#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fr8 s LYS 2 N 0.00 2.09 -0.04 3.17 1.02 -1.26 -0.16 119.74 124.56 2fr8 s LYS 2 Ca 0.00 -0.96 0.04 0.00 0.02 0.00 0.00 55.97 55.07 2fr8 s LYS 2 Cb 0.00 -2.17 -0.00 0.00 -0.52 0.00 0.00 37.83 35.14 2fr8 s LYS 2 CO 0.00 0.55 -0.16 -1.50 -0.92 0.00 0.00 175.35 173.32 2fr8 s ILE 3 N -0.85 1.32 0.10 2.17 2.07 -0.73 -1.43 121.20 123.84 2fr8 s ILE 3 Ca 0.13 -0.65 0.10 0.00 -1.41 0.00 0.00 60.65 58.82 2fr8 s ILE 3 Cb -0.10 -1.14 -0.04 0.00 0.13 0.00 0.00 42.46 41.31 2fr8 s ILE 3 CO 0.03 0.38 -0.23 0.00 -1.91 0.00 0.00 174.94 173.22 2fr8 s ALA 4 N 0.12 2.47 -0.21 1.50 0.00 -0.64 -1.22 121.76 123.78 2fr8 s ALA 4 Ca -0.05 -1.37 -0.02 0.00 0.00 0.00 0.00 51.96 50.53 2fr8 s ALA 4 Cb -0.12 -0.52 0.06 0.00 0.00 0.00 0.00 23.12 22.55 2fr8 s ALA 4 CO 0.02 0.56 0.01 0.42 0.00 0.00 0.00 175.76 176.77 2fr8 s ILE 5 N -1.02 0.87 1.00 0.00 1.09 -0.45 -1.10 121.20 121.58 2fr8 s ILE 5 Ca 0.15 -0.81 -0.17 0.00 -1.10 0.00 0.00 60.65 58.72 2fr8 s ILE 5 Cb -0.10 -1.31 0.23 0.00 -1.06 0.00 0.00 42.46 40.22 2fr8 s ILE 5 CO 0.06 -0.19 1.33 -0.81 -0.10 0.00 0.00 174.94 175.23 2fr8 n PRO 6 N 4.92 -1.40 -3.03 2.79 -0.04 -1.25 -2.68 135.00 134.31 2fr8 n PRO 6 Ca -0.10 -2.06 -0.40 0.00 -0.04 0.00 0.00 63.50 60.90 2fr8 n PRO 6 Cb 0.46 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.47 2fr8 n PRO 6 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2fr8 s LYS 7 N -5.92 4.45 -0.08 0.54 2.20 -1.26 -4.73 119.74 114.94 2fr8 s LYS 7 Ca 0.76 0.97 -0.30 0.00 -0.36 0.00 0.00 55.97 57.04 2fr8 s LYS 7 Cb -0.02 -3.39 -0.05 0.00 -1.51 0.00 0.00 37.83 32.86 2fr8 s LYS 7 CO 0.53 0.21 1.67 -1.21 -0.36 0.00 0.00 175.35 176.20 2fr8 s GLU 8 N 0.24 4.09 0.07 4.03 0.41 -1.26 -4.89 118.70 121.38 2fr8 s GLU 8 Ca 0.38 2.11 0.22 0.00 -0.41 0.00 0.00 54.97 57.27 2fr8 s GLU 8 Cb -0.19 -4.01 -0.13 0.00 -1.78 0.00 0.00 34.13 28.02 2fr8 s GLU 8 CO 0.21 -0.95 0.81 0.54 -0.49 0.00 0.00 175.26 175.37 2fr8 n ARG 9 N 7.26 0.54 -1.68 1.61 5.12 -1.26 -4.86 116.66 123.40 2fr8 n ARG 9 Ca 0.18 -0.04 -0.45 0.00 -1.93 0.00 0.00 57.85 55.61 2fr8 n ARG 9 Cb 0.43 -1.64 -0.03 0.00 -1.16 0.00 0.00 32.46 30.06 2fr8 n ARG 9 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2fr8 n ARG 10 N -2.32 2.11 -1.74 5.56 5.12 -1.26 -4.91 116.66 119.22 2fr8 n ARG 10 Ca -0.01 0.75 -0.42 0.00 -1.93 0.00 0.00 57.85 56.24 2fr8 n ARG 10 Cb 0.53 -2.44 -0.01 0.00 -1.16 0.00 0.00 32.46 29.38 2fr8 n ARG 10 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2fr8 n PRO 11 N 2.25 2.48 0.00 5.56 -0.02 -1.26 -2.01 135.00 142.00 2fr8 n PRO 11 Ca 0.12 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 2fr8 n PRO 11 Cb 0.31 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 2fr8 n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fr8 n GLY 12 N 0.95 2.94 3.57 -1.23 0.00 -1.26 -5.00 105.19 105.16 2fr8 n GLY 12 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 2fr8 n GLY 12 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fr8 s GLU 13 N -0.23 3.56 0.00 1.61 2.56 -0.85 -4.85 118.70 120.49 2fr8 s GLU 13 Ca 0.00 0.24 0.06 0.00 0.00 0.00 0.00 54.97 55.26 2fr8 s GLU 13 Cb 0.00 -3.96 0.11 0.00 2.00 0.00 0.00 34.13 32.29 2fr8 s GLU 13 CO 0.00 -1.39 0.94 -0.25 -0.56 0.00 0.00 175.26 173.99 2fr8 n ASP 14 N 7.65 2.05 -4.15 -1.70 8.00 -1.26 -4.77 116.55 122.36 2fr8 n ASP 14 Ca 0.08 -1.66 -0.30 0.00 0.71 0.00 0.00 54.79 53.62 2fr8 n ASP 14 Cb 0.49 -0.07 0.19 0.00 -0.02 0.00 0.00 41.12 41.71 2fr8 n ASP 14 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2fr8 s ARG 15 N -0.77 0.36 -0.18 -1.24 0.52 -1.26 -2.87 118.95 113.51 2fr8 s ARG 15 Ca 0.10 -0.27 -0.25 0.00 -0.52 0.00 0.00 55.73 54.80 2fr8 s ARG 15 Cb 0.06 -1.80 0.06 0.00 0.52 0.00 0.00 34.95 33.79 2fr8 s ARG 15 CO 0.08 -2.62 0.64 0.54 0.02 0.00 0.00 175.30 173.96 2fr8 s VAL 16 N -3.65 0.00 -0.60 3.52 0.11 -1.26 -4.47 120.40 114.05 2fr8 s VAL 16 Ca 0.72 -0.03 -0.05 0.00 -2.93 0.00 0.00 61.98 59.69 2fr8 s VAL 16 Cb -0.06 -0.92 -0.02 0.00 -1.53 0.00 0.00 36.38 33.86 2fr8 s VAL 16 CO 0.53 -0.02 2.92 0.00 -3.33 0.00 0.00 175.10 175.20 2fr8 n ALA 17 N 2.12 6.59 -3.53 1.54 0.00 -1.26 -4.61 120.51 121.36 2fr8 n ALA 17 Ca -0.16 -3.00 -0.12 0.00 0.00 0.00 0.00 53.44 50.17 2fr8 n ALA 17 Cb 0.56 -2.40 -0.04 0.00 0.00 0.00 0.00 19.45 17.57 2fr8 n ALA 17 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2fr8 s ILE 18 N -0.96 0.00 0.08 0.00 1.10 -1.26 -4.79 121.20 115.37 2fr8 s ILE 18 Ca 0.61 0.00 -0.13 0.00 -0.51 0.00 0.00 60.65 60.62 2fr8 s ILE 18 Cb 0.32 -1.00 0.02 0.00 0.15 0.00 0.00 42.46 41.94 2fr8 s ILE 18 CO -0.14 0.00 0.29 -0.94 -2.11 0.00 0.00 174.94 172.04 2fr8 s SER 19 N -1.65 -0.07 0.32 4.50 1.04 -1.26 -4.51 113.70 112.07 2fr8 s SER 19 Ca -0.02 -0.40 0.07 0.00 0.48 0.00 0.00 55.95 56.08 2fr8 s SER 19 Cb -0.01 0.39 0.76 0.00 0.10 0.00 0.00 66.02 67.26 2fr8 s SER 19 CO -0.01 -0.73 1.82 -0.65 0.98 0.00 0.00 173.24 174.65 2fr8 h PRO 20 N 2.78 0.74 0.07 4.02 0.11 -1.95 -2.57 132.00 135.21 2fr8 h PRO 20 Ca -0.33 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.73 2fr8 h PRO 20 Cb 1.22 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2fr8 h PRO 20 CO 0.50 0.49 -0.03 1.49 -0.21 0.00 0.00 178.00 180.24 2fr8 h GLU 21 N 0.76 -0.09 0.00 1.05 4.81 -1.96 -3.08 114.58 116.07 2fr8 h GLU 21 Ca 0.52 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.76 2fr8 h GLU 21 Cb 0.81 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.21 2fr8 h GLU 21 CO -0.29 0.03 0.00 -0.39 -0.73 0.00 0.00 179.01 177.63 2fr8 h VAL 22 N -0.19 0.00 0.37 0.32 -1.51 -1.86 -2.84 116.25 110.54 2fr8 h VAL 22 Ca -0.01 -0.61 -0.02 0.00 -1.23 0.00 0.00 66.70 64.83 2fr8 h VAL 22 Cb 0.16 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 2fr8 h VAL 22 CO 0.02 0.00 -0.18 0.58 -1.23 0.00 0.00 177.57 176.76 2fr8 h VAL 23 N 0.00 0.65 -0.53 7.19 2.07 -1.41 -1.08 116.25 123.13 2fr8 h VAL 23 Ca 0.00 -0.26 0.11 0.00 0.82 0.00 0.00 66.70 67.37 2fr8 h VAL 23 Cb 0.65 0.78 -0.11 0.00 -1.52 0.00 0.00 31.29 31.09 2fr8 h VAL 23 CO 0.00 0.05 -0.22 0.11 0.02 0.00 0.00 177.57 177.54 2fr8 h LYS 24 N -0.63 -0.09 0.00 1.57 1.57 -1.42 0.28 116.57 117.85 2fr8 h LYS 24 Ca -0.05 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 2fr8 h LYS 24 Cb 0.46 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2fr8 h LYS 24 CO 0.08 -0.06 -0.19 0.87 -0.57 0.00 0.00 179.45 179.59 2fr8 h LYS 25 N -0.09 0.00 -0.08 3.15 1.57 -1.57 -1.79 116.57 117.77 2fr8 h LYS 25 Ca 0.25 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.81 2fr8 h LYS 25 Cb 0.48 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.80 2fr8 h LYS 25 CO -0.60 0.19 -0.80 -0.07 -0.57 0.00 0.00 179.45 177.61 2fr8 h LEU 26 N 0.00 0.84 -0.62 2.94 3.38 0.34 -3.02 115.31 119.18 2fr8 h LEU 26 Ca -0.00 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.29 2fr8 h LEU 26 Cb 0.75 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2fr8 h LEU 26 CO 0.02 1.40 0.40 0.58 0.09 0.00 0.00 178.44 180.93 2fr8 h VAL 27 N 0.36 1.17 0.00 1.22 2.07 -0.31 -1.91 116.25 118.84 2fr8 h VAL 27 Ca -0.08 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2fr8 h VAL 27 Cb 1.45 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2fr8 h VAL 27 CO 0.16 0.16 0.00 1.23 0.02 0.00 0.00 177.57 179.15 2fr8 h GLY 28 N 0.83 0.00 0.04 2.17 0.00 -1.36 -0.41 103.07 104.34 2fr8 h GLY 28 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2fr8 h GLY 28 CO -0.05 0.00 -0.15 1.04 0.00 0.00 0.00 176.54 177.38 2fr8 n LEU 29 N -2.65 1.15 0.00 3.11 4.77 -0.76 -4.94 117.00 117.68 2fr8 n LEU 29 Ca -0.02 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 2fr8 n LEU 29 Cb 0.07 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2fr8 n LEU 29 CO 0.15 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2fr8 n GLY 30 N 1.27 0.86 3.85 -0.72 0.00 -0.16 -3.51 105.19 106.77 2fr8 n GLY 30 Ca 0.15 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 2fr8 n GLY 30 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fr8 s PHE 31 N -2.00 3.59 -0.44 1.61 0.40 -0.98 -3.90 117.98 116.26 2fr8 s PHE 31 Ca 0.00 1.03 -0.19 0.00 -0.60 0.00 0.00 56.93 57.17 2fr8 s PHE 31 Cb 0.00 -2.35 0.03 0.00 0.51 0.00 0.00 43.02 41.21 2fr8 s PHE 31 CO 0.00 0.42 0.56 -2.00 0.70 0.00 0.00 175.22 174.91 2fr8 s GLU 32 N -2.01 3.18 -0.10 0.44 2.12 0.78 -4.33 118.70 118.77 2fr8 s GLU 32 Ca 0.38 -0.61 -0.23 0.00 0.36 0.00 0.00 54.97 54.87 2fr8 s GLU 32 Cb -0.15 -3.98 -0.03 0.00 0.26 0.00 0.00 34.13 30.23 2fr8 s GLU 32 CO 0.19 -0.99 0.70 0.08 -0.54 0.00 0.00 175.26 174.71 2fr8 s VAL 33 N 2.52 5.03 -0.03 3.70 1.01 -1.26 -1.78 120.40 129.59 2fr8 s VAL 33 Ca 0.17 1.42 0.03 0.00 0.00 0.00 0.00 61.98 63.60 2fr8 s VAL 33 Cb -0.16 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.19 2fr8 s VAL 33 CO 0.16 0.21 -0.11 -0.63 0.00 0.00 0.00 175.10 174.72 2fr8 s ILE 34 N 1.12 0.94 0.03 2.22 1.01 -0.36 0.12 121.20 126.28 2fr8 s ILE 34 Ca 0.36 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.59 2fr8 s ILE 34 Cb -0.17 -0.83 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 2fr8 s ILE 34 CO 0.16 0.29 -0.06 0.68 0.00 0.00 0.00 174.94 176.01 2fr8 s VAL 35 N 0.20 0.42 0.28 2.92 -7.23 -0.40 -1.35 120.40 115.25 2fr8 s VAL 35 Ca -0.04 -0.83 -0.29 0.00 -1.81 0.00 0.00 61.98 59.01 2fr8 s VAL 35 Cb -0.10 -0.47 -0.10 0.00 0.56 0.00 0.00 36.38 36.28 2fr8 s VAL 35 CO 0.01 -0.29 1.29 -0.70 -0.31 0.00 0.00 175.10 175.10 2fr8 s GLU 36 N -1.20 4.40 0.25 4.82 2.12 -1.09 -0.93 118.70 127.07 2fr8 s GLU 36 Ca -0.08 2.12 -0.31 0.00 0.36 0.00 0.00 54.97 57.06 2fr8 s GLU 36 Cb -0.08 -3.12 -0.11 0.00 0.26 0.00 0.00 34.13 31.08 2fr8 s GLU 36 CO 0.00 -0.16 1.60 1.14 -0.54 0.00 0.00 175.26 177.30 2fr8 s GLN 37 N -1.21 4.16 -0.08 4.30 -2.07 0.99 -1.96 119.66 123.79 2fr8 s GLN 37 Ca 0.51 2.51 0.00 0.00 -1.82 0.00 0.00 55.36 56.56 2fr8 s GLN 37 Cb -0.38 -3.07 0.00 0.00 -1.09 0.00 0.00 33.01 28.47 2fr8 s GLN 37 CO 0.47 -0.62 0.00 0.41 -1.32 0.00 0.00 175.29 174.22 2fr8 n GLY 38 N 2.83 0.47 0.18 2.60 0.00 -1.26 -4.92 105.19 105.10 2fr8 n GLY 38 Ca 0.11 -0.21 0.02 0.00 0.00 0.00 0.00 46.02 45.93 2fr8 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 h ALA 39 N 0.00 1.32 -0.55 4.61 0.00 -1.73 -3.08 119.26 119.82 2fr8 h ALA 39 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2fr8 h ALA 39 Cb 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2fr8 h ALA 39 CO 0.02 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.19 2fr8 n GLY 40 N -0.37 2.69 0.30 0.00 0.00 -1.26 -4.54 105.19 102.01 2fr8 n GLY 40 Ca -0.02 -0.64 -0.04 0.00 0.00 0.00 0.00 46.02 45.32 2fr8 n GLY 40 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2fr8 h VAL 41 N 3.27 1.18 0.00 1.61 2.07 -1.52 -0.09 116.25 122.77 2fr8 h VAL 41 Ca 0.00 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2fr8 h VAL 41 Cb 0.95 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2fr8 h VAL 41 CO 0.03 0.19 0.00 0.61 0.02 0.00 0.00 177.57 178.42 2fr8 n GLY 42 N -1.31 -0.92 0.68 2.17 0.00 -1.26 -1.80 105.19 102.75 2fr8 n GLY 42 Ca 0.08 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.23 2fr8 n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 n ALA 43 N -1.63 2.93 -3.19 4.61 0.00 -0.47 -4.49 120.51 118.26 2fr8 n ALA 43 Ca 0.01 -2.51 -0.23 0.00 0.00 0.00 0.00 53.44 50.71 2fr8 n ALA 43 Cb 0.11 -0.61 0.04 0.00 0.00 0.00 0.00 19.45 18.99 2fr8 n ALA 43 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2fr8 n SER 44 N -0.85 -6.03 -4.06 0.00 7.64 -0.74 -4.25 113.62 105.31 2fr8 n SER 44 Ca 0.21 -0.36 -0.32 0.00 1.01 0.00 0.00 58.87 59.41 2fr8 n SER 44 Cb 0.83 -4.85 -0.15 0.00 -1.01 0.00 0.00 64.21 59.04 2fr8 n SER 44 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2fr8 s ILE 45 N -3.20 2.31 0.44 0.44 1.01 -0.17 -5.02 121.20 117.01 2fr8 s ILE 45 Ca 0.38 -1.86 -0.18 0.00 0.00 0.00 0.00 60.65 58.99 2fr8 s ILE 45 Cb -0.17 -2.48 -0.09 0.00 0.01 0.00 0.00 42.46 39.72 2fr8 s ILE 45 CO 0.47 -0.24 0.93 0.42 0.00 0.00 0.00 174.94 176.52 2fr8 s THR 46 N 1.05 4.49 0.20 2.92 -4.23 -1.26 -3.30 115.64 115.51 2fr8 s THR 46 Ca -0.02 1.28 -0.12 0.00 -1.18 0.00 0.00 61.69 61.65 2fr8 s THR 46 Cb -0.20 -3.65 0.17 0.00 1.34 0.00 0.00 72.50 70.16 2fr8 s THR 46 CO -0.06 -0.44 1.67 0.44 -0.54 0.00 0.00 174.62 175.69 2fr8 h ASP 47 N 1.58 -0.29 0.25 3.99 3.32 -1.98 -1.01 116.42 122.28 2fr8 h ASP 47 Ca -0.48 0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.69 2fr8 h ASP 47 Cb 1.18 0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.99 2fr8 h ASP 47 CO 0.62 -0.11 -0.11 -2.24 -1.72 0.00 0.00 179.24 175.68 2fr8 h ASP 48 N 0.10 0.00 0.35 6.45 2.03 -1.99 -0.99 116.42 122.37 2fr8 h ASP 48 Ca 0.29 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.53 2fr8 h ASP 48 Cb 0.45 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.94 2fr8 h ASP 48 CO -0.49 0.11 -0.27 0.00 -1.03 0.00 0.00 179.24 177.56 2fr8 h ALA 49 N 1.89 1.42 0.01 4.15 0.00 -1.56 0.08 119.26 125.25 2fr8 h ALA 49 Ca -0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 2fr8 h ALA 49 Cb 0.27 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.02 2fr8 h ALA 49 CO 0.01 0.33 -0.50 -0.07 0.00 0.00 0.00 179.25 179.03 2fr8 h LEU 50 N 0.00 0.42 -1.47 0.00 -0.00 -1.07 -3.23 115.31 109.96 2fr8 h LEU 50 Ca -0.00 -0.79 -0.06 0.00 -0.00 0.00 0.00 57.88 57.03 2fr8 h LEU 50 Cb 0.51 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.04 2fr8 h LEU 50 CO 0.03 1.15 -0.27 0.71 -0.00 0.00 0.00 178.44 180.07 2fr8 h THR 51 N -0.28 1.06 -0.33 0.22 1.35 -1.38 -0.56 112.91 113.00 2fr8 h THR 51 Ca -0.07 -0.97 0.05 0.00 -0.55 0.00 0.00 66.41 64.87 2fr8 h THR 51 Cb 1.24 1.54 -0.02 0.00 -1.73 0.00 0.00 68.15 69.19 2fr8 h THR 51 CO 0.10 0.26 0.22 0.00 -0.25 0.00 0.00 175.52 175.85 2fr8 h ALA 52 N 1.73 2.01 0.00 6.62 0.00 -1.05 -2.43 119.26 126.15 2fr8 h ALA 52 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2fr8 h ALA 52 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2fr8 h ALA 52 CO 0.04 -0.07 -0.78 0.00 0.00 0.00 0.00 179.25 178.43 2fr8 h ALA 53 N 1.82 0.54 0.00 0.00 0.00 -1.17 -3.48 119.26 116.98 2fr8 h ALA 53 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2fr8 h ALA 53 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2fr8 h ALA 53 CO -0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.63 2fr8 n GLY 54 N 1.27 1.89 3.86 0.00 0.00 -0.79 -3.85 105.19 107.58 2fr8 n GLY 54 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2fr8 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 s ALA 55 N -2.00 3.31 -0.09 4.61 0.00 -0.50 -4.55 121.76 122.55 2fr8 s ALA 55 Ca 0.00 -0.05 -0.14 0.00 0.00 0.00 0.00 51.96 51.77 2fr8 s ALA 55 Cb 0.00 -2.77 -0.05 0.00 0.00 0.00 0.00 23.12 20.30 2fr8 s ALA 55 CO 0.00 0.15 0.35 0.99 0.00 0.00 0.00 175.76 177.25 2fr8 s THR 56 N -2.19 5.20 -0.29 0.00 2.01 0.32 -4.23 115.64 116.47 2fr8 s THR 56 Ca 0.53 0.68 -0.09 0.00 0.31 0.00 0.00 61.69 63.13 2fr8 s THR 56 Cb -0.10 -3.66 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 2fr8 s THR 56 CO 0.24 0.48 0.12 -0.63 -0.69 0.00 0.00 174.62 174.14 2fr8 s ILE 57 N -0.31 4.49 0.11 1.82 1.01 -1.26 -1.27 121.20 125.79 2fr8 s ILE 57 Ca 0.21 -0.33 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 2fr8 s ILE 57 Cb -0.15 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 39.05 2fr8 s ILE 57 CO 0.09 0.17 0.35 0.00 0.00 0.00 0.00 174.94 175.54 2fr8 s ALA 58 N 1.61 3.82 0.06 9.38 0.00 -0.11 -4.94 121.76 131.59 2fr8 s ALA 58 Ca 0.05 -0.59 -0.17 0.00 0.00 0.00 0.00 51.96 51.25 2fr8 s ALA 58 Cb -0.16 -2.09 -0.13 0.00 0.00 0.00 0.00 23.12 20.73 2fr8 s ALA 58 CO 0.05 0.68 1.33 0.77 0.00 0.00 0.00 175.76 178.59 2fr8 h SER 59 N 3.03 0.61 -4.81 0.00 0.02 -1.86 0.28 113.55 110.82 2fr8 h SER 59 Ca -0.46 -0.54 -0.57 0.00 -0.84 0.00 0.00 61.79 59.38 2fr8 h SER 59 Cb 1.17 -0.17 -0.12 0.00 0.14 0.00 0.00 62.40 63.42 2fr8 h SER 59 CO 0.72 1.03 -0.44 0.35 -1.14 0.00 0.00 176.83 177.35 2fr8 n THR 60 N -4.33 0.00 0.07 -2.27 -2.24 -1.26 -4.18 114.28 100.08 2fr8 n THR 60 Ca -0.06 -2.22 -0.03 0.00 -2.27 0.00 0.00 64.05 59.46 2fr8 n THR 60 Cb 0.49 0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 69.33 2fr8 n THR 60 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fr8 h ALA 61 N 1.44 -0.48 -0.96 6.98 0.00 -1.97 -3.35 119.26 120.91 2fr8 h ALA 61 Ca -0.34 -0.05 0.20 0.00 0.00 0.00 0.00 54.91 54.72 2fr8 h ALA 61 Cb 1.16 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 2fr8 h ALA 61 CO 0.56 -0.47 0.61 0.00 0.00 0.00 0.00 179.25 179.95 2fr8 h ALA 62 N -1.70 1.98 0.00 0.00 0.00 -1.99 -0.23 119.26 117.32 2fr8 h ALA 62 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2fr8 h ALA 62 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2fr8 h ALA 62 CO 0.04 -0.30 0.00 0.94 0.00 0.00 0.00 179.25 179.92 2fr8 n GLN 63 N -4.62 0.86 0.00 0.00 7.27 -1.26 -2.87 117.38 116.76 2fr8 n GLN 63 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.28 2fr8 n GLN 63 Cb 0.65 -1.16 0.00 0.00 2.41 0.00 0.00 30.24 32.14 2fr8 n GLN 63 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2fr8 n ALA 64 N 0.44 0.50 -0.02 1.69 0.00 -0.15 -4.65 120.51 118.31 2fr8 n ALA 64 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2fr8 n ALA 64 Cb 0.38 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.69 2fr8 n ALA 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2fr8 n LEU 65 N -0.44 0.30 0.20 0.00 4.77 -0.90 -4.12 117.00 116.81 2fr8 n LEU 65 Ca 0.00 0.13 0.06 0.00 -0.03 0.00 0.00 56.01 56.17 2fr8 n LEU 65 Cb 0.00 0.19 0.53 0.00 -2.33 0.00 0.00 43.42 41.81 2fr8 n LEU 65 CO 0.00 0.20 1.00 0.77 -1.33 0.00 0.00 177.39 178.03 2fr8 h SER 66 N 0.00 0.09 0.25 -1.43 4.64 -1.40 -2.93 113.55 112.78 2fr8 h SER 66 Ca -0.23 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2fr8 h SER 66 Cb 1.60 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 2fr8 h SER 66 CO 0.02 0.16 -0.87 0.00 -0.87 0.00 0.00 176.83 175.27 2fr8 n GLN 67 N -4.42 0.08 -2.88 4.77 10.64 -1.26 -4.42 117.38 119.89 2fr8 n GLN 67 Ca -0.02 -0.01 -0.41 0.00 -1.83 0.00 0.00 57.00 54.74 2fr8 n GLN 67 Cb 0.17 -1.52 -0.04 0.00 -0.86 0.00 0.00 30.24 27.98 2fr8 n GLN 67 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2fr8 s ALA 68 N -3.06 3.28 0.09 2.61 0.00 -1.12 -4.80 121.76 118.77 2fr8 s ALA 68 Ca 0.08 0.37 -0.04 0.00 0.00 0.00 0.00 51.96 52.36 2fr8 s ALA 68 Cb 0.16 -3.13 -0.24 0.00 0.00 0.00 0.00 23.12 19.92 2fr8 s ALA 68 CO 0.80 -0.07 1.18 -0.44 0.00 0.00 0.00 175.76 177.24 2fr8 h ASP 69 N 6.19 0.43 -4.26 0.00 3.32 -1.59 -3.40 116.42 117.11 2fr8 h ASP 69 Ca -0.42 -0.44 -0.55 0.00 0.02 0.00 0.00 57.03 55.64 2fr8 h ASP 69 Cb 1.21 -0.14 -0.24 0.00 0.22 0.00 0.00 39.33 40.38 2fr8 h ASP 69 CO 0.73 1.32 -0.83 -0.69 -1.72 0.00 0.00 179.24 178.05 2fr8 s VAL 70 N -2.79 1.57 -0.07 -1.35 1.01 -1.09 0.40 120.40 118.09 2fr8 s VAL 70 Ca -0.04 -1.28 0.01 0.00 0.00 0.00 0.00 61.98 60.67 2fr8 s VAL 70 Cb 0.07 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 35.07 2fr8 s VAL 70 CO 0.88 0.08 -0.09 -0.69 0.00 0.00 0.00 175.10 175.27 2fr8 s VAL 71 N -0.94 0.96 -0.23 2.92 1.01 0.28 -1.63 120.40 122.78 2fr8 s VAL 71 Ca 0.06 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 61.64 2fr8 s VAL 71 Cb -0.09 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 2fr8 s VAL 71 CO 0.02 0.33 0.01 0.26 0.00 0.00 0.00 175.10 175.72 2fr8 s TRP 72 N 0.97 3.02 0.14 5.22 0.52 -0.26 -1.83 118.94 126.72 2fr8 s TRP 72 Ca -0.09 -0.69 0.05 0.00 0.02 0.00 0.00 56.10 55.38 2fr8 s TRP 72 Cb -0.15 -2.16 -0.04 0.00 -1.15 0.00 0.00 33.47 29.97 2fr8 s TRP 72 CO 0.00 -0.45 -0.11 0.21 0.02 0.00 0.00 176.95 176.62 2fr8 s LYS 73 N 1.50 1.03 -0.05 4.98 2.20 -1.06 -3.97 119.74 124.38 2fr8 s LYS 73 Ca 0.06 -1.37 -0.17 0.00 -0.36 0.00 0.00 55.97 54.13 2fr8 s LYS 73 Cb -0.15 -0.68 -0.31 0.00 -1.51 0.00 0.00 37.83 35.19 2fr8 s LYS 73 CO -0.00 0.10 0.77 0.28 -0.36 0.00 0.00 175.35 176.14 2fr8 h VAL 74 N 3.02 1.20 -3.80 4.02 2.07 -1.92 -3.37 116.25 117.47 2fr8 h VAL 74 Ca -0.37 -2.53 -0.16 0.00 0.82 0.00 0.00 66.70 64.46 2fr8 h VAL 74 Cb 1.19 2.94 -0.20 0.00 -1.52 0.00 0.00 31.29 33.70 2fr8 h VAL 74 CO 0.60 0.76 -0.61 -1.58 0.02 0.00 0.00 177.57 176.76 2fr8 s GLN 75 N -2.51 0.40 0.36 1.57 0.74 -1.26 -1.89 119.66 117.07 2fr8 s GLN 75 Ca -0.15 -0.56 -0.25 0.00 0.05 0.00 0.00 55.36 54.45 2fr8 s GLN 75 Cb 0.03 0.16 -0.13 0.00 1.10 0.00 0.00 33.01 34.17 2fr8 s GLN 75 CO 0.84 -0.08 0.71 2.89 -0.55 0.00 0.00 175.29 179.10 2fr8 n ARG 76 N 1.44 0.77 -2.33 1.67 1.85 0.81 -4.80 116.66 116.07 2fr8 n ARG 76 Ca -0.23 0.28 -0.40 0.00 -1.00 0.00 0.00 57.85 56.50 2fr8 n ARG 76 Cb 0.56 -1.58 -0.03 0.00 -1.05 0.00 0.00 32.46 30.36 2fr8 n ARG 76 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2fr8 s PRO 77 N -1.54 4.46 0.35 2.89 0.04 -1.26 -5.00 135.00 134.95 2fr8 s PRO 77 Ca 0.62 1.95 -0.26 0.00 0.04 0.00 0.00 61.00 63.35 2fr8 s PRO 77 Cb -0.67 -3.08 -0.09 0.00 0.04 0.00 0.00 34.50 30.71 2fr8 s PRO 77 CO 0.58 0.00 1.10 -1.64 0.04 0.00 0.00 177.00 177.08 2fr8 s MET 78 N -1.69 4.33 0.64 4.56 -1.94 -1.26 -4.76 119.30 119.18 2fr8 s MET 78 Ca 0.48 1.71 0.03 0.00 -1.71 0.00 0.00 55.69 56.20 2fr8 s MET 78 Cb -0.34 -2.84 0.10 0.00 2.01 0.00 0.00 34.83 33.76 2fr8 s MET 78 CO 0.45 -0.04 0.88 0.95 -0.01 0.00 0.00 175.02 177.25 2fr8 s THR 79 N -1.40 2.24 0.12 2.05 -4.23 -1.25 -0.99 115.64 112.18 2fr8 s THR 79 Ca 0.52 -0.76 -0.24 0.00 -1.18 0.00 0.00 61.69 60.03 2fr8 s THR 79 Cb -0.28 -2.48 -0.06 0.00 1.34 0.00 0.00 72.50 71.02 2fr8 s THR 79 CO 0.36 0.00 1.67 0.00 -0.54 0.00 0.00 174.62 176.11 2fr8 h ALA 80 N -0.17 -0.20 -0.11 3.99 0.00 -1.91 -2.23 119.26 118.63 2fr8 h ALA 80 Ca -0.35 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2fr8 h ALA 80 Cb 1.28 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2fr8 h ALA 80 CO 0.42 -0.66 0.00 -0.85 0.00 0.00 0.00 179.25 178.16 2fr8 n GLU 81 N -5.30 1.71 -0.00 0.00 0.28 -1.26 -3.41 120.64 112.67 2fr8 n GLU 81 Ca -0.05 -0.58 0.03 0.00 -0.16 0.00 0.00 57.16 56.40 2fr8 n GLU 81 Cb 0.22 -1.63 -0.04 0.00 1.43 0.00 0.00 31.44 31.42 2fr8 n GLU 81 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2fr8 n GLU 82 N 0.11 4.75 0.00 3.44 2.13 -0.84 -5.05 120.64 125.18 2fr8 n GLU 82 Ca 0.05 -0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.87 2fr8 n GLU 82 Cb 0.42 -0.82 0.00 0.00 0.27 0.00 0.00 31.44 31.31 2fr8 n GLU 82 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fr8 n GLY 83 N 1.17 0.68 3.07 8.31 0.00 -1.21 -4.89 105.19 112.31 2fr8 n GLY 83 Ca 0.01 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 2fr8 n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2fr8 s THR 84 N 0.00 1.18 -1.03 2.61 -4.23 -1.25 -4.95 115.64 107.97 2fr8 s THR 84 Ca 0.00 -0.55 -0.23 0.00 -1.18 0.00 0.00 61.69 59.73 2fr8 s THR 84 Cb 0.00 -1.04 0.05 0.00 1.34 0.00 0.00 72.50 72.85 2fr8 s THR 84 CO 0.00 0.35 1.45 -0.62 -0.54 0.00 0.00 174.62 175.27 2fr8 s ASP 85 N 0.30 6.52 -0.03 3.99 -1.08 -1.25 -3.85 116.67 121.27 2fr8 s ASP 85 Ca -0.08 -1.52 -0.05 0.00 -0.52 0.00 0.00 52.55 50.39 2fr8 s ASP 85 Cb -0.12 -2.56 -0.28 0.00 -1.46 0.00 0.00 42.92 38.49 2fr8 s ASP 85 CO 0.02 -1.48 0.72 -0.33 0.52 0.00 0.00 175.17 174.62 2fr8 h GLU 86 N 9.66 0.28 -0.84 4.34 5.08 -1.33 -3.32 114.58 128.44 2fr8 h GLU 86 Ca 0.21 -0.47 0.19 0.00 -1.00 0.00 0.00 59.36 58.29 2fr8 h GLU 86 Cb 1.00 0.18 -0.12 0.00 0.50 0.00 0.00 28.75 30.31 2fr8 h GLU 86 CO 1.42 1.14 0.33 0.28 -1.00 0.00 0.00 179.01 181.18 2fr8 h VAL 87 N 0.08 0.52 0.00 3.13 2.07 -1.82 0.91 116.25 121.13 2fr8 h VAL 87 Ca -0.30 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 2fr8 h VAL 87 Cb 2.04 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 2fr8 h VAL 87 CO 0.15 0.07 -0.21 0.00 0.02 0.00 0.00 177.57 177.60 2fr8 h ALA 88 N 1.66 1.59 0.00 1.67 0.00 -1.87 -2.97 119.26 119.34 2fr8 h ALA 88 Ca 0.50 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 2fr8 h ALA 88 Cb 0.90 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2fr8 h ALA 88 CO -0.50 0.26 -0.09 -0.07 0.00 0.00 0.00 179.25 178.85 2fr8 h LEU 89 N 0.00 0.00 -9.93 0.00 4.07 -0.91 -3.45 115.31 105.09 2fr8 h LEU 89 Ca -0.00 0.00 -0.50 0.00 0.08 0.00 0.00 57.88 57.46 2fr8 h LEU 89 Cb 0.38 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.16 