#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 5.16 0.09 -0.99 1.01 -1.26 -5.09 120.40 119.31 1nso s VAL 2 Ca 0.00 0.15 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 1nso s VAL 2 Cb 0.00 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.77 1nso s VAL 2 CO 0.00 0.13 0.29 0.00 0.00 0.00 0.00 175.10 175.52 1nso s GLN 3 N -2.40 0.91 0.17 2.72 -2.07 -1.26 -4.75 119.66 112.98 1nso s GLN 3 Ca 0.38 -0.75 -0.30 0.00 -1.82 0.00 0.00 55.36 52.86 1nso s GLN 3 Cb -0.13 0.39 -0.08 0.00 -1.09 0.00 0.00 33.01 32.10 1nso s GLN 3 CO 0.22 -0.31 1.32 -1.25 -1.32 0.00 0.00 175.29 173.95 1nso s PRO 4 N -3.48 4.38 0.06 9.60 0.04 -1.26 -4.48 135.00 139.86 1nso s PRO 4 Ca 0.02 2.03 -0.31 0.00 0.04 0.00 0.00 61.00 62.78 1nso s PRO 4 Cb 0.02 -3.22 -0.07 0.00 0.04 0.00 0.00 34.50 31.27 1nso s PRO 4 CO -0.09 -0.30 1.38 -1.50 0.04 0.00 0.00 177.00 176.54 1nso s ILE 5 N 0.44 3.53 0.58 0.56 1.10 -1.26 -5.01 121.20 121.14 1nso s ILE 5 Ca 0.59 1.03 -0.10 0.00 -0.51 0.00 0.00 60.65 61.66 1nso s ILE 5 Cb -0.36 -3.66 -0.04 0.00 0.15 0.00 0.00 42.46 38.55 1nso s ILE 5 CO 0.35 0.04 0.97 0.42 -2.11 0.00 0.00 174.94 174.62 1nso s THR 6 N 1.66 4.74 0.00 4.00 -4.23 -1.26 -4.89 115.64 115.66 1nso s THR 6 Ca 0.64 0.75 0.00 0.00 -1.18 0.00 0.00 61.69 61.90 1nso s THR 6 Cb -0.34 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 69.64 1nso s THR 6 CO 0.29 -1.05 0.00 0.00 -0.54 0.00 0.00 174.62 173.31 1nso n ALA 7 N -2.56 0.00 -3.90 3.99 0.00 -1.26 -4.56 120.51 112.22 1nso n ALA 7 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.18 1nso n ALA 7 Cb 0.54 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.84 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 0.00 1.24 -0.11 0.00 -1.52 -1.26 -5.08 119.66 112.93 1nso s GLN 8 Ca 0.00 -1.66 -0.14 0.00 -1.95 0.00 0.00 55.36 51.60 1nso s GLN 8 Cb 0.00 -2.75 0.03 0.00 -0.22 0.00 0.00 33.01 30.08 1nso s GLN 8 CO 0.00 -0.98 0.37 -1.59 -0.25 0.00 0.00 175.29 172.84 1nso s LYS 9 N 1.03 0.53 -0.68 2.91 0.00 -1.26 -5.05 119.74 117.21 1nso s LYS 9 Ca 0.11 0.33 -0.05 0.00 0.00 0.00 0.00 55.97 56.36 1nso s LYS 9 Cb -0.19 0.25 -0.04 0.00 0.00 0.00 0.00 37.83 37.84 1nso s LYS 9 CO -0.13 -0.10 1.83 -0.35 0.00 0.00 0.00 175.35 176.60 1nso n PRO 10 N 2.37 1.55 -3.28 1.78 -0.04 -1.23 -4.59 135.00 131.57 1nso n PRO 10 Ca -0.16 -1.23 -0.05 0.00 -0.04 0.00 0.00 63.50 62.02 1nso n PRO 10 Cb 0.57 -2.35 -0.05 0.00 -0.04 0.00 0.00 33.50 31.62 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 3.86 -0.22 -0.08 3.54 0.01 -1.25 -3.84 113.70 115.71 1nso s SER 11 Ca 0.30 0.22 -0.05 0.00 1.31 0.00 0.00 55.95 57.73 1nso s SER 11 Cb 0.08 1.41 0.04 0.00 0.21 0.00 0.00 66.02 67.76 1nso s SER 11 CO -0.02 -0.30 0.19 -0.22 0.41 0.00 0.00 173.24 173.30 1nso s LEU 12 N 2.63 0.74 -0.36 2.44 2.96 -1.02 -4.77 118.68 121.30 1nso s LEU 12 Ca 0.14 0.40 -0.18 0.00 -0.22 0.00 0.00 54.13 54.27 1nso s LEU 12 Cb -0.14 0.56 0.00 0.00 0.50 0.00 0.00 46.19 47.11 1nso s LEU 12 CO -0.21 -0.14 0.50 -0.89 -1.32 0.00 0.00 176.35 174.29 1nso s THR 13 N 0.96 5.02 0.24 3.68 2.01 -1.26 -2.00 115.64 124.29 1nso s THR 13 Ca -0.07 0.22 0.01 0.00 0.31 0.00 0.00 61.69 62.16 1nso s THR 13 Cb -0.09 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 1nso s THR 13 CO -0.06 -0.26 0.19 -0.76 -0.69 0.00 0.00 174.62 173.04 1nso s LEU 14 N 2.36 1.31 0.02 4.42 1.43 0.27 -4.04 118.68 124.45 1nso s LEU 14 Ca 0.18 -1.49 0.01 0.00 -1.03 0.00 0.00 54.13 51.79 1nso s LEU 14 Cb -0.16 0.48 -0.04 0.00 0.03 0.00 0.00 