#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iav s GLN 2 N 0.00 3.94 0.16 0.00 0.74 -1.22 -3.75 119.66 119.53 1iav s GLN 2 Ca 0.00 -0.19 0.08 0.00 0.05 0.00 0.00 55.36 55.30 1iav s GLN 2 Cb 0.00 -3.34 -0.04 0.00 1.10 0.00 0.00 33.01 30.73 1iav s GLN 2 CO 0.00 0.46 -0.10 -1.54 -0.55 0.00 0.00 175.29 173.56 1iav s SER 3 N -0.10 4.28 -0.38 6.67 1.04 -0.16 -4.98 113.70 120.07 1iav s SER 3 Ca 0.10 -0.53 -0.10 0.00 0.48 0.00 0.00 55.95 55.90 1iav s SER 3 Cb -0.11 -0.74 0.04 0.00 0.10 0.00 0.00 66.02 65.30 1iav s SER 3 CO -0.00 0.12 0.21 -0.69 0.98 0.00 0.00 173.24 173.86 1iav s VAL 4 N -1.57 4.44 0.64 5.02 1.01 -1.26 -3.53 120.40 125.14 1iav s VAL 4 Ca 0.24 -0.98 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 1iav s VAL 4 Cb -0.09 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.72 1iav s VAL 4 CO 0.15 -0.28 0.77 -2.65 0.00 0.00 0.00 175.10 173.09 1iav n PRO 5 N 4.97 0.61 -0.19 2.72 -0.02 -1.26 -4.81 135.00 137.02 1iav n PRO 5 Ca -0.12 0.25 -0.02 0.00 -2.02 0.00 0.00 63.50 61.59 1iav n PRO 5 Cb 0.45 -2.00 0.08 0.00 -0.02 0.00 0.00 33.50 32.01 1iav n PRO 5 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 1iav h TRP 6 N 0.12 0.51 -0.68 6.00 5.08 -1.95 -2.50 115.95 122.54 1iav h TRP 6 Ca -0.47 0.02 0.01 0.00 1.08 0.00 0.00 58.89 59.54 1iav h TRP 6 Cb 1.37 -0.14 -0.03 0.00 -3.00 0.00 0.00 29.16 27.35 1iav h TRP 6 CO 0.35 0.22 0.45 0.78 -1.28 0.00 0.00 178.44 178.96 1iav h GLY 7 N 0.52 0.95 0.86 11.11 0.00 -1.92 0.24 103.07 114.84 1iav h GLY 7 Ca 0.27 -0.35 0.03 0.00 0.00 0.00 0.00 47.33 47.28 1iav h GLY 7 CO -0.20 0.33 0.32 -2.22 0.00 0.00 0.00 176.54 174.77 1iav h ILE 8 N 0.89 1.05 0.03 2.60 1.08 -1.81 0.95 117.51 122.31 1iav h ILE 8 Ca 0.25 -0.22 -0.22 0.00 -0.39 0.00 0.00 64.86 64.29 1iav h ILE 8 Cb -0.06 0.35 -0.01 0.00 -3.07 0.00 0.00 36.82 34.03 1iav h ILE 8 CO -0.06 0.12 -0.97 0.77 -0.69 0.00 0.00 178.15 177.32 1iav h SER 9 N 0.64 0.32 -0.70 1.72 4.64 -1.26 -2.43 113.55 116.48 1iav h SER 9 Ca 0.22 -0.28 0.07 0.00 -0.47 0.00 0.00 61.79 61.34 1iav h SER 9 Cb 0.03 -0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 61.96 1iav h SER 9 CO -0.10 1.11 0.38 -0.09 -0.87 0.00 0.00 176.83 177.26 1iav h ARG 10 N 0.12 0.66 -0.00 4.77 9.65 0.23 -0.71 114.38 129.09 1iav h ARG 10 Ca -0.06 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 1iav h ARG 10 Cb 1.63 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 30.06 1iav h ARG 10 CO 0.15 0.44 0.00 1.33 2.80 0.00 0.00 179.97 184.69 1iav n VAL 11 N -4.80 0.00 -2.49 0.20 0.24 0.26 -4.91 118.33 106.84 1iav n VAL 11 Ca 0.10 -0.01 -0.16 0.00 -2.04 0.00 0.00 64.34 62.23 1iav n VAL 11 Cb 0.21 -0.39 0.01 0.00 -1.47 0.00 0.00 33.84 32.19 1iav n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1iav n GLN 12 N -0.89 -2.12 -0.20 7.34 6.02 -0.27 -0.59 117.38 126.68 1iav n GLN 12 Ca 0.20 0.71 -0.02 0.00 -0.01 0.00 0.00 57.00 57.88 1iav n GLN 12 Cb 0.10 -5.06 0.08 0.00 1.02 0.00 0.00 30.24 26.38 1iav n GLN 12 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1iav h ALA 13 N 0.73 0.76 -0.71 -1.58 0.00 -1.67 -2.96 119.26 113.83 1iav h ALA 13 Ca -0.37 0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.68 1iav h ALA 13 Cb 1.27 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1iav h ALA 13 CO 0.42 -0.07 0.47 -1.35 0.00 0.00 0.00 179.25 178.72 1iav h PRO 14 N 0.54 0.52 -0.84 0.00 0.11 -1.91 0.22 132.00 130.63 1iav h PRO 14 Ca 0.27 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.38 1iav h PRO 14 Cb 0.21 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.16 1iav h PRO 14 CO -0.20 0.34 0.54 0.00 -0.21 0.00 0.00 178.00 178.47 1iav h ALA 15 N 1.65 1.11 -0.23 -0.75 0.00 -1.92 -0.97 119.26 118.15 1iav h ALA 15 Ca 0.34 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.08 1iav h ALA 15 Cb 0.59 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1iav h ALA 15 CO -0.11 0.38 -0.37 0.00 0.00 0.00 0.00 179.25 179.15 1iav h ALA 16 N 1.35 0.35 -0.48 0.00 0.00 -0.62 -3.08 119.26 116.78 1iav h ALA 16 Ca 0.34 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1iav h ALA 16 Cb 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1iav h ALA 16 CO -0.11 0.42 0.29 0.45 0.00 0.00 0.00 179.25 180.30 1iav h HIS 17 N 0.35 0.62 0.00 0.00 3.86 -0.83 -0.88 115.15 118.26 1iav h HIS 17 Ca 0.02 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1iav h HIS 17 Cb 0.96 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.22 1iav h HIS 17 CO 0.08 0.41 0.00 0.09 0.86 0.00 0.00 177.93 179.38 1iav n ASN 18 N -4.44 0.36 -0.95 2.45 3.02 -0.41 -1.40 115.26 113.89 1iav n ASN 18 Ca 0.04 0.59 0.12 0.00 -0.03 0.00 0.00 54.58 55.30 1iav n ASN 18 Cb 0.08 -0.67 0.22 0.00 -0.61 0.00 0.00 39.78 38.80 1iav n ASN 18 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1iav n ARG 19 N -1.90 2.27 -0.39 3.52 1.74 -0.39 -4.96 116.66 116.55 1iav n ARG 19 Ca 0.03 -1.88 0.00 0.00 -0.77 0.00 0.00 57.85 55.22 1iav n ARG 19 Cb 0.19 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1iav n ARG 19 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iav n GLY 20 N 1.37 0.81 3.34 -0.13 0.00 -0.49 -5.05 105.19 105.04 1iav n GLY 20 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1iav n GLY 20 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iav s LEU 21 N 0.00 4.02 0.00 0.99 1.43 -0.84 -4.88 118.68 119.40 1iav s LEU 21 Ca 0.00 -0.79 0.00 0.00 -1.03 0.00 0.00 54.13 52.31 1iav s LEU 21 Cb 0.00 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.32 1iav s LEU 21 CO 0.00 -0.23 0.38 0.35 0.23 0.00 0.00 176.35 177.08 1iav n THR 22 N 4.88 0.14 -0.42 5.49 -2.24 -1.26 -3.04 114.28 117.82 1iav n THR 22 Ca -0.14 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1iav n THR 22 Cb 0.47 1.30 0.00 0.00 -2.10 0.00 0.00 70.33 70.01 1iav n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iav n GLY 23 N -0.07 0.76 3.66 3.38 0.00 -1.26 -0.77 105.19 110.89 1iav n GLY 23 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.53 1iav n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1iav n SER 24 N 0.00 2.76 0.00 1.61 7.64 -1.25 -1.60 113.62 122.78 1iav n SER 24 Ca 0.00 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1iav n SER 24 Cb 0.00 -1.32 0.00 0.00 -1.01 0.00 0.00 64.21 61.88 1iav n SER 24 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1iav n GLY 25 N 3.53 0.55 3.57 0.23 0.00 -1.26 -4.79 105.19 107.03 1iav n GLY 25 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 1iav n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iav s VAL 26 N -2.19 4.38 -0.20 1.61 1.01 -0.63 -4.97 120.40 119.41 1iav s VAL 26 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 61.66 1iav s VAL 26 Cb 0.00 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1iav s VAL 26 CO 0.00 0.47 0.30 -0.54 0.00 0.00 0.00 175.10 175.33 1iav s LYS 27 N 0.38 4.17 -0.12 2.72 1.02 -1.26 -1.00 119.74 125.65 1iav s LYS 27 Ca -0.00 0.04 0.01 0.00 0.02 0.00 0.00 55.97 56.04 1iav s LYS 27 Cb -0.13 -3.51 0.02 0.00 -0.52 0.00 0.00 37.83 33.69 1iav s LYS 27 CO 0.01 0.07 -0.13 0.08 -0.92 0.00 0.00 175.35 174.46 1iav s VAL 28 N 1.00 1.40 -0.19 3.17 1.01 0.06 -0.56 120.40 126.29 1iav s VAL 28 Ca 0.15 -0.55 -0.11 0.00 0.00 0.00 0.00 61.98 61.47 1iav s VAL 28 Cb -0.14 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 1iav s VAL 28 CO 0.06 0.43 0.17 0.00 0.00 0.00 0.00 175.10 175.75 1iav s ALA 29 N 1.30 3.67 -0.43 5.51 0.00 -0.07 -0.40 121.76 131.33 1iav s ALA 29 Ca -0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 51.96 51.23 1iav s ALA 29 Cb -0.14 -2.22 0.09 0.00 0.00 0.00 0.00 23.12 20.85 1iav s ALA 29 CO -0.06 0.14 0.27 0.08 0.00 0.00 0.00 175.76 176.19 1iav s VAL 30 N 0.40 4.16 -0.44 0.00 1.01 -0.53 -0.57 120.40 124.43 1iav s VAL 30 Ca 0.10 -1.52 -0.23 0.00 0.00 0.00 0.00 61.98 60.32 1iav s VAL 30 Cb -0.11 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.68 1iav s VAL 30 CO -0.01 -0.57 0.79 -0.76 0.00 0.00 0.00 175.10 174.55 1iav s LEU 31 N 1.39 4.23 0.00 3.92 1.02 -0.41 -1.85 118.68 126.98 1iav s LEU 31 Ca 0.04 -0.05 0.00 0.00 0.02 0.00 0.00 54.13 54.14 1iav s LEU 31 Cb -0.24 -2.97 0.00 0.00 0.02 0.00 0.00 46.19 43.00 1iav s LEU 31 CO 0.01 -0.89 0.00 -0.67 0.02 0.00 0.00 176.35 174.82 1iav n ASP 32 N 6.69 0.48 -0.19 2.29 4.64 -0.98 -4.13 116.55 125.34 1iav n ASP 32 Ca 0.02 0.00 0.10 0.00 -1.38 0.00 0.00 54.79 53.53 1iav n ASP 32 Cb 0.48 0.00 0.49 0.00 -1.04 0.00 0.00 41.12 41.05 1iav n ASP 32 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1iav n THR 33 N 0.00 0.07 0.00 5.18 -2.24 -1.26 -0.87 114.28 115.17 1iav n THR 33 Ca 0.00 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1iav n THR 33 Cb 0.00 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 1iav n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iav n GLY 34 N 0.91 0.08 2.67 3.38 0.00 -1.26 -4.08 105.19 106.89 1iav n GLY 34 Ca 0.15 -2.30 -0.22 0.00 0.00 0.00 0.00 46.02 43.65 1iav n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iav s ILE 35 N -0.99 -0.01 0.34 -0.61 1.01 0.21 -3.61 121.20 117.54 1iav s ILE 35 Ca 0.00 0.21 -0.26 0.00 0.00 0.00 0.00 60.65 60.61 1iav s ILE 35 Cb 0.00 -0.33 -0.09 0.00 0.01 0.00 0.00 42.46 42.04 1iav s ILE 35 CO 0.00 0.07 1.01 -0.44 0.00 0.00 0.00 174.94 175.58 1iav s SER 36 N 2.12 7.11 0.26 3.58 0.01 -1.26 -3.98 113.70 121.55 1iav s SER 36 Ca 0.04 1.98 -0.30 0.00 1.31 0.00 0.00 55.95 58.98 1iav s SER 36 Cb -0.13 -2.59 -0.14 0.00 0.21 0.00 0.00 66.02 63.37 1iav s SER 36 CO -0.05 -0.24 1.20 0.41 0.41 0.00 0.00 173.24 174.97 1iav n THR 38 N 0.43 1.51 -3.69 1.44 -1.04 -1.26 -4.95 114.28 106.72 1iav n THR 38 Ca 0.03 -0.38 -0.14 0.00 -2.04 0.00 0.00 64.05 61.52 1iav n THR 38 Cb 0.49 -1.20 -0.08 0.00 -1.82 0.00 0.00 70.33 67.71 1iav n THR 38 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1iav s HIS 39 N -0.64 -0.45 -0.94 -1.42 5.04 -1.26 -4.75 115.29 110.88 1iav s HIS 39 Ca 0.63 0.94 0.13 0.00 -1.54 0.00 0.00 55.06 55.22 1iav s HIS 39 Cb -0.69 0.20 0.54 0.00 0.04 0.00 0.00 32.58 32.67 1iav s HIS 39 CO 0.56 -0.37 1.40 -0.35 -2.34 0.00 0.00 174.74 173.64 1iav n PRO 40 N 1.95 0.02 -0.50 2.88 -0.04 -1.26 -2.17 135.00 135.88 1iav n PRO 40 Ca -0.17 0.32 0.08 0.00 -0.04 0.00 0.00 63.50 63.69 1iav n PRO 40 Cb 0.56 -1.54 0.28 0.00 -0.04 0.00 0.00 33.50 32.76 1iav n PRO 40 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1iav n ASP 41 N -1.58 4.10 -4.17 3.54 2.03 -1.26 -4.95 116.55 114.26 1iav n ASP 41 Ca 0.03 -2.97 -0.17 0.00 0.52 0.00 0.00 54.79 52.19 1iav n ASP 41 Cb 0.14 -0.55 -0.12 0.00 -0.72 0.00 0.00 41.12 39.87 1iav n ASP 41 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1iav s LEU 42 N -2.75 2.30 -0.36 -2.67 1.43 -0.92 -0.84 118.68 114.87 1iav s LEU 42 Ca 0.43 -0.65 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 1iav s LEU 42 Cb 0.34 -0.47 0.11 0.00 0.03 0.00 0.00 46.19 46.20 1iav s LEU 42 CO 0.10 -0.11 0.10 0.21 0.23 0.00 0.00 176.35 176.88 1iav s ASN 43 N -1.87 4.44 -0.38 2.29 2.47 -1.26 -4.56 114.94 116.07 1iav s ASN 43 Ca -0.01 -2.14 -0.20 0.00 0.42 0.00 0.00 52.86 50.93 1iav s ASN 43 Cb -0.09 -1.38 0.01 0.00 -1.45 0.00 0.00 41.25 38.34 1iav s ASN 43 CO 0.02 -0.37 0.60 -0.63 -3.72 0.00 0.00 177.10 173.01 1iav s ILE 44 N 0.93 4.90 -0.09 -5.21 1.01 -1.26 -4.14 121.20 117.34 1iav s ILE 44 Ca 0.12 0.34 0.21 0.00 0.00 0.00 0.00 60.65 61.31 1iav s ILE 44 Cb -0.20 -4.09 0.19 0.00 0.01 0.00 0.00 42.46 38.37 1iav s ILE 44 CO -0.11 -0.39 1.64 0.03 0.00 0.00 0.00 174.94 176.11 1iav h ARG 45 N 8.61 0.00 0.00 2.79 2.47 -1.07 -3.49 114.38 123.69 1iav h ARG 45 Ca -0.26 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.46 1iav h ARG 45 Cb 1.11 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.43 1iav h ARG 45 CO 0.84 0.28 0.00 0.41 0.56 0.00 0.00 179.97 182.06 1iav n GLY 46 N 0.75 -0.82 0.00 0.04 0.00 -1.25 -5.04 105.19 98.88 1iav n GLY 46 Ca 0.02 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1iav n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iav n GLY 47 N 0.00 0.02 3.35 -0.02 0.00 -1.26 -0.61 105.19 106.67 1iav n GLY 47 Ca 0.00 -1.68 -0.11 0.00 0.00 0.00 0.00 46.02 44.23 1iav n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iav s ALA 48 N -1.08 -1.17 -0.05 4.61 0.00 -0.76 -4.94 121.76 118.36 1iav s ALA 48 Ca 0.00 0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.16 1iav s ALA 48 Cb 0.00 0.76 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 1iav s ALA 48 CO 0.00 -0.69 -0.23 0.45 0.00 0.00 0.00 175.76 175.30 1iav s SER 49 N -2.77 2.79 -0.15 0.00 0.15 -1.26 -0.89 113.70 111.57 1iav s SER 49 Ca 0.02 -0.46 0.18 0.00 0.70 0.00 0.00 55.95 56.39 1iav s SER 49 Cb 0.01 -0.77 0.34 0.00 -1.71 0.00 0.00 66.02 63.89 1iav s SER 49 CO -0.12 0.22 1.20 0.49 1.20 0.00 0.00 173.24 176.23 1iav n PHE 50 N 3.01 0.16 -3.53 3.44 3.72 0.29 -4.93 117.46 119.62 1iav n PHE 50 Ca -0.18 -1.03 -0.42 0.00 -0.05 0.00 0.00 57.45 55.77 1iav n PHE 50 Cb 0.52 -0.19 -0.10 0.00 -0.94 0.00 0.00 39.48 38.77 1iav n PHE 50 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1iav s VAL 51 N -2.91 4.78 0.24 -4.37 1.01 -1.25 -4.63 120.40 113.28 1iav s VAL 51 Ca 0.34 -0.98 -0.31 0.00 0.00 0.00 0.00 61.98 61.04 1iav s VAL 51 Cb 0.30 -3.76 -0.11 0.00 0.00 0.00 0.00 36.38 32.81 1iav s VAL 51 CO 0.03 -0.38 1.55 -2.16 0.00 0.00 0.00 175.10 174.14 1iav s PRO 52 N 1.57 4.19 0.00 2.72 0.04 -1.26 -2.32 135.00 139.94 1iav s PRO 52 Ca 0.03 2.44 0.00 0.00 0.04 0.00 0.00 61.00 63.51 1iav s PRO 52 Cb -0.21 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1iav s PRO 52 CO 0.06 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 176.95 1iav n GLY 53 N 2.73 0.76 2.39 0.56 0.00 -1.26 -4.95 105.19 105.42 1iav n GLY 53 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 1iav n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1iav n GLU 54 N -2.00 0.32 0.14 1.61 1.02 -0.98 -5.00 120.64 115.74 1iav n GLU 54 Ca 0.00 -3.07 0.12 0.00 -0.02 0.00 0.00 57.16 54.19 1iav n GLU 54 Cb 0.00 -1.56 0.51 0.00 -0.02 0.00 0.00 31.44 30.37 1iav n GLU 54 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1iav n PRO 55 N 2.55 0.18 -3.14 3.49 -0.04 -1.26 -4.56 135.00 132.23 1iav n PRO 55 Ca 0.27 0.47 -0.28 0.00 -0.04 0.00 0.00 63.50 63.92 1iav n PRO 55 Cb 0.50 -1.90 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 1iav n PRO 55 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1iav s SER 56 N -4.21 6.43 0.00 3.54 0.15 -1.26 -4.51 113.70 113.83 1iav s SER 56 Ca 0.03 0.82 0.26 0.00 0.70 0.00 0.00 55.95 57.75 1iav s SER 56 Cb 0.09 -2.19 0.64 0.00 -1.71 0.00 0.00 66.02 62.85 1iav s SER 56 CO 0.35 -0.30 1.50 0.35 1.20 0.00 0.00 173.24 176.34 1iav n THR 57 N -1.27 0.00 -1.71 6.45 -2.24 -1.26 -4.79 114.28 109.46 1iav n THR 57 Ca -0.01 -0.24 -0.34 0.00 -2.27 0.00 0.00 64.05 61.19 1iav n THR 57 Cb 0.54 0.72 0.06 0.00 -2.10 0.00 0.00 70.33 69.56 1iav n THR 57 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1iav s GLN 58 N -2.27 2.60 -0.34 -0.78 -1.52 -1.26 -0.62 119.66 115.47 1iav s GLN 58 Ca 0.28 1.66 -0.14 0.00 -1.95 0.00 0.00 55.36 55.21 1iav s GLN 58 Cb 0.20 -1.90 -0.02 0.00 -0.22 0.00 0.00 33.01 31.07 1iav s GLN 58 CO 0.44 -1.46 0.29 0.34 -0.25 0.00 0.00 175.29 174.65 1iav s ASP 60 N -2.07 6.11 0.00 5.90 2.15 -1.26 -4.50 116.67 123.00 1iav s ASP 60 Ca 0.73 -0.30 0.20 0.00 0.43 0.00 0.00 52.55 53.60 1iav s ASP 60 Cb -0.27 -2.16 0.76 0.00 -0.30 0.00 0.00 42.92 40.95 1iav s ASP 60 CO 0.40 -0.27 1.54 0.61 -0.17 0.00 0.00 175.17 177.29 1iav n GLY 61 N 5.03 0.11 0.60 2.66 0.00 -1.26 -4.46 105.19 107.87 1iav n GLY 61 Ca -0.11 -0.37 -0.07 0.00 0.00 0.00 0.00 46.02 45.47 1iav n GLY 61 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1iav n ASN 62 N 0.17 1.19 0.00 1.61 2.85 -1.26 -4.80 115.26 115.02 1iav n ASN 62 Ca 0.15 0.06 0.00 0.00 -0.11 0.00 0.00 54.58 54.69 1iav n ASN 62 Cb 0.29 -0.20 0.00 0.00 1.24 0.00 0.00 39.78 41.11 1iav n ASN 62 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1iav n GLY 63 N 2.67 2.18 0.07 8.20 0.00 -1.26 -4.98 105.19 112.07 1iav n GLY 63 Ca -0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 1iav n GLY 63 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1iav h HIS 64 N 0.00 0.12 -0.76 1.61 6.17 -1.95 -1.91 115.15 118.43 1iav h HIS 64 Ca 0.00 -0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.06 1iav h HIS 64 Cb 0.00 -0.04 -0.04 0.00 2.52 0.00 0.00 27.41 29.86 1iav h HIS 64 CO 0.00 0.22 0.42 0.78 0.71 0.00 0.00 177.93 180.06 1iav h GLY 65 N -0.01 1.13 1.15 5.26 0.00 -1.89 -0.99 103.07 107.72 1iav h GLY 65 Ca 0.03 -0.50 -0.10 0.00 0.00 0.00 0.00 47.33 46.76 1iav h GLY 65 CO -0.00 0.48 -0.05 -0.84 0.00 0.00 0.00 176.54 176.13 1iav h THR 66 N 1.06 1.26 0.87 4.70 2.02 -1.58 0.13 112.91 121.38 1iav h THR 66 Ca 0.27 -1.18 -0.04 0.00 0.77 0.00 0.00 66.41 66.22 1iav h THR 66 Cb 0.02 0.88 0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1iav h THR 66 CO -0.04 0.42 -0.44 -0.74 0.37 0.00 0.00 175.52 175.09 1iav h HIS 67 N 0.92 -1.15 -0.24 3.16 6.17 -1.05 -2.04 115.15 120.91 1iav h HIS 67 Ca 0.16 -0.02 0.06 0.00 0.71 0.00 0.00 60.37 61.27 1iav h HIS 67 Cb 0.59 0.39 -0.07 0.00 2.52 0.00 0.00 27.41 30.84 1iav h HIS 67 CO 0.04 -0.70 -0.25 0.28 0.71 0.00 0.00 177.93 178.01 1iav h VAL 68 N -1.20 0.38 -0.88 5.26 2.07 -1.03 -2.20 116.25 118.65 1iav h VAL 68 Ca -0.12 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.50 1iav h VAL 68 Cb 0.93 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 1iav h VAL 68 CO 0.18 0.00 0.57 0.00 0.02 0.00 0.00 177.57 178.34 1iav h ALA 69 N 0.78 1.66 -0.06 1.67 0.00 -0.54 -2.41 119.26 120.35 1iav h ALA 69 Ca 0.14 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1iav h ALA 69 Cb 0.47 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1iav h ALA 69 CO -0.39 0.16 -0.43 0.78 0.00 0.00 0.00 179.25 179.37 1iav h GLY 70 N 0.86 0.14 1.23 0.00 0.00 -0.75 -0.89 103.07 103.67 1iav h GLY 70 Ca 0.41 -0.13 -0.07 0.00 0.00 0.00 0.00 47.33 47.54 1iav h GLY 70 CO -0.17 0.12 0.09 -0.84 0.00 0.00 0.00 176.54 175.74 1iav h THR 71 N 0.11 1.25 0.11 4.70 2.02 -1.15 -1.28 112.91 118.68 1iav h THR 71 Ca 0.01 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 1iav h THR 71 Cb 0.82 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1iav h THR 71 CO 0.06 0.36 -0.06 0.40 0.37 0.00 0.00 175.52 176.65 1iav h ILE 72 N 0.89 1.06 -0.17 3.11 2.04 -1.26 0.19 117.51 123.37 1iav h ILE 72 Ca 0.18 -1.19 -0.20 0.00 1.00 0.00 0.00 64.86 64.64 1iav h ILE 72 Cb 0.40 1.75 -0.39 0.00 -0.74 0.00 0.00 36.82 37.84 1iav h ILE 72 CO 0.01 0.26 -1.07 0.00 0.00 0.00 0.00 178.15 177.36 1iav n ALA 73 N -2.50 2.45 -1.74 1.87 0.00 -0.36 0.16 120.51 120.39 1iav n ALA 73 Ca -0.08 -2.50 -0.42 0.00 0.00 0.00 0.00 53.44 50.44 1iav n ALA 73 Cb 0.28 -0.79 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 1iav n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iav n ALA 74 N 0.05 2.27 -1.77 0.00 0.00 -0.49 -4.67 120.51 115.91 1iav n ALA 74 Ca 0.06 0.37 -0.41 0.00 0.00 0.00 0.00 53.44 53.47 1iav n ALA 74 Cb 1.01 -2.