2fr8 h LEU 89 CO 0.03 0.09 0.46 -0.63 -1.08 0.00 0.00 178.44 177.31 2fr8 s ILE 90 N -3.55 3.45 0.34 1.22 1.01 -1.12 -2.91 121.20 119.65 2fr8 s ILE 90 Ca 0.02 1.21 -0.28 0.00 0.00 0.00 0.00 60.65 61.60 2fr8 s ILE 90 Cb 0.08 -3.67 -0.10 0.00 0.01 0.00 0.00 42.46 38.78 2fr8 s ILE 90 CO 0.60 0.10 1.33 -0.75 0.00 0.00 0.00 174.94 176.22 2fr8 s LYS 91 N -2.24 4.30 0.23 2.79 2.20 -1.15 -4.90 119.74 120.97 2fr8 s LYS 91 Ca 0.55 2.25 -0.31 0.00 -0.36 0.00 0.00 55.97 58.10 2fr8 s LYS 91 Cb -0.27 -3.03 -0.12 0.00 -1.51 0.00 0.00 37.83 32.90 2fr8 s LYS 91 CO 0.34 -0.25 1.66 -2.00 -0.36 0.00 0.00 175.35 174.75 2fr8 s GLU 92 N -1.86 4.13 0.00 4.03 2.12 -1.26 -1.79 118.70 124.07 2fr8 s GLU 92 Ca 0.50 2.58 0.00 0.00 0.36 0.00 0.00 54.97 58.41 2fr8 s GLU 92 Cb -0.40 -3.06 0.00 0.00 0.26 0.00 0.00 34.13 30.92 2fr8 s GLU 92 CO 0.54 -0.70 0.00 0.41 -0.54 0.00 0.00 175.26 174.97 2fr8 n GLY 93 N 3.33 1.59 3.78 -1.50 0.00 -0.94 -4.99 105.19 106.47 2fr8 n GLY 93 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2fr8 n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 s ALA 94 N -3.25 2.42 -0.11 4.61 0.00 -0.74 -4.62 121.76 120.07 2fr8 s ALA 94 Ca 0.00 0.26 -0.16 0.00 0.00 0.00 0.00 51.96 52.06 2fr8 s ALA 94 Cb 0.00 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 2fr8 s ALA 94 CO 0.00 -1.51 0.39 0.08 0.00 0.00 0.00 175.76 174.72 2fr8 s VAL 95 N -2.85 5.21 0.01 0.00 1.01 0.16 -2.31 120.40 121.63 2fr8 s VAL 95 Ca 0.61 0.76 0.04 0.00 0.00 0.00 0.00 61.98 63.40 2fr8 s VAL 95 Cb -0.17 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2fr8 s VAL 95 CO 0.53 0.40 -0.11 -0.22 0.00 0.00 0.00 175.10 175.69 2fr8 s LEU 96 N 0.25 2.93 -0.17 3.92 2.96 0.19 0.99 118.68 129.75 2fr8 s LEU 96 Ca 0.22 -0.24 -0.05 0.00 -0.22 0.00 0.00 54.13 53.84 2fr8 s LEU 96 Cb -0.14 -1.68 0.08 0.00 0.50 0.00 0.00 46.19 44.95 2fr8 s LEU 96 CO 0.08 0.29 0.32 -0.04 -1.32 0.00 0.00 176.35 175.68 2fr8 s MET 97 N -1.30 0.23 0.05 1.98 -1.94 -0.76 -1.09 119.30 116.47 2fr8 s MET 97 Ca 0.15 0.79 -0.15 0.00 -1.71 0.00 0.00 55.69 54.77 2fr8 s MET 97 Cb -0.11 -0.03 0.05 0.00 2.01 0.00 0.00 34.83 36.75 2fr8 s MET 97 CO 0.06 -0.33 0.70 0.00 -0.01 0.00 0.00 175.02 175.43 2fr8 s HIS 99 N -3.06 2.74 -0.16 0.00 5.65 -0.79 -1.47 115.29 118.20 2fr8 s HIS 99 Ca 0.16 0.25 -0.08 0.00 0.25 0.00 0.00 55.06 55.64 2fr8 s HIS 99 Cb -0.01 -4.25 -0.23 0.00 -1.18 0.00 0.00 32.58 26.90 2fr8 s HIS 99 CO 0.02 -1.40 0.24 1.28 -0.65 0.00 0.00 174.74 174.23 2fr8 n LEU 100 N 7.82 2.54 -1.67 8.88 4.77 -1.26 -0.13 117.00 137.95 2fr8 n LEU 100 Ca 0.06 0.20 -0.12 0.00 -0.03 0.00 0.00 56.01 56.12 2fr8 n LEU 100 Cb 0.48 -1.06 0.01 0.00 -2.33 0.00 0.00 43.42 40.53 2fr8 n LEU 100 CO 0.67 0.77 -0.04 0.61 -1.33 0.00 0.00 177.39 178.07 2fr8 n GLY 101 N 1.92 -0.02 0.30 -0.72 0.00 -1.26 -4.66 105.19 100.75 2fr8 n GLY 101 Ca -0.35 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2fr8 n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 h ALA 102 N 0.56 0.40 0.00 4.61 0.00 -1.94 0.49 119.26 123.38 2fr8 h ALA 102 Ca -0.29 0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2fr8 h ALA 102 Cb 1.21 0.64 0.00 0.00 0.00 0.00 0.00 17.79 19.63 2fr8 h ALA 102 CO 0.32 -0.46 0.00 1.28 0.00 0.00 0.00 179.25 180.39 2fr8 n LEU 103 N -5.49 0.00 -0.00 0.00 4.77 -1.26 -2.18 117.00 112.83 2fr8 n LEU 103 Ca 0.10 0.20 -0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2fr8 n LEU 103 Cb 0.39 -0.20 -0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2fr8 n LEU 103 CO -0.02 -0.13 -0.50 0.35 -1.33 0.00 0.00 177.39 175.76 2fr8 n THR 104 N -1.20 0.00 -3.08 -5.08 -2.24 0.67 -4.85 114.28 98.50 2fr8 n THR 104 Ca 0.06 -0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.54 2fr8 n THR 104 Cb 0.07 -0.44 -0.04 0.00 -2.10 0.00 0.00 70.33 67.82 2fr8 n THR 104 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2fr8 n ASN 105 N -1.81 4.78 -0.36 3.42 3.02 0.14 -4.89 115.26 119.56 2fr8 n ASN 105 Ca -0.00 -3.58 -0.02 0.00 -0.03 0.00 0.00 54.58 50.95 2fr8 n ASN 105 Cb 0.31 -0.74 0.11 0.00 -0.61 0.00 0.00 39.78 38.85 2fr8 n ASN 105 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 2fr8 h ARG 106 N 3.80 1.27 -0.93 3.52 2.43 -1.79 -3.06 114.38 119.61 2fr8 h ARG 106 Ca 0.21 -0.08 0.14 0.00 -0.81 0.00 0.00 59.98 59.44 2fr8 h ARG 106 Cb 0.55 -0.29 -0.08 0.00 -0.42 0.00 0.00 29.97 29.74 2fr8 h ARG 106 CO 0.92 0.84 0.59 -1.35 -1.51 0.00 0.00 179.97 179.46 2fr8 h PRO 107 N 1.31 0.77 0.00 0.20 0.11 -1.90 -1.34 132.00 131.14 2fr8 h PRO 107 Ca 0.36 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.30 2fr8 h PRO 107 Cb -0.13 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 30.78 2fr8 h PRO 107 CO -0.08 0.51 -0.60 -0.39 -0.21 0.00 0.00 178.00 177.22 2fr8 h VAL 108 N 0.79 1.30 -0.13 3.15 -1.51 -1.92 -2.19 116.25 115.74 2fr8 h VAL 108 Ca 0.46 -2.16 -0.01 0.00 -1.23 0.00 0.00 66.70 63.76 2fr8 h VAL 108 Cb 0.64 2.21 -0.01 0.00 -2.13 0.00 0.00 31.29 32.00 2fr8 h VAL 108 CO -0.23 0.59 0.04 0.58 -1.23 0.00 0.00 177.57 177.33 2fr8 h VAL 109 N 0.00 1.17 -0.41 7.19 2.07 -1.30 -2.52 116.25 122.45 2fr8 h VAL 109 Ca -0.01 -0.52 -0.10 0.00 0.82 0.00 0.00 66.70 66.90 2fr8 h VAL 109 Cb 1.16 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.19 2fr8 h VAL 109 CO 0.08 0.16 -0.13 -0.33 0.02 0.00 0.00 177.57 177.36 2fr8 h GLU 110 N 0.04 0.75 -0.51 1.57 5.08 -1.27 -1.33 114.58 118.91 2fr8 h GLU 110 Ca 0.04 -0.26 0.05 0.00 -1.00 0.00 0.00 59.36 58.19 2fr8 h GLU 110 Cb 0.21 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2fr8 h GLU 110 CO -0.00 0.85 0.34 0.00 -1.00 0.00 0.00 179.01 179.20 2fr8 h ALA 111 N 1.17 1.83 -0.03 3.43 0.00 -1.33 -1.31 119.26 123.02 2fr8 h ALA 111 Ca 0.11 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2fr8 h ALA 111 Cb 0.61 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.27 2fr8 h ALA 111 CO 0.04 0.10 -0.37 -0.07 0.00 0.00 0.00 179.25 178.95 2fr8 h LEU 112 N 0.51 0.38 -0.48 0.00 3.38 -1.01 -3.24 115.31 114.84 2fr8 h LEU 112 Ca 0.21 -0.72 0.10 0.00 0.09 0.00 0.00 57.88 57.56 2fr8 h LEU 112 Cb 0.20 -0.11 -0.10 0.00 0.09 0.00 0.00 40.66 40.74 2fr8 h LEU 112 CO -0.06 1.04 -0.25 0.74 0.09 0.00 0.00 178.44 180.00 2fr8 h THR 113 N -0.25 0.31 -0.68 0.22 2.02 -0.81 -1.74 112.91 111.98 2fr8 h THR 113 Ca -0.04 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.26 2fr8 h THR 113 Cb 1.07 0.31 -0.13 0.00 -1.74 0.00 0.00 68.15 67.66 2fr8 h THR 113 CO 0.07 0.00 -0.30 0.11 0.37 0.00 0.00 175.52 175.77 2fr8 h LYS 114 N -0.14 -0.10 -0.10 6.66 1.57 -1.34 0.10 116.57 123.22 2fr8 h LYS 114 Ca 0.22 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 2fr8 h LYS 114 Cb 0.49 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2fr8 h LYS 114 CO -0.57 -0.07 0.00 0.54 -0.57 0.00 0.00 179.45 178.78 2fr8 n ARG 115 N -5.45 1.05 -3.25 3.15 1.74 -0.72 -4.87 116.66 108.31 2fr8 n ARG 115 Ca 0.06 -0.08 -0.24 0.00 -0.77 0.00 0.00 57.85 56.83 2fr8 n ARG 115 Cb 0.37 -1.06 0.03 0.00 -1.02 0.00 0.00 32.46 30.79 2fr8 n ARG 115 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2fr8 n LYS 116 N -0.40 -5.13 -3.47 5.56 4.76 0.36 -3.33 118.16 116.50 2fr8 n LYS 116 Ca 0.01 0.79 -0.37 0.00 -2.87 0.00 0.00 58.31 55.86 2fr8 n LYS 116 Cb 0.04 -5.66 -0.06 0.00 -1.84 0.00 0.00 35.03 27.51 2fr8 n LYS 116 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2fr8 s ILE 117 N -3.16 5.17 -0.30 -0.18 1.01 -0.88 -2.21 121.20 120.65 2fr8 s ILE 117 Ca 0.40 0.77 -0.24 0.00 0.00 0.00 0.00 60.65 61.58 2fr8 s ILE 117 Cb -0.19 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.58 2fr8 s ILE 117 CO 0.49 0.45 0.83 -0.89 0.00 0.00 0.00 174.94 175.82 2fr8 s THR 118 N -0.15 4.77 -0.03 2.92 2.01 -0.98 -4.11 115.64 120.07 2fr8 s THR 118 Ca 0.22 1.30 0.05 0.00 0.31 0.00 0.00 61.69 63.57 2fr8 s THR 118 Cb -0.15 -4.17 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 2fr8 s THR 118 CO 0.10 -0.25 -0.17 0.00 -0.69 0.00 0.00 174.62 173.60 2fr8 s ALA 119 N 3.02 2.55 -0.20 7.40 0.00 -0.24 0.57 121.76 134.85 2fr8 s ALA 119 Ca 0.34 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 51.28 2fr8 s ALA 119 Cb -0.14 -0.85 0.04 0.00 0.00 0.00 0.00 23.12 22.16 2fr8 s ALA 119 CO 0.12 0.55 -0.15 0.71 0.00 0.00 0.00 175.76 176.99 2fr8 s TYR 120 N -0.73 2.78 -0.74 0.00 1.51 -0.25 -1.05 117.35 118.87 2fr8 s TYR 120 Ca 0.12 -1.78 -0.24 0.00 -1.01 0.00 0.00 57.07 54.16 2fr8 s TYR 120 Cb -0.10 -1.83 0.06 0.00 -0.11 0.00 0.00 41.96 39.98 2fr8 s TYR 120 CO 0.01 -0.80 1.12 0.00 -1.11 0.00 0.00 175.55 174.77 2fr8 s ALA 121 N 1.28 2.98 0.52 3.71 0.00 0.29 -3.07 121.76 127.48 2fr8 s ALA 121 Ca -0.00 -1.80 0.20 0.00 0.00 0.00 0.00 51.96 50.36 2fr8 s ALA 121 Cb -0.16 -4.06 1.32 0.00 0.00 0.00 0.00 23.12 20.22 2fr8 s ALA 121 CO -0.10 -3.03 2.07 0.52 0.00 0.00 0.00 175.76 175.23 2fr8 h MET 122 N 9.67 0.02 0.00 0.00 2.86 -1.54 -1.31 114.93 124.63 2fr8 h MET 122 Ca -0.21 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 2fr8 h MET 122 Cb 1.05 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.71 2fr8 h MET 122 CO 1.23 0.01 0.00 1.05 1.06 0.00 0.00 176.91 180.26 2fr8 h GLU 123 N 0.02 0.00 -0.79 1.72 9.09 -1.91 -2.93 114.58 119.78 2fr8 h GLU 123 Ca 0.13 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.54 2fr8 h GLU 123 Cb 0.49 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.59 2fr8 h GLU 123 CO -0.00 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.34 2fr8 n LEU 124 N -2.47 3.44 -4.68 3.06 4.77 -0.49 -4.92 117.00 115.70 2fr8 n LEU 124 Ca 0.02 -1.74 -0.43 0.00 -0.03 0.00 0.00 56.01 53.83 2fr8 n LEU 124 Cb 0.29 -0.60 -0.03 0.00 -2.33 0.00 0.00 43.42 40.75 2fr8 n LEU 124 CO 0.24 0.44 1.49 0.80 -1.33 0.00 0.00 177.39 179.04 2fr8 n MET 125 N 0.32 2.74 -1.92 3.23 1.56 -1.11 -4.41 117.12 117.53 2fr8 n MET 125 Ca 0.14 1.00 -0.41 0.00 -0.27 0.00 0.00 57.70 58.16 2fr8 n MET 125 Cb 0.74 -2.90 -0.02 0.00 2.15 0.00 0.00 33.22 33.19 2fr8 n MET 125 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 2fr8 s PRO 126 N 3.11 4.21 -1.35 2.12 0.04 -1.26 -4.87 135.00 136.99 2fr8 s PRO 126 Ca 0.84 2.42 -0.16 0.00 0.04 0.00 0.00 61.00 64.14 2fr8 s PRO 126 Cb -0.50 -3.05 0.07 0.00 0.04 0.00 0.00 34.50 31.06 2fr8 s PRO 126 CO 0.39 -0.47 1.91 0.00 0.04 0.00 0.00 177.00 178.87 2fr8 n ALA 127 N 1.73 4.37 -2.62 8.56 0.00 -1.26 -4.80 120.51 126.50 2fr8 n ALA 127 Ca 0.05 -3.90 -0.23 0.00 0.00 0.00 0.00 53.44 49.36 2fr8 n ALA 127 Cb 0.39 -3.53 -0.08 0.00 0.00 0.00 0.00 19.45 16.24 2fr8 n ALA 127 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2fr8 s ILE 128 N 3.57 3.30 0.13 0.00 -4.36 -1.26 -5.06 121.20 117.52 2fr8 s ILE 128 Ca 0.50 -1.98 -0.17 0.00 -0.26 0.00 0.00 60.65 58.74 2fr8 s ILE 128 Cb 0.08 -2.77 -0.02 0.00 1.25 0.00 0.00 42.46 40.99 2fr8 s ILE 128 CO 0.01 -0.37 1.75 0.28 0.24 0.00 0.00 174.94 176.85 2fr8 h SER 129 N 1.93 0.40 0.41 4.36 0.02 -2.02 -2.32 113.55 116.32 2fr8 h SER 129 Ca -0.44 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 60.39 2fr8 h SER 129 Cb 1.25 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 2fr8 h SER 129 CO 0.60 0.35 -0.30 0.08 -1.14 0.00 0.00 176.83 176.42 2fr8 h ARG 130 N 0.42 0.00 -0.60 3.45 0.11 -1.97 -3.09 114.38 112.70 2fr8 h ARG 130 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 2fr8 h ARG 130 Cb 0.