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 bmr16618_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.02 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.64 _LACS_plot.Line_2_terminator_val_x_2 6.45 _LACS_plot.Line_2_terminator_val_y_2 5.10 _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 59 ASP -5.02 -1.97 0 10 ILE 4.31 3.98 1 11 MET -1.68 -0.83 1 13 VAL -3.76 -3.65 1 14 LYS -0.76 -0.70 1 16 THR -0.78 -1.60 1 17 ASP 0.84 1.52 1 18 ASP -3.09 -2.03 1 19 LEU 4.18 2.97 1 20 LYS 5.66 4.11 1 21 THR 6.45 5.31 1 22 ILE 6.22 5.37 1 23 LYS 4.63 3.97 1 24 THR 5.95 5.00 1 25 ALA 3.87 2.90 1 26 TYR 3.74 2.84 1 27 ARG 4.44 3.05 1 28 ARG 4.22 3.40 1 29 LEU 1.96 2.61 1 30 ALA 4.67 2.53 1 31 ARG 3.36 2.29 1 32 LYS 2.30 2.59 1 33 TYR -1.22 -0.85 1 34 HIS 2.27 3.93 1 36 ASP 2.65 2.18 1 37 VAL -1.86 -0.30 1 38 SER 0.43 0.80 1 39 LYS -0.24 -1.29 1 40 GLU 0.34 0.24 1 42 ASP 0.70 -0.85 1 43 ALA 4.91 4.17 1 44 GLU 4.48 3.71 1 45 ALA 3.29 2.32 1 46 ARG 3.67 2.03 1 47 PHE 5.12 4.37 1 48 LYS 4.44 3.58 1 49 GLU 2.85 2.52 1 50 VAL 5.71 4.17 1 51 ALA 4.37 2.93 1 52 GLU 2.62 2.35 1 53 ALA 2.07 1.66 1 54 TRP 0.71 1.38 1 55 GLU 3.63 2.61 1 56 VAL 4.83 3.54 1 57 LEU 1.89 1.47 1 58 SER 1.83 0.40 1 60 GLU 4.11 3.85 1 61 GLN 4.36 3.14 1 62 ARG 4.12 3.56 1 63 ARG 5.90 4.45 1 64 ALA 4.03 2.78 1 65 GLU 2.77 2.70 1 66 TYR 4.27 3.88 1 67 ASP 4.49 3.45 1 68 GLN 4.19 3.22 1 69 MET 3.55 3.15 1 70 TRP 3.47 3.13 1 71 GLN 3.71 2.42 1 72 HIS 1.21 1.21 1 73 ARG 3.74 1.83 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16618_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.02 _LACS_plot.Line_1_terminator_val_y_1 1.93 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.36 _LACS_plot.Line_2_terminator_val_x_2 6.45 _LACS_plot.Line_2_terminator_val_y_2 -1.35 _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 59 ASP -5.02 3.05 0 10 ILE 4.31 -0.33 1 11 MET -1.68 0.85 1 13 VAL -3.76 0.11 1 14 LYS -0.76 0.06 1 16 THR -0.78 -0.82 1 17 ASP 0.84 0.68 1 18 ASP -3.09 1.06 1 19 LEU 4.18 -1.21 1 20 LYS 5.66 -1.55 1 21 THR 6.45 -1.14 1 22 ILE 6.22 -0.85 1 23 LYS 4.63 -0.66 1 24 THR 5.95 -0.95 1 25 ALA 3.87 -0.97 1 26 TYR 3.74 -0.90 1 27 ARG 4.44 -1.39 1 28 ARG 4.22 -0.82 1 29 LEU 1.96 0.65 1 30 ALA 4.67 -2.14 1 31 ARG 3.36 -1.07 1 32 LYS 2.30 0.29 1 33 TYR -1.22 0.37 1 34 HIS 2.27 1.66 1 36 ASP 2.65 -0.47 1 37 VAL -1.86 1.56 1 38 SER 0.43 0.37 1 39 LYS -0.24 -1.05 1 40 GLU 0.34 -0.10 1 42 ASP 0.70 -1.55 1 43 ALA 4.91 -0.74 1 44 GLU 4.48 -0.77 1 45 ALA 3.29 -0.97 1 46 ARG 3.67 -1.64 1 47 PHE 5.12 -0.75 1 48 LYS 4.44 -0.86 1 49 GLU 2.85 -0.33 1 50 VAL 5.71 -1.54 1 51 ALA 4.37 -1.44 1 52 GLU 2.62 -0.27 1 53 ALA 2.07 -0.41 1 54 TRP 0.71 0.67 1 55 GLU 3.63 -1.02 1 56 VAL 4.83 -1.29 1 57 LEU 1.89 -0.42 1 58 SER 1.83 -1.43 1 60 GLU 4.11 -0.26 1 61 GLN 4.36 -1.22 1 62 ARG 4.12 -0.56 1 63 ARG 5.90 -1.45 1 64 ALA 4.03 -1.25 1 65 GLU 2.77 -0.07 1 66 TYR 4.27 -0.39 1 67 ASP 4.49 -1.04 1 68 GLN 4.19 -0.97 1 69 MET 3.55 -0.40 1 70 TRP 3.47 -0.34 1 71 GLN 3.71 -1.29 1 72 HIS 1.21 0.00 1 73 ARG 3.74 -1.91 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16618_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.02 _LACS_plot.Line_1_terminator_val_y_1 0.