46.19 46.50 1nso s LEU 14 CO 0.14 -0.92 0.06 -1.66 0.23 0.00 0.00 176.35 174.20 1nso s TRP 15 N -3.93 3.21 -0.03 0.29 1.48 0.15 -0.10 118.94 120.01 1nso s TRP 15 Ca 0.39 0.14 -0.05 0.00 -1.06 0.00 0.00 56.10 55.52 1nso s TRP 15 Cb 0.05 -1.69 0.01 0.00 -1.16 0.00 0.00 33.47 30.69 1nso s TRP 15 CO 0.17 0.52 0.13 -0.48 -4.06 0.00 0.00 176.95 173.23 1nso s LEU 16 N -1.90 1.53 -1.46 -4.66 0.05 0.48 -0.49 118.68 112.23 1nso s LEU 16 Ca 0.24 0.09 -0.09 0.00 0.05 0.00 0.00 54.13 54.42 1nso s LEU 16 Cb -0.12 0.52 0.04 0.00 -2.05 0.00 0.00 46.19 44.58 1nso s LEU 16 CO 0.16 -0.16 0.82 0.47 -0.55 0.00 0.00 176.35 177.08 1nso n ASP 17 N 2.46 -5.43 -2.87 1.48 8.00 -1.10 -1.29 116.55 117.80 1nso n ASP 17 Ca -0.16 -0.49 -0.20 0.00 0.71 0.00 0.00 54.79 54.65 1nso n ASP 17 Cb 0.58 -4.35 0.05 0.00 -0.02 0.00 0.00 41.12 37.37 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 -2.67 -5.59 -3.66 -2.24 9.92 -1.26 -5.00 116.55 106.05 1nso n ASP 18 Ca -0.03 -0.36 -0.05 0.00 -0.53 0.00 0.00 54.79 53.82 1nso n ASP 18 Cb 0.57 -4.30 -0.07 0.00 -0.64 0.00 0.00 41.12 36.68 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 -5.84 0.50 0.35 -1.24 2.20 -0.41 -5.15 119.74 110.16 1nso s LYS 19 Ca 0.39 1.23 -0.28 0.00 -0.36 0.00 0.00 55.97 56.95 1nso s LYS 19 Cb -0.17 0.51 -0.10 0.00 -1.51 0.00 0.00 37.83 36.56 1nso s LYS 19 CO 0.48 -0.20 1.30 -1.64 -0.36 0.00 0.00 175.35 174.92 1nso s MET 20 N 2.47 4.25 0.22 4.03 -1.94 -1.26 -0.39 119.30 126.69 1nso s MET 20 Ca -0.06 2.18 -0.15 0.00 -1.71 0.00 0.00 55.69 55.95 1nso s MET 20 Cb -0.11 -2.98 0.06 0.00 2.01 0.00 0.00 34.83 33.81 1nso s MET 20 CO -0.17 -0.26 0.75 0.34 -0.01 0.00 0.00 175.02 175.67 1nso n PHE 21 N 0.61 -1.59 -4.30 -0.03 7.35 0.86 -4.88 117.46 115.48 1nso n PHE 21 Ca 0.01 -1.23 -0.25 0.00 -0.76 0.00 0.00 57.45 55.22 1nso n PHE 21 Cb 0.42 0.61 -0.08 0.00 0.35 0.00 0.00 39.48 40.78 1nso n PHE 21 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1nso s THR 22 N -2.21 3.30 0.35 -2.13 -4.23 -1.26 -0.57 115.64 108.89 1nso s THR 22 Ca 0.16 -1.80 -0.03 0.00 -1.18 0.00 0.00 61.69 58.84 1nso s THR 22 Cb -0.03 -2.70 0.01 0.00 1.34 0.00 0.00 72.50 71.12 1nso s THR 22 CO 0.07 -0.24 0.50 0.61 -0.54 0.00 0.00 174.62 175.02 1nso n GLY 23 N -0.42 2.02 3.17 3.99 0.00 -0.85 -4.95 105.19 108.16 1nso n GLY 23 Ca -0.08 -1.58 -0.34 0.00 0.00 0.00 0.00 46.02 44.02 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 3.04 -0.38 0.99 0.05 -1.26 -2.44 118.68 118.68 1nso s LEU 24 Ca 0.27 -0.89 -0.13 0.00 0.05 0.00 0.00 54.13 53.43 1nso s LEU 24 Cb -0.01 -1.62 0.01 0.00 -2.05 0.00 0.00 46.19 42.52 1nso s LEU 24 CO 0.20 -0.11 0.26 -0.63 -0.55 0.00 0.00 176.35 175.51 1nso s ILE 25 N 1.29 5.09 0.12 1.48 1.01 -1.25 -4.73 121.20 124.22 1nso s ILE 25 Ca -0.00 -0.58 -0.24 0.00 0.00 0.00 0.00 60.65 59.84 1nso s ILE 25 Cb -0.16 -3.77 -0.07 0.00 0.01 0.00 0.00 42.46 38.46 1nso s ILE 25 CO -0.06 -0.20 0.72 0.21 0.00 0.00 0.00 174.94 175.61 1nso s ASN 26 N 1.66 7.27 0.00 3.58 3.04 -1.26 -3.49 114.94 125.74 1nso s ASN 26 Ca 0.05 1.50 0.06 0.00 0.04 0.00 0.00 52.86 54.51 1nso s ASN 26 Cb -0.19 -2.45 0.36 0.00 -1.54 0.00 0.00 41.25 37.43 1nso s ASN 26 CO 0.09 0.20 0.92 1.07 -3.04 0.00 0.00 177.10 176.34 1nso n THR 27 N 1.84 0.00 -2.79 -5.21 5.66 -1.26 -3.55 114.28 108.96 1nso n THR 27 Ca -0.06 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.84 1nso n THR 27 Cb 0.49 -0.33 0.07 0.00 -1.55 0.00 0.00 70.33 69.01 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 0.17 1.34 