#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h47 s GLU 0 N 0.00 1.07 0.16 1.47 2.12 -1.26 -5.03 118.70 117.23 1h47 s GLU 0 Ca 0.00 -0.39 0.09 0.00 0.36 0.00 0.00 54.97 55.03 1h47 s GLU 0 Cb 0.00 -1.00 -0.04 0.00 0.26 0.00 0.00 34.13 33.35 1h47 s GLU 0 CO 0.00 0.18 -0.20 -1.64 -0.54 0.00 0.00 175.26 173.06 1h47 s MET 1 N 0.01 1.30 -0.01 4.30 -1.94 -1.26 -0.98 119.30 120.72 1h47 s MET 1 Ca -0.01 -1.39 0.00 0.00 -1.71 0.00 0.00 55.69 52.58 1h47 s MET 1 Cb -0.08 -1.45 0.01 0.00 2.01 0.00 0.00 34.83 35.32 1h47 s MET 1 CO 0.00 0.31 -0.00 1.03 -0.01 0.00 0.00 175.02 176.35 1h47 s ARG 2 N -2.62 0.07 0.03 2.03 0.52 -0.47 -4.97 118.95 113.53 1h47 s ARG 2 Ca 0.15 0.01 0.00 0.00 -0.52 0.00 0.00 55.73 55.37 1h47 s ARG 2 Cb -0.07 -0.12 -0.04 0.00 0.52 0.00 0.00 34.95 35.24 1h47 s ARG 2 CO 0.07 -0.02 0.12 -1.50 0.02 0.00 0.00 175.30 173.99 1h47 s ILE 3 N 0.21 4.93 0.07 1.52 -1.16 -1.26 -1.02 121.20 124.49 1h47 s ILE 3 Ca -0.02 -0.45 -0.07 0.00 -0.51 0.00 0.00 60.65 59.60 1h47 s ILE 3 Cb -0.03 -3.32 -0.01 0.00 0.61 0.00 0.00 42.46 39.71 1h47 s ILE 3 CO -0.01 0.25 0.15 -0.83 -2.81 0.00 0.00 174.94 171.69 1h47 s GLY 4 N -2.08 0.14 -0.01 1.50 0.00 -0.67 -3.66 107.32 102.54 1h47 s GLY 4 Ca 0.28 -0.62 0.01 0.00 0.00 0.00 0.00 44.72 44.39 1h47 s GLY 4 CO 0.19 -0.79 -0.05 -1.58 0.00 0.00 0.00 173.10 170.88 1h47 s HIS 5 N -3.47 0.45 0.09 1.90 2.46 -1.24 -1.45 115.29 114.02 1h47 s HIS 5 Ca 0.02 -0.08 0.05 0.00 0.47 0.00 0.00 55.06 55.51 1h47 s HIS 5 Cb 0.03 -0.31 -0.03 0.00 -0.13 0.00 0.00 32.58 32.14 1h47 s HIS 5 CO -0.09 -0.02 -0.12 0.20 -2.47 0.00 0.00 174.74 172.24 1h47 s GLY 6 N -0.01 0.87 -0.11 1.59 0.00 -0.16 -3.62 107.32 105.87 1h47 s GLY 6 Ca 0.01 -1.10 -0.07 0.00 0.00 0.00 0.00 44.72 43.56 1h47 s GLY 6 CO -0.00 -1.15 0.27 -0.12 0.00 0.00 0.00 173.10 172.09 1h47 s PHE 7 N -1.85 -0.36 0.02 1.90 5.36 -1.26 -1.28 117.98 120.51 1h47 s PHE 7 Ca 0.02 0.84 -0.07 0.00 -0.96 0.00 0.00 56.93 56.75 1h47 s PHE 7 Cb -0.07 0.09 -0.00 0.00 -0.34 0.00 0.00 43.02 42.70 1h47 s PHE 7 CO 0.01 -0.23 0.13 0.34 -1.46 0.00 0.00 175.22 174.02 1h47 s ASP 8 N 1.05 0.07 -0.02 6.13 2.15 -0.57 -4.77 116.67 120.71 1h47 s ASP 8 Ca -0.07 -0.32 -0.01 0.00 0.43 0.00 0.00 52.55 52.58 1h47 s ASP 8 Cb -0.08 0.22 0.01 0.00 -0.30 0.00 0.00 42.92 42.77 1h47 s ASP 8 CO -0.07 -0.43 0.03 -0.69 -0.17 0.00 0.00 175.17 173.84 1h47 s VAL 9 N -1.87 -0.02 0.06 1.11 1.01 -1.26 -0.44 120.40 119.00 1h47 s VAL 9 Ca -0.11 0.06 0.03 0.00 0.00 0.00 0.00 61.98 61.96 1h47 s VAL 9 Cb -0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 36.38 36.24 1h47 s VAL 9 CO -0.01 0.02 -0.09 -1.00 0.00 0.00 0.00 175.10 174.03 1h47 s HIS 10 N 0.32 0.84 0.21 5.22 3.76 -0.86 -5.02 115.29 119.76 1h47 s HIS 10 Ca -0.03 -0.58 -0.16 0.00 -0.15 0.00 0.00 55.06 54.14 1h47 s HIS 10 Cb -0.04 -0.49 -0.08 0.00 1.11 0.00 0.00 32.58 33.09 1h47 s HIS 10 CO -0.01 -0.06 0.64 0.00 -0.85 0.00 0.00 174.74 174.46 1h47 s ALA 11 N -1.89 3.48 0.37 -1.40 0.00 -1.26 -1.82 121.76 119.24 1h47 s ALA 11 Ca -0.03 -0.01 -0.27 0.00 0.00 0.00 0.00 51.96 51.65 1h47 s ALA 11 Cb -0.06 -2.66 -0.09 0.00 0.00 0.00 0.00 23.12 20.30 1h47 s ALA 11 CO -0.00 0.39 1.26 -0.06 0.00 0.00 0.00 175.76 177.35 1h47 s PHE 12 N -1.58 3.01 0.00 0.00 0.08 -0.32 -0.86 117.98 118.30 1h47 s PHE 12 Ca 0.43 1.47 0.00 0.00 0.12 0.00 0.00 56.93 58.94 1h47 s PHE 12 Cb -0.15 -3.58 0.00 0.00 -0.57 0.00 0.00 43.02 38.72 1h47 s PHE 12 CO 0.20 -1.72 0.00 0.41 -0.10 0.00 0.00 175.22 174.00 1h47 n GLY 13 N 0.75 0.38 7.00 4.36 0.00 -0.28 -4.69 105.19 112.71 1h47 n GLY 13 Ca 0.02 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1h47 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h47 n GLY 14 N -0.02 0.55 3.37 -0.02 0.00 -1.26 -2.11 105.19 105.70 1h47 n GLY 14 Ca 0.00 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 1h47 n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h47 s GLU 15 N 0.00 1.36 1.11 1.61 0.41 -1.26 -3.28 118.70 118.65 1h47 s GLU 15 Ca 0.00 -1.39 -0.15 0.00 -0.41 0.00 0.00 54.97 53.01 1h47 s GLU 15 Cb 0.00 -1.63 0.17 0.00 -1.78 0.00 0.00 34.13 30.89 1h47 s GLU 15 CO 0.00 0.36 0.50 0.41 -0.49 0.00 0.00 175.26 176.04 1h47 n GLY 16 N 0.54 -2.14 3.94 -1.39 0.00 -1.20 -2.86 105.19 102.07 1h47 n GLY 16 Ca -0.15 -0.93 -0.25 0.00 0.00 0.00 0.00 46.02 44.69 1h47 n GLY 16 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h47 s PRO 17 N -3.90 2.10 0.22 1.61 0.04 -1.26 -4.84 135.00 128.96 1h47 s PRO 17 Ca 0.62 -0.38 -0.03 0.00 0.04 0.00 0.00 61.00 61.25 1h47 s PRO 17 Cb -0.19 -2.19 -0.05 0.00 0.04 0.00 0.00 34.50 32.11 1h47 s PRO 17 CO 0.65 -1.28 0.44 0.96 0.04 0.00 0.00 177.00 177.82 1h47 s ILE 18 N -3.23 5.13 -0.21 0.56 -4.36 -0.88 -4.70 121.20 113.50 1h47 s ILE 18 Ca 0.61 -0.11 -0.04 0.00 -0.26 0.00 0.00 60.65 60.85 1h47 s ILE 18 Cb -0.10 -3.70 -0.02 0.00 1.25 0.00 0.00 42.46 39.89 1h47 s ILE 18 CO 0.45 -0.16 -0.03 -0.63 0.24 0.00 0.00 174.94 174.81 1h47 s ILE 19 N -1.88 3.62 -0.04 8.37 1.01 -1.26 -0.43 121.20 130.58 1h47 s ILE 19 Ca 0.41 -0.42 0.01 0.00 0.00 0.00 0.00 60.65 60.65 1h47 s ILE 19 Cb -0.11 -2.64 0.02 0.00 0.01 0.00 0.00 42.46 39.74 1h47 s ILE 19 CO 0.28 0.43 -0.05 -0.63 0.00 0.00 0.00 174.94 174.97 1h47 s ILE 20 N 1.23 0.54 -1.48 2.92 -1.09 -0.45 -4.01 