#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 3.17 -0.03 -0.99 0.11 -1.26 -4.88 120.40 116.52 1nso s VAL 2 Ca 0.00 -1.86 0.06 0.00 -2.93 0.00 0.00 61.98 57.25 1nso s VAL 2 Cb 0.00 -2.63 -0.02 0.00 -1.53 0.00 0.00 36.38 32.20 1nso s VAL 2 CO 0.00 -0.25 -0.21 -1.10 -3.33 0.00 0.00 175.10 170.21 1nso s GLN 3 N -3.23 2.25 -0.04 1.54 -0.21 -1.23 -5.03 119.66 113.72 1nso s GLN 3 Ca 0.28 -0.85 -0.30 0.00 0.02 0.00 0.00 55.36 54.51 1nso s GLN 3 Cb -0.07 -2.17 -0.04 0.00 1.00 0.00 0.00 33.01 31.73 1nso s GLN 3 CO 0.17 0.58 1.23 -1.25 -2.12 0.00 0.00 175.29 173.91 1nso s PRO 4 N -0.68 4.34 -0.15 2.91 0.04 -1.26 -4.30 135.00 135.91 1nso s PRO 4 Ca 0.11 1.73 -0.29 0.00 0.04 0.00 0.00 61.00 62.58 1nso s PRO 4 Cb -0.10 -3.55 -0.03 0.00 0.04 0.00 0.00 34.50 30.86 1nso s PRO 4 CO -0.00 -0.46 1.53 -1.50 0.04 0.00 0.00 177.00 176.61 1nso s ILE 5 N 2.17 3.81 -0.41 0.56 1.10 -1.26 -4.98 121.20 122.19 1nso s ILE 5 Ca 0.57 0.96 -0.13 0.00 -0.51 0.00 0.00 60.65 61.54 1nso s ILE 5 Cb -0.26 -3.70 0.04 0.00 0.15 0.00 0.00 42.46 38.69 1nso s ILE 5 CO 0.23 -0.17 0.28 -0.89 -2.11 0.00 0.00 174.94 172.28 1nso s THR 6 N 4.30 4.88 0.58 4.00 2.01 -1.26 -4.96 115.64 125.19 1nso s THR 6 Ca 0.67 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.77 1nso s THR 6 Cb -0.27 -3.79 0.00 0.00 0.01 0.00 0.00 72.50 68.45 1nso s THR 6 CO 0.25 -0.36 0.00 0.00 -0.69 0.00 0.00 174.62 173.82 1nso n ALA 7 N 5.08 -2.56 -1.90 7.40 0.00 -1.26 -4.44 120.51 122.83 1nso n ALA 7 Ca -0.11 0.63 -0.23 0.00 0.00 0.00 0.00 53.44 53.73 1nso n ALA 7 Cb 0.45 -1.47 -0.06 0.00 0.00 0.00 0.00 19.45 18.38 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 -4.96 2.27 0.10 0.00 1.11 -1.26 -4.88 119.66 112.04 1nso s GLN 8 Ca 0.00 -0.03 -0.05 0.00 0.01 0.00 0.00 55.36 55.29 1nso s GLN 8 Cb 0.00 -4.96 -0.02 0.00 -1.01 0.00 0.00 33.01 27.01 1nso s GLN 8 CO 0.00 -3.68 0.11 0.15 0.01 0.00 0.00 175.29 171.88 1nso s LYS 9 N 7.57 0.84 -0.87 2.91 1.02 -1.26 -4.94 119.74 125.02 1nso s LYS 9 Ca 0.77 -1.17 -0.06 0.00 0.02 0.00 0.00 55.97 55.53 1nso s LYS 9 Cb -0.09 0.29 -0.06 0.00 -0.52 0.00 0.00 37.83 37.45 1nso s LYS 9 CO 0.02 -0.24 2.18 -0.35 -0.92 0.00 0.00 175.35 176.04 1nso n PRO 10 N -0.04 2.09 -3.66 -1.68 -0.04 -1.24 -3.49 135.00 126.94 1nso n PRO 10 Ca -0.11 -1.41 -0.07 0.00 -0.04 0.00 0.00 63.50 61.86 1nso n PRO 10 Cb 0.62 -2.41 -0.08 0.00 -0.04 0.00 0.00 33.50 31.59 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 3.24 -0.50 -0.18 3.54 0.01 -1.23 -4.25 113.70 114.34 1nso s SER 11 Ca 0.41 1.12 -0.31 0.00 1.31 0.00 0.00 55.95 58.48 1nso s SER 11 Cb 0.11 1.46 0.14 0.00 0.21 0.00 0.00 66.02 67.95 1nso s SER 11 CO -0.03 -0.22 1.13 -1.48 0.41 0.00 0.00 173.24 173.05 1nso s LEU 12 N 2.46 -0.22 -0.22 2.44 -0.00 -0.80 -4.62 118.68 117.72 1nso s LEU 12 Ca -0.04 0.14 0.02 0.00 -0.00 0.00 0.00 54.13 54.24 1nso s LEU 12 Cb -0.11 1.55 0.04 0.00 -0.00 0.00 0.00 46.19 47.67 1nso s LEU 12 CO -0.14 -0.27 -0.13 -0.89 -0.00 0.00 0.00 176.35 174.92 1nso s THR 13 N -1.78 1.92 0.26 5.48 2.01 -1.26 -0.40 115.64 121.87 1nso s THR 13 Ca 0.05 -1.23 0.02 0.00 0.31 0.00 0.00 61.69 60.84 1nso s THR 13 Cb -0.01 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.50 1nso s THR 13 CO -0.04 0.17 0.16 -0.76 -0.69 0.00 0.00 174.62 173.46 1nso s LEU 14 N 1.26 1.49 0.07 4.42 1.43 0.09 -3.50 118.68 123.95 1nso s LEU 14 Ca -0.03 -1.51 -0.08 0.00 -1.03 0.00 0.00 54.13 51.48 1nso s LEU 14 Cb -0.17 0.30 -0.05 0.00 0.03 