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.11 2fr8 h ARG 130 CO -0.02 0.30 0.00 0.00 0.10 0.00 0.00 179.97 180.35 2fr8 n ALA 131 N -2.42 2.88 0.09 0.08 0.00 -0.90 -4.12 120.51 116.12 2fr8 n ALA 131 Ca -0.02 -1.06 -0.05 0.00 0.00 0.00 0.00 53.44 52.31 2fr8 n ALA 131 Cb 0.37 -1.02 0.11 0.00 0.00 0.00 0.00 19.45 18.91 2fr8 n ALA 131 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2fr8 h GLN 132 N 2.80 0.22 0.00 0.00 4.20 -1.42 -2.84 115.11 118.08 2fr8 h GLN 132 Ca 0.00 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.55 2fr8 h GLN 132 Cb 1.04 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.85 2fr8 h GLN 132 CO 0.15 0.79 0.00 -1.13 -0.67 0.00 0.00 178.83 177.97 2fr8 n SER 133 N -3.84 0.00 -0.00 1.46 3.41 -1.26 -2.43 113.62 110.96 2fr8 n SER 133 Ca -0.02 0.04 0.08 0.00 -0.26 0.00 0.00 58.87 58.71 2fr8 n SER 133 Cb 0.64 -0.29 -0.10 0.00 -0.26 0.00 0.00 64.21 64.19 2fr8 n SER 133 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2fr8 n MET 134 N -1.29 1.27 -2.41 4.33 2.81 -1.08 -4.26 117.12 116.49 2fr8 n MET 134 Ca 0.09 -0.05 -0.43 0.00 -1.81 0.00 0.00 57.70 55.50 2fr8 n MET 134 Cb 0.15 -1.31 -0.02 0.00 -0.71 0.00 0.00 33.22 31.33 2fr8 n MET 134 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2fr8 s ASP 135 N -2.99 6.97 -0.05 7.83 2.15 -1.02 -4.70 116.67 124.86 2fr8 s ASP 135 Ca 0.02 1.78 -0.01 0.00 0.43 0.00 0.00 52.55 54.78 2fr8 s ASP 135 Cb 0.12 -2.55 -0.26 0.00 -0.30 0.00 0.00 42.92 39.93 2fr8 s ASP 135 CO 0.68 -0.70 0.66 0.16 -0.17 0.00 0.00 175.17 175.79 2fr8 h ILE 136 N 5.28 0.91 -0.47 4.11 3.07 -1.90 -3.18 117.51 125.34 2fr8 h ILE 136 Ca -0.30 -2.62 0.08 0.00 1.55 0.00 0.00 64.86 63.56 2fr8 h ILE 136 Cb 1.13 2.60 -0.06 0.00 -0.27 0.00 0.00 36.82 40.22 2fr8 h ILE 136 CO 0.93 0.77 0.11 -0.07 -1.05 0.00 0.00 178.15 178.84 2fr8 h LEU 137 N 0.06 0.03 -0.21 0.16 3.38 -1.91 0.18 115.31 117.00 2fr8 h LEU 137 Ca -0.31 0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 2fr8 h LEU 137 Cb 2.02 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.87 2fr8 h LEU 137 CO 0.12 0.05 -0.16 -1.28 0.09 0.00 0.00 178.44 177.26 2fr8 h SER 138 N 0.25 0.51 -0.43 -0.43 0.87 -1.96 -1.79 113.55 110.57 2fr8 h SER 138 Ca 0.23 -0.45 -0.08 0.00 -1.23 0.00 0.00 61.79 60.26 2fr8 h SER 138 Cb 0.29 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 2fr8 h SER 138 CO -0.29 0.85 -0.03 0.77 -0.53 0.00 0.00 176.83 177.60 2fr8 h SER 139 N 0.18 0.83 0.01 6.23 4.64 -1.47 -3.03 113.55 120.93 2fr8 h SER 139 Ca 0.04 -0.22 -0.10 0.00 -0.47 0.00 0.00 61.79 61.05 2fr8 h SER 139 Cb 0.68 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2fr8 h SER 139 CO 0.04 0.91 -0.51 1.56 -0.87 0.00 0.00 176.83 177.96 2fr8 h GLN 140 N 0.79 0.02 0.00 4.77 1.08 -0.63 -3.34 115.11 117.79 2fr8 h GLN 140 Ca 0.14 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 2fr8 h GLN 140 Cb 0.51 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 2fr8 h GLN 140 CO 0.03 1.02 0.00 -1.13 -0.95 0.00 0.00 178.83 177.79 2fr8 n SER 141 N -4.51 0.50 -0.06 1.46 3.41 -0.68 -2.27 113.62 111.48 2fr8 n SER 141 Ca -0.18 0.62 -0.11 0.00 -0.26 0.00 0.00 58.87 58.94 2fr8 n SER 141 Cb 0.58 -0.73 -0.05 0.00 -0.26 0.00 0.00 64.21 63.75 2fr8 n SER 141 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 2fr8 h ASN 142 N 0.00 0.29 0.61 4.04 -0.73 -1.65 -2.34 115.58 115.79 2fr8 h ASN 142 Ca 0.00 -0.22 -0.06 0.00 1.87 0.00 0.00 56.30 57.90 2fr8 h ASN 142 Cb 0.36 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.87 2fr8 h ASN 142 CO 0.00 0.43 -0.27 -0.07 -0.37 0.00 0.00 177.43 177.15 2fr8 h LEU 143 N 0.13 0.00 -0.76 0.34 3.38 -1.57 -1.99 115.31 114.85 2fr8 h LEU 143 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2fr8 h LEU 143 Cb 0.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2fr8 h LEU 143 CO -0.00 0.27 0.43 0.00 0.09 0.00 0.00 178.44 179.22 2fr8 h ALA 144 N 1.73 0.97 -0.83 1.53 0.00 -1.38 -0.13 119.26 121.16 2fr8 h ALA 144 Ca -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2fr8 h ALA 144 Cb 0.64 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2fr8 h ALA 144 CO 0.03 0.47 0.51 0.78 0.00 0.00 0.00 179.25 181.04 2fr8 h GLY 145 N 1.04 1.20 0.83 0.00 0.00 -0.81 -1.63 103.07 103.71 2fr8 h GLY 145 Ca 0.27 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 2fr8 h GLY 145 CO -0.05 0.48 0.03 -1.82 0.00 0.00 0.00 176.54 175.18 2fr8 h TYR 146 N 1.14 0.31 -0.70 5.60 3.20 -1.21 -3.18 116.97 122.12 2fr8 h TYR 146 Ca 0.30 -0.04 0.03 0.00 3.14 0.00 0.00 58.73 62.15 2fr8 h TYR 146 Cb -0.06 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 2fr8 h TYR 146 CO -0.01 0.44 0.44 -0.09 -1.64 0.00 0.00 178.16 177.31 2fr8 h ARG 147 N 0.08 0.85 -0.69 1.82 1.12 -0.81 -3.00 114.38 113.75 2fr8 h ARG 147 Ca 0.05 -0.05 0.15 0.00 -1.11 0.00 0.00 59.98 59.02 2fr8 h ARG 147 Cb 0.30 -0.19 -0.10 0.00 -0.01 0.00 0.00 29.97 29.96 2fr8 h ARG 147 CO 0.00 0.56 0.15 0.00 -3.11 0.00 0.00 179.97 177.57 2fr8 h ALA 148 N 1.29 0.86 -0.31 2.80 0.00 -1.34 0.30 119.26 122.86 2fr8 h ALA 148 Ca 0.28 0.16 -0.12 0.00 0.00 0.00 0.00 54.91 55.23 2fr8 h ALA 148 Cb -0.01 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2fr8 h ALA 148 CO -0.10 -0.33 -0.31 0.28 0.00 0.00 0.00 179.25 178.79 2fr8 h VAL 149 N 0.25 1.28 -0.35 0.00 2.07 -1.62 0.54 116.25 118.42 2fr8 h VAL 149 Ca 0.38 -1.44 -0.04 0.00 0.82 0.00 0.00 66.70 66.43 2fr8 h VAL 149 Cb 0.63 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 2fr8 h VAL 149 CO -0.49 0.46 0.07 0.40 0.02 0.00 0.00 177.57 178.03 2fr8 h ILE 150 N 0.56 1.23 -0.26 4.57 1.08 -0.89 0.53 117.51 124.33 2fr8 h ILE 150 Ca 0.07 -0.81 -0.02 0.00 -0.39 0.00 0.00 64.86 63.71 2fr8 h ILE 150 Cb 0.81 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 35.63 2fr8 h ILE 150 CO 0.07 0.27 0.11 0.44 -0.69 0.00 0.00 178.15 178.35 2fr8 h ASP 151 N 0.42 0.37 -0.07 1.72 3.32 -0.40 -1.08 116.42 120.70 2fr8 h ASP 151 Ca 0.11 -0.16 0.04 0.00 0.02 0.00 0.00 57.03 57.03 2fr8 h ASP 151 Cb 0.34 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.74 2fr8 h ASP 151 CO 0.00 0.43 -0.28 1.23 -1.72 0.00 0.00 179.24 178.90 2fr8 h GLY 152 N 0.28 -0.40 0.09 2.75 0.00 -0.78 0.13 103.07 105.14 2fr8 h GLY 152 Ca 0.09 0.34 0.15 0.00 0.00 0.00 0.00 47.33 47.91 2fr8 h GLY 152 CO -0.01 -0.22 0.29 0.00 0.00 0.00 0.00 176.54 176.61 2fr8 h ALA 153 N 0.45 1.08 -0.29 3.60 0.00 -0.83 -0.96 119.26 122.30 2fr8 h ALA 153 Ca 0.08 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 2fr8 h ALA 153 Cb 0.51 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2fr8 h ALA 153 CO -0.29 -0.24 0.08 -0.92 0.00 0.00 0.00 179.25 177.88 2fr8 h TYR 154 N 0.42 0.49 0.00 0.00 3.20 -0.25 -2.99 116.97 117.83 2fr8 h TYR 154 Ca 0.43 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.23 2fr8 h TYR 154 Cb 0.67 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.80 2fr8 h TYR 154 CO -0.18 0.52 -0.07 0.93 -1.64 0.00 0.00 178.16 177.72 2fr8 h GLU 155 N 0.31 0.00 -6.39 1.82 4.39 -0.37 -3.44 114.58 110.91 2fr8 h GLU 155 Ca 0.09 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.25 2fr8 h GLU 155 Cb 0.27 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 2fr8 h GLU 155 CO -0.00 0.07 0.37 0.12 -1.16 0.00 0.00 179.01 178.41 2fr8 s PHE 156 N -3.56 3.65 -2.04 4.33 5.36 -0.40 -4.93 117.98 120.38 2fr8 s PHE 156 Ca 0.02 1.68 0.16 0.00 -0.96 0.00 0.00 56.93 57.82 2fr8 s PHE 156 Cb 0.09 -3.11 0.84 0.00 -0.34 0.00 0.00 43.02 40.50 2fr8 s PHE 156 CO 0.59 -0.02 1.55 0.00 -1.46 0.00 0.00 175.22 175.89 2fr8 n ALA 157 N 3.94 2.57 -2.44 11.12 0.00 -1.26 -4.81 120.51 129.64 2fr8 n ALA 157 Ca 0.06 -0.18 -0.23 0.00 0.00 0.00 0.00 53.44 53.09 2fr8 n ALA 157 Cb 0.51 -1.21 -0.10 0.00 0.00 0.00 0.00 19.45 18.65 2fr8 n ALA 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2fr8 s ARG 158 N -1.95 1.59 0.43 0.00 0.52 -1.26 -5.14 118.95 113.14 2fr8 s ARG 158 Ca 0.24 -1.72 -0.22 0.00 -0.52 0.00 0.00 55.73 53.51 2fr8 s ARG 158 Cb 0.11 -1.61 -0.09 0.00 0.52 0.00 0.00 34.95 33.88 2fr8 s ARG 158 CO 0.18 0.30 1.01 0.00 0.02 0.00 0.00 175.30 176.82 2fr8 s ALA 159 N -2.59 3.00 -0.04 2.13 0.00 -1.26 -5.02 121.76 117.99 2fr8 s ALA 159 Ca 0.28 0.59 -0.22 0.00 0.00 0.00 0.00 51.96 52.60 2fr8 s ALA 159 Cb -0.04 -3.23 -0.16 0.00 0.00 0.00 0.00 23.12 19.68 2fr8 s ALA 159 CO 0.13 -0.14 0.97 0.74 0.00 0.00 0.00 175.76 177.46 2fr8 h PHE 160 N 2.07 -0.21 -4.34 0.00 -1.00 -1.91 -3.35 116.94 108.20 2fr8 h PHE 160 Ca -0.49 -0.00 -0.47 0.00 2.81 0.00 0.00 57.97 59.82 2fr8 h PHE 160 Cb 1.21 0.07 0.12 0.00 3.61 0.00 0.00 35.95 40.95 2fr8 h PHE 160 CO 0.59 0.22 0.34 -1.25 -1.61 0.00 0.00 178.31 176.60 2fr8 s PRO 161 N -3.70 1.57 0.13 1.51 0.04 -1.24 0.13 135.00 133.43 2fr8 s PRO 161 Ca -0.13 0.32 -0.29 0.00 0.04 0.00 0.00 61.00 60.93 2fr8 s PRO 161 Cb 0.01 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 2fr8 s PRO 161 CO 0.51 -1.91 0.93 1.41 0.04 0.00 0.00 177.00 177.98 2fr8 s MET 162 N -5.33 4.70 -0.12 4.56 -2.45 -1.26 -4.33 119.30 115.08 2fr8 s MET 162 Ca 0.63 1.41 -0.01 0.00 -1.25 0.00 0.00 55.69 56.47 2fr8 s MET 162 Cb -0.14 -3.35 0.03 0.00 1.25 0.00 0.00 34.83 32.62 2fr8 s MET 162 CO 0.52 0.29 -0.05 -1.64 1.05 0.00 0.00 175.02 175.19 2fr8 s MET 163 N -0.27 1.30 -0.18 4.11 -1.94 -1.11 -4.97 119.30 116.25 2fr8 s MET 163 Ca 0.45 -0.23 -0.13 0.00 -1.71 0.00 0.00 55.69 54.07 2fr8 s MET 163 Cb -0.24 -1.55 -0.05 0.00 2.01 0.00 0.00 34.83 35.01 2fr8 s MET 163 CO 0.29 -0.31 0.26 -1.64 -0.01 0.00 0.00 175.02 173.61 2fr8 s MET 164 N 1.76 4.23 0.30 2.03 -1.94 -1.26 -2.29 119.30 122.12 2fr8 s MET 164 Ca 0.04 0.02 0.05 0.00 -1.71 0.00 0.00 55.69 54.08 2fr8 s MET 164 Cb -0.13 -3.44 -0.02 0.00 2.01 0.00 0.00 34.83 33.25 2fr8 s MET 164 CO -0.08 0.21 0.17 0.25 -0.01 0.00 0.00 175.02 175.56 2fr8 n THR 165 N 3.69 0.00 0.19 2.05 -2.24 -0.85 -5.03 114.28 112.09 2fr8 n THR 165 Ca -0.13 -1.93 0.16 0.00 -2.27 0.00 0.00 64.05 59.88 2fr8 n THR 165 Cb 0.52 0.82 0.78 0.00 -2.10 0.00 0.00 70.33 70.35 2fr8 n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fr8 h ALA 166 N 1.69 1.94 -0.82 6.98 0.00 -2.06 -3.19 119.26 123.80 2fr8 h ALA 166 Ca -0.22 -0.01 -0.55 0.00 0.00 0.00 0.00 54.91 54.13 2fr8 h ALA 166 Cb 0.97 0.01 -0.43 0.00 0.00 0.00 0.00 17.79 18.35 2fr8 h ALA 166 CO 0.34 -0.28 -0.81 0.00 0.00 0.00 0.00 179.25 178.50 2fr8 n ALA 167 N -2.43 5.01 0.00 0.00 0.00 -1.26 -5.08 120.51 116.75 2fr8 n ALA 167 Ca 0.02 -3.83 0.00 0.00 0.00 0.00 0.00 53.44 49.63 2fr8 n ALA 167 Cb 0.31 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.42 2fr8 n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fr8 n GLY 168 N -0.69 -1.65 3.16 0.00 0.00 -1.21 -5.05 105.19 99.76 2fr8 n GLY 168 Ca 0.43 -2.20 -0.27 0.00 0.00 0.00 0.00 46.02 43.99 2fr8 n GLY 168 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fr8 s THR 169 N -0.64 1.53 -0.07 2.61 2.01 -1.26 -2.00 115.64 117.82 2fr8 s THR 169 Ca 0.00 -0.78 -0.14 0.00 0.31 0.00 0.00 61.69 61.08 2fr8 s THR 169 Cb 0.00 -1.30 -0.05 0.00 0.01 0.00 0.00 72.50 71.16 2fr8 s THR 169 CO 0.00 0.44 0.35 0.68 -0.69 0.00 0.00 174.62 175.40 2fr8 s VAL 170 N -0.05 5.18 0.88 3.82 -7.23 -0.97 -5.00 120.40 117.02 2fr8 s VAL 170 Ca -0.02 0.70 -0.12 0.00 -1.81 0.00 0.00 61.98 60.73 2fr8 s VAL 170 Cb -0.11 -3.66 0.12 0.00 0.56 0.00 0.00 36.38 33.28 2fr8 s VAL 170 CO 0.02 0.51 1.10 -2.16 -0.31 0.00 0.00 175.10 174.25 2fr8 s PRO 171 N -0.47 1.43 0.65 4.82 0.04 -1.26 -2.76 135.00 137.45 2fr8 s PRO 171 Ca 0.21 0.69 -0.11 0.00 0.04 0.00 0.00 61.00 61.83 2fr8 s PRO 171 Cb -0.15 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 2fr8 s PRO 171 CO 0.09 -2.09 1.04 -1.25 0.04 0.00 0.00 177.00 174.84 2fr8 s PRO 172 N -5.03 3.32 0.39 0.56 0.04 -1.26 -4.50 135.00 128.51 2fr8 s PRO 172 Ca 0.63 0.85 -0.25 0.00 0.04 0.00 0.00 61.00 62.27 2fr8 s PRO 172 Cb -0.17 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 2fr8 s PRO 172 CO 0.56 -0.80 1.08 0.00 0.04 0.00 0.00 177.00 177.89 2fr8 s ALA 173 N -3.10 3.14 -0.32 8.56 0.00 0.12 -4.78 121.76 125.37 2fr8 s ALA 173 Ca 0.57 0.79 -0.11 0.00 0.00 0.00 0.00 51.96 53.21 2fr8 s ALA 173 Cb -0.12 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 2fr8 s ALA 173 CO 0.54 -0.29 0.18 1.03 0.00 0.00 0.00 175.76 177.22 2fr8 s ARG 174 N -2.32 3.41 0.07 0.00 0.52 -1.26 -0.68 118.95 118.69 2fr8 s ARG 174 Ca 0.56 -0.68 0.03 0.00 -0.52 0.00 0.00 55.73 55.12 2fr8 s ARG 174 Cb -0.25 -3.65 -0.04 0.00 0.52 0.00 0.00 34.95 31.53 2fr8 s ARG 174 CO 0.32 -0.42 0.08 0.08 0.02 0.00 0.00 175.30 175.38 2fr8 s VAL 175 N 1.65 4.54 -0.11 3.52 1.01 0.19 -0.49 120.40 130.72 2fr8 s VAL 175 Ca 0.05 -0.74 -0.03 0.00 0.00 0.00 0.00 61.98 61.27 2fr8 s VAL 175 Cb -0.17 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.07 2fr8 s VAL 175 CO 0.08 0.14 0.05 -0.22 0.00 0.00 0.00 175.10 175.15 2fr8 s LEU 176 N -2.33 0.50 -0.30 3.92 0.20 -0.78 -0.21 118.68 119.68 2fr8 s LEU 176 Ca 0.29 -0.30 -0.09 0.00 0.69 0.00 0.00 54.13 54.72 2fr8 s LEU 176 Cb -0.12 -0.33 -0.01 