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 bmr25902_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 -3.28 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.43 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 4.79 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 ILE -6.63 -2.24 0 21 ASP 1.08 0.98 1 22 THR 2.24 1.90 1 23 ALA 2.94 2.24 1 24 ASP 3.19 2.68 1 25 GLN 3.24 2.61 1 26 VAL 6.16 4.44 1 27 MET 4.89 3.85 1 28 ALA 3.37 2.26 1 30 PHE 4.92 4.20 1 31 LYS 5.01 3.95 1 32 ILE 4.51 3.33 1 33 LEU 3.59 2.80 1 34 ALA -0.84 -0.72 1 36 ASP 3.24 1.55 1 37 LYS -0.24 0.39 1 38 ASN 0.72 0.77 1 39 TYR -4.43 -3.22 1 41 THR -2.92 -1.58 1 42 MET 5.00 4.96 1 43 ASP 3.85 3.23 1 44 GLU 3.47 3.21 1 45 LEU 3.54 3.73 1 46 ARG 3.72 2.58 1 47 ARG 2.02 2.20 1 48 GLU -1.70 -0.19 1 49 LEU -2.57 -1.46 1 52 ASP 4.85 2.55 1 53 GLN 3.43 2.70 1 54 ALA 5.02 3.88 1 55 GLU 3.63 2.18 1 56 TYR 3.40 3.33 1 58 ILE 4.46 4.27 1 59 ALA 1.57 1.08 1 60 ARG -1.07 -0.48 1 61 MET -2.59 0.06 1 62 ALA -0.92 -0.91 1 64 TYR -1.17 -0.82 1 65 THR -0.46 -1.60 1 68 ASP 0.76 -1.51 1 69 SER 1.67 0.98 1 70 VAL -2.24 -1.92 1 73 ALA -1.05 0.64 1 74 LEU -3.04 -0.95 1 75 ASP -2.27 -2.44 1 76 TYR 2.77 1.01 1 77 MET 4.43 1.32 1 78 SER 1.36 1.28 1 79 PHE 0.51 1.40 1 80 SER 1.76 1.48 1 81 THR 2.89 1.88 1 82 ALA 0.82 0.47 1 83 LEU 1.01 0.73 1 84 TYR 0.98 0.55 1 86 GLU -0.42 -0.06 1 87 SER -0.19 0.11 1 88 ASP -0.01 -0.08 1 89 LEU 0.76 1.74 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25902_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 3.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.57 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -1.36 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 40 ILE -6.63 4.39 0 21 ASP 1.08 -0.10 1 22 THR 2.24 -0.34 1 23 ALA 2.94 -0.70 1 24 ASP 3.19 -0.51 1 25 GLN 3.24 -0.63 1 26 VAL 6.16 -1.72 1 27 MET 4.89 -1.04 1 28 ALA 3.37 -1.11 1 30 PHE 4.92 -0.72 1 31 LYS 5.01 -1.06 1 32 ILE 4.51 -1.18 1 33 LEU 3.59 -0.79 1 34 ALA -0.84 0.12 1 36 ASP 3.24 -1.69 1 37 LYS -0.24 0.63 1 38 ASN 0.72 0.05 1 39 TYR -4.43 1.21 1 41 THR -2.92 1.34 1 42 MET 5.00 -0.04 1 43 ASP 3.85 -0.62 1 44 GLU 3.47 -0.26 1 45 LEU 3.54 0.19 1 46 ARG 3.72 -1.14 1 47 ARG 2.02 0.18 1 48 GLU -1.70 1.51 1 49 LEU -2.57 1.11 1 52 ASP 4.85 -2.30 1 53 GLN 3.43 -0.73 1 54 ALA 5.02 -1.14 1 55 GLU 3.63 -1.45 1 56 TYR 3.40 -0.07 1 58 ILE 4.46 -0.19 1 59 ALA 1.57 -0.49 1 60 ARG -1.07 0.59 1 61 MET -2.59 2.65 1 62 ALA -0.92 0.01 1 64 TYR -1.17 0.35 1 65 THR -0.46 -1.14 1 68 ASP 0.76 -2.27 1 69 SER 1.67 -0.69 1 70 VAL -2.24 0.32 1 73 ALA -1.05 1.69 1 74 LEU -3.04 2.09 1 75 ASP -2.27 -0.17 1 76 TYR 2.77 -1.76 1 77 MET 4.43 -3.11 1 78 SER 1.36 -0.08 1 79 PHE 0.51 0.89 1 80 SER 1.76 -0.28 1 81 THR 2.89 -1.01 1 82 ALA 0.82 -0.35 1 83 LEU 1.01 -0.28 1 84 TYR 0.98 -0.43 1 86 GLU -0.42 0.36 1 87 SER -0.19 0.30 1 88 ASP -0.01 -0.07 1 