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 bmr19178_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 -3.24 _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 -1.00 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 5.03 _LACS_plot.Y_axis_chem_shift_offset -0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 ILE 3.16 -0.13 0 10 HIS 0.43 1.33 1 19 TRP 4.52 4.86 1 20 ALA 3.75 3.12 1 21 MET 4.32 1.38 1 22 GLN 4.69 3.17 1 23 THR 6.80 4.58 1 24 LEU 4.63 3.78 1 25 MET 1.03 0.20 1 27 SER -0.61 0.01 1 29 VAL 4.48 4.27 1 30 LEU -3.99 -2.87 1 31 ALA -4.75 -1.54 1 32 ARG -2.04 -1.46 1 34 ARG 3.46 2.72 1 35 ILE 0.61 0.93 1 37 ASN 2.88 3.31 1 38 ASP 0.62 -0.22 1 39 VAL 1.80 1.31 1 40 ILE 0.05 -0.47 1 41 LEU -5.17 -2.45 1 42 ASP -1.18 -0.87 1 43 SER 0.99 2.13 1 45 ASN -0.63 -0.29 1 46 ASP -0.69 0.67 1 47 ALA 3.92 1.37 1 50 ALA 2.59 2.32 1 51 TYR 5.07 3.07 1 53 LEU 3.87 2.76 1 56 TYR 4.07 3.25 1 57 LEU 3.05 2.68 1 67 PHE -4.96 -2.12 1 68 ASN 0.88 1.99 1 69 THR -6.74 -2.92 1 70 LEU 2.82 1.62 1 71 THR 5.89 4.61 1 72 GLU 1.64 2.65 1 73 ALA 3.36 1.82 1 74 ARG 5.46 4.44 1 75 ASP 4.38 2.97 1 76 ALA 3.52 2.74 1 77 ILE 6.11 5.26 1 78 LYS 4.32 4.24 1 80 ALA 3.33 2.48 1 81 TYR 4.41 3.73 1 82 GLU 3.75 2.70 1 83 SER 3.39 2.74 1 84 TYR -1.98 0.97 1 88 ASP -0.47 0.12 1 89 ASP -4.35 -1.83 1 92 GLN 3.29 2.14 1 94 SER 1.71 1.13 1 95 LYS 0.76 0.42 1 96 TYR 0.25 0.14 1 97 ILE -0.41 -0.17 1 98 ASP -0.42 -0.02 1 99 ASP 0.41 1.82 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19178_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 3.50 _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 1.00 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -1.76 _LACS_plot.Y_axis_chem_shift_offset -0.42 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 87 ILE 3.16 -3.29 0 10 HIS 0.43 0.90 1 19 TRP 4.52 0.34 1 20 ALA 3.75 -0.63 1 21 MET 4.32 -2.94 1 22 GLN 4.69 -1.52 1 23 THR 6.80 -2.22 1 24 LEU 4.63 -0.85 1 25 MET 1.03 -0.83 1 27 SER -0.61 0.62 1 29 VAL 4.48 -0.21 1 30 LEU -3.99 1.12 1 31 ALA -4.75 3.21 1 32 ARG -2.04 0.58 1 34 ARG 3.46 -0.74 1 35 ILE 0.61 0.32 1 37 ASN 2.88 0.43 1 38 ASP 0.62 -0.84 1 39 VAL 1.80 -0.49 1 40 ILE 0.05 -0.52 1 41 LEU -5.17 2.72 1 42 ASP -1.18 0.31 1 43 SER 0.99 1.14 1 45 ASN -0.63 0.34 1 46 ASP -0.69 1.36 1 47 ALA 3.92 -2.55 1 50 ALA 2.59 -0.27 1 51 TYR 5.07 -2.00 1 53 LEU 3.87 -1.11 1 56 TYR 4.07 -0.82 1 57 LEU 3.05 -0.37 1 67 PHE -4.96 2.84 1 68 ASN 0.88 1.11 1 69 THR -6.74 3.82 1 70 LEU 2.82 -1.20 1 71 THR 5.89 -1.28 1 72 GLU 1.64 1.01 1 73 ALA 3.36 -1.54 1 74 ARG 5.46 -1.02 1 75 ASP 4.38 -1.41 1 76 ALA 3.52 -0.78 1 77 ILE 6.11 -0.85 1 78 LYS 4.32 -0.08 1 80 ALA 3.33 -0.85 1 81 TYR 4.41 -0.68 1 82 GLU 3.75 -1.05 1 83 SER 3.39 -0.65 1 84 TYR -1.98 2.95 1 88 ASP -0.47 0.59 1 89 ASP -4.35 2.52 1 92 GLN 3.29 -1.15 1 94 SER 1.71 -0.58 1 95 LYS 0.76 -0.34 1 96 TYR 0.25 -0.11 1 97 ILE -0.41 0.24 1 98 ASP -0.42 0.40 