#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 3.05 -0.02 -1.67 0.11 -1.26 -4.84 120.40 115.76 1nso s VAL 2 Ca 0.00 -1.91 0.03 0.00 -2.93 0.00 0.00 61.98 57.17 1nso s VAL 2 Cb 0.00 -2.56 -0.00 0.00 -1.53 0.00 0.00 36.38 32.29 1nso s VAL 2 CO 0.00 -0.24 -0.10 -1.58 -3.33 0.00 0.00 175.10 169.85 1nso s GLN 3 N -3.17 0.97 0.39 1.54 -0.44 -1.23 -5.08 119.66 112.65 1nso s GLN 3 Ca 0.27 -0.37 -0.24 0.00 -2.50 0.00 0.00 55.36 52.52 1nso s GLN 3 Cb -0.07 -0.92 -0.09 0.00 -1.64 0.00 0.00 33.01 30.29 1nso s GLN 3 CO 0.16 0.18 1.06 -1.25 0.50 0.00 0.00 175.29 175.95 1nso s PRO 4 N -0.04 4.17 -0.01 1.67 0.04 -1.26 -3.96 135.00 135.60 1nso s PRO 4 Ca 0.01 1.56 -0.22 0.00 0.04 0.00 0.00 61.00 62.39 1nso s PRO 4 Cb -0.07 -2.58 -0.05 0.00 0.04 0.00 0.00 34.50 31.84 1nso s PRO 4 CO 0.00 -0.15 0.64 -1.50 0.04 0.00 0.00 177.00 176.04 1nso s ILE 5 N -1.61 4.92 -0.25 0.56 2.07 -1.26 -4.91 121.20 120.72 1nso s ILE 5 Ca 0.57 1.35 -0.12 0.00 -1.41 0.00 0.00 60.65 61.04 1nso s ILE 5 Cb -0.23 -3.98 -0.05 0.00 0.13 0.00 0.00 42.46 38.32 1nso s ILE 5 CO 0.29 0.37 0.21 -0.89 -1.91 0.00 0.00 174.94 173.01 1nso s THR 6 N 0.09 5.32 0.04 4.00 2.01 -1.26 -4.98 115.64 120.86 1nso s THR 6 Ca 0.34 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.60 1nso s THR 6 Cb -0.18 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 68.78 1nso s THR 6 CO 0.18 0.29 0.00 0.00 -0.69 0.00 0.00 174.62 174.41 1nso n ALA 7 N 4.61 -0.44 -3.35 7.40 0.00 -1.26 -4.38 120.51 123.09 1nso n ALA 7 Ca -0.14 0.05 -0.46 0.00 0.00 0.00 0.00 53.44 52.89 1nso n ALA 7 Cb 0.52 -0.15 -0.02 0.00 0.00 0.00 0.00 19.45 19.79 1nso n ALA 7 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1nso s GLN 8 N -0.26 3.54 0.11 0.00 -1.52 -1.26 -5.01 119.66 115.25 1nso s GLN 8 Ca 0.00 -2.45 -0.06 0.00 -1.95 0.00 0.00 55.36 50.90 1nso s GLN 8 Cb 0.00 -4.39 -0.02 0.00 -0.22 0.00 0.00 33.01 28.38 1nso s GLN 8 CO 0.00 -1.28 0.14 0.15 -0.25 0.00 0.00 175.29 174.05 1nso s LYS 9 N 0.17 0.90 -1.07 2.91 3.01 -1.26 -4.85 119.74 119.56 1nso s LYS 9 Ca 0.18 -1.17 -0.07 0.00 -1.01 0.00 0.00 55.97 53.89 1nso s LYS 9 Cb -0.11 0.31 -0.10 0.00 -1.01 0.00 0.00 37.83 36.92 1nso s LYS 9 CO -0.08 -0.28 2.65 -0.35 0.51 0.00 0.00 175.35 177.80 1nso n PRO 10 N -0.08 2.71 -3.55 -1.68 -0.04 -0.92 -3.81 135.00 127.64 1nso n PRO 10 Ca -0.11 -1.66 -0.11 0.00 -0.04 0.00 0.00 63.50 61.57 1nso n PRO 10 Cb 0.63 -2.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.48 1nso n PRO 10 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1nso s SER 11 N 2.64 0.27 -0.07 3.54 0.01 -1.25 -4.16 113.70 114.68 1nso s SER 11 Ca 0.55 0.51 -0.29 0.00 1.31 0.00 0.00 55.95 58.03 1nso s SER 11 Cb 0.16 0.97 0.11 0.00 0.21 0.00 0.00 66.02 67.47 1nso s SER 11 CO -0.04 -0.27 0.89 -0.22 0.41 0.00 0.00 173.24 174.02 1nso s LEU 12 N 2.50 -0.42 -0.23 2.44 0.20 -0.94 -4.58 118.68 117.65 1nso s LEU 12 Ca 0.04 0.27 0.01 0.00 0.69 0.00 0.00 54.13 55.15 1nso s LEU 12 Cb -0.13 2.06 0.04 0.00 -0.43 0.00 0.00 46.19 47.72 1nso s LEU 12 CO -0.12 -0.52 -0.12 -0.89 -0.29 0.00 0.00 176.35 174.40 1nso s THR 13 N -2.04 2.32 0.29 3.68 2.01 -1.25 -0.30 115.64 120.34 1nso s THR 13 Ca -0.00 -1.29 0.02 0.00 0.31 0.00 0.00 61.69 60.73 1nso s THR 13 Cb -0.01 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 1nso s THR 13 CO -0.02 0.19 0.14 -0.76 -0.69 0.00 0.00 174.62 173.48 1nso s LEU 14 N 1.21 1.63 -0.10 4.42 1.43 -0.70 -3.49 118.68 123.09 1nso s LEU 14 Ca -0.03 -1.50 -0.07 0.00 -1.03 0.00 0.00 54.13 51.50 1nso s LEU 14 Cb -0.17 