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 bmr11431_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.78 _LACS_plot.Line_1_terminator_val_y_1 -2.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 9.27 _LACS_plot.Line_2_terminator_val_y_2 7.06 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 SER -3.78 -1.83 0 55 LYS 9.27 7.26 0 45 GLU 2.63 3.90 0 10 LYS -1.01 -0.76 1 11 ARG 1.65 0.53 1 15 ALA 3.72 3.46 1 16 PHE 2.04 1.16 1 17 PHE 4.92 4.21 1 18 LEU 3.30 3.04 1 19 PHE 4.14 3.81 1 21 SER 4.51 3.13 1 22 GLU 1.61 1.42 1 23 TYR 3.14 3.80 1 24 ARG 3.57 2.87 1 26 LYS 4.08 3.10 1 27 ILE 3.80 2.26 1 28 LYS 3.28 2.46 1 29 SER 0.14 0.99 1 30 GLU -0.93 -0.84 1 31 HIS -0.42 0.23 1 34 LEU -2.18 -0.85 1 35 SER 4.96 4.18 1 36 ILE 4.05 2.94 1 38 ASP 4.34 3.13 1 40 ALA 3.62 3.32 1 41 LYS 3.64 2.30 1 42 LYS 4.34 3.46 1 43 LEU 3.27 2.61 1 46 MET 0.69 1.97 1 47 TRP 3.53 2.73 1 48 SER -0.79 -0.50 1 49 GLU -0.75 -0.53 1 50 GLN -1.99 -0.85 1 51 SER 4.67 3.35 1 52 ALA 3.81 2.89 1 53 LYS 2.90 2.34 1 54 ASP 2.28 3.09 1 56 GLN 4.15 3.76 1 58 TYR 3.38 2.83 1 59 GLU 4.43 3.29 1 60 GLN 3.94 3.56 1 61 LYS 4.54 3.32 1 62 ALA 4.14 3.01 1 63 ALA 3.89 2.69 1 64 LYS 3.32 2.64 1 65 LEU 4.86 3.89 1 66 LYS 3.07 2.83 1 67 GLU 3.79 3.16 1 68 LYS 3.65 3.32 1 69 TYR 3.66 2.63 1 70 GLU 3.62 2.98 1 71 LYS 4.27 2.99 1 72 ASP 2.73 1.07 1 73 ILE 3.08 2.05 1 74 ALA 1.41 1.09 1 75 ALA 1.81 1.85 1 76 TYR 0.24 0.19 1 77 ARG -0.03 0.14 1 78 ALA 1.10 1.61 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11431_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.78 _LACS_plot.Line_1_terminator_val_y_1 1.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.75 _LACS_plot.Line_2_terminator_val_x_2 9.27 _LACS_plot.Line_2_terminator_val_y_2 -2.21 _LACS_plot.Y_axis_chem_shift_offset -0.27 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 SER -3.78 1.95 0 55 LYS 9.27 -2.01 0 45 GLU 2.63 1.27 0 10 LYS -1.01 0.25 1 11 ARG 1.65 -1.12 1 15 ALA 3.72 -0.26 1 16 PHE 2.04 -0.88 1 17 PHE 4.92 -0.71 1 18 LEU 3.30 -0.26 1 19 PHE 4.14 -0.33 1 21 SER 4.51 -1.38 1 22 GLU 1.61 -0.19 1 23 TYR 3.14 0.66 1 24 ARG 3.57 -0.70 1 26 LYS 4.08 -0.98 1 27 ILE 3.80 -1.54 1 28 LYS 3.28 -0.82 1 29 SER 0.14 0.85 1 30 GLU -0.93 0.09 1 31 HIS -0.42 0.65 1 34 LEU -2.18 1.33 1 35 SER 4.96 -0.78 1 36 ILE 4.05 -1.11 1 38 ASP 4.34 -1.21 1 40 ALA 3.62 -0.30 1 41 LYS 3.64 -1.34 1 42 LYS 4.34 -0.88 1 43 LEU 3.27 -0.66 1 46 MET 0.69 1.28 1 47 TRP 3.53 -0.80 1 48 SER -0.79 0.29 1 49 GLU -0.75 0.22 1 50 GLN -1.99 1.14 1 51 SER 4.67 -1.32 1 52 ALA 3.81 -0.92 1 53 LYS 2.90 -0.56 1 54 ASP 2.28 0.81 1 56 GLN 4.15 -0.39 1 58 TYR 3.38 -0.55 1 59 GLU 4.43 -1.14 1 60 GLN 3.94 -0.38 1 61 LYS 4.54 -1.22 1 62 ALA 4.14 -1.13 1 63 ALA 3.89 -1.20 1 64 LYS 3.32 -0.68 1 65 LEU 4.86 -0.97 1 66 LYS 3.07 -0.24 1 67 GLU 3.79 -0.63 1 68 LYS 3.65 -0.33 1 69 TYR 3.66 -1.03 1 70 GLU 3.62 -0.64 1 71 LYS 4.27 -1.28 1 72 ASP 2.73 -1.66 1 73 ILE 3.08 -1.03 1 74 ALA 1.41 -0.32 1 75 ALA 1.81 0.04 1 76 TYR 0.24 -0.05 1 77 ARG -0.03 0.17 1 78 ALA 1.10 0.51 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11431_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.78 _LACS_plot.Line_1_terminator_val_y_1 -0.