#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1usl s MET 4 N 0.00 3.58 -0.04 1.61 -1.94 -1.26 -4.89 119.30 116.35 1usl s MET 4 Ca 0.00 -0.07 -0.30 0.00 -1.71 0.00 0.00 55.69 53.61 1usl s MET 4 Cb 0.00 -3.22 -0.03 0.00 2.01 0.00 0.00 34.83 33.60 1usl s MET 4 CO 0.00 0.72 1.03 0.50 -0.01 0.00 0.00 175.02 177.26 1usl s ARG 5 N -0.89 4.48 -0.14 2.03 3.52 -1.26 -0.66 118.95 126.03 1usl s ARG 5 Ca 0.15 1.46 -0.01 0.00 -0.13 0.00 0.00 55.73 57.20 1usl s ARG 5 Cb -0.12 -3.49 0.04 0.00 -1.56 0.00 0.00 34.95 29.81 1usl s ARG 5 CO 0.05 -0.20 -0.02 0.08 -0.81 0.00 0.00 175.30 174.40 1usl s VAL 6 N 1.50 0.72 -0.07 7.11 1.01 -0.64 -1.37 120.40 128.66 1usl s VAL 6 Ca 0.52 -0.33 -0.23 0.00 0.00 0.00 0.00 61.98 61.94 1usl s VAL 6 Cb -0.21 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1usl s VAL 6 CO 0.24 0.12 0.69 -0.31 0.00 0.00 0.00 175.10 175.84 1usl s TYR 7 N 1.81 3.57 -0.01 5.22 1.51 -0.23 -0.26 117.35 128.96 1usl s TYR 7 Ca 0.02 1.22 0.08 0.00 -1.01 0.00 0.00 57.07 57.38 1usl s TYR 7 Cb -0.14 -2.79 -0.02 0.00 -0.11 0.00 0.00 41.96 38.89 1usl s TYR 7 CO -0.07 0.09 -0.26 -0.51 -1.11 0.00 0.00 175.55 173.69 1usl s LEU 8 N 0.82 2.10 0.02 -1.29 1.02 0.05 -0.97 118.68 120.42 1usl s LEU 8 Ca 0.37 -0.48 0.01 0.00 0.02 0.00 0.00 54.13 54.05 1usl s LEU 8 Cb -0.17 -1.34 -0.01 0.00 0.02 0.00 0.00 46.19 44.68 1usl s LEU 8 CO 0.17 0.31 -0.05 -0.83 0.02 0.00 0.00 176.35 175.98 1usl s GLY 9 N -0.71 0.30 -0.21 -3.19 0.00 -0.73 -0.35 107.32 102.43 1usl s GLY 9 Ca 0.10 -0.47 -0.27 0.00 0.00 0.00 0.00 44.72 44.08 1usl s GLY 9 CO -0.00 -0.49 0.89 0.00 0.00 0.00 0.00 173.10 173.49 1usl s ALA 10 N -0.87 -1.88 0.73 3.20 0.00 -0.39 -1.17 121.76 121.38 1usl s ALA 10 Ca -0.07 1.75 -0.01 0.00 0.00 0.00 0.00 51.96 53.63 1usl s ALA 10 Cb -0.06 -0.97 0.02 0.00 0.00 0.00 0.00 23.12 22.11 1usl s ALA 10 CO -0.00 -0.30 0.15 -0.40 0.00 0.00 0.00 175.76 175.21 1usl n ASP 11 N 1.78 0.09 -0.33 0.00 5.75 -1.24 -0.27 116.55 122.32 1usl n ASP 11 Ca -0.13 -1.10 0.19 0.00 -0.01 0.00 0.00 54.79 53.74 1usl n ASP 11 Cb 0.56 -0.11 0.44 0.00 -1.03 0.00 0.00 41.12 40.98 1usl n ASP 11 CO 0.00 0.00 0.00 1.12 -0.11 0.00 0.00 177.20 178.21 1usl h HIS 12 N -0.77 0.84 0.00 2.11 2.07 -1.85 -0.60 115.15 116.95 1usl h HIS 12 Ca -0.05 0.03 -0.09 0.00 -2.85 0.00 0.00 60.37 57.41 1usl h HIS 12 Cb 0.16 -0.24 -0.01 0.00 2.57 0.00 0.00 27.41 29.88 1usl h HIS 12 CO 0.00 0.10 -0.43 0.00 -3.07 0.00 0.00 177.93 174.53 1usl h ALA 13 N 1.66 1.09 -0.19 6.11 0.00 -1.91 -2.95 119.26 123.06 1usl h ALA 13 Ca 0.60 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1usl h ALA 13 Cb 1.30 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1usl h ALA 13 CO -0.36 0.53 0.00 0.41 0.00 0.00 0.00 179.25 179.83 1usl n GLY 14 N 0.03 1.06 0.11 0.00 0.00 -0.74 -4.35 105.19 101.30 1usl n GLY 14 Ca -0.01 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 1usl n GLY 14 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1usl h TYR 15 N 3.19 0.28 -0.52 1.61 3.20 -0.95 -0.61 116.97 123.17 1usl h TYR 15 Ca 0.00 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 1usl h TYR 15 Cb 0.75 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 1usl h TYR 15 CO 0.12 0.23 -0.10 0.93 -1.64 0.00 0.00 178.16 177.69 1usl h GLU 16 N 0.26 0.99 -0.53 1.82 4.39 -1.86 -2.23 114.58 117.41 1usl h GLU 16 Ca 0.08 -0.37 -0.09 0.00 0.34 0.00 0.00 59.36 59.32 1usl h GLU 16 Cb 0.03 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1usl h GLU 16 CO -0.01 1.04 -0.02 1.25 -1.16 0.00 0.00 179.01 180.11 1usl h LEU 17 N 0.85 0.90 -0.73 1.33 5.85 -1.85 -2.51 115.31 119.15 1usl h LEU 17 Ca 0.13 -0.25 0.03 0.00 0.84 0.00 0.00 57.88 58.63 1usl h LEU 17 Cb 0.67 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 1usl h LEU 17 CO 0.05 0.98 0.46 0.50 -0.34 0.00 0.00 178.44 180.09 1usl h LYS 18 N 0.85 0.89 -0.78 1.25 3.64 -0.82 -0.28 116.57 121.32 1usl h LYS 18 Ca 0.15 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1usl h LYS 18 Cb 0.53 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 1usl h LYS 18 CO 0.03 0.59 0.31 1.96 -2.27 0.00 0.00 179.45 180.06 1usl h GLN 19 N 0.91 1.16 -0.48 1.90 1.08 -1.10 -0.10 115.11 118.48 1usl h GLN 19 Ca 0.29 -0.21 -0.10 0.00 -1.45 0.00 0.00 58.65 57.17 1usl h GLN 19 Cb -0.01 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.21 1usl h GLN 19 CO -0.10 0.95 -0.11 0.00 -0.95 0.00 0.00 178.83 178.62 1usl h ARG 20 N 1.13 0.89 -0.22 1.46 3.08 -1.01 -2.31 114.38 117.39 1usl h ARG 20 Ca 0.26 -0.31 -0.15 0.00 0.07 0.00 0.00 59.98 59.85 1usl h ARG 20 Cb 0.22 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1usl h ARG 20 CO -0.02 0.95 -0.48 0.82 -1.07 0.00 0.00 179.97 180.17 1usl h ILE 21 N 0.80 1.31 -0.53 2.04 2.04 -0.73 -0.89 117.51 121.54 1usl h ILE 21 Ca 0.13 -1.69 -0.02 0.00 1.00 0.00 0.00 64.86 64.28 1usl h ILE 21 Cb 0.62 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 1usl h ILE 21 CO 0.04 0.53 0.24 0.40 0.00 0.00 0.00 178.15 179.37 1usl h ILE 22 N 0.47 1.20 -0.71 -0.67 2.04 -0.84 0.74 117.51 119.75 1usl h ILE 22 Ca 0.02 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.22 1usl h ILE 22 Cb 1.01 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 1usl h ILE 22 CO 0.09 0.23 0.16 -0.08 0.00 0.00 0.00 178.15 178.56 1usl h GLU 23 N 0.72 1.14 -0.51 