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.02 1iav n ALA 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1iav s LEU 75 N -0.56 4.37 -0.73 0.00 1.43 -0.02 -1.11 118.68 122.06 1iav s LEU 75 Ca 0.63 2.79 -0.24 0.00 -1.03 0.00 0.00 54.13 56.28 1iav s LEU 75 Cb -0.52 -3.69 0.06 0.00 0.03 0.00 0.00 46.19 42.07 1iav s LEU 75 CO 0.51 -0.68 1.12 0.21 0.23 0.00 0.00 176.35 177.74 1iav s ASN 76 N -0.43 6.22 0.00 2.29 2.47 -1.26 -4.63 114.94 119.60 1iav s ASN 76 Ca 0.51 -0.89 0.00 0.00 0.42 0.00 0.00 52.86 52.90 1iav s ASN 76 Cb -0.41 -2.48 0.00 0.00 -1.45 0.00 0.00 41.25 36.91 1iav s ASN 76 CO 0.55 -1.57 0.00 -0.46 -3.72 0.00 0.00 177.10 171.91 1iav n ASN 77 N 8.31 1.20 -1.51 -4.21 0.23 -1.26 -5.06 115.26 112.96 1iav n ASN 77 Ca 0.03 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.16 1iav n ASN 77 Cb 0.47 0.00 0.35 0.00 -2.08 0.00 0.00 39.78 38.52 1iav n ASN 77 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1iav n SER 78 N 0.00 4.82 -4.20 0.53 7.64 -1.26 -4.64 113.62 116.51 1iav n SER 78 Ca 0.00 -2.66 -0.16 0.00 1.01 0.00 0.00 58.87 57.05 1iav n SER 78 Cb 0.00 -0.58 -0.10 0.00 -1.01 0.00 0.00 64.21 62.52 1iav n SER 78 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1iav s ILE 79 N -2.24 0.39 0.00 0.44 -4.36 -1.26 -1.92 121.20 112.25 1iav s ILE 79 Ca 0.49 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.88 1iav s ILE 79 Cb 0.35 -2.58 0.00 0.00 1.25 0.00 0.00 42.46 41.48 1iav s ILE 79 CO 0.19 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.98 1iav n GLY 80 N -0.47 3.24 0.00 6.27 0.00 -1.25 -4.47 105.19 108.52 1iav n GLY 80 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1iav n GLY 80 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1iav n VAL 81 N 0.00 0.00 -3.80 1.61 0.24 -1.26 -0.99 118.33 114.12 1iav n VAL 81 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.16 1iav n VAL 81 Cb 0.00 0.00 -0.15 0.00 -1.47 0.00 0.00 33.84 32.22 1iav n VAL 81 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1iav s LEU 82 N 0.00 1.34 0.76 1.34 2.96 -1.23 -4.52 118.68 119.34 1iav s LEU 82 Ca 0.00 0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.95 1iav s LEU 82 Cb 0.00 0.05 0.14 0.00 0.50 0.00 0.00 46.19 46.88 1iav s LEU 82 CO 0.00 -0.09 1.06 -0.83 -1.32 0.00 0.00 176.35 175.17 1iav s GLY 83 N 0.68 1.76 0.18 7.98 0.00 -0.26 -4.71 107.32 112.95 1iav s GLY 83 Ca -0.06 -1.59 -0.08 0.00 0.00 0.00 0.00 44.72 43.00 1iav s GLY 83 CO -0.02 -0.99 1.57 -2.08 0.00 0.00 0.00 173.10 171.57 1iav h VAL 84 N -0.74 1.27 -2.51 1.40 2.07 -0.21 -3.35 116.25 114.18 1iav h VAL 84 Ca -0.38 -1.41 -0.60 0.00 0.82 0.00 0.00 66.70 65.13 1iav h VAL 84 Cb 1.26 1.21 -0.40 0.00 -1.52 0.00 0.00 31.29 31.84 1iav h VAL 84 CO 0.41 0.48 -0.77 0.00 0.02 0.00 0.00 177.57 177.70 1iav n ALA 85 N -2.52 3.26 0.26 1.67 0.00 0.12 -4.89 120.51 118.40 1iav n ALA 85 Ca -0.00 -4.02 0.13 0.00 0.00 0.00 0.00 53.44 49.54 1iav n ALA 85 Cb 0.47 -0.89 0.62 0.00 0.00 0.00 0.00 19.45 19.65 1iav n ALA 85 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1iav h PRO 86 N 4.94 0.00 -0.04 0.00 0.13 -1.62 -1.86 132.00 133.54 1iav h PRO 86 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1iav h PRO 86 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1iav h PRO 86 CO 0.61 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.47 1iav n ASN 87 N -2.37 2.93 -4.70 1.44 4.13 0.05 -4.54 115.26 112.20 1iav n ASN 87 Ca -0.00 -1.95 -0.36 0.00 1.68 0.00 0.00 54.58 53.94 1iav n ASN 87 Cb 0.11 -0.01 0.08 0.00 -1.54 0.00 0.00 39.78 38.42 1iav n ASN 87 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1iav n ALA 88 N 1.29 0.68 -2.55 5.41 0.00 -0.70 -3.82 120.51 120.82 1iav n ALA 88 Ca 0.14 -0.09 -0.43 0.00 0.00 0.00 0.00 53.44 53.06 1iav n ALA 88 Cb 0.57 -2.27 -0.05 0.00 0.00 0.00 0.00 19.45 17.71 1iav n ALA 88 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1iav s GLU 89 N -3.46 3.47 -0.12 0.00 2.02 -0.17 -4.98 118.70 115.46 1iav s GLU 89 Ca 0.79 0.02 -0.20 0.00 0.02 0.00 0.00 54.97 55.60 1iav s GLU 89 Cb -0.36 -3.93 -0.04 0.00 0.10 0.00 0.00 34.13 29.90 1iav s GLU 89 CO 0.44 -1.15 0.58 -1.17 0.02 0.00 0.00 175.26 173.97 1iav s LEU 90 N 3.48 4.25 -0.10 1.80 2.96 -1.26 -0.76 118.68 129.05 1iav s LEU 90 Ca 0.33 0.92 0.04 0.00 -0.22 0.00 0.00 54.13 55.19 1iav s LEU 90 Cb -0.11 -2.85 -0.00 0.00 0.50 0.00 0.00 46.19 43.72 1iav s LEU 90 CO 0.24 -0.10 -0.23 -0.31 -1.32 0.00 0.00 176.35 174.63 1iav s TYR 91 N 1.01 2.58 -0.50 5.38 1.51 0.46 -0.37 117.35 127.42 1iav s TYR 91 Ca 0.30 -0.96 -0.22 0.00 -1.01 0.00 0.00 57.07 55.18 1iav s TYR 91 Cb -0.16 -1.72 0.04 0.00 -0.11 0.00 0.00 41.96 40.01 1iav s TYR 91 CO 0.13 -0.37 0.79 0.00 -1.11 0.00 0.00 175.55 174.99 1iav s ALA 92 N 0.29 3.27 -0.45 3.71 0.00 0.22 -1.46 121.76 127.34 1iav s ALA 92 Ca -0.16 -1.30 -0.07 0.00 0.00 0.00 0.00 51.96 50.43 1iav s ALA 92 Cb -0.17 -3.53 0.11 0.00 0.00 0.00 0.00 23.12 19.53 1iav s ALA 92 CO 0.08 -2.11 0.29 0.08 0.00 0.00 0.00 175.76 174.10 1iav s VAL 93 N 3.34 3.93 -0.54 0.00 1.01 -0.77 -1.83 120.40 125.54 1iav s VAL 93 Ca 0.26 -1.82 -0.26 0.00 0.00 0.00 0.00 61.98 60.16 1iav s VAL 93 Cb -0.14 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.68 1iav s VAL 93 CO 0.18 -0.72 1.02 -0.75 0.00 0.00 0.00 175.10 174.83 1iav s LYS 94 N 1.30 3.43 0.00 2.72 2.20 -0.07 -2.32 119.74 127.00 1iav s LYS 94 Ca 0.06 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.64 1iav s LYS 94 Cb -0.25 -4.02 0.00 0.00 -1.51 0.00 0.00 37.83 32.05 1iav s LYS 94 CO -0.01 -1.49 0.02 1.33 -0.36 0.00 0.00 175.35 174.83 1iav n VAL 95 N 6.39 0.00 -4.56 4.02 0.24 -0.05 -0.55 118.33 123.82 1iav n VAL 95 Ca 0.05 -0.50 -0.26 0.00 -2.04 0.00 0.00 64.34 61.59 1iav n VAL 95 Cb 0.48 1.00 -0.14 0.00 -1.47 0.00 0.00 33.84 33.71 1iav n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1iav s LEU 96 N -1.91 2.22 0.93 1.34 1.43 -0.71 -4.37 118.68 117.62 1iav s LEU 96 Ca 0.00 -0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 52.37 1iav s LEU 96 Cb 0.00 -1.02 0.20 0.00 0.03 0.00 0.00 46.19 45.40 1iav s LEU 96 CO 0.00 0.15 1.27 -0.83 0.23 0.00 0.00 176.35 177.17 1iav s GLY 97 N -1.46 1.80 0.38 -3.19 0.00 -0.65 -4.06 107.32 100.14 1iav s GLY 97 Ca 0.08 -1.40 0.15 0.00 0.00 0.00 0.00 44.72 43.56 1iav s GLY 97 CO 0.03 -0.63 1.79 0.00 0.00 0.00 0.00 173.10 174.28 1iav h ALA 98 N -1.48 2.10 0.00 3.20 0.00 -1.87 0.32 119.26 121.53 1iav h ALA 98 Ca -0.42 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1iav h ALA 98 Cb 1.23 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1iav h ALA 98 CO 0.35 -0.48 -0.03 0.66 0.00 0.00 0.00 179.25 179.75 1iav h SER 99 N 0.48 0.00 0.00 0.00 4.64 -1.93 -3.38 113.55 113.36 1iav h SER 99 Ca 0.57 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1iav h SER 99 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1iav h SER 99 CO -0.29 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.31 1iav n GLY 100 N -0.82 0.77 3.48 -0.77 0.00 0.11 -5.08 105.19 102.88 1iav n GLY 100 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 1iav n GLY 100 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iav s SER 101 N -2.40 3.69 0.36 1.61 1.04 -1.25 -4.81 113.70 111.95 1iav s SER 101 Ca 0.00 -0.86 -0.09 0.00 0.48 0.00 0.00 55.95 55.49 1iav s SER 101 Cb 0.00 -0.38 0.04 0.00 0.10 0.00 0.00 66.02 65.77 1iav s SER 101 CO 0.00 0.08 0.63 0.61 0.98 0.00 0.00 173.24 175.55 1iav n GLY 102 N -0.13 1.51 3.93 7.32 0.00 -1.26 -1.64 105.19 114.92 1iav n GLY 102 Ca -0.09 -1.41 -0.26 0.00 0.00 0.00 0.00 46.02 44.26 1iav n GLY 102 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iav s SER 103 N -3.04 6.34 0.56 1.61 1.04 -1.26 -4.97 113.70 113.97 1iav s SER 103 Ca 0.21 0.57 0.31 0.00 0.48 0.00 0.00 55.95 57.52 1iav s SER 103 Cb -0.03 -2.09 1.64 0.00 0.10 0.00 0.00 66.02 65.65 1iav s SER 103 CO 0.15 -0.28 2.14 -0.37 0.98 0.00 0.00 173.24 175.86 1iav h VAL 104 N 0.91 0.44 -0.04 5.02 -1.51 -1.98 -1.57 116.25 117.51 1iav h VAL 104 Ca -0.49 -0.37 -0.00 0.00 -1.23 0.00 0.00 66.70 64.61 1iav h VAL 104 Cb 1.21 1.25 -0.00 0.00 -2.13 0.00 0.00 31.29 31.62 1iav h VAL 104 CO 0.63 0.07 0.01 -1.28 -1.23 0.00 0.00 177.57 175.77 1iav h SER 105 N 0.00 0.06 -0.71 4.19 0.87 -1.98 0.65 113.55 116.64 1iav h SER 105 Ca -0.00 -0.22 -0.07 0.00 -1.23 0.00 0.00 61.79 60.28 1iav h SER 105 Cb 0.24 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 1iav h SER 105 CO 0.01 