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 bmr19671_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -2.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.66 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 4.34 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 ASP 6.00 5.90 0 10 VAL -3.90 -0.20 1 11 SER -3.60 -2.20 1 12 VAL -6.80 -3.40 1 13 SER 1.30 0.40 1 16 GLN -0.80 -0.70 1 17 THR 0.90 0.60 1 18 ALA -5.00 -2.50 1 19 SER -2.00 -1.60 1 20 ILE 2.80 -0.60 1 21 THR -2.70 -0.80 1 23 SER -4.30 -1.40 1 25 ASP 3.10 2.50 1 26 LYS 1.70 1.20 1 29 ASP 0.60 -0.50 1 30 LYS -5.80 -2.00 1 33 TYR -4.50 -1.70 1 34 TRP -6.10 -2.10 1 35 TYR -5.20 -1.20 1 36 GLN -6.50 -1.60 1 37 GLN -3.30 -0.80 1 38 LYS 0.10 0.00 1 41 GLN -4.40 -2.20 1 42 SER 2.70 1.30 1 46 VAL -0.30 -0.30 1 48 TYR -7.40 -4.10 1 49 GLN 4.50 1.20 1 51 SER -3.60 -1.10 1 52 LYS 1.70 0.10 1 53 ARG -4.20 -1.30 1 55 SER 2.60 1.70 1 59 GLU 0.40 1.30 1 60 ARG 1.60 1.30 1 61 PHE -0.20 0.20 1 62 SER -3.30 -1.20 1 64 SER -4.20 -1.40 1 65 ASN -0.20 0.50 1 66 SER -0.70 -0.20 1 68 ASN 2.00 1.00 1 69 THR -1.80 0.60 1 70 ALA -4.10 -2.50 1 71 THR -1.40 -0.30 1 73 THR -0.80 -0.80 1 75 SER -0.90 -1.10 1 77 THR 4.20 3.30 1 78 GLN -5.90 -2.70 1 79 ALA 5.30 3.50 1 80 MET 2.80 1.80 1 81 ASP 0.50 0.20 1 82 GLU 2.50 2.50 1 83 ALA -2.80 -1.10 1 84 ASP -2.60 -0.50 1 85 TYR -4.00 -1.00 1 86 TYR -2.60 0.20 1 88 GLN -5.80 -2.10 1 102 THR -4.40 -0.70 1 103 LYS 0.60 -0.10 1 105 THR -1.80 -0.70 1 106 VAL -0.70 -1.50 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19671_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 4.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.34 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -1.66 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 50 ASP 6.00 -0.10 0 10 VAL -3.90 3.70 1 11 SER -3.60 1.40 1 12 VAL -6.80 3.40 1 13 SER 1.30 -0.90 1 16 GLN -0.80 0.10 1 17 THR 0.90 -0.30 1 18 ALA -5.00 2.50 1 19 SER -2.00 0.40 1 20 ILE 2.80 -3.40 1 21 THR -2.70 1.90 1 23 SER -4.30 2.90 1 25 ASP 3.10 -0.60 1 26 LYS 1.70 -0.50 1 29 ASP 0.60 -1.10 1 30 LYS -5.80 3.80 1 33 TYR -4.50 2.80 1 34 TRP -6.10 4.00 1 35 TYR -5.20 4.00 1 36 GLN -6.50 4.90 1 37 GLN -3.30 2.50 1 38 LYS 0.10 -0.10 1 41 GLN -4.40 2.20 1 42 SER 2.70 -1.40 1 46 VAL -0.30 0.00 1 48 TYR -7.40 3.30 1 49 GLN 4.50 -3.30 1 51 SER -3.60 2.50 1 52 LYS 1.70 -1.60 1 53 ARG -4.20 2.90 1 55 SER 2.60 -0.90 1 59 GLU 0.40 0.90 1 60 ARG 1.60 -0.30 1 61 PHE -0.20 0.40 1 62 SER -3.30 2.10 1 64 SER -4.20 2.80 1 65 ASN -0.20 0.70 1 66 SER -0.70 0.50 1 68 ASN 2.00 -1.00 1 69 THR -1.80 2.40 1 70 ALA -4.10 1.60 1 71 THR -1.40 1.10 1 73 THR -0.80 0.00 1 75 SER -0.90 -0.20 1 77 THR 4.20 -0.90 1 78 GLN -5.90 3.20 1 79 ALA 5.30 -1.80 1 80 MET 2.80 -1.00 1 81 ASP 0.50 -0.30 1 82 GLU 2.50 0.00 1 83 ALA -2.80 1.70 1 84 ASP -2.60 2.10 1 85 TYR -4.00 3.00 1 86 TYR -2.60 2.80 1 88 GLN -5.80 3.70 1 102 THR -4.40 3.70 1 103 LYS 0.60 -0.70 1 105 THR -1.80 1.10 1 106 VAL -0.70 -0.80 