2.37 4.57 -1.27 -2.09 114.58 119.50 1usl h GLU 23 Ca 0.18 -0.28 -0.11 0.00 -1.18 0.00 0.00 59.36 57.98 1usl h GLU 23 Cb 0.14 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 1usl h GLU 23 CO -0.02 1.01 -0.10 1.25 -1.18 0.00 0.00 179.01 179.97 1usl h HIS 24 N 1.07 1.08 -0.50 0.92 2.76 -0.71 -1.62 115.15 118.15 1usl h HIS 24 Ca 0.22 -0.22 -0.13 0.00 -2.20 0.00 0.00 60.37 58.04 1usl h HIS 24 Cb 0.39 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 1usl h HIS 24 CO 0.03 1.02 -0.18 -0.07 -1.30 0.00 0.00 177.93 177.43 1usl h LEU 25 N 0.83 1.01 -0.50 0.26 3.38 -0.82 -1.81 115.31 117.67 1usl h LEU 25 Ca 0.13 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.77 1usl h LEU 25 Cb 0.65 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 1usl h LEU 25 CO 0.05 1.16 0.28 0.11 0.09 0.00 0.00 178.44 180.12 1usl h LYS 26 N 0.87 0.53 -0.02 1.13 1.57 -1.15 -0.32 116.57 119.18 1usl h LYS 26 Ca 0.12 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.78 1usl h LYS 26 Cb 0.75 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1usl h LYS 26 CO 0.06 0.35 -0.39 1.96 -0.57 0.00 0.00 179.45 180.87 1usl h GLN 27 N 0.55 0.04 -0.65 3.15 4.20 -1.07 -2.99 115.11 118.35 1usl h GLN 27 Ca 0.21 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1usl h GLN 27 Cb 0.07 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1usl h GLN 27 CO -0.12 0.43 0.00 0.25 -0.67 0.00 0.00 178.83 178.72 1usl n THR 28 N -4.07 1.79 -0.48 -0.54 -2.24 -0.70 -4.93 114.28 103.11 1usl n THR 28 Ca -0.02 -1.10 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 1usl n THR 28 Cb 0.43 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 1usl n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1usl n GLY 29 N 1.01 0.72 3.96 3.38 0.00 -1.09 -4.98 105.19 108.19 1usl n GLY 29 Ca 0.24 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 1usl n GLY 29 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1usl s HIS 30 N -2.00 1.75 -0.58 1.61 3.76 -0.15 -4.27 115.29 115.41 1usl s HIS 30 Ca 0.00 -0.72 0.04 0.00 -0.15 0.00 0.00 55.06 54.23 1usl s HIS 30 Cb 0.00 -2.10 0.15 0.00 1.11 0.00 0.00 32.58 31.74 1usl s HIS 30 CO 0.00 -0.72 0.36 -2.00 -0.85 0.00 0.00 174.74 171.53 1usl s GLU 31 N -4.43 2.02 0.22 1.40 2.12 0.16 -4.28 118.70 115.92 1usl s GLU 31 Ca 0.49 -2.81 -0.30 0.00 0.36 0.00 0.00 54.97 52.71 1usl s GLU 31 Cb -0.04 -3.12 -0.09 0.00 0.26 0.00 0.00 34.13 31.14 1usl s GLU 31 CO 0.30 -1.20 1.23 -1.25 -0.54 0.00 0.00 175.26 173.80 1usl s PRO 32 N -0.66 4.46 -0.20 4.30 0.04 -1.26 -1.61 135.00 140.07 1usl s PRO 32 Ca 0.21 1.96 0.01 0.00 0.04 0.00 0.00 61.00 63.23 1usl s PRO 32 Cb -0.15 -3.20 0.03 0.00 0.04 0.00 0.00 34.50 31.22 1usl s PRO 32 CO -0.08 -0.11 -0.15 0.42 0.04 0.00 0.00 177.00 177.12 1usl s ILE 33 N -0.28 1.93 -0.29 0.56 1.01 0.65 -4.91 121.20 119.87 1usl s ILE 33 Ca 0.52 -1.08 -0.28 0.00 0.00 0.00 0.00 60.65 59.81 1usl s ILE 33 Cb -0.35 -1.88 0.01 0.00 0.01 0.00 0.00 42.46 40.26 1usl s ILE 33 CO 0.40 0.32 1.02 -0.62 0.00 0.00 0.00 174.94 176.06 1usl s ASP 34 N 1.29 6.94 0.00 3.58 3.68 -1.26 -0.77 116.67 130.13 1usl s ASP 34 Ca 0.00 1.08 0.26 0.00 2.13 0.00 0.00 52.55 56.03 1usl s ASP 34 Cb -0.15 -2.52 0.75 0.00 -1.45 0.00 0.00 42.92 39.54 1usl s ASP 34 CO -0.10 -0.79 1.56 0.00 0.13 0.00 0.00 175.17 175.98 1usl n GLY 36 N 1.29 2.56 3.76 0.00 0.00 -1.25 -4.91 105.19 106.64 1usl n GLY 36 Ca 0.15 -1.97 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 1usl n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1usl s ALA 37 N -2.75 3.36 -0.78 4.61 0.00 0.63 -1.27 121.76 125.57 1usl s ALA 37 Ca 0.00 0.93 0.25 0.00 0.00 0.00 0.00 51.96 53.15 1usl s ALA 37 Cb 0.00 -3.35 0.60 0.00 0.00 0.00 0.00 23.12 20.37 1usl s ALA 37 CO 0.00 -0.27 1.52 1.28 0.00 0.00 0.00 175.76 178.29 1usl n LEU 38 N 0.89 0.59 -3.81 0.00 4.77 -1.26 -4.87 117.00 113.31 1usl n LEU 38 Ca 0.00 0.30 -0.09 0.00 -0.03 0.00 0.00 56.01 56.19 1usl n LEU 38 Cb 0.45 -0.27 -0.07 0.00 -2.33 0.00 0.00 43.42 41.20 1usl n LEU 38 CO 0.53 -0.04 -0.05 -0.60 -1.33 0.00 0.00 177.39 175.91 1usl s ARG 39 N -3.10 0.88 -0.06 3.23 3.52 -1.26 -5.12 118.95 117.04 1usl s ARG 39 Ca 0.09 -0.91 -0.30 0.00 -0.13 0.00 0.00 55.73 54.49 1usl s ARG 39 Cb 0.15 0.37 -0.04 0.00 -1.56 0.00 0.00 34.95 33.86 1usl s ARG 39 CO 0.66 -0.29 1.46 -0.47 -0.81 0.00 0.00 175.30 175.85 1usl s TYR 40 N -3.83 2.53 -0.25 5.12 5.04 -1.26 -4.92 117.35 119.78 1usl s TYR 40 Ca 0.04 0.63 -0.03 0.00 -2.44 0.00 0.00 57.07 55.28 1usl s TYR 40 Cb 0.04 -3.72 0.08 0.00 0.35 0.00 0.00 41.96 38.71 1usl s TYR 40 CO -0.11 -2.78 0.07 0.34 -1.34 0.00 0.00 175.55 171.73 1usl s ASP 41 N 2.44 3.34 0.62 4.32 -1.08 -1.26 -5.04 116.67 120.01 1usl s ASP 41 Ca 0.65 -1.14 0.33 0.00 -0.52 0.00 0.00 52.55 51.87 1usl s ASP 41 Cb -0.30 -0.61 1.84 0.00 -1.46 0.00 0.00 42.92 42.39 1usl s ASP 41 CO 0.25 -0.37 2.13 0.00 0.52 0.00 0.00 175.17 177.70 1usl h ALA 42 N 8.24 1.51 -0.17 3.66 0.00 -1.94 -1.90 119.26 128.65 1usl h ALA 42 Ca -0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1usl h ALA 42 Cb 1.07 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1usl h ALA 42 CO 0.39 -0.23 0.00 -0.25 0.00 0.00 0.00 179.25 179.16 1usl n ASP 43 N -3.43 2.95 -4.76 0.00 8.00 -1.26 -4.91 116.55 113.13 1usl n ASP 43 Ca -0.00 -1.89 -0.30 0.00 0.71 0.00 