3.77 1.09 0.00 -1.26 -5.13 105.19 105.17 1nso n GLY 28 Ca 0.05 -0.40 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.45 3.22 0.00 4.61 0.00 -1.23 -4.91 121.76 123.00 1nso s ALA 29 Ca 0.25 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1nso s ALA 29 Cb 0.34 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 20.00 1nso s ALA 29 CO -0.06 -0.74 0.22 -0.40 0.00 0.00 0.00 175.76 174.79 1nso n ASP 30 N 0.10 0.00 -3.33 0.00 5.75 -1.26 -3.24 116.55 114.58 1nso n ASP 30 Ca 0.04 -1.05 -0.10 0.00 -0.01 0.00 0.00 54.79 53.67 1nso n ASP 30 Cb 0.44 -0.01 -0.07 0.00 -1.03 0.00 0.00 41.12 40.46 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 0.00 -0.59 -0.60 2.12 -7.23 -1.26 -4.91 120.40 107.92 1nso s VAL 31 Ca 0.00 -0.29 -0.27 0.00 -1.81 0.00 0.00 61.98 59.61 1nso s VAL 31 Cb 0.00 -0.96 0.00 0.00 0.56 0.00 0.00 36.38 35.98 1nso s VAL 31 CO 0.00 -0.29 1.60 0.42 -0.31 0.00 0.00 175.10 176.52 1nso s THR 32 N 2.51 3.57 -0.00 5.32 -4.23 -1.25 -4.20 115.64 117.36 1nso s THR 32 Ca 0.10 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 61.02 1nso s THR 32 Cb -0.13 -4.28 -0.00 0.00 1.34 0.00 0.00 72.50 69.43 1nso s THR 32 CO -0.28 -1.16 -0.02 -0.63 -0.54 0.00 0.00 174.62 172.00 1nso s ILE 33 N 7.30 0.13 -0.14 2.99 -1.09 0.72 -1.94 121.20 129.17 1nso s ILE 33 Ca 0.57 -0.07 -0.03 0.00 -2.23 0.00 0.00 60.65 58.88 1nso s ILE 33 Cb -0.12 -0.12 0.05 0.00 -1.58 0.00 0.00 42.46 40.70 1nso s ILE 33 CO 0.22 0.03 0.06 -0.63 -1.23 0.00 0.00 174.94 173.39 1nso s ILE 34 N -0.05 0.12 1.01 2.92 1.09 -0.77 -1.09 121.20 124.43 1nso s ILE 34 Ca 0.01 -0.12 -0.16 0.00 -1.10 0.00 0.00 60.65 59.28 1nso s ILE 34 Cb -0.01 -0.61 0.01 0.00 -1.06 0.00 0.00 42.46 40.80 1nso s ILE 34 CO -0.00 -0.11 0.00 2.29 -0.10 0.00 0.00 174.94 177.02 1nso n LYS 35 N 5.21 -0.59 0.17 2.79 0.00 -1.26 -3.31 118.16 121.17 1nso n LYS 35 Ca -0.07 -0.15 0.03 0.00 -0.00 0.00 0.00 58.31 58.13 1nso n LYS 35 Cb 0.49 -1.64 0.27 0.00 -0.00 0.00 0.00 35.03 34.15 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 -1.59 0.00 -2.43 -5.58 6.46 -0.97 -3.00 115.31 108.20 1nso h LEU 36 Ca -0.46 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 57.32 1nso h LEU 36 Cb 1.31 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.24 1nso h LEU 36 CO 0.33 0.46 0.15 -0.33 -0.62 0.00 0.00 178.44 178.43 1nso h GLU 37 N 0.00 0.00 0.00 1.25 5.08 -1.90 0.15 114.58 119.16 1nso h GLU 37 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1nso h GLU 37 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1nso h GLU 37 CO 0.06 0.00 -0.98 -0.25 -1.00 0.00 0.00 179.01 176.84 1nso n ASP 38 N -3.37 0.95 -4.77 1.42 9.92 -1.13 -4.97 116.55 114.60 1nso n ASP 38 Ca -0.01 -0.93 -0.38 0.00 -0.53 0.00 0.00 54.79 52.94 1nso n ASP 38 Cb 0.24 0.96 -0.01 0.00 -0.64 0.00 0.00 41.12 41.66 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 2.97 -0.04 1.24 -0.00 0.52 -4.97 118.94 115.65 1nso s TRP 39 Ca 0.08 1.53 -0.30 0.00 -0.00 0.00 0.00 56.10 57.41 1nso s TRP 39 Cb 0.16 -3.43 -0.05 0.00 -0.00 0.00 0.00 33.47 30.16 1nso s TRP 39 CO 0.86 -1.48 1.46 -1.25 -0.00 0.00 0.00 176.95 176.54 1nso s PRO 40 N -2.43 4.24 0.00 5.86 0.04 -1.26 -4.90 135.00 136.55 1nso s PRO 40 Ca 0.59 2.00 0.22 0.00 0.04 0.00 0.00 61.00 63.85 1nso s PRO 40 Cb -0.31 -3.73 1.20 0.00 0.04 0.00 0.00 34.50 31.70 1nso s PRO 40 CO 0.39 -0.69 1.72 -0.35 0.04 0.00 0.00 177.00 178.11 1nso n PRO 41 N 6.12 0.44 -0.26 0.56 -0.04 -1.26 -3.44 135.00 137.13 1nso n PRO 41 Ca 0.15 0.05 -0.01 0.00 -0.04 