0.16 -0.04 0.00 0.03 0.00 0.00 46.19 46.17 1nso s LEU 14 CO -0.07 -0.84 0.17 0.86 0.23 0.00 0.00 176.35 176.69 1nso s TRP 15 N -3.68 3.61 -0.04 0.29 -0.11 0.46 0.14 118.94 119.60 1nso s TRP 15 Ca 0.36 0.56 0.01 0.00 1.22 0.00 0.00 56.10 58.25 1nso s TRP 15 Cb 0.06 -1.96 0.02 0.00 -1.50 0.00 0.00 33.47 30.09 1nso s TRP 15 CO 0.16 0.72 -0.04 -0.48 -4.62 0.00 0.00 176.95 172.70 1nso s LEU 16 N -1.11 1.33 -0.17 5.86 0.05 -0.30 -0.04 118.68 124.31 1nso s LEU 16 Ca 0.17 -0.10 -0.02 0.00 0.05 0.00 0.00 54.13 54.22 1nso s LEU 16 Cb -0.12 -0.39 0.02 0.00 -2.05 0.00 0.00 46.19 43.65 1nso s LEU 16 CO 0.06 -0.06 0.05 -0.90 -0.55 0.00 0.00 176.35 174.96 1nso n ASP 17 N 4.00 -0.28 0.00 1.48 5.75 -0.92 -2.41 116.55 124.17 1nso n ASP 17 Ca -0.25 -0.05 0.00 0.00 -0.01 0.00 0.00 54.79 54.47 1nso n ASP 17 Cb 0.51 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 1nso n ASP 17 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1nso n ASP 18 N -0.12 0.00 -3.68 -1.12 9.92 -1.26 -5.09 116.55 115.20 1nso n ASP 18 Ca 0.01 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.25 1nso n ASP 18 Cb 0.10 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.57 1nso n ASP 18 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 1nso s LYS 19 N 0.00 0.84 0.58 -1.24 -2.85 -1.01 -5.14 119.74 110.91 1nso s LYS 19 Ca 0.00 -0.45 -0.19 0.00 -1.00 0.00 0.00 55.97 54.33 1nso s LYS 19 Cb 0.00 0.30 -0.04 0.00 -2.06 0.00 0.00 37.83 36.03 1nso s LYS 19 CO 0.00 -0.38 1.18 -1.64 0.10 0.00 0.00 175.35 174.61 1nso s MET 20 N -2.93 3.09 0.29 1.78 -1.94 -1.26 -1.15 119.30 117.18 1nso s MET 20 Ca 0.12 1.76 -0.19 0.00 -1.71 0.00 0.00 55.69 55.67 1nso s MET 20 Cb 0.01 -1.95 0.07 0.00 2.01 0.00 0.00 34.83 34.96 1nso s MET 20 CO -0.01 -1.10 0.93 -0.59 -0.01 0.00 0.00 175.02 174.24 1nso s PHE 21 N -1.65 0.11 -0.20 -0.03 -0.71 0.12 -4.89 117.98 110.73 1nso s PHE 21 Ca 0.76 -0.66 -0.12 0.00 -1.04 0.00 0.00 56.93 55.87 1nso s PHE 21 Cb -0.28 0.78 -0.05 0.00 -1.21 0.00 0.00 43.02 42.25 1nso s PHE 21 CO 0.31 -1.25 0.22 0.95 -1.34 0.00 0.00 175.22 174.11 1nso s THR 22 N -2.14 5.34 0.17 -4.49 -4.23 -1.26 -1.71 115.64 107.31 1nso s THR 22 Ca 0.19 0.35 0.02 0.00 -1.18 0.00 0.00 61.69 61.07 1nso s THR 22 Cb -0.04 -3.56 -0.01 0.00 1.34 0.00 0.00 72.50 70.24 1nso s THR 22 CO 0.08 0.38 0.06 0.61 -0.54 0.00 0.00 174.62 175.22 1nso n GLY 23 N 3.74 3.73 3.09 3.99 0.00 0.59 -5.00 105.19 115.34 1nso n GLY 23 Ca -0.14 -1.98 -0.31 0.00 0.00 0.00 0.00 46.02 43.59 1nso n GLY 23 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1nso s LEU 24 N 0.00 1.90 -0.25 0.99 -0.00 -1.26 -2.21 118.68 117.85 1nso s LEU 24 Ca 0.09 -0.54 -0.07 0.00 -0.00 0.00 0.00 54.13 53.62 1nso s LEU 24 Cb 0.00 -1.29 -0.02 0.00 -0.00 0.00 0.00 46.19 44.88 1nso s LEU 24 CO 0.06 0.01 0.06 -0.63 -0.00 0.00 0.00 176.35 175.85 1nso s ILE 25 N 1.15 4.18 -0.40 1.48 -1.09 -1.25 -4.55 121.20 120.73 1nso s ILE 25 Ca -0.01 -0.26 -0.04 0.00 -2.23 0.00 0.00 60.65 58.12 1nso s ILE 25 Cb -0.14 -2.97 0.10 0.00 -1.58 0.00 0.00 42.46 37.87 1nso s ILE 25 CO -0.07 0.32 0.19 0.54 -1.23 0.00 0.00 174.94 174.69 1nso s ASN 26 N 1.59 5.26 0.60 3.58 4.22 -1.26 -2.15 114.94 126.78 1nso s ASN 26 Ca 0.06 -1.86 0.29 0.00 -2.14 0.00 0.00 52.86 49.21 1nso s ASN 26 Cb -0.15 -1.84 1.26 0.00 1.28 0.00 0.00 41.25 41.80 1nso s ASN 26 CO 0.03 -0.51 1.64 0.00 -2.04 0.00 0.00 177.10 176.22 1nso h THR 27 N 6.34 0.19 -2.42 0.54 1.03 -1.89 -2.40 112.91 114.31 1nso h THR 27 Ca -0.16 0.00 -0.67 0.00 -0.01 0.00 0.00 66.41 65.58 1nso