data_LACS ################################# # LACS Output Information # ################################# ############################################################ # LACS Designator Definition # # # # Index Value Definition # # # # 0 Outliers # # 1 Normal points # # # ############################################################ save_LACS_CACB_CA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25140_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.15 _LACS_plot.Line_1_terminator_val_y_1 -3.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.86 _LACS_plot.Line_2_terminator_val_x_2 4.77 _LACS_plot.Line_2_terminator_val_y_2 2.54 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 VAL -6.15 -5.88 0 22 GLN 0.26 0.28 1 23 TYR -0.50 -0.30 1 24 ALA -0.64 -0.35 1 25 PHE -0.09 -0.04 1 26 GLU -0.68 -0.05 1 27 ASP -0.21 0.13 1 28 GLU 0.37 0.59 1 30 ALA -0.41 0.02 1 31 GLU 0.52 0.90 1 34 VAL 0.03 0.01 1 35 ALA -0.26 -0.04 1 36 ALA -0.13 0.10 1 37 THR -0.03 0.11 1 39 GLU 2.76 0.88 1 40 GLN 0.90 0.79 1 41 ALA 0.50 0.46 1 42 LEU 0.66 0.49 1 43 LYS 0.48 0.40 1 44 SER 0.70 0.74 1 45 LEU 1.22 -0.08 1 46 ALA 1.17 1.08 1 47 ASP 1.00 -0.40 1 50 ILE -0.03 0.14 1 51 ASP -0.11 0.03 1 52 VAL 0.35 0.16 1 53 ALA 0.08 0.22 1 54 VAL 0.50 0.11 1 55 LEU -0.23 -0.02 1 57 VAL 1.36 2.60 1 70 ASP 2.48 1.68 1 71 ALA 0.01 0.03 1 72 LEU 0.93 0.30 1 75 ARG -0.71 1.04 1 82 HIS 0.47 0.35 1 83 THR -0.03 0.18 1 85 ASP 2.32 1.20 1 86 LEU -0.85 -2.78 1 87 ASP 4.77 2.31 1 88 ARG 0.02 0.37 1 91 GLU 0.90 0.65 1 92 LEU 0.40 0.29 1 93 LEU 2.50 2.56 1 94 ARG 0.35 0.20 1 100 VAL -0.55 -0.35 1 101 MET -0.53 -0.26 1 102 ALA -1.65 -2.08 1 103 LYS -0.19 0.08 1 106 ASP 0.42 0.06 1 107 THR -0.42 0.93 1 109 ASP 1.37 1.05 1 112 LYS 1.16 0.91 1 113 ARG 1.06 0.81 1 114 ALA 0.84 0.73 1 115 LEU 0.24 0.45 1 116 GLU 0.04 0.41 1 117 MET 0.12 0.18 1 121 ASP -0.58 -0.33 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25140_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.15 _LACS_plot.Line_1_terminator_val_y_1 2.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.68 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.14 _LACS_plot.Line_2_terminator_val_x_2 4.77 _LACS_plot.Line_2_terminator_val_y_2 -2.23 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 33 VAL -6.15 0.27 0 22 GLN 0.26 0.02 1 23 TYR -0.50 0.20 1 24 ALA -0.64 0.29 1 25 PHE -0.09 0.05 1 26 GLU -0.68 0.63 1 27 ASP -0.21 0.34 1 28 GLU 0.37 0.22 1 30 ALA -0.41 0.43 1 31 GLU 0.52 0.38 1 34 VAL 0.03 -0.02 