0.00 0.00 63.50 63.65 1nso n PRO 41 Cb 0.43 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.58 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 0.95 -4.30 3.54 -0.73 -2.03 -3.43 115.58 109.58 1nso h ASN 42 Ca 0.00 -0.05 -0.50 0.00 1.87 0.00 0.00 56.30 57.61 1nso h ASN 42 Cb 0.14 -0.24 -0.22 0.00 0.27 0.00 0.00 38.32 38.27 1nso h ASN 42 CO 0.00 0.73 -0.81 -1.66 -0.37 0.00 0.00 177.43 175.32 1nso s TRP 43 N -5.82 1.56 0.50 0.67 -2.14 -1.22 -5.14 118.94 107.35 1nso s TRP 43 Ca -0.11 -0.42 -0.20 0.00 2.66 0.00 0.00 56.10 58.02 1nso s TRP 43 Cb 0.17 -0.87 -0.08 0.00 -3.10 0.00 0.00 33.47 29.59 1nso s TRP 43 CO 0.80 0.13 1.07 -2.14 -2.66 0.00 0.00 176.95 174.16 1nso s PRO 44 N -1.73 3.67 0.36 3.25 0.02 -1.26 -4.88 135.00 134.43 1nso s PRO 44 Ca 0.03 1.47 0.04 0.00 0.02 0.00 0.00 61.00 62.57 1nso s PRO 44 Cb -0.10 -2.10 -0.03 0.00 0.02 0.00 0.00 34.50 32.29 1nso s PRO 44 CO 0.03 -0.56 0.17 0.96 -0.33 0.00 0.00 177.00 177.27 1nso s ILE 45 N -1.87 0.39 1.33 2.83 -5.25 -1.26 -5.13 121.20 112.24 1nso s ILE 45 Ca 0.68 -2.00 -0.22 0.00 -0.99 0.00 0.00 60.65 58.12 1nso s ILE 45 Cb -0.20 -2.44 0.34 0.00 2.95 0.00 0.00 42.46 43.11 1nso s ILE 45 CO 0.23 0.00 1.00 0.35 -1.79 0.00 0.00 174.94 174.74 1nso n THR 46 N -0.74 0.00 0.00 8.37 -2.24 -1.26 -4.92 114.28 113.49 1nso n THR 46 Ca -0.01 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1nso n THR 46 Cb 0.64 -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 -5.27 0.00 -4.02 3.42 -0.08 0.23 -4.25 116.55 106.59 1nso n ASP 47 Ca 0.15 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.28 1nso n ASP 47 Cb 0.59 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.92 1nso n ASP 47 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1nso s THR 48 N 0.00 0.52 0.48 5.18 -1.32 -1.20 -2.22 115.64 117.08 1nso s THR 48 Ca 0.00 -0.64 0.02 0.00 -1.21 0.00 0.00 61.69 59.86 1nso s THR 48 Cb 0.00 -0.51 -0.01 0.00 -1.51 0.00 0.00 72.50 70.47 1nso s THR 48 CO 0.00 -0.10 0.04 -0.22 -2.21 0.00 0.00 174.62 172.13 1nso s LEU 49 N -0.80 2.19 -0.30 9.08 2.96 0.80 -4.26 118.68 128.35 1nso s LEU 49 Ca -0.03 -1.67 -0.10 0.00 -0.22 0.00 0.00 54.13 52.10 1nso s LEU 49 Cb -0.06 -0.54 -0.02 0.00 0.50 0.00 0.00 46.19 46.07 1nso s LEU 49 CO 0.00 -0.89 0.17 0.42 -1.32 0.00 0.00 176.35 174.73 1nso s THR 50 N -2.97 4.86 -0.53 3.68 -4.23 -1.26 -0.19 115.64 114.99 1nso s THR 50 Ca 0.10 -0.23 0.04 0.00 -1.18 0.00 0.00 61.69 60.43 1nso s THR 50 Cb 0.02 -3.42 0.17 0.00 1.34 0.00 0.00 72.50 70.60 1nso s THR 50 CO 0.06 0.12 0.39 0.21 -0.54 0.00 0.00 174.62 174.87 1nso s ASN 51 N 1.67 3.01 -0.28 3.99 2.47 -0.51 -4.35 114.94 120.94 1nso s ASN 51 Ca 0.06 -3.35 -0.18 0.00 0.42 0.00 0.00 52.86 49.80 1nso s ASN 51 Cb -0.17 -0.97 -0.02 0.00 -1.45 0.00 0.00 41.25 38.64 1nso s ASN 51 CO 0.08 -0.14 0.54 -0.76 -3.72 0.00 0.00 177.10 173.10 1nso s LEU 52 N -0.53 4.10 -0.01 3.21 1.02 -1.17 -0.39 118.68 124.90 1nso s LEU 52 Ca 0.28 0.45 0.05 0.00 0.02 0.00 0.00 54.13 54.94 1nso s LEU 52 Cb -0.02 -2.69 0.17 0.00 0.02 0.00 0.00 46.19 43.67 1nso s LEU 52 CO -0.17 -0.35 1.06 0.54 0.02 0.00 0.00 176.35 177.45 1nso n ARG 53 N 5.64 1.57 0.00 1.70 1.74 -0.99 -4.84 116.66 121.47 1nso n ARG 53 Ca -0.03 -0.70 0.00 0.00 -0.77 0.00 0.00 57.85 56.35 1nso n ARG 53 Cb 0.49 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 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 0.64 1.03 0.01 -0.13 0.00 -1.26 -2.82 105.19 102.66 1nso n GLY 54 Ca 0.06 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.17 