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 bmr6355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.69 _LACS_plot.Line_1_terminator_val_y_1 -1.74 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.04 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.06 _LACS_plot.Line_2_terminator_val_x_2 5.87 _LACS_plot.Line_2_terminator_val_y_2 4.85 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 ASP 0.43 -0.98 0 10 ASP 3.89 3.54 1 11 GLN 2.97 3.70 1 12 VAL 5.59 4.44 1 13 ALA 4.61 3.49 1 14 GLU 3.34 3.07 1 15 VAL 5.77 4.64 1 16 ILE 5.88 3.82 1 17 GLU 3.34 3.07 1 18 ARG 3.57 2.97 1 19 LEU 0.34 0.95 1 20 ARG 3.24 2.48 1 22 PHE 3.09 2.60 1 23 LEU 2.40 1.94 1 24 LEU 3.21 3.19 1 25 ARG -0.39 0.15 1 26 ASP -3.50 -0.85 1 29 ASP -2.44 -0.18 1 31 THR 0.39 0.51 1 32 LEU 2.63 2.63 1 33 VAL -3.58 0.00 1 34 ASP -1.58 0.00 1 35 VAL -3.29 -0.63 1 36 GLU 2.79 1.78 1 39 ILE -0.34 0.05 1 40 VAL -1.28 -0.76 1 41 LYS -5.69 -1.79 1 42 LEU -2.72 -0.99 1 43 GLN -3.17 -1.11 1 44 LEU -3.32 0.01 1 45 HIS 0.36 0.81 1 47 ALA 0.37 0.74 1 50 THR 2.58 2.03 1 53 SER 1.61 1.64 1 54 SER 4.09 3.34 1 55 THR 4.00 3.48 1 56 ILE 4.25 3.46 1 57 THR 2.98 3.08 1 58 LEU 5.02 4.60 1 59 LYS 3.39 2.69 1 60 ALA 4.39 4.29 1 62 ILE 3.94 4.35 1 63 GLU 4.50 3.87 1 64 ARG 3.00 2.83 1 65 ALA 3.40 3.20 1 66 LEU 3.89 3.70 1 67 HIS 1.68 2.30 1 68 GLU -1.81 1.60 1 69 GLU 0.36 -0.08 1 70 VAL 3.13 2.16 1 73 VAL 0.66 1.42 1 74 ILE -5.59 -1.40 1 75 GLU -1.81 -1.18 1 76 VAL -5.63 -2.01 1 77 GLU -0.89 -0.64 1 78 GLN -3.66 -2.19 1 79 VAL -1.01 -0.21 1 80 PHE -0.54 0.07 1 81 LEU -0.41 0.32 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.69 _LACS_plot.Line_1_terminator_val_y_1 3.95 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.95 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.94 _LACS_plot.Line_2_terminator_val_x_2 5.87 _LACS_plot.Line_2_terminator_val_y_2 -1.02 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 37 ASP 0.43 -1.41 0 10 ASP 3.89 -0.35 1 11 GLN 2.97 0.73 1 12 VAL 5.59 -1.15 1 13 ALA 4.61 -1.12 1 14 GLU 3.34 -0.27 1 15 VAL 5.77 -1.13 1 16 ILE 5.88 -2.06 1 17 GLU 3.34 -0.27 1 18 ARG 3.57 -0.60 1 19 LEU 0.34 0.61 1 20 ARG 3.24 -0.76 1 22 PHE 3.09 -0.49 1 23 LEU 2.40 -0.46 1 24 LEU 3.21 -0.02 1 25 ARG -0.39 0.54 1 26 ASP -3.50 2.65 1 29 ASP -2.44 2.26 1 31 THR 0.39 0.12 1 32 LEU 2.63 0.00 1 33 VAL -3.58 3.58 1 34 ASP -1.58 1.58 1 35 VAL -3.29 2.66 1 36 GLU 2.79 -1.01 1 39 ILE -0.34 0.39 1 40 VAL -1.28 0.52 1 41 LYS -5.69 3.90 1 42 LEU -2.72 1.73 1 43 GLN -3.17 2.06 1 44 LEU -3.32 3.33 1 45 HIS 0.36 0.45 1 47 ALA 0.37 0.37 1 50 THR 2.58 -0.55 1 53 SER 1.61 0.03 1 54 SER 4.09 -0.75 1 55 THR 4.00 -0.52 1 56 ILE 4.25 -0.79 1 57 THR 2.98 0.10 1 58 LEU 5.02 -0.42 1 59 LYS 3.39 -0.70 1 60 ALA 4.39 -0.10 1 62 ILE 3.94 0.41 1 63 GLU 4.50 -0.63 1 64 ARG 3.00 -0.17 1 65 ALA 3.40 -0.20 1 66 LEU 3.89 -0.19 1 67 HIS 1.68 0.62 1 68 GLU -1.81 3.41 1 69 GLU 0.36 -0.44 1 70 VAL 3.13 -0.97 1 73 VAL 0.66 0.76 1 74 ILE -5.59 4.19 1 75 GLU -1.81 0.63 1 76 VAL -5.63 3.62 1 77 GLU -0.89 