0.00 54.79 53.31 1usl n ASP 43 Cb 0.28 -0.10 0.12 0.00 -0.02 0.00 0.00 41.12 41.39 1usl n ASP 43 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1usl s ASP 44 N -1.53 3.81 -0.17 -2.24 1.47 -0.71 -5.03 116.67 112.27 1usl s ASP 44 Ca 0.28 1.31 -0.00 0.00 1.18 0.00 0.00 52.55 55.32 1usl s ASP 44 Cb 0.18 -2.00 0.00 0.00 -0.34 0.00 0.00 42.92 40.77 1usl s ASP 44 CO 0.26 -2.40 -0.15 -1.81 0.68 0.00 0.00 175.17 171.75 1usl s ASP 45 N -3.71 3.60 0.35 2.11 1.01 -1.26 -4.71 116.67 114.06 1usl s ASP 45 Ca 0.63 -0.51 0.05 0.00 0.71 0.00 0.00 52.55 53.43 1usl s ASP 45 Cb -0.16 -1.56 0.64 0.00 1.01 0.00 0.00 42.92 42.85 1usl s ASP 45 CO 0.55 0.05 1.89 0.10 0.21 0.00 0.00 175.17 177.97 1usl h TYR 46 N 7.57 0.48 -0.74 4.23 -0.00 -1.96 -3.34 116.97 123.22 1usl h TYR 46 Ca -0.37 -0.05 0.14 0.00 0.00 0.00 0.00 58.73 58.45 1usl h TYR 46 Cb 1.17 -0.14 -0.09 0.00 0.00 0.00 0.00 36.73 37.67 1usl h TYR 46 CO 0.51 0.50 0.29 -1.35 -0.00 0.00 0.00 178.16 178.11 1usl h PRO 47 N 0.45 0.43 -0.54 0.10 0.11 -1.96 -2.09 132.00 128.49 1usl h PRO 47 Ca 0.10 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.14 1usl h PRO 47 Cb 0.33 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.32 1usl h PRO 47 CO 0.01 0.28 0.16 0.00 -0.21 0.00 0.00 178.00 178.24 1usl h ALA 48 N 1.54 1.27 -0.32 -0.75 0.00 -2.00 0.28 119.26 119.27 1usl h ALA 48 Ca 0.40 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 1usl h ALA 48 Cb 0.60 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1usl h ALA 48 CO -0.40 0.52 -0.44 0.74 0.00 0.00 0.00 179.25 179.67 1usl h PHE 49 N 0.79 1.01 -0.23 0.00 -1.00 -1.62 -1.46 116.94 114.42 1usl h PHE 49 Ca 0.18 -0.32 -0.20 0.00 2.81 0.00 0.00 57.97 60.44 1usl h PHE 49 Cb 0.24 -0.21 0.00 0.00 3.61 0.00 0.00 35.95 39.60 1usl h PHE 49 CO 0.01 1.12 -0.65 0.00 -1.61 0.00 0.00 178.31 177.19 1usl h ILE 51 N 0.61 1.26 0.03 0.00 2.04 -0.96 -1.04 117.51 119.44 1usl h ILE 51 Ca -0.01 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 64.94 1usl h ILE 51 Cb 1.26 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1usl h ILE 51 CO 0.14 0.35 -0.02 0.00 0.00 0.00 0.00 178.15 178.62 1usl h ALA 52 N 1.08 -0.04 -0.46 1.87 0.00 -1.16 -0.14 119.26 120.41 1usl h ALA 52 Ca 0.22 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1usl h ALA 52 Cb 0.32 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1usl h ALA 52 CO -0.00 -0.49 0.28 0.00 0.00 0.00 0.00 179.25 179.04 1usl h ALA 53 N 0.86 0.59 -0.36 0.00 0.00 -1.16 -1.79 119.26 117.40 1usl h ALA 53 Ca -0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1usl h ALA 53 Cb 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1usl h ALA 53 CO 0.01 0.07 -0.09 0.00 0.00 0.00 0.00 179.25 179.24 1usl h ALA 54 N 1.14 0.50 -0.42 0.00 0.00 -1.10 -1.96 119.26 117.42 1usl h ALA 54 Ca 0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1usl h ALA 54 Cb -0.02 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1usl h ALA 54 CO -0.03 0.35 0.24 1.15 0.00 0.00 0.00 179.25 180.96 1usl h THR 55 N 0.50 1.15 -0.38 0.00 2.02 -0.93 -1.78 112.91 113.49 1usl h THR 55 Ca 0.09 -0.38 -0.12 0.00 0.77 0.00 0.00 66.41 66.78 1usl h THR 55 Cb 0.60 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1usl h THR 55 CO 0.04 0.16 -0.23 0.03 0.37 0.00 0.00 175.52 175.88 1usl h ARG 56 N 0.55 0.77 -0.23 6.66 3.08 -1.29 -1.79 114.38 122.14 1usl h ARG 56 Ca 0.15 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 1usl h ARG 56 Cb 0.04 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1usl h ARG 56 CO -0.02 0.93 0.12 1.15 -1.07 0.00 0.00 179.97 181.08 1usl h THR 57 N 0.67 1.12 -0.25 2.04 2.02 -1.23 -2.19 112.91 115.10 1usl h THR 57 Ca 0.09 -0.33 -0.08 0.00 0.77 0.00 0.00 66.41 66.86 1usl h THR 57 Cb 0.75 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 1usl h THR 57 CO 0.06 0.12 -0.20 0.58 0.37 0.00 0.00 175.52 176.45 1usl h VAL 58 N 0.26 1.24 0.00 3.16 2.07 -1.20 -2.57 116.25 119.21 1usl h VAL 58 Ca 0.08 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1usl h VAL 58 Cb 0.08 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1usl h VAL 58 CO -0.01 0.36 0.00 0.00 0.02 0.00 0.00 177.57 177.94 1usl n ALA 59 N -2.48 2.33 -3.50 1.67 0.00 -0.68 -4.14 120.51 113.70 1usl n ALA 59 Ca -0.00 -0.12 -0.27 0.00 0.00 0.00 0.00 53.44 53.05 1usl n ALA 59 Cb 0.36 -1.45 -0.09 0.00 0.00 0.00 0.00 19.45 18.27 1usl n ALA 59 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1usl n ASP 60 N -1.35 1.98 -4.63 0.00 2.03 -0.84 -5.07 116.55 108.66 1usl n ASP 60 Ca 0.11 -3.01 -0.46 0.00 0.52 0.00 0.00 54.79 51.94 1usl n ASP 60 Cb 0.25 -0.67 -0.03 0.00 -0.72 0.00 0.00 41.12 39.95 1usl n ASP 60 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1usl n PRO 61 N 1.67 1.68 0.00 -0.67 -0.02 -1.26 -1.60 135.00 134.81 1usl n PRO 61 Ca 0.25 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1usl n PRO 61 Cb 0.43 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1usl n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1usl n GLY 62 N 2.07 1.25 3.94 -1.23 0.00 -1.26 -5.06 105.19 104.91 1usl n GLY 62 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1usl n GLY 62 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1usl s SER 63 N -1.84 5.42 0.40 1.61 1.04 -0.62 -4.73 113.70 114.97 1usl s SER 63 Ca 0.00 0.35 0.04 