h THR 27 Cb 1.05 0.35 -0.38 0.00 -1.07 0.00 0.00 68.15 68.11 1nso h THR 27 CO 0.69 0.00 -0.15 0.61 -0.01 0.00 0.00 175.52 176.66 1nso n GLY 28 N -1.60 4.97 3.89 2.99 0.00 -1.26 -4.91 105.19 109.26 1nso n GLY 28 Ca 0.15 -2.74 -0.29 0.00 0.00 0.00 0.00 46.02 43.14 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 -2.63 3.44 0.00 4.61 0.00 -0.91 -4.97 121.76 121.31 1nso s ALA 29 Ca 0.37 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.93 1nso s ALA 29 Cb 0.12 -2.55 0.00 0.00 0.00 0.00 0.00 23.12 20.69 1nso s ALA 29 CO 0.02 -0.05 0.00 -0.40 0.00 0.00 0.00 175.76 175.33 1nso n ASP 30 N -1.51 0.00 -4.01 0.00 5.68 -1.26 -4.28 116.55 111.17 1nso n ASP 30 Ca 0.01 0.00 -0.25 0.00 -0.50 0.00 0.00 54.79 54.05 1nso n ASP 30 Cb 0.54 0.00 -0.17 0.00 -1.14 0.00 0.00 41.12 40.36 1nso n ASP 30 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1nso s VAL 31 N -1.00 1.12 -0.47 2.12 0.11 -1.26 -4.77 120.40 116.24 1nso s VAL 31 Ca 0.00 -0.45 -0.26 0.00 -2.93 0.00 0.00 61.98 58.34 1nso s VAL 31 Cb 0.00 -1.04 0.03 0.00 -1.53 0.00 0.00 36.38 33.84 1nso s VAL 31 CO 0.00 0.36 0.95 0.42 -3.33 0.00 0.00 175.10 173.50 1nso s THR 32 N 0.81 4.43 -0.01 5.04 -4.23 -1.26 -4.37 115.64 116.05 1nso s THR 32 Ca -0.12 0.74 0.01 0.00 -1.18 0.00 0.00 61.69 61.14 1nso s THR 32 Cb -0.15 -4.47 0.01 0.00 1.34 0.00 0.00 72.50 69.23 1nso s THR 32 CO 0.02 -0.89 -0.04 -0.63 -0.54 0.00 0.00 174.62 172.54 1nso s ILE 33 N 3.86 0.38 -0.16 2.99 -1.09 0.15 -1.38 121.20 125.95 1nso s ILE 33 Ca 0.37 -0.15 -0.04 0.00 -2.23 0.00 0.00 60.65 58.61 1nso s ILE 33 Cb -0.10 -0.36 0.06 0.00 -1.58 0.00 0.00 42.46 40.48 1nso s ILE 33 CO 0.26 0.13 0.06 -0.51 -1.23 0.00 0.00 174.94 173.65 1nso s ILE 34 N 0.24 0.21 1.00 2.92 1.10 0.46 -0.34 121.20 126.80 1nso s ILE 34 Ca -0.02 -0.26 -0.17 0.00 -0.51 0.00 0.00 60.65 59.68 1nso s ILE 34 Cb -0.06 -0.73 -0.05 0.00 0.15 0.00 0.00 42.46 41.77 1nso s ILE 34 CO -0.00 -0.17 -0.33 2.29 -2.11 0.00 0.00 174.94 174.62 1nso n LYS 35 N 5.17 -0.37 0.16 3.50 -0.00 -1.26 -3.27 118.16 122.09 1nso n LYS 35 Ca -0.08 -0.09 0.02 0.00 -0.00 0.00 0.00 58.31 58.17 1nso n LYS 35 Cb 0.48 -1.43 0.23 0.00 -0.00 0.00 0.00 35.03 34.31 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 -1.39 0.00 -2.09 -5.58 6.46 -0.99 -3.13 115.31 108.59 1nso h LEU 36 Ca -0.45 0.00 0.04 0.00 -0.12 0.00 0.00 57.88 57.35 1nso h LEU 36 Cb 1.32 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.24 1nso h LEU 36 CO 0.29 0.50 0.32 -0.33 -0.62 0.00 0.00 178.44 178.61 1nso h GLU 37 N 0.00 0.00 -0.29 1.25 5.08 -1.90 0.16 114.58 118.88 1nso h GLU 37 Ca -0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1nso h GLU 37 Cb 1.04 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.25 1nso h GLU 37 CO 0.06 0.00 -0.02 -0.25 -1.00 0.00 0.00 179.01 177.81 1nso n ASP 38 N -3.25 3.21 -4.84 1.42 9.92 -1.18 -5.01 116.55 116.81 1nso n ASP 38 Ca 0.01 -3.34 -0.32 0.00 -0.53 0.00 0.00 54.79 50.61 1nso n ASP 38 Cb 0.42 -0.58 -0.05 0.00 -0.64 0.00 0.00 41.12 40.26 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 -3.01 3.38 -0.39 1.24 -0.00 0.57 -5.03 118.94 115.70 1nso s TRP 39 Ca 0.43 0.21 -0.32 0.00 -0.00 0.00 0.00 56.10 56.41 1nso s TRP 39 Cb 0.37 -1.73 -0.10 0.00 -0.00 0.00 0.00 33.47 32.01 1nso s TRP 39 CO 0.05 0.57 2.27 -2.30 -0.00 0.00 0.00 176.95 177.54 1nso n PRO 40 N 0.64 1.19 0.00 5.86 -0.02 -1.26 -4.81 135.00 136.60 1nso n PRO 40 Ca -0.09 0.28 0.09 0.00 -2.02 0.00 0.00 63.50 61.76 1nso n PRO 40 Cb 0.52 -2.71 0.40 0.00 -0.02 0.00 0.00 33.50 31.68 