121.20 118.85 1h47 s ILE 20 Ca 0.03 -0.13 -0.14 0.00 -2.23 0.00 0.00 60.65 58.18 1h47 s ILE 20 Cb -0.14 -0.56 0.11 0.00 -1.58 0.00 0.00 42.46 40.29 1h47 s ILE 20 CO -0.00 0.22 0.68 0.61 -1.23 0.00 0.00 174.94 175.22 1h47 n GLY 21 N 4.01 -0.47 2.66 6.18 0.00 -1.26 -1.46 105.19 114.84 1h47 n GLY 21 Ca -0.25 0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1h47 n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h47 n GLY 22 N -1.31 0.63 3.45 -0.02 0.00 -1.26 -4.33 105.19 102.34 1h47 n GLY 22 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1h47 n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h47 s VAL 23 N -2.67 3.40 -0.18 1.61 1.01 -0.53 -5.02 120.40 118.01 1h47 s VAL 23 Ca 0.00 -0.55 -0.28 0.00 0.00 0.00 0.00 61.98 61.15 1h47 s VAL 23 Cb 0.00 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.94 1h47 s VAL 23 CO 0.00 0.53 0.95 -0.13 0.00 0.00 0.00 175.10 176.45 1h47 s ARG 24 N 0.12 4.31 -0.21 2.72 0.52 -1.26 -1.34 118.95 123.80 1h47 s ARG 24 Ca -0.04 1.23 0.00 0.00 -0.52 0.00 0.00 55.73 56.41 1h47 s ARG 24 Cb -0.14 -3.60 0.03 0.00 0.52 0.00 0.00 34.95 31.76 1h47 s ARG 24 CO 0.04 -0.45 -0.14 0.42 0.02 0.00 0.00 175.30 175.19 1h47 s ILE 25 N 2.55 2.40 0.00 1.52 1.01 0.43 -4.98 121.20 124.13 1h47 s ILE 25 Ca 0.43 -1.04 -0.37 0.00 0.00 0.00 0.00 60.65 59.66 1h47 s ILE 25 Cb -0.16 -2.14 -0.16 0.00 0.01 0.00 0.00 42.46 40.00 1h47 s ILE 25 CO 0.11 0.34 1.49 -2.65 0.00 0.00 0.00 174.94 174.24 1h47 n PRO 26 N 4.61 1.33 -3.69 2.79 -0.02 -1.26 -2.08 135.00 136.68 1h47 n PRO 26 Ca -0.18 0.48 -0.10 0.00 -2.02 0.00 0.00 63.50 61.68 1h47 n PRO 26 Cb 0.48 -2.16 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 1h47 n PRO 26 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1h47 s TYR 27 N 1.44 -0.12 0.42 6.00 5.04 -1.26 -4.90 117.35 123.97 1h47 s TYR 27 Ca 0.87 -0.20 0.09 0.00 -2.44 0.00 0.00 57.07 55.40 1h47 s TYR 27 Cb -0.93 0.18 0.92 0.00 0.35 0.00 0.00 41.96 42.47 1h47 s TYR 27 CO 0.50 -0.65 2.05 0.93 -1.34 0.00 0.00 175.55 177.04 1h47 h GLU 28 N 2.52 0.40 -5.87 4.97 3.07 -1.98 -3.19 114.58 114.50 1h47 h GLU 28 Ca -0.34 -0.03 -0.53 0.00 -0.50 0.00 0.00 59.36 57.95 1h47 h GLU 28 Cb 1.24 -0.08 -0.14 0.00 -0.84 0.00 0.00 28.75 28.92 1h47 h GLU 28 CO 0.49 0.30 -0.74 0.15 -1.40 0.00 0.00 179.01 177.81 1h47 s LYS 29 N -5.29 1.53 0.23 2.33 1.02 -1.26 -4.10 119.74 114.20 1h47 s LYS 29 Ca -0.07 -1.70 0.00 0.00 0.02 0.00 0.00 55.97 54.22 1h47 s LYS 29 Cb 0.17 -1.45 0.04 0.00 -0.52 0.00 0.00 37.83 36.08 1h47 s LYS 29 CO 0.72 0.24 0.31 0.41 -0.92 0.00 0.00 175.35 176.11 1h47 n GLY 30 N -0.52 0.91 3.24 -3.33 0.00 -0.90 -3.29 105.19 101.30 1h47 n GLY 30 Ca -0.06 -2.01 -0.34 0.00 0.00 0.00 0.00 46.02 43.61 1h47 n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h47 s LEU 31 N 0.00 2.80 -0.05 0.99 1.43 -1.23 -1.13 118.68 121.50 1h47 s LEU 31 Ca 0.21 -0.57 -0.30 0.00 -1.03 0.00 0.00 54.13 52.44 1h47 s LEU 31 Cb -0.01 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 1h47 s LEU 31 CO 0.14 -0.04 1.61 -0.76 0.23 0.00 0.00 176.35 177.52 1h47 s LEU 32 N 1.40 4.31 -0.03 1.79 1.43 -0.04 -4.67 118.68 122.87 1h47 s LEU 32 Ca 0.04 2.21 -0.29 0.00 -1.03 0.00 0.00 54.13 55.06 1h47 s LEU 32 Cb -0.15 -3.54 0.10 0.00 0.03 0.00 0.00 46.19 42.63 1h47 s LEU 32 CO -0.06 -0.90 0.84 0.00 0.23 0.00 0.00 176.35 176.46 1h47 s ALA 33 N 3.78 -1.81 0.29 4.21 0.00 -1.26 -4.20 121.76 122.77 1h47 s ALA 33 Ca 0.71 1.15 0.03 0.00 0.00 0.00 0.00 51.96 53.85 1h47 s ALA 33 Cb -0.33 0.11 0.43 0.00 0.00 0.00 0.00 23.12 23.33 1h47 s ALA 33 CO 0.28 -0.54 1.74 0.45 0.00 0.00 0.00 175.76 177.69 1h47 h HIS 34 N 2.33 0.54 -3.08 0.00 -0.00 -2.02 -3.44 115.15 109.48 1h47 h HIS 34 Ca -0.24 -0.11 -0.02 0.00 -0.00 0.00 0.00 60.37 60.00 1h47 h HIS 34 Cb 1.21 -0.14 0.01 0.00 -0.00 0.00 0.00 27.41 28.49 1h47 h HIS 34 CO 0.28 0.68 0.01 -1.13 -0.00 0.00 0.00 177.93 177.77 1h47 n SER 35 N -4.14 0.06 0.00 2.45 3.41 -1.26 -4.90 113.62 109.24 1h47 n SER 35 Ca -0.00 -1.05 0.06 0.00 -0.26 0.00 0.00 58.87 57.62 1h47 n SER 35 Cb 0.39 -0.04 0.34 0.00 -0.26 0.00 0.00 64.21 64.64 1h47 n SER 35 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1h47 n ASP 36 N -3.01 0.00 0.00 4.04 5.68 -1.26 -4.88 116.55 117.12 1h47 n ASP 36 Ca 0.01 -0.21 0.00 0.00 -0.50 0.00 0.00 54.79 54.09 1h47 n ASP 36 Cb 0.03 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 39.91 1h47 n ASP 36 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h47 n GLY 37 N -0.24 0.49 3.56 6.12 0.00 -1.26 -4.53 105.19 109.33 1h47 n GLY 37 Ca 0.08 -0.52 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 1h47 n GLY 37 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h47 s ASP 38 N -2.48 6.10 0.27 1.61 -1.08 -1.26 -4.81 116.67 115.03 1h47 s ASP 38 Ca 0.00 -0.99 0.07 0.00 -0.52 0.00 0.00 52.55 51.11 1h47 s ASP 38 Cb 0.00 -2.56 0.37 0.00 -1.46 0.00 0.00 42.92 39.27 1h47 s ASP 38 CO 0.00 -1.86 1.63 1.62 0.52 0.00 0.00 175.17 177.09 1h47 h VAL 39 N 6.74 1.37 -0.09 1.11 3.04 -1.93 -0.11 116.25 126.37 1h47 h VAL 39 Ca 0.06 -1.82 -0.04 0.00 -1.01 0.00 0.00 66.70 63.88 1h47 h VAL 39 Cb 1.03 1.92 -0.00 0.00 -2.01 0.00 0.00 31.29 32.22 1h47 h VAL 39 CO 1.35 0.53 -0.11 0.00 -1.01 0.00 0.00 177.57 178.33 1h47 h ALA 40 N 1.32 0.14 0.00 3.17 0.00 -1.89 -2.36 119.26 119.64 1h47 h ALA 40 Ca 0.00 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 1h47 h ALA 40 Cb 0.98 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1h47 h ALA 40 CO 0.08 -0.00 -0.57 -0.07 0.00 0.00 0.00 179.25 178.68 1h47 h LEU 41 N -0.18 0.00 0.28 0.00 3.38 -1.88 -1.67 115.31 115.24 1h47 h LEU 41 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1h47 h LEU 41 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1h47 h LEU 41 CO 0.03 0.57 -0.13 -0.74 0.09 0.00 0.00 178.44 178.25 1h47 h HIS 42 N 0.00 -0.35 -0.45 1.13 2.76 -1.05 0.92 115.15 118.11 1h47 h HIS 42 Ca -0.01 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1h47 h HIS 42 Cb 1.01 0.12 -0.03 0.00 1.55 0.00 0.00 27.41 30.06 1h47 h HIS 42 CO 0.00 -0.12 0.28 0.00 -1.30 0.00 0.00 177.93 176.79 1h47 h ALA 43 N 0.17 0.57 -0.66 5.26 0.00 -1.41 -0.76 119.26 122.44 1h47 h ALA 43 Ca -0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1h47 h ALA 43 Cb 0.38 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1h47 h ALA 43 CO 0.06 -0.01 0.40 1.25 0.00 0.00 0.00 179.25 180.95 1h47 h LEU 44 N 0.57 0.79 -0.46 0.00 5.85 -1.23 0.13 115.31 120.96 1h47 h LEU 44 Ca 0.17 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1h47 h LEU 44 Cb -0.03 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1h47 h LEU 44 CO -0.06 0.62 0.24 0.74 -0.34 0.00 0.00 178.44 179.64 1h47 h THR 45 N 0.90 1.17 -0.59 1.05 2.02 -0.34 -0.22 112.91 116.90 1h47 h THR 45 Ca 0.24 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1h47 h THR 45 Cb -0.03 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 1h47 h THR 45 CO -0.04 0.18 0.34 0.44 0.37 0.00 0.00 175.52 176.81 1h47 h ASP 46 N 0.60 0.71 -0.94 4.18 3.32 -0.48 -1.05 116.42 122.77 1h47 h ASP 46 Ca 0.16 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.15 1h47 h ASP 46 Cb 0.07 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.39 1h47 h ASP 46 CO -0.02 0.58 0.62 0.00 -1.72 0.00 0.00 179.24 178.70 1h47 h ALA 47 N 1.17 1.20 -0.19 3.45 0.00 0.09 0.40 119.26 125.37 1h47 h ALA 47 Ca 0.21 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1h47 h ALA 47 Cb 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.42 1h47 h ALA 47 CO -0.04 0.59 -0.43 -0.07 0.00 0.00 0.00 179.25 179.30 1h47 h LEU 48 N 1.27 0.70 -0.72 0.00 3.38 -0.70 -1.75 115.31 117.50 1h47 h LEU 48 Ca 0.35 -0.56 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 1h47 h LEU 48 Cb -0.14 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 1h47 h LEU 48 CO -0.08 1.13 0.27 -0.07 0.09 0.00 0.00 178.44 179.79 1h47 h LEU 49 N 0.29 1.01 -0.39 1.67 3.38 -1.05 -2.61 115.31 117.60 1h47 h LEU 49 Ca -0.00 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 57.84 1h47 h LEU 49 Cb 1.04 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.47 1h47 h LEU 49 CO 0.09 0.91 0.09 1.23 0.09 0.00 0.00 178.44 180.86 1h47 h GLY 50 N 1.04 0.47 1.46 0.83 0.00 -0.11 -0.48 103.07 106.27 1h47 h GLY 50 Ca 0.24 -0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.57 1h47 h GLY 50 CO -0.02 -0.02 0.27 0.00 0.00 0.00 0.00 176.54 176.77 1h47 h ALA 51 N 1.29 1.89 -0.01 3.60 0.00 -1.08 -1.90 119.26 123.05 1h47 h ALA 51 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1h47 h ALA 51 Cb 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1h47 h ALA 51 CO -0.23 0.05 -0.19 0.00 0.00 0.00 0.00 179.25 178.87 1h47 n ALA 52 N -2.51 2.93 -3.85 0.00 0.00 -0.72 -4.64 120.51 111.72 1h47 n ALA 52 Ca 0.05 -0.33 -0.25 0.00 0.00 0.00 0.00 53.44 52.90 1h47 n ALA 52 Cb 0.19 -1.23 0.01 0.00 0.00 0.00 0.00 19.45 18.41 1h47 n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h47 n ALA 53 N -0.86 -1.82 -0.49 0.00 0.00 -0.49 -4.90 120.51 111.94 1h47 n ALA 53 Ca 0.13 -0.12 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1h47 n ALA 53 Cb 0.31 -2.39 0.17 0.00 0.00 0.00 0.00 19.45 17.54 1h47 n ALA 53 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1h47 n LEU 54 N -4.40 3.06 0.00 0.00 4.77 -0.31 -5.03 117.00 115.09 1h47 n LEU 54 Ca -0.21 -2.42 0.00 0.00 -0.03 0.00 0.00 56.01 53.34 1h47 n LEU 54 Cb 0.64 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1h47 n LEU 54 CO 0.73 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 178.08 1h47 n GLY 55 N -0.13 1.30 3.83 -0.72 0.00 -1.25 -4.75 105.19 103.47 1h47 n GLY 55 Ca 0.13 -0.59 -0.06 0.00 0.00 0.00 0.00 46.02 45.50 1h47 n GLY 55 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1h47 s ASP 56 N -4.00 -0.07 0.32 1.61 1.47 -1.26 -4.13 116.67 110.60 1h47 s ASP 56 Ca 0.00 -0.83 0.07 0.00 1.18 0.00 0.00 52.55 52.97 1h47 s ASP 56 Cb 0.00 0.70 0.77 0.00 -0.34 0.00 0.00 42.92 44.05 1h47 s ASP 56 CO 0.00 -1.36 1.80 0.16 0.68 0.00 0.00 175.17 176.45 1h47 h ILE 57 N 2.00 0.73 -0.61 2.11 -0.00 -1.91 -1.46 117.51 118.37 1h47 h ILE 57 Ca -0.27 -0.25 -0.06 0.00 -0.00 0.00 0.00 64.86 64.27 1h47 h ILE 57 Cb 1.24 -0.07 -0.03 0.00 -0.00 0.00 0.00 36.82 37.96 1h47 h ILE 57 CO 0.34 0.14 0.14 1.23 -0.00 0.00 0.00 178.15 179.99 1h47 h GLY 58 N 0.74 1.02 0.99 0.16 0.00 -1.96 0.19 103.07 104.21 1h47 h GLY 58 Ca 0.55 -0.62 -0.10 0.00 0.00 0.00 0.00 47.33 47.17 1h47 h GLY 58 CO -0.33 0.58 -0.12 1.70 0.00 0.00 0.00 176.54 178.36 1h47 h LYS 59 N 0.91 0.79 -0.06 4.80 3.64 -1.64 -2.71 116.57 122.30 1h47 h