0.00 0.48 0.00 0.00 55.95 56.82 1usl s SER 63 Cb 0.00 -1.32 -0.04 0.00 0.10 0.00 0.00 66.02 64.76 1usl s SER 63 CO 0.00 -1.09 0.07 -0.76 0.98 0.00 0.00 173.24 172.44 1usl s LEU 64 N -4.86 2.20 -0.01 2.42 1.43 -0.47 -4.91 118.68 114.47 1usl s LEU 64 Ca 0.54 -1.54 -0.15 0.00 -1.03 0.00 0.00 54.13 51.96 1usl s LEU 64 Cb -0.10 -0.39 0.02 0.00 0.03 0.00 0.00 46.19 45.75 1usl s LEU 64 CO 0.41 -0.76 0.31 -0.83 0.23 0.00 0.00 176.35 175.72 1usl s GLY 65 N -3.62 -0.15 -0.05 -3.19 0.00 0.47 -1.07 107.32 99.70 1usl s GLY 65 Ca 0.26 0.31 0.01 0.00 0.00 0.00 0.00 44.72 45.30 1usl s GLY 65 CO 0.13 0.10 -0.04 -0.42 0.00 0.00 0.00 173.10 172.87 1usl s ILE 66 N -1.41 0.55 -0.08 0.90 1.01 -0.14 -2.13 121.20 119.89 1usl s ILE 66 Ca -0.13 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.42 1usl s ILE 66 Cb -0.05 -0.59 -0.02 0.00 0.01 0.00 0.00 42.46 41.81 1usl s ILE 66 CO 0.04 0.24 -0.11 0.68 0.00 0.00 0.00 174.94 175.79 1usl s VAL 67 N 1.05 3.31 -0.06 2.92 -7.23 -0.11 -1.77 120.40 118.51 1usl s VAL 67 Ca -0.09 -0.61 0.05 0.00 -1.81 0.00 0.00 61.98 59.52 1usl s VAL 67 Cb -0.14 -2.35 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 1usl s VAL 67 CO -0.01 0.57 -0.22 -0.76 -0.31 0.00 0.00 175.10 174.37 1usl s LEU 68 N -0.38 2.01 0.00 1.32 2.01 -0.31 -1.23 118.68 122.09 1usl s LEU 68 Ca 0.05 -0.46 0.00 0.00 0.01 0.00 0.00 54.13 53.73 1usl s LEU 68 Cb -0.12 -1.23 0.00 0.00 0.01 0.00 0.00 46.19 44.85 1usl s LEU 68 CO 0.02 0.20 0.00 0.61 1.01 0.00 0.00 176.35 178.19 1usl n GLY 69 N 3.11 4.77 0.22 -3.19 0.00 -0.95 -3.73 105.19 105.42 1usl n GLY 69 Ca -0.18 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.57 1usl n GLY 69 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1usl h GLY 70 N 0.00 -0.49 0.29 -0.02 0.00 -1.85 -0.54 103.07 100.47 1usl h GLY 70 Ca 0.00 0.18 -0.10 0.00 0.00 0.00 0.00 47.33 47.41 1usl h GLY 70 CO 0.00 -0.18 -1.85 -1.14 0.00 0.00 0.00 176.54 173.37 1usl n SER 71 N -5.09 0.25 0.00 0.19 3.41 -1.26 -1.91 113.62 109.21 1usl n SER 71 Ca -0.07 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1usl n SER 71 Cb 0.22 1.29 0.00 0.00 -0.26 0.00 0.00 64.21 65.45 1usl n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1usl n GLY 72 N 1.37 2.15 0.15 5.00 0.00 -1.26 -2.89 105.19 109.71 1usl n GLY 72 Ca -0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.74 1usl n GLY 72 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1usl h ASN 73 N 0.00 0.55 -0.91 1.61 2.35 -1.94 -1.22 115.58 116.01 1usl h ASN 73 Ca 0.00 -0.73 0.06 0.00 -0.55 0.00 0.00 56.30 55.07 1usl h ASN 73 Cb 0.00 -0.17 -0.06 0.00 0.05 0.00 0.00 38.32 38.15 1usl h ASN 73 CO 0.00 1.20 0.59 1.23 -1.65 0.00 0.00 177.43 178.81 1usl h GLY 74 N -0.06 1.32 0.77 2.83 0.00 -2.00 -1.90 103.07 104.03 1usl h GLY 74 Ca -0.07 -0.43 -0.05 0.00 0.00 0.00 0.00 47.33 46.79 1usl h GLY 74 CO 0.11 0.33 -0.09 0.83 0.00 0.00 0.00 176.54 177.72 1usl h GLU 75 N 1.06 0.36 -0.16 4.80 3.07 -1.92 -1.72 114.58 120.07 1usl h GLU 75 Ca 0.38 -0.16 -0.11 0.00 -0.50 0.00 0.00 59.36 58.97 1usl h GLU 75 Cb 0.14 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 1usl h GLU 75 CO -0.14 0.68 -0.36 -0.56 -1.40 0.00 0.00 179.01 177.23 1usl h GLN 76 N 0.04 0.35 -0.31 2.33 -0.00 -1.14 -1.73 115.11 114.65 1usl h GLN 76 Ca 0.04 -0.15 -0.00 0.00 -0.00 0.00 0.00 58.65 58.53 1usl h GLN 76 Cb 0.57 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 28.03 1usl h GLN 76 CO 0.03 0.67 0.18 0.82 -0.00 0.00 0.00 178.83 180.52 1usl h ILE 77 N 0.30 1.12 -0.30 1.86 2.04 -1.15 -0.57 117.51 120.80 1usl h ILE 77 Ca 0.03 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1usl h ILE 77 Cb 0.78 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 1usl h ILE 77 CO 0.06 0.12 0.17 0.00 0.00 0.00 0.00 178.15 178.50 1usl h ALA 78 N 1.05 0.39 -0.84 1.87 0.00 -1.19 -2.68 119.26 117.87 1usl h ALA 78 Ca 0.11 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1usl h ALA 78 Cb 0.04 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1usl h ALA 78 CO -0.02 -0.09 0.52 0.00 0.00 0.00 0.00 179.25 179.66 1usl h ALA 79 N 1.04 1.34 0.00 0.00 0.00 -1.09 -2.25 119.26 118.30 1usl h ALA 79 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1usl h ALA 79 Cb 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1usl h ALA 79 CO -0.02 0.58 0.00 0.09 0.00 0.00 0.00 179.25 179.90 1usl n ASN 80 N -4.38 0.63 0.21 0.00 3.02 -0.24 -1.96 115.26 112.53 1usl n ASN 80 Ca 0.09 0.64 0.14 0.00 -0.03 0.00 0.00 54.58 55.42 1usl n ASN 80 Cb 0.05 -0.78 0.45 0.00 -0.61 0.00 0.00 39.78 38.90 1usl n ASN 80 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1usl h LYS 81 N 0.00 0.00 -6.30 3.52 1.79 -1.20 -3.44 116.57 110.94 1usl h LYS 81 Ca 0.00 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.92 1usl h LYS 81 Cb 0.41 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.04 1usl h LYS 81 CO 0.00 0.00 0.79 0.08 -1.08 0.00 0.00 179.45 179.24 1usl s VAL 82 N -3.38 4.07 0.09 0.50 1.01 -0.83 -4.95 120.40 116.91 1usl s VAL 82 Ca 0.05 1.39 -0.36 0.00 0.00 0.00 0.00 61.98 63.06 1usl s VAL 82 Cb 0.08 -3.89 -0.16 0.00 0.00 0.00 0.00 36.38 32.41 1usl s VAL 82 CO 0.56 -0.03 1.43 -2.65 0.00 0.00 0.00 175.10 174.41 1usl n PRO 83 N 5.58 1.44 0.00 2.72 -0.02 -1.26 -1.65 135.00 141.81 1usl n PRO 83 Ca 0.12 