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 bmr10240_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.94 _LACS_plot.Line_1_terminator_val_y_1 -7.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.09 _LACS_plot.Line_2_terminator_val_x_2 5.58 _LACS_plot.Line_2_terminator_val_y_2 0.42 _LACS_plot.Y_axis_chem_shift_offset 2.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 TRP -9.94 -7.69 0 20 ALA -7.54 -3.96 0 26 TYR -2.44 -0.97 0 10 ASP -0.24 -2.28 1 11 GLU 0.17 -1.94 1 12 TYR 0.12 -2.36 1 13 GLU -0.11 -2.19 1 14 ASN -0.05 -2.04 1 15 ASP 0.46 -1.91 1 16 LEU 0.13 -2.53 1 18 ILE 2.25 -1.37 1 19 THR -5.43 -4.68 1 21 VAL -5.11 -5.53 1 22 ALA -1.13 -2.13 1 23 LEU -0.37 -1.98 1 24 TYR -7.39 -6.16 1 25 ASP -1.58 -2.70 1 27 GLN -2.43 -4.78 1 28 ALA -0.71 -1.87 1 29 ALA -0.78 -3.04 1 31 ASP 2.70 0.05 1 32 ASP 0.42 -3.02 1 33 GLU -6.13 -3.96 1 34 ILE -3.13 -3.27 1 35 SER -4.45 -4.29 1 36 PHE -2.89 -4.17 1 37 ASP -0.95 -2.71 1 39 ASP 5.25 1.00 1 40 ASP 1.07 -0.72 1 41 ILE -1.82 -4.24 1 42 ILE -2.75 -3.29 1 43 THR -2.62 -4.05 1 44 ASN 3.69 -0.05 1 45 ILE 2.37 -0.40 1 46 GLU -4.91 -4.68 1 47 MET 2.39 -2.35 1 48 ILE 3.23 -0.43 1 49 ASP -1.52 -2.68 1 50 ASP 1.96 -0.71 1 52 TRP -1.76 -2.56 1 54 ARG -5.62 -4.04 1 56 VAL -1.98 -4.04 1 58 LYS 5.58 -0.43 1 60 ARG -2.82 -3.76 1 61 TYR -5.77 -5.37 1 63 LEU -3.82 -2.31 1 64 PHE 0.31 -2.16 1 66 ALA 5.16 -0.19 1 67 ASN 2.91 -1.95 1 68 TYR 1.16 -1.99 1 69 VAL -5.94 -6.38 1 70 GLU -5.96 -4.71 1 71 LEU 1.04 -1.08 1 72 ARG -0.11 -2.31 1 73 GLN -0.29 -2.33 1 74 SER -0.15 -2.30 1 77 SER -0.33 -2.36 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10240_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.94 _LACS_plot.Line_1_terminator_val_y_1 2.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.09 _LACS_plot.Line_2_terminator_val_x_2 5.58 _LACS_plot.Line_2_terminator_val_y_2 -5.16 _LACS_plot.Y_axis_chem_shift_offset 2.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 TRP -9.94 2.25 0 20 ALA -7.54 3.58 0 26 TYR -2.44 1.47 0 10 ASP -0.24 -2.04 1 11 GLU 0.17 -2.11 1 12 TYR 0.12 -2.48 1 13 GLU -0.11 -2.08 1 14 ASN -0.05 -1.99 1 15 ASP 0.46 -2.37 1 16 LEU 0.13 -2.66 1 18 ILE 2.25 -3.62 1 19 THR -5.43 0.75 1 21 VAL -5.11 -0.42 1 22 ALA -1.13 -1.00 1 23 LEU -0.37 -1.61 1 24 TYR -7.39 1.23 1 25 ASP -1.58 -1.12 1 27 GLN -2.43 -2.35 1 28 ALA -0.71 -1.16 1 29 ALA -0.78 -2.26 1 31 ASP 2.70 -2.65 1 32 ASP 0.42 -3.44 1 33 GLU -6.13 2.17 1 34 ILE -3.13 -0.14 1 35 SER -4.45 0.16 1 36 PHE -2.89 -1.28 1 37 ASP -0.95 -1.76 1 39 ASP 5.25 -4.25 1 40 ASP 1.07 -1.79 1 41 ILE -1.82 -2.42 1 42 ILE -2.75 -0.54 1 43 THR -2.62 -1.43 1 44 ASN 3.69 -3.74 1 45 ILE 2.37 -2.77 1 46 GLU -4.91 0.23 1 47 MET 2.39 -4.74 1 48 ILE 3.23 -3.66 1 49 ASP -1.52 -1.16 1 50 ASP 1.96 -2.67 1 52 TRP -1.76 -0.80 1 54 ARG -5.62 1.58 1 56 VAL -1.98 -2.06 1 58 LYS 5.58 -6.01 1 60 ARG -2.82 -0.94 1 61 TYR -5.77 0.40 1 63 LEU -3.82 1.51 1 64 PHE 0.31 -2.47 1 66 ALA 5.16 -5.35 1 67 ASN 2.91 -4.86 1 68 TYR 1.16 -3.15 1 69 VAL -5.94 -0.44 1 70 GLU -5.96 1.25 1 71 LEU 1.04 -2.12 1 72 ARG -0.11 -2.20 1 73 GLN -0.29 -2.04 1 74 SER -0.15 -2.15 1 77 SER -0.33 -2.03 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10240_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.94 _LACS_plot.Line_1_terminator_val_y_1 1.