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 bmr18559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 -2.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.68 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.74 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 5.78 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 57 MET 1.55 -2.39 0 21 ASP 0.27 0.36 1 26 THR 0.10 0.07 1 27 ASP 0.03 0.23 1 28 VAL -0.89 -0.04 1 29 THR 0.65 0.13 1 30 ARG 1.63 0.36 1 32 ILE 3.60 3.05 1 35 PHE -2.19 -0.52 1 36 THR -0.28 -1.01 1 37 HIS -1.51 0.82 1 38 ASP -1.39 -1.30 1 39 ASP -2.67 -1.57 1 41 TYR -1.28 -0.69 1 42 MET -4.08 -1.24 1 43 ILE -4.86 -1.03 1 46 ASP 1.87 3.28 1 47 LYS 1.31 2.21 1 49 SER 7.00 3.24 1 50 VAL -0.41 -0.37 1 51 TRP -1.65 -1.08 1 52 GLN -4.98 -1.60 1 53 HIS 1.25 2.59 1 54 ILE 6.52 5.56 1 55 ASP 2.87 2.74 1 59 ILE -1.99 -1.86 1 60 ASP -2.04 -0.53 1 61 ARG 2.95 3.03 1 62 GLN 0.40 0.14 1 63 HIS -2.44 -0.73 1 64 ILE 1.60 0.66 1 66 ASP 1.72 1.70 1 67 THR -2.69 -1.61 1 68 TYR -0.85 1.21 1 69 LEU -7.09 -3.03 1 71 GLU 1.92 0.23 1 72 ARG 2.78 2.30 1 74 GLN -2.16 -0.44 1 76 ARG -0.97 -1.48 1 77 ASN 1.04 0.92 1 78 LEU -5.36 -1.39 1 79 ASP -0.80 -1.30 1 80 LYS 4.25 3.62 1 81 GLU 4.29 3.28 1 82 ARG 3.68 2.76 1 83 ALA 4.11 3.32 1 84 VAL 5.69 5.07 1 85 LEU 3.86 3.25 1 86 LEU 4.27 3.20 1 87 GLN 2.62 1.72 1 88 ARG 5.09 4.20 1 89 ARG 4.13 2.79 1 90 LYS 5.01 4.00 1 91 ARG 2.53 1.75 1 92 GLU 1.82 1.48 1 93 ASN 0.45 0.51 1 94 MET 0.42 0.84 1 98 ASP -0.02 0.19 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 4.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.26 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 -1.22 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 57 MET 1.55 -3.94 0 21 ASP 0.27 0.09 1 26 THR 0.10 -0.03 1 27 ASP 0.03 0.20 1 28 VAL -0.89 0.85 1 29 THR 0.65 -0.52 1 30 ARG 1.63 -1.27 1 32 ILE 3.60 -0.55 1 35 PHE -2.19 1.67 1 36 THR -0.28 -0.73 1 37 HIS -1.51 2.33 1 38 ASP -1.39 0.09 1 39 ASP -2.67 1.10 1 41 TYR -1.28 0.59 1 42 MET -4.08 2.84 1 43 ILE -4.86 3.83 1 46 ASP 1.87 1.41 1 47 LYS 1.31 0.90 1 49 SER 7.00 -3.76 1 50 VAL -0.41 0.04 1 51 TRP -1.65 0.57 1 52 GLN -4.98 3.38 1 53 HIS 1.25 1.34 1 54 ILE 6.52 -0.96 1 55 ASP 2.87 -0.13 1 59 ILE -1.99 0.13 1 60 ASP -2.04 1.51 1 61 ARG 2.95 0.08 1 62 GLN 0.40 -0.26 1 63 HIS -2.44 1.71 1 64 ILE 1.60 -0.94 1 66 ASP 1.72 -0.02 1 67 THR -2.69 1.08 1 68 TYR -0.85 2.06 1 69 LEU -7.09 4.06 1 71 GLU 1.92 -1.69 1 72 ARG 2.78 -0.48 1 74 GLN -2.16 1.72 1 76 ARG -0.97 -0.51 1 77 ASN 1.04 -0.12 1 78 LEU -5.36 3.97 1 79 ASP -0.80 -0.50 1 80 LYS 4.25 -0.63 1 81 GLU 4.29 -1.01 1 82 ARG 3.68 -0.92 1 83 ALA 4.11 -0.79 1 84 VAL 5.69 -0.62 1 85 LEU 3.86 -0.61 1 86 LEU 4.27 -1.07 1 87 GLN 2.62 -0.90 1 88 ARG 5.09 -0.89 1 89 ARG 4.13 -1.34 1 90 LYS 5.01 -1.01 1 91 ARG 2.53 -0.78 1 92 GLU 1.82 -0.34 1 93 ASN 0.45 0.06 1 94 MET 0.42 0.42 1 98 ASP -0.02 0.21 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 0.