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1usl n PRO 83 Cb 0.45 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1usl n PRO 83 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1usl n GLY 84 N 2.86 1.79 3.82 -1.23 0.00 -1.26 -4.99 105.19 106.18 1usl n GLY 84 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1usl n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1usl s ALA 85 N -2.59 3.54 -0.21 4.61 0.00 -0.66 -4.98 121.76 121.46 1usl s ALA 85 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 51.96 52.00 1usl s ALA 85 Cb 0.00 -2.67 0.06 0.00 0.00 0.00 0.00 23.12 20.51 1usl s ALA 85 CO 0.00 0.39 -0.03 1.03 0.00 0.00 0.00 175.76 177.15 1usl s ARG 86 N -1.51 1.30 -0.23 0.00 0.52 -1.26 -4.79 118.95 112.97 1usl s ARG 86 Ca 0.35 -0.76 0.02 0.00 -0.52 0.00 0.00 55.73 54.82 1usl s ARG 86 Cb -0.18 -2.38 0.05 0.00 0.52 0.00 0.00 34.95 32.95 1usl s ARG 86 CO 0.20 -0.59 -0.14 0.00 0.02 0.00 0.00 175.30 174.79 1usl s ALA 88 N 1.17 3.47 -0.33 0.00 0.00 -0.75 -4.86 121.76 120.46 1usl s ALA 88 Ca -0.05 -0.57 -0.15 0.00 0.00 0.00 0.00 51.96 51.19 1usl s ALA 88 Cb -0.18 -2.49 -0.02 0.00 0.00 0.00 0.00 23.12 20.44 1usl s ALA 88 CO -0.07 -0.24 0.38 -1.17 0.00 0.00 0.00 175.76 174.65 1usl s LEU 89 N -4.57 4.33 -0.35 0.00 2.96 -1.26 -0.29 118.68 119.50 1usl s LEU 89 Ca 0.46 -0.09 -0.14 0.00 -0.22 0.00 0.00 54.13 54.15 1usl s LEU 89 Cb -0.10 -2.39 -0.01 0.00 0.50 0.00 0.00 46.19 44.19 1usl s LEU 89 CO 0.42 -0.32 0.28 0.00 -1.32 0.00 0.00 176.35 175.40 1usl s ALA 90 N 2.08 3.50 -0.07 5.97 0.00 -0.51 -4.87 121.76 127.86 1usl s ALA 90 Ca 0.13 -1.39 0.01 0.00 0.00 0.00 0.00 51.96 50.71 1usl s ALA 90 Cb -0.16 -2.74 0.02 0.00 0.00 0.00 0.00 23.12 20.24 1usl s ALA 90 CO 0.12 -1.07 0.92 -2.67 0.00 0.00 0.00 175.76 173.06 1usl n TRP 91 N 5.18 0.03 -3.54 0.00 4.27 -1.26 -4.54 117.44 117.57 1usl n TRP 91 Ca -0.12 -0.40 -0.10 0.00 -3.89 0.00 0.00 57.50 53.00 1usl n TRP 91 Cb 0.49 -0.04 -0.02 0.00 -1.36 0.00 0.00 31.31 30.38 1usl n TRP 91 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 1usl s SER 92 N -0.81 -0.44 0.32 -0.67 1.04 -1.26 -5.01 113.70 106.86 1usl s SER 92 Ca 0.01 -0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.31 1usl s SER 92 Cb 0.01 0.57 0.55 0.00 0.10 0.00 0.00 66.02 67.25 1usl s SER 92 CO 0.01 -0.96 1.97 0.58 0.98 0.00 0.00 173.24 175.81 1usl h VAL 93 N 2.00 1.14 -0.36 5.02 2.07 -1.91 -1.96 116.25 122.25 1usl h VAL 93 Ca -0.28 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 1usl h VAL 93 Cb 1.28 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1usl h VAL 93 CO 0.33 0.18 -0.04 -0.61 0.02 0.00 0.00 177.57 177.45 1usl h GLN 94 N 0.99 0.67 -0.03 1.57 4.15 -1.97 -1.61 115.11 118.88 1usl h GLN 94 Ca 0.30 -0.24 -0.13 0.00 0.77 0.00 0.00 58.65 59.36 1usl h GLN 94 Cb -0.00 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 1usl h GLN 94 CO -0.08 0.80 -0.58 1.79 -1.93 0.00 0.00 178.83 178.83 1usl h THR 95 N 0.47 1.40 -0.37 2.39 1.35 -1.91 -0.98 112.91 115.25 1usl h THR 95 Ca 0.10 -1.96 -0.04 0.00 -0.55 0.00 0.00 66.41 63.96 1usl h THR 95 Cb 0.53 2.03 -0.02 0.00 -1.73 0.00 0.00 68.15 68.96 1usl h THR 95 CO 0.03 0.57 0.08 0.00 -0.25 0.00 0.00 175.52 175.95 1usl h ALA 96 N 1.34 0.50 -0.09 6.62 0.00 -1.25 -1.51 119.26 124.86 1usl h ALA 96 Ca -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1usl h ALA 96 Cb 1.04 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1usl h ALA 96 CO 0.08 0.18 0.03 0.00 0.00 0.00 0.00 179.25 179.54 1usl h ALA 97 N 0.93 0.12 -0.19 0.00 0.00 -1.15 -2.96 119.26 116.01 1usl h ALA 97 Ca 0.12 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1usl h ALA 97 Cb 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1usl h ALA 97 CO 0.00 -0.28 -0.11 -0.07 0.00 0.00 0.00 179.25 178.80 1usl h LEU 98 N -0.03 0.28 -0.79 0.00 3.38 -1.18 -0.50 115.31 116.46 1usl h LEU 98 Ca 0.03 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1usl h LEU 98 Cb 0.20 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 1usl h LEU 98 CO -0.00 0.42 0.49 0.00 0.09 0.00 0.00 178.44 179.43 1usl h ALA 99 N 1.62 1.07 0.00 1.53 0.00 -1.11 0.09 119.26 122.46 1usl h ALA 99 Ca 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1usl h ALA 99 Cb 0.37 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1usl h ALA 99 CO 0.02 0.24 -0.00 0.00 0.00 0.00 0.00 179.25 179.51 1usl h ARG 100 N 0.91 -0.00 -0.16 0.00 2.47 -1.34 -0.71 114.38 115.54 1usl h ARG 100 Ca 0.34 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.06 1usl h ARG 100 Cb 0.12 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.43 1usl h ARG 100 CO -0.15 0.70 0.11 0.93 0.56 0.00 0.00 179.97 182.12 1usl h GLU 101 N -0.71 0.22 0.00 0.04 5.08 -0.88 -2.73 114.58 115.59 1usl h GLU 101 Ca -0.00 -0.01 -0.41 0.00 -1.00 0.00 0.00 59.36 57.93 1usl h GLU 101 Cb 0.71 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.84 1usl h GLU 101 CO 0.00 0.15 -2.48 0.72 -1.00 0.00 0.00 179.01 176.40 1usl n HIS 102 N -4.97 0.05 1.06 4.33 8.25 0.00 -2.83 115.22 121.11 1usl n HIS 102 Ca -0.04 0.01 0.11 0.00 -0.26 0.00 0.00 57.72 57.55 1usl n HIS 102 Cb 0.03 -1.01 0.08 0.00 1.12 0.00 0.00 29.99 30.22 1usl n HIS 102 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1usl n ASN 103 N -3.59 1.41 -4.25 0.41 3.02 -1.02 -4.79 115.26 106.44 1usl n ASN 103 