1 35 ALA -0.26 0.22 1 36 ALA -0.13 0.23 1 37 THR -0.03 0.14 1 39 GLU 2.76 -1.88 1 40 GLN 0.90 -0.11 1 41 ALA 0.50 -0.04 1 42 LEU 0.66 -0.17 1 43 LYS 0.48 -0.08 1 44 SER 0.70 0.04 1 45 LEU 1.22 -1.30 1 46 ALA 1.17 -0.09 1 47 ASP 1.00 -1.40 1 50 ILE -0.03 0.17 1 51 ASP -0.11 0.14 1 52 VAL 0.35 -0.19 1 53 ALA 0.08 0.14 1 54 VAL 0.50 -0.39 1 55 LEU -0.23 0.21 1 57 VAL 1.36 1.24 1 70 ASP 2.48 -0.80 1 71 ALA 0.01 0.02 1 72 LEU 0.93 -0.63 1 75 ARG -0.71 1.75 1 82 HIS 0.47 -0.12 1 83 THR -0.03 0.21 1 85 ASP 2.32 -1.12 1 86 LEU -0.85 -1.93 1 87 ASP 4.77 -2.46 1 88 ARG 0.02 0.35 1 91 GLU 0.90 -0.25 1 92 LEU 0.40 -0.11 1 93 LEU 2.50 0.06 1 94 ARG 0.35 -0.15 1 100 VAL -0.55 0.20 1 101 MET -0.53 0.27 1 102 ALA -1.65 -0.43 1 103 LYS -0.19 0.27 1 106 ASP 0.42 -0.36 1 107 THR -0.42 1.35 1 109 ASP 1.37 -0.32 1 112 LYS 1.16 -0.25 1 113 ARG 1.06 -0.25 1 114 ALA 0.84 -0.11 1 115 LEU 0.24 0.21 1 116 GLU 0.04 0.37 1 117 MET 0.12 0.06 1 121 ASP -0.58 0.25 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25140_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.15 _LACS_plot.Line_1_terminator_val_y_1 0.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.02 _LACS_plot.Line_2_terminator_val_x_2 4.77 _LACS_plot.Line_2_terminator_val_y_2 -0.22 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 LEU 4.77 0.21 0 33 VAL -6.15 0.16 0 22 GLN 0.26 -0.11 1 23 TYR -0.50 0.05 1 24 ALA -0.64 -0.05 1 25 PHE -0.09 -0.22 1 26 GLU -0.68 0.26 1 27 ASP -0.21 -0.06 1 28 GLU 0.37 -0.12 1 30 ALA -0.41 -0.03 1 31 GLU 0.52 -0.03 1 34 VAL 0.03 -0.04 1 35 ALA -0.26 -0.01 1 36 ALA -0.13 0.05 1 37 THR -0.03 -0.10 1 39 GLU 2.76 -0.12 1 40 GLN 0.90 -0.10 1 41 ALA 0.50 -0.05 1 42 LEU 0.66 -0.08 1 43 LYS 0.48 -0.02 1 44 SER 0.70 -0.05 1 45 LEU 1.22 0.15 1 46 ALA 1.17 -0.11 1 47 ASP 1.00 -0.05 1 50 ILE -0.03 -0.04 1 51 ASP -0.11 -0.02 1 52 VAL 0.35 -0.05 1 53 ALA 0.08 0.00 1 54 VAL 0.50 -0.13 1 55 LEU -0.23 0.00 1 57 VAL 1.36 -0.13 1 70 ASP 2.48 -0.20 1 71 ALA 0.01 0.03 1 72 LEU 0.93 -0.01 1 75 ARG -0.71 -0.14 1 82 HIS 0.47 -0.11 1 83 THR -0.03 -0.05 1 85 ASP 2.32 0.02 1 88 ARG 0.02 -0.12 1 91 GLU 0.90 -0.06 1 92 LEU 0.40 0.10 1 93 LEU 2.50 -0.32 1 94 ARG 0.35 -0.08 1 100 VAL -0.55 0.01 1 101 MET -0.53 -0.01 1 102 ALA -1.65 -0.02 1 103 LYS -0.19 0.02 1 106 ASP 0.42 0.01 1 107 THR -0.42 -0.13 1 109 ASP 1.37 -0.12 1 112 LYS 1.16 -0.10 1 113 ARG 1.06 -0.08 1 114 ALA 0.84 -0.07 1 115 LEU 0.24 -0.12 1 116 GLU 0.04 -0.11 1 117 MET 0.12 -0.15 1 121 ASP -0.58 0.17 1 stop_ save_