LYS 59 Ca 0.19 -0.32 -0.17 0.00 -1.27 0.00 0.00 60.65 59.09 1h47 h LYS 59 Cb 0.34 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1h47 h LYS 59 CO 0.00 0.93 -0.70 -0.07 -2.27 0.00 0.00 179.45 177.35 1h47 h LEU 60 N 0.60 0.34 -6.20 5.20 4.07 -0.93 -3.37 115.31 115.02 1h47 h LEU 60 Ca 0.10 -0.22 -0.59 0.00 0.08 0.00 0.00 57.88 57.25 1h47 h LEU 60 Cb 0.66 -0.10 -0.41 0.00 1.08 0.00 0.00 40.66 41.89 1h47 h LEU 60 CO 0.04 0.93 -0.80 0.49 -1.08 0.00 0.00 178.44 178.02 1h47 n PHE 61 N -3.82 1.89 -0.80 1.13 3.72 0.01 -5.08 117.46 114.51 1h47 n PHE 61 Ca -0.03 -3.90 -0.32 0.00 -0.05 0.00 0.00 57.45 53.14 1h47 n PHE 61 Cb 0.68 -0.44 0.14 0.00 -0.94 0.00 0.00 39.48 38.92 1h47 n PHE 61 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1h47 n PRO 62 N 1.25 -0.29 -0.18 -1.08 -0.02 -1.02 -4.64 135.00 129.03 1h47 n PRO 62 Ca 0.26 -0.03 -0.02 0.00 -2.02 0.00 0.00 63.50 61.69 1h47 n PRO 62 Cb 0.45 -2.09 0.08 0.00 -0.02 0.00 0.00 33.50 31.92 1h47 n PRO 62 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1h47 h ASP 63 N -1.57 0.20 -0.54 2.55 1.82 -1.98 -2.78 116.42 114.11 1h47 h ASP 63 Ca -0.44 0.07 0.00 0.00 -0.39 0.00 0.00 57.03 56.27 1h47 h ASP 63 Cb 1.28 0.05 0.00 0.00 0.68 0.00 0.00 39.33 41.34 1h47 h ASP 63 CO 0.38 0.14 0.00 1.07 -1.61 0.00 0.00 179.24 179.21 1h47 n THR 64 N -5.00 1.48 -3.07 2.25 5.66 -1.26 -4.79 114.28 109.55 1h47 n THR 64 Ca 0.06 -0.96 -0.42 0.00 -3.05 0.00 0.00 64.05 59.68 1h47 n THR 64 Cb 0.22 0.06 -0.06 0.00 -1.55 0.00 0.00 70.33 69.00 1h47 n THR 64 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1h47 s ASP 65 N -0.83 6.42 0.47 1.09 -1.08 -1.05 -4.93 116.67 116.76 1h47 s ASP 65 Ca 0.42 0.04 0.22 0.00 -0.52 0.00 0.00 52.55 52.71 1h47 s ASP 65 Cb 0.27 -2.34 1.18 0.00 -1.46 0.00 0.00 42.92 40.56 1h47 s ASP 65 CO 0.21 -0.69 1.99 1.55 0.52 0.00 0.00 175.17 178.74 1h47 h PRO 66 N 8.62 0.00 -0.62 4.34 0.13 -1.88 -3.36 132.00 139.23 1h47 h PRO 66 Ca -0.26 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.99 1h47 h PRO 66 Cb 1.10 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.11 1h47 h PRO 66 CO 0.87 0.19 -0.25 0.00 -0.23 0.00 0.00 178.00 178.59 1h47 h ALA 67 N 1.81 0.21 -0.52 -0.56 0.00 -1.95 -1.35 119.26 116.89 1h47 h ALA 67 Ca -0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1h47 h ALA 67 Cb 0.43 0.63 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1h47 h ALA 67 CO 0.02 -0.54 0.00 1.19 0.00 0.00 0.00 179.25 179.92 1h47 n PHE 68 N -5.45 0.81 -1.70 0.00 3.72 -1.26 -4.93 117.46 108.66 1h47 n PHE 68 Ca 0.06 -0.54 -0.43 0.00 -0.05 0.00 0.00 57.45 56.49 1h47 n PHE 68 Cb 0.35 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.79 1h47 n PHE 68 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1h47 n LYS 69 N 0.94 2.59 0.00 -1.08 4.01 -0.51 -1.73 118.16 122.37 1h47 n LYS 69 Ca 0.19 0.93 0.00 0.00 -0.51 0.00 0.00 58.31 58.92 1h47 n LYS 69 Cb 0.59 -2.77 0.00 0.00 -0.51 0.00 0.00 35.03 32.34 1h47 n LYS 69 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1h47 n GLY 70 N 3.88 2.51 3.76 0.72 0.00 -1.26 -5.03 105.19 109.77 1h47 n GLY 70 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1h47 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h47 s ALA 71 N -2.19 3.66 0.90 4.61 0.00 -0.71 -5.01 121.76 123.03 1h47 s ALA 71 Ca 0.00 1.57 -0.12 0.00 0.00 0.00 0.00 51.96 53.41 1h47 s ALA 71 Cb 0.00 -3.63 0.13 0.00 0.00 0.00 0.00 23.12 19.63 1h47 s ALA 71 CO 0.00 -1.02 1.13 0.16 0.00 0.00 0.00 175.76 176.03 1h47 s ASP 72 N 0.18 3.56 0.45 0.00 1.47 -1.26 -4.71 116.67 116.36 1h47 s ASP 72 Ca 0.58 1.01 0.25 0.00 1.18 0.00 0.00 52.55 55.58 1h47 s ASP 72 Cb -0.47 -1.61 0.92 0.00 -0.34 0.00 0.00 42.92 41.42 1h47 s ASP 72 CO 0.55 -2.52 1.82 0.28 0.68 0.00 0.00 175.17 175.98 1h47 h SER 73 N -1.48 0.00 0.33 2.11 0.02 -1.96 -2.16 113.55 110.41 1h47 h SER 73 Ca -0.50 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.32 1h47 h SER 73 Cb 1.33 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 1h47 h SER 73 CO 0.61 0.18 -0.53 0.03 -1.14 0.00 0.00 176.83 175.99 1h47 h ARG 74 N 0.00 0.22 -0.29 3.45 3.08 -1.97 -0.16 114.38 118.71 1h47 h ARG 74 Ca -0.00 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.85 1h47 h ARG 74 Cb 0.75 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1h47 h ARG 74 CO 0.02 0.69 -0.07 0.93 -1.07 0.00 0.00 179.97 180.47 1h47 h GLU 75 N 0.17 0.56 -0.55 0.04 5.08 -1.77 -0.95 114.58 117.16 1h47 h GLU 75 Ca 0.00 -0.22 -0.07 0.00 -1.00 0.00 0.00 59.36 58.08 1h47 h GLU 75 Cb 0.98 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 1h47 h GLU 75 CO 0.08 0.76 0.08 -0.07 -1.00 0.00 0.00 179.01 178.86 1h47 h LEU 76 N 0.32 0.88 -0.16 1.33 3.38 -1.33 -1.22 115.31 118.51 1h47 h LEU 76 Ca 0.07 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.81 1h47 h LEU 76 Cb 0.55 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1h47 h LEU 76 CO 0.03 0.92 -0.02 0.25 0.09 0.00 0.00 178.44 179.71 1h47 h LEU 77 N 0.81 -0.10 -1.32 1.67 5.85 -0.94 0.49 115.31 121.77 1h47 h LEU 77 Ca 0.17 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 1h47 h LEU 77 Cb 0.42 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1h47 h LEU 77 CO 0.01 -0.03 -0.34 0.03 -0.34 0.00 0.00 178.44 177.77 1h47 h ARG 78 N 0.03 0.00 0.14 1.25 3.08 -0.99 -0.68 114.38 117.21 1h47 h ARG 78 Ca 0.08 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.86 1h47 h ARG 78 Cb 0.11 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.18 1h47 h ARG 78 CO -0.15 0.34 -1.13 1.49 -1.07 0.00 0.00 179.97 179.46 1h47 h GLU 79 N 0.00 0.52 -0.30 0.04 4.57 -0.95 -0.61 114.58 117.85 1h47 h GLU 79 Ca -0.00 -0.74 0.03 0.00 -1.18 0.00 0.00 59.36 57.46 1h47 h GLU 79 Cb 0.61 0.26 -0.03 0.00 -0.16 0.00 0.00 28.75 29.42 1h47 h GLU 79 CO 0.04 1.33 0.11 0.00 -1.18 0.00 0.00 179.01 179.32 1h47 h ALA 80 N 0.22 0.34 -0.92 2.92 0.00 -0.79 -1.89 119.26 119.14 1h47 h ALA 80 Ca -0.18 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1h47 h ALA 80 Cb 1.84 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 1h47 h ALA 80 CO 0.21 -0.29 0.58 2.35 0.00 0.00 0.00 179.25 182.10 1h47 h TRP 81 N 0.25 1.20 -0.34 0.00 -0.00 -1.11 0.65 115.95 116.59 1h47 h TRP 81 Ca 0.13 0.01 0.02 0.00 -0.00 0.00 0.00 58.89 59.05 1h47 h TRP 81 Cb 0.09 -0.40 -0.03 0.00 -0.00 0.00 0.00 29.16 28.83 1h47 h TRP 81 CO -0.13 0.78 0.18 -0.09 -0.00 0.00 0.00 178.44 179.18 1h47 h ARG 82 N 1.27 0.35 -0.32 2.65 2.43 -0.66 -0.18 114.38 119.92 1h47 h ARG 82 Ca 0.33 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.40 1h47 h ARG 82 Cb -0.08 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.37 1h47 h ARG 82 CO -0.07 0.23 -0.16 0.00 -1.51 0.00 0.00 179.97 178.46 1h47 h ARG 83 N 0.36 0.57 -0.31 0.20 3.08 -0.56 -0.90 114.38 116.83 1h47 h ARG 83 Ca 0.14 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1h47 h ARG 83 Cb 0.04 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1h47 h ARG 83 CO -0.09 0.72 0.11 0.82 -1.07 0.00 0.00 179.97 180.46 1h47 h ILE 84 N 0.52 1.19 -0.09 2.04 2.04 -0.56 -2.90 117.51 119.76 1h47 h ILE 84 Ca 0.09 -0.60 -0.09 0.00 1.00 0.00 0.00 64.86 65.26 1h47 h ILE 84 Cb 0.58 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1h47 h ILE 84 CO 0.04 0.20 -0.33 1.56 0.00 0.00 0.00 178.15 179.62 1h47 h GLN 85 N 0.34 0.17 -0.05 2.37 4.20 -0.54 -2.05 115.11 119.54 1h47 h GLN 85 Ca 0.10 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.76 1h47 h GLN 85 Cb 0.21 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 1h47 h GLN 85 CO -0.01 0.49 0.13 0.00 -0.67 0.00 0.00 178.83 178.78 1h47 h ALA 86 N 1.51 1.36 -0.31 3.87 0.00 -0.97 0.11 119.26 124.83 1h47 h ALA 86 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1h47 h ALA 86 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1h47 h ALA 86 CO 0.05 -0.16 0.00 1.63 0.00 0.00 0.00 179.25 180.77 1h47 n LYS 87 N -3.32 1.74 -0.33 0.00 5.02 -0.77 -4.96 118.16 115.54 1h47 n LYS 87 Ca -0.01 -1.15 0.00 0.00 -2.02 0.00 0.00 58.31 55.13 1h47 n LYS 87 Cb 0.21 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 1h47 n LYS 87 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h47 n GLY 88 N 1.02 0.68 3.85 0.72 0.00 0.02 -5.08 105.19 106.41 1h47 n GLY 88 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1h47 n GLY 88 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h47 s TYR 89 N -2.66 3.53 0.33 1.61 2.02 -1.23 -4.68 117.35 116.26 1h47 s TYR 89 Ca 0.00 1.12 0.05 0.00 -0.37 0.00 0.00 57.07 57.87 1h47 s TYR 89 Cb 0.00 -2.43 -0.06 0.00 -0.40 0.00 0.00 41.96 39.07 1h47 s TYR 89 CO 0.00 0.31 0.03 0.95 -1.57 0.00 0.00 175.55 175.26 1h47 s THR 90 N -1.66 1.40 -0.02 -0.71 -4.23 -0.75 -4.29 115.64 105.38 1h47 s THR 90 Ca 0.44 -2.02 -0.29 0.00 -1.18 0.00 0.00 61.69 58.63 1h47 s THR 90 Cb -0.14 -2.75 -0.03 0.00 1.34 0.00 0.00 72.50 70.93 1h47 s THR 90 CO 0.20 -0.07 0.96 -0.22 -0.54 0.00 0.00 174.62 174.95 1h47 s LEU 91 N -3.51 4.35 0.00 4.79 2.96 -1.26 -0.57 118.68 125.43 1h47 s LEU 91 Ca 0.35 1.60 0.00 0.00 -0.22 0.00 0.00 54.13 55.86 1h47 s LEU 91 Cb 0.08 -3.52 0.00 0.00 0.50 0.00 0.00 46.19 43.25 1h47 s LEU 91 CO 0.15 -0.27 0.00 0.61 -1.32 0.00 0.00 176.35 175.52 1h47 n GLY 92 N 2.95 0.83 3.69 7.98 0.00 -0.25 -4.74 105.19 115.65 1h47 n GLY 92 Ca 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1h47 n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h47 s ASN 93 N -1.54 -0.27 0.05 1.61 4.22 -1.01 -4.87 114.94 113.12 1h47 s ASN 93 Ca 0.00 -0.33 0.00 0.00 -2.14 0.00 0.00 52.86 50.39 1h47 s ASN 93 Cb 0.00 0.54 -0.03 0.00 1.28 0.00 0.00 41.25 43.03 1h47 s ASN 93 CO 0.00 -0.96 -0.05 0.68 -2.04 0.00 0.00 177.10 174.74 1h47 s VAL 94 N -3.45 0.34 -0.06 3.54 -7.23 -0.21 -1.40 120.40 111.94 1h47 s VAL 94 Ca 0.09 -1.44 -0.03 0.00 -1.81 0.00 0.00 61.98 58.79 1h47 s VAL 94 Cb -0.02 -1.02 0.03 0.00 0.56 0.00 0.00 36.38 35.92 1h47 s VAL 94 CO -0.00 -0.72 0.14 -0.62 -0.31 0.00 0.00 175.10 173.58 1h47 s ASP 95 N -2.28 -0.11 0.00 4.85 2.15 -0.69 -1.94 116.67 118.65 1h47 s ASP 95 Ca -0.02 0.28 0.05 0.00 0.43 0.00 0.00 52.55 53.29 1h47 s ASP 95 Cb -0.01 0.20 -0.02 0.00 -0.30 0.00 0.00 42.92 42.79 1h47 s ASP 95 CO -0.04 -0.12 -0.17 -0.69 -0.17 0.00 0.00 175.17 173.98 1h47 s VAL 96 N 0.84 1.32 -0.24 1.11 1.01 -0.66 -1.15 120.40 122.63 1h47 s VAL 96 Ca -0.06 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1h47 s VAL 96 Cb -0.08 -1.11 0.08 0.00 0.00 0.00 0.00 36.38 35.26 1h47 s VAL 96 CO -0.04 0.30 0.07 -0.89 0.00 0.00 0.00 175.10 174.54 1h47 s THR 97 N -0.49 0.50 -0.02 3.92 2.01 0.59 -0.55 115.64 121.59 1h47 s THR 