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 8.47 0.06 -0.32 0.52 -0.04 -1.26 -3.19 135.00 139.23 1nso n PRO 41 Ca 0.40 0.18 -0.04 0.00 -0.04 0.00 0.00 63.50 64.00 1nso n PRO 41 Cb 0.31 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.35 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 1.01 -4.27 3.54 -0.73 -2.05 -3.43 115.58 109.65 1nso h ASN 42 Ca 0.00 -0.05 -0.52 0.00 1.87 0.00 0.00 56.30 57.61 1nso h ASN 42 Cb 0.28 -0.25 -0.22 0.00 0.27 0.00 0.00 38.32 38.39 1nso h ASN 42 CO 0.00 0.76 -0.81 -1.66 -0.37 0.00 0.00 177.43 175.34 1nso s TRP 43 N -6.05 1.62 0.52 0.67 -2.14 -1.19 -5.14 118.94 107.23 1nso s TRP 43 Ca -0.13 -0.42 -0.19 0.00 2.66 0.00 0.00 56.10 58.02 1nso s TRP 43 Cb 0.16 -0.90 -0.07 0.00 -3.10 0.00 0.00 33.47 29.56 1nso s TRP 43 CO 0.80 0.15 1.07 -1.25 -2.66 0.00 0.00 176.95 175.06 1nso s PRO 44 N -1.74 3.58 0.33 3.25 0.04 -1.26 -4.86 135.00 134.33 1nso s PRO 44 Ca 0.04 1.42 0.04 0.00 0.04 0.00 0.00 61.00 62.54 1nso s PRO 44 Cb -0.10 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 1nso s PRO 44 CO 0.03 -0.63 0.15 0.96 0.04 0.00 0.00 177.00 177.56 1nso s ILE 45 N -1.98 0.42 1.32 0.56 -5.25 -1.26 -5.14 121.20 109.87 1nso s ILE 45 Ca 0.69 -2.00 -0.22 0.00 -0.99 0.00 0.00 60.65 58.12 1nso s ILE 45 Cb -0.19 -2.50 0.33 0.00 2.95 0.00 0.00 42.46 43.06 1nso s ILE 45 CO 0.25 0.00 1.00 0.35 -1.79 0.00 0.00 174.94 174.75 1nso n THR 46 N -0.65 0.00 0.00 8.37 -2.24 -1.26 -4.80 114.28 113.69 1nso n THR 46 Ca -0.00 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1nso n THR 46 Cb 0.65 -1.14 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 1nso n THR 46 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1nso n ASP 47 N -5.24 0.00 -3.87 3.42 2.03 0.10 -3.54 116.55 109.45 1nso n ASP 47 Ca 0.15 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.16 1nso n ASP 47 Cb 0.59 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.84 1nso n ASP 47 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1nso s THR 48 N 0.00 1.29 0.63 5.18 -1.32 -1.24 -2.65 115.64 117.53 1nso s THR 48 Ca 0.00 -1.28 0.06 0.00 -1.21 0.00 0.00 61.69 59.26 1nso s THR 48 Cb 0.00 -1.74 0.11 0.00 -1.51 0.00 0.00 72.50 69.36 1nso s THR 48 CO 0.00 -0.31 0.87 -0.22 -2.21 0.00 0.00 174.62 172.75 1nso s LEU 49 N 1.47 3.05 -0.21 9.08 2.96 -0.13 -4.88 118.68 130.01 1nso s LEU 49 Ca 0.01 -0.68 -0.07 0.00 -0.22 0.00 0.00 54.13 53.16 1nso s LEU 49 Cb -0.18 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1nso s LEU 49 CO -0.11 -1.56 0.05 -0.89 -1.32 0.00 0.00 176.35 172.52 1nso s THR 50 N -2.85 4.42 -0.53 3.68 2.01 -1.26 -0.04 115.64 121.06 1nso s THR 50 Ca 0.64 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 62.53 1nso s THR 50 Cb -0.05 -3.02 0.17 0.00 0.01 0.00 0.00 72.50 69.60 1nso s THR 50 CO 0.41 0.41 0.40 0.21 -0.69 0.00 0.00 174.62 175.35 1nso s ASN 51 N 0.96 3.02 -0.36 3.53 3.84 -0.03 -3.97 114.94 121.93 1nso s ASN 51 Ca 0.03 -3.36 -0.23 0.00 0.21 0.00 0.00 52.86 49.52 1nso s ASN 51 Cb -0.14 -0.98 0.01 0.00 -0.55 0.00 0.00 41.25 39.59 1nso s ASN 51 CO 0.03 -0.14 0.79 -0.76 -2.79 0.00 0.00 177.10 174.22 1nso s LEU 52 N -0.54 4.12 -0.01 3.21 2.01 -1.19 0.01 118.68 126.29 1nso s LEU 52 Ca 0.28 0.38 0.03 0.00 0.01 0.00 0.00 54.13 54.84 1nso s LEU 52 Cb -0.02 -3.03 0.11 0.00 0.01 0.00 0.00 46.19 43.26 1nso s LEU 52 CO -0.17 -0.73 0.99 0.54 1.01 0.00 0.00 176.35 177.99 1nso n ARG 53 N 6.41 1.36 0.00 1.70 1.74 -1.04 -4.86 116.66 121.98 1nso n ARG 53 Ca 0.03 -0.44 0.00 0.00 -0.77 0.00 0.00 57.85 56.67 