Ca -0.48 -1.12 -0.36 0.00 -0.03 0.00 0.00 54.58 52.59 1usl n ASN 103 Cb 0.96 0.50 -0.04 0.00 -0.61 0.00 0.00 39.78 40.58 1usl n ASN 103 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1usl n ASN 104 N -0.66 -2.42 -4.68 6.41 5.15 -0.83 -4.85 115.26 113.39 1usl n ASN 104 Ca 0.08 -1.07 -0.42 0.00 -0.60 0.00 0.00 54.58 52.57 1usl n ASN 104 Cb 0.40 -2.54 -0.03 0.00 -0.53 0.00 0.00 39.78 37.08 1usl n ASN 104 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1usl s ALA 105 N -3.44 3.65 -0.47 5.20 0.00 -0.34 -4.88 121.76 121.48 1usl s ALA 105 Ca 0.62 1.09 0.23 0.00 0.00 0.00 0.00 51.96 53.90 1usl s ALA 105 Cb -0.34 -3.70 0.39 0.00 0.00 0.00 0.00 23.12 19.47 1usl s ALA 105 CO 0.94 -1.18 1.60 1.96 0.00 0.00 0.00 175.76 179.09 1usl h GLN 106 N 8.68 0.00 -5.50 0.00 7.50 -1.80 -3.42 115.11 120.57 1usl h GLN 106 Ca -0.41 0.00 -0.43 0.00 0.50 0.00 0.00 58.65 58.30 1usl h GLN 106 Cb 1.19 0.00 -0.19 0.00 0.05 0.00 0.00 27.48 28.53 1usl h GLN 106 CO 0.93 0.00 -0.77 -0.51 -1.50 0.00 0.00 178.83 176.98 1usl s LEU 107 N -5.93 2.36 0.10 1.46 1.02 -1.00 -0.40 118.68 116.30 1usl s LEU 107 Ca 0.07 -0.75 0.07 0.00 0.02 0.00 0.00 54.13 53.54 1usl s LEU 107 Cb 0.06 -0.58 -0.03 0.00 0.02 0.00 0.00 46.19 45.65 1usl s LEU 107 CO 0.67 -0.10 -0.19 0.27 0.02 0.00 0.00 176.35 177.01 1usl s ILE 108 N -1.83 1.58 0.00 -0.59 -4.36 -0.90 -1.81 121.20 113.28 1usl s ILE 108 Ca 0.06 -1.51 -0.06 0.00 -0.26 0.00 0.00 60.65 58.88 1usl s ILE 108 Cb -0.07 -1.46 -0.05 0.00 1.25 0.00 0.00 42.46 42.13 1usl s ILE 108 CO 0.03 -0.11 0.26 -0.83 0.24 0.00 0.00 174.94 174.52 1usl s GLY 109 N -1.91 2.24 -0.05 6.27 0.00 0.60 -0.94 107.32 113.53 1usl s GLY 109 Ca 0.05 -0.59 0.03 0.00 0.00 0.00 0.00 44.72 44.21 1usl s GLY 109 CO 0.04 -0.41 -0.13 -0.42 0.00 0.00 0.00 173.10 172.17 1usl s ILE 110 N -1.30 1.17 -0.68 0.90 1.01 -0.36 -1.43 121.20 120.51 1usl s ILE 110 Ca 0.27 -0.54 -0.24 0.00 0.00 0.00 0.00 60.65 60.15 1usl s ILE 110 Cb -0.13 -1.04 0.06 0.00 0.01 0.00 0.00 42.46 41.36 1usl s ILE 110 CO 0.16 0.35 1.04 -0.83 0.00 0.00 0.00 174.94 175.67 1usl s GLY 111 N 0.36 1.25 0.47 6.18 0.00 -1.14 -2.24 107.32 112.19 1usl s GLY 111 Ca -0.09 -1.73 0.18 0.00 0.00 0.00 0.00 44.72 43.08 1usl s GLY 111 CO 0.03 2.21 1.99 -1.33 0.00 0.00 0.00 173.10 175.99 1usl h GLY 112 N 11.76 0.38 1.85 0.20 0.00 -0.94 -1.39 103.07 114.93 1usl h GLY 112 Ca -0.28 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1usl h GLY 112 CO 1.21 0.06 0.00 0.54 0.00 0.00 0.00 176.54 178.34 1usl n ARG 113 N -4.45 0.10 0.00 4.80 1.74 -0.80 -3.29 116.66 114.76 1usl n ARG 113 Ca 0.09 0.14 0.10 0.00 -0.77 0.00 0.00 57.85 57.42 1usl n ARG 113 Cb 0.44 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.28 1usl n ARG 113 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1usl n MET 114 N -1.43 0.10 -4.04 5.56 2.81 -0.52 -4.99 117.12 114.61 1usl n MET 114 Ca 0.06 -0.08 -0.11 0.00 -1.81 0.00 0.00 57.70 55.77 1usl n MET 114 Cb 0.20 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.10 1usl n MET 114 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 1usl s HIS 115 N -2.96 0.51 0.90 2.03 3.76 -1.21 -5.11 115.29 113.21 1usl s HIS 115 Ca 0.09 -0.59 -0.11 0.00 -0.15 0.00 0.00 55.06 54.29 1usl s HIS 115 Cb 0.16 -0.32 0.13 0.00 1.11 0.00 0.00 32.58 33.66 1usl s HIS 115 CO 0.84 -0.16 1.09 0.95 -0.85 0.00 0.00 174.74 176.62 1usl s THR 116 N -1.81 2.66 0.26 1.30 -4.23 -1.26 -4.84 115.64 107.72 1usl s THR 116 Ca -0.09 0.21 -0.04 0.00 -1.18 0.00 0.00 61.69 60.59 1usl s THR 116 Cb -0.07 -2.63 0.23 0.00 1.34 0.00 0.00 72.50 71.37 1usl s THR 116 CO -0.01 -0.28 1.90 0.58 -0.54 0.00 0.00 174.62 176.27 1usl h VAL 117 N -1.59 1.24 -0.67 2.29 2.07 -1.99 -1.59 116.25 116.01 1usl h VAL 117 Ca -0.49 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.48 1usl h VAL 117 Cb 1.28 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1usl h VAL 117 CO 0.53 0.26 0.40 0.00 0.02 0.00 0.00 177.57 178.77 1usl h ALA 118 N 1.37 0.85 -0.63 1.67 0.00 -1.99 -0.93 119.26 119.60 1usl h ALA 118 Ca 0.30 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1usl h ALA 118 Cb -0.03 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1usl h ALA 118 CO -0.05 0.33 0.04 0.93 0.00 0.00 0.00 179.25 180.50 1usl h GLU 119 N 0.91 1.08 -0.52 0.00 5.08 -1.82 -2.11 114.58 117.20 1usl h GLU 119 Ca 0.24 -0.32 -0.10 0.00 -1.00 0.00 0.00 59.36 58.18 1usl h GLU 119 Cb -0.02 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1usl h GLU 119 CO -0.04 1.03 -0.05 0.00 -1.00 0.00 0.00 179.01 178.95 1usl h ALA 120 N 1.01 0.71 -0.00 3.43 0.00 -1.03 -2.38 119.26 121.00 1usl h ALA 120 Ca 0.18 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1usl h ALA 120 Cb 0.52 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1usl h ALA 120 CO 0.02 0.57 -0.49 -0.07 0.00 0.00 0.00 179.25 179.28 1usl h LEU 121 N 0.82 0.00 -0.81 0.00 3.38 -1.06 -1.70 115.31 115.95 1usl h LEU 121 Ca 0.14 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 1usl h LEU 121 Cb 0.59 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1usl h LEU 121 CO 0.04 0.50 -0.40 0.00 0.09 0.00 0.00 178.44 178.66 1usl h ALA 122 N 1.50 0.98 -0.47 1.53 0.00 -1.24 -1.16 119.26 120.40 1usl h ALA 122 Ca -0.00 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 1usl h ALA 122 Cb 0.88 