0.27 0.19 0.28 -0.53 0.00 0.00 176.83 177.04 1iav h SER 106 N -0.14 1.06 -0.52 6.23 0.02 -1.64 -1.70 113.55 116.86 1iav h SER 106 Ca 0.01 -0.23 -0.06 0.00 -0.84 0.00 0.00 61.79 60.67 1iav h SER 106 Cb 0.23 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 1iav h SER 106 CO -0.00 1.01 0.07 0.40 -1.14 0.00 0.00 176.83 177.18 1iav h ILE 107 N 1.06 1.25 -0.27 3.27 2.04 -1.07 -1.58 117.51 122.22 1iav h ILE 107 Ca 0.22 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 65.12 1iav h ILE 107 Cb 0.35 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1iav h ILE 107 CO -0.00 0.35 0.17 0.00 0.00 0.00 0.00 178.15 178.67 1iav h ALA 108 N 0.98 0.35 -0.82 1.87 0.00 0.60 -2.06 119.26 120.17 1iav h ALA 108 Ca 0.16 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1iav h ALA 108 Cb 0.42 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1iav h ALA 108 CO 0.01 -0.17 0.48 1.96 0.00 0.00 0.00 179.25 181.54 1iav h GLN 109 N 0.36 0.83 -0.64 0.00 4.20 -1.24 -1.10 115.11 117.50 1iav h GLN 109 Ca 0.10 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 1iav h GLN 109 Cb -0.02 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 1iav h GLN 109 CO -0.02 0.55 0.21 0.78 -0.67 0.00 0.00 178.83 179.67 1iav h GLY 110 N 0.85 1.05 1.50 3.46 0.00 -0.83 -0.31 103.07 108.80 1iav h GLY 110 Ca 0.37 -0.59 -0.16 0.00 0.00 0.00 0.00 47.33 46.96 1iav h GLY 110 CO -0.21 0.55 -0.56 1.41 0.00 0.00 0.00 176.54 177.74 1iav h LEU 111 N 0.95 0.58 -0.19 3.11 3.38 -0.80 -0.30 115.31 122.04 1iav h LEU 111 Ca 0.21 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1iav h LEU 111 Cb 0.26 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1iav h LEU 111 CO -0.01 1.02 0.07 -0.08 0.09 0.00 0.00 178.44 179.53 1iav h GLU 112 N 0.40 0.29 -0.28 1.13 4.81 -1.02 -1.07 114.58 118.85 1iav h GLU 112 Ca 0.01 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.24 1iav h GLU 112 Cb 1.10 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 30.37 1iav h GLU 112 CO 0.10 0.38 -0.14 2.35 -0.73 0.00 0.00 179.01 180.97 1iav h TRP 113 N 0.15 -0.34 -0.67 0.92 7.01 -0.93 0.16 115.95 122.26 1iav h TRP 113 Ca 0.06 0.03 0.03 0.00 2.11 0.00 0.00 58.89 61.12 1iav h TRP 113 Cb 0.20 0.19 -0.04 0.00 -2.10 0.00 0.00 29.16 27.41 1iav h TRP 113 CO -0.01 -0.21 0.42 0.00 -2.79 0.00 0.00 178.44 175.85 1iav h ALA 114 N 1.12 0.87 -0.03 2.65 0.00 -0.66 -0.69 119.26 122.52 1iav h ALA 114 Ca 0.15 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1iav h ALA 114 Cb 0.32 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1iav h ALA 114 CO -0.34 0.18 -0.51 0.78 0.00 0.00 0.00 179.25 179.35 1iav h GLY 115 N 0.82 0.09 2.00 0.00 0.00 -0.35 -2.00 103.07 103.62 1iav h GLY 115 Ca 0.27 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1iav h GLY 115 CO -0.11 0.09 -0.04 3.43 0.00 0.00 0.00 176.54 179.91 1iav h ASN 116 N 0.07 0.00 -0.42 0.19 2.35 0.11 -3.25 115.58 114.62 1iav h ASN 116 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1iav h ASN 116 Cb 0.93 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.30 1iav h ASN 116 CO 0.07 0.04 0.00 0.59 -1.65 0.00 0.00 177.43 176.49 1iav n ASN 117 N -3.12 3.84 -3.60 5.81 4.13 -0.34 -4.99 115.26 116.99 1iav n ASN 117 Ca 0.03 -2.46 -0.24 0.00 1.68 0.00 0.00 54.58 53.59 1iav n ASN 117 Cb 0.48 -0.44 0.08 0.00 -1.54 0.00 0.00 39.78 38.35 1iav n ASN 117 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1iav n GLY 118 N 0.41 -0.54 3.76 7.41 0.00 -1.09 -4.98 105.19 110.16 1iav n GLY 118 Ca 0.19 0.25 -0.41 0.00 0.00 0.00 0.00 46.02 46.05 1iav n GLY 118 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1iav s MET 119 N -6.27 4.46 0.01 1.61 -1.94 -0.77 -4.84 119.30 111.57 1iav s MET 119 Ca 0.55 2.04 -0.10 0.00 -1.71 0.00 0.00 55.69 56.48 1iav s MET 119 Cb -0.25 -3.13 -0.31 0.00 2.01 0.00 0.00 34.83 33.15 1iav s MET 119 CO 0.73 -0.05 0.92 0.45 -0.01 0.00 0.00 175.02 177.06 1iav h HIS 120 N 3.85 0.71 -3.90 -0.03 3.86 -1.13 -3.38 115.15 115.12 1iav h HIS 120 Ca -0.47 -0.52 -0.34 0.00 -1.16 0.00 0.00 60.37 57.88 1iav h HIS 120 Cb 1.22 -0.03 -0.29 0.00 1.06 0.00 0.00 27.41 29.37 1iav h HIS 120 CO 0.58 1.50 -0.76 0.08 0.86 0.00 0.00 177.93 180.19 1iav s VAL 121 N -2.61 0.45 -0.15 2.45 1.01 -1.03 -0.49 120.40 120.03 1iav s VAL 121 Ca -0.10 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1iav s VAL 121 Cb 0.06 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 36.07 1iav s VAL 121 CO 0.89 0.13 -0.16 0.00 0.00 0.00 0.00 175.10 175.97 1iav s ALA 122 N -0.08 1.94 -0.45 5.51 0.00 -0.49 -0.89 121.76 127.30 1iav s ALA 122 Ca 0.02 -0.95 -0.18 0.00 0.00 0.00 0.00 51.96 50.85 1iav s ALA 122 Cb -0.03 -1.05 0.04 0.00 0.00 0.00 0.00 23.12 22.08 1iav s ALA 122 CO -0.00 -0.33 0.48 1.21 0.00 0.00 0.00 175.76 177.12 1iav s ASN 123 N 1.37 6.20 -0.60 0.00 2.47 0.27 -1.08 114.94 123.57 1iav s ASN 123 Ca 0.03 -0.80 -0.02 0.00 0.42 0.00 0.00 52.86 52.50 1iav s ASN 123 Cb -0.13 -2.24 0.15 0.00 -1.45 0.00 0.00 41.25 37.59 1iav s ASN 123 CO -0.10 -0.66 0.40 -0.76 -3.72 0.00 0.00 177.10 172.26 1iav s LEU 124 N 2.20 5.08 -1.27 3.21 1.43 -0.06 -1.29 118.68 127.97 1iav s LEU 124 Ca 0.12 -2.86 -0.06 0.00 -1.03 0.00 0.00 54.13 50.30 1iav s LEU 124 Cb -0.18 -1.81 0.16 0.00 0.03 0.00 0.00 46.19 44.38 1iav s LEU 124 CO 0.13 -0.35 2.12 -1.20 0.23 0.00 0.00 176.35 177.28 1iav n SER 125 N 3.45 6.92 -3.86 2.29 7.64 -1.26 -2.22 113.62 126.59 1iav n SER 125 Ca 0.07 -3.19 -0.07 0.00 1.01 0.00 0.00 58.87 56.69 1iav n SER 125 Cb 0.37 -1.38 -0.02 0.00 -1.01 0.00 0.00 64.21 62.17 1iav n SER 125 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1iav s LEU 126 N -1.69 -0.20 0.00 -3.43 0.05 -1.26 -4.97 118.68 107.18 1iav s LEU 126 Ca 0.47 -0.62 0.00 0.00 0.05 0.00 0.00 54.13 54.02 1iav s LEU 126 Cb 0.15 2.60 0.00 0.00 -2.05 0.00 0.00 46.19 46.89 1iav s LEU 126 CO -0.05 -1.31 0.00 0.61 -0.55 0.00 0.00 176.35 175.05 1iav n GLY 127 N -0.45 1.32 3.11 -3.48 0.00 -1.26 -4.39 105.19 100.05 1iav n GLY 127 Ca -0.04 -0.87 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 1iav n GLY 127 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iav s SER 128 N 0.00 1.04 0.24 1.61 0.15 0.67 -4.92 113.70 112.50 1iav s SER 128 Ca 0.00 -0.68 0.26 0.00 0.70 0.00 0.00 55.95 56.22 1iav s SER 128 Cb 0.00 0.04 0.81 0.00 -1.71 0.00 0.00 66.02 65.16 1iav s SER 128 CO 0.00 -0.26 1.76 1.55 1.20 0.00 0.00 173.24 177.49 1iav h PRO 129 N 4.05 0.00 -5.54 5.44 0.13 -1.93 0.43 132.00 134.57 1iav h PRO 129 Ca -0.36 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.13 1iav h PRO 129 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.24 1iav h PRO 129 CO 0.47 0.00 -0.45 -1.12 -0.23 0.00 0.00 178.00 176.67 1iav s SER 130 N -4.64 6.37 0.54 1.44 0.01 -1.26 -4.77 113.70 111.38 1iav s SER 130 Ca 0.09 0.43 -0.18 0.00 1.31 0.00 0.00 55.95 57.60 1iav s SER 130 Cb 0.11 -2.10 -0.06 0.00 0.21 0.00 0.00 66.02 64.19 1iav s SER 130 CO 0.57 0.31 1.06 -2.16 0.41 0.00 0.00 173.24 173.43 1iav s PRO 131 N -0.52 3.55 -0.07 12.44 0.04 -1.26 -4.67 135.00 144.51 1iav s PRO 131 Ca 0.14 1.32 -0.01 0.00 0.04 0.00 0.00 61.00 62.48 1iav s PRO 131 Cb -0.12 -2.06 0.03 0.00 0.04 0.00 0.00 34.50 32.39 1iav s PRO 131 CO 0.03 -0.64 -0.01 0.45 0.04 0.00 0.00 177.00 176.87 1iav s SER 132 N -2.31 1.59 0.29 6.66 0.15 -1.26 -5.04 113.70 113.77 1iav s SER 132 Ca 0.66 -0.12 -0.01 0.00 0.70 0.00 0.00 55.95 57.18 1iav s SER 132 Cb -0.17 -0.50 0.41 0.00 -1.71 0.00 0.00 66.02 64.06 1iav s SER 132 CO 0.28 -0.17 1.86 0.00 1.20 0.00 0.00 173.24 176.41 1iav h ALA 133 N 8.17 1.26 -0.03 5.45 0.00 -1.99 -0.89 119.26 131.24 1iav h ALA 133 Ca -0.23 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1iav h ALA 133 Cb 1.13 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1iav h ALA 133 CO 0.30 0.54 0.01 1.15 0.00 0.00 0.00 179.25 181.26 1iav h THR 134 N 0.87 1.06 -0.59 0.00 2.02 -1.96 -1.89 112.91 112.41 1iav h THR 134 Ca 0.20 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1iav h THR 134 Cb 0.20 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 1iav h THR 134 CO -0.02 0.05 0.31 0.25 0.37 0.00 0.00 175.52 176.49 1iav h LEU 135 N -0.03 0.75 -0.85 2.58 5.85 -1.80 -2.15 115.31 119.66 1iav h LEU 135 Ca 0.01 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 1iav h LEU 135 Cb 0.06 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1iav h LEU 135 CO -0.00 0.64 0.42 -0.08 -0.34 0.00 0.00 178.44 179.07 1iav h GLU 136 N 0.80 1.21 -0.65 1.25 4.81 -1.00 0.56 114.58 121.57 1iav h GLU 136 Ca 0.21 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1iav h GLU 136 Cb 0.07 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1iav h GLU 136 CO -0.03 0.92 0.29 0.37 -0.73 0.00 0.00 179.01 179.83 1iav h GLN 137 N 1.20 0.95 -0.55 1.92 4.15 -1.18 0.47 115.11 122.07 1iav h GLN 137 Ca 0.29 -0.15 -0.06 0.00 0.77 0.00 0.00 58.65 59.50 1iav h GLN 137 Cb 0.10 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 1iav h GLN 137 CO -0.04 0.77 0.10 0.00 -1.93 0.00 0.00 178.83 177.73 1iav h ALA 138 N 1.13 0.73 -0.14 3.38 0.00 -1.09 0.17 119.26 123.44 1iav h ALA 138 Ca 0.22 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1iav h