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 bmr30474_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -1.88 _LACS_plot.Line_1_terminator_val_y_1 -1.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.62 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.47 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 5.00 _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 13 HIS 1.55 3.10 0 10 GLU 2.82 2.21 1 11 ARG 4.78 3.40 1 12 ALA 3.17 2.19 1 14 ARG 4.66 3.77 1 15 GLU 3.46 2.57 1 16 GLN 2.11 2.45 1 17 LYS 4.64 3.76 1 18 GLU 2.58 2.13 1 19 ILE 4.78 3.22 1 21 LYS 3.84 3.10 1 22 LYS 3.48 2.34 1 23 ALA 3.43 2.60 1 26 LEU 3.10 2.51 1 28 ARG 4.27 2.87 1 29 ARG 3.29 2.05 1 30 LEU 2.94 2.22 1 31 GLU 3.79 3.14 1 32 GLU 2.44 2.40 1 33 ILE 3.75 3.56 1 34 VAL 4.65 3.49 1 35 ARG 2.67 2.63 1 36 GLN 0.17 0.40 1 37 SER 0.73 0.63 1 39 SER -0.72 -0.62 1 40 SER -1.88 -1.29 1 41 GLU 2.81 2.33 1 42 GLU 3.33 2.61 1 43 ALA 2.08 1.80 1 44 LYS 3.99 3.52 1 45 LYS 3.76 3.08 1 46 GLU 2.75 1.96 1 47 ALA 3.03 2.34 1 48 LYS 3.89 3.20 1 49 LYS 3.48 2.57 1 50 ILE 4.92 4.06 1 51 LEU 4.18 3.23 1 52 GLU 2.97 2.20 1 53 GLU 3.12 2.86 1 54 ILE 6.39 5.07 1 55 ARG 5.02 4.23 1 56 GLU 2.99 2.44 1 57 LEU 3.77 2.49 1 58 SER 4.32 3.28 1 62 LEU 3.13 2.11 1 63 GLU 2.67 2.37 1 64 LEU 1.96 2.22 1 65 LEU 3.48 2.73 1 66 ARG 4.81 3.73 1 67 GLU 3.12 2.54 1 68 ILE 4.51 3.96 1 69 LEU 2.13 1.76 1 70 TYR 2.68 1.36 1 71 LEU 2.02 1.76 1 72 SER 1.32 1.04 1 73 GLN 0.54 0.57 1 74 GLU 0.18 0.36 1 75 GLN 0.30 0.08 1 76 LYS 0.08 -0.11 1 78 SER -0.59 -0.40 1 79 LEU -0.30 -0.32 1 80 VAL -0.67 -0.53 1 82 ARG 0.06 0.90 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30474_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -1.88 _LACS_plot.Line_1_terminator_val_y_1 0.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.38 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.53 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -1.39 _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 13 HIS 1.55 1.55 0 10 GLU 2.82 -0.61 1 11 ARG 4.78 -1.38 1 12 ALA 3.17 -0.98 1 14 ARG 4.66 -0.89 1 15 GLU 3.46 -0.89 1 16 GLN 2.11 0.34 1 17 LYS 4.64 -0.88 1 18 GLU 2.58 -0.45 1 19 ILE 4.78 -1.56 1 21 LYS 3.84 -0.74 1 22 LYS 3.48 -1.14 1 23 ALA 3.43 -0.83 1 26 LEU 3.10 -0.59 1 28 ARG 4.27 -1.40 1 29 ARG 3.29 -1.24 1 30 LEU 2.94 -0.72 1 31 GLU 3.79 -0.65 1 32 GLU 2.44 -0.04 1 33 ILE 3.75 -0.19 1 34 VAL 4.65 -1.16 1 35 ARG 2.67 -0.04 1 36 GLN 0.17 0.23 1 37 SER 0.73 -0.10 1 39 SER -0.72 0.10 1 40 SER -1.88 0.59 1 41 GLU 2.81 -0.48 1 42 GLU 3.33 -0.72 1 43 ALA 2.08 -0.28 1 44 LYS 3.99 -0.47 1 45 LYS 3.76 -0.68 1 46 GLU 2.75 -0.79 1 47 ALA 3.03 -0.69 1 48 LYS 3.89 -0.69 1 49 LYS 3.48 -0.91 1 50 ILE 4.92 -0.86 1 51 LEU 4.18 -0.95 1 52 GLU 2.97 -0.77 1 53 GLU 3.12 -0.26 1 54 ILE 6.39 -1.32 1 55 ARG 5.02 -0.79 1 56 GLU 2.99 -0.55 1 57 LEU 3.77 -1.28 1 58 SER 4.32 -1.04 1 62 LEU 3.13 -1.02 1 63 GLU 2.67 -0.30 1 64 LEU 1.96 0.26 1 65 LEU 3.48 -0.75 1 66 ARG 4.81 -1.08 1 67 GLU 3.12 -0.58 1 68 ILE 4.51 -0.55 1 69 LEU 2.13 -0.37 1 70 TYR 2.68 -1.32 1 71 LEU 2.02 -0.26 1 72 SER 1.32 -0.28 1 73 GLN 0.54 0.03 1 74 GLU 