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 bmr18355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 -2.77 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.08 _LACS_plot.Line_2_terminator_val_x_2 7.78 _LACS_plot.Line_2_terminator_val_y_2 5.34 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 ARG 5.75 5.22 0 66 PHE 7.78 2.79 0 10 GLU -0.99 -0.14 1 11 VAL 0.38 0.05 1 12 THR -1.55 -0.68 1 15 ASP 2.95 2.25 1 16 ALA 4.33 2.91 1 17 ASP 4.13 3.14 1 18 ARG 4.43 2.92 1 19 ALA 4.05 2.50 1 21 ALA 3.45 2.20 1 22 ALA 1.54 1.84 1 23 ALA 2.51 2.77 1 24 VAL 4.37 2.85 1 25 GLN 3.27 2.33 1 26 ALA -0.47 0.18 1 27 VAL -1.29 -1.05 1 31 THR -1.45 -0.54 1 32 ALA -2.02 -0.64 1 34 GLU 0.74 1.29 1 35 VAL -3.17 -1.90 1 36 GLU -5.19 -2.52 1 37 THR -0.27 -0.36 1 38 GLU -2.26 -1.44 1 39 THR -0.65 -0.54 1 41 GLU -0.38 -0.21 1 43 ALA -0.18 0.19 1 44 ALA 0.57 0.23 1 45 ALA -2.34 -0.14 1 46 TYR -6.74 -1.95 1 48 VAL -4.39 -1.93 1 49 LEU 0.11 -0.03 1 50 VAL -2.62 -1.12 1 51 THR 0.50 0.16 1 52 ARG 2.59 2.27 1 54 ASP 0.35 -1.00 1 56 THR -0.12 0.68 1 57 ARG -3.82 -0.92 1 58 VAL -5.57 -2.54 1 59 GLU -2.08 -1.80 1 60 VAL -1.83 -0.89 1 61 HIS -1.50 0.04 1 62 LEU -6.72 -2.47 1 63 ASP -2.44 -1.60 1 64 ARG 3.26 2.04 1 65 ASP 0.45 0.55 1 67 ARG -0.21 -0.66 1 68 VAL 2.68 1.76 1 69 LEU -0.66 0.29 1 70 ASP -1.82 -0.40 1 71 THR -2.30 -1.36 1 72 GLU -3.25 -0.78 1 74 ALA -1.69 -0.94 1 75 ASP -0.31 0.30 1 77 ASP -0.30 0.20 1 80 LEU -0.06 0.09 1 81 GLU 0.10 1.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 3.97 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.92 _LACS_plot.Line_2_terminator_val_x_2 7.78 _LACS_plot.Line_2_terminator_val_y_2 -2.44 _LACS_plot.Y_axis_chem_shift_offset -0.16 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 ARG 5.75 -0.53 0 66 PHE 7.78 -4.99 0 10 GLU -0.99 0.85 1 11 VAL 0.38 -0.33 1 12 THR -1.55 0.87 1 15 ASP 2.95 -0.70 1 16 ALA 4.33 -1.42 1 17 ASP 4.13 -0.99 1 18 ARG 4.43 -1.51 1 19 ALA 4.05 -1.55 1 21 ALA 3.45 -1.25 1 22 ALA 1.54 0.30 1 23 ALA 2.51 0.26 1 24 VAL 4.37 -1.52 1 25 GLN 3.27 -0.94 1 26 ALA -0.47 0.65 1 27 VAL -1.29 0.24 1 31 THR -1.45 0.91 1 32 ALA -2.02 1.38 1 34 GLU 0.74 0.55 1 35 VAL -3.17 1.27 1 36 GLU -5.19 2.67 1 37 THR -0.27 -0.09 1 38 GLU -2.26 0.82 1 39 THR -0.65 0.11 1 41 GLU -0.38 0.17 1 43 ALA -0.18 0.37 1 44 ALA 0.57 -0.34 1 45 ALA -2.34 2.20 1 46 TYR -6.74 4.79 1 48 VAL -4.39 2.46 1 49 LEU 0.11 -0.14 1 50 VAL -2.62 1.50 1 51 THR 0.50 -0.34 1 52 ARG 2.59 -0.32 1 54 ASP 0.35 -1.35 1 56 THR -0.12 0.80 1 57 ARG -3.82 2.90 1 58 VAL -5.57 3.03 1 59 GLU -2.08 0.28 1 60 VAL -1.83 0.94 1 61 HIS -1.50 1.54 1 62 LEU -6.72 4.25 1 63 ASP -2.44 0.84 1 64 ARG 3.26 -1.22 1 65 ASP 0.45 0.10 1 67 ARG -0.21 -0.45 1 68 VAL 2.68 -0.92 1 69 LEU -0.66 0.95 1 70 ASP -1.82 1.42 1 71 THR -2.30 0.94 1 72 GLU -3.25 2.47 1 74 ALA -1.69 0.75 1 75 ASP -0.31 0.61 1 77 ASP -0.30 0.50 1 80 