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 0.06 -2.90 -0.61 -5.35 -1.26 -4.43 119.36 104.87 1nso n ILE 55 Ca 0.00 -0.22 -0.22 0.00 -0.27 0.00 0.00 62.75 62.03 1nso n ILE 55 Cb 0.00 0.43 -0.02 0.00 -1.74 0.00 0.00 39.64 38.31 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 1.39 4.58 3.52 3.28 0.00 -1.13 -5.05 105.19 111.78 1nso n GLY 56 Ca 0.01 -2.27 -0.31 0.00 0.00 0.00 0.00 46.02 43.45 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 -0.11 0.31 -4.31 1.61 10.64 -1.26 -2.34 117.38 121.91 1nso n GLN 57 Ca 0.28 -0.13 -0.29 0.00 -1.83 0.00 0.00 57.00 55.03 1nso n GLN 57 Cb 0.57 -2.13 -0.05 0.00 -0.86 0.00 0.00 30.24 27.77 1nso n GLN 57 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 1nso s SER 58 N 7.68 4.37 -0.17 2.61 0.01 0.47 -4.85 113.70 123.83 1nso s SER 58 Ca 1.20 -1.40 0.01 0.00 1.31 0.00 0.00 55.95 57.07 1nso s SER 58 Cb -0.75 0.32 0.01 0.00 0.21 0.00 0.00 66.02 65.82 1nso s SER 58 CO 0.40 -0.90 -0.19 0.20 0.41 0.00 0.00 173.24 173.16 1nso s ASN 59 N -4.04 3.27 1.29 2.44 0.01 -1.24 -1.43 114.94 115.25 1nso s ASN 59 Ca 0.23 -0.60 -0.21 0.00 -0.71 0.00 0.00 52.86 51.56 1nso s ASN 59 Cb 0.01 -1.50 0.32 0.00 0.41 0.00 0.00 41.25 40.49 1nso s ASN 59 CO 0.13 0.03 1.07 0.59 -1.51 0.00 0.00 177.10 177.41 1nso n ASN 60 N 4.42 -2.45 -4.34 -1.22 3.02 0.73 -4.64 115.26 110.78 1nso n ASN 60 Ca -0.20 -1.13 -0.37 0.00 -0.03 0.00 0.00 54.58 52.84 1nso n ASN 60 Cb 0.51 -1.01 -0.13 0.00 -0.61 0.00 0.00 39.78 38.54 1nso n ASN 60 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1nso s PRO 61 N -5.44 3.06 -0.16 3.52 0.04 -1.26 -0.14 135.00 134.62 1nso s PRO 61 Ca 0.71 -0.88 -0.07 0.00 0.04 0.00 0.00 61.00 60.80 1nso s PRO 61 Cb -0.08 -3.38 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 1nso s PRO 61 CO 0.55 -0.46 0.09 0.15 0.04 0.00 0.00 177.00 177.38 1nso s LYS 62 N 1.49 3.76 -0.07 4.56 1.02 -0.94 -4.65 119.74 124.91 1nso s LYS 62 Ca 0.02 -0.26 0.03 0.00 0.02 0.00 0.00 55.97 55.78 1nso s LYS 62 Cb -0.17 -3.21 0.01 0.00 -0.52 0.00 0.00 37.83 33.94 1nso s LYS 62 CO 0.03 0.47 -0.17 1.14 -0.92 0.00 0.00 175.35 175.90 1nso s GLN 63 N -0.17 2.09 1.10 1.68 0.00 -1.26 0.74 119.66 123.85 1nso s GLN 63 Ca 0.09 -0.58 -0.17 0.00 -0.00 0.00 0.00 55.36 54.70 1nso s GLN 63 Cb -0.12 -1.69 0.13 0.00 0.00 0.00 0.00 33.01 31.33 1nso s GLN 63 CO 0.01 0.11 0.26 0.45 0.00 0.00 0.00 175.29 176.12 1nso n SER 64 N 3.60 -2.16 -0.00 12.60 2.88 -0.91 -4.65 113.62 124.97 1nso n SER 64 Ca -0.21 -0.05 0.02 0.00 -1.33 0.00 0.00 58.87 57.30 1nso n SER 64 Cb 0.52 -1.06 -0.03 0.00 -0.75 0.00 0.00 64.21 62.90 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 -2.23 3.84 -0.67 -3.46 3.41 -1.26 -2.21 113.62 111.04 1nso n SER 65 Ca 0.02 -0.05 -0.09 0.00 -0.26 0.00 0.00 58.87 58.48 1nso n SER 65 Cb 0.59 1.14 -0.02 0.00 -0.26 0.00 0.00 64.21 65.67 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 -1.57 0.00 -3.28 4.33 3.00 -1.26 -3.59 118.16 115.79 1nso n LYS 66 Ca -0.01 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 57.98 1nso n LYS 66 Cb 0.09 -0.22 -0.06 0.00 0.00 0.00 0.00 35.03 34.84 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 0.69 3.40 0.03 5.64 1.13 -1.26 -4.12 117.35 122.86 1nso s TYR 67 Ca 0.17 1.04 0.05 0.00 -1.41 0.00 0.00 57.07 56.92 1nso s TYR 67 Cb -0.22 -2.40 -0.03 0.00 -1.10 0.00 0.00 41.96 38.21 1nso s TYR 67 CO 0.11 0.18 -0.12 -1.17 -2.51 0.00 0.00 175.55 172.04 1nso s LEU 68 N -2.90 2.90 -0.25 -3.49 2.96 -0.75 -4.92 118.68 