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 -0.54 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 LEU -7.09 1.13 0 42 MET -4.08 1.09 0 21 ASP 0.27 -0.08 1 26 THR 0.10 -0.08 1 27 ASP 0.03 0.07 1 28 VAL -0.89 0.06 1 29 THR 0.65 0.44 1 30 ARG 1.63 -0.13 1 32 ILE 3.60 0.00 1 35 PHE -2.19 0.50 1 36 THR -0.28 0.08 1 37 HIS -1.51 -0.21 1 38 ASP -1.39 0.42 1 39 ASP -2.67 0.04 1 41 TYR -1.28 0.19 1 43 ILE -4.86 0.34 1 46 ASP 1.87 -0.30 1 47 LYS 1.31 0.10 1 49 SER 7.00 -0.50 1 50 VAL -0.41 0.50 1 51 TRP -1.65 0.41 1 52 GLN -4.98 0.07 1 53 HIS 1.25 0.20 1 54 ILE 6.52 -0.90 1 55 ASP 2.87 -0.21 1 57 MET 1.55 0.25 1 59 ILE -1.99 -0.21 1 60 ASP -2.04 -0.26 1 61 ARG 2.95 -0.67 1 62 GLN 0.40 -0.21 1 63 HIS -2.44 -0.01 1 64 ILE 1.60 -0.49 1 66 ASP 1.72 -0.28 1 67 THR -2.69 0.19 1 68 TYR -0.85 -0.25 1 71 GLU 1.92 -0.09 1 72 ARG 2.78 -0.10 1 74 GLN -2.16 -0.26 1 76 ARG -0.97 0.15 1 77 ASN 1.04 -0.05 1 78 LEU -5.36 0.27 1 79 ASP -0.80 0.10 1 80 LYS 4.25 -0.43 1 81 GLU 4.29 -0.39 1 82 ARG 3.68 -0.43 1 83 ALA 4.11 -0.18 1 84 VAL 5.69 -0.41 1 85 LEU 3.86 -0.37 1 86 LEU 4.27 -0.29 1 87 GLN 2.62 -0.17 1 88 ARG 5.09 -0.74 1 89 ARG 4.13 -0.32 1 90 LYS 5.01 -0.35 1 91 ARG 2.53 -0.61 1 92 GLU 1.82 -0.34 1 93 ASN 0.45 -0.09 1 94 MET 0.42 -0.13 1 98 ASP -0.02 0.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18559_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.09 _LACS_plot.Line_1_terminator_val_y_1 -2.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 7.00 _LACS_plot.Line_2_terminator_val_y_2 2.61 _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 49 SER 7.00 -1.09 0 30 ARG 1.63 -4.42 0 43 ILE -4.86 -6.10 0 21 ASP 0.27 0.42 1 26 THR 0.10 -0.29 1 27 ASP 0.03 -0.50 1 28 VAL -0.89 -1.18 1 29 THR 0.65 -1.11 1 32 ILE 3.60 -0.71 1 35 PHE -2.19 2.48 1 36 THR -0.28 -0.45 1 37 HIS -1.51 -0.86 1 38 ASP -1.39 0.94 1 39 ASP -2.67 0.78 1 41 TYR -1.28 -1.87 1 42 MET -4.08 -1.86 1 46 ASP 1.87 -0.37 1 47 LYS 1.31 0.75 1 50 VAL -0.41 -1.56 1 51 TRP -1.65 -0.06 1 52 GLN -4.98 -1.40 1 53 HIS 1.25 2.43 1 54 ILE 6.52 0.92 1 55 ASP 2.87 4.05 1 57 MET 1.55 1.32 1 59 ILE -1.99 -2.34 1 60 ASP -2.04 0.83 1 61 ARG 2.95 0.97 1 62 GLN 0.40 -0.53 1 63 HIS -2.44 -0.35 1 66 ASP 1.72 -0.15 1 67 THR -2.69 -2.25 1 68 TYR -0.85 -4.08 1 69 LEU -7.09 -0.85 1 71 GLU 1.92 -0.42 1 72 ARG 2.78 1.51 1 77 ASN 1.04 -0.63 1 79 ASP -0.80 0.30 1 80 LYS 4.25 0.83 1 81 GLU 4.29 2.44 1 82 ARG 3.68 1.79 1 83 ALA 4.11 0.29 1 84 VAL 5.69 2.06 1 85 LEU 3.86 2.18 1 86 LEU 4.27 2.72 1 87 GLN 2.62 2.82 1 88 ARG 5.09 3.01 1 89 ARG 4.13 2.77 1 90 LYS 5.01 2.66 1 91 ARG 2.53 1.81 1 92 GLU 1.82 0.59 1 93 ASN 0.45 0.22 1 stop_ save_