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 bmr25460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.36 _LACS_plot.Line_1_terminator_val_y_1 -1.97 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.55 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 3.55 _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 97 TYR -0.72 3.49 0 21 ARG 0.71 0.34 1 22 GLU 0.79 0.67 1 23 ASN 0.54 0.35 1 24 LEU 0.67 0.53 1 25 TYR 0.24 0.03 1 26 PHE 0.34 0.25 1 27 GLN 0.77 0.48 1 29 HIS 0.15 0.43 1 30 MET 0.42 0.26 1 31 ALA -0.27 -0.24 1 32 ALA -0.72 -0.40 1 34 ALA -0.24 -0.15 1 35 ARG -1.59 1.00 1 36 PHE -4.81 -0.85 1 38 VAL -0.94 -1.46 1 39 TYR -2.86 -0.80 1 40 TYR -6.29 -1.00 1 41 ASP -1.65 -1.40 1 43 HIS -0.65 0.98 1 44 LEU -0.86 -1.02 1 46 ALA 1.78 2.11 1 47 THR -2.15 -1.40 1 48 ARG 1.11 0.09 1 49 VAL -3.02 -0.87 1 50 LEU 2.85 2.27 1 51 LEU 0.70 0.63 1 52 MET -3.34 0.64 1 53 TYR -0.62 0.04 1 54 VAL -3.13 -0.72 1 55 ARG 1.68 0.76 1 56 ILE 5.39 3.83 1 58 THR -3.88 -1.52 1 59 THR -4.60 -2.56 1 60 ALA -6.21 -0.90 1 61 THR 1.06 0.52 1 62 ILE -3.46 -1.59 1 63 THR -0.82 -0.77 1 64 ALA -4.14 -0.52 1 65 ARG 4.89 1.03 1 67 HIS -4.07 -0.97 1 68 GLU -3.39 -1.51 1 69 PHE -3.08 -1.23 1 70 GLU -1.19 -1.14 1 71 VAL -4.90 -3.65 1 72 GLU -4.57 -2.42 1 73 ALA -0.59 -1.98 1 74 LYS 1.95 3.39 1 75 ASP -1.20 -1.05 1 76 GLN 3.55 1.99 1 77 ASN 3.01 2.02 1 79 LYS 1.64 0.66 1 80 VAL 5.29 2.55 1 81 ILE -3.23 -0.54 1 82 LEU -0.66 -1.91 1 83 THR 3.67 2.15 1 84 ASN 1.29 -0.39 1 86 LYS 0.14 -0.47 1 87 GLN 0.26 -0.12 1 88 ALA -0.20 -0.42 1 90 ASP 2.87 2.30 1 91 TRP -2.41 -2.87 1 92 LEU 0.26 -0.25 1 93 ALA -6.36 -2.19 1 94 ALA -4.63 -1.49 1 95 GLU -4.46 -1.19 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.36 _LACS_plot.Line_1_terminator_val_y_1 4.39 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.56 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.45 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 -1.84 _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 97 TYR -0.72 4.21 0 21 ARG 0.71 -0.37 1 22 GLU 0.79 -0.12 1 23 ASN 0.54 -0.19 1 24 LEU 0.67 -0.14 1 25 TYR 0.24 -0.21 1 26 PHE 0.34 -0.09 1 27 GLN 0.77 -0.29 1 29 HIS 0.15 0.28 1 30 MET 0.42 -0.16 1 31 ALA -0.27 0.03 1 32 ALA -0.72 0.32 1 34 ALA -0.24 0.09 1 35 ARG -1.59 2.59 1 36 PHE -4.81 3.96 1 38 VAL -0.94 -0.52 1 39 TYR -2.86 2.06 1 40 TYR -6.29 5.29 1 41 ASP -1.65 0.25 1 43 HIS -0.65 1.63 1 44 LEU -0.86 -0.16 1 46 ALA 1.78 0.33 1 47 THR -2.15 0.75 1 48 ARG 1.11 -1.02 1 49 VAL -3.02 2.15 1 50 LEU 2.85 -0.58 1 51 LEU 0.70 -0.07 1 52 MET -3.34 3.98 1 53 TYR -0.62 0.66 1 54 VAL -3.13 2.41 1 55 ARG 1.68 -0.92 1 56 ILE 5.39 -1.56 1 58 THR -3.88 2.36 1 59 THR -4.60 2.04 1 60 ALA -6.21 5.31 1 61 THR 1.06 -0.54 1 62 ILE -3.46 1.87 1 63 THR -0.82 0.05 1 64 ALA -4.14 3.62 1 65 ARG 4.89 -3.86 1 67 HIS -4.07 3.10 1 68 GLU -3.39 1.88 1 69 PHE -3.08 1.85 1 70 GLU -1.19 0.05 1 71 VAL -4.90 1.25 1 72 GLU -4.57 2.15 1 73 ALA -0.59 -1.39 1 74 LYS 1.95 1.44 1 75 ASP -1.20 0.15 1 76 GLN 3.55 -1.56 1 77 ASN 3.01 -0.99 1 79 LYS 1.64 -0.98 1 80 VAL 5.29 -2.74 1 81 ILE -3.23 2.69 1 82 LEU -0.66 -1.25 1 83 THR 3.67 -1.52 1 84 ASN 1.29 -1.68 1 86 LYS 0.14 -0.61 1 87 GLN 0.26 -0.38 1 88 ALA -0.20 -0.22 1 90 ASP 2.87 -0.57 1 91 TRP -2.41 -0.46 1 92 LEU 0.26 -0.51 1 93 ALA -6.36 4.17 1 94 ALA -4.63 