0.00 -0.43 0.00 0.00 46.19 45.30 2fr8 s LEU 176 CO 0.21 -0.27 0.13 -0.69 -0.29 0.00 0.00 176.35 175.44 2fr8 s VAL 177 N 2.05 4.43 -0.14 1.68 1.01 -0.55 -1.39 120.40 127.49 2fr8 s VAL 177 Ca 0.03 -0.46 -0.20 0.00 0.00 0.00 0.00 61.98 61.35 2fr8 s VAL 177 Cb -0.14 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 2fr8 s VAL 177 CO -0.06 0.10 0.57 -0.36 0.00 0.00 0.00 175.10 175.35 2fr8 s PHE 178 N 1.59 3.47 0.15 5.22 0.40 0.06 -1.25 117.98 127.62 2fr8 s PHE 178 Ca 0.04 0.96 0.00 0.00 -0.60 0.00 0.00 56.93 57.33 2fr8 s PHE 178 Cb -0.17 -2.69 0.00 0.00 0.51 0.00 0.00 43.02 40.67 2fr8 s PHE 178 CO 0.05 0.01 0.00 0.41 0.70 0.00 0.00 175.22 176.39 2fr8 n GLY 179 N 3.48 -3.99 2.81 4.36 0.00 0.34 -1.84 105.19 110.35 2fr8 n GLY 179 Ca -0.04 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 2fr8 n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fr8 s VAL 180 N -1.44 2.14 0.00 1.61 1.01 -1.26 -4.36 120.40 118.10 2fr8 s VAL 180 Ca 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 61.98 58.61 2fr8 s VAL 180 Cb 0.00 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.92 2fr8 s VAL 180 CO 0.00 -0.94 0.00 0.61 0.00 0.00 0.00 175.10 174.77 2fr8 n GLY 181 N 2.81 2.46 0.33 4.51 0.00 -1.26 -4.85 105.19 109.19 2fr8 n GLY 181 Ca 0.14 -1.91 -0.01 0.00 0.00 0.00 0.00 46.02 44.24 2fr8 n GLY 181 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2fr8 h VAL 182 N 0.00 1.20 0.03 1.61 2.07 -1.96 -2.33 116.25 116.87 2fr8 h VAL 182 Ca 0.00 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 2fr8 h VAL 182 Cb 0.00 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 2fr8 h VAL 182 CO 0.00 0.23 -0.01 0.00 0.02 0.00 0.00 177.57 177.80 2fr8 h ALA 183 N 1.47 -0.04 -0.34 1.67 0.00 -1.88 -2.77 119.26 117.37 2fr8 h ALA 183 Ca 0.23 -0.28 0.07 0.00 0.00 0.00 0.00 54.91 54.93 2fr8 h ALA 183 Cb 0.05 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.77 2fr8 h ALA 183 CO -0.03 -0.23 -0.18 0.78 0.00 0.00 0.00 179.25 179.59 2fr8 h GLY 184 N -0.61 0.08 0.85 0.00 0.00 -1.74 -0.08 103.07 101.57 2fr8 h GLY 184 Ca -0.00 0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.60 2fr8 h GLY 184 CO 0.01 -0.18 0.64 1.41 0.00 0.00 0.00 176.54 178.41 2fr8 h LEU 185 N -0.12 1.05 -0.42 3.11 3.38 -1.47 0.19 115.31 121.02 2fr8 h LEU 185 Ca 0.17 -0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.96 2fr8 h LEU 185 Cb 0.39 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2fr8 h LEU 185 CO -0.42 0.70 -0.71 -0.61 0.09 0.00 0.00 178.44 177.49 2fr8 h GLN 186 N 1.20 0.41 0.82 1.13 5.75 -1.12 -1.44 115.11 121.86 2fr8 h GLN 186 Ca 0.40 -0.32 -0.04 0.00 -0.15 0.00 0.00 58.65 58.54 2fr8 h GLN 186 Cb 0.07 0.07 0.01 0.00 1.07 0.00 0.00 27.48 28.70 2fr8 h GLN 186 CO -0.14 0.96 -0.40 0.00 -2.65 0.00 0.00 178.83 176.61 2fr8 h ALA 187 N 0.95 -1.11 -0.68 3.38 0.00 -0.45 0.03 119.26 121.39 2fr8 h ALA 187 Ca -0.03 -0.24 0.13 0.00 0.00 0.00 0.00 54.91 54.77 2fr8 h ALA 187 Cb 1.28 0.43 -0.13 0.00 0.00 0.00 0.00 17.79 19.37 2fr8 h ALA 187 CO 0.12 -1.12 -0.24 0.82 0.00 0.00 0.00 179.25 178.83 2fr8 h ILE 188 N -1.12 0.23 -0.42 0.00 2.04 -1.00 0.88 117.51 118.11 2fr8 h ILE 188 Ca -0.11 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.82 2fr8 h ILE 188 Cb 0.85 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 37.10 2fr8 h ILE 188 CO 0.19 0.00 0.05 0.00 0.00 0.00 0.00 178.15 178.38 2fr8 h ALA 189 N 1.43 0.43 -0.23 1.87 0.00 -1.09 0.19 119.26 121.87 2fr8 h ALA 189 Ca 0.30 0.10 -0.18 0.00 0.00 0.00 0.00 54.91 55.13 2fr8 h ALA 189 Cb 0.54 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2fr8 h ALA 189 CO -0.72 -0.35 -0.56 1.15 0.00 0.00 0.00 179.25 178.77 2fr8 h THR 190 N 0.17 1.29 -0.29 0.00 2.02 0.99 -1.59 112.91 115.50 2fr8 h THR 190 Ca 0.21 -1.76 0.00 0.00 0.77 0.00 0.00 66.41 65.63 2fr8 h THR 190 Cb 0.28 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.45 2fr8 h THR 190 CO -0.30 0.56 0.19 0.00 0.37 0.00 0.00 175.52 176.34 2fr8 h ALA 191 N 0.62 0.37 0.07 6.16 0.00 0.10 -1.68 119.26 124.91 2fr8 h ALA 191 Ca -0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.62 2fr8 h ALA 191 Cb 1.17 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.86 2fr8 h ALA 191 CO 0.12 -0.16 -1.13 -0.22 0.00 0.00 0.00 179.25 177.87 2fr8 h LYS 192 N 0.39 0.53 0.00 0.00 3.64 -0.63 -2.69 116.57 117.81 2fr8 h LYS 192 Ca 0.11 -0.66 -0.02 0.00 -1.27 0.00 0.00 60.65 58.81 2fr8 h LYS 192 Cb -0.04 0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2fr8 h LYS 192 CO -0.02 1.27 -0.09 0.07 -2.27 0.00 0.00 179.45 178.40 2fr8 h ARG 193 N 0.26 0.00 0.00 1.90 0.11 -1.32 -2.10 114.38 113.22 2fr8 h ARG 193 Ca -0.14 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.85 2fr8 h ARG 193 Cb 1.79 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.86 2fr8 h ARG 193 CO 0.21 0.09 -0.41 1.25 0.10 0.00 0.00 179.97 181.21 2fr8 h LEU 194 N 0.00 0.00 0.00 0.08 5.85 -0.98 -3.47 115.31 116.79 2fr8 h LEU 194 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2fr8 h LEU 194 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 2fr8 h LEU 194 CO 0.01 0.41 0.00 0.61 -0.34 0.00 0.00 178.44 179.13 2fr8 n GLY 195 N -0.06 1.14 3.82 3.75 0.00 -0.79 -3.73 105.19 109.32 2fr8 n GLY 195 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2fr8 n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 s ALA 196 N -2.00 2.72 -0.41 4.61 0.00 -1.08 -4.10 121.76 121.50 2fr8 s ALA 196 Ca 0.00 0.11 -0.29 0.00 0.00 0.00 0.00 51.96 51.78 2fr8 s ALA 196 Cb 0.00 -3.17 0.02 0.00 0.00 0.00 0.00 23.12 19.97 2fr8 s ALA 196 CO 0.00 -1.14 1.11 0.08 0.00 0.00 0.00 175.76 175.81 2fr8 s VAL 197 N -2.99 4.35 -0.22 0.00 1.01 0.14 -4.56 120.40 118.12 2fr8 s VAL 197 Ca 0.58 1.45 -0.09 0.00 0.00 0.00 0.00 61.98 63.92 2fr8 s VAL 197 Cb -0.14 -4.52 -0.05 0.00 0.00 0.00 0.00 36.38 31.68 2fr8 s VAL 197 CO 0.53 -0.77 0.13 -0.69 0.00 0.00 0.00 175.10 174.30 2fr8 s VAL 198 N 4.08 5.16 0.17 2.92 1.01 -1.26 -0.63 120.40 131.85 2fr8 s VAL 198 Ca 0.47 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.62 2fr8 s VAL 198 Cb -0.09 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2fr8 s VAL 198 CO 0.24 0.39 0.01 -0.04 0.00 0.00 0.00 175.10 175.70 2fr8 s MET 199 N 0.84 2.45 -0.01 2.72 -1.94 0.70 -2.03 119.30 122.03 2fr8 s MET 199 Ca 0.06 -1.08 -0.23 0.00 -1.71 0.00 0.00 55.69 52.73 2fr8 s MET 199 Cb -0.13 -2.39 0.05 0.00 2.01 0.00 0.00 34.83 34.37 2fr8 s MET 199 CO 0.02 0.46 0.51 0.00 -0.01 0.00 0.00 175.02 176.01 2fr8 s ALA 200 N -1.73 -1.32 0.04 3.03 0.00 -0.55 -1.48 121.76 119.74 2fr8 s ALA 200 Ca 0.28 0.77 -0.07 0.00 0.00 0.00 0.00 51.96 52.94 2fr8 s ALA 200 Cb -0.09 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 2fr8 s ALA 200 CO 0.19 -0.38 0.13 -0.08 0.00 0.00 0.00 175.76 175.62 2fr8 s THR 201 N -1.67 0.13 -0.07 0.00 -1.32 -0.38 -2.19 115.64 110.14 2fr8 s THR 201 Ca -0.10 -1.05 -0.30 0.00 -1.21 0.00 0.00 61.69 59.04 2fr8 s THR 201 Cb -0.02 -0.93 0.09 0.00 -1.51 0.00 0.00 72.50 70.13 2fr8 s THR 201 CO 0.04 -0.58 0.80 -0.62 -2.21 0.00 0.00 174.62 172.06 2fr8 s ASP 202 N -2.17 -0.53 0.11 8.08 -1.08 -1.26 -0.50 116.67 119.32 2fr8 s ASP 202 Ca -0.04 0.52 0.26 0.00 -0.52 0.00 0.00 52.55 52.77 2fr8 s ASP 202 Cb -0.01 0.45 0.99 0.00 -1.46 0.00 0.00 42.92 42.89 2fr8 s ASP 202 CO -0.05 -0.54 1.81 1.33 0.52 0.00 0.00 175.17 178.25 2fr8 n VAL 203 N 0.70 0.40 -1.41 1.11 0.24 -1.26 -4.85 118.33 113.25 2fr8 n VAL 203 Ca -0.15 -0.09 -0.31 0.00 -2.04 0.00 0.00 64.34 61.75 2fr8 n VAL 203 Cb 0.58 -0.62 0.07 0.00 -1.47 0.00 0.00 33.84 32.40 2fr8 n VAL 203 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2fr8 s ARG 204 N -3.07 2.55 -0.05 7.34 0.52 -1.26 -5.05 118.95 119.94 2fr8 s ARG 204 Ca 0.11 1.10 -0.01 0.00 -0.52 0.00 0.00 55.73 56.40 2fr8 s ARG 204 Cb 0.15 -1.94 -0.00 0.00 0.52 0.00 0.00 34.95 33.67 2fr8 s ARG 204 CO 0.53 -1.41 -0.03 0.00 0.02 0.00 0.00 175.30 174.41 2fr8 h ALA 205 N -0.90 0.00 0.00 2.13 0.00 -2.02 -3.37 119.26 115.10 2fr8 h ALA 205 Ca -0.44 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2fr8 h ALA 205 Cb 1.22 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2fr8 h ALA 205 CO 0.54 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.87 2fr8 n ALA 206 N -2.52 2.07 -0.03 0.00 0.00 -1.26 -3.69 120.51 115.07 2fr8 n ALA 206 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.29 2fr8 n ALA 206 Cb 0.04 -1.00 -0.11 0.00 0.00 0.00 0.00 19.45 18.38 2fr8 n ALA 206 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2fr8 h THR 207 N 0.00 1.53 -0.70 0.00 2.02 -1.96 -3.23 112.91 110.57 2fr8 h THR 207 Ca 0.00 -1.77 0.12 0.00 0.77 0.00 0.00 66.41 65.53 2fr8 h THR 207 Cb 0.36 2.65 -0.13 0.00 -1.74 0.00 0.00 68.15 69.29 2fr8 h THR 207 CO 0.00 0.48 -0.35 0.50 0.37 0.00 0.00 175.52 176.52 2fr8 h LYS 208 N -0.53 -0.11 0.08 6.66 3.64 -1.84 0.24 116.57 124.71 2fr8 h LYS 208 Ca -0.01 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2fr8 h LYS 208 Cb 0.86 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.68 2fr8 h LYS 208 CO 0.03 -0.08 -0.15 1.49 -2.27 0.00 0.00 179.45 178.48 2fr8 h GLU 209 N -0.12 -0.28 -0.58 1.90 4.81 -1.86 0.44 114.58 118.90 2fr8 h GLU 209 Ca 0.26 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.62 2fr8 h GLU 209 Cb 0.56 0.06 -0.08 0.00 0.63 0.00 0.00 28.75 29.93 2fr8 h GLU 209 CO -0.76 -0.18 0.14 1.96 -0.73 0.00 0.00 179.01 179.43 2fr8 h GLN 210 N -0.29 0.27 -0.42 1.92 4.20 -1.16 0.53 115.11 120.16 2fr8 h GLN 210 Ca 0.02 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2fr8 h GLN 210 Cb 0.31 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 2fr8 h GLN 210 CO -0.08 0.18 0.25 0.28 -0.67 0.00 0.00 178.83 178.79 2fr8 h VAL 211 N 0.28 1.13 0.00 -0.54 2.07 -0.35 -2.48 116.25 116.35 2fr8 h VAL 211 Ca 0.30 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 2fr8 h VAL 211 Cb 0.43 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2fr8 h VAL 211 CO -0.37 0.13 -0.18 -0.33 0.02 0.00 0.00 177.57 176.83 2fr8 h GLU 212 N 0.55 0.00 -0.20 1.57 5.08 0.34 -1.83 114.58 120.09 2fr8 h GLU 212 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2fr8 h GLU 212 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2fr8 h GLU 212 CO -0.03 0.18 0.00 -1.13 -1.00 0.00 0.00 179.01 177.04 2fr8 n SER 213 N -3.86 0.20 0.00 1.42 3.41 0.17 -2.74 113.62 112.22 2fr8 n SER 213 Ca -0.02 -1.16 0.00 0.00 -0.26 0.00 0.00 58.87 57.43 2fr8 n SER 213 Cb 0.28 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 2fr8 n SER 213 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2fr8 n LEU 214 N -0.26 0.05 0.00 1.04 4.77 -0.70 -5.02 117.00 116.88 2fr8 n LEU 214 Ca 0.00 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 2fr8 n LEU 214 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2fr8 n LEU 214 CO 0.00 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.68 2fr8 n GLY 215 N 0.44 0.97 3.83 -0.72 0.00 -1.11 -4.92 105.19 103.69 2fr8 n GLY 215 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2fr8 n GLY 215 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fr8 s GLY 216 N -2.18 1.83 -0.23 -0.02 0.00 -1.17 -4.88 107.32 100.66 2fr8 s GLY 216 Ca 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 44.72 44.75 2fr8 s GLY 216 CO 0.00 0.42 0.13 0.54 0.00 0.00 0.00 173.10 174.18 2fr8 s LYS 217 N -4.72 3.99 -0.26 2.90 1.02 -0.86 -3.90 119.74 117.91 2fr8 s LYS 217 Ca 0.59 -0.32 -0.25 0.00 0.02 0.00 0.00 55.97 56.01 2fr8 s LYS 217 Cb -0.13 -3.44 -0.00 0.00 -0.52 0.00 0.00 37.83 33.74 2fr8 s LYS 217 CO 0.47 0.06 0.86 0.12 -0.92 0.00 0.00 175.35 175.95 2fr8 s PHE 218 N 1.01 3.28 -0.41 3.18 5.36 -1.26 -1.49 117.98 127.66 2fr8 s PHE 218 Ca 0.06 1.11 -0.28 0.00 -0.96 0.00 0.00 56.93 56.87 2fr8 s PHE 218 Cb -0.14 -3.15 -0.03 0.00 -0.34 0.00 0.00 43.02 39.36 2fr8 s PHE 218 CO 0.04 -0.47 1.93 0.42 -1.46 0.00 0.00 175.22 175.68 2fr8 s ILE 219 N 2.96 3.34 -0.28 3.12 1.01 -0.93 -4.92 121.20 125.50 2fr8 s ILE 219 Ca 0.36 0.30 -0.08 0.00 0.00 0.00 0.00 60.65 61.24 2fr8 s ILE 219 Cb -0.15 -3.57 0.13 0.00 0.01 0.00 0.00 42.46 38.88 2fr8 s ILE 219 CO 0.09 -0.44 0.59 0.42 0.00 0.00 0.00 174.94 175.60 2fr8 s THR 220 N 