1 99 ASP 0.41 1.41 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19178_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 0.44 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.11 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 -0.54 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 73 ALA 3.36 -2.15 0 10 HIS 0.43 -0.91 1 19 TRP 4.52 -0.54 1 20 ALA 3.75 -0.51 1 21 MET 4.32 0.00 1 22 GLN 4.69 -0.31 1 23 THR 6.80 -0.64 1 24 LEU 4.63 -0.61 1 25 MET 1.03 0.24 1 27 SER -0.61 -0.05 1 29 VAL 4.48 0.60 1 30 LEU -3.99 1.01 1 31 ALA -4.75 0.22 1 32 ARG -2.04 1.00 1 34 ARG 3.46 -0.41 1 35 ILE 0.61 -0.33 1 37 ASN 2.88 -0.34 1 38 ASP 0.62 -0.26 1 39 VAL 1.80 -0.18 1 40 ILE 0.05 0.05 1 41 LEU -5.17 0.54 1 42 ASP -1.18 0.22 1 43 SER 0.99 -0.29 1 45 ASN -0.63 -0.06 1 46 ASP -0.69 -0.27 1 47 ALA 3.92 -0.58 1 50 ALA 2.59 -0.24 1 51 TYR 5.07 -0.27 1 53 LEU 3.87 0.04 1 56 TYR 4.07 -0.20 1 57 LEU 3.05 -0.43 1 67 PHE -4.96 0.23 1 69 THR -6.74 0.38 1 70 LEU 2.82 -1.34 1 71 THR 5.89 -0.73 1 72 GLU 1.64 -0.35 1 74 ARG 5.46 -0.45 1 75 ASP 4.38 -0.19 1 76 ALA 3.52 0.02 1 77 ILE 6.11 -0.54 1 78 LYS 4.32 -0.06 1 80 ALA 3.33 0.02 1 81 TYR 4.41 -0.43 1 82 GLU 3.75 -0.53 1 83 SER 3.39 -0.31 1 84 TYR -1.98 0.04 1 87 ILE 3.16 0.12 1 88 ASP -0.47 0.11 1 89 ASP -4.35 0.18 1 92 GLN 3.29 -0.28 1 94 SER 1.71 -0.19 1 95 LYS 0.76 -0.11 1 96 TYR 0.25 0.01 1 97 ILE -0.41 -0.05 1 98 ASP -0.42 -0.01 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19178_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.74 _LACS_plot.Line_1_terminator_val_y_1 -2.59 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.77 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 6.79 _LACS_plot.Line_2_terminator_val_y_2 2.62 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 MET 1.03 5.17 0 10 HIS 0.43 -0.03 1 19 TRP 4.52 3.30 1 20 ALA 3.75 2.63 1 21 MET 4.32 2.44 1 22 GLN 4.69 4.10 1 23 THR 6.80 2.78 1 24 LEU 4.63 0.94 1 27 SER -0.61 1.01 1 29 VAL 4.48 0.85 1 30 LEU -3.99 -3.17 1 31 ALA -4.75 -2.67 1 32 ARG -2.04 1.75 1 34 ARG 3.46 0.26 1 35 ILE 0.61 -0.37 1 37 ASN 2.88 -1.29 1 38 ASP 0.62 -0.46 1 39 VAL 1.80 -2.57 1 40 ILE 0.05 -2.31 1 41 LEU -5.17 -1.61 1 42 ASP -1.18 -0.17 1 43 SER 0.99 1.69 1 45 ASN -0.63 -0.33 1 46 ASP -0.69 0.97 1 47 ALA 3.92 0.18 1 50 ALA 2.59 1.32 1 51 TYR 5.07 3.72 1 53 LEU 3.87 0.77 1 56 TYR 4.07 2.01 1 57 LEU 3.05 2.49 1 67 PHE -4.96 0.09 1 68 ASN 0.88 0.14 1 69 THR -6.74 -1.17 1 70 LEU 2.82 0.65 1 71 THR 5.89 0.70 1 72 GLU 1.64 2.38 1 73 ALA 3.36 1.16 1 74 ARG 5.46 2.93 1 75 ASP 4.38 1.74 1 76 ALA 3.52 3.42 1 77 ILE 6.11 0.17 1 78 LYS 4.32 1.78 1 80 ALA 3.33 1.46 1 81 TYR 4.41 2.25 1 82 GLU 3.75 2.06 1 83 SER 3.39 -0.21 1 84 TYR -1.98 -1.47 1 87 ILE 3.16 -2.06 1 88 ASP -0.47 -0.40 1 89 ASP -4.35 -2.23 1 92 GLN 3.29 2.18 1 94 SER 1.71 -0.12 1 95 LYS 0.76 -0.36 1 96 TYR 0.25 -0.32 1 97 ILE -0.41 -1.21 1 98 ASP -0.42 -1.32 1 stop_ save_