ALA 138 Cb 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1iav h ALA 138 CO -0.02 0.46 0.06 0.28 0.00 0.00 0.00 179.25 180.03 1iav h VAL 139 N 0.80 0.98 -0.50 0.00 2.07 -0.34 -0.67 116.25 118.58 1iav h VAL 139 Ca 0.17 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.58 1iav h VAL 139 Cb 0.40 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 1iav h VAL 139 CO 0.01 0.02 0.06 0.78 0.02 0.00 0.00 177.57 178.46 1iav h ASN 140 N 0.13 0.76 -0.13 0.57 -0.26 -0.66 -1.71 115.58 114.29 1iav h ASN 140 Ca 0.06 -0.16 -0.06 0.00 -0.56 0.00 0.00 56.30 55.58 1iav h ASN 140 Cb 0.02 -0.20 -0.00 0.00 -1.06 0.00 0.00 38.32 37.08 1iav h ASN 140 CO -0.05 0.79 -0.15 -1.28 -1.06 0.00 0.00 177.43 175.68 1iav h SER 141 N 0.76 0.36 -0.77 5.81 0.87 -0.49 -1.44 113.55 118.65 1iav h SER 141 Ca 0.16 -0.50 0.04 0.00 -1.23 0.00 0.00 61.79 60.26 1iav h SER 141 Cb 0.38 -0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.19 1iav h SER 141 CO 0.01 0.78 0.48 0.00 -0.53 0.00 0.00 176.83 177.57 1iav h ALA 142 N 0.58 1.03 -0.99 6.23 0.00 -1.06 -1.68 119.26 123.37 1iav h ALA 142 Ca 0.02 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1iav h ALA 142 Cb 0.69 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1iav h ALA 142 CO 0.04 0.24 0.65 1.15 0.00 0.00 0.00 179.25 181.33 1iav h THR 143 N 0.91 1.26 0.00 0.00 2.02 -1.16 -1.58 112.91 114.36 1iav h THR 143 Ca 0.32 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1iav h THR 143 Cb 0.09 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.31 1iav h THR 143 CO -0.14 0.25 0.00 -1.54 0.37 0.00 0.00 175.52 174.46 1iav n SER 144 N -4.38 0.00 -1.05 4.18 3.41 -0.56 -1.86 113.62 113.37 1iav n SER 144 Ca 0.12 -0.05 0.07 0.00 -0.26 0.00 0.00 58.87 58.75 1iav n SER 144 Cb 0.02 -0.30 0.24 0.00 -0.26 0.00 0.00 64.21 63.90 1iav n SER 144 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1iav n ARG 145 N -1.30 2.51 -0.88 4.33 1.74 -0.67 -4.93 116.66 117.45 1iav n ARG 145 Ca 0.12 -1.90 0.00 0.00 -0.77 0.00 0.00 57.85 55.30 1iav n ARG 145 Cb 0.23 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1iav n ARG 145 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iav n GLY 146 N 1.12 0.53 3.75 -0.13 0.00 -0.78 -4.94 105.19 104.73 1iav n GLY 146 Ca 0.17 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 1iav n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iav s VAL 147 N -2.00 4.95 -0.35 1.61 1.01 -0.74 -4.44 120.40 120.44 1iav s VAL 147 Ca 0.00 1.29 -0.22 0.00 0.00 0.00 0.00 61.98 63.04 1iav s VAL 147 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1iav s VAL 147 CO 0.00 0.37 0.74 -0.22 0.00 0.00 0.00 175.10 175.99 1iav s LEU 148 N 0.09 4.15 -0.20 3.92 2.96 0.36 -4.03 118.68 125.92 1iav s LEU 148 Ca 0.32 0.36 -0.15 0.00 -0.22 0.00 0.00 54.13 54.45 1iav s LEU 148 Cb -0.18 -2.96 -0.04 0.00 0.50 0.00 0.00 46.19 43.51 1iav s LEU 148 CO 0.17 -0.66 0.35 -0.69 -1.32 0.00 0.00 176.35 174.20 1iav s VAL 149 N 2.95 5.24 -0.17 1.68 1.01 -1.26 -1.39 120.40 128.44 1iav s VAL 149 Ca 0.29 0.60 0.00 0.00 0.00 0.00 0.00 61.98 62.88 1iav s VAL 149 Cb -0.14 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.57 1iav s VAL 149 CO 0.15 0.28 -0.16 -0.69 0.00 0.00 0.00 175.10 174.68 1iav s VAL 150 N 1.17 2.45 0.06 2.92 1.01 -0.24 -0.34 120.40 127.41 1iav s VAL 150 Ca 0.17 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.36 1iav s VAL 150 Cb -0.14 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1iav s VAL 150 CO 0.07 0.51 -0.11 0.00 0.00 0.00 0.00 175.10 175.57 1iav s ALA 151 N 1.12 0.88 0.33 5.51 0.00 -0.14 -0.88 121.76 128.58 1iav s ALA 151 Ca 0.01 -0.87 -0.28 0.00 0.00 0.00 0.00 51.96 50.81 1iav s ALA 151 Cb -0.14 -0.04 -0.09 0.00 0.00 0.00 0.00 23.12 22.85 1iav s ALA 151 CO -0.06 0.08 1.18 0.00 0.00 0.00 0.00 175.76 176.96 1iav s ALA 152 N -1.29 3.36 -0.31 0.00 0.00 -0.94 -1.28 121.76 121.31 1iav s ALA 152 Ca -0.05 1.03 0.27 0.00 0.00 0.00 0.00 51.96 53.20 1iav s ALA 152 Cb -0.10 -3.39 0.87 0.00 0.00 0.00 0.00 23.12 20.50 1iav s ALA 152 CO 0.01 -0.41 1.78 0.66 0.00 0.00 0.00 175.76 177.81 1iav h SER 153 N 3.34 0.00 -5.00 0.00 4.64 -0.24 -3.42 113.55 112.87 1iav h SER 153 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1iav h SER 153 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1iav h SER 153 CO 0.65 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.22 1iav n GLY 154 N 0.60 2.89 1.03 -0.77 0.00 -1.26 -1.60 105.19 106.08 1iav n GLY 154 Ca 0.03 -1.95 0.03 0.00 0.00 0.00 0.00 46.02 44.13 1iav n GLY 154 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1iav n ASN 155 N 0.00 3.43 0.09 1.61 3.02 -1.25 -1.27 115.26 120.88 1iav n ASN 155 Ca 0.00 -3.28 0.13 0.00 -0.03 0.00 0.00 54.58 51.39 1iav n ASN 155 Cb 0.00 -0.59 0.34 0.00 -0.61 0.00 0.00 39.78 38.92 1iav n ASN 155 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1iav n SER 156 N -0.74 0.77 0.00 6.41 3.41 -1.16 -4.73 113.62 117.59 1iav n SER 156 Ca 0.27 0.43 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 1iav n SER 156 Cb 0.97 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1iav n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iav n GLY 157 N 1.32 0.85 3.84 5.00 0.00 -0.10 -4.97 105.19 111.12 1iav n GLY 157 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1iav n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iav s ALA 158 N -3.37 3.01 -0.44 4.61 0.00 -1.26 -4.79 121.76 119.53 1iav s ALA 158 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1iav s ALA 158 Cb 0.00 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.98 1iav s ALA 158 CO 0.00 -0.32 0.61 0.41 0.00 0.00 0.00 175.76 176.46 1iav n GLY 159 N -1.46 1.38 3.16 0.00 0.00 -1.26 -1.90 105.19 105.11 1iav n GLY 159 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 1iav n GLY 159 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iav s SER 160 N 0.47 0.03 0.25 1.61 1.04 -0.25 -4.18 113.70 112.67 1iav s SER 160 Ca 0.00 -0.30 0.06 0.00 0.48 0.00 0.00 55.95 56.19 1iav s SER 160 Cb 0.00 0.26 -0.03 0.00 0.10 0.00 0.00 66.02 66.35 1iav s SER 160 CO 0.00 -0.49 0.26 0.27 0.98 0.00 0.00 173.24 174.26 1iav s ILE 165 N -2.12 4.70 0.89 -1.02 -4.36 -1.22 -4.21 121.20 113.86 1iav s ILE 165 Ca -0.09 -1.25 -0.12 0.00 -0.26 0.00 0.00 60.65 58.93 1iav s ILE 165 Cb -0.03 -3.56 0.13 0.00 1.25 0.00 0.00 42.46 40.24 1iav s ILE 165 CO -0.02 -0.34 1.10 -0.44 0.24 0.00 0.00 174.94 175.49 1iav s SER 166 N -3.90 3.59 -0.11 4.36 0.01 -0.63 -4.68 113.70 112.34 1iav s SER 166 Ca 0.34 1.31 -0.06 0.00 1.31 0.00 0.00 55.95 58.85 1iav s SER 166 Cb -0.08 -1.98 -0.04 0.00 0.21 0.00 0.00 66.02 64.13 1iav s SER 166 CO 0.26 -2.54 0.10 -0.31 0.41 0.00 0.00 173.24 171.17 1iav s TYR 167 N -3.05 3.47 -2.22 2.43 1.51 0.15 0.13 117.35 119.77 1iav s TYR 167 Ca 0.63 0.43 0.21 0.00 -1.01 0.00 0.00 57.07 57.33 1iav s TYR 167 Cb -0.17 -1.90 0.88 0.00 -0.11 0.00 0.00 41.96 40.66 1iav s TYR 167 CO 0.56 0.66 1.61 -0.35 -1.11 0.00 0.00 175.55 176.92 1iav n PRO 168 N 2.05 1.54 0.13 -1.71 -0.04 -1.26 -0.23 135.00 135.47 1iav n PRO 168 Ca -0.20 -0.82 0.10 0.00 -0.04 0.00 0.00 63.50 62.55 1iav n PRO 168 Cb 0.55 -1.38 0.60 0.00 -0.04 0.00 0.00 33.50 33.22 1iav n PRO 168 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iav h ALA 169 N 3.97 2.05 -0.43 0.55 0.00 -1.61 -1.80 119.26 121.98 1iav h ALA 169 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1iav h ALA 169 Cb 0.37 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1iav h ALA 169 CO 0.00 -0.09 0.27 -0.09 0.00 0.00 0.00 179.25 179.34 1iav h ARG 170 N 0.14 0.57 -6.95 0.00 9.65 -0.58 -3.38 114.38 113.83 1iav h ARG 170 Ca 0.10 -0.04 -0.55 0.00 -1.10 0.00 0.00 59.98 58.40 1iav h ARG 170 Cb 0.24 -0.13 0.12 0.00 -1.39 0.00 0.00 29.97 28.82 1iav h ARG 170 CO -0.01 0.38 0.65 0.66 2.80 0.00 0.00 179.97 184.45 1iav n TYR 171 N -4.46 2.57 -0.28 2.20 4.01 -0.68 -4.83 117.16 115.69 1iav n TYR 171 Ca 0.03 0.45 0.13 0.00 -0.16 0.00 0.00 57.90 58.36 1iav n TYR 171 Cb 0.06 -2.44 0.39 0.00 -0.31 0.00 0.00 39.34 37.05 1iav n TYR 171 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1iav h ALA 172 N 2.24 1.87 -0.00 -0.72 0.00 -1.89 -2.20 119.26 118.57 1iav h ALA 172 Ca -0.50 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1iav h ALA 172 Cb 1.