8.23 -0.93 0.00 2.92 -4.23 -1.26 -4.90 115.64 115.47 2fr8 s THR 220 Ca 0.81 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 61.34 2fr8 s THR 220 Cb -0.20 -0.94 0.00 0.00 1.34 0.00 0.00 72.50 72.69 2fr8 s THR 220 CO 0.30 0.01 0.24 0.52 -0.54 0.00 0.00 174.62 175.14 2fr8 n VAL 221 N 5.43 0.00 -3.95 2.29 0.31 -1.26 -5.17 118.33 115.99 2fr8 n VAL 221 Ca -0.09 0.66 -0.36 0.00 -0.01 0.00 0.00 64.34 64.54 2fr8 n VAL 221 Cb 0.49 -1.50 0.01 0.00 -0.91 0.00 0.00 33.84 31.94 2fr8 n VAL 221 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2fr8 n LYS 246 N -0.29 -0.52 -0.00 5.55 5.02 -1.26 -5.20 118.16 121.46 2fr8 n LYS 246 Ca 0.00 0.08 -0.04 0.00 -2.02 0.00 0.00 58.31 56.34 2fr8 n LYS 246 Cb 0.00 -1.85 -0.01 0.00 -0.02 0.00 0.00 35.03 33.14 2fr8 n LYS 246 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 2fr8 n GLN 247 N -3.99 0.12 0.00 1.97 0.00 -1.26 -4.62 117.38 109.61 2fr8 n GLN 247 Ca -0.13 0.05 0.05 0.00 -0.00 0.00 0.00 57.00 56.97 2fr8 n GLN 247 Cb 0.49 -0.71 0.24 0.00 0.00 0.00 0.00 30.24 30.27 2fr8 n GLN 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2fr8 n ALA 248 N -3.53 1.63 -0.13 1.69 0.00 -1.26 -1.28 120.51 117.64 2fr8 n ALA 248 Ca -0.07 -0.05 -0.08 0.00 0.00 0.00 0.00 53.44 53.24 2fr8 n ALA 248 Cb 0.30 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.66 2fr8 n ALA 248 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2fr8 h GLU 249 N 0.00 0.88 -0.47 0.00 4.81 -1.99 0.31 114.58 118.12 2fr8 h GLU 249 Ca 0.00 -0.33 -0.10 0.00 -0.13 0.00 0.00 59.36 58.80 2fr8 h GLU 249 Cb 0.08 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 2fr8 h GLU 249 CO 0.00 0.98 -0.10 0.00 -0.73 0.00 0.00 179.01 179.15 2fr8 h ALA 250 N 1.03 0.93 0.11 2.92 0.00 -1.46 -0.63 119.26 122.16 2fr8 h ALA 250 Ca 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2fr8 h ALA 250 Cb 0.69 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2fr8 h ALA 250 CO 0.05 0.62 -0.05 0.28 0.00 0.00 0.00 179.25 180.15 2fr8 h VAL 251 N 0.78 1.00 0.36 0.00 2.07 -1.49 -3.20 116.25 115.76 2fr8 h VAL 251 Ca 0.13 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2fr8 h VAL 251 Cb 0.61 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2fr8 h VAL 251 CO 0.04 0.11 -0.27 -0.07 0.02 0.00 0.00 177.57 177.40 2fr8 h LEU 252 N -0.35 -0.70 -0.99 2.57 3.38 -0.31 -1.49 115.31 117.42 2fr8 h LEU 252 Ca -0.02 0.05 0.36 0.00 0.09 0.00 0.00 57.88 58.37 2fr8 h LEU 252 Cb 0.29 0.22 -0.17 0.00 0.09 0.00 0.00 40.66 41.09 2fr8 h LEU 252 CO 0.03 -0.41 0.42 0.50 0.09 0.00 0.00 178.44 179.07 2fr8 h LYS 253 N -0.62 0.07 0.02 1.13 1.63 -1.19 0.16 116.57 117.76 2fr8 h LYS 253 Ca -0.03 -0.00 -0.17 0.00 -0.85 0.00 0.00 60.65 59.60 2fr8 h LYS 253 Cb 0.54 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 32.17 2fr8 h LYS 253 CO -0.00 0.04 -0.68 0.93 -3.45 0.00 0.00 179.45 176.29 2fr8 h GLU 254 N 0.07 0.42 0.00 1.90 4.39 -1.49 -3.35 114.58 116.52 2fr8 h GLU 254 Ca 0.76 -0.48 -0.01 0.00 0.34 0.00 0.00 59.36 59.97 2fr8 h GLU 254 Cb 1.87 0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 30.67 2fr8 h GLU 254 CO -0.77 1.15 -0.03 1.25 -1.16 0.00 0.00 179.01 179.45 2fr8 h LEU 255 N -0.09 0.00 0.25 1.33 5.85 0.36 -1.83 115.31 121.19 2fr8 h LEU 255 Ca -0.09 0.00 -0.34 0.00 0.84 0.00 0.00 57.88 58.29 2fr8 h LEU 255 Cb 1.40 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.47 2fr8 h LEU 255 CO 0.13 0.03 -1.49 0.58 -0.34 0.00 0.00 178.44 177.35 2fr8 h VAL 256 N 0.00 1.26 0.00 1.05 2.07 -1.50 -3.15 116.25 115.99 2fr8 h VAL 256 Ca -0.00 -2.68 0.00 0.00 0.82 0.00 0.00 66.70 64.84 2fr8 h VAL 256 Cb 0.09 3.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 2fr8 h VAL 256 CO 0.00 0.81 0.00 2.29 0.02 0.00 0.00 177.57 180.69 2fr8 n LYS 257 N -3.72 0.14 -2.01 1.57 2.85 -1.05 -4.05 118.16 111.89 2fr8 n LYS 257 Ca -0.17 0.06 -0.36 0.00 -1.05 0.00 0.00 58.31 56.79 2fr8 n LYS 257 Cb 1.10 -1.50 0.03 0.00 -0.65 0.00 0.00 35.03 34.01 2fr8 n LYS 257 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2fr8 s THR 258 N -2.83 2.60 -0.13 0.58 2.01 -0.71 -4.76 115.64 112.40 2fr8 s THR 258 Ca 0.17 0.38 -0.07 0.00 0.31 0.00 0.00 61.69 62.49 2fr8 s THR 258 Cb 0.17 -3.16 -0.06 0.00 0.01 0.00 0.00 72.50 69.46 2fr8 s THR 258 CO 0.43 -0.07 -0.17 0.47 -0.69 0.00 0.00 174.62 174.58 2fr8 n ASP 259 N -1.50 0.99 -4.28 3.53 8.00 0.36 -4.51 116.55 119.14 2fr8 n ASP 259 Ca 0.13 0.16 -0.31 0.00 0.71 0.00 0.00 54.79 55.48 2fr8 n ASP 259 Cb 0.49 -0.39 -0.16 0.00 -0.02 0.00 0.00 41.12 41.04 2fr8 n ASP 259 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2fr8 s ILE 260 N -2.25 2.03 -0.10 0.53 1.09 -0.97 -0.40 121.20 121.14 2fr8 s ILE 260 Ca -0.19 -1.08 -0.01 0.00 -1.10 0.00 0.00 60.65 58.28 2fr8 s ILE 260 Cb 0.07 -1.71 0.03 0.00 -1.06 0.00 0.00 42.46 39.79 2fr8 s ILE 260 CO 0.24 0.57 -0.05 0.00 -0.10 0.00 0.00 174.94 175.59 2fr8 s ALA 261 N -0.34 1.17 -0.22 9.38 0.00 -0.76 -1.86 121.76 129.13 2fr8 s ALA 261 Ca 0.02 -0.45 -0.05 0.00 0.00 0.00 0.00 51.96 51.49 2fr8 s ALA 261 Cb -0.12 -0.88 -0.02 0.00 0.00 0.00 0.00 23.12 22.11 2fr8 s ALA 261 CO 0.02 -0.44 -0.01 0.42 0.00 0.00 0.00 175.76 175.74 2fr8 s ILE 262 N 1.78 3.69 -0.14 0.00 1.09 -0.48 -0.26 121.20 126.87 2fr8 s ILE 262 Ca 0.05 -0.39 -0.03 0.00 -1.10 0.00 0.00 60.65 59.17 2fr8 s ILE 262 Cb -0.13 -2.68 -0.03 0.00 -1.06 0.00 0.00 42.46 38.56 2fr8 s ILE 262 CO -0.07 0.41 -0.02 0.42 -0.10 0.00 0.00 174.94 175.58 2fr8 s THR 263 N 1.34 4.07 0.00 2.92 -4.23 -0.53 -0.76 115.64 118.45 2fr8 s THR 263 Ca 0.04 -0.31 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 2fr8 s THR 263 Cb -0.14 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 70.93 2fr8 s THR 263 CO -0.00 0.52 0.32 0.35 -0.54 0.00 0.00 174.62 175.27 2fr8 n THR 264 N 3.14 0.08 -1.97 3.99 -2.24 -0.77 -1.51 114.28 115.00 2fr8 n THR 264 Ca -0.18 -0.28 -0.38 0.00 -2.27 0.00 0.00 64.05 60.94 2fr8 n THR 264 Cb 0.53 1.40 -0.03 0.00 -2.10 0.00 0.00 70.33 70.12 2fr8 n THR 264 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fr8 s ALA 265 N -0.08 2.12 -0.28 6.98 0.00 -1.25 -4.91 121.76 124.34 2fr8 s ALA 265 Ca 0.00 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.43 2fr8 s ALA 265 Cb 0.00 -4.30 0.04 0.00 0.00 0.00 0.00 23.12 18.86 2fr8 s ALA 265 CO 0.00 -3.93 -0.02 -0.51 0.00 0.00 0.00 175.76 171.29 2fr8 s LEU 266 N 9.47 3.62 0.32 0.00 1.02 -1.26 -4.15 118.68 127.70 2fr8 s LEU 266 Ca 0.72 -1.12 -0.28 0.00 0.02 0.00 0.00 54.13 53.47 2fr8 s LEU 266 Cb -0.14 -1.69 -0.09 0.00 0.02 0.00 0.00 46.19 44.29 2fr8 s LEU 266 CO 0.22 -0.21 1.11 -0.63 0.02 0.00 0.00 176.35 176.87 2fr8 s ILE 267 N 1.28 3.43 0.00 -0.59 -1.09 -1.26 -5.00 121.20 117.97 2fr8 s ILE 267 Ca -0.03 1.35 0.00 0.00 -2.23 0.00 0.00 60.65 59.73 2fr8 s ILE 267 Cb -0.19 -3.82 0.00 0.00 -1.58 0.00 0.00 42.46 36.87 2fr8 s ILE 267 CO -0.02 0.25 0.19 -2.65 -1.23 0.00 0.00 174.94 171.47 2fr8 n PRO 268 N 0.80 0.00 -0.11 2.79 -0.02 -1.26 -3.68 135.00 133.52 2fr8 n PRO 268 Ca 0.01 0.19 0.05 0.00 -2.02 0.00 0.00 63.50 61.72 2fr8 n PRO 268 Cb 0.46 -0.50 0.11 0.00 -0.02 0.00 0.00 33.50 33.55 2fr8 n PRO 268 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fr8 n GLY 269 N -0.49 1.70 4.01 -1.23 0.00 -1.26 -5.04 105.19 102.89 2fr8 n GLY 269 Ca 0.00 -0.32 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 2fr8 n GLY 269 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fr8 s LYS 270 N -0.95 2.18 0.43 1.61 -0.14 -1.24 -5.07 119.74 116.56 2fr8 s LYS 270 Ca 0.18 -1.32 -0.22 0.00 -1.36 0.00 0.00 55.97 53.25 2fr8 s LYS 270 Cb 0.10 -2.54 -0.09 0.00 -1.68 0.00 0.00 37.83 33.62 2fr8 s LYS 270 CO 0.14 -0.97 1.01 -1.25 -0.76 0.00 0.00 175.35 173.52 2fr8 s PRO 271 N -4.80 4.09 0.18 -1.68 0.04 -1.26 -4.57 135.00 126.99 2fr8 s PRO 271 Ca 0.62 1.36 -0.32 0.00 0.04 0.00 0.00 61.00 62.70 2fr8 s PRO 271 Cb -0.07 -2.33 -0.11 0.00 0.04 0.00 0.00 34.50 32.04 2fr8 s PRO 271 CO 0.40 -0.18 1.64 0.00 0.04 0.00 0.00 177.00 178.90 2fr8 s ALA 272 N -1.88 3.84 0.50 8.56 0.00 0.24 -4.55 121.76 128.47 2fr8 s ALA 272 Ca 0.61 1.45 -0.21 0.00 0.00 0.00 0.00 51.96 53.81 2fr8 s ALA 272 Cb -0.17 -3.66 -0.07 0.00 0.00 0.00 0.00 23.12 19.23 2fr8 s ALA 272 CO 0.21 -0.86 1.17 -1.25 0.00 0.00 0.00 175.76 175.03 2fr8 s PRO 273 N 1.26 3.55 -0.14 0.00 0.04 -1.26 -4.54 135.00 133.90 2fr8 s PRO 273 Ca 0.72 1.75 -0.28 0.00 0.04 0.00 0.00 61.00 63.23 2fr8 s PRO 273 Cb -0.46 -2.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.83 2fr8 s PRO 273 CO 0.32 -0.72 0.97 0.08 0.04 0.00 0.00 177.00 177.68 2fr8 s VAL 274 N -1.61 4.79 0.00 -0.36 1.01 -1.26 -4.15 120.40 118.82 2fr8 s VAL 274 Ca 0.68 1.93 0.00 0.00 0.00 0.00 0.00 61.98 64.59 2fr8 s VAL 274 Cb -0.28 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.84 2fr8 s VAL 274 CO 0.33 -0.02 0.00 0.18 0.00 0.00 0.00 175.10 175.59 2fr8 n LEU 275 N 5.28 0.00 -3.88 3.92 4.77 0.12 -4.96 117.00 122.25 2fr8 n LEU 275 Ca 0.08 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.76 2fr8 n LEU 275 Cb 0.48 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.42 2fr8 n LEU 275 CO 0.51 0.00 -0.36 -0.63 -1.33 0.00 0.00 177.39 175.58 2fr8 s ILE 276 N -1.87 1.49 0.69 -0.08 1.01 -0.99 -5.04 121.20 116.41 2fr8 s ILE 276 Ca 0.00 -1.63 -0.06 0.00 0.00 0.00 0.00 60.65 58.97 2fr8 s ILE 276 Cb 0.00 -2.01 0.06 0.00 0.01 0.00 0.00 42.46 40.53 2fr8 s ILE 276 CO 0.00 -0.48 0.99 0.42 0.00 0.00 0.00 174.94 175.87 2fr8 s THR 277 N 1.34 2.30 0.12 2.92 -4.23 -1.26 -4.20 115.64 112.63 2fr8 s THR 277 Ca 0.06 -0.31 -0.30 0.00 -1.18 0.00 0.00 61.69 59.96 2fr8 s THR 277 Cb -0.18 -2.99 -0.07 0.00 1.34 0.00 0.00 72.50 70.60 2fr8 s THR 277 CO -0.14 0.00 1.59 -0.08 -0.54 0.00 0.00 174.62 175.45 2fr8 h GLU 278 N -0.55 -0.53 0.00 3.99 4.57 -2.00 -1.11 114.58 118.96 2fr8 h GLU 278 Ca -0.44 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 57.76 2fr8 h GLU 278 Cb 1.31 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 30.02 2fr8 h GLU 278 CO 0.59 -0.35 -0.06 1.05 -1.18 0.00 0.00 179.01 179.06 2fr8 h GLU 279 N -0.55 0.00 -0.02 1.92 9.09 -2.00 0.66 114.58 123.69 2fr8 h GLU 279 Ca 0.05 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.32 2fr8 h GLU 279 Cb 0.64 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.72 2fr8 h GLU 279 CO -0.33 0.06 -0.66 0.52 0.05 0.00 0.00 179.01 178.64 2fr8 h MET 280 N 0.00 0.08 -0.13 1.06 2.86 -1.69 -3.22 114.93 113.90 2fr8 h MET 280 Ca -0.00 -0.07 -0.18 0.00 -2.06 0.00 0.00 59.70 57.39 2fr8 h MET 280 Cb 0.21 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 2fr8 h MET 280 CO 0.01 0.72 -0.67 0.28 1.06 0.00 0.00 176.91 178.31 2fr8 h VAL 281 N 0.06 1.34 0.00 -2.22 2.07 0.29 -3.22 116.25 114.58 2fr8 h VAL 281 Ca -0.01 -1.99 -0.03 0.00 0.82 0.00 0.00 66.70 65.49 2fr8 h VAL 281 Cb 1.18 1.97 -0.00 0.00 -1.52 0.00 0.00 31.29 32.92 2fr8 h VAL 281 CO 0.09 0.61 -0.13 0.71 0.02 0.00 0.00 177.57 178.88 2fr8 h THR 282 N 0.36 0.78 0.00 2.57 1.35 -1.33 -2.26 112.91 114.38 2fr8 h THR 282 Ca -0.02 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 2fr8 h THR 282 Cb 1.24 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 2fr8 h THR 282 CO 0.12 0.12 0.00 0.11 -0.25 0.00 0.00 175.52 175.62 2fr8 h LYS 283 N 0.00 0.00 -7.22 4.72 1.57 -1.57 -3.47 116.57 110.60 2fr8 h LYS 283 Ca -0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.28 2fr8 h LYS 283 Cb 0.28 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.65 2fr8 h LYS 283 CO 0.02 0.00 0.38 -1.64 -0.57 0.00 0.00 179.45 177.63 2fr8 s MET 284 N -3.39 3.29 0.36 3.15 -1.94 -0.85 -4.79 119.30 115.13 2fr8 s MET 284 Ca 0.05 1.14 -0.27 0.00 -1.71 0.00 0.00 55.69 54.89 2fr8 s MET 284 Cb 0.08 -2.03 -0.09 0.00 2.01 0.00 0.00 34.83 34.80 2fr8 s MET 284 CO 0.58 -0.82 1.20 0.15 -0.01 0.00 0.00 175.02 176.11 2fr8 s LYS 285 N -4.26 4.24 -0.08 2.03 1.02 -1.26 -4.96 119.74 116.46 2fr8 s LYS 285 Ca 0.62 1.95 -0.30 0.00 0.02 0.00 0.00 55.97 58.26 2fr8 s LYS 285 Cb -0.15 -2.88 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 2fr8 s LYS 285 CO 0.40 -0.20 1.51 -2.14 -0.92 0.00 0.00 175.35 174.00 2fr8 s PRO 286 N -2.01 4.21 0.00 -1.68 0.02 -1.26 -2.26 135.00 132.02 2fr8 s PRO 286 