0.00 0.00 46.19 46.29 1nso s LEU 14 CO -0.08 -0.88 0.36 -1.66 0.23 0.00 0.00 176.35 174.33 1nso s TRP 15 N -3.80 3.56 0.00 0.29 1.48 0.41 -0.09 118.94 120.80 1nso s TRP 15 Ca 0.38 0.70 0.02 0.00 -1.06 0.00 0.00 56.10 56.14 1nso s TRP 15 Cb 0.06 -2.09 -0.01 0.00 -1.16 0.00 0.00 33.47 30.27 1nso s TRP 15 CO 0.17 0.53 -0.07 -0.48 -4.06 0.00 0.00 176.95 173.03 1nso s LEU 16 N -2.00 2.04 0.00 -4.66 0.05 0.72 -0.12 118.68 114.71 1nso s LEU 16 Ca 0.33 -0.17 0.00 0.00 0.05 0.00 0.00 54.13 54.34 1nso s LEU 16 Cb -0.13 -0.33 0.00 0.00 -2.05 0.00 0.00 46.19 43.68 1nso s LEU 16 CO 0.19 0.05 0.00 0.47 -0.55 0.00 0.00 176.35 176.51 1nso n ASP 17 N 2.73 0.00 -1.27 1.48 8.00 -0.61 -1.93 116.55 124.95 1nso n ASP 17 Ca -0.14 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.34 1nso n ASP 17 Cb 0.57 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.68 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 1.41 -0.40 -3.60 -2.24 8.00 -1.26 -5.03 116.55 113.43 1nso n ASP 18 Ca 0.00 -1.02 -0.09 0.00 0.71 0.00 0.00 54.79 54.39 1nso n ASP 18 Cb 0.00 0.16 -0.06 0.00 -0.02 0.00 0.00 41.12 41.20 1nso n ASP 18 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1nso s LYS 19 N 0.02 0.49 0.57 -1.24 2.20 -0.81 -5.16 119.74 115.81 1nso s LYS 19 Ca 0.01 0.26 -0.19 0.00 -0.36 0.00 0.00 55.97 55.69 1nso s LYS 19 Cb 0.07 0.23 -0.05 0.00 -1.51 0.00 0.00 37.83 36.58 1nso s LYS 19 CO -0.02 -0.12 1.18 -1.64 -0.36 0.00 0.00 175.35 174.38 1nso s MET 20 N -0.65 3.15 0.14 4.03 -1.94 -1.26 -0.20 119.30 122.57 1nso s MET 20 Ca 0.01 1.74 -0.24 0.00 -1.71 0.00 0.00 55.69 55.49 1nso s MET 20 Cb -0.02 -1.97 0.08 0.00 2.01 0.00 0.00 34.83 34.92 1nso s MET 20 CO -0.02 -1.05 1.05 0.12 -0.01 0.00 0.00 175.02 175.11 1nso s PHE 21 N -1.66 -0.02 0.48 -0.03 5.36 0.87 -4.82 117.98 118.16 1nso s PHE 21 Ca 0.75 -0.30 0.06 0.00 -0.96 0.00 0.00 56.93 56.49 1nso s PHE 21 Cb -0.28 0.65 0.03 0.00 -0.34 0.00 0.00 43.02 43.08 1nso s PHE 21 CO 0.31 -0.78 0.66 0.99 -1.46 0.00 0.00 175.22 174.94 1nso s THR 22 N -2.62 2.79 0.00 0.12 2.01 -1.26 -0.73 115.64 115.95 1nso s THR 22 Ca 0.17 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.28 1nso s THR 22 Cb -0.01 -2.89 0.00 0.00 0.01 0.00 0.00 72.50 69.60 1nso s THR 22 CO 0.03 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.57 1nso n GLY 23 N -2.06 1.11 2.93 4.40 0.00 0.46 -4.86 105.19 107.16 1nso n GLY 23 Ca 0.09 -0.81 -0.17 0.00 0.00 0.00 0.00 46.02 45.14 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 1.75 -0.17 0.99 -0.00 -1.26 -1.91 118.68 118.09 1nso s LEU 24 Ca 0.00 -0.09 -0.05 0.00 -0.00 0.00 0.00 54.13 53.98 1nso s LEU 24 Cb 0.00 -0.30 -0.03 0.00 -0.00 0.00 0.00 46.19 45.85 1nso s LEU 24 CO 0.00 0.02 0.01 -0.63 -0.00 0.00 0.00 176.35 175.75 1nso s ILE 25 N 0.25 4.32 -0.13 1.48 -1.09 -1.23 -4.67 121.20 120.13 1nso s ILE 25 Ca -0.03 -0.20 -0.06 0.00 -2.23 0.00 0.00 60.65 58.13 1nso s ILE 25 Cb -0.06 -2.92 -0.04 0.00 -1.58 0.00 0.00 42.46 37.86 1nso s ILE 25 CO -0.00 0.48 0.10 0.20 -1.23 0.00 0.00 174.94 174.48 1nso s ASN 26 N 0.35 6.00 0.00 3.58 -0.87 -1.26 -3.61 114.94 119.14 1nso s ASN 26 Ca -0.01 0.32 0.15 0.00 -1.57 0.00 0.00 52.86 51.76 1nso s ASN 26 Cb -0.13 -1.91 0.54 0.00 -0.02 0.00 0.00 41.25 39.72 1nso s ASN 26 CO 0.02 0.35 1.40 1.07 -2.57 0.00 0.00 177.10 177.37 1nso n THR 27 N 2.34 0.30 -2.85 1.60 5.66 -1.26 -4.29 114.28 115.77 1nso n THR 27 Ca -0.19 -0.36 -0.11 0.00 -3.05 0.00 0.00 64.05 60.34 1nso n THR 