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1usl h ALA 122 CO 0.06 0.62 0.07 0.82 0.00 0.00 0.00 179.25 180.82 1usl h ILE 123 N 0.34 1.25 -0.52 0.00 2.04 -1.02 -2.06 117.51 117.54 1usl h ILE 123 Ca 0.03 -0.93 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 1usl h ILE 123 Cb 0.85 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1usl h ILE 123 CO 0.07 0.33 0.21 0.58 0.00 0.00 0.00 178.15 179.34 1usl h VAL 124 N 0.65 1.22 -0.26 1.67 2.07 -1.09 -1.70 116.25 118.81 1usl h VAL 124 Ca 0.14 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1usl h VAL 124 Cb 0.40 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1usl h VAL 124 CO 0.01 0.25 0.17 0.44 0.02 0.00 0.00 177.57 178.46 1usl h ASP 125 N 0.70 0.30 -0.76 0.57 3.32 -1.10 -1.73 116.42 117.73 1usl h ASP 125 Ca 0.17 -0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.26 1usl h ASP 125 Cb 0.19 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.61 1usl h ASP 125 CO -0.01 0.24 0.45 0.00 -1.72 0.00 0.00 179.24 178.19 1usl h ALA 126 N 1.08 1.03 -0.49 3.45 0.00 -1.19 -2.12 119.26 121.02 1usl h ALA 126 Ca 0.09 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1usl h ALA 126 Cb -0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1usl h ALA 126 CO -0.02 0.16 -0.04 0.35 0.00 0.00 0.00 179.25 179.69 1usl h PHE 127 N 0.82 0.98 -0.00 0.00 3.57 -0.81 -1.77 116.94 119.73 1usl h PHE 127 Ca 0.34 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1usl h PHE 127 Cb 0.18 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.67 1usl h PHE 127 CO -0.06 0.94 -0.33 1.33 -2.23 0.00 0.00 178.31 177.96 1usl n VAL 128 N -4.29 0.00 -0.03 1.41 0.24 -0.69 -4.09 118.33 110.88 1usl n VAL 128 Ca 0.01 -0.01 0.01 0.00 -2.04 0.00 0.00 64.34 62.30 1usl n VAL 128 Cb 0.35 0.03 -0.11 0.00 -1.47 0.00 0.00 33.84 32.64 1usl n VAL 128 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1usl n THR 129 N -1.44 0.42 -2.53 3.34 -2.24 -0.81 -4.90 114.28 106.12 1usl n THR 129 Ca 0.07 -0.43 -0.42 0.00 -2.27 0.00 0.00 64.05 60.99 1usl n THR 129 Cb 0.33 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.32 1usl n THR 129 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1usl s THR 130 N -2.66 4.42 0.49 4.28 2.01 -0.67 -5.01 115.64 118.50 1usl s THR 130 Ca -0.06 1.72 -0.20 0.00 0.31 0.00 0.00 61.69 63.47 1usl s THR 130 Cb 0.07 -4.11 -0.08 0.00 0.01 0.00 0.00 72.50 68.39 1usl s THR 130 CO 0.56 -0.01 1.04 -2.84 -0.69 0.00 0.00 174.62 172.68 1usl s PRO 131 N 2.24 3.76 0.09 4.92 0.02 -1.26 -4.77 135.00 140.00 1usl s PRO 131 Ca 0.53 1.35 -0.31 0.00 0.02 0.00 0.00 61.00 62.60 1usl s PRO 131 Cb -0.22 -2.09 -0.08 0.00 0.02 0.00 0.00 34.50 32.13 1usl s PRO 131 CO 0.20 -0.47 1.43 -0.46 -0.33 0.00 0.00 177.00 177.38 1usl s TRP 132 N -2.02 3.06 0.31 6.54 -0.00 -1.26 -3.74 118.94 121.83 1usl s TRP 132 Ca 0.67 0.83 0.13 0.00 -0.00 0.00 0.00 56.10 57.73 1usl s TRP 132 Cb -0.16 -3.72 0.58 0.00 -0.00 0.00 0.00 33.47 30.16 1usl s TRP 132 CO 0.21 -2.63 1.73 0.66 -0.00 0.00 0.00 176.95 176.93 1usl h SER 133 N 7.18 0.00 -0.57 5.86 4.64 -1.71 -3.47 113.55 125.48 1usl h SER 133 Ca -0.41 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 60.66 1usl h SER 133 Cb 1.20 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.19 1usl h SER 133 CO 0.88 0.47 -0.22 0.29 -0.87 0.00 0.00 176.83 177.38 1usl n LYS 134 N -3.89 -1.05 -2.17 4.77 5.02 -1.26 -4.97 118.16 114.61 1usl n LYS 134 Ca -0.01 0.90 -0.40 0.00 -2.02 0.00 0.00 58.31 56.77 1usl n LYS 134 Cb 0.50 -4.99 -0.02 0.00 -0.02 0.00 0.00 35.03 30.51 1usl n LYS 134 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1usl s ALA 135 N -2.34 3.42 0.19 7.82 0.00 -1.26 -4.85 121.76 124.74 1usl s ALA 135 Ca 0.00 1.19 -0.12 0.00 0.00 0.00 0.00 51.96 53.03 1usl s ALA 135 Cb 0.00 -3.45 0.22 0.00 0.00 0.00 0.00 23.12 19.89 1usl s ALA 135 CO 0.00 -0.60 1.72 0.37 0.00 0.00 0.00 175.76 177.25 1usl h GLN 136 N 3.27 0.26 -0.35 0.00 4.15 -1.99 -1.58 115.11 118.87 1usl h GLN 136 Ca -0.49 -0.02 -0.10 0.00 0.77 0.00 0.00 58.65 58.82 1usl h GLN 136 Cb 1.23 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.84 1usl h GLN 136 CO 0.65 0.17 -0.20 0.07 -1.93 0.00 0.00 178.83 177.59 1usl h ARG 137 N 0.27 0.66 -0.36 1.69 0.11 -1.99 -0.20 114.38 114.56 1usl h ARG 137 Ca 0.27 -0.24 -0.07 0.00 0.10 0.00 0.00 59.98 60.03 1usl h ARG 137 Cb 0.36 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.38 1usl h ARG 137 CO -0.33 0.82 -0.06 0.45 0.10 0.00 0.00 179.97 180.95 1usl h HIS 138 N 0.58 0.75 -0.67 4.08 3.86 -1.66 -1.97 115.15 120.13 1usl h HIS 138 Ca 0.09 -0.15 -0.07 0.00 -1.16 0.00 0.00 60.37 59.07 1usl h HIS 138 Cb 0.67 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.92 1usl h HIS 138 CO 0.03 0.81 0.14 0.37 0.86 0.00 0.00 177.93 180.14 1usl h GLN 139 N 0.48 1.08 -0.77 2.45 5.75 -1.17 -1.65 115.11 121.28 1usl h GLN 139 Ca 0.10 -0.26 0.05 0.00 -0.15 0.00 0.00 58.65 58.38 1usl h GLN 139 Cb 0.55 -0.14 -0.05 0.00 1.07 0.00 0.00 27.48 28.91 1usl h GLN 139 CO 0.03 0.97 0.47 -0.09 -2.65 0.00 0.00 178.83 177.56 1usl h ARG 140 N 1.02 0.87 -0.19 1.69 2.43 -0.83 -0.54 114.38 118.82 1usl h ARG 140 Ca 0.21 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 59.18 1usl h ARG 140 Cb 0.39 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1usl h ARG 140 CO 