Ca 0.53 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.55 2fr8 s PRO 286 Cb -0.34 -3.86 0.00 0.00 0.02 0.00 0.00 34.50 30.32 2fr8 s PRO 286 CO 0.43 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 2fr8 n GLY 287 N 3.92 1.32 3.73 0.52 0.00 -0.15 -5.04 105.19 109.49 2fr8 n GLY 287 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 2fr8 n GLY 287 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fr8 s SER 288 N -1.43 4.53 0.27 1.61 1.04 -0.96 -4.71 113.70 114.06 2fr8 s SER 288 Ca 0.00 2.39 0.06 0.00 0.48 0.00 0.00 55.95 58.89 2fr8 s SER 288 Cb 0.00 -2.59 -0.06 0.00 0.10 0.00 0.00 66.02 63.47 2fr8 s SER 288 CO 0.00 -2.04 -0.06 0.68 0.98 0.00 0.00 173.24 172.80 2fr8 s VAL 289 N -1.81 1.61 -0.16 5.02 -7.23 0.46 -2.41 120.40 115.89 2fr8 s VAL 289 Ca 0.76 -2.12 -0.02 0.00 -1.81 0.00 0.00 61.98 58.78 2fr8 s VAL 289 Cb -0.30 -2.41 0.05 0.00 0.56 0.00 0.00 36.38 34.27 2fr8 s VAL 289 CO 0.41 -0.32 0.02 -0.63 -0.31 0.00 0.00 175.10 174.27 2fr8 s ILE 290 N -3.04 0.52 -0.34 -0.62 1.01 0.21 -1.83 121.20 117.11 2fr8 s ILE 290 Ca 0.29 -0.36 -0.19 0.00 0.00 0.00 0.00 60.65 60.39 2fr8 s ILE 290 Cb 0.04 -0.90 -0.00 0.00 0.01 0.00 0.00 42.46 41.60 2fr8 s ILE 290 CO 0.11 -0.05 0.55 -0.63 0.00 0.00 0.00 174.94 174.92 2fr8 s ILE 291 N 1.88 4.98 -0.53 2.92 1.09 0.64 0.43 121.20 132.60 2fr8 s ILE 291 Ca 0.01 0.45 -0.08 0.00 -1.10 0.00 0.00 60.65 59.93 2fr8 s ILE 291 Cb -0.16 -3.99 0.14 0.00 -1.06 0.00 0.00 42.46 37.39 2fr8 s ILE 291 CO -0.07 -0.22 0.39 -0.62 -0.10 0.00 0.00 174.94 174.32 2fr8 s ASP 292 N 1.75 5.69 -0.01 3.58 2.15 0.08 -1.45 116.67 128.46 2fr8 s ASP 292 Ca 0.21 -2.18 0.03 0.00 0.43 0.00 0.00 52.55 51.04 2fr8 s ASP 292 Cb -0.15 -1.99 0.11 0.00 -0.30 0.00 0.00 42.92 40.59 2fr8 s ASP 292 CO 0.13 -0.61 0.96 0.18 -0.17 0.00 0.00 175.17 175.66 2fr8 n LEU 293 N 4.53 1.00 -0.24 -1.34 4.77 -0.57 -3.32 117.00 121.82 2fr8 n LEU 293 Ca -0.02 -0.50 0.04 0.00 -0.03 0.00 0.00 56.01 55.49 2fr8 n LEU 293 Cb 0.41 -0.23 0.01 0.00 -2.33 0.00 0.00 43.42 41.28 2fr8 n LEU 293 CO 0.39 0.21 0.27 0.00 -1.33 0.00 0.00 177.39 176.94 2fr8 n ALA 294 N -0.07 2.61 -0.18 -1.18 0.00 -1.26 -4.83 120.51 115.60 2fr8 n ALA 294 Ca 0.04 -0.47 -0.05 0.00 0.00 0.00 0.00 53.44 52.96 2fr8 n ALA 294 Cb 0.20 -0.28 -0.04 0.00 0.00 0.00 0.00 19.45 19.33 2fr8 n ALA 294 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2fr8 n VAL 295 N 0.03 -0.30 0.30 0.00 0.24 -1.21 -0.63 118.33 116.77 2fr8 n VAL 295 Ca 0.04 1.39 0.18 0.00 -2.04 0.00 0.00 64.34 63.90 2fr8 n VAL 295 Cb 0.18 -1.75 0.91 0.00 -1.47 0.00 0.00 33.84 31.71 2fr8 n VAL 295 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2fr8 h GLU 296 N 0.00 0.00 -0.84 7.34 5.08 -1.90 0.33 114.58 124.59 2fr8 h GLU 296 Ca 0.07 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.85 2fr8 h GLU 296 Cb 0.18 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 29.10 2fr8 h GLU 296 CO -0.41 0.00 0.11 0.00 -1.00 0.00 0.00 179.01 177.71 2fr8 n ALA 297 N -2.03 5.61 0.00 3.43 0.00 0.20 -4.92 120.51 122.81 2fr8 n ALA 297 Ca -0.01 -3.56 0.00 0.00 0.00 0.00 0.00 53.44 49.88 2fr8 n ALA 297 Cb 0.32 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.68 2fr8 n ALA 297 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fr8 n GLY 298 N -0.86 2.92 0.00 0.00 0.00 0.09 0.83 105.19 108.16 2fr8 n GLY 298 Ca 0.53 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2fr8 n GLY 298 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fr8 n GLY 299 N 0.00 2.17 0.16 -0.02 0.00 -0.28 -4.69 105.19 102.54 2fr8 n GLY 299 Ca 0.00 -1.64 0.12 0.00 0.00 0.00 0.00 46.02 44.51 2fr8 n GLY 299 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2fr8 h ASN 300 N 0.00 0.00 -3.34 1.61 -0.26 -1.79 -3.41 115.58 108.39 2fr8 h ASN 300 Ca 0.00 -0.01 -0.67 0.00 -0.56 0.00 0.00 56.30 55.06 2fr8 h ASN 300 Cb 0.00 0.00 -0.35 0.00 -1.06 0.00 0.00 38.32 36.91 2fr8 h ASN 300 CO 0.00 0.01 -0.82 0.00 -1.06 0.00 0.00 177.43 175.55 2fr8 n PRO 302 N 4.59 0.11 -0.10 0.00 -0.04 -1.26 -2.27 135.00 136.04 2fr8 n PRO 302 Ca -0.18 0.31 0.05 0.00 -0.04 0.00 0.00 63.50 63.63 2fr8 n PRO 302 Cb 0.48 -1.70 0.17 0.00 -0.04 0.00 0.00 33.50 32.40 2fr8 n PRO 302 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2fr8 n LEU 303 N -1.92 1.14 -4.76 1.53 0.00 -1.26 -4.88 117.00 106.85 2fr8 n LEU 303 Ca 0.03 -0.55 -0.35 0.00 0.00 0.00 0.00 56.01 55.14 2fr8 n LEU 303 Cb 0.23 -0.13 -0.08 0.00 0.00 0.00 0.00 43.42 43.45 2fr8 n LEU 303 CO 0.19 0.28 -0.26 -0.94 0.00 0.00 0.00 177.39 176.66 2fr8 s SER 304 N -1.12 5.65 -0.09 1.96 1.04 -0.96 -4.99 113.70 115.19 2fr8 s SER 304 Ca 0.18 0.22 0.03 0.00 0.48 0.00 0.00 55.95 56.86 2fr8 s SER 304 Cb 0.09 -1.66 -0.01 0.00 0.10 0.00 0.00 66.02 64.54 2fr8 s SER 304 CO 0.13 0.35 -0.19 -1.61 0.98 0.00 0.00 173.24 172.90 2fr8 s GLU 305 N -1.19 2.96 0.16 4.02 2.02 -1.26 -4.96 118.70 120.45 2fr8 s GLU 305 Ca 0.17 -0.79 -0.34 0.00 0.02 0.00 0.00 54.97 54.03 2fr8 s GLU 305 Cb -0.12 -2.39 -0.15 0.00 0.10 0.00 0.00 34.13 31.57 2fr8 s GLU 305 CO 0.06 0.31 1.42 -2.30 0.02 0.00 0.00 175.26 174.77 2fr8 n PRO 306 N 3.20 1.74 -0.22 0.39 -0.02 -1.26 -2.28 135.00 136.54 2fr8 n PRO 306 Ca -0.18 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2fr8 n PRO 306 Cb 0.52 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2fr8 n PRO 306 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fr8 n GLY 307 N 2.69 1.91 3.61 -1.23 0.00 0.23 -4.98 105.19 107.43 2fr8 n GLY 307 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2fr8 n GLY 307 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fr8 s LYS 308 N -0.06 2.68 -0.81 1.61 1.02 -0.97 -4.78 119.74 118.44 2fr8 s LYS 308 Ca 0.00 -0.63 -0.18 0.00 0.02 0.00 0.00 55.97 55.18 2fr8 s LYS 308 Cb 0.00 -2.57 0.14 0.00 -0.52 0.00 0.00 37.83 34.88 2fr8 s LYS 308 CO 0.00 0.63 0.93 0.42 -0.92 0.00 0.00 175.35 176.41 2fr8 s ILE 309 N -0.95 4.94 0.39 2.17 1.01 -1.26 -2.42 121.20 125.07 2fr8 s ILE 309 Ca 0.16 -1.57 -0.21 0.00 0.00 0.00 0.00 60.65 59.02 2fr8 s ILE 309 Cb -0.11 -4.63 -0.10 0.00 0.01 0.00 0.00 42.46 37.62 2fr8 s ILE 309 CO 0.06 -1.30 0.91 -0.69 0.00 0.00 0.00 174.94 173.91 2fr8 s VAL 310 N 2.17 4.41 -0.14 2.92 1.01 -0.52 -4.88 120.40 125.36 2fr8 s VAL 310 Ca 0.23 1.46 0.01 0.00 0.00 0.00 0.00 61.98 63.69 2fr8 s VAL 310 Cb -0.11 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.60 2fr8 s VAL 310 CO -0.04 -0.19 -0.16 -0.69 0.00 0.00 0.00 175.10 174.02 2fr8 s VAL 311 N -2.02 1.66 -0.09 2.92 1.01 -1.26 0.61 120.40 123.23 2fr8 s VAL 311 Ca 0.58 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.80 2fr8 s VAL 311 Cb -0.11 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.77 2fr8 s VAL 311 CO 0.16 0.47 0.22 -0.54 0.00 0.00 0.00 175.10 175.41 2fr8 s LYS 312 N 1.31 0.21 -1.63 2.72 -0.14 -0.57 -4.90 119.74 116.75 2fr8 s LYS 312 Ca 0.02 0.41 -0.03 0.00 -1.36 0.00 0.00 55.97 55.00 2fr8 s LYS 312 Cb -0.13 -0.02 0.00 0.00 -1.68 0.00 0.00 37.83 36.00 2fr8 s LYS 312 CO -0.09 -0.10 0.42 0.72 -0.76 0.00 0.00 175.35 175.54 2fr8 n HIS 313 N 3.65 -1.65 -1.52 3.18 8.25 -1.26 -0.76 115.22 125.10 2fr8 n HIS 313 Ca -0.20 0.36 -0.13 0.00 -0.26 0.00 0.00 57.72 57.49 2fr8 n HIS 313 Cb 0.55 -4.34 -0.04 0.00 1.12 0.00 0.00 29.99 27.28 2fr8 n HIS 313 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2fr8 n GLY 314 N -1.37 1.07 3.03 -1.41 0.00 -1.26 -4.66 105.19 100.60 2fr8 n GLY 314 Ca -0.16 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.14 2fr8 n GLY 314 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fr8 s VAL 315 N -2.49 1.48 -0.24 1.61 1.01 0.06 -0.97 120.40 120.85 2fr8 s VAL 315 Ca 0.00 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 2fr8 s VAL 315 Cb 0.00 -1.38 -0.00 0.00 0.00 0.00 0.00 36.38 35.00 2fr8 s VAL 315 CO 0.00 0.44 1.25 -0.54 0.00 0.00 0.00 175.10 176.25 2fr8 s LYS 316 N 1.19 4.08 -0.64 2.72 1.02 -1.01 -1.51 119.74 125.59 2fr8 s LYS 316 Ca -0.02 1.41 -0.16 0.00 0.02 0.00 0.00 55.97 57.22 2fr8 s LYS 316 Cb -0.14 -3.81 0.15 0.00 -0.52 0.00 0.00 37.83 33.51 2fr8 s LYS 316 CO -0.05 -0.91 0.63 0.42 -0.92 0.00 0.00 175.35 174.52 2fr8 s ILE 317 N 3.90 5.25 -0.11 2.17 -1.09 0.20 0.64 121.20 132.17 2fr8 s ILE 317 Ca 0.54 -1.70 -0.23 0.00 -2.23 0.00 0.00 60.65 57.03 2fr8 s ILE 317 Cb -0.18 -4.42 -0.03 0.00 -1.58 0.00 0.00 42.46 36.25 2fr8 s ILE 317 CO 0.18 -0.98 0.72 -0.69 -1.23 0.00 0.00 174.94 172.94 2fr8 s VAL 318 N 1.40 5.01 -0.37 2.92 1.01 0.17 -1.44 120.40 129.10 2fr8 s VAL 318 Ca 0.10 1.45 0.14 0.00 0.00 0.00 0.00 61.98 63.66 2fr8 s VAL 318 Cb -0.23 -4.05 0.41 0.00 0.00 0.00 0.00 36.38 32.51 2fr8 s VAL 318 CO -0.00 0.18 0.88 0.61 0.00 0.00 0.00 175.10 176.77 2fr8 n GLY 319 N 3.28 2.93 3.67 4.51 0.00 -1.02 -0.74 105.19 117.84 2fr8 n GLY 319 Ca -0.00 -1.65 -0.39 0.00 0.00 0.00 0.00 46.02 43.98 2fr8 n GLY 319 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2fr8 n HIS 320 N 0.03 1.59 -3.89 1.61 8.25 -1.26 0.76 115.22 122.30 2fr8 n HIS 320 Ca 0.19 0.46 -0.32 0.00 -0.26 0.00 0.00 57.72 57.79 2fr8 n HIS 320 Cb 0.72 -2.26 -0.04 0.00 1.12 0.00 0.00 29.99 29.52 2fr8 n HIS 320 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2fr8 s THR 321 N -1.35 5.38 -0.76 1.59 -4.23 -1.26 -4.65 115.64 110.35 2fr8 s THR 321 Ca 0.71 -0.30 -0.02 0.00 -1.18 0.00 0.00 61.69 60.90 2fr8 s THR 321 Cb -0.45 -3.61 0.00 0.00 1.34 0.00 0.00 72.50 69.78 2fr8 s THR 321 CO 0.50 0.17 0.65 -3.20 -0.54 0.00 0.00 174.62 172.21 2fr8 n ASN 322 N 0.42 -6.30 -0.05 3.99 5.15 -1.26 -4.92 115.26 112.29 2fr8 n ASN 322 Ca -0.06 -0.49 -0.13 0.00 -0.60 0.00 0.00 54.58 53.30 2fr8 n ASN 322 Cb 0.51 -3.44 -0.07 0.00 -0.53 0.00 0.00 39.78 36.26 2fr8 n ASN 322 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 2fr8 h VAL 323 N 0.19 1.33 -0.25 3.44 2.07 -1.99 -3.07 116.25 117.99 2fr8 h VAL 323 Ca -0.33 -1.19 0.07 0.00 0.82 0.00 0.00 66.70 66.08 2fr8 h VAL 323 Cb 1.21 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.79 2fr8 h VAL 323 CO 0.33 0.35 0.27 1.55 0.02 0.00 0.00 177.57 180.08 2fr8 h PRO 324 N -0.05 0.00 0.00 1.57 0.13 -1.88 0.13 132.00 131.90 2fr8 h PRO 324 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2fr8 h PRO 324 Cb 0.59 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 2fr8 h PRO 324 CO 0.03 0.00 0.00 0.45 -0.23 0.00 0.00 178.00 178.25 2fr8 n SER 325 N -3.79 0.21 0.01 1.44 2.88 -1.16 -1.28 113.62 111.92 2fr8 n SER 325 Ca 0.03 0.56 0.13 0.00 -1.33 0.00 0.00 58.87 58.26 2fr8 n SER 325 Cb 0.41 -0.60 0.36 0.00 -0.75 0.00 0.00 64.21 63.63 2fr8 n SER 325 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2fr8 n ARG 326 N -1.74 0.03 -2.20 -1.46 1.74 0.46 -3.35 116.66 110.13 2fr8 n ARG 326 Ca 0.02 0.01 -0.25 0.00 -0.77 0.00 0.00 57.85 56.86 2fr8 n ARG 326 Cb 0.14 -1.52 0.01 0.00 -1.02 0.00 0.00 32.46 30.08 2fr8 n ARG 326 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2fr8 n VAL 327 N -1.56 2.45 -0.17 1.55 0.31 -0.40 -4.93 118.33 115.58 2fr8 n VAL 327 Ca 0.06 -4.47 0.00 0.00 -0.01 0.00 0.00 64.34 59.92 2fr8 n VAL 327 Cb 0.35 -1.16 0.25 0.00 -0.91 0.00 0.00 33.84 32.37 2fr8 n VAL 327 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2fr8 h ALA 328 N 2.34 1.42 0.00 3.52 0.00 -1.54 -0.07 119.26 124.93 2fr8 h ALA 328 Ca 0.34 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2fr8 h ALA 328 Cb 1.30 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2fr8 h ALA 328 CO 0.79 0.49 -0.07 0.00 0.00 0.00 0.00 179.25 180.45 2fr8 h ALA 329 N 1.50 1.03 0.00 0.00 0.00 -1.79 -2.36 119.26 117.65 2fr8 h ALA 329 Ca 0.24 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2fr8 h ALA 329 Cb -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2fr8 h ALA 329 CO -0.04 0.09 -2.05 -0.25 0.00 0.00 0.00 179.25 177.00 2fr8 n ASP 330 N -3.22 0.56 0.05 0.00 8.00 -0.88 -4.56 116.55 116.49 2fr8 n ASP 330 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 2fr8 n ASP 330 Cb 0.33 1.44 0.00 0.00 -0.02 0.00 0.00 41.12 42.87 2fr8 n ASP 330 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fr8 h ALA 331 N 1.36 0.52 -0.01 2.24 0.00 -0.92 -3.28 119.26 119.16 2fr8 h ALA 331 Ca -0.23 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.04 