27 Cb 0.54 0.24 0.05 0.00 -1.55 0.00 0.00 70.33 69.62 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 1.04 1.24 3.85 1.09 0.00 -1.26 -5.10 105.19 106.06 1nso n GLY 28 Ca 0.13 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.29 3.59 0.00 4.61 0.00 -1.26 -4.98 121.76 123.43 1nso s ALA 29 Ca 0.28 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1nso s ALA 29 Cb 0.29 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.92 1nso s ALA 29 CO -0.09 0.47 0.00 -0.40 0.00 0.00 0.00 175.76 175.74 1nso n ASP 30 N 0.63 2.64 -3.65 0.00 5.75 -1.26 -3.43 116.55 117.23 1nso n ASP 30 Ca -0.04 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.52 1nso n ASP 30 Cb 0.52 0.00 -0.18 0.00 -1.03 0.00 0.00 41.12 40.43 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 -1.96 -0.11 -0.30 2.12 -7.23 -1.26 -4.36 120.40 107.30 1nso s VAL 31 Ca 0.00 0.24 -0.33 0.00 -1.81 0.00 0.00 61.98 60.08 1nso s VAL 31 Cb 0.00 -0.29 -0.09 0.00 0.56 0.00 0.00 36.38 36.56 1nso s VAL 31 CO 0.00 0.03 2.20 0.41 -0.31 0.00 0.00 175.10 177.43 1nso n THR 32 N 5.29 0.25 -4.24 5.32 -1.04 -1.23 -4.74 114.28 113.89 1nso n THR 32 Ca -0.04 -0.34 -0.31 0.00 -2.04 0.00 0.00 64.05 61.32 1nso n THR 32 Cb 0.50 -1.99 -0.16 0.00 -1.82 0.00 0.00 70.33 66.85 1nso n THR 32 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1nso s ILE 33 N 7.69 1.82 -0.13 12.58 -1.09 0.26 -0.69 121.20 141.64 1nso s ILE 33 Ca 1.06 -0.80 0.02 0.00 -2.23 0.00 0.00 60.65 58.71 1nso s ILE 33 Cb -0.66 -1.65 0.00 0.00 -1.58 0.00 0.00 42.46 38.57 1nso s ILE 33 CO 0.44 0.50 -0.21 -0.51 -1.23 0.00 0.00 174.94 173.93 1nso s ILE 34 N 1.22 2.23 0.93 2.92 1.10 0.51 -0.36 121.20 129.76 1nso s ILE 34 Ca 0.01 -0.94 -0.11 0.00 -0.51 0.00 0.00 60.65 59.11 1nso s ILE 34 Cb -0.14 -1.89 0.12 0.00 0.15 0.00 0.00 42.46 40.71 1nso s ILE 34 CO -0.08 0.55 0.98 2.29 -2.11 0.00 0.00 174.94 176.56 1nso n LYS 35 N 3.85 -0.43 0.23 3.50 0.00 -1.26 -3.26 118.16 120.78 1nso n LYS 35 Ca -0.19 -0.07 0.07 0.00 -0.00 0.00 0.00 58.31 58.12 1nso n LYS 35 Cb 0.52 -2.26 0.56 0.00 -0.00 0.00 0.00 35.03 33.85 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 -1.83 0.00 -0.44 -5.58 6.46 -1.55 -2.60 115.31 109.76 1nso h LEU 36 Ca -0.43 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 1nso h LEU 36 Cb 1.27 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.20 1nso h LEU 36 CO 0.39 0.19 0.13 -0.62 -0.62 0.00 0.00 178.44 177.91 1nso n GLU 37 N -4.05 0.04 -0.31 1.25 1.02 -1.26 -0.32 120.64 117.01 1nso n GLU 37 Ca -0.02 0.47 0.08 0.00 -0.02 0.00 0.00 57.16 57.67 1nso n GLU 37 Cb 0.27 -1.77 0.17 0.00 -0.02 0.00 0.00 31.44 30.09 1nso n GLU 37 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1nso n ASP 38 N -1.69 2.22 -4.67 1.62 9.92 -0.98 -5.04 116.55 117.93 1nso n ASP 38 Ca -0.00 -3.41 -0.27 0.00 -0.53 0.00 0.00 54.79 50.58 1nso n ASP 38 Cb 0.14 -0.48 -0.08 0.00 -0.64 0.00 0.00 41.12 40.06 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 -3.02 2.88 -0.20 1.24 -0.00 0.56 -5.03 118.94 115.38 1nso s TRP 39 Ca 0.35 -0.12 -0.30 0.00 -0.00 0.00 0.00 56.10 56.03 1nso s TRP 39 Cb 0.32 -1.41 -0.07 0.00 -0.00 0.00 0.00 33.47 32.31 1nso s TRP 39 CO -0.00 0.51 2.15 -2.30 -0.00 0.00 0.00 176.95 177.31 1nso n PRO 40 N -0.01 1.94 0.00 5.86 -0.02 -1.26 -4.84 135.00 136.67 1nso n PRO 40 Ca -0.10 0.58 0.05 0.00 -2.02 0.00 0.00 63.50 62.01 1nso n PRO 40 Cb 0.55 -3.00 0.21 0.00 -0.02 0.00 0.00 33.50 31.23 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 