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.08 _LACS_plot.Line_2_terminator_val_x_2 9.27 _LACS_plot.Line_2_terminator_val_y_2 -0.34 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 11 ARG 1.65 -1.24 0 10 LYS -1.01 -0.03 1 14 SER -3.78 0.01 1 15 ALA 3.72 -0.27 1 16 PHE 2.04 -0.18 1 17 PHE 4.92 -0.92 1 18 LEU 3.30 -0.25 1 19 PHE 4.14 -0.83 1 21 SER 4.51 -0.59 1 22 GLU 1.61 -0.27 1 23 TYR 3.14 -0.47 1 24 ARG 3.57 -0.21 1 26 LYS 4.08 -0.17 1 27 ILE 3.80 -0.28 1 28 LYS 3.28 -0.28 1 29 SER 0.14 -0.31 1 30 GLU -0.93 -0.01 1 31 HIS -0.42 0.01 1 34 LEU -2.18 0.00 1 35 SER 4.96 -0.30 1 36 ILE 4.05 -0.07 1 38 ASP 4.34 -0.18 1 40 ALA 3.62 -0.21 1 41 LYS 3.64 -0.08 1 42 LYS 4.34 -0.03 1 43 LEU 3.27 -0.28 1 45 GLU 2.63 -0.37 1 46 MET 0.69 -0.80 1 47 TRP 3.53 -0.44 1 48 SER -0.79 -0.17 1 49 GLU -0.75 -0.11 1 50 GLN -1.99 -0.16 1 51 SER 4.67 -0.42 1 52 ALA 3.81 -0.25 1 53 LYS 2.90 0.00 1 54 ASP 2.28 0.02 1 55 LYS 9.27 -0.29 1 56 GLN 4.15 -0.29 1 58 TYR 3.38 -0.08 1 59 GLU 4.43 -0.14 1 60 GLN 3.94 -0.21 1 61 LYS 4.54 -0.31 1 62 ALA 4.14 -0.05 1 63 ALA 3.89 -0.08 1 64 LYS 3.32 -0.11 1 65 LEU 4.86 -0.25 1 66 LYS 3.07 -0.21 1 67 GLU 3.79 -0.21 1 68 LYS 3.65 -0.13 1 69 TYR 3.66 -0.58 1 70 GLU 3.62 -0.21 1 71 LYS 4.27 -0.20 1 72 ASP 2.73 -0.20 1 73 ILE 3.08 -0.16 1 74 ALA 1.41 -0.07 1 75 ALA 1.81 -0.25 1 76 TYR 0.24 -0.20 1 77 ARG -0.03 -0.09 1 78 ALA 1.10 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11431_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.78 _LACS_plot.Line_1_terminator_val_y_1 -0.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.33 _LACS_plot.Line_2_terminator_val_x_2 9.27 _LACS_plot.Line_2_terminator_val_y_2 2.29 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 SER 4.67 -4.37 0 14 SER -3.78 0.22 0 55 LYS 9.27 3.20 0 10 LYS -1.01 -1.60 1 11 ARG 1.65 0.39 1 15 ALA 3.72 -4.21 1 16 PHE 2.04 1.76 1 17 PHE 4.92 0.50 1 18 LEU 3.30 0.40 1 19 PHE 4.14 0.29 1 21 SER 4.51 0.79 1 22 GLU 1.61 -2.24 1 23 TYR 3.14 1.05 1 24 ARG 3.57 1.69 1 26 LYS 4.08 1.52 1 27 ILE 3.80 0.54 1 28 LYS 3.28 2.66 1 29 SER 0.14 -1.52 1 30 GLU -0.93 2.87 1 31 HIS -0.42 -3.83 1 34 LEU -2.18 2.47 1 35 SER 4.96 -0.94 1 36 ILE 4.05 -0.20 1 38 ASP 4.34 -3.67 1 40 ALA 3.62 3.53 1 41 LYS 3.64 1.61 1 42 LYS 4.34 0.29 1 43 LEU 3.27 -0.60 1 45 GLU 2.63 2.15 1 46 MET 0.69 2.45 1 47 TRP 3.53 2.51 1 48 SER -0.79 -2.31 1 49 GLU -0.75 -0.31 1 50 GLN -1.99 0.78 1 52 ALA 3.81 3.47 1 53 LYS 2.90 1.23 1 54 ASP 2.28 1.16 1 56 GLN 4.15 3.13 1 58 TYR 3.38 0.50 1 59 GLU 4.43 3.48 1 60 GLN 3.94 1.36 1 61 LYS 4.54 0.15 1 62 ALA 4.14 0.15 1 63 ALA 3.89 3.20 1 64 LYS 3.32 1.80 1 65 LEU 4.86 2.56 1 66 LYS 3.07 -0.22 1 67 GLU 3.79 1.53 1 68 LYS 3.65 0.69 1 69 TYR 3.66 -0.90 1 70 GLU 3.62 2.47 1 71 LYS 4.27 1.87 1 72 ASP 2.73 2.52 1 73 ILE 3.08 -1.33 1 74 ALA 1.41 0.78 1 75 ALA 1.81 1.86 1 76 TYR 0.24 -0.92 1 77 ARG -0.03 -3.23 1 stop_ save_