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 bmr6452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.72 _LACS_plot.Line_1_terminator_val_y_1 -2.61 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 5.17 _LACS_plot.Y_axis_chem_shift_offset -0.34 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 HIS 6.55 6.71 0 23 ASP 4.40 0.00 0 16 PHE -5.72 -3.02 1 17 ARG -5.11 -1.86 1 18 LEU -5.29 -1.39 1 19 VAL -5.31 -2.22 1 22 LYS 3.81 3.50 1 24 PHE -0.75 0.35 1 25 GLU 2.97 0.69 1 26 GLN -4.66 -0.88 1 28 LEU -0.47 -0.26 1 29 ALA -6.72 -2.43 1 31 SER -1.24 -0.10 1 32 ARG -2.96 0.59 1 33 VAL -2.70 -0.48 1 34 THR 1.34 1.63 1 37 SER -3.50 -0.42 1 38 LYS 4.68 4.30 1 39 ALA 1.87 2.90 1 40 ALA 3.27 2.54 1 41 LEU 3.21 2.19 1 42 ALA -0.92 -0.70 1 43 ASN 3.19 1.59 1 44 LEU 0.68 0.56 1 46 ILE 4.09 2.97 1 48 ASP 2.07 1.92 1 50 ILE -0.39 -1.92 1 51 THR 2.75 1.32 1 52 ALA -1.69 0.37 1 53 ILE -3.64 -0.64 1 54 ASP 2.52 1.16 1 56 GLU -2.30 -1.65 1 57 ASN 0.96 1.22 1 58 THR 0.09 0.12 1 60 ASN -1.46 -0.76 1 61 MET -0.65 0.94 1 62 THR -1.42 -0.09 1 64 LEU 2.70 2.68 1 65 GLU 2.95 2.88 1 66 ALA 2.61 3.03 1 67 GLN 4.00 3.60 1 68 ASN 3.82 2.49 1 69 ARG 3.19 2.19 1 70 ILE 4.49 4.02 1 71 LYS 3.03 2.67 1 74 THR 1.05 0.81 1 75 ASP 0.72 1.30 1 78 THR -0.84 -0.43 1 79 LEU -5.29 -2.23 1 80 THR 2.16 0.95 1 81 VAL -5.61 -3.02 1 82 ALA -4.24 -2.08 1 83 ARG -3.55 -0.92 1 84 SER -0.46 -0.07 1 85 GLU -0.45 0.22 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.72 _LACS_plot.Line_1_terminator_val_y_1 4.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.77 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -1.37 _LACS_plot.Y_axis_chem_shift_offset -0.34 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 HIS 6.55 0.16 0 23 ASP 4.40 -4.40 0 16 PHE -5.72 2.70 1 17 ARG -5.11 3.25 1 18 LEU -5.29 3.90 1 19 VAL -5.31 3.09 1 22 LYS 3.81 -0.31 1 24 PHE -0.75 1.10 1 25 GLU 2.97 -2.28 1 26 GLN -4.66 3.78 1 28 LEU -0.47 0.21 1 29 ALA -6.72 4.29 1 31 SER -1.24 1.14 1 32 ARG -2.96 3.55 1 33 VAL -2.70 2.22 1 34 THR 1.34 0.29 1 37 SER -3.50 3.08 1 38 LYS 4.68 -0.38 1 39 ALA 1.87 1.03 1 40 ALA 3.27 -0.73 1 41 LEU 3.21 -1.02 1 42 ALA -0.92 0.22 1 43 ASN 3.19 -1.60 1 44 LEU 0.68 -0.12 1 46 ILE 4.09 -1.12 1 48 ASP 2.07 -0.15 1 50 ILE -0.39 -1.53 1 51 THR 2.75 -1.43 1 52 ALA -1.69 2.06 1 53 ILE -3.64 3.00 1 54 ASP 2.52 -1.36 1 56 GLU -2.30 0.65 1 57 ASN 0.96 0.26 1 58 THR 0.09 0.03 1 60 ASN -1.46 0.70 1 61 MET -0.65 1.59 1 62 THR -1.42 1.33 1 64 LEU 2.70 -0.02 1 65 GLU 2.95 -0.07 1 66 ALA 2.61 0.42 1 67 GLN 4.00 -0.40 1 68 ASN 3.82 -1.33 1 69 ARG 3.19 -1.00 1 70 ILE 4.49 -0.47 1 71 LYS 3.03 -0.36 1 74 THR 1.05 -0.24 1 75 ASP 0.72 0.58 1 78 THR -0.84 0.41 1 79 LEU -5.29 3.06 1 80 THR 2.16 -1.21 1 81 VAL -5.61 2.59 1 82 ALA -4.24 2.16 1 83 ARG -3.55 2.63 1 84 SER -0.46 0.39 1 85 GLU -0.45 0.67 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.72 _LACS_plot.Line_1_terminator_val_y_1 0.