00 -1.25 0.00 0.00 55.69 52.93 1nso s MET 105 Cb -0.28 -5.33 -0.04 0.00 2.84 0.00 0.00 34.83 32.03 1nso s MET 105 CO 0.48 -2.05 0.03 0.00 -0.65 0.00 0.00 175.02 172.84 1nso s ALA 106 N 3.15 3.37 -0.22 4.11 0.00 -1.26 -5.23 121.76 125.67 1nso s ALA 106 Ca 0.49 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.70 1nso s ALA 106 Cb 0.01 -1.69 0.01 0.00 0.00 0.00 0.00 23.12 21.45 1nso s ALA 106 CO 0.04 0.42 0.56 0.43 0.00 0.00 0.00 175.76 177.20