89 LEU 0.76 0.98 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25902_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -0.67 _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 41 THR -2.92 1.05 0 26 VAL 6.16 0.21 0 21 ASP 1.08 -0.02 1 22 THR 2.24 -0.08 1 23 ALA 2.94 -0.36 1 24 ASP 3.19 -0.22 1 25 GLN 3.24 -0.20 1 27 MET 4.89 -0.11 1 28 ALA 3.37 -0.27 1 30 PHE 4.92 -0.74 1 31 LYS 5.01 -0.88 1 32 ILE 4.51 -0.44 1 33 LEU 3.59 -0.52 1 34 ALA -0.84 -0.15 1 36 ASP 3.24 -0.47 1 37 LYS -0.24 -0.05 1 38 ASN 0.72 -0.24 1 39 TYR -4.43 0.21 1 40 ILE -6.63 0.82 1 42 MET 5.00 -0.65 1 43 ASP 3.85 -0.36 1 44 GLU 3.47 -0.51 1 45 LEU 3.54 -0.50 1 46 ARG 3.72 -0.41 1 47 ARG 2.02 -0.14 1 48 GLU -1.70 0.18 1 49 LEU -2.57 0.22 1 52 ASP 4.85 -0.38 1 53 GLN 3.43 -0.75 1 54 ALA 5.02 -0.59 1 55 GLU 3.63 -0.37 1 56 TYR 3.40 -0.43 1 58 ILE 4.46 -0.86 1 59 ALA 1.57 -0.19 1 60 ARG -1.07 -0.08 1 61 MET -2.59 0.03 1 62 ALA -0.92 -0.29 1 64 TYR -1.17 0.18 1 65 THR -0.46 -0.02 1 68 ASP 0.76 -0.03 1 69 SER 1.67 -1.03 1 70 VAL -2.24 0.30 1 73 ALA -1.05 -0.25 1 74 LEU -3.04 0.44 1 75 ASP -2.27 0.24 1 76 TYR 2.77 -0.10 1 77 MET 4.43 0.22 1 78 SER 1.36 -0.05 1 79 PHE 0.51 -0.07 1 80 SER 1.76 -0.33 1 81 THR 2.89 -0.31 1 82 ALA 0.82 -0.11 1 83 LEU 1.01 -0.32 1 84 TYR 0.98 -0.11 1 86 GLU -0.42 -0.03 1 87 SER -0.19 -0.04 1 88 ASP -0.01 0.01 1 89 LEU 0.76 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25902_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.63 _LACS_plot.Line_1_terminator_val_y_1 -3.35 _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 -1.22 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 2.60 _LACS_plot.Y_axis_chem_shift_offset 0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 89 LEU 0.76 4.78 0 21 ASP 1.08 0.81 1 22 THR 2.24 0.71 1 23 ALA 2.94 0.91 1 24 ASP 3.19 2.45 1 25 GLN 3.24 2.81 1 26 VAL 6.16 1.01 1 27 MET 4.89 2.29 1 28 ALA 3.37 2.76 1 30 PHE 4.92 0.88 1 31 LYS 5.01 1.87 1 32 ILE 4.51 4.28 1 33 LEU 3.59 -0.49 1 34 ALA -0.84 1.38 1 36 ASP 3.24 -0.83 1 37 LYS -0.24 -0.20 1 38 ASN 0.72 -3.92 1 39 TYR -4.43 -4.52 1 40 ILE -6.63 -2.65 1 41 THR -2.92 1.47 1 42 MET 5.00 1.43 1 43 ASP 3.85 2.58 1 44 GLU 3.47 2.31 1 45 LEU 3.54 0.42 1 46 ARG 3.72 1.65 1 47 ARG 2.02 1.86 1 48 GLU -1.70 -0.22 1 49 LEU -2.57 -2.05 1 52 ASP 4.85 2.69 1 53 GLN 3.43 2.07 1 54 ALA 5.02 1.44 1 55 GLU 3.63 2.53 1 56 TYR 3.40 1.73 1 58 ILE 4.46 0.58 1 59 ALA 1.57 0.91 1 60 ARG -1.07 -1.36 1 61 MET -2.59 -2.41 1 62 ALA -0.92 -1.51 1 64 TYR -1.17 0.29 1 65 THR -0.46 -1.06 1 68 ASP 0.76 -1.51 1 69 SER 1.67 -1.34 1 73 ALA -1.05 -0.70 1 74 LEU -3.04 -1.96 1 75 ASP -2.27 0.66 1 76 TYR 2.77 1.05 1 77 MET 4.43 1.98 1 78 SER 1.36 0.49 1 79 PHE 0.51 -0.44 1 80 SER 1.76 0.12 1 81 THR 2.89 0.75 1 82 ALA 0.82 0.23 1 83 LEU 1.01 -0.09 1 84 TYR 0.98 0.61 1 86 GLU -0.42 -0.14 1 87 SER -0.19 -0.62 1 88 ASP -0.01 -1.30 1 stop_ save_