0.25 1 78 GLN -3.66 1.47 1 79 VAL -1.01 0.80 1 80 PHE -0.54 0.61 1 81 LEU -0.41 0.73 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.69 _LACS_plot.Line_1_terminator_val_y_1 0.60 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _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 5.87 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _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 40 VAL -1.28 0.93 0 10 ASP 3.89 -0.26 1 11 GLN 2.97 -0.22 1 12 VAL 5.59 -0.76 1 13 ALA 4.61 -0.64 1 14 GLU 3.34 -0.31 1 15 VAL 5.77 -0.57 1 16 ILE 5.88 -0.71 1 17 GLU 3.34 -0.31 1 18 ARG 3.57 -0.25 1 19 LEU 0.34 0.15 1 20 ARG 3.24 -0.34 1 22 PHE 3.09 -0.23 1 23 LEU 2.40 0.14 1 24 LEU 3.21 -0.20 1 25 ARG -0.39 0.25 1 26 ASP -3.50 0.07 1 29 ASP -2.44 0.18 1 31 THR 0.39 -0.11 1 32 LEU 2.63 -0.04 1 33 VAL -3.58 0.38 1 34 ASP -1.58 0.80 1 35 VAL -3.29 0.23 1 36 GLU 2.79 -0.32 1 37 ASP 0.43 0.43 1 39 ILE -0.34 0.09 1 41 LYS -5.69 0.76 1 42 LEU -2.72 0.51 1 43 GLN -3.17 0.57 1 44 LEU -3.32 0.10 1 45 HIS 0.36 -0.03 1 47 ALA 0.37 0.01 1 50 THR 2.58 -0.10 1 53 SER 1.61 0.05 1 54 SER 4.09 -0.23 1 55 THR 4.00 -0.27 1 56 ILE 4.25 -0.25 1 57 THR 2.98 -0.16 1 58 LEU 5.02 -0.64 1 59 LYS 3.39 -0.06 1 60 ALA 4.39 -0.56 1 62 ILE 3.94 -0.73 1 63 GLU 4.50 -0.23 1 64 ARG 3.00 -0.10 1 65 ALA 3.40 -0.38 1 66 LEU 3.89 -0.30 1 67 HIS 1.68 -0.26 1 68 GLU -1.81 0.09 1 69 GLU 0.36 0.07 1 70 VAL 3.13 -0.34 1 73 VAL 0.66 0.05 1 74 ILE -5.59 0.35 1 75 GLU -1.81 0.65 1 76 VAL -5.63 0.25 1 77 GLU -0.89 0.58 1 78 GLN -3.66 0.30 1 79 VAL -1.01 0.17 1 80 PHE -0.54 0.03 1 81 LEU -0.41 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6355_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.69 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 5.87 _LACS_plot.Line_2_terminator_val_y_2 2.52 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 45 HIS -3.32 0.40 0 32 LEU 0.39 -2.73 0 10 ASP 3.89 3.10 1 11 GLN 2.97 3.20 1 12 VAL 5.59 1.02 1 13 ALA 4.61 2.30 1 14 GLU 3.34 2.30 1 15 VAL 5.77 1.90 1 16 ILE 5.88 1.40 1 17 GLU 3.34 2.70 1 18 ARG 3.57 2.20 1 19 LEU 0.34 1.30 1 22 PHE 3.24 2.10 1 23 LEU 3.09 2.10 1 24 LEU 2.40 3.10 1 25 ARG 3.21 0.70 1 26 ASP -0.39 -0.20 1 29 ASP -3.50 -2.10 1 31 THR -2.44 -1.40 1 33 VAL 2.63 -0.80 1 34 ASP -3.58 -2.10 1 35 VAL -1.58 -1.90 1 36 GLU -3.29 -0.80 1 37 ASP 2.79 -0.90 1 39 ILE 0.43 -0.50 1 40 VAL -0.34 -2.30 1 41 LYS -1.28 -1.60 1 42 LEU -5.69 -2.20 1 43 GLN -2.72 -1.00 1 44 LEU -3.17 -2.64 1 47 ALA 0.36 0.52 1 50 THR 0.37 -0.25 1 53 SER 2.58 1.20 1 54 SER 1.61 1.50 1 55 THR 4.09 0.90 1 56 ILE 4.00 1.70 1 57 THR 4.25 2.30 1 58 LEU 2.98 0.90 1 59 LYS 5.02 1.30 1 60 ALA 3.39 3.20 1 62 ILE 4.39 0.78 1 63 GLU 3.94 1.20 1 64 ARG 4.50 2.20 1 65 ALA 3.00 2.40 1 66 LEU 3.40 0.60 1 67 HIS 3.89 3.20 1 68 GLU 1.68 1.70 1 69 GLU -1.81 -0.10 1 73 VAL 3.13 -0.40 1 74 ILE 0.66 0.20 1 75 GLU -5.59 -3.20 1 76 VAL -1.81 -2.10 1 77 GLU -5.63 -2.00 1 78 GLN -0.89 -0.80 1 79 VAL -3.66 -1.90 1 80 PHE -1.01 -0.40 1 81 LEU -0.54 -0.80 1 82 GLU -0.41 -0.50 1 stop_ save_