8.28 0.01 -0.35 0.52 -0.04 -1.26 -2.89 135.00 139.28 1nso n PRO 41 Ca 0.30 0.32 -0.03 0.00 -0.04 0.00 0.00 63.50 64.05 1nso n PRO 41 Cb 0.39 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.44 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 1.11 -3.87 3.54 -0.73 -2.04 -3.43 115.58 110.15 1nso h ASN 42 Ca 0.00 -0.06 -0.28 0.00 1.87 0.00 0.00 56.30 57.83 1nso h ASN 42 Cb 0.16 -0.28 -0.28 0.00 0.27 0.00 0.00 38.32 38.19 1nso h ASN 42 CO 0.00 0.83 -0.74 -1.66 -0.37 0.00 0.00 177.43 175.50 1nso s TRP 43 N -6.01 0.26 0.61 0.67 -2.14 -1.14 -5.15 118.94 106.04 1nso s TRP 43 Ca -0.13 -0.07 -0.17 0.00 2.66 0.00 0.00 56.10 58.40 1nso s TRP 43 Cb 0.17 -0.17 -0.02 0.00 -3.10 0.00 0.00 33.47 30.35 1nso s TRP 43 CO 0.82 -0.01 1.13 -1.25 -2.66 0.00 0.00 176.95 174.98 1nso s PRO 44 N -0.12 3.00 -0.05 3.25 0.04 -1.26 -4.79 135.00 135.06 1nso s PRO 44 Ca 0.01 1.52 0.03 0.00 0.04 0.00 0.00 61.00 62.59 1nso s PRO 44 Cb -0.01 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.57 1nso s PRO 44 CO -0.00 -1.12 -0.12 0.96 0.04 0.00 0.00 177.00 176.77 1nso s ILE 45 N -2.06 1.05 -0.04 0.56 -5.25 -1.26 -5.10 121.20 109.10 1nso s ILE 45 Ca 0.70 -0.46 -0.03 0.00 -0.99 0.00 0.00 60.65 59.86 1nso s ILE 45 Cb -0.23 -0.95 0.02 0.00 2.95 0.00 0.00 42.46 44.25 1nso s ILE 45 CO 0.35 0.33 0.11 0.28 -1.79 0.00 0.00 174.94 174.22 1nso s THR 46 N 0.45 -0.02 0.33 8.37 -1.32 -1.26 -4.22 115.64 117.98 1nso s THR 46 Ca -0.10 0.06 0.05 0.00 -1.21 0.00 0.00 61.69 60.49 1nso s THR 46 Cb -0.13 -0.17 -0.02 0.00 -1.51 0.00 0.00 72.50 70.67 1nso s THR 46 CO 0.02 0.02 0.17 -0.67 -2.21 0.00 0.00 174.62 171.96 1nso n ASP 47 N 3.40 0.57 -4.16 8.08 2.03 -1.20 -4.62 116.55 120.66 1nso n ASP 47 Ca -0.17 -2.90 -0.34 0.00 0.52 0.00 0.00 54.79 51.90 1nso n ASP 47 Cb 0.57 1.09 -0.14 0.00 -0.72 0.00 0.00 41.12 41.92 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 -2.99 2.72 0.49 5.18 -1.32 -1.26 -0.28 115.64 118.18 1nso s THR 48 Ca 0.24 -1.30 0.03 0.00 -1.21 0.00 0.00 61.69 59.45 1nso s THR 48 Cb 0.01 -2.49 -0.02 0.00 -1.51 0.00 0.00 72.50 68.48 1nso s THR 48 CO 0.17 0.04 0.06 -0.22 -2.21 0.00 0.00 174.62 172.46 1nso s LEU 49 N 1.24 2.51 -0.09 9.08 2.96 -1.04 -4.94 118.68 128.40 1nso s LEU 49 Ca -0.04 -1.51 0.01 0.00 -0.22 0.00 0.00 54.13 52.37 1nso s LEU 49 Cb -0.18 -0.87 -0.02 0.00 0.50 0.00 0.00 46.19 45.62 1nso s LEU 49 CO -0.04 -0.78 -0.12 0.28 -1.32 0.00 0.00 176.35 174.37 1nso s THR 50 N -2.81 3.24 -0.53 3.68 -1.32 -1.26 -0.34 115.64 116.30 1nso s THR 50 Ca 0.17 -0.62 0.04 0.00 -1.21 0.00 0.00 61.69 60.07 1nso s THR 50 Cb 0.03 -2.33 0.17 0.00 -1.51 0.00 0.00 72.50 68.86 1nso s THR 50 CO 0.09 0.56 0.39 0.21 -2.21 0.00 0.00 174.62 173.66 1nso s ASN 51 N -0.22 3.01 -0.29 8.08 3.04 -0.87 -3.89 114.94 123.81 1nso s ASN 51 Ca 0.01 -3.35 -0.22 0.00 0.04 0.00 0.00 52.86 49.35 1nso s ASN 51 Cb -0.13 -0.97 -0.01 0.00 -1.54 0.00 0.00 41.25 38.60 1nso s ASN 51 CO 0.03 -0.14 0.70 -0.76 -3.04 0.00 0.00 177.10 173.88 1nso s LEU 52 N -0.53 4.10 -0.02 3.21 2.01 -1.23 -0.96 118.68 125.25 1nso s LEU 52 Ca 0.28 0.63 0.09 0.00 0.01 0.00 0.00 54.13 55.14 1nso s LEU 52 Cb -0.02 -2.94 0.29 0.00 0.01 0.00 0.00 46.19 43.53 1nso s LEU 52 CO -0.17 -0.50 1.18 0.54 1.01 0.00 0.00 176.35 178.42 1nso n ARG 53 N 5.95 1.94 0.00 1.70 5.12 -1.01 -4.88 116.66 125.47 1nso n ARG 53 Ca 0.01 -1.16 0.00 0.00 -1.93 0.00 0.00 57.85 54.77 1nso n ARG 53 Cb 0.48 -1.38 0.00 0.00 -1.16 