2fr8 h ALA 331 Cb 1.47 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2fr8 h ALA 331 CO 0.01 0.78 -0.00 0.77 0.00 0.00 0.00 179.25 180.81 2fr8 h SER 332 N 0.27 0.03 -0.89 0.00 0.02 -1.67 -0.66 113.55 110.64 2fr8 h SER 332 Ca -0.04 -0.33 0.10 0.00 -0.84 0.00 0.00 61.79 60.67 2fr8 h SER 332 Cb 1.39 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 63.84 2fr8 h SER 332 CO 0.14 0.35 0.54 -0.65 -1.14 0.00 0.00 176.83 176.07 2fr8 h PRO 333 N -0.30 0.86 -0.62 3.45 0.11 -1.79 0.24 132.00 133.95 2fr8 h PRO 333 Ca 0.00 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 2fr8 h PRO 333 Cb 0.34 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.23 2fr8 h PRO 333 CO 0.00 0.57 0.16 -0.07 -0.21 0.00 0.00 178.00 178.45 2fr8 h LEU 334 N 0.89 0.90 -0.23 2.35 3.38 -1.59 -0.68 115.31 120.32 2fr8 h LEU 334 Ca 0.43 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 2fr8 h LEU 334 Cb 0.38 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2fr8 h LEU 334 CO -0.24 0.87 -0.17 0.15 0.09 0.00 0.00 178.44 179.13 2fr8 h PHE 335 N 0.92 0.63 -0.38 1.13 3.57 -0.57 -0.82 116.94 121.42 2fr8 h PHE 335 Ca 0.20 -0.17 0.01 0.00 3.53 0.00 0.00 57.97 61.54 2fr8 h PHE 335 Cb 0.32 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 2fr8 h PHE 335 CO 0.02 0.84 0.23 0.00 -2.23 0.00 0.00 178.31 177.17 2fr8 h ALA 336 N 0.69 0.48 0.00 2.41 0.00 -0.41 -0.89 119.26 121.53 2fr8 h ALA 336 Ca 0.04 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2fr8 h ALA 336 Cb 0.70 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2fr8 h ALA 336 CO 0.05 -0.10 -0.32 -0.22 0.00 0.00 0.00 179.25 178.66 2fr8 h LYS 337 N 0.47 0.00 0.60 0.00 3.64 -1.12 -0.22 116.57 119.94 2fr8 h LYS 337 Ca 0.15 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 2fr8 h LYS 337 Cb -0.02 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2fr8 h LYS 337 CO -0.05 0.32 -0.29 -0.91 -2.27 0.00 0.00 179.45 176.25 2fr8 h ASN 338 N 0.00 -0.68 -0.92 4.20 -0.26 -0.80 -1.55 115.58 115.56 2fr8 h ASN 338 Ca -0.00 -0.01 0.17 0.00 -0.56 0.00 0.00 56.30 55.90 2fr8 h ASN 338 Cb 0.93 0.18 -0.08 0.00 -1.06 0.00 0.00 38.32 38.29 2fr8 h ASN 338 CO 0.04 -0.43 0.59 -0.07 -1.06 0.00 0.00 177.43 176.51 2fr8 h LEU 339 N -0.90 0.60 -0.27 1.61 4.07 -0.99 -2.34 115.31 117.09 2fr8 h LEU 339 Ca -0.08 0.05 -0.16 0.00 0.08 0.00 0.00 57.88 57.77 2fr8 h LEU 339 Cb 0.65 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.33 2fr8 h LEU 339 CO 0.14 0.27 -0.44 0.25 -1.08 0.00 0.00 178.44 177.57 2fr8 h LEU 340 N 0.62 0.85 -1.20 1.67 5.85 -0.94 -2.72 115.31 119.43 2fr8 h LEU 340 Ca 0.48 -0.52 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2fr8 h LEU 340 Cb 0.91 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 2fr8 h LEU 340 CO -0.23 1.21 0.36 0.78 -0.34 0.00 0.00 178.44 180.21 2fr8 h ASN 341 N 0.52 0.81 -0.30 1.25 2.35 -0.76 -0.96 115.58 118.49 2fr8 h ASN 341 Ca 0.02 -0.06 -0.15 0.00 -0.55 0.00 0.00 56.30 55.56 2fr8 h ASN 341 Cb 1.04 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 39.20 2fr8 h ASN 341 CO 0.10 0.66 -0.37 0.15 -1.65 0.00 0.00 177.43 176.32 2fr8 h PHE 342 N 0.91 1.00 0.09 1.19 3.57 -1.45 -3.37 116.94 118.89 2fr8 h PHE 342 Ca 0.23 -0.29 -0.15 0.00 3.53 0.00 0.00 57.97 61.29 2fr8 h PHE 342 Cb 0.03 -0.22 0.01 0.00 2.79 0.00 0.00 35.95 38.56 2fr8 h PHE 342 CO 0.01 1.08 -0.69 1.25 -2.23 0.00 0.00 178.31 177.73 2fr8 h LEU 343 N 0.70 0.28 -0.96 0.59 5.85 -1.16 -3.40 115.31 117.21 2fr8 h LEU 343 Ca 0.06 -0.92 0.24 0.00 0.84 0.00 0.00 57.88 58.10 2fr8 h LEU 343 Cb 0.94 -0.09 -0.18 0.00 0.37 0.00 0.00 40.66 41.70 2fr8 h LEU 343 CO 0.09 1.32 -0.07 0.41 -0.34 0.00 0.00 178.44 179.85 2fr8 n THR 344 N -4.26 -0.40 0.03 1.05 -1.04 -0.39 -1.09 114.28 108.17 2fr8 n THR 344 Ca -0.16 2.15 0.21 0.00 -2.04 0.00 0.00 64.05 64.21 2fr8 n THR 344 Cb 0.72 -3.08 0.73 0.00 -1.82 0.00 0.00 70.33 66.88 2fr8 n THR 344 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 2fr8 h PRO 345 N 0.00 0.00 -0.02 -2.82 0.11 -1.78 -2.86 132.00 124.62 2fr8 h PRO 345 Ca 0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.65 2fr8 h PRO 345 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2fr8 h PRO 345 CO -0.93 0.00 -0.13 0.72 -0.21 0.00 0.00 178.00 177.45 2fr8 n HIS 346 N -4.05 0.00 -3.52 0.65 8.25 -0.25 -4.87 115.22 111.42 2fr8 n HIS 346 Ca 0.09 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.17 2fr8 n HIS 346 Cb 0.64 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.64 2fr8 n HIS 346 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2fr8 s VAL 347 N -2.13 5.26 -0.29 1.59 1.01 -1.08 -1.45 120.40 123.30 2fr8 s VAL 347 Ca 0.26 0.27 -0.23 0.00 0.00 0.00 0.00 61.98 62.28 2fr8 s VAL 347 Cb 0.20 -3.60 0.18 0.00 0.00 0.00 0.00 36.38 33.16 2fr8 s VAL 347 CO 0.38 0.20 1.30 -0.62 0.00 0.00 0.00 175.10 176.36 2fr8 s ASP 348 N 1.72 -0.17 0.04 3.32 -1.08 -0.27 -4.90 116.67 115.33 2fr8 s ASP 348 Ca 0.09 0.31 0.00 0.00 -0.52 0.00 0.00 52.55 52.43 2fr8 s ASP 348 Cb -0.16 0.47 0.00 0.00 -1.46 0.00 0.00 42.92 41.77 2fr8 s ASP 348 CO 0.11 -0.05 0.00 1.17 0.52 0.00 0.00 175.17 176.92 2fr8 n LYS 349 N 2.06 0.00 -0.01 4.34 4.81 -1.26 -4.42 118.16 123.68 2fr8 n LYS 349 Ca -0.12 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.31 2fr8 n LYS 349 Cb 0.57 -0.04 -0.00 0.00 0.02 0.00 0.00 35.03 35.58 2fr8 n LYS 349 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2fr8 n ASP 350 N -2.68 2.32 -2.91 3.14 -0.08 -1.26 -4.95 116.55 110.13 2fr8 n ASP 350 Ca 0.00 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.27 2fr8 n ASP 350 Cb 0.03 -0.02 0.01 0.00 2.34 0.00 0.00 41.12 43.47 2fr8 n ASP 350 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2fr8 s THR 351 N -2.02 -0.75 -0.14 5.18 -4.23 -1.26 -5.08 115.64 107.33 2fr8 s THR 351 Ca -0.01 -0.36 0.05 0.00 -1.18 0.00 0.00 61.69 60.19 2fr8 s THR 351 Cb 0.00 0.00 0.17 0.00 1.34 0.00 0.00 72.50 74.02 2fr8 s THR 351 CO 0.02 0.00 0.96 1.17 -0.54 0.00 0.00 174.62 176.23 2fr8 n LYS 352 N 3.55 0.58 -3.62 3.99 4.81 -1.23 -3.52 118.16 122.72 2fr8 n LYS 352 Ca 0.12 -0.65 -0.03 0.00 -0.87 0.00 0.00 58.31 56.88 2fr8 n LYS 352 Cb 0.59 0.31 -0.06 0.00 0.02 0.00 0.00 35.03 35.89 2fr8 n LYS 352 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 2fr8 s THR 353 N 0.05 -0.37 -0.16 3.15 2.01 -1.26 -4.64 115.64 114.42 2fr8 s THR 353 Ca 0.04 0.00 -0.14 0.00 0.31 0.00 0.00 61.69 61.90 2fr8 s THR 353 Cb 0.19 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.65 2fr8 s THR 353 CO -0.05 0.00 0.31 -0.22 -0.69 0.00 0.00 174.62 173.96 2fr8 s LEU 354 N 2.08 4.24 -0.21 4.42 2.96 -1.26 -1.12 118.68 129.80 2fr8 s LEU 354 Ca -0.08 0.52 -0.05 0.00 -0.22 0.00 0.00 54.13 54.31 2fr8 s LEU 354 Cb -0.07 -2.40 0.07 0.00 0.50 0.00 0.00 46.19 44.29 2fr8 s LEU 354 CO -0.19 0.08 0.10 -0.69 -1.32 0.00 0.00 176.35 174.34 2fr8 s VAL 355 N 0.53 -0.09 -0.16 1.68 1.01 -0.53 -5.01 120.40 117.84 2fr8 s VAL 355 Ca 0.17 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 2fr8 s VAL 355 Cb -0.13 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2fr8 s VAL 355 CO 0.04 -0.42 1.70 -0.04 0.00 0.00 0.00 175.10 176.38 2fr8 s MET 356 N 2.13 3.87 -0.66 2.72 1.00 -1.26 -4.67 119.30 122.43 2fr8 s MET 356 Ca 0.04 1.91 -0.27 0.00 0.00 0.00 0.00 55.69 57.37 2fr8 s MET 356 Cb -0.16 -4.06 0.01 0.00 0.00 0.00 0.00 34.83 30.62 2fr8 s MET 356 CO -0.18 -1.21 1.46 0.15 0.00 0.00 0.00 175.02 175.24 2fr8 s LYS 357 N 4.62 3.08 0.52 2.03 1.02 -1.26 -4.86 119.74 124.89 2fr8 s LYS 357 Ca 0.76 0.17 0.22 0.00 0.02 0.00 0.00 55.97 57.14 2fr8 s LYS 357 Cb -0.29 -4.22 1.34 0.00 -0.52 0.00 0.00 37.83 34.14 2fr8 s LYS 357 CO 0.31 -2.23 2.04 1.25 -0.92 0.00 0.00 175.35 175.79 2fr8 h LEU 358 N 13.90 0.02 -0.72 3.17 6.46 -1.97 -0.01 115.31 136.16 2fr8 h LEU 358 Ca -0.27 0.00 0.16 0.00 -0.12 0.00 0.00 57.88 57.65 2fr8 h LEU 358 Cb 1.09 -0.00 -0.11 0.00 -0.73 0.00 0.00 40.66 40.91 2fr8 h LEU 358 CO 1.23 0.01 0.13 -0.33 -0.62 0.00 0.00 178.44 178.87 2fr8 h GLU 359 N 0.02 0.21 -6.20 1.25 3.07 -2.01 -3.37 114.58 107.56 2fr8 h GLU 359 Ca 0.18 -0.01 -0.64 0.00 -0.50 0.00 0.00 59.36 58.38 2fr8 h GLU 359 Cb 0.67 -0.05 0.01 0.00 -0.84 0.00 0.00 28.75 28.54 2fr8 h GLU 359 CO -0.01 0.14 1.13 -3.47 -1.40 0.00 0.00 179.01 175.40 2fr8 n ASP 360 N -5.20 3.10 0.23 1.42 -0.08 -0.02 -4.85 116.55 111.15 2fr8 n ASP 360 Ca 0.13 0.89 0.11 0.00 -1.51 0.00 0.00 54.79 54.41 2fr8 n ASP 360 Cb 0.44 -1.32 0.71 0.00 2.34 0.00 0.00 41.12 43.29 2fr8 n ASP 360 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2fr8 h GLU 361 N 9.55 0.00 -0.47 -0.67 4.81 -1.86 -1.76 114.58 124.18 2fr8 h GLU 361 Ca -0.45 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.69 2fr8 h GLU 361 Cb 1.28 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.65 2fr8 h GLU 361 CO 0.96 0.00 -0.07 0.00 -0.73 0.00 0.00 179.01 179.17 2fr8 h THR 362 N 0.00 1.25 0.24 0.32 1.03 -1.92 -0.89 112.91 112.94 2fr8 h THR 362 Ca 0.04 -1.12 -0.01 0.00 -0.01 0.00 0.00 66.41 65.30 2fr8 h THR 362 Cb 0.15 0.97 0.00 0.00 -1.07 0.00 0.00 68.15 68.20 2fr8 h THR 362 CO -0.00 0.39 -0.12 0.58 -0.01 0.00 0.00 175.52 176.36 2fr8 h VAL 363 N 0.75 0.57 -0.36 0.00 2.07 -1.62 -3.00 116.25 114.67 2fr8 h VAL 363 Ca 0.13 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.68 2fr8 h VAL 363 Cb 0.55 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2fr8 h VAL 363 CO 0.03 0.14 0.01 0.77 0.02 0.00 0.00 177.57 178.54 2fr8 h SER 364 N -0.94 0.52 0.99 0.57 4.64 -1.53 0.59 113.55 118.38 2fr8 h SER 364 Ca -0.03 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 2fr8 h SER 364 Cb 0.49 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2fr8 h SER 364 CO 0.06 0.58 0.00 1.23 -0.87 0.00 0.00 176.83 177.83 2fr8 h GLY 365 N 0.85 0.00 0.00 -0.77 0.00 -1.26 -3.32 103.07 98.57 2fr8 h GLY 365 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 2fr8 h GLY 365 CO 0.01 0.00 -1.28 -0.37 0.00 0.00 0.00 176.54 174.90 2fr8 n THR 366 N -2.73 0.07 -1.94 4.70 5.66 -0.90 -4.71 114.28 114.43 2fr8 n THR 366 Ca 0.02 -0.15 -0.42 0.00 -3.05 0.00 0.00 64.05 60.45 2fr8 n THR 366 Cb 0.30 0.15 -0.03 0.00 -1.55 0.00 0.00 70.33 69.20 2fr8 n THR 366 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2fr8 n VAL 368 N 3.76 0.75 -3.69 0.00 3.14 -0.21 -4.84 118.33 117.23 2fr8 n VAL 368 Ca 0.13 -0.43 -0.12 0.00 -2.96 0.00 0.00 64.34 60.96 2fr8 n VAL 368 Cb 0.39 -0.77 -0.06 0.00 -1.06 0.00 0.00 33.84 32.33 2fr8 n VAL 368 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2fr8 s THR 369 N -2.26 0.07 -0.29 1.55 -1.32 -1.19 -2.37 115.64 109.83 2fr8 s THR 369 Ca -0.08 -0.55 -0.16 0.00 -1.21 0.00 0.00 61.69 59.70 2fr8 s THR 369 Cb 0.04 -0.98 0.12 0.00 -1.51 0.00 0.00 72.50 70.16 2fr8 s THR 369 CO 0.42 -0.30 0.83 -0.60 -2.21 0.00 0.00 174.62 172.76 2fr8 s ARG 370 N -2.69 0.53 -1.42 7.08 3.52 -0.06 -1.08 118.95 124.83 2fr8 s ARG 370 Ca -0.04 0.95 -0.10 0.00 -0.13 0.00 0.00 55.73 56.41 2fr8 s ARG 370 Cb -0.00 0.16 0.04 0.00 -1.56 0.00 0.00 34.95 33.59 2fr8 s ARG 370 CO -0.04 -0.12 1.09 -0.25 -0.81 0.00 0.00 175.30 175.17 2fr8 n ASP 371 N 4.12 -5.51 -1.54 -2.12 8.00 -1.26 -1.87 116.55 116.37 2fr8 n ASP 371 Ca -0.18 -0.64 -0.12 0.00 0.71 0.00 0.00 54.79 54.55 2fr8 n ASP 371 Cb 0.58 -4.56 0.01 0.00 -0.02 0.00 0.00 41.12 37.12 2fr8 n ASP 371 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fr8 n GLY 372 N -1.85 -0.05 3.06 0.44 0.00 -1.25 -4.93 105.19 100.61 2fr8 n GLY 372 Ca 0.01 -0.34 -0.12 0.00 0.00 0.00 0.00 46.02 45.56 2fr8 n GLY 372 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fr8 s ALA 373 N -2.73 -0.57 0.36 4.61 0.00 -0.78 -4.88 121.76 117.76 2fr8 s ALA 373 Ca 0.08 1.02 -0.27 0.00 0.00 0.00 0.00 51.96 52.79 2fr8 s ALA 373 Cb -0.04 -0.65 -0.09 0.00 0.00 0.00 0.00 23.12 22.35 2fr8 s ALA 373 CO 0.10 -0.20 1.13 0.42 0.00 0.00 0.00 175.76 177.21 2fr8 s ILE 374 N 1.28 3.35 0.00 0.00 1.01 -1.26 -0.88 121.20 124.69 2fr8 s ILE 374 Ca -0.09 1.19 0.00 0.00 0.00 0.00 0.00 60.65 61.75 2fr8 s ILE 374 Cb -0.10 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.67 2fr8 s ILE 374 CO -0.09 0.16 0.44 1.33 0.00 0.00 0.00 174.94 176.78