112.23 1nso s LEU 68 Ca 0.51 -0.29 -0.02 0.00 -0.22 0.00 0.00 54.13 54.11 1nso s LEU 68 Cb -0.11 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.92 1nso s LEU 68 CO 0.19 0.26 -0.05 0.42 -1.32 0.00 0.00 176.35 175.86 1nso s THR 69 N -0.98 2.98 -0.11 3.68 -4.23 -1.26 -2.05 115.64 113.67 1nso s THR 69 Ca 0.16 -0.97 0.02 0.00 -1.18 0.00 0.00 61.69 59.72 1nso s THR 69 Cb -0.11 -2.51 0.01 0.00 1.34 0.00 0.00 72.50 71.24 1nso s THR 69 CO 0.07 0.20 -0.15 0.86 -0.54 0.00 0.00 174.62 175.06 1nso s TRP 70 N 1.35 1.96 0.00 3.99 -0.00 -0.27 -2.72 118.94 123.25 1nso s TRP 70 Ca 0.01 -0.91 -0.11 0.00 -0.00 0.00 0.00 56.10 55.08 1nso s TRP 70 Cb -0.16 -1.41 0.01 0.00 -0.00 0.00 0.00 33.47 31.90 1nso s TRP 70 CO -0.04 -0.47 0.22 -0.98 -0.00 0.00 0.00 176.95 175.69 1nso s ARG 71 N 0.96 0.61 0.74 5.86 3.03 0.35 -0.39 118.95 130.12 1nso s ARG 71 Ca -0.07 -0.36 -0.12 0.00 2.03 0.00 0.00 55.73 57.21 1nso s ARG 71 Cb -0.15 0.26 0.04 0.00 -1.03 0.00 0.00 34.95 34.07 1nso s ARG 71 CO -0.01 -0.16 1.11 0.16 -1.13 0.00 0.00 175.30 175.26 1nso s ASP 72 N -1.52 5.10 0.53 -2.89 1.47 0.43 -0.67 116.67 119.11 1nso s ASP 72 Ca -0.12 1.10 0.43 0.00 1.18 0.00 0.00 52.55 55.15 1nso s ASP 72 Cb -0.05 -1.84 1.48 0.00 -0.34 0.00 0.00 42.92 42.17 1nso s ASP 72 CO 0.01 -1.56 1.41 1.17 0.68 0.00 0.00 175.17 176.89 1nso n LYS 73 N -3.14 0.00 0.00 2.11 4.81 -1.26 0.26 118.16 120.94 1nso n LYS 73 Ca 0.07 1.00 0.02 0.00 -0.87 0.00 0.00 58.31 58.53 1nso n LYS 73 Cb 0.58 -2.34 0.11 0.00 0.02 0.00 0.00 35.03 33.39 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 -3.67 0.77 -3.10 1.64 2.13 -1.26 -4.84 120.64 112.32 1nso n GLU 74 Ca 0.38 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 58.07 1nso n GLU 74 Cb 1.81 -1.08 0.05 0.00 0.27 0.00 0.00 31.44 32.50 1nso n GLU 74 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1nso n ASN 75 N -0.58 -3.96 -3.63 4.31 2.85 0.73 -5.02 115.26 109.96 1nso n ASN 75 Ca 0.03 -0.35 -0.05 0.00 -0.11 0.00 0.00 54.58 54.10 1nso n ASN 75 Cb 0.01 -3.32 -0.06 0.00 1.24 0.00 0.00 39.78 37.66 1nso n ASN 75 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1nso s ASN 76 N -3.38 -0.16 0.00 1.20 2.20 -1.07 -4.87 114.94 108.86 1nso s ASN 76 Ca 0.26 0.24 0.00 0.00 -0.94 0.00 0.00 52.86 52.42 1nso s ASN 76 Cb -0.12 0.22 0.00 0.00 -2.00 0.00 0.00 41.25 39.36 1nso s ASN 76 CO 0.45 -0.10 0.00 -1.54 -2.94 0.00 0.00 177.10 172.97 1nso n SER 77 N 1.14 0.00 0.00 3.54 3.41 -1.24 -0.43 113.62 120.04 1nso n SER 77 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1nso n SER 77 Cb 0.58 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1nso n SER 77 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nso n GLY 78 N 0.00 3.97 3.48 5.00 0.00 0.47 -2.90 105.19 115.21 1nso n GLY 78 Ca 0.00 -0.24 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.66 0.24 0.99 0.05 -1.26 -1.12 118.68 116.91 1nso s LEU 79 Ca 0.00 1.27 -0.21 0.00 0.05 0.00 0.00 54.13 55.24 1nso s LEU 79 Cb 0.00 1.93 0.03 0.00 -2.05 0.00 0.00 46.19 46.10 1nso s LEU 79 CO 0.00 -0.22 0.65 0.27 -0.55 0.00 0.00 176.35 176.50 1nso s ILE 80 N 1.82 0.00 -0.53 1.48 -5.25 -0.87 -4.98 121.20 112.87 1nso s ILE 80 Ca -0.08 -0.73 -0.22 0.00 -0.99 0.00 0.00 60.65 58.63 1nso s ILE 80 Cb -0.08 -1.69 0.05 0.00 2.95 0.00 0.00 42.46 43.69 1nso s ILE 80 CO -0.17 -0.02 0.79 -1.59 -1.79 0.00 0.00 174.94 172.17 1nso s LYS 81 N -3.87 3.23 0.00 0.37 -2.85 -1.26 -1.82 119.74 113.54 1nso s LYS 81 Ca 0.09 -0.57 0.00 0.00 -1.00 0.00 0.00 55.97 54.49 1nso