1nso n ARG 53 Cb 0.48 -1.23 0.00 0.00 -1.02 0.00 0.00 32.46 30.70 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 0.54 1.23 0.00 -0.13 0.00 -1.26 -2.77 105.19 102.80 1nso n GLY 54 Ca 0.04 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.64 -0.61 -5.35 -1.26 -4.51 119.36 104.98 1nso n ILE 55 Ca 0.00 -0.15 -0.25 0.00 -0.27 0.00 0.00 62.75 62.08 1nso n ILE 55 Cb 0.00 0.86 -0.01 0.00 -1.74 0.00 0.00 39.64 38.75 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 1.42 5.48 3.51 3.28 0.00 -1.11 -5.04 105.19 112.72 1nso n GLY 56 Ca 0.02 -2.63 -0.27 0.00 0.00 0.00 0.00 46.02 43.14 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 -0.36 0.10 -4.32 1.61 10.64 -1.26 -2.48 117.38 121.30 1nso n GLN 57 Ca 0.34 -0.08 -0.29 0.00 -1.83 0.00 0.00 57.00 55.14 1nso n GLN 57 Cb 0.60 -1.52 -0.05 0.00 -0.86 0.00 0.00 30.24 28.41 1nso n GLN 57 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1nso s SER 58 N 4.26 4.36 -0.15 2.61 0.15 0.10 -4.86 113.70 120.17 1nso s SER 58 Ca 1.28 -1.40 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1nso s SER 58 Cb -0.87 0.31 -0.00 0.00 -1.71 0.00 0.00 66.02 63.74 1nso s SER 58 CO 0.49 -0.90 -0.15 0.20 1.20 0.00 0.00 173.24 174.08 1nso s ASN 59 N -4.04 3.70 1.03 5.45 -0.87 -1.23 -0.85 114.94 118.13 1nso s ASN 59 Ca 0.23 -0.45 -0.12 0.00 -1.57 0.00 0.00 52.86 50.95 1nso s ASN 59 Cb 0.01 -1.56 0.21 0.00 -0.02 0.00 0.00 41.25 39.88 1nso s ASN 59 CO 0.13 0.10 1.08 0.20 -2.57 0.00 0.00 177.10 176.05 1nso s ASN 60 N 0.70 2.30 -0.24 -1.22 -0.87 0.94 -4.50 114.94 112.04 1nso s ASN 60 Ca -0.07 1.28 -0.06 0.00 -1.57 0.00 0.00 52.86 52.44 1nso s ASN 60 Cb -0.16 -1.97 -0.02 0.00 -0.02 0.00 0.00 41.25 39.09 1nso s ASN 60 CO 0.02 -3.35 0.02 -2.16 -2.57 0.00 0.00 177.10 169.06 1nso s PRO 61 N -4.86 3.46 0.16 -0.60 0.04 -1.26 -0.96 135.00 130.99 1nso s PRO 61 Ca 0.66 -0.59 -0.05 0.00 0.04 0.00 0.00 61.00 61.06 1nso s PRO 61 Cb -0.20 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.12 1nso s PRO 61 CO 0.59 -0.22 0.18 0.15 0.04 0.00 0.00 177.00 177.74 1nso s LYS 62 N 1.54 1.09 -0.18 4.56 1.02 -1.09 -4.81 119.74 121.87 1nso s LYS 62 Ca 0.06 -1.35 -0.26 0.00 0.02 0.00 0.00 55.97 54.43 1nso s LYS 62 Cb -0.15 0.31 0.07 0.00 -0.52 0.00 0.00 37.83 37.54 1nso s LYS 62 CO 0.00 -0.36 0.67 1.14 -0.92 0.00 0.00 175.35 175.89 1nso s GLN 63 N -4.03 0.89 0.52 1.68 0.00 -1.26 0.03 119.66 117.48 1nso s GLN 63 Ca 0.23 0.69 -0.22 0.00 -0.00 0.00 0.00 55.36 56.07 1nso s GLN 63 Cb 0.05 0.43 -0.06 0.00 0.00 0.00 0.00 33.01 33.42 1nso s GLN 63 CO 0.03 -0.18 1.17 0.45 0.00 0.00 0.00 175.29 176.77 1nso n SER 64 N 2.06 1.86 -0.00 12.60 2.88 -0.84 -4.61 113.62 127.58 1nso n SER 64 Ca -0.16 0.95 0.02 0.00 -1.33 0.00 0.00 58.87 58.35 1nso n SER 64 Cb 0.56 -1.47 -0.03 0.00 -0.75 0.00 0.00 64.21 62.52 1nso n SER 64 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1nso n SER 65 N -0.51 3.74 0.00 -3.46 7.64 -1.25 -0.34 113.62 119.44 1nso n SER 65 Ca 0.11 -0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.92 1nso n SER 65 Cb 0.44 1.14 0.00 0.00 -1.01 0.00 0.00 64.21 64.78 1nso n SER 65 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1nso n LYS 66 N -1.56 0.00 -1.83 1.43 3.00 -1.26 -3.53 118.16 114.40 1nso n LYS 66 Ca -0.00 0.00 -0.42 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 1.52 -0.40 5.64 1.51 -1.26 -4.26 117.35 120.10 1nso s TYR 67 Ca 0.00 0.71 -0.26 0.00 -1.01 0.00 0.00 57.07 56.51 1nso s TYR 67 Cb 0.00 -4.01 0.02 0.00 -0.11 0.00 0.00 41.96 37.86 1nso s TYR 67 CO 0.00 -3.21 0.95 -1.17 -1.11 0.00 0.00 175.55 171.00 1nso s LEU 68 N 8.08 3.97 -0.21 -1.29 2.96 0.13 -4.84 118.68 127.47 1nso s LEU 68 Ca 0.87 0.46 -0.22 0.00 -0.22 0.00 0.00 54.13 55.02 1nso s LEU 68 Cb -0.24 -3.27 -0.02 0.00 0.50 0.00 0.00 46.19 43.16 1nso s LEU 68 CO 0.32 -0.94 0.72 0.42 -1.32 0.00 0.00 176.35 175.55 1nso s THR 69 N 3.63 4.94 -0.05 3.68 -4.23 -1.26 -2.42 115.64 119.93 1nso s THR 69 Ca 0.39 1.35 0.03 0.00 -1.18 0.00 0.00 61.69 62.28 1nso s THR 69 Cb -0.11 -4.02 0.00 0.00 1.34 0.00 0.00 72.50 69.71 1nso s THR 69 CO 0.22 0.04 -0.15 0.86 -0.54 0.00 0.00 174.62 175.04 1nso s TRP 70 N 2.29 1.57 -0.10 3.99 -0.00 -0.18 -2.17 118.94 124.34 1nso s TRP 70 Ca 0.32 -0.50 -0.19 0.00 -0.00 0.00 0.00 56.10 55.73 1nso s TRP 70 Cb -0.16 -1.09 0.04 0.00 -0.00 0.00 0.00 33.47 32.26 1nso s TRP 70 CO 0.10 -0.21 0.46 -0.98 -0.00 0.00 0.00 176.95 176.32 1nso s ARG 71 N 0.28 0.69 0.67 5.86 3.03 0.95 -0.32 118.95 130.10 1nso s ARG 71 Ca -0.08 0.30 -0.11 0.00 2.03 0.00 0.00 55.73 57.87 1nso s ARG 71 Cb -0.13 0.32 -0.01 0.00 -1.03 0.00 0.00 34.95 34.11 1nso s ARG 71 CO 0.03 -0.15 1.06 0.34 -1.13 0.00 0.00 175.30 175.45 1nso s ASP 72 N -0.54 5.72 0.46 -2.89 -1.08 0.46 -0.41 116.67 118.39 1nso s ASP 72 Ca -0.07 1.34 0.42 0.00 -0.52 0.00 0.00 52.55 53.72 1nso s ASP 72 Cb -0.03 -2.25 1.45 0.00 -1.46 0.00 0.00 42.92 40.63 1nso s ASP 72 CO 0.04 -1.19 1.31 1.17 0.52 0.00 0.00 175.17 177.02 1nso n LYS 73 N -2.94 -0.00 0.00 4.34 4.81 -1.26 0.28 118.16 123.39 1nso n LYS 73 Ca 0.07 0.91 0.00 0.00 -0.87 0.00 0.00 58.31 58.42 1nso n LYS 73 Cb 0.55 -2.10 0.00 0.00 0.02 0.00 0.00 35.03 33.50 1nso n LYS 73 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1nso n GLU 74 N -3.64 0.74 -3.12 1.64 4.07 -1.26 -4.83 120.64 114.25 1nso n GLU 74 Ca 0.37 0.00 -0.14 0.00 -0.06 0.00 0.00 57.16 57.34 1nso n GLU 74 Cb 1.69 -1.01 0.06 0.00 -0.06 0.00 0.00 31.44 32.12 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 -0.48 -2.84 0.00 4.31 5.15 0.80 -5.02 115.26 117.19 1nso n ASN 75 Ca 0.00 -0.44 0.00 0.00 -0.60 0.00 0.00 54.58 53.54 1nso n ASN 75 Cb 0.01 -3.88 0.00 0.00 -0.53 0.00 0.00 39.78 35.37 1nso n ASN 75 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1nso n ASN 76 N -2.37 0.00 0.00 1.20 0.23 -1.04 -4.86 115.26 108.41 1nso n ASN 76 Ca -0.16 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.89 1nso n ASN 76 Cb 0.60 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.30 1nso n ASN 76 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 1nso n SER 77 N 0.00 0.00 0.00 0.53 2.88 -1.25 -0.41 113.62 115.38 1nso n SER 77 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1nso n SER 77 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 3.19 2.97 0.46 0.00 0.56 -4.02 105.19 108.35 1nso n GLY 78 Ca 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 0.40 0.00 0.99 0.05 -1.25 -1.01 118.68 117.86 1nso s LEU 79 Ca 0.00 0.42 -0.07 0.00 0.05 0.00 0.00 54.13 54.53 1nso s LEU 79 Cb 0.00 0.53 0.03 0.00 -2.05 0.00 0.00 46.19 44.70 1nso s LEU 79 CO 0.00 -0.18 0.40 2.30 -0.55 0.00 0.00 176.35 178.33 1nso n ILE 80 N 4.47 0.00 -3.48 1.48 -0.00 -1.02 -4.95 119.36 115.87 1nso n ILE 80 Ca -0.21 -0.61 -0.43 0.00 -0.00 0.00 0.00 62.75 61.50 1nso n ILE 80 Cb 0.52 0.55 -0.07 0.00 -0.00 0.00 0.00 39.64 40.63 1nso n ILE 80 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.55 174.96 1nso s LYS 81 N -2.11 2.65 0.67 6.28 -2.85 -1.26 0.18 119.74 123.30 1nso s LYS 81 Ca 0.10 -1.76 -0.03 0.00 -1.00 0.00 0.00 55.97 53.28 1nso s LYS 81 Cb -0.02 -4.05 0.14 0.00 -2.06 0.00 0.00 37.83 31.83 1nso s LYS 81 CO 0.07 -1.24 0.91 -0.35 0.10 0.00 0.00 175.35 174.84 1nso n PRO 82 N 4.99 -0.20 -3.64 1.78 -0.04 -1.23 -4.97 135.00 131.69 1nso n PRO 82 Ca -0.09 -2.25 -0.37 0.00 -0.04 0.00 0.00 63.50 60.74 1nso n PRO 82 Cb 0.41 -0.68 -0.11 0.00 -0.04 0.00 0.00 33.50 33.07 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 -2.78 3.19 -0.34 0.54 0.08 -0.48 -3.94 117.98 114.24 1nso s PHE 83 Ca 0.59 -0.03 -0.11 0.00 0.12 0.00 0.00 56.93 57.50 1nso s PHE 83 Cb -0.03 -2.33 0.01 0.00 -0.57 0.00 0.00 43.02 40.09 1nso s PHE 83 CO 0.39 -0.20 0.19 0.08 -0.10 0.00 0.00 175.22 175.58 1nso s VAL 84 N 1.68 4.68 0.02 -0.44 1.01 0.54 -0.40 120.40 127.49 1nso s VAL 84 Ca 0.07 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.55 1nso s VAL 84 Cb -0.16 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 1nso s VAL 84 CO 0.09 -0.07 -0.24 -0.63 0.00 0.00 0.00 175.10 174.25 1nso s ILE 85 N 1.60 1.90 -0.25 2.22 1.01 -1.24 -1.99 121.20 124.45 1nso s ILE 85 Ca 0.04 -1.17 -0.04 0.00 0.00 0.00 0.00 60.65 59.47 1nso s ILE 85 Cb -0.18 -1.61 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 1nso s ILE 85 CO 0.07 0.40 2.95 -0.81 0.00 0.00 0.00 174.94 177.54 1nso n PRO 86 N 2.11 2.11 -0.18 2.79 -0.04 -1.26 -0.40 135.00 140.12 1nso n PRO 86 Ca -0.16 -1.64 0.00 0.00 -0.04 0.00 0.00 63.50 61.66 1nso n PRO 86 Cb 0.52 -1.96 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1nso n PRO 86 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1nso n ASN 87 N 1.44 0.00 -2.46 3.54 0.23 -1.26 -4.95 115.26 111.81 1nso n ASN 87 Ca 0.42 -1.28 -0.05 0.00 -0.53 0.00 0.00 54.58 53.14 1nso n ASN 87 Cb 0.68 -0.06 0.01 0.00 -2.08 0.00 0.00 39.78 38.33 1nso n ASN 87 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1nso n LEU 88 N 0.00 -6.01 0.00 -4.53 7.94 -1.24 -4.85 117.00 108.31 1nso n LEU 88 Ca 0.00 0.31 0.01 0.00 -1.11 0.00 0.00 56.01 55.22 1nso n LEU 88 Cb 0.56 -2.66 0.04 0.00 0.53 0.00 0.00 43.42 41.88 1nso n LEU 88 CO 0.00 -1.51 0.26 -2.65 -1.11 0.00 0.00 177.39 172.38 1nso n PRO 89 N -0.53 0.46 -0.05 1.96 -0.02 -1.26 -4.71 135.00 130.84 1nso n PRO 89 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1nso n PRO 89 Cb 0.34 -1.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.78 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 -0.54 0.00 -2.91 -1.45 0.31 -1.26 -4.67 118.33 107.81 1nso n VAL 90 Ca 0.01 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.28 1nso n VAL 90 Cb 0.00 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 1nso n VAL 90 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1nso n ASN 91 N 0.00 -7.54 -4.18 4.52 4.13 -1.26 -5.03 115.26 105.90 1nso n ASN 91 Ca 0.00 0.89 -0.24 0.00 1.68 0.00 0.00 54.58 56.90 1nso n ASN 91 Cb 0.00 -4.38 -0.15 0.00 -1.54 0.00 0.00 39.78 33.71 1nso n ASN 91 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1nso s LEU 92 N -1.85 2.08 0.00 3.41 2.01 0.54 -4.82 118.68 120.04 1nso s LEU 92 Ca 0.10 -0.38 0.04 0.00 0.01 0.00 0.00 54.13 53.90 1nso s LEU 92 Cb -0.02 -0.88 0.11 0.00 0.01 0.00 0.00 46.19 45.40 1nso s LEU 92 CO 0.66 0.18 0.80 1.87 1.01 0.00 0.00 176.35 180.87 1nso n TRP 93 N 2.40 -2.70 -3.93 0.29 -0.00 -1.26 0.32 117.44 112.55 1nso n TRP 93 Ca -0.16 -1.71 -0.29 0.00 -0.00 0.00 0.00 57.50 55.35 1nso n TRP 93 Cb 0.54 -0.57 -0.04 0.00 -0.00 0.00 0.00 31.31 31.24 1nso n TRP 93 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 177.69 177.89 1nso s GLY 94 N -4.57 2.00 0.28 5.87 0.00 -1.26 -4.12 107.32 