LEU -0.06 0.15 1 81 GLU 0.10 1.38 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 0.90 _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 0.25 _LACS_plot.Line_2_terminator_val_x_2 7.78 _LACS_plot.Line_2_terminator_val_y_2 -0.93 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 61 HIS -1.50 0.99 0 10 GLU -0.99 0.01 1 11 VAL 0.38 0.13 1 12 THR -1.55 0.15 1 15 ASP 2.95 -0.28 1 16 ALA 4.33 -0.48 1 17 ASP 4.13 -0.29 1 18 ARG 4.43 -0.61 1 19 ALA 4.05 -0.45 1 20 ARG 5.75 -0.73 1 21 ALA 3.45 -0.28 1 22 ALA 1.54 -0.17 1 23 ALA 2.51 -0.36 1 24 VAL 4.37 -0.39 1 25 GLN 3.27 -0.30 1 26 ALA -0.47 -0.01 1 27 VAL -1.29 -0.15 1 31 THR -1.45 0.17 1 32 ALA -2.02 0.29 1 34 GLU 0.74 -0.25 1 35 VAL -3.17 0.74 1 36 GLU -5.19 0.66 1 37 THR -0.27 0.26 1 38 GLU -2.26 0.12 1 39 THR -0.65 0.06 1 41 GLU -0.38 -0.11 1 43 ALA -0.18 -0.18 1 44 ALA 0.57 -0.39 1 45 ALA -2.34 0.02 1 46 TYR -6.74 0.94 1 48 VAL -4.39 0.76 1 49 LEU 0.11 0.40 1 50 VAL -2.62 0.56 1 51 THR 0.50 0.49 1 52 ARG 2.59 -0.42 1 54 ASP 0.35 -0.15 1 56 THR -0.12 0.01 1 57 ARG -3.82 1.08 1 58 VAL -5.57 0.47 1 59 GLU -2.08 0.49 1 60 VAL -1.83 0.17 1 62 LEU -6.72 1.37 1 63 ASP -2.44 0.26 1 64 ARG 3.26 -0.64 1 65 ASP 0.45 0.13 1 66 PHE 7.78 -0.97 1 67 ARG -0.21 0.09 1 68 VAL 2.68 -0.22 1 69 LEU -0.66 0.08 1 70 ASP -1.82 0.10 1 71 THR -2.30 0.63 1 72 GLU -3.25 0.34 1 74 ALA -1.69 0.20 1 75 ASP -0.31 0.01 1 77 ASP -0.30 0.01 1 80 LEU -0.06 0.04 1 81 GLU 0.10 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 -4.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.34 _LACS_plot.Line_2_terminator_val_x_2 7.78 _LACS_plot.Line_2_terminator_val_y_2 0.47 _LACS_plot.Y_axis_chem_shift_offset 2.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 PHE 7.78 -4.72 0 10 GLU -0.99 -2.80 1 11 VAL 0.38 -2.69 1 12 THR -1.55 -2.46 1 15 ASP 2.95 -1.55 1 16 ALA 4.33 -1.04 1 17 ASP 4.13 0.61 1 18 ARG 4.43 0.25 1 19 ALA 4.05 -1.25 1 20 ARG 5.75 -1.12 1 21 ALA 3.45 0.10 1 22 ALA 1.54 0.10 1 23 ALA 2.51 -1.44 1 24 VAL 4.37 -0.53 1 25 GLN 3.27 -1.39 1 26 ALA -0.47 -3.22 1 31 THR -1.45 -3.43 1 32 ALA -2.02 -3.81 1 34 GLU 0.74 -3.96 1 35 VAL -3.17 -3.64 1 36 GLU -5.19 -2.82 1 37 THR -0.27 -2.86 1 38 GLU -2.26 -3.18 1 39 THR -0.65 -2.27 1 41 GLU -0.38 -2.04 1 43 ALA -0.18 -2.43 1 44 ALA 0.57 -4.57 1 45 ALA -2.34 -3.22 1 46 TYR -6.74 -3.85 1 48 VAL -4.39 -4.23 1 49 LEU 0.11 -3.80 1 50 VAL -2.62 -4.09 1 51 THR 0.50 -1.96 1 52 ARG 2.59 -0.89 1 54 ASP 0.35 -1.72 1 56 THR -0.12 -3.62 1 57 ARG -3.82 -2.69 1 58 VAL -5.57 -5.84 1 59 GLU -2.08 -4.39 1 60 VAL -1.83 -3.47 1 61 HIS -1.50 -2.43 1 62 LEU -6.72 -3.02 1 63 ASP -2.44 -1.72 1 64 ARG 3.26 -2.90 1 65 ASP 0.45 -3.85 1 67 ARG -0.21 -1.72 1 68 VAL 2.68 -2.10 1 69 LEU -0.66 -3.40 1 70 ASP -1.82 -4.42 1 71 THR -2.30 -3.62 1 72 GLU -3.25 -4.23 1 74 ALA -1.69 -3.41 1 75 ASP -0.31 -2.10 1 77 ASP -0.30 -1.74 1 80 LEU -0.06 -3.40 1 stop_ save_