s LYS 81 Cb -0.04 -4.08 0.00 0.00 -2.06 0.00 0.00 37.83 31.66 1nso s LYS 81 CO 0.01 -1.37 0.00 -0.35 0.10 0.00 0.00 175.35 173.74 1nso n PRO 82 N 6.86 1.91 -3.87 1.78 -0.04 -1.24 -4.92 135.00 135.48 1nso n PRO 82 Ca -0.02 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.08 1nso n PRO 82 Cb 0.46 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.79 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 1.14 2.99 -0.35 0.54 0.08 -0.82 -4.19 117.98 117.37 1nso s PHE 83 Ca 0.00 -0.79 -0.16 0.00 0.12 0.00 0.00 56.93 56.10 1nso s PHE 83 Cb 0.00 -2.14 -0.01 0.00 -0.57 0.00 0.00 43.02 40.31 1nso s PHE 83 CO 0.00 -0.49 0.40 0.08 -0.10 0.00 0.00 175.22 175.12 1nso s VAL 84 N 1.50 5.13 0.01 -0.44 1.01 -0.94 -1.85 120.40 124.81 1nso s VAL 84 Ca 0.06 0.06 0.07 0.00 0.00 0.00 0.00 61.98 62.16 1nso s VAL 84 Cb -0.14 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1nso s VAL 84 CO -0.01 -0.16 -0.20 -0.63 0.00 0.00 0.00 175.10 174.10 1nso s ILE 85 N 2.11 2.61 -0.06 2.22 -1.09 -1.24 -2.15 121.20 123.60 1nso s ILE 85 Ca 0.13 -1.08 0.00 0.00 -2.23 0.00 0.00 60.65 57.47 1nso s ILE 85 Cb -0.16 -2.03 0.05 0.00 -1.58 0.00 0.00 42.46 38.74 1nso s ILE 85 CO 0.12 0.46 1.62 -0.81 -1.23 0.00 0.00 174.94 175.10 1nso n PRO 86 N 1.96 1.15 0.00 2.79 -0.04 -1.26 -0.36 135.00 139.24 1nso n PRO 86 Ca -0.16 -0.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.98 1nso n PRO 86 Cb 0.52 -1.12 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 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 0.88 0.55 -2.40 3.54 4.05 -1.26 -4.95 115.26 115.68 1nso n ASN 87 Ca 0.06 -1.12 -0.05 0.00 0.45 0.00 0.00 54.58 53.93 1nso n ASN 87 Cb 0.56 0.00 0.01 0.00 1.23 0.00 0.00 39.78 41.57 1nso n ASN 87 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 1nso n LEU 88 N -0.06 -6.02 -0.61 1.20 7.94 -1.22 -4.87 117.00 113.36 1nso n LEU 88 Ca 0.00 0.45 0.00 0.00 -1.11 0.00 0.00 56.01 55.35 1nso n LEU 88 Cb 0.21 -2.62 0.00 0.00 0.53 0.00 0.00 43.42 41.54 1nso n LEU 88 CO 0.00 -1.68 0.27 -2.65 -1.11 0.00 0.00 177.39 172.23 1nso n PRO 89 N -0.25 0.90 -0.89 1.96 -0.02 -1.26 -4.77 135.00 130.67 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 0.27 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 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 0.16 0.00 -3.07 -1.45 0.31 -1.26 -4.42 118.33 108.60 1nso n VAL 90 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1nso n VAL 90 Cb 0.27 -0.13 -0.00 0.00 -0.91 0.00 0.00 33.84 33.08 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 -0.02 -6.86 -4.40 4.52 6.94 -1.26 -4.98 115.26 109.21 1nso n ASN 91 Ca 0.00 0.67 -0.33 0.00 -0.02 0.00 0.00 54.58 54.90 1nso n ASN 91 Cb 0.01 -2.46 -0.14 0.00 -2.36 0.00 0.00 39.78 34.83 1nso n ASN 91 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1nso s LEU 92 N -1.10 2.66 0.60 -4.53 2.01 -0.25 -4.88 118.68 113.18 1nso s LEU 92 Ca -0.00 -0.29 -0.09 0.00 0.01 0.00 0.00 54.13 53.76 1nso s LEU 92 Cb 0.00 -1.56 -0.02 0.00 0.01 0.00 0.00 46.19 44.62 1nso s LEU 92 CO 0.18 0.25 0.96 0.86 1.01 0.00 0.00 176.35 179.61 1nso s TRP 93 N -0.14 3.48 0.55 0.29 -0.00 -1.26 -0.20 118.94 121.66 1nso s TRP 93 Ca -0.01 0.99 -0.07 0.00 -0.00 0.00 0.00 56.10 57.01 1nso s TRP 93 Cb -0.14 -2.69 -0.02 0.00 -0.00 0.00 0.00 33.47 30.62 1nso s TRP 93 CO 0.03 -0.71 0.89 0.20 -0.00 0.00 0.00 176.95 177.36 1nso s GLY 94 N -4.22 1.57 0.32 5.86 0.00 -1.26 -4.07 107.32 105.51 1nso s GLY 94 Ca 0.53 -0.44 -0.00 0.00 0.00 0.00 0.00 44.72 44.81 1nso