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1iav h ALA 172 CO 0.61 -0.14 -0.06 0.09 0.00 0.00 0.00 179.25 179.75 1iav n ASN 173 N -4.58 0.39 -4.85 0.00 5.03 -1.26 -4.77 115.26 105.23 1iav n ASN 173 Ca 0.18 -0.68 -0.37 0.00 0.87 0.00 0.00 54.58 54.58 1iav n ASN 173 Cb 0.52 -0.09 -0.06 0.00 -1.02 0.00 0.00 39.78 39.13 1iav n ASN 173 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1iav s ALA 174 N -2.35 3.78 -0.46 5.41 0.00 -0.83 -4.47 121.76 122.85 1iav s ALA 174 Ca 0.34 -0.46 -0.21 0.00 0.00 0.00 0.00 51.96 51.63 1iav s ALA 174 Cb 0.21 -2.18 0.03 0.00 0.00 0.00 0.00 23.12 21.18 1iav s ALA 174 CO 0.44 0.51 0.68 1.41 0.00 0.00 0.00 175.76 178.80 1iav s MET 175 N -0.90 3.27 -0.18 0.00 1.75 0.53 -4.81 119.30 118.96 1iav s MET 175 Ca 0.18 -0.40 -0.22 0.00 -1.25 0.00 0.00 55.69 54.00 1iav s MET 175 Cb -0.14 -3.98 -0.02 0.00 2.84 0.00 0.00 34.83 33.53 1iav s MET 175 CO 0.08 -1.08 0.70 0.00 -0.65 0.00 0.00 175.02 174.06 1iav s ALA 176 N 2.93 3.52 -0.17 4.11 0.00 -1.26 -0.97 121.76 129.92 1iav s ALA 176 Ca 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 51.96 52.03 1iav s ALA 176 Cb -0.14 -3.05 -0.00 0.00 0.00 0.00 0.00 23.12 19.92 1iav s ALA 176 CO 0.19 -0.56 -0.12 0.08 0.00 0.00 0.00 175.76 175.35 1iav s VAL 177 N 1.92 2.88 0.54 0.00 1.01 -0.41 -0.81 120.40 125.52 1iav s VAL 177 Ca 0.32 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.68 1iav s VAL 177 Cb -0.16 -2.25 0.04 0.00 0.00 0.00 0.00 36.38 34.01 1iav s VAL 177 CO 0.11 0.49 0.48 -0.83 0.00 0.00 0.00 175.10 175.35 1iav s GLY 178 N 0.99 2.22 -0.01 4.51 0.00 -0.44 0.50 107.32 115.09 1iav s GLY 178 Ca -0.01 -1.52 0.05 0.00 0.00 0.00 0.00 44.72 43.24 1iav s GLY 178 CO -0.02 -1.86 -0.16 0.00 0.00 0.00 0.00 173.10 171.06 1iav s ALA 179 N -2.72 2.64 0.32 3.20 0.00 -1.26 -1.87 121.76 122.07 1iav s ALA 179 Ca 0.41 -1.06 0.09 0.00 0.00 0.00 0.00 51.96 51.40 1iav s ALA 179 Cb -0.03 -0.88 -0.05 0.00 0.00 0.00 0.00 23.12 22.16 1iav s ALA 179 CO 0.25 0.57 0.04 0.95 0.00 0.00 0.00 175.76 177.57 1iav s THR 180 N -0.81 2.93 0.36 0.00 -4.23 -0.35 -1.04 115.64 112.51 1iav s THR 180 Ca 0.13 -1.90 0.05 0.00 -1.18 0.00 0.00 61.69 58.79 1iav s THR 180 Cb -0.11 -2.84 0.05 0.00 1.34 0.00 0.00 72.50 70.94 1iav s THR 180 CO 0.03 -0.25 0.40 -0.90 -0.54 0.00 0.00 174.62 173.35 1iav n ASP 181 N -0.98 1.72 0.27 3.99 5.68 0.24 -1.59 116.55 125.88 1iav n ASP 181 Ca -0.04 -2.09 0.18 0.00 -0.50 0.00 0.00 54.79 52.33 1iav n ASP 181 Cb 0.61 -0.16 0.83 0.00 -1.14 0.00 0.00 41.12 41.26 1iav n ASP 181 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1iav h GLN 182 N 0.00 0.00 -0.06 0.11 7.50 -1.90 -2.04 115.11 118.72 1iav h GLN 182 Ca -0.20 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.95 1iav h GLN 182 Cb 0.81 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.34 1iav h GLN 182 CO 0.30 0.00 0.00 0.09 -1.50 0.00 0.00 178.83 177.72 1iav n ASN 183 N -2.92 1.52 -1.39 1.46 3.02 -1.26 -4.92 115.26 110.77 1iav n ASN 183 Ca -0.01 -1.55 -0.11 0.00 -0.03 0.00 0.00 54.58 52.88 1iav n ASN 183 Cb 0.20 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 1iav n ASN 183 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1iav n ASN 184 N 0.19 -3.72 -4.78 6.41 3.02 -0.77 -5.04 115.26 110.58 1iav n ASN 184 Ca 0.18 -0.05 -0.23 0.00 -0.03 0.00 0.00 54.58 54.45 1iav n ASN 184 Cb 0.34 -2.86 -0.05 0.00 -0.61 0.00 0.00 39.78 36.60 1iav n ASN 184 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1iav s ASN 185 N -2.59 5.32 0.18 6.41 0.01 -1.26 -4.90 114.94 118.11 1iav s ASN 185 Ca 0.04 -0.29 -0.30 0.00 -0.71 0.00 0.00 52.86 51.60 1iav s ASN 185 Cb -0.02 -1.30 -0.08 0.00 0.41 0.00 0.00 41.25 40.26 1iav s ASN 185 CO 0.05 0.00 1.28 -0.60 -1.51 0.00 0.00 177.10 176.33 1iav s ARG 186 N -3.57 4.41 0.47 -0.60 3.52 -1.26 -0.60 118.95 121.32 1iav s ARG 186 Ca 0.32 2.00 -0.23 0.00 -0.13 0.00 0.00 55.73 57.69 1iav s ARG 186 Cb -0.08 -3.22 -0.07 0.00 -1.56 0.00 0.00 34.95 30.02 1iav s ARG 186 CO 0.23 -0.23 1.21 0.00 -0.81 0.00 0.00 175.30 175.70 1iav s ALA 187 N 0.21 2.97 0.33 6.12 0.00 -0.20 -4.80 121.76 126.38 1iav s ALA 187 Ca 0.57 1.03 0.06 0.00 0.00 0.00 0.00 51.96 53.62 1iav s ALA 187 Cb -0.35 -3.42 0.73 0.00 0.00 0.00 0.00 23.12 20.08 1iav s ALA 187 CO 0.37 -0.80 1.85 0.66 0.00 0.00 0.00 175.76 177.84 1iav h SER 188 N 2.01 0.75 1.07 0.00 4.64 -1.92 -1.94 113.55 118.16 1iav h SER 188 Ca -0.50 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1iav h SER 188 Cb 1.26 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1iav h SER 188 CO 0.60 0.37 -0.01 2.22 -0.87 0.00 0.00 176.83 179.14 1iav n PHE 189 N -4.60 0.16 -2.26 4.77 1.16 -1.26 -4.35 117.46 111.08 1iav n PHE 189 Ca 0.19 0.05 -0.43 0.00 -1.87 0.00 0.00 57.45 55.39 1iav n PHE 189 Cb 0.45 -0.57 -0.02 0.00 -1.61 0.00 0.00 39.48 37.72 1iav n PHE 189 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1iav s SER 190 N -3.27 6.84 0.54 5.98 0.15 -0.73 -0.92 113.70 122.29 1iav s SER 190 Ca 0.13 1.91 -0.20 0.00 0.70 0.00 0.00 55.95 58.50 1iav s SER 190 Cb 0.18 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.90 1iav s SER 190 CO 0.55 -0.81 1.17 -1.10 1.20 0.00 0.00 173.24 174.24 1iav s GLN 191 N 3.60 3.32 0.23 5.44 -0.21 -0.40 -4.53 119.66 127.11 1iav s GLN 191 Ca 0.62 1.74 0.00 0.00 0.02 0.00 0.00 55.36 57.74 1iav s GLN 191 Cb -0.26 -2.08 -0.00 0.00 1.00 0.00 0.00 33.01 31.67 1iav s GLN 191 CO 0.21 -0.90 0.29 2.48 -2.12 0.00 0.00 175.29 175.25 1iav n TYR 192 N -1.20 -0.98 0.00 0.91 0.18 -0.80 -4.79 117.16 110.49 1iav n TYR 192 Ca 0.11 -1.63 0.00 0.00 1.88 0.00 0.00 57.90 58.26 1iav n TYR 192 Cb 0.50 0.33 0.00 0.00 -0.38 0.00 0.00 39.34 39.78 1iav n TYR 192 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1iav n GLY 193 N -0.39 0.45 3.74 -7.48 0.00 -0.08 -1.09 105.19 100.33 1iav n GLY 193 Ca 0.02 -2.28 -0.41 0.00 0.00 0.00 0.00 46.02 43.34 1iav n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iav s ALA 194 N -2.00 3.59 0.00 4.61 0.00 -1.26 -2.76 121.76 123.94 1iav s ALA 194 Ca 0.00 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1iav s ALA 194 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1iav s ALA 194 CO 0.00 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.52 1iav n GLY 195 N 2.47 1.92 3.67 0.00 0.00 -1.26 -4.51 105.19 107.48 1iav n GLY 195 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1iav n GLY 195 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iav s LEU 196 N 0.00 4.37 -0.24 0.99 2.96 -1.11 -4.36 118.68 121.29 1iav s LEU 196 Ca 0.00 2.46 0.00 0.00 -0.22 0.00 0.00 54.13 56.38 1iav s LEU 196 Cb 0.00 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.97 1iav s LEU 196 CO 0.00 -0.96 -0.15 0.47 -1.32 0.00 0.00 176.35 174.39 1iav n ASP 197 N 6.74 2.00 -3.73 3.68 8.00 0.01 -4.35 116.55 128.90 1iav n ASP 197 Ca 0.18 -0.08 -0.06 0.00 0.71 0.00 0.00 54.79 55.54 1iav n ASP 197 Cb 0.41 -0.48 -0.02 0.00 -0.02 0.00 0.00 41.12 41.01 1iav n ASP 197 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1iav s ILE 198 N -2.52 0.00 0.23 0.53 2.07 -0.93 -1.06 121.20 119.52 1iav s ILE 198 Ca -0.33 -0.63 0.04 0.00 -1.41 0.00 0.00 60.65 58.32 1iav s ILE 198 Cb 0.09 -1.81 -0.05 0.00 0.13 0.00 0.00 42.46 40.82 1iav s ILE 198 CO 0.62 0.00 -0.02 0.68 -1.91 0.00 0.00 174.94 174.31 1iav s VAL 199 N -3.46 1.14 0.24 4.00 -7.23 -0.26 -1.32 120.40 113.52 1iav s VAL 199 Ca 0.10 -2.05 -0.21 0.00 -1.81 0.00 0.00 61.98 58.02 1iav s VAL 199 Cb -0.02 -2.34 0.03 0.00 0.56 0.00 0.00 36.38 34.61 1iav s VAL 199 CO 0.01 -0.34 0.66 0.00 -0.31 0.00 0.00 175.10 175.12 1iav s ALA 200 N -3.35 -1.23 0.12 1.32 0.00 -0.78 -1.20 121.76 116.65 1iav s ALA 200 Ca 0.28 -0.15 -0.34 0.00 0.00 0.00 0.00 51.96 51.75 1iav s ALA 200 Cb 0.05 0.87 -0.14 0.00 0.00 0.00 0.00 23.12 23.91 1iav s ALA 200 CO 0.09 -0.94 1.62 -2.30 0.00 0.00 0.00 175.76 174.22 1iav n PRO 201 N -0.42 2.13 0.00 0.00 -0.02 -1.26 -1.22 135.00 134.21 1iav n PRO 201 Ca -0.08 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1iav n PRO 201 Cb 0.61 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1iav n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iav n GLY 202 N 3.54 -1.37 3.22 -1.23 0.00 -0.62 -3.28 105.19 105.45 1iav n GLY 202 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1iav n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iav s VAL 203 N -0.16 1.87 -1.22 1.61 1.01 -1.24 -0.78 120.40 121.50 1iav s VAL 203 Ca 0.00 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 60.96 1iav s VAL 203 Cb 0.00 -1.59 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 1iav s VAL 203 CO 0.00 0.52 0.76 -3.20 0.00 0.00 0.00 175.10 173.18 1iav n ASN 204 N 3.07 -3.20 -4.56 3.32 2.85 -1.18 -4.91 115.26 110.65 1iav n ASN 204 Ca -0.18 -0.86 -0.41 0.00 -0.11 0.00 0.00 54.58 53.02 1iav n ASN 204 Cb 0.52 -4.06 -0.08 0.00 1.24 0.00 0.00 39.78 37.40 1iav n ASN 204 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1iav s VAL 205 N -3.57 5.03 -0.00 3.44 1.01 0.67 -4.79 120.40 122.19 1iav s VAL 205 Ca 0.21 0.35 -0.23 0.00 0.00 0.00 0.00 61.98 62.30 1iav s VAL 205 Cb -0.06 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 1iav s VAL 205 CO 0.81 -0.18 0.71 -1.58 0.00 0.00 0.00 175.10 174.86 1iav s GLN 206 N 2.36 4.44 0.37 2.72 0.74 -1.26 -1.49 119.66 127.53 1iav s GLN 206 Ca 0.18 0.93 -0.10 0.00 0.05 0.00 0.00 55.36 56.42 1iav s GLN 206 Cb -0.16 -3.39 0.04 0.00 1.10 0.00 0.00 33.01 30.60 1iav s GLN 206 CO 0.13 0.23 0.68 0.45 -0.55 0.00 0.00 175.29 176.22 1iav s SER 207 N 0.21 0.38 0.53 6.67 0.15 -0.34 -4.83 113.70 116.47 1iav s SER 207 Ca 0.37 -1.30 -0.22 0.00 0.70 0.00 0.00 55.95 55.50 1iav s SER 207 Cb -0.19 0.79 -0.05 0.00 -1.71 0.00 0.00 66.02 64.86 1iav s SER 207 CO 0.20 -1.56 1.34 0.42 1.20 0.00 0.00 173.24 174.85 1iav s THR 208 N -2.53 2.17 -0.00 6.45 -4.23 -1.26 -1.45 115.64 114.79 1iav s THR 208 Ca 0.21 0.13 -0.13 0.00 -1.18 0.00 0.00 61.69 60.72 1iav s THR 208 Cb -0.03 -3.06 0.02 0.00 1.34 0.00 0.00 72.50 70.76 1iav s THR 208 CO 0.15 -0.00 0.26 -0.47 -0.54 0.00 