105.52 1nso s GLY 94 Ca 0.56 -0.92 0.02 0.00 0.00 0.00 0.00 44.72 44.38 1nso s GLY 94 CO 0.37 -0.91 1.71 3.21 0.00 0.00 0.00 173.10 177.47 1nso h ARG 95 N 2.72 0.41 -0.43 2.90 3.08 -1.86 -0.33 114.38 120.87 1nso h ARG 95 Ca -0.46 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 59.64 1nso h ARG 95 Cb 1.17 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 31.06 1nso h ARG 95 CO 0.73 0.27 0.02 0.22 -1.07 0.00 0.00 179.97 180.14 1nso h ASP 96 N 0.42 -0.14 0.65 7.04 3.58 -1.94 0.21 116.42 126.24 1nso h ASP 96 Ca 0.53 0.10 -0.22 0.00 0.42 0.00 0.00 57.03 57.86 1nso h ASP 96 Cb 0.96 0.16 -0.01 0.00 1.72 0.00 0.00 39.33 42.16 1nso h ASP 96 CO -0.50 -0.04 -0.99 -0.07 -2.88 0.00 0.00 179.24 174.77 1nso h LEU 97 N 0.13 0.27 -1.23 2.28 -0.00 -1.58 -2.89 115.31 112.29 1nso h LEU 97 Ca 0.21 -0.24 -0.06 0.00 -0.00 0.00 0.00 57.88 57.79 1nso h LEU 97 Cb 0.30 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 40.87 1nso h LEU 97 CO -0.34 1.10 -0.29 -0.07 -0.00 0.00 0.00 178.44 178.84 1nso h LEU 98 N 0.09 0.00 0.14 1.67 -0.00 -0.66 0.41 115.31 116.96 1nso h LEU 98 Ca -0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.81 1nso h LEU 98 Cb 1.66 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.32 1nso h LEU 98 CO 0.15 0.29 -0.07 -1.28 -0.00 0.00 0.00 178.44 177.53 1nso h SER 99 N 0.00 -0.16 -0.07 -0.43 0.87 -0.52 0.90 113.55 114.14 1nso h SER 99 Ca -0.00 -0.36 -0.15 0.00 -1.23 0.00 0.00 61.79 60.06 1nso h SER 99 Cb 0.71 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.71 1nso h SER 99 CO 0.04 0.31 -0.45 1.56 -0.53 0.00 0.00 176.83 177.76 1nso h GLN 100 N -0.68 0.62 0.00 2.24 4.20 -1.40 0.41 115.11 120.50 1nso h GLN 100 Ca -0.02 -0.34 -0.09 0.00 0.06 0.00 0.00 58.65 58.26 1nso h GLN 100 Cb 0.50 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1nso h GLN 100 CO 0.03 0.94 -0.41 0.52 -0.67 0.00 0.00 178.83 179.25 1nso h MET 101 N 0.50 0.00 0.00 1.46 2.86 -0.20 -3.38 114.93 116.16 1nso h MET 101 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1nso h MET 101 Cb 0.98 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.64 1nso h MET 101 CO 0.09 0.41 0.00 1.17 1.06 0.00 0.00 176.91 179.64 1nso n LYS 102 N -3.40 0.08 0.00 1.72 3.00 0.22 -4.92 118.16 114.86 1nso n LYS 102 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1nso n LYS 102 Cb 0.58 -0.32 0.00 0.00 0.00 0.00 0.00 35.03 35.29 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 -0.49 0.00 -1.53 3.15 2.08 0.75 -4.88 119.36 118.44 1nso n ILE 103 Ca 0.00 0.11 -0.38 0.00 0.56 0.00 0.00 62.75 63.05 1nso n ILE 103 Cb 0.00 -0.30 0.05 0.00 -0.75 0.00 0.00 39.64 38.64 1nso n ILE 103 CO 0.00 0.00 0.00 0.80 0.56 0.00 0.00 176.55 177.91 1nso n MET 104 N -0.13 0.68 -1.69 0.38 1.56 0.11 -4.72 117.12 113.30 1nso n MET 104 Ca 0.00 0.27 -0.17 0.00 -0.27 0.00 0.00 57.70 57.53 1nso n MET 104 Cb 0.00 -1.98 -0.10 0.00 2.15 0.00 0.00 33.22 33.30 1nso n MET 104 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1nso s MET 105 N -2.55 1.46 0.20 2.12 0.23 -1.26 -4.76 119.30 114.74 1nso s MET 105 Ca 0.73 -0.45 0.01 0.00 -1.03 0.00 0.00 55.69 54.94 1nso s MET 105 Cb -0.42 -5.00 -0.05 0.00 -1.53 0.00 0.00 34.83 27.83 1nso s MET 105 CO 0.50 -5.11 0.06 0.00 -2.03 0.00 0.00 175.02 168.44 1nso s ALA 106 N 15.69 1.41 -2.00 3.16 0.00 -1.26 -5.16 121.76 133.60 1nso s ALA 106 Ca 0.80 -1.70 0.19 0.00 0.00 0.00 0.00 51.96 51.26 1nso s ALA 106 Cb -0.05 0.89 1.14 0.00 0.00 0.00 0.00 23.12 25.09 1nso s ALA 106 CO 0.16 -0.43 1.53 -1.13 0.00 0.00 0.00 175.76 175.89