s GLY 94 CO 0.49 -0.22 1.98 -0.09 0.00 0.00 0.00 173.10 175.27 1nso h ARG 95 N -0.04 1.00 -0.06 2.90 9.65 -1.90 -1.41 114.38 124.52 1nso h ARG 95 Ca -0.46 -0.06 0.01 0.00 -1.10 0.00 0.00 59.98 58.37 1nso h ARG 95 Cb 1.22 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 29.56 1nso h ARG 95 CO 0.62 0.66 -0.01 0.22 2.80 0.00 0.00 179.97 184.25 1nso h ASP 96 N 1.03 -0.05 0.08 -3.80 3.58 -1.93 0.17 116.42 115.50 1nso h ASP 96 Ca 0.29 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.75 1nso h ASP 96 Cb -0.09 0.03 0.00 0.00 1.72 0.00 0.00 39.33 40.99 1nso h ASP 96 CO -0.07 -0.02 -0.04 -0.07 -2.88 0.00 0.00 179.24 176.17 1nso h LEU 97 N 0.00 -0.09 -0.74 2.28 4.07 -1.81 -2.72 115.31 116.29 1nso h LEU 97 Ca 0.03 -0.28 0.06 0.00 0.08 0.00 0.00 57.88 57.77 1nso h LEU 97 Cb 0.04 0.02 -0.06 0.00 1.08 0.00 0.00 40.66 41.75 1nso h LEU 97 CO -0.06 0.24 0.43 -0.07 -1.08 0.00 0.00 178.44 177.90 1nso h LEU 98 N -0.43 0.65 -0.37 1.67 3.38 -1.22 0.23 115.31 119.23 1nso h LEU 98 Ca -0.01 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.06 1nso h LEU 98 Cb 0.37 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.94 1nso h LEU 98 CO 0.02 0.42 -0.11 0.28 0.09 0.00 0.00 178.44 179.14 1nso h SER 99 N 0.79 -0.40 0.45 -0.43 0.02 -0.60 -2.34 113.55 111.04 1nso h SER 99 Ca 0.33 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.37 1nso h SER 99 Cb 0.18 0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1nso h SER 99 CO -0.18 -0.14 -0.22 1.56 -1.14 0.00 0.00 176.83 176.71 1nso h GLN 100 N -0.03 -0.58 -0.53 3.45 4.20 -1.06 -1.81 115.11 118.75 1nso h GLN 100 Ca 0.18 0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.98 1nso h GLN 100 Cb 0.30 0.13 -0.06 0.00 0.30 0.00 0.00 27.48 28.15 1nso h GLN 100 CO -0.39 -0.28 -0.31 -0.12 -0.67 0.00 0.00 178.83 177.05 1nso n MET 101 N -5.21 -0.23 -1.82 1.46 1.56 0.74 -4.42 117.12 109.20 1nso n MET 101 Ca -0.10 0.94 -0.01 0.00 -0.27 0.00 0.00 57.70 58.26 1nso n MET 101 Cb 0.29 -1.39 0.01 0.00 2.15 0.00 0.00 33.22 34.28 1nso n MET 101 CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 175.97 176.87 1nso n LYS 102 N -4.37 0.13 -0.08 2.12 4.76 -1.04 -4.98 118.16 114.69 1nso n LYS 102 Ca 0.01 -0.22 -0.11 0.00 -2.87 0.00 0.00 58.31 55.12 1nso n LYS 102 Cb 0.14 0.03 -0.04 0.00 -1.84 0.00 0.00 35.03 33.32 1nso n LYS 102 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1nso n ILE 103 N -0.22 1.44 -2.38 -0.18 -0.00 -0.91 -4.94 119.36 112.17 1nso n ILE 103 Ca -0.07 0.09 -0.42 0.00 -0.00 0.00 0.00 62.75 62.34 1nso n ILE 103 Cb 0.56 -2.17 -0.03 0.00 -0.00 0.00 0.00 39.64 38.00 1nso n ILE 103 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1nso s MET 104 N -2.72 4.31 -0.93 0.38 0.23 -0.72 -4.90 119.30 114.95 1nso s MET 104 Ca -0.26 1.76 -0.25 0.00 -1.03 0.00 0.00 55.69 55.90 1nso s MET 104 Cb 0.05 -3.61 -0.18 0.00 -1.53 0.00 0.00 34.83 29.56 1nso s MET 104 CO 0.38 -0.53 1.94 -0.12 -2.03 0.00 0.00 175.02 174.65 1nso n MET 105 N 5.54 0.92 -2.34 3.16 1.56 -1.26 -4.90 117.12 119.80 1nso n MET 105 Ca 0.12 -1.94 -0.42 0.00 -0.27 0.00 0.00 57.70 55.19 1nso n MET 105 Cb 0.45 -3.50 -0.03 0.00 2.15 0.00 0.00 33.22 32.30 1nso n MET 105 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1nso s ALA 106 N 11.43 3.46 -2.00 -5.12 0.00 -1.26 -5.27 121.76 122.99 1nso s ALA 106 Ca 0.71 0.94 0.07 0.00 0.00 0.00 0.00 51.96 53.68 1nso s ALA 106 Cb 0.03 -3.47 0.44 0.00 0.00 0.00 0.00 23.12 20.11 1nso s ALA 106 CO 0.18 -0.48 0.90 -1.13 0.00 0.00 0.00 175.76 175.22