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19671_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.02 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.35 _LACS_plot.Line_2_terminator_val_x_2 6.00 _LACS_plot.Line_2_terminator_val_y_2 -0.42 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 48 TYR -7.40 -0.27 0 49 GLN 4.50 -1.35 0 10 VAL -3.90 0.14 1 11 SER -3.60 1.28 1 12 VAL -6.80 0.56 1 13 SER 1.30 0.21 1 16 GLN -0.80 0.09 1 17 THR 0.90 0.56 1 18 ALA -5.00 0.28 1 19 SER -2.00 0.62 1 20 ILE 2.80 -0.06 1 21 THR -2.70 0.94 1 23 SER -4.30 1.32 1 25 ASP 3.10 -0.23 1 26 LYS 1.70 -0.19 1 29 ASP 0.60 -0.08 1 30 LYS -5.80 0.22 1 33 TYR -4.50 0.39 1 34 TRP -6.10 0.96 1 35 TYR -5.20 0.87 1 36 GLN -6.50 0.00 1 37 GLN -3.30 0.61 1 38 LYS 0.10 0.10 1 41 GLN -4.40 0.41 1 42 SER 2.70 -0.06 1 46 VAL -0.30 0.24 1 50 ASP 6.00 -0.43 1 51 SER -3.60 -0.02 1 52 LYS 1.70 -0.17 1 53 ARG -4.20 0.54 1 55 SER 2.60 -0.24 1 59 GLU 0.40 0.06 1 60 ARG 1.60 0.56 1 61 PHE -0.20 0.10 1 62 SER -3.30 0.24 1 64 SER -4.20 0.14 1 65 ASN -0.20 0.49 1 66 SER -0.70 0.14 1 68 ASN 2.00 -0.22 1 69 THR -1.80 0.58 1 70 ALA -4.10 1.20 1 71 THR -1.40 0.83 1 73 THR -0.80 0.51 1 75 SER -0.90 0.01 1 77 THR 4.20 -0.82 1 78 GLN -5.90 0.31 1 79 ALA 5.30 -0.41 1 80 MET 2.80 -0.11 1 81 ASP 0.50 -0.06 1 82 GLU 2.50 -0.27 1 83 ALA -2.80 0.08 1 84 ASP -2.60 1.02 1 85 TYR -4.00 1.11 1 86 TYR -2.60 0.30 1 88 GLN -5.80 0.46 1 102 THR -4.40 0.32 1 103 LYS 0.60 0.54 1 105 THR -1.80 0.22 1 106 VAL -0.70 0.71 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19671_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.40 _LACS_plot.Line_1_terminator_val_y_1 -2.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.55 _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 6.00 _LACS_plot.Line_2_terminator_val_y_2 -0.05 _LACS_plot.Y_axis_chem_shift_offset 0.87 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 ALA 5.30 2.60 0 10 VAL -3.90 -2.90 1 11 SER -3.60 -0.80 1 12 VAL -6.80 -2.60 1 16 GLN -0.80 -0.30 1 17 THR 0.90 -1.20 1 18 ALA -5.00 -2.60 1 19 SER -2.00 -1.40 1 20 ILE 2.80 -2.10 1 21 THR -2.70 -0.80 1 23 SER -4.30 -0.70 1 25 ASP 3.10 -0.40 1 26 LYS 1.70 0.00 1 29 ASP 0.60 -1.30 1 33 TYR -4.50 -1.70 1 34 TRP -6.10 -0.90 1 35 TYR -5.20 -1.30 1 36 GLN -6.50 -1.50 1 37 GLN -3.30 -1.60 1 41 GLN -4.40 -2.20 1 46 VAL -0.30 -3.00 1 48 TYR -7.40 -3.70 1 49 GLN 4.50 -0.40 1 50 ASP 6.00 1.50 1 51 SER -3.60 0.10 1 52 LYS 1.70 -2.40 1 55 SER 2.60 0.90 1 59 GLU 0.40 -0.20 1 60 ARG 1.60 -0.50 1 61 PHE -0.20 -1.70 1 62 SER -3.30 -2.80 1 64 SER -4.20 -0.20 1 65 ASN -0.20 -0.90 1 66 SER -0.70 0.70 1 68 ASN 2.00 -1.20 1 69 THR -1.80 -2.50 1 70 ALA -4.10 -1.90 1 71 THR -1.40 -1.90 1 73 THR -0.80 -1.70 1 75 SER -0.90 0.00 1 77 THR 4.20 -0.20 1 78 GLN -5.90 0.70 1 80 MET 2.80 -0.90 1 81 ASP 0.50 1.00 1 82 GLU 2.50 -1.40 1 83 ALA -2.80 -3.40 1 84 ASP -2.60 -1.00 1 85 TYR -4.00 0.70 1 86 TYR -2.60 0.50 1 102 THR -4.40 -1.00 1 103 LYS 0.60 -1.60 1 105 THR -1.80 -2.00 1 106 VAL -0.70 -1.10 1 stop_ save_