0.00 0.00 32.46 30.41 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 0.82 1.12 0.00 -0.13 0.00 -1.26 -2.81 105.19 102.93 1nso n GLY 54 Ca 0.11 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.99 -0.61 -5.35 -1.26 -4.63 119.36 104.52 1nso n ILE 55 Ca 0.00 -0.27 -0.32 0.00 -0.27 0.00 0.00 62.75 61.89 1nso n ILE 55 Cb 0.00 0.45 -0.03 0.00 -1.74 0.00 0.00 39.64 38.32 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 5.50 3.51 3.28 0.00 -1.12 -5.02 105.19 112.92 1nso n GLY 56 Ca -0.01 -2.73 -0.27 0.00 0.00 0.00 0.00 46.02 43.02 1nso n GLY 56 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1nso n GLN 57 N 0.24 0.12 -4.30 1.61 7.27 -1.26 -2.39 117.38 118.66 1nso n GLN 57 Ca 0.34 -0.10 -0.28 0.00 0.07 0.00 0.00 57.00 57.02 1nso n GLN 57 Cb 0.36 -1.57 -0.05 0.00 2.41 0.00 0.00 30.24 31.39 1nso n GLN 57 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1nso s SER 58 N 4.23 4.36 -0.03 1.69 0.15 -0.13 -4.91 113.70 119.06 1nso s SER 58 Ca 1.27 -1.36 0.06 0.00 0.70 0.00 0.00 55.95 56.61 1nso s SER 58 Cb -0.84 0.20 -0.01 0.00 -1.71 0.00 0.00 66.02 63.66 1nso s SER 58 CO 0.48 -0.85 -0.21 0.20 1.20 0.00 0.00 173.24 174.06 1nso s ASN 59 N -4.02 2.46 0.55 5.45 0.01 -1.21 -2.06 114.94 116.13 1nso s ASN 59 Ca 0.25 -0.39 -0.17 0.00 -0.71 0.00 0.00 52.86 51.84 1nso s ASN 59 Cb 0.01 -0.43 -0.06 0.00 0.41 0.00 0.00 41.25 41.18 1nso s ASN 59 CO 0.15 0.23 1.04 0.20 -1.51 0.00 0.00 177.10 177.20 1nso s ASN 60 N -0.31 6.11 0.17 -1.22 -0.87 0.54 -4.31 114.94 115.05 1nso s ASN 60 Ca 0.04 1.78 -0.30 0.00 -1.57 0.00 0.00 52.86 52.81 1nso s ASN 60 Cb -0.10 -2.53 -0.08 0.00 -0.02 0.00 0.00 41.25 38.52 1nso s ASN 60 CO 0.01 -0.94 1.25 -2.16 -2.57 0.00 0.00 177.10 172.69 1nso s PRO 61 N -3.87 4.44 -0.27 -0.60 0.04 -1.26 -2.51 135.00 130.97 1nso s PRO 61 Ca 0.63 1.94 -0.43 0.00 0.04 0.00 0.00 61.00 63.18 1nso s PRO 61 Cb -0.15 -3.24 -0.19 0.00 0.04 0.00 0.00 34.50 30.97 1nso s PRO 61 CO 0.31 -0.19 1.46 1.63 0.04 0.00 0.00 177.00 180.26 1nso n LYS 62 N 2.79 0.33 -4.22 4.56 4.01 0.61 -4.51 118.16 121.74 1nso n LYS 62 Ca 0.06 0.12 -0.33 0.00 -0.51 0.00 0.00 58.31 57.65 1nso n LYS 62 Cb 0.44 -1.67 -0.15 0.00 -0.51 0.00 0.00 35.03 33.14 1nso n LYS 62 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1nso s GLN 63 N 2.07 3.12 0.72 1.97 1.11 -1.22 -3.21 119.66 124.22 1nso s GLN 63 Ca 0.98 -0.77 -0.15 0.00 0.01 0.00 0.00 55.36 55.43 1nso s GLN 63 Cb -1.30 -2.65 -0.12 0.00 -1.01 0.00 0.00 33.01 27.92 1nso s GLN 63 CO 0.69 -0.14 -0.76 0.45 0.01 0.00 0.00 175.29 175.54 1nso n SER 64 N 4.48 -3.68 -0.00 5.90 2.88 0.11 -3.50 113.62 119.80 1nso n SER 64 Ca -0.20 0.09 0.02 0.00 -1.33 0.00 0.00 58.87 57.45 1nso n SER 64 Cb 0.51 -0.49 -0.04 0.00 -0.75 0.00 0.00 64.21 63.44 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 2.54 3.53 -3.03 -3.46 3.41 -1.25 -2.47 113.62 112.88 1nso n SER 65 Ca -0.01 -0.06 -0.43 0.00 -0.26 0.00 0.00 58.87 58.10 1nso n SER 65 Cb 0.45 1.20 -0.08 0.00 -0.26 0.00 0.00 64.21 65.52 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 -1.61 0.00 -2.72 4.33 3.00 -1.26 -3.79 118.16 116.12 1nso n LYS 66 Ca -0.01 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.91 1nso n LYS 66 Cb 0.12 -1.05 -0.06 0.00 0.00 0.00 0.00 35.03 34.04 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 3.82 3.90 0.11 5.64 1.13 -1.26 -4.07 117.35 126.62 1nso s TYR 67 Ca 0.82 1.88 0.05 0.00 -1.41 0.00 0.00 57.07 58.40 1nso s TYR 67 Cb -1.05 -3.01 -0.04 0.00 -1.10 0.00 0.00 41.96 36.76 1nso s TYR 67 CO 0.48 0.30 0.04 -1.17 -2.51 0.00 0.00 175.55 172.69 1nso s LEU 68 N -1.33 3.59 -0.34 -3.49 2.96 -0.96 -4.89 118.68 114.22 1nso s LEU 68 Ca 0.43 -0.15 0.03 0.00 -0.22 0.00 0.00 54.13 54.21 1nso s LEU 68 Cb -0.26 -2.28 0.10 0.00 0.50 0.00 0.00 46.19 44.26 1nso s LEU 68 CO 0.32 0.14 0.06 0.42 -1.32 0.00 0.00 176.35 175.98 1nso s THR 69 N -1.46 2.09 -0.22 3.68 -4.23 -1.26 -1.82 115.64 112.41 1nso s THR 69 Ca 0.28 -2.24 -0.10 0.00 -1.18 0.00 0.00 61.69 58.45 1nso s THR 69 Cb -0.11 -2.55 -0.05 0.00 1.34 0.00 0.00 72.50 71.13 1nso s THR 69 CO 0.20 -0.62 0.14 0.86 -0.54 0.00 0.00 174.62 174.66 1nso s TRP 70 N 0.98 3.33 -0.03 3.99 -0.11 -0.02 -1.58 118.94 125.50 1nso s TRP 70 Ca 0.11 0.22 -0.02 0.00 1.22 0.00 0.00 56.10 57.63 1nso s TRP 70 Cb -0.19 -2.21 0.02 0.00 -1.50 0.00 0.00 33.47 29.59 1nso s TRP 70 CO -0.10 0.14 0.07 1.03 -4.62 0.00 0.00 176.95 173.47 1nso s ARG 71 N 0.76 0.05 0.62 5.86 3.00 0.83 -0.36 118.95 129.71 1nso s ARG 71 Ca 0.07 0.17 -0.12 0.00 0.00 0.00 0.00 55.73 55.85 1nso s ARG 71 Cb -0.13 -0.07 -0.03 0.00 0.00 0.00 0.00 34.95 34.72 1nso s ARG 71 CO 0.02 -0.08 1.03 0.16 0.00 0.00 0.00 175.30 176.43 1nso s ASP 72 N 0.50 6.09 0.58 0.23 1.47 -0.80 -0.45 116.67 124.29 1nso s ASP 72 Ca -0.04 1.48 0.37 0.00 1.18 0.00 0.00 52.55 55.54 1nso s ASP 72 Cb -0.05 -2.48 1.26 0.00 -0.34 0.00 0.00 42.92 41.31 1nso s ASP 72 CO -0.02 -0.96 1.40 2.29 0.68 0.00 0.00 175.17 178.56 1nso n LYS 73 N -2.71 0.01 0.00 2.11 0.00 -1.26 0.24 118.16 116.55 1nso n LYS 73 Ca 0.06 1.04 0.08 0.00 -0.00 0.00 0.00 58.31 59.50 1nso n LYS 73 Cb 0.54 -2.51 0.50 0.00 -0.00 0.00 0.00 35.03 33.57 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 -3.52 0.55 -2.54 -1.58 2.13 -1.26 -4.83 120.64 109.58 1nso n GLU 74 Ca 0.32 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 58.10 1nso n GLU 74 Cb 1.74 -1.48 0.02 0.00 0.27 0.00 0.00 31.44 31.99 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 -0.98 -2.51 0.00 4.31 2.85 0.66 -5.05 115.26 114.54 1nso n ASN 75 Ca 0.13 -0.13 0.00 0.00 -0.11 0.00 0.00 54.58 54.46 1nso n ASN 75 Cb 0.06 -1.56 0.00 0.00 1.24 0.00 0.00 39.78 39.52 1nso n ASN 75 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 1nso n ASN 76 N -0.52 0.00 0.00 1.20 0.23 -1.06 -4.90 115.26 110.21 1nso n ASN 76 Ca -0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.02 1nso n ASN 76 Cb 0.53 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.23 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 -1.24 -1.91 113.62 113.88 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 0.20 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 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 -1.22 4.12 3.48 0.46 0.00 0.51 -4.27 105.19 108.27 1nso n GLY 78 Ca 0.00 -0.75 -0.07 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.73 0.20 0.99 0.05 -1.26 -0.84 118.68 117.09 1nso s LEU 79 Ca 0.00 1.28 -0.21 0.00 0.05 0.00 0.00 54.13 55.25 1nso s LEU 79 Cb 0.00 1.91 0.05 0.00 -2.05 0.00 0.00 46.19 46.10 1nso s LEU 79 CO 0.00 -0.22 0.61 0.27 -0.55 0.00 0.00 176.35 176.46 1nso s ILE 80 N 2.08 0.01 -0.50 1.48 -5.25 -0.76 -4.97 121.20 113.30 1nso s ILE 80 Ca -0.07 -0.45 -0.28 0.00 -0.99 0.00 0.00 60.65 58.86 1nso s ILE 80 Cb -0.09 -1.39 0.01 0.00 2.95 0.00 0.00 42.46 43.94 1nso s ILE 80 CO -0.17 -0.03 1.39 -1.59 -1.79 0.00 0.00 174.94 172.75 1nso s LYS 81 N -3.82 3.44 0.51 0.37 0.00 -1.26 -2.25 