97 Ca 0.06 -0.81 -0.21 0.00 0.31 0.00 0.00 61.69 61.03 1h47 s THR 97 Cb -0.07 -1.18 -0.05 0.00 0.01 0.00 0.00 72.50 71.21 1h47 s THR 97 CO -0.00 -0.43 0.62 -0.63 -0.69 0.00 0.00 174.62 173.49 1h47 s ILE 98 N 1.84 4.94 -0.34 1.82 -1.09 0.47 -1.05 121.20 127.79 1h47 s ILE 98 Ca 0.04 1.30 0.01 0.00 -2.23 0.00 0.00 60.65 59.77 1h47 s ILE 98 Cb -0.17 -3.96 0.09 0.00 -1.58 0.00 0.00 42.46 36.84 1h47 s ILE 98 CO -0.18 0.37 0.07 -0.63 -1.23 0.00 0.00 174.94 173.34 1h47 s ILE 99 N 0.08 2.62 -0.20 2.92 1.01 -0.05 -1.09 121.20 126.48 1h47 s ILE 99 Ca 0.33 -2.07 -0.13 0.00 0.00 0.00 0.00 60.65 58.78 1h47 s ILE 99 Cb -0.18 -2.80 0.06 0.00 0.01 0.00 0.00 42.46 39.56 1h47 s ILE 99 CO 0.17 -0.49 0.50 0.00 0.00 0.00 0.00 174.94 175.12 1h47 s ALA 100 N 1.03 -1.30 0.24 9.38 0.00 -0.66 -1.59 121.76 128.87 1h47 s ALA 100 Ca 0.06 1.73 -0.01 0.00 0.00 0.00 0.00 51.96 53.73 1h47 s ALA 100 Cb -0.20 -1.03 0.28 0.00 0.00 0.00 0.00 23.12 22.17 1h47 s ALA 100 CO -0.06 -0.29 1.65 0.37 0.00 0.00 0.00 175.76 177.44 1h47 h GLN 101 N 6.69 0.60 -2.53 0.00 5.75 -1.82 -3.31 115.11 120.50 1h47 h GLN 101 Ca -0.33 -0.25 0.05 0.00 -0.15 0.00 0.00 58.65 57.97 1h47 h GLN 101 Cb 1.19 -0.02 -0.14 0.00 1.07 0.00 0.00 27.48 29.58 1h47 h GLN 101 CO 0.24 0.82 0.37 0.00 -2.65 0.00 0.00 178.83 177.61 1h47 s ALA 102 N -4.46 -1.74 1.14 3.38 0.00 -1.26 -4.81 121.76 114.01 1h47 s ALA 102 Ca -0.08 0.84 -0.18 0.00 0.00 0.00 0.00 51.96 52.54 1h47 s ALA 102 Cb 0.13 0.54 0.26 0.00 0.00 0.00 0.00 23.12 24.06 1h47 s ALA 102 CO 0.81 -0.69 1.16 -1.25 0.00 0.00 0.00 175.76 175.79 1h47 s PRO 103 N -3.22 -0.76 0.10 0.00 0.04 -1.26 -5.00 135.00 124.90 1h47 s PRO 103 Ca 0.03 -0.15 -0.31 0.00 0.04 0.00 0.00 61.00 60.61 1h47 s PRO 103 Cb -0.01 -1.66 -0.08 0.00 0.04 0.00 0.00 34.50 32.80 1h47 s PRO 103 CO -0.09 -3.39 1.40 0.21 0.04 0.00 0.00 177.00 175.17 1h47 s LYS 104 N -5.52 4.31 -0.21 4.56 2.47 -1.26 -4.93 119.74 119.16 1h47 s LYS 104 Ca 0.72 2.07 0.13 0.00 -1.56 0.00 0.00 55.97 57.32 1h47 s LYS 104 Cb -0.08 -3.30 -0.22 0.00 -1.46 0.00 0.00 37.83 32.76 1h47 s LYS 104 CO 0.55 -0.47 -0.02 -1.33 0.16 0.00 0.00 175.35 174.24 1h47 n MET 105 N 4.20 0.74 -0.36 4.03 2.81 -1.26 -4.68 117.12 122.61 1h47 n MET 105 Ca 0.12 0.04 0.04 0.00 -1.81 0.00 0.00 57.70 56.09 1h47 n MET 105 Cb 0.42 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.62 1h47 n MET 105 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1h47 h LEU 106 N 0.00 0.96 -2.07 4.03 5.85 -1.98 0.14 115.31 122.23 1h47 h LEU 106 Ca -0.54 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.26 1h47 h LEU 106 Cb 2.11 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.96 1h47 h LEU 106 CO -0.01 0.57 0.15 -0.65 -0.34 0.00 0.00 178.44 178.16 1h47 h PRO 107 N 1.07 0.00 -0.01 5.25 0.11 -2.02 -2.32 132.00 134.07 1h47 h PRO 107 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 1h47 h PRO 107 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1h47 h PRO 107 CO -0.21 0.00 -0.46 0.72 -0.21 0.00 0.00 178.00 177.84 1h47 n HIS 108 N -4.33 0.00 -0.03 0.65 8.25 0.41 -4.58 115.22 115.59 1h47 n HIS 108 Ca 0.02 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.37 1h47 n HIS 108 Cb 0.28 -0.05 -0.05 0.00 1.12 0.00 0.00 29.99 31.30 1h47 n HIS 108 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1h47 h ILE 109 N 1.74 1.12 -0.79 1.59 2.04 -0.78 -2.54 117.51 119.88 1h47 h ILE 109 Ca 0.00 -0.34 0.18 0.00 1.00 0.00 0.00 64.86 65.70 1h47 h ILE 109 Cb 0.65 1.08 -0.12 0.00 -0.74 0.00 0.00 36.82 37.68 1h47 h ILE 109 CO 0.00 0.11 0.20 -0.65 0.00 0.00 0.00 178.15 177.81 1h47 h PRO 110 N 0.12 0.25 -0.41 2.37 0.11 -1.81 -1.14 132.00 131.50 1h47 h PRO 110 Ca 0.05 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.03 1h47 h PRO 110 Cb 0.11 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1h47 h PRO 110 CO -0.01 0.17 -0.22 0.37 -0.21 0.00 0.00 178.00 178.10 1h47 h GLN 111 N 0.26 0.87 -0.67 1.05 5.75 -1.85 -2.32 115.11 118.20 1h47 h GLN 111 Ca 0.46 -0.39 0.12 0.00 -0.15 0.00 0.00 58.65 58.70 1h47 h GLN 111 Cb 0.84 -0.02 -0.09 0.00 1.07 0.00 0.00 27.48 29.28 1h47 h GLN 111 CO -0.56 1.03 0.21 0.52 -2.65 0.00 0.00 178.83 177.38 1h47 h MET 112 N 0.68 0.35 -0.44 1.69 2.86 -0.82 -1.49 114.93 117.77 1h47 h MET 112 Ca 0.09 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.61 1h47 h MET 112 Cb 0.78 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 1h47 h MET 112 CO 0.06 0.23 -0.14 0.00 1.06 0.00 0.00 176.91 178.13 1h47 h ARG 113 N 0.36 0.81 0.12 1.72 3.08 -0.82 -0.80 114.38 118.84 1h47 h ARG 113 Ca 0.35 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 1h47 h ARG 113 Cb 0.52 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1h47 h ARG 113 CO -0.39 0.90 -0.08 0.28 -1.07 0.00 0.00 179.97 179.61 1h47 h VAL 114 N 0.72 0.82 -0.90 2.04 2.07 -0.94 -0.26 116.25 119.80 1h47 h VAL 114 Ca 0.12 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.64 1h47 h VAL 114 Cb 0.64 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 1h47 h VAL 114 CO 0.04 0.00 0.59 -0.26 0.02 0.00 0.00 177.57 177.97 1h47 h PHE 115 N -0.21 1.13 -0.05 1.57 0.04 -0.96 -1.00 116.94 117.46 1h47 h PHE 115 Ca -0.01 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 1h47 h PHE 115 Cb 0.18 -0.38 -0.00 0.00 2.20 