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.07 _LACS_plot.Line_2_terminator_val_x_2 6.45 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 ALA 2.07 -1.59 0 10 ILE 4.31 -0.52 1 11 MET -1.68 -0.03 1 13 VAL -3.76 0.70 1 14 LYS -0.76 0.02 1 16 THR -0.78 -0.24 1 17 ASP 0.84 0.11 1 18 ASP -3.09 0.06 1 19 LEU 4.18 -0.22 1 20 LYS 5.66 -0.27 1 21 THR 6.45 -0.39 1 22 ILE 6.22 -0.44 1 23 LYS 4.63 -0.48 1 24 THR 5.95 -0.50 1 25 ALA 3.87 -0.16 1 26 TYR 3.74 -0.53 1 27 ARG 4.44 -0.91 1 28 ARG 4.22 -0.36 1 29 LEU 1.96 -0.31 1 30 ALA 4.67 -0.35 1 31 ARG 3.36 -0.27 1 32 LYS 2.30 -0.40 1 33 TYR -1.22 0.19 1 34 HIS 2.27 -0.34 1 36 ASP 2.65 -0.05 1 37 VAL -1.86 0.24 1 38 SER 0.43 -0.22 1 39 LYS -0.24 0.26 1 40 GLU 0.34 -0.10 1 42 ASP 0.70 0.07 1 43 ALA 4.91 -0.45 1 44 GLU 4.48 -0.39 1 45 ALA 3.29 -0.23 1 46 ARG 3.67 -0.41 1 47 PHE 5.12 -0.69 1 48 LYS 4.44 -0.37 1 49 GLU 2.85 -0.18 1 50 VAL 5.71 -0.62 1 51 ALA 4.37 -0.36 1 52 GLU 2.62 -0.53 1 54 TRP 0.71 -0.65 1 55 GLU 3.63 -1.07 1 56 VAL 4.83 -0.84 1 57 LEU 1.89 -0.74 1 58 SER 1.83 -1.01 1 59 ASP -5.02 0.12 1 60 GLU 4.11 -0.46 1 61 GLN 4.36 -0.11 1 62 ARG 4.12 -0.22 1 63 ARG 5.90 -0.59 1 64 ALA 4.03 0.00 1 65 GLU 2.77 -0.25 1 66 TYR 4.27 -0.18 1 67 ASP 4.49 -0.17 1 68 GLN 4.19 -0.22 1 69 MET 3.55 -0.32 1 70 TRP 3.47 -0.72 1 71 GLN 3.71 -0.47 1 72 HIS 1.21 -0.16 1 73 ARG 3.74 -0.36 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16618_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.02 _LACS_plot.Line_1_terminator_val_y_1 -5.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -4.23 _LACS_plot.Line_2_terminator_val_x_2 6.45 _LACS_plot.Line_2_terminator_val_y_2 -1.26 _LACS_plot.Y_axis_chem_shift_offset 3.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 59 ASP -5.02 -5.37 0 10 ILE 4.31 -3.00 1 11 MET -1.68 -4.68 1 13 VAL -3.76 -6.02 1 16 THR -0.78 -3.04 1 17 ASP 0.84 -4.18 1 18 ASP -3.09 -4.16 1 19 LEU 4.18 -2.92 1 20 LYS 5.66 -0.92 1 21 THR 6.45 -1.42 1 22 ILE 6.22 -3.36 1 23 LYS 4.63 -1.92 1 24 THR 5.95 -2.27 1 25 ALA 3.87 -2.41 1 26 TYR 3.74 -3.35 1 27 ARG 4.44 -0.65 1 28 ARG 4.22 -0.70 1 29 LEU 1.96 -2.72 1 30 ALA 4.67 -1.93 1 31 ARG 3.36 -2.37 1 32 LYS 2.30 -1.89 1 33 TYR -1.22 -6.62 1 36 ASP 2.65 -2.81 1 37 VAL -1.86 -3.89 1 38 SER 0.43 -2.44 1 39 LYS -0.24 -3.35 1 42 ASP 0.70 -3.87 1 43 ALA 4.91 -3.02 1 44 GLU 4.48 -1.77 1 45 ALA 3.29 -0.52 1 46 ARG 3.67 -0.74 1 47 PHE 5.12 -2.21 1 48 LYS 4.44 -0.92 1 49 GLU 2.85 -2.06 1 50 VAL 5.71 -3.12 1 51 ALA 4.37 -1.35 1 52 GLU 2.62 -2.86 1 53 ALA 2.07 -2.90 1 54 TRP 0.71 -2.19 1 55 GLU 3.63 -3.11 1 56 VAL 4.83 -4.57 1 57 LEU 1.89 -4.44 1 58 SER 1.83 -5.55 1 60 GLU 4.11 -1.43 1 61 GLN 4.36 -0.88 1 62 ARG 4.12 -0.14 1 63 ARG 5.90 -2.80 1 64 ALA 4.03 -0.28 1 65 GLU 2.77 -1.38 1 66 TYR 4.27 -2.77 1 67 ASP 4.49 -0.55 1 68 GLN 4.19 -1.51 1 69 MET 3.55 -1.13 1 70 TRP 3.47 -0.64 1 71 GLN 3.71 -2.45 1 72 HIS 1.21 -2.08 1 73 ARG 3.74 -4.28 1 stop_ save_