119.74 116.72 1nso s LYS 81 Ca 0.05 0.65 0.03 0.00 0.00 0.00 0.00 55.97 56.70 1nso s LYS 81 Cb -0.02 -4.07 0.10 0.00 0.00 0.00 0.00 37.83 33.84 1nso s LYS 81 CO -0.05 -1.75 0.70 -0.35 0.00 0.00 0.00 175.35 173.90 1nso n PRO 82 N 8.37 0.30 -3.87 1.78 -0.04 -1.25 -4.90 135.00 135.39 1nso n PRO 82 Ca 0.14 -2.17 -0.36 0.00 -0.04 0.00 0.00 63.50 61.07 1nso n PRO 82 Cb 0.49 -0.38 -0.12 0.00 -0.04 0.00 0.00 33.50 33.44 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 -2.07 3.11 -0.25 0.54 0.08 0.14 -3.88 117.98 115.64 1nso s PHE 83 Ca 0.49 -0.32 0.01 0.00 0.12 0.00 0.00 56.93 57.22 1nso s PHE 83 Cb -0.03 -2.18 0.04 0.00 -0.57 0.00 0.00 43.02 40.28 1nso s PHE 83 CO 0.32 -0.24 -0.10 0.08 -0.10 0.00 0.00 175.22 175.18 1nso s VAL 84 N 1.27 2.44 0.05 -0.44 1.01 -1.03 -0.36 120.40 123.35 1nso s VAL 84 Ca 0.05 -1.32 0.07 0.00 0.00 0.00 0.00 61.98 60.78 1nso s VAL 84 Cb -0.15 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 1nso s VAL 84 CO 0.03 0.12 -0.21 -0.63 0.00 0.00 0.00 175.10 174.41 1nso s ILE 85 N 1.21 1.68 -0.04 2.22 -1.09 -1.25 0.06 121.20 124.00 1nso s ILE 85 Ca -0.04 -1.27 -0.06 0.00 -2.23 0.00 0.00 60.65 57.06 1nso s ILE 85 Cb -0.18 -1.48 -0.24 0.00 -1.58 0.00 0.00 42.46 38.98 1nso s ILE 85 CO -0.06 0.16 3.36 -0.81 -1.23 0.00 0.00 174.94 176.36 1nso n PRO 86 N 1.70 1.88 0.00 2.79 -0.04 -1.26 -1.57 135.00 138.50 1nso n PRO 86 Ca -0.18 -0.95 0.00 0.00 -0.04 0.00 0.00 63.50 62.33 1nso n PRO 86 Cb 0.53 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 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 2.57 0.00 -2.25 3.54 6.94 -1.26 -4.95 115.26 119.85 1nso n ASN 87 Ca 0.40 -1.00 -0.03 0.00 -0.02 0.00 0.00 54.58 53.94 1nso n ASN 87 Cb 0.83 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.25 1nso n ASN 87 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1nso n LEU 88 N 0.00 -5.50 -0.98 -4.53 -0.00 -1.22 -4.85 117.00 99.92 1nso n LEU 88 Ca 0.00 0.56 0.00 0.00 -0.00 0.00 0.00 56.01 56.57 1nso n LEU 88 Cb 0.41 -2.39 0.00 0.00 -0.00 0.00 0.00 43.42 41.44 1nso n LEU 88 CO 0.00 -1.62 0.42 -2.65 -0.00 0.00 0.00 177.39 173.55 1nso n PRO 89 N -0.02 0.86 -0.90 1.96 -0.02 -1.26 -4.71 135.00 130.92 1nso n PRO 89 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1nso n PRO 89 Cb 0.14 -1.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 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 0.55 0.00 -3.17 -1.45 0.31 -1.26 -4.44 118.33 108.87 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 0.42 -0.19 -0.00 0.00 -0.91 0.00 0.00 33.84 33.16 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 -0.08 -6.63 -4.03 4.52 6.94 -1.25 -5.00 115.26 109.72 1nso n ASN 91 Ca 0.00 0.45 -0.15 0.00 -0.02 0.00 0.00 54.58 54.86 1nso n ASN 91 Cb 0.04 -1.68 -0.13 0.00 -2.36 0.00 0.00 39.78 35.65 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 -0.99 2.14 0.00 -4.53 2.34 0.52 -4.90 118.68 113.26 1nso s LEU 92 Ca -0.00 -0.34 -0.06 0.00 0.06 0.00 0.00 54.13 53.79 1nso s LEU 92 Cb 0.00 -0.28 0.12 0.00 -0.56 0.00 0.00 46.19 45.47 1nso s LEU 92 CO 0.02 -0.05 0.78 1.87 -1.06 0.00 0.00 176.35 177.91 1nso n TRP 93 N 2.16 -3.53 -3.86 3.48 -0.00 -1.26 0.93 117.44 115.35 1nso n TRP 93 Ca -0.18 -0.99 -0.31 0.00 -0.00 0.00 0.00 57.50 56.03 1nso n TRP 93 Cb 0.56 -0.59 -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 2.16 0.59 5.87 0.00 -1.26 -3.55 107.32 106.55 1nso s GLY 94 Ca 0.47 -0.79 0.30 0.00 0.00 0.00 0.00 44.72 44.70 1nso s