0.00 0.00 35.95 37.95 1h47 h PHE 115 CO -0.09 0.71 -0.01 0.82 -0.60 0.00 0.00 178.31 179.14 1h47 h ILE 116 N 1.22 1.28 -0.95 -0.55 2.04 -1.04 -0.09 117.51 119.42 1h47 h ILE 116 Ca 0.33 -0.87 0.06 0.00 1.00 0.00 0.00 64.86 65.38 1h47 h ILE 116 Cb -0.14 1.77 -0.06 0.00 -0.74 0.00 0.00 36.82 37.65 1h47 h ILE 116 CO -0.07 0.23 0.62 0.00 0.00 0.00 0.00 178.15 178.93 1h47 h ALA 117 N 0.67 1.46 -0.26 1.87 0.00 -0.88 -0.48 119.26 121.64 1h47 h ALA 117 Ca 0.01 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1h47 h ALA 117 Cb 0.38 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1h47 h ALA 117 CO 0.00 0.41 -0.29 0.93 0.00 0.00 0.00 179.25 180.30 1h47 h GLU 118 N 1.11 0.66 -0.04 0.00 5.08 -1.07 0.85 114.58 121.16 1h47 h GLU 118 Ca 0.41 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1h47 h GLU 118 Cb 0.17 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1h47 h GLU 118 CO -0.15 0.97 0.04 -0.44 -1.00 0.00 0.00 179.01 178.43 1h47 h ASP 119 N 0.39 0.00 -0.01 1.42 3.32 -0.44 -2.77 116.42 118.33 1h47 h ASP 119 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1h47 h ASP 119 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1h47 h ASP 119 CO 0.07 0.00 -0.13 0.18 -1.72 0.00 0.00 179.24 177.64 1h47 n LEU 120 N -4.14 1.84 -2.61 1.55 4.77 -0.24 -4.71 117.00 113.46 1h47 n LEU 120 Ca -0.02 -0.89 -0.19 0.00 -0.03 0.00 0.00 56.01 54.87 1h47 n LEU 120 Cb 0.14 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.26 1h47 n LEU 120 CO 0.30 0.34 -0.01 0.61 -1.33 0.00 0.00 177.39 177.31 1h47 n GLY 121 N 0.91 -0.36 3.78 -0.72 0.00 0.14 -4.95 105.19 103.99 1h47 n GLY 121 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1h47 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h47 s HIS 123 N -2.88 3.06 0.31 0.00 3.76 -1.26 -4.55 115.29 113.73 1h47 s HIS 123 Ca 0.07 1.53 0.05 0.00 -0.15 0.00 0.00 55.06 56.56 1h47 s HIS 123 Cb 0.01 -2.99 0.70 0.00 1.11 0.00 0.00 32.58 31.40 1h47 s HIS 123 CO 0.04 -0.91 1.82 0.52 -0.85 0.00 0.00 174.74 175.36 1h47 h MET 124 N 0.87 0.80 0.00 1.40 0.00 -1.93 -1.99 114.93 114.07 1h47 h MET 124 Ca -0.48 -0.05 0.00 0.00 0.00 0.00 0.00 59.70 59.18 1h47 h MET 124 Cb 1.21 -0.18 0.00 0.00 0.00 0.00 0.00 31.60 32.63 1h47 h MET 124 CO 0.58 0.53 0.00 -3.47 0.00 0.00 0.00 176.91 174.56 1h47 n ASP 125 N -4.66 0.14 -0.79 1.22 -0.08 -1.26 -1.54 116.55 109.58 1h47 n ASP 125 Ca 0.21 0.54 0.13 0.00 -1.51 0.00 0.00 54.79 54.16 1h47 n ASP 125 Cb 0.48 -0.57 0.28 0.00 2.34 0.00 0.00 41.12 43.65 1h47 n ASP 125 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1h47 n ASP 126 N -1.67 2.44 -4.03 1.67 8.00 -0.75 -4.86 116.55 117.35 1h47 n ASP 126 Ca 0.02 -1.81 -0.29 0.00 0.71 0.00 0.00 54.79 53.43 1h47 n ASP 126 Cb 0.13 -0.04 -0.17 0.00 -0.02 0.00 0.00 41.12 41.03 1h47 n ASP 126 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h47 s VAL 127 N -1.93 1.48 -0.01 2.53 1.01 -0.59 -1.04 120.40 121.85 1h47 s VAL 127 Ca 0.33 -0.60 0.08 0.00 0.00 0.00 0.00 61.98 61.78 1h47 s VAL 127 Cb 0.20 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1h47 s VAL 127 CO 0.31 0.44 -0.24 0.21 0.00 0.00 0.00 175.10 175.82 1h47 s ASN 128 N 1.22 2.83 -0.03 3.32 2.47 -0.82 -4.97 114.94 118.96 1h47 s ASN 128 Ca -0.02 -0.46 0.02 0.00 0.42 0.00 0.00 52.86 52.82 1h47 s ASN 128 Cb -0.14 -0.30 0.01 0.00 -1.45 0.00 0.00 41.25 39.36 1h47 s ASN 128 CO -0.05 0.28 -0.06 -0.69 -3.72 0.00 0.00 177.10 172.85 1h47 s VAL 129 N -0.60 0.60 0.31 -5.21 1.01 -1.26 -1.65 120.40 113.60 1h47 s VAL 129 Ca 0.09 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1h47 s VAL 129 Cb -0.09 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 1h47 s VAL 129 CO -0.00 0.20 0.16 -1.59 0.00 0.00 0.00 175.10 173.87 1h47 s LYS 130 N 0.34 1.63 0.04 2.72 -2.85 0.29 -4.95 119.74 116.96 1h47 s LYS 130 Ca -0.05 -1.94 0.00 0.00 -1.00 0.00 0.00 55.97 52.99 1h47 s LYS 130 Cb -0.09 -0.14 -0.03 0.00 -2.06 0.00 0.00 37.83 35.52 1h47 s LYS 130 CO 0.00 -0.46 -0.04 0.00 0.10 0.00 0.00 175.35 174.95 1h47 s ALA 131 N -3.56 0.39 -0.03 0.59 0.00 -1.26 -0.39 121.76 117.50 1h47 s ALA 131 Ca 0.35 -0.86 -0.13 0.00 0.00 0.00 0.00 51.96 51.32 1h47 s ALA 131 Cb 0.05 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.35 1h47 s ALA 131 CO 0.18 -0.20 0.28 -0.08 0.00 0.00 0.00 175.76 175.94 1h47 s THR 132 N -2.31 0.05 0.73 0.00 -1.32 -0.25 -4.91 115.64 107.63 1h47 s THR 132 Ca -0.06 -0.43 -0.06 0.00 -1.21 0.00 0.00 61.69 59.93 1h47 s THR 132 Cb -0.04 -0.56 0.09 0.00 -1.51 0.00 0.00 72.50 70.48 1h47 s THR 132 CO -0.03 -0.24 1.03 0.42 -2.21 0.00 0.00 174.62 173.59 1h47 s THR 133 N -1.10 2.25 -0.27 5.08 -4.23 -1.25 -1.65 115.64 114.48 1h47 s THR 133 Ca -0.12 -0.32 0.11 0.00 -1.18 0.00 0.00 61.69 60.18 1h47 s THR 133 Cb -0.05 -2.93 0.52 0.00 1.34 0.00 0.00 72.50 71.38 1h47 s THR 133 CO 0.03 0.00 1.47 0.35 -0.54 0.00 0.00 174.62 175.93 1h47 n THR 134 N -2.97 2.51 -3.58 3.99 -2.24 -1.26 -4.89 114.28 105.84 1h47 n THR 134 Ca 0.10 -2.49 -0.23 0.00 -2.27 0.00 0.00 64.05 59.16 1h47 n THR 134 Cb 0.60 -0.31 0.08 0.00 -2.10 0.00 0.00 70.33 68.60 1h47 n THR 134 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1h47 n GLU 135 N -0.98 -7.52 -1.00 -0.78 2.13 -1.26 -1.08 120.64 110.15 1h47 n GLU 135 Ca 0.31 0.82 0.00 0.00 0.66 0.00 0.00 57.16 