0.00 174.62 174.02 1iav s TYR 209 N -1.32 -0.11 0.69 3.99 5.04 -0.35 -2.52 117.35 122.77 1iav s TYR 209 Ca 0.70 0.11 -0.16 0.00 -2.44 0.00 0.00 57.07 55.28 1iav s TYR 209 Cb -0.40 0.05 0.02 0.00 0.35 0.00 0.00 41.96 41.98 1iav s TYR 209 CO 0.47 -0.38 1.24 -2.14 -1.34 0.00 0.00 175.55 173.41 1iav s PRO 210 N -1.53 2.34 0.00 4.97 0.02 -1.26 -1.89 135.00 137.65 1iav s PRO 210 Ca -0.13 1.90 0.00 0.00 0.02 0.00 0.00 61.00 62.79 1iav s PRO 210 Cb -0.05 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.63 1iav s PRO 210 CO 0.02 -1.72 0.00 0.41 -0.33 0.00 0.00 177.00 175.39 1iav n GLY 211 N 0.63 1.13 4.01 0.52 0.00 -1.26 -4.15 105.19 106.07 1iav n GLY 211 Ca 0.14 -0.38 -0.27 0.00 0.00 0.00 0.00 46.02 45.52 1iav n GLY 211 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1iav n SER 212 N 0.77 -0.37 -0.45 1.61 7.64 -1.23 -4.94 113.62 116.65 1iav n SER 212 Ca 0.00 -1.07 0.00 0.00 1.01 0.00 0.00 58.87 58.81 1iav n SER 212 Cb 0.12 -2.75 0.00 0.00 -1.01 0.00 0.00 64.21 60.57 1iav n SER 212 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1iav n THR 213 N -4.44 0.00 -4.03 0.44 5.66 -0.79 -5.01 114.28 106.11 1iav n THR 213 Ca -0.30 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.58 1iav n THR 213 Cb 0.68 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.34 1iav n THR 213 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1iav s TYR 214 N -1.16 0.45 0.04 1.09 1.51 -1.26 -1.22 117.35 116.80 1iav s TYR 214 Ca 0.00 -0.42 -0.15 0.00 -1.01 0.00 0.00 57.07 55.49 1iav s TYR 214 Cb 0.00 -0.28 0.02 0.00 -0.11 0.00 0.00 41.96 41.59 1iav s TYR 214 CO 0.00 -0.10 0.34 0.00 -1.11 0.00 0.00 175.55 174.67 1iav s ALA 215 N -1.14 -0.79 -0.15 3.71 0.00 -0.53 -4.88 121.76 117.99 1iav s ALA 215 Ca -0.10 0.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.95 1iav s ALA 215 Cb -0.08 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 1iav s ALA 215 CO -0.00 -0.41 -0.03 -1.12 0.00 0.00 0.00 175.76 174.20 1iav s SER 216 N -1.97 4.87 0.30 0.00 0.01 -1.26 -1.19 113.70 114.45 1iav s SER 216 Ca -0.06 -0.09 0.02 0.00 1.31 0.00 0.00 55.95 57.13 1iav s SER 216 Cb -0.01 -1.75 -0.05 0.00 0.21 0.00 0.00 66.02 64.42 1iav s SER 216 CO -0.02 0.19 0.09 -0.76 0.41 0.00 0.00 173.24 173.15 1iav s LEU 217 N 0.23 1.87 0.05 2.44 1.43 -0.56 -4.79 118.68 119.35 1iav s LEU 217 Ca -0.02 -1.41 0.05 0.00 -1.03 0.00 0.00 54.13 51.72 1iav s LEU 217 Cb -0.14 -0.14 -0.02 0.00 0.03 0.00 0.00 46.19 45.92 1iav s LEU 217 CO 0.03 -0.70 -0.14 0.20 0.23 0.00 0.00 176.35 175.96 1iav s ASN 218 N -3.40 1.66 0.00 2.29 0.01 -1.26 -0.24 114.94 114.00 1iav s ASN 218 Ca 0.36 -0.52 0.00 0.00 -0.71 0.00 0.00 52.86 51.99 1iav s ASN 218 Cb 0.08 -0.08 0.00 0.00 0.41 0.00 0.00 41.25 41.66 1iav s ASN 218 CO 0.15 -0.01 0.00 0.61 -1.51 0.00 0.00 177.10 176.33 1iav n GLY 219 N 1.65 3.08 2.20 0.66 0.00 0.04 -4.86 105.19 107.97 1iav n GLY 219 Ca -0.19 -1.27 -0.07 0.00 0.00 0.00 0.00 46.02 44.48 1iav n GLY 219 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iav n THR 220 N -1.43 1.80 0.00 2.61 -2.24 -1.26 -2.88 114.28 110.88 1iav n THR 220 Ca 0.00 -0.90 0.00 0.00 -2.27 0.00 0.00 64.05 60.88 1iav n THR 220 Cb 0.00 -1.80 0.00 0.00 -2.10 0.00 0.00 70.33 66.43 1iav n THR 220 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1iav n MET 222 N 2.71 0.00 -0.03 -0.78 2.00 -1.26 -1.33 117.12 118.42 1iav n MET 222 Ca 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.82 1iav n MET 222 Cb 0.55 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.66 1iav n MET 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1iav h ALA 223 N 0.00 0.04 -0.94 3.04 0.00 -1.51 -3.35 119.26 116.54 1iav h ALA 223 Ca 0.00 -0.37 0.17 0.00 0.00 0.00 0.00 54.91 54.72 1iav h ALA 223 Cb 0.00 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 17.62 1iav h ALA 223 CO 0.00 -0.06 -0.30 1.15 0.00 0.00 0.00 179.25 180.04 1iav h THR 224 N -0.51 0.04 0.00 0.00 2.02 -1.50 -1.62 112.91 111.34 1iav h THR 224 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1iav h THR 224 Cb 0.76 0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1iav h THR 224 CO 0.02 0.00 -0.04 1.55 0.37 0.00 0.00 175.52 177.42 1iav h PRO 225 N -0.01 0.00 -0.56 6.66 0.13 -1.87 -1.24 132.00 135.10 1iav h PRO 225 Ca 0.40 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.48 1iav h PRO 225 Cb 0.65 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.75 1iav h PRO 225 CO -0.96 0.04 0.15 0.45 -0.23 0.00 0.00 178.00 177.45 1iav h HIS 226 N 0.00 0.89 0.07 1.56 3.86 -1.46 -0.54 115.15 119.52 1iav h HIS 226 Ca -0.00 -0.08 -0.28 0.00 -1.16 0.00 0.00 60.37 58.85 1iav h HIS 226 Cb 0.12 -0.26 0.03 0.00 1.06 0.00 0.00 27.41 28.35 1iav h HIS 226 CO 0.00 0.73 -1.13 0.28 0.86 0.00 0.00 177.93 178.68 1iav h VAL 227 N 0.83 1.29 -0.81 2.45 2.07 -1.33 -0.40 116.25 120.34 1iav h VAL 227 Ca 0.18 -2.35 0.08 0.00 0.82 0.00 0.00 66.70 65.43 1iav h VAL 227 Cb 0.29 2.58 -0.07 0.00 -1.52 0.00 0.00 31.29 32.56 1iav h VAL 227 CO -0.00 0.72 0.48 0.00 0.02 0.00 0.00 177.57 178.78 1iav h ALA 228 N 0.33 1.14 -0.46 1.67 0.00 -1.12 -0.61 119.26 120.20 1iav h ALA 228 Ca -0.16 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1iav h ALA 228 Cb 1.80 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 1iav h ALA 228 CO 0.22 0.15 0.13 0.78 0.00 0.00 0.00 179.25 180.52 1iav h GLY 229 N 0.84 0.78 1.12 0.00 0.00 -1.05 -2.59 103.07 102.16 1iav h GLY 229 Ca 0.38 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 1iav h GLY 229 CO -0.21 0.45 0.29 0.00 0.00 0.00 0.00 176.54 177.06 1iav h ALA 230 N 0.98 1.09 -0.60 3.60 0.00 -0.33 -1.98 119.26 122.02 1iav h ALA 230 Ca 0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1iav h ALA 230 Cb 0.30 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1iav h ALA 230 CO -0.00 0.64 0.30 0.00 0.00 0.00 0.00 179.25 180.19 1iav h ALA 231 N 1.22 1.39 -0.35 0.00 0.00 -0.96 -2.49 119.26 118.07 1iav h ALA 231 Ca 0.25 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1iav h ALA 231 Cb 0.22 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1iav h ALA 231 CO -0.02 0.48 -0.21 0.00 0.00 0.00 0.00 179.25 179.50 1iav h ALA 232 N 1.48 0.98 -0.19 0.00 0.00 -0.97 -1.07 119.26 119.49 1iav h ALA 232 Ca 0.21 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1iav h ALA 232 Cb 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1iav h ALA 232 CO -0.03 0.60 0.11 -0.07 0.00 0.00 0.00 179.25 179.86 1iav h LEU 233 N 0.59 0.22 -0.40 0.00 3.38 -1.15 -0.05 115.31 117.91 1iav h LEU 233 Ca 0.09 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1iav h LEU 233 Cb 0.69 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1iav h LEU 233 CO 0.05 0.21 0.07 0.58 0.09 0.00 0.00 178.44 179.44 1iav h VAL 234 N 0.22 1.24 -0.69 1.22 2.07 -1.25 -1.69 116.25 117.37 1iav h VAL 234 Ca 0.07 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1iav h VAL 234 Cb 0.03 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1iav h VAL 234 CO -0.01 0.29 0.44 0.50 0.02 0.00 0.00 177.57 178.81 1iav h LYS 235 N 0.50 0.92 -0.49 1.57 1.63 -0.94 0.77 116.57 120.53 1iav h LYS 235 Ca 0.12 -0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1iav h LYS 235 Cb 0.37 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.77 1iav h LYS 235 CO 0.01 0.63 0.30 0.37 -3.45 0.00 0.00 179.45 177.31 1iav h GLN 236 N 0.93 0.66 -0.11 1.90 4.15 -0.75 -1.26 115.11 120.62 1iav h GLN 236 Ca 0.25 -0.06 -0.09 0.00 0.77 0.00 0.00 58.65 59.53 1iav h GLN 236 Cb -0.07 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.47 1iav h GLN 236 CO -0.05 0.47 -0.33 -0.22 -1.93 0.00 0.00 178.83 176.77 1iav h LYS 237 N 0.65 0.22 -2.11 1.69 3.64 -0.78 -3.35 116.57 116.52 1iav h LYS 237 Ca 0.18 -0.09 -0.58 0.00 -1.27 0.00 0.00 60.65 58.89 1iav h LYS 237 Cb -0.02 -0.01 -0.41 0.00 -0.41 0.00 0.00 32.23 31.38 1iav h LYS 237 CO -0.03 0.53 -0.82 0.09 -2.27 0.00 0.00 179.45 176.94 1iav n ASN 238 N -4.10 2.24 0.29 4.20 3.02 0.22 -4.92 115.26 116.20 1iav n ASN 238 Ca -0.01 -3.13 0.17 0.00 -0.03 0.00 0.00 54.58 51.57 1iav n ASN 238 Cb 0.41 -0.65 0.86 0.00 -0.61 0.00 0.00 39.78 39.79 1iav n ASN 238 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1iav h PRO 239 N 4.02 0.00 0.00 3.52 0.13 -1.40 -1.35 132.00 136.92 1iav h PRO 239 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1iav h PRO 239 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1iav h PRO 239 CO 0.67 0.00 -0.38 -1.13 -0.23 0.00 0.00 178.00 176.93 1iav n SER 240 N -3.12 0.42 -4.77 1.44 3.41 -1.26 -4.92 113.62 104.82 1iav n SER 240 Ca -0.00 0.02 -0.38 0.00 -0.26 0.00 0.00 58.87 58.24 1iav n SER 240 Cb 0.37 0.02 -0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1iav n SER 240 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1iav s TRP 241 N -3.03 2.82 0.80 7.33 0.52 -0.51 -5.04 118.94 121.83 1iav s TRP 241 Ca 0.11 1.48 -0.10 0.00 0.02 0.00 0.00 56.10 57.61 1iav s TRP 241 Cb 0.17 -3.53 0.11 0.00 -1.15 0.00 0.00 33.47 29.07 1iav s TRP 241 CO 0.66 -1.84 1.13 -1.54 0.02 0.00 0.00 176.95 175.38 1iav s SER 242 N -1.06 4.22 0.17 2.95 1.04 -1.26 -4.86 113.70 114.89 1iav s SER 242 Ca 0.61 0.38 -0.15 0.00 0.48 