GLY 94 CO 0.32 -0.76 1.75 -0.09 0.00 0.00 0.00 173.10 174.32 1nso h ARG 95 N 2.93 0.00 0.00 2.90 2.43 -1.75 0.17 114.38 121.06 1nso h ARG 95 Ca -0.45 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1nso h ARG 95 Cb 1.16 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1nso h ARG 95 CO 0.75 0.00 -0.00 0.22 -1.51 0.00 0.00 179.97 179.42 1nso h ASP 96 N 0.00 -0.00 -0.49 -3.80 3.58 -1.92 -0.37 116.42 113.41 1nso h ASP 96 Ca 0.33 -0.60 -0.12 0.00 0.42 0.00 0.00 57.03 57.06 1nso h ASP 96 Cb 1.75 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.79 1nso h ASP 96 CO -0.00 0.60 -0.18 -0.07 -2.88 0.00 0.00 179.24 176.71 1nso h LEU 97 N -0.61 1.01 0.43 2.28 3.38 -1.08 -2.82 115.31 117.91 1nso h LEU 97 Ca -0.00 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1nso h LEU 97 Cb 0.60 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1nso h LEU 97 CO 0.00 1.17 -0.21 -0.07 0.09 0.00 0.00 178.44 179.42 1nso h LEU 98 N 0.85 -0.49 -0.86 1.67 -0.00 -0.93 0.69 115.31 116.24 1nso h LEU 98 Ca 0.12 -0.10 0.18 0.00 -0.00 0.00 0.00 57.88 58.08 1nso h LEU 98 Cb 0.75 0.13 -0.16 0.00 -0.00 0.00 0.00 40.66 41.38 1nso h LEU 98 CO 0.06 -0.16 -0.15 0.28 -0.00 0.00 0.00 178.44 178.48 1nso h SER 99 N -0.85 -0.68 0.45 -0.43 0.02 -1.09 0.04 113.55 111.01 1nso h SER 99 Ca -0.06 0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 1nso h SER 99 Cb 0.56 0.49 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1nso h SER 99 CO 0.10 -0.28 -0.21 1.56 -1.14 0.00 0.00 176.83 176.86 1nso h GLN 100 N 0.02 -0.58 -0.84 3.45 4.20 -1.46 -0.61 115.11 119.30 1nso h GLN 100 Ca 0.44 0.04 0.08 0.00 0.06 0.00 0.00 58.65 59.26 1nso h GLN 100 Cb 0.72 0.13 -0.11 0.00 0.30 0.00 0.00 27.48 28.53 1nso h GLN 100 CO -0.85 -0.28 -0.56 0.52 -0.67 0.00 0.00 178.83 176.99 1nso h MET 101 N -1.00 -0.08 0.00 1.46 2.86 0.28 -3.42 114.93 115.03 1nso h MET 101 Ca -0.06 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1nso h MET 101 Cb 0.57 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.24 1nso h MET 101 CO 0.10 -0.05 0.00 1.17 1.06 0.00 0.00 176.91 179.19 1nso n LYS 102 N -5.18 0.00 -0.00 1.72 4.81 -0.11 -5.03 118.16 114.38 1nso n LYS 102 Ca 0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.45 1nso n LYS 102 Cb 0.27 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.31 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 0.00 0.02 -1.73 3.15 -0.00 -0.69 -4.95 119.36 115.17 1nso n ILE 103 Ca 0.00 -0.01 -0.42 0.00 -0.00 0.00 0.00 62.75 62.32 1nso n ILE 103 Cb 0.00 -0.55 -0.02 0.00 -0.00 0.00 0.00 39.64 39.07 1nso n ILE 103 CO 0.00 0.00 0.00 0.80 -0.00 0.00 0.00 176.55 177.35 1nso n MET 104 N -2.48 2.63 -1.13 0.38 1.56 -0.26 -4.80 117.12 113.02 1nso n MET 104 Ca -0.01 0.94 -0.38 0.00 -0.27 0.00 0.00 57.70 57.99 1nso n MET 104 Cb 0.51 -2.73 -0.09 0.00 2.15 0.00 0.00 33.22 33.06 1nso n MET 104 CO 0.00 0.00 0.00 -0.12 -0.73 0.00 0.00 175.97 175.12 1nso n MET 105 N 2.68 0.82 -2.13 2.12 1.56 -1.26 -4.85 117.12 116.05 1nso n MET 105 Ca 0.11 -1.64 -0.33 0.00 -0.27 0.00 0.00 57.70 55.57 1nso n MET 105 Cb 0.35 -3.05 -0.04 0.00 2.15 0.00 0.00 33.22 32.64 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 8.35 2.01 0.00 -5.12 0.00 -1.26 -5.29 121.76 120.45 1nso s ALA 106 Ca 0.66 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 51.34 1nso s ALA 106 Cb 0.10 -4.45 0.00 0.00 0.00 0.00 0.00 23.12 18.77 1nso s ALA 106 CO 0.21 -4.29 0.00 -1.13 0.00 0.00 0.00 175.76 170.55