58.95 1h47 n GLU 135 Cb 1.02 -5.85 0.00 0.00 0.27 0.00 0.00 31.44 26.88 1h47 n GLU 135 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1h47 n LYS 136 N -4.78 -1.47 -3.76 5.31 5.02 -1.26 -4.99 118.16 112.23 1h47 n LYS 136 Ca -0.06 0.37 -0.33 0.00 -2.02 0.00 0.00 58.31 56.26 1h47 n LYS 136 Cb 0.59 -4.47 -0.05 0.00 -0.02 0.00 0.00 35.03 31.07 1h47 n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1h47 s LEU 137 N 0.00 4.34 0.00 -0.35 1.43 -0.24 -4.01 118.68 119.85 1h47 s LEU 137 Ca 0.00 0.53 0.00 0.00 -1.03 0.00 0.00 54.13 53.63 1h47 s LEU 137 Cb 0.00 -2.88 0.00 0.00 0.03 0.00 0.00 46.19 43.34 1h47 s LEU 137 CO 0.00 0.19 0.00 0.61 0.23 0.00 0.00 176.35 177.38 1h47 n GLY 138 N 0.73 -1.82 0.20 -3.19 0.00 -1.26 -1.72 105.19 98.14 1h47 n GLY 138 Ca -0.08 -1.34 -0.08 0.00 0.00 0.00 0.00 46.02 44.51 1h47 n GLY 138 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1h47 h PHE 139 N 0.00 0.59 -0.33 1.61 -0.00 -1.96 -1.28 116.94 115.58 1h47 h PHE 139 Ca 0.00 -0.21 -0.05 0.00 -0.00 0.00 0.00 57.97 57.70 1h47 h PHE 139 Cb 0.00 -0.11 -0.01 0.00 -0.00 0.00 0.00 35.95 35.83 1h47 h PHE 139 CO 0.00 0.93 -0.01 1.79 -0.00 0.00 0.00 178.31 181.02 1h47 h THR 140 N 0.35 1.26 0.00 0.88 1.35 -1.76 -0.93 112.91 114.06 1h47 h THR 140 Ca 0.00 -0.97 -0.04 0.00 -0.55 0.00 0.00 66.41 64.85 1h47 h THR 140 Cb 1.10 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.77 1h47 h THR 140 CO 0.10 0.32 -0.19 1.23 -0.25 0.00 0.00 175.52 176.73 1h47 h GLY 141 N 0.38 0.00 -0.89 5.82 0.00 -1.07 -1.88 103.07 105.44 1h47 h GLY 141 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1h47 h GLY 141 CO 0.02 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.10 1h47 n ARG 142 N -4.20 1.79 -1.92 4.80 1.74 -0.50 -4.29 116.66 114.07 1h47 n ARG 142 Ca -0.02 -1.18 -0.03 0.00 -0.77 0.00 0.00 57.85 55.85 1h47 n ARG 142 Cb 0.26 -1.42 -0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1h47 n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h47 n GLY 143 N 1.17 0.30 0.08 -0.13 0.00 -0.71 -4.94 105.19 100.97 1h47 n GLY 143 Ca 0.17 -0.79 0.10 0.00 0.00 0.00 0.00 46.02 45.50 1h47 n GLY 143 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h47 n GLU 144 N -1.51 0.62 -2.38 1.61 1.02 -0.36 -4.86 120.64 114.78 1h47 n GLU 144 Ca -0.03 0.04 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 1h47 n GLU 144 Cb 0.47 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 1h47 n GLU 144 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h47 n GLY 145 N 1.23 0.56 3.17 0.62 0.00 -1.23 -1.18 105.19 108.36 1h47 n GLY 145 Ca -0.02 -0.89 -0.24 0.00 0.00 0.00 0.00 46.02 44.86 1h47 n GLY 145 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h47 s ILE 146 N -2.13 1.37 0.30 -0.61 1.01 -0.76 -4.37 121.20 116.02 1h47 s ILE 146 Ca 0.08 -0.78 0.10 0.00 0.00 0.00 0.00 60.65 60.04 1h47 s ILE 146 Cb -0.00 -1.15 -0.05 0.00 0.01 0.00 0.00 42.46 41.27 1h47 s ILE 146 CO -0.00 0.35 -0.03 0.00 0.00 0.00 0.00 174.94 175.27 1h47 s ALA 147 N -0.45 3.12 -0.16 9.38 0.00 -0.62 -2.02 121.76 131.00 1h47 s ALA 147 Ca 0.06 -1.82 -0.13 0.00 0.00 0.00 0.00 51.96 50.07 1h47 s ALA 147 Cb -0.07 -0.52 0.05 0.00 0.00 0.00 0.00 23.12 22.58 1h47 s ALA 147 CO -0.00 0.18 0.41 0.00 0.00 0.00 0.00 175.76 176.35 1h47 s GLU 149 N 0.58 2.02 -0.03 0.00 2.02 -0.22 -1.51 118.70 121.56 1h47 s GLU 149 Ca -0.03 -1.25 -0.11 0.00 0.02 0.00 0.00 54.97 53.60 1h47 s GLU 149 Cb -0.05 -2.16 0.02 0.00 0.10 0.00 0.00 34.13 32.04 1h47 s GLU 149 CO -0.03 0.44 0.25 0.00 0.02 0.00 0.00 175.26 175.94 1h47 s ALA 150 N -1.61 -0.62 0.13 5.21 0.00 -0.40 -0.30 121.76 124.17 1h47 s ALA 150 Ca 0.24 0.32 0.06 0.00 0.00 0.00 0.00 51.96 52.58 1h47 s ALA 150 Cb -0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 1h47 s ALA 150 CO 0.14 -0.21 -0.14 0.14 0.00 0.00 0.00 175.76 175.70 1h47 s VAL 151 N -0.92 1.34 0.00 0.00 -7.23 -0.30 -0.99 120.40 112.31 1h47 s VAL 151 Ca -0.10 -1.75 -0.09 0.00 -1.81 0.00 0.00 61.98 58.23 1h47 s VAL 151 Cb -0.05 -1.57 0.00 0.00 0.56 0.00 0.00 36.38 35.33 1h47 s VAL 151 CO 0.02 -0.44 0.17 0.00 -0.31 0.00 0.00 175.10 174.54 1h47 s ALA 152 N -2.23 -0.40 -0.12 1.32 0.00 -0.53 -1.70 121.76 118.11 1h47 s ALA 152 Ca 0.10 -0.08 0.03 0.00 0.00 0.00 0.00 51.96 52.01 1h47 s ALA 152 Cb -0.04 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.20 1h47 s ALA 152 CO 0.03 -0.23 -0.23 -1.17 0.00 0.00 0.00 175.76 174.16 1h47 s LEU 153 N -1.45 2.08 0.26 0.00 2.96 -0.49 -1.67 118.68 120.37 1h47 s LEU 153 Ca -0.14 -0.57 0.07 0.00 -0.22 0.00 0.00 54.13 53.27 1h47 s LEU 153 Cb -0.07 -1.41 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 1h47 s LEU 153 CO 0.02 0.12 0.21 -0.76 -1.32 0.00 0.00 176.35 174.61 1h47 s LEU 154 N 0.57 3.83 0.03 -0.68 1.43 -0.19 -1.09 118.68 122.58 1h47 s LEU 154 Ca -0.13 -0.25 0.08 0.00 -1.03 0.00 0.00 54.13 52.80 1h47 s LEU 154 Cb -0.17 -2.37 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 1h47 s LEU 154 CO 0.04 -0.05 -0.21 -0.63 0.23 0.00 0.00 176.35 175.72 1h47 s ILE 155 N -2.13 2.51 -2.57 -0.59 1.01 0.26 -1.37 121.20 118.31 1h47 s ILE 155 Ca 0.33 -1.21 0.27 0.00 0.00 0.00 0.00 60.65 60.05 1h47 s ILE 155 Cb -0.08 -2.01 0.50 0.00 0.01 0.00 0.00 42.46 40.88 1h47 s ILE 155 CO 0.25 0.39 1.67 2.29 0.00 0.00 0.00 174.94 179.55