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.29 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _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 16 PHE -5.72 1.22 0 81 VAL -5.61 1.23 0 80 THR 2.16 0.54 0 17 ARG -5.11 0.49 1 18 LEU -5.29 1.16 1 19 VAL -5.31 0.36 1 22 LYS 3.81 -0.08 1 23 ASP 4.40 -0.35 1 24 PHE -0.75 -0.10 1 25 GLU 2.97 -0.35 1 26 GLN -4.66 0.30 1 28 LEU -0.47 0.41 1 29 ALA -6.72 1.14 1 31 SER -1.24 0.13 1 32 ARG -2.96 0.00 1 33 VAL -2.70 0.53 1 34 THR 1.34 -0.13 1 37 SER -3.50 -0.03 1 38 LYS 4.68 -0.22 1 39 ALA 1.87 -0.32 1 40 ALA 3.27 -0.23 1 41 LEU 3.21 -0.22 1 42 ALA -0.92 0.07 1 43 ASN 3.19 -0.48 1 44 LEU 0.68 -0.24 1 46 ILE 4.09 -0.85 1 48 ASP 2.07 -0.19 1 50 ILE -0.39 0.40 1 51 THR 2.75 -0.10 1 52 ALA -1.69 0.85 1 53 ILE -3.64 0.08 1 54 ASP 2.52 -0.37 1 56 GLU -2.30 0.13 1 57 ASN 0.96 0.21 1 58 THR 0.09 -0.03 1 60 ASN -1.46 0.30 1 61 MET -0.65 0.27 1 62 THR -1.42 0.14 1 63 HIS 6.55 -0.64 1 64 LEU 2.70 -0.21 1 65 GLU 2.95 -0.39 1 66 ALA 2.61 -0.29 1 67 GLN 4.00 -0.49 1 68 ASN 3.82 -0.24 1 69 ARG 3.19 -0.20 1 70 ILE 4.49 -0.42 1 71 LYS 3.03 -0.07 1 74 THR 1.05 0.10 1 75 ASP 0.72 0.04 1 78 THR -0.84 0.82 1 79 LEU -5.29 0.62 1 82 ALA -4.24 0.81 1 83 ARG -3.55 0.31 1 84 SER -0.46 0.10 1 85 GLU -0.45 -0.14 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6452_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.72 _LACS_plot.Line_1_terminator_val_y_1 -2.33 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.74 _LACS_plot.Line_2_terminator_val_x_2 6.54 _LACS_plot.Line_2_terminator_val_y_2 2.46 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 ALA 3.27 4.75 0 16 PHE -5.72 -2.03 1 17 ARG -5.11 -1.06 1 18 LEU -5.29 -0.60 1 19 VAL -5.31 -2.46 1 22 LYS 3.81 1.98 1 23 ASP 4.40 -0.19 1 24 PHE -0.75 -1.44 1 25 GLU 2.97 -1.65 1 28 LEU -0.47 -2.14 1 29 ALA -6.72 -1.34 1 31 SER -1.24 -0.15 1 32 ARG -2.96 -2.38 1 33 VAL -2.70 -0.59 1 37 SER -3.50 0.02 1 38 LYS 4.68 3.09 1 39 ALA 1.87 0.04 1 41 LEU 3.21 0.48 1 42 ALA -0.92 -1.80 1 43 ASN 3.19 -0.21 1 44 LEU 0.68 -1.68 1 46 ILE 4.09 1.18 1 48 ASP 2.07 -1.18 1 50 ILE -0.39 -0.12 1 51 THR 2.75 1.55 1 52 ALA -1.69 -2.47 1 53 ILE -3.64 -0.74 1 54 ASP 2.52 -0.46 1 56 GLU -2.30 -1.22 1 57 ASN 0.96 2.44 1 58 THR 0.09 3.28 1 60 ASN -1.46 -0.35 1 61 MET -0.65 1.14 1 62 THR -1.42 -0.24 1 63 HIS 6.55 2.91 1 64 LEU 2.70 1.17 1 65 GLU 2.95 3.25 1 66 ALA 2.61 1.49 1 67 GLN 4.00 3.41 1 68 ASN 3.82 3.54 1 69 ARG 3.19 2.76 1 70 ILE 4.49 1.97 1 71 LYS 3.03 1.50 1 74 THR 1.05 0.11 1 75 ASP 0.72 -0.79 1 78 THR -0.84 -0.47 1 79 LEU -5.29 -2.04 1 80 THR 2.16 -0.73 1 81 VAL -5.61 -1.98 1 82 ALA -4.24 -1.61 1 83 ARG -3.55 -0.75 1 84 SER -0.46 -0.02 1 85 GLU -0.45 -0.52 1 stop_ save_