3.14 1 95 GLU -4.46 3.27 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.36 _LACS_plot.Line_1_terminator_val_y_1 0.57 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.20 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 -0.52 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 HIS 0.15 -0.85 0 71 VAL -4.90 1.30 0 94 ALA -4.63 1.36 0 21 ARG 0.71 -0.02 1 22 GLU 0.79 -0.14 1 23 ASN 0.54 -0.07 1 24 LEU 0.67 -0.15 1 25 TYR 0.24 -0.05 1 26 PHE 0.34 -0.10 1 27 GLN 0.77 -0.16 1 30 MET 0.42 -0.09 1 31 ALA -0.27 -0.05 1 32 ALA -0.72 -0.08 1 34 ALA -0.24 0.01 1 35 ARG -1.59 0.00 1 36 PHE -4.81 0.76 1 38 VAL -0.94 0.26 1 39 TYR -2.86 0.59 1 40 TYR -6.29 0.72 1 41 ASP -1.65 0.61 1 43 HIS -0.65 -0.24 1 44 LEU -0.86 0.14 1 46 ALA 1.78 -0.13 1 47 THR -2.15 0.25 1 48 ARG 1.11 0.42 1 49 VAL -3.02 0.22 1 50 LEU 2.85 -0.57 1 51 LEU 0.70 0.29 1 52 MET -3.34 -0.01 1 53 TYR -0.62 0.26 1 54 VAL -3.13 0.29 1 55 ARG 1.68 -0.42 1 56 ILE 5.39 -0.48 1 58 THR -3.88 0.62 1 59 THR -4.60 1.03 1 60 ALA -6.21 0.34 1 61 THR 1.06 0.56 1 62 ILE -3.46 0.27 1 63 THR -0.82 0.96 1 64 ALA -4.14 0.39 1 65 ARG 4.89 -0.48 1 67 HIS -4.07 0.05 1 68 GLU -3.39 0.74 1 69 PHE -3.08 0.15 1 70 GLU -1.19 0.87 1 72 GLU -4.57 0.27 1 73 ALA -0.59 0.38 1 74 LYS 1.95 -0.32 1 75 ASP -1.20 -0.25 1 76 GLN 3.55 -0.24 1 77 ASN 3.01 -0.16 1 79 LYS 1.64 -0.14 1 80 VAL 5.29 -0.45 1 81 ILE -3.23 0.01 1 82 LEU -0.66 0.96 1 83 THR 3.67 -0.26 1 84 ASN 1.29 -0.18 1 86 LYS 0.14 -0.02 1 87 GLN 0.26 -0.18 1 88 ALA -0.20 -0.45 1 90 ASP 2.87 -0.42 1 91 TRP -2.41 -0.17 1 92 LEU 0.26 0.42 1 93 ALA -6.36 0.35 1 95 GLU -4.46 0.31 1 97 TYR -0.72 -0.10 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25460_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.36 _LACS_plot.Line_1_terminator_val_y_1 -1.68 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.61 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 0.98 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 VAL 5.29 -1.84 0 97 TYR -0.72 3.63 0 21 ARG 0.71 0.49 1 22 GLU 0.79 0.00 1 23 ASN 0.54 0.22 1 24 LEU 0.67 -0.31 1 25 TYR 0.24 0.05 1 26 PHE 0.34 0.02 1 27 GLN 0.77 0.42 1 29 HIS 0.15 0.51 1 30 MET 0.42 -0.55 1 31 ALA -0.27 -0.85 1 32 ALA -0.72 -0.51 1 34 ALA -0.24 -0.88 1 35 ARG -1.59 -0.08 1 36 PHE -4.81 0.11 1 38 VAL -0.94 -1.78 1 39 TYR -2.86 -0.50 1 40 TYR -6.29 -1.31 1 41 ASP -1.65 1.37 1 43 HIS -0.65 1.13 1 44 LEU -0.86 0.33 1 46 ALA 1.78 1.32 1 47 THR -2.15 0.91 1 48 ARG 1.11 -1.08 1 49 VAL -3.02 -0.61 1 50 LEU 2.85 -1.09 1 51 LEU 0.70 -0.80 1 52 MET -3.34 -2.55 1 53 TYR -0.62 -0.22 1 54 VAL -3.13 -0.70 1 55 ARG 1.68 0.71 1 56 ILE 5.39 0.62 1 58 THR -3.88 -2.39 1 59 THR -4.60 -0.14 1 60 ALA -6.21 -2.18 1 61 THR 1.06 -0.30 1 62 ILE -3.46 -1.32 1 63 THR -0.82 -0.45 1 64 ALA -4.14 -1.27 1 65 ARG 4.89 0.77 1 67 HIS -4.07 -1.79 1 68 GLU -3.39 -0.45 1 69 PHE -3.08 -1.87 1 70 GLU -1.19 -0.78 1 71 VAL -4.90 -1.51 1 72 GLU -4.57 -0.55 1 73 ALA -0.59 -1.54 1 74 LYS 1.95 0.43 1 75 ASP -1.20 -0.49 1 76 GLN 3.55 -0.05 1 77 ASN 3.01 2.05 1 79 LYS 1.64 1.88 1 81 ILE -3.23 -1.34 1 82 LEU -0.66 3.20 1 83 THR 3.67 1.54 1 84 ASN 1.29 2.14 1 86 LYS 0.14 -0.88 1 87 GLN 0.26 0.49 1 88 ALA -0.20 -0.98 1 90 ASP 2.87 0.31 1 91 TRP -2.41 -0.82 1 92 LEU 0.26 -3.33 1 93 ALA -6.36 -2.59 1 94 ALA -4.63 -0.52 1 95 GLU -4.46 -2.34 1 stop_ save_