0.18 0.18 1 75 GLN 0.30 -0.22 1 76 LYS 0.08 -0.19 1 78 SER -0.59 0.19 1 79 LEU -0.30 -0.02 1 80 VAL -0.67 0.14 1 82 ARG 0.06 0.84 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30474_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -1.88 _LACS_plot.Line_1_terminator_val_y_1 0.12 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.14 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 GLU 3.79 -0.71 0 10 GLU 2.82 -0.14 1 11 ARG 4.78 -0.36 1 12 ALA 3.17 -0.09 1 13 HIS 1.55 -0.36 1 14 ARG 4.66 -0.52 1 15 GLU 3.46 -0.29 1 16 GLN 2.11 -0.02 1 17 LYS 4.64 -0.51 1 18 GLU 2.58 -0.25 1 19 ILE 4.78 -0.34 1 21 LYS 3.84 -0.08 1 22 LYS 3.48 -0.16 1 23 ALA 3.43 -0.32 1 26 LEU 3.10 -0.22 1 28 ARG 4.27 -0.11 1 29 ARG 3.29 -0.16 1 30 LEU 2.94 -0.29 1 32 GLU 2.44 -0.36 1 33 ILE 3.75 -0.42 1 34 VAL 4.65 -0.48 1 35 ARG 2.67 -0.13 1 36 GLN 0.17 0.09 1 37 SER 0.73 0.01 1 39 SER -0.72 -0.02 1 40 SER -1.88 0.15 1 41 GLU 2.81 -0.28 1 42 GLU 3.33 -0.32 1 43 ALA 2.08 -0.07 1 44 LYS 3.99 -0.49 1 45 LYS 3.76 -0.31 1 46 GLU 2.75 -0.27 1 47 ALA 3.03 -0.44 1 48 LYS 3.89 -0.43 1 49 LYS 3.48 -0.21 1 50 ILE 4.92 -0.37 1 51 LEU 4.18 -0.50 1 52 GLU 2.97 -0.28 1 53 GLU 3.12 -0.18 1 54 ILE 6.39 -0.63 1 55 ARG 5.02 -0.60 1 56 GLU 2.99 -0.20 1 57 LEU 3.77 -0.19 1 58 SER 4.32 -0.25 1 62 LEU 3.13 -0.22 1 63 GLU 2.67 -0.40 1 64 LEU 1.96 -0.23 1 65 LEU 3.48 -0.24 1 66 ARG 4.81 -0.62 1 67 GLU 3.12 -0.32 1 68 ILE 4.51 -0.53 1 69 LEU 2.13 -0.23 1 70 TYR 2.68 -0.14 1 71 LEU 2.02 -0.23 1 72 SER 1.32 -0.19 1 73 GLN 0.54 -0.07 1 74 GLU 0.18 -0.19 1 75 GLN 0.30 -0.10 1 76 LYS 0.08 -0.02 1 78 SER -0.59 -0.01 1 79 LEU -0.30 0.04 1 80 VAL -0.67 -0.03 1 82 ARG 0.06 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30474_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -1.88 _LACS_plot.Line_1_terminator_val_y_1 -0.04 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.03 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 3.25 _LACS_plot.Y_axis_chem_shift_offset -0.77 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 SER 1.32 5.02 0 10 GLU 2.82 2.73 1 11 ARG 4.78 2.76 1 12 ALA 3.17 1.40 1 13 HIS 1.55 3.11 1 14 ARG 4.66 3.13 1 15 GLU 3.46 1.87 1 16 GLN 2.11 2.19 1 17 LYS 4.64 3.11 1 18 GLU 2.58 2.97 1 21 LYS 3.84 3.06 1 22 LYS 3.48 2.53 1 28 ARG 4.27 2.84 1 29 ARG 3.29 2.22 1 30 LEU 2.94 0.14 1 31 GLU 3.79 0.96 1 32 GLU 2.44 2.59 1 33 ILE 3.75 2.60 1 34 VAL 4.65 1.90 1 35 ARG 2.67 1.73 1 36 GLN 0.17 1.23 1 37 SER 0.73 0.82 1 39 SER -0.72 -0.07 1 40 SER -1.88 0.69 1 41 GLU 2.81 2.76 1 42 GLU 3.33 2.45 1 43 ALA 2.08 1.86 1 44 LYS 3.99 2.65 1 45 LYS 3.76 2.92 1 46 GLU 2.75 2.00 1 47 ALA 3.03 0.89 1 48 LYS 3.89 1.60 1 49 LYS 3.48 3.12 1 50 ILE 4.92 1.71 1 51 LEU 4.18 1.44 1 52 GLU 2.97 2.64 1 53 GLU 3.12 3.15 1 54 ILE 6.39 2.12 1 55 ARG 5.02 2.97 1 56 GLU 2.99 3.07 1 57 LEU 3.77 1.64 1 62 LEU 3.13 0.76 1 63 GLU 2.67 3.28 1 64 LEU 1.96 1.16 1 65 LEU 3.48 1.08 1 66 ARG 4.81 1.92 1 67 GLU 3.12 2.21 1 69 LEU 2.13 1.66 1 70 TYR 2.68 2.08 1 71 LEU 2.02 0.77 1 73 GLN 0.54 0.65 1 74 GLU 0.18 0.48 1 75 GLN 0.30 0.28 1 76 LYS 0.08 0.60 1 78 SER -0.59 -0.16 1 79 LEU -0.30 -0.70 1 stop_ save_