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.19 _LACS_plot.Line_2_terminator_val_x_2 5.58 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset 0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 66 ALA 5.16 -1.78 0 10 ASP -0.24 -0.21 1 11 GLU 0.17 -0.32 1 12 TYR 0.12 -0.11 1 13 GLU -0.11 -0.26 1 14 ASN -0.05 -0.20 1 15 ASP 0.46 -0.15 1 16 LEU 0.13 -0.13 1 18 ILE 2.25 -0.30 1 19 THR -5.43 1.16 1 20 ALA -7.54 0.60 1 21 VAL -5.11 0.63 1 22 ALA -1.13 -0.46 1 23 LEU -0.37 -0.42 1 24 TYR -7.39 0.32 1 25 ASP -1.58 0.18 1 26 TYR -2.44 -0.17 1 27 GLN -2.43 -0.15 1 28 ALA -0.71 -0.35 1 29 ALA -0.78 -0.09 1 31 ASP 2.70 -0.28 1 32 ASP 0.42 0.03 1 33 GLU -6.13 1.01 1 34 ILE -3.13 0.42 1 35 SER -4.45 0.39 1 36 PHE -2.89 0.05 1 37 ASP -0.95 0.16 1 39 ASP 5.25 -0.66 1 40 ASP 1.07 -0.13 1 41 ILE -1.82 0.45 1 42 ILE -2.75 0.51 1 43 THR -2.62 0.64 1 44 ASN 3.69 -0.57 1 45 ILE 2.37 0.53 1 46 GLU -4.91 -0.10 1 47 MET 2.39 -0.90 1 48 ILE 3.23 -0.30 1 49 ASP -1.52 -0.02 1 50 ASP 1.96 -0.15 1 52 TRP -1.76 -0.07 1 53 TRP -9.94 0.45 1 54 ARG -5.62 1.04 1 56 VAL -1.98 1.09 1 58 LYS 5.58 -0.44 1 60 ARG -2.82 0.34 1 61 TYR -5.77 1.04 1 63 LEU -3.82 0.98 1 64 PHE 0.31 -0.23 1 67 ASN 2.91 -0.37 1 68 TYR 1.16 0.11 1 69 VAL -5.94 0.90 1 70 GLU -5.96 0.35 1 71 LEU 1.04 -0.09 1 72 ARG -0.11 0.00 1 73 GLN -0.29 0.00 1 74 SER -0.15 -0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10240_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.94 _LACS_plot.Line_1_terminator_val_y_1 -4.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.25 _LACS_plot.Line_2_terminator_val_x_2 5.58 _LACS_plot.Line_2_terminator_val_y_2 -2.27 _LACS_plot.Y_axis_chem_shift_offset 3.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 64 PHE 0.31 -6.15 0 10 ASP -0.24 -2.61 1 11 GLU 0.17 -2.77 1 12 TYR 0.12 -2.36 1 13 GLU -0.11 -2.93 1 14 ASN -0.05 -2.67 1 15 ASP 0.46 -2.13 1 16 LEU 0.13 -3.53 1 18 ILE 2.25 -3.19 1 19 THR -5.43 -3.32 1 20 ALA -7.54 -6.12 1 21 VAL -5.11 -3.53 1 22 ALA -1.13 -1.31 1 23 LEU -0.37 -4.25 1 24 TYR -7.39 -5.06 1 25 ASP -1.58 -3.57 1 26 TYR -2.44 -4.15 1 27 GLN -2.43 -5.61 1 28 ALA -0.71 -1.58 1 29 ALA -0.78 -3.07 1 31 ASP 2.70 -2.72 1 32 ASP 0.42 -2.85 1 33 GLU -6.13 -2.83 1 34 ILE -3.13 -6.01 1 35 SER -4.45 -3.46 1 36 PHE -2.89 -4.01 1 37 ASP -0.95 -4.49 1 39 ASP 5.25 -2.74 1 40 ASP 1.07 -4.22 1 41 ILE -1.82 -3.47 1 42 ILE -2.75 -2.96 1 43 THR -2.62 -3.95 1 44 ASN 3.69 -2.47 1 45 ILE 2.37 -1.52 1 46 GLU -4.91 -3.36 1 47 MET 2.39 -2.91 1 48 ILE 3.23 -2.73 1 49 ASP -1.52 -3.85 1 50 ASP 1.96 -1.67 1 52 TRP -1.76 -5.11 1 53 TRP -9.94 -5.27 1 54 ARG -5.62 -2.92 1 56 VAL -1.98 -2.96 1 58 LYS 5.58 -2.22 1 60 ARG -2.82 -5.64 1 61 TYR -5.77 -2.50 1 63 LEU -3.82 -2.89 1 66 ALA 5.16 -2.26 1 67 ASN 2.91 -2.05 1 68 TYR 1.16 -3.50 1 69 VAL -5.94 -5.38 1 70 GLU -5.96 -2.84 1 71 LEU 1.04 -2.44 1 72 ARG -0.11 -2.56 1 73 GLN -0.29 -2.64 1 74 SER -0.15 -2.51 1 77 SER -0.33 -2.27 1 stop_ save_