0.00 0.00 55.95 57.26 1iav s SER 242 Cb -0.34 -0.79 0.11 0.00 0.10 0.00 0.00 66.02 65.10 1iav s SER 242 CO 0.42 -2.01 1.72 -0.55 0.98 0.00 0.00 173.24 173.79 1iav h ASN 243 N -0.98 -0.04 -0.14 7.02 7.08 -1.91 -0.29 115.58 126.32 1iav h ASN 243 Ca -0.44 0.07 0.02 0.00 -3.08 0.00 0.00 56.30 52.87 1iav h ASN 243 Cb 1.29 0.11 -0.02 0.00 -2.08 0.00 0.00 38.32 37.62 1iav h ASN 243 CO 0.53 0.01 0.02 0.58 -2.08 0.00 0.00 177.43 176.49 1iav h VAL 244 N 0.18 0.93 -0.43 6.14 2.07 -1.94 0.36 116.25 123.56 1iav h VAL 244 Ca 0.19 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.73 1iav h VAL 244 Cb 0.24 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 1iav h VAL 244 CO -0.27 0.01 0.18 1.56 0.02 0.00 0.00 177.57 179.07 1iav h GLN 245 N 0.07 0.36 -0.33 1.57 4.20 -1.81 0.19 115.11 119.36 1iav h GLN 245 Ca 0.06 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1iav h GLN 245 Cb 0.06 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1iav h GLN 245 CO -0.09 0.24 0.17 0.82 -0.67 0.00 0.00 178.83 179.30 1iav h ILE 246 N 0.37 1.15 -0.49 2.54 2.04 -0.54 -1.28 117.51 121.31 1iav h ILE 246 Ca 0.20 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1iav h ILE 246 Cb 0.15 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1iav h ILE 246 CO -0.17 0.16 0.31 -0.09 0.00 0.00 0.00 178.15 178.36 1iav h ARG 247 N 0.41 0.65 -0.02 2.37 2.43 -0.70 -1.73 114.38 117.79 1iav h ARG 247 Ca 0.12 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.12 1iav h ARG 247 Cb 0.09 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 1iav h ARG 247 CO -0.02 0.45 -0.56 -0.91 -1.51 0.00 0.00 179.97 177.42 1iav h ASN 248 N 0.66 0.06 -0.50 -3.80 2.35 -0.84 -2.86 115.58 110.65 1iav h ASN 248 Ca 0.18 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.80 1iav h ASN 248 Cb -0.05 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1iav h ASN 248 CO -0.04 0.61 -0.08 -0.74 -1.65 0.00 0.00 177.43 175.52 1iav h HIS 249 N 0.04 1.04 -0.50 1.19 2.76 -0.85 -0.67 115.15 118.17 1iav h HIS 249 Ca -0.00 -0.21 0.04 0.00 -2.20 0.00 0.00 60.37 57.99 1iav h HIS 249 Cb 1.00 -0.26 -0.04 0.00 1.55 0.00 0.00 27.41 29.66 1iav h HIS 249 CO 0.00 0.99 0.27 -0.07 -1.30 0.00 0.00 177.93 177.83 1iav h LEU 250 N 0.79 0.40 -0.26 0.26 3.38 -1.24 -1.36 115.31 117.28 1iav h LEU 250 Ca 0.13 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1iav h LEU 250 Cb 0.63 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1iav h LEU 250 CO 0.04 0.28 0.07 0.11 0.09 0.00 0.00 178.44 179.03 1iav h LYS 251 N 0.53 0.42 0.00 1.13 1.57 -1.30 -2.38 116.57 116.54 1iav h LYS 251 Ca 0.22 -0.10 -0.05 0.00 -1.87 0.00 0.00 60.65 58.85 1iav h LYS 251 Cb 0.10 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1iav h LYS 251 CO -0.13 0.51 -0.23 -0.91 -0.57 0.00 0.00 179.45 178.12 1iav h ASN 252 N 0.26 0.00 -0.11 0.86 2.35 -1.01 -2.55 115.58 115.38 1iav h ASN 252 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1iav h ASN 252 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 1iav h ASN 252 CO 0.00 0.23 0.00 0.35 -1.65 0.00 0.00 177.43 176.36 1iav n THR 253 N -3.99 0.14 -1.57 2.81 -2.24 -0.52 -5.00 114.28 103.91 1iav n THR 253 Ca -0.02 -0.57 -0.32 0.00 -2.27 0.00 0.00 64.05 60.87 1iav n THR 253 Cb 0.30 1.28 0.06 0.00 -2.10 0.00 0.00 70.33 69.88 1iav n THR 253 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iav s ALA 254 N -1.55 2.46 -0.25 6.98 0.00 -0.90 -4.50 121.76 124.00 1iav s ALA 254 Ca 0.25 0.33 -0.20 0.00 0.00 0.00 0.00 51.96 52.34 1iav s ALA 254 Cb 0.17 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 1iav s ALA 254 CO 0.25 -1.39 0.62 0.99 0.00 0.00 0.00 175.76 176.23 1iav s THR 255 N -2.71 4.99 0.23 0.00 2.01 -0.29 -4.79 115.64 115.09 1iav s THR 255 Ca 0.63 1.12 -0.32 0.00 0.31 0.00 0.00 61.69 63.43 1iav s THR 255 Cb -0.17 -3.93 -0.13 0.00 0.01 0.00 0.00 72.50 68.28 1iav s THR 255 CO 0.49 0.03 1.56 -0.24 -0.69 0.00 0.00 174.62 175.77 1iav n SER 256 N 5.67 3.38 -0.03 3.53 2.88 -1.26 -0.95 113.62 126.86 1iav n SER 256 Ca -0.01 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 1iav n SER 256 Cb 0.49 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.45 1iav n SER 256 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1iav n LEU 257 N 2.73 1.65 0.00 2.46 4.77 -1.26 -4.89 117.00 122.45 1iav n LEU 257 Ca 0.12 -1.61 0.00 0.00 -0.03 0.00 0.00 56.01 54.50 1iav n LEU 257 Cb 0.33 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1iav n LEU 257 CO 0.63 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 1iav n GLY 258 N -0.26 0.54 1.95 -0.72 0.00 -1.26 -5.05 105.19 100.39 1iav n GLY 258 Ca 0.00 -2.24 -0.30 0.00 0.00 0.00 0.00 46.02 43.48 1iav n GLY 258 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1iav n SER 259 N 0.08 -0.38 0.12 1.61 2.88 -1.26 -4.74 113.62 111.92 1iav n SER 259 Ca 0.00 0.65 0.13 0.00 -1.33 0.00 0.00 58.87 58.32 1iav n SER 259 Cb 0.00 -0.53 0.43 0.00 -0.75 0.00 0.00 64.21 63.35 1iav n SER 259 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1iav n THR 260 N 0.39 0.67 -0.10 2.46 -2.24 -1.26 -1.61 114.28 112.60 1iav n THR 260 Ca 0.11 -0.16 -0.11 0.00 -2.27 0.00 0.00 64.05 61.62 1iav n THR 260 Cb 0.10 -0.75 0.02 0.00 -2.10 0.00 0.00 70.33 67.60 1iav n THR 260 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1iav h ASN 261 N 0.00 0.90 0.45 3.42 -0.73 -1.87 0.52 115.58 118.27 1iav h ASN 261 Ca 0.00 -0.39 -0.30 0.00 1.87 0.00 0.00 56.30 57.48 1iav h ASN 261 Cb 0.65 -0.25 -0.05 0.00 0.27 0.00 0.00 38.32 38.94 1iav h ASN 261 CO 0.00 1.15 -1.74 0.18 -0.37 0.00 0.00 177.43 176.65 1iav n LEU 262 N -4.07 1.07 0.00 0.34 4.77 -1.16 -0.91 117.00 117.05 1iav n LEU 262 Ca -0.01 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1iav n LEU 262 Cb 0.51 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1iav n LEU 262 CO 0.47 0.44 0.17 -1.22 -1.33 0.00 0.00 177.39 175.92 1iav n TYR 263 N -3.09 0.00 -4.56 -1.77 4.01 -0.63 -4.85 117.16 106.26 1iav n TYR 263 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 1iav n TYR 263 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1iav n TYR 263 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1iav n GLY 264 N 0.23 2.71 0.25 2.72 0.00 0.17 -1.53 105.19 109.75 1iav n GLY 264 Ca 0.00 -0.37 0.17 0.00 0.00 0.00 0.00 46.02 45.82 1iav n GLY 264 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1iav h SER 265 N 9.06 0.00 -4.26 1.61 0.02 -1.35 -3.39 113.55 115.24 1iav h SER 265 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1iav h SER 265 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1iav h SER 265 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1iav n GLY 266 N -0.55 0.49 3.71 -3.77 0.00 -0.58 -4.14 105.19 100.35 1iav n GLY 266 Ca -0.01 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 1iav n GLY 266 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iav s LEU 267 N 0.00 4.36 0.50 0.99 2.96 -0.12 -1.10 118.68 126.27 1iav s LEU 267 Ca 0.00 1.75 -0.23 0.00 -0.22 0.00 0.00 54.13 55.42 1iav s LEU 267 Cb 0.00 -3.57 -0.06 0.00 0.50 0.00 0.00 46.19 43.05 1iav s LEU 267 CO 0.00 -0.34 1.38 0.55 -1.32 0.00 0.00 176.35 176.62 1iav n VAL 268 N 3.99 3.37 -3.63 1.68 3.14 -0.34 -1.13 118.33 125.41 1iav n VAL 268 Ca 0.07 -0.50 -0.29 0.00 -2.96 0.00 0.00 64.34 60.66 1iav n VAL 268 Cb 0.49 -1.73 -0.15 0.00 -1.06 0.00 0.00 33.84 31.40 1iav n VAL 268 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 1iav s ASN 269 N -0.72 3.76 0.31 6.55 3.84 -1.26 -4.64 114.94 122.78 1iav s ASN 269 Ca 0.67 -1.51 0.26 0.00 0.21 0.00 0.00 52.86 52.49 1iav s ASN 269 Cb -0.43 -0.61 0.97 0.00 -0.55 0.00 0.00 41.25 40.63 1iav s ASN 269 CO 0.53 -0.42 1.77 0.00 -2.79 0.00 0.00 177.10 176.18 1iav h ALA 270 N 8.18 1.00 0.01 1.71 0.00 -1.10 0.69 119.26 129.76 1iav h ALA 270 Ca -0.16 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1iav h ALA 270 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1iav h ALA 270 CO 0.45 0.00 -0.01 1.49 0.00 0.00 0.00 179.25 181.18 1iav h GLU 271 N 0.00 -0.02 -0.47 0.00 4.22 -1.67 -2.86 114.58 113.78 1iav h GLU 271 Ca 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 59.36 59.35 1iav h GLU 271 Cb 0.51 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1iav h GLU 271 CO 0.00 0.73 -0.06 0.00 -2.18 0.00 0.00 179.01 177.50 1iav h ALA 272 N 0.13 1.01 0.00 2.92 0.00 -1.82 -3.02 119.26 118.49 1iav h ALA 272 Ca -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1iav h ALA 272 Cb 0.76 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1iav h ALA 272 CO 0.00 0.60 -0.03 0.00 0.00 0.00 0.00 179.25 179.82 1iav h ALA 273 N 1.18 1.02 -0.33 0.00 0.00 -0.91 -3.26 119.26 116.96 1iav h ALA 273 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1iav h ALA 273 Cb 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1iav h ALA 273 CO 0.03 0.04 0.00 0.25 0.00 0.00 0.00 179.25 179.57 1iav n THR 274 N -3.17 2.30 0.66 0.00 -2.24 -1.08 -4.87 114.28 105.88 1iav n THR 274 Ca -0.00 -1.74 0.08 0.00 -2.27 0.00 0.00 64.05 60.11 1iav n THR 274 Cb 0.28 -0.21 0.07 0.00 -2.10 0.00 0.00 70.33 68.37 1iav n THR 274 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36