0.01 0.57 -0.46 0.00 -1.51 0.00 0.00 179.97 178.58 1usl h ARG 141 N 0.89 0.65 -0.67 0.20 3.08 -1.13 -1.87 114.38 115.53 1usl h ARG 141 Ca 0.32 -0.44 0.09 0.00 0.07 0.00 0.00 59.98 60.02 1usl h ARG 141 Cb 0.10 0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.15 1usl h ARG 141 CO -0.15 1.06 0.31 0.82 -1.07 0.00 0.00 179.97 180.95 1usl h ILE 142 N 0.33 0.84 -0.40 2.04 2.04 -1.12 -1.92 117.51 119.32 1usl h ILE 142 Ca -0.00 -0.19 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 1usl h ILE 142 Cb 1.07 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1usl h ILE 142 CO 0.10 0.10 -0.17 0.44 0.00 0.00 0.00 178.15 178.62 1usl h ASP 143 N 0.54 0.75 -0.39 1.72 3.32 -0.94 -0.65 116.42 120.76 1usl h ASP 143 Ca 0.33 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 1usl h ASP 143 Cb 0.35 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1usl h ASP 143 CO -0.27 0.92 0.22 0.40 -1.72 0.00 0.00 179.24 178.79 1usl h ILE 144 N 0.67 1.14 -0.68 0.35 2.04 -0.89 -1.25 117.51 118.89 1usl h ILE 144 Ca 0.10 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.53 1usl h ILE 144 Cb 0.65 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1usl h ILE 144 CO 0.05 0.15 0.15 0.25 0.00 0.00 0.00 178.15 178.74 1usl h LEU 145 N 0.51 1.05 -1.02 1.44 5.85 -1.09 -2.14 115.31 119.91 1usl h LEU 145 Ca 0.14 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1usl h LEU 145 Cb 0.04 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 1usl h LEU 145 CO -0.02 1.02 0.45 0.00 -0.34 0.00 0.00 178.44 179.54 1usl h ALA 146 N 1.07 1.25 -0.45 1.25 0.00 -0.88 -0.65 119.26 120.85 1usl h ALA 146 Ca 0.21 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1usl h ALA 146 Cb 0.39 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1usl h ALA 146 CO 0.01 0.61 -0.16 1.49 0.00 0.00 0.00 179.25 181.20 1usl h GLU 147 N 1.14 0.86 -0.64 0.00 4.57 -0.98 -1.94 114.58 117.60 1usl h GLU 147 Ca 0.29 -0.32 -0.04 0.00 -1.18 0.00 0.00 59.36 58.10 1usl h GLU 147 Cb 0.03 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.54 1usl h GLU 147 CO -0.05 0.96 0.23 -0.92 -1.18 0.00 0.00 179.01 178.06 1usl h TYR 148 N 0.77 1.00 -0.99 0.92 5.03 -0.92 -2.23 116.97 120.55 1usl h TYR 148 Ca 0.12 -0.09 0.06 0.00 2.58 0.00 0.00 58.73 61.40 1usl h TYR 148 Cb 0.68 -0.30 -0.07 0.00 1.55 0.00 0.00 36.73 38.60 1usl h TYR 148 CO 0.04 0.80 0.64 0.93 -1.32 0.00 0.00 178.16 179.25 1usl h GLU 149 N 0.92 1.13 -0.47 1.82 5.08 -0.84 0.51 114.58 122.74 1usl h GLU 149 Ca 0.21 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.38 1usl h GLU 149 Cb 0.24 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1usl h GLU 149 CO -0.01 0.75 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.47 1usl h ARG 150 N 1.16 0.92 0.00 2.33 2.43 -0.97 -3.36 114.38 116.89 1usl h ARG 150 Ca 0.42 -0.36 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1usl h ARG 150 Cb 0.15 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1usl h ARG 150 CO -0.17 1.02 -1.26 0.25 -1.51 0.00 0.00 179.97 178.30 1usl n THR 151 N -4.12 0.00 -2.79 0.20 -2.24 -0.88 -5.01 114.28 99.44 1usl n THR 151 Ca 0.01 -0.19 -0.16 0.00 -2.27 0.00 0.00 64.05 61.43 1usl n THR 151 Cb 0.43 0.38 -0.00 0.00 -2.10 0.00 0.00 70.33 69.04 1usl n THR 151 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1usl n HIS 152 N -1.72 -1.59 -3.67 4.78 8.25 0.18 -4.97 115.22 116.48 1usl n HIS 152 Ca -0.01 0.19 -0.39 0.00 -0.26 0.00 0.00 57.72 57.25 1usl n HIS 152 Cb 0.19 -2.90 -0.11 0.00 1.12 0.00 0.00 29.99 28.29 1usl n HIS 152 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1usl s GLU 153 N -5.40 2.66 0.19 -0.41 2.02 -1.26 -5.05 118.70 111.45 1usl s GLU 153 Ca 0.15 -1.24 -0.33 0.00 0.02 0.00 0.00 54.97 53.58 1usl s GLU 153 Cb -0.08 -3.63 -0.13 0.00 0.10 0.00 0.00 34.13 30.39 1usl s GLU 153 CO 0.19 -0.76 1.59 0.00 0.02 0.00 0.00 175.26 176.30 1usl n ALA 154 N 4.89 1.78 -1.60 5.21 0.00 -1.26 -4.76 120.51 124.78 1usl n ALA 154 Ca -0.11 0.43 -0.34 0.00 0.00 0.00 0.00 53.44 53.42 1usl n ALA 154 Cb 0.44 -2.39 0.03 0.00 0.00 0.00 0.00 19.45 17.53 1usl n ALA 154 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1usl s PRO 155 N 0.72 2.99 0.56 0.00 0.04 -1.26 -4.98 135.00 133.07 1usl s PRO 155 Ca 0.76 1.45 -0.21 0.00 0.04 0.00 0.00 61.00 63.03 1usl s PRO 155 Cb -0.62 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 1usl s PRO 155 CO 0.39 -1.11 1.29 -1.25 0.04 0.00 0.00 177.00 176.36 1usl s PRO 156 N -3.85 3.12 -0.33 0.56 0.04 -1.26 -4.98 135.00 128.31 1usl s PRO 156 Ca 0.68 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 63.63 1usl s PRO 156 Cb -0.21 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 1usl s PRO 156 CO 0.37 -1.15 0.36 0.08 0.04 0.00 0.00 177.00 176.69 1usl s VAL 157 N -1.42 5.18 0.24 -0.36 1.01 -1.26 -5.05 120.40 118.75 1usl s VAL 157 Ca 0.73 0.15 -0.31 0.00 0.00 0.00 0.00 61.98 62.55 1usl s VAL 157 Cb -0.36 -3.78 -0.14 0.00 0.00 0.00 0.00 36.38 32.10 1usl s VAL 157 CO 0.41 -0.03 1.32 -2.65 0.00 0.00 0.00 175.10 174.15 1usl n PRO 158 N 5.36 1.82 0.00 2.72 -0.02 -1.26 -5.34 135.00 138.28 1usl n PRO 158 Ca -0.09 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1usl n PRO 158 Cb 0.50 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1usl n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89