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 bmr27148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.66 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 4.23 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 HIS -2.99 2.15 0 10 LEU 3.30 3.10 1 11 LEU 4.34 2.88 1 12 SER 4.38 3.31 1 13 GLU 3.38 2.81 1 14 ILE 4.34 3.33 1 15 ALA 2.47 2.21 1 16 LYS 3.44 2.60 1 17 GLU 2.19 2.34 1 18 GLN 1.23 1.00 1 20 PHE -4.42 -2.76 1 21 ASN -3.88 -1.27 1 22 ILE -3.86 -1.53 1 23 THR -1.97 -0.55 1 24 TYR -0.51 0.34 1 25 LEU -2.36 -1.48 1 26 ASP 0.75 0.80 1 27 ILE -0.61 -1.29 1 28 ASP 2.13 2.03 1 29 GLU -0.00 0.41 1 30 LEU -0.60 -0.49 1 31 SER -1.22 -0.35 1 32 ALA 2.83 2.05 1 33 ASN 0.06 -0.96 1 35 GLN -0.79 -0.24 1 36 TYR 0.70 0.97 1 37 GLN -6.31 -1.52 1 39 LEU -3.81 -2.24 1 40 ALA -1.99 -2.22 1 41 GLU -2.58 -1.37 1 42 LEU -2.79 -2.12 1 43 SER 0.89 -0.44 1 44 THR -0.90 -0.17 1 45 SER -2.91 -2.12 1 47 ILE 2.43 2.24 1 48 THR -2.55 0.21 1 49 VAL -3.07 -2.27 1 53 SER -4.88 -1.51 1 55 ILE 2.05 1.80 1 56 SER -5.59 -2.63 1 59 ASN 3.30 2.85 1 60 ALA 4.62 2.99 1 61 GLN 5.73 3.57 1 62 SER 4.28 3.48 1 63 ASP 1.30 3.81 1 64 ALA 4.83 3.32 1 65 ALA 3.37 2.48 1 66 HIS 3.25 2.63 1 67 ASN 4.44 2.74 1 68 ALA 2.89 3.11 1 69 LEU 3.34 3.28 1 70 GLN 3.86 3.31 1 71 TYR 3.73 3.70 1 72 LEU 3.46 2.46 1 73 LYS 3.73 3.11 1 74 ILE 4.03 3.38 1 75 ILE 4.57 2.70 1 76 ALA 2.41 1.85 1 77 GLU -0.16 -0.12 1 78 ARG 1.14 0.88 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 3.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.34 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.99 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 -1.49 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 HIS -2.99 5.14 0 10 LEU 3.30 -0.20 1 11 LEU 4.34 -1.46 1 12 SER 4.38 -1.07 1 13 GLU 3.38 -0.57 1 14 ILE 4.34 -1.01 1 15 ALA 2.47 -0.26 1 16 LYS 3.44 -0.84 1 17 GLU 2.19 0.15 1 18 GLN 1.23 -0.23 1 20 PHE -4.42 1.66 1 21 ASN -3.88 2.61 1 22 ILE -3.86 2.33 1 23 THR -1.97 1.42 1 24 TYR -0.51 0.85 1 25 LEU -2.36 0.88 1 26 ASP 0.75 0.05 1 27 ILE -0.61 -0.68 1 28 ASP 2.13 -0.10 1 29 GLU -0.00 0.41 1 30 LEU -0.60 0.11 1 31 SER -1.22 0.87 1 32 ALA 2.83 -0.78 1 33 ASN 0.06 -1.02 1 35 GLN -0.79 0.55 1 36 TYR 0.70 0.27 1 37 GLN -6.31 4.79 1 39 LEU -3.81 1.57 1 40 ALA -1.99 -0.23 1 41 GLU -2.58 1.21 1 42 LEU -2.79 0.67 1 43 SER 0.89 -1.33 1 44 THR -0.90 0.73 1 45 SER -2.91 0.79 1 47 ILE 2.43 -0.19 1 48 THR -2.55 2.76 1 49 VAL -3.07 0.80 1 53 SER -4.88 3.37 1 55 ILE 2.05 -0.25 1 56 SER -5.59 2.96 1 59 ASN 3.30 -0.45 1 60 ALA 4.62 -1.63 1 61 GLN 5.73 -2.16 1 62 SER 4.28 -0.80 1 63 ASP 1.30 2.51 1 64 ALA 4.83 -1.51 1 65 ALA 3.37 -0.89 1 66 HIS 3.25 -0.62 1 67 ASN 4.44 -1.70 1 68 ALA 2.89 0.22 1 69 LEU 3.34 -0.06 1 70 GLN 3.86 -0.55 1 71 TYR 3.73 -0.03 1 72 LEU 3.46 -1.00 1 73 LYS 3.73 -0.62 1 74 ILE 4.03 -0.65 1 75 ILE 4.57 -1.87 1 76 ALA 2.41 -0.56 1 77 GLU -0.16 0.04 1 78 ARG 1.14 -0.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 0.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.30 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 -0.57 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 15 ALA 2.47 -2.33 0 10 LEU 3.30 -0.24 1 12 SER 4.38 -0.42 1 16 LYS 3.44 -0.34 1 17 GLU 2.19 -0.31 1 20 PHE -4.42 0.41 1 21 ASN -3.88 0.29 1 22 ILE -3.86 0.87 1 23 THR -1.97 0.13 1 24 TYR -0.51 0.53 1 25 LEU -2.36 0.32 1 26 ASP 0.75 0.12 1 27 ILE -0.61 0.12 1 28 ASP 2.13 -0.11 1 29 GLU -0.00 -0.11 1 30 LEU -0.60 0.09 1 31 SER -1.22 -0.11 1 32 ALA 2.83 -0.13 1 33 ASN 0.06 0.08 1 36 TYR 0.70 -0.04 1 37 GLN -6.31 1.02 1 39 LEU -3.81 0.73 1 40 ALA -1.99 0.30 1 41 GLU -2.58 0.47 1 42 LEU -2.79 0.90 1 43 SER 0.89 0.28 1 44 THR -0.90 -0.33 1 45 SER -2.91 -0.07 1 47 ILE 2.43 -0.25 1 48 THR -2.55 0.46 1 49 VAL -3.07 0.93 1 51 HIS -2.99 0.23 1 53 SER -4.88 1.29 1 56 SER -5.59 -0.21 1 59 ASN 3.30 -0.21 1 60 ALA 4.62 -0.57 1 61 GLN 5.73 -0.29 1 62 SER 4.28 -0.33 1 63 ASP 1.30 -0.24 1 64 ALA 4.83 -0.55 1 65 ALA 3.37 -0.19 1 66 HIS 3.25 -0.84 1 67 ASN 4.44 -0.49 1 68 ALA 2.89 0.13 1 69 LEU 3.34 -0.34 1 70 GLN 3.86 -0.30 1 71 TYR 3.73 -0.59 1 72 LEU 3.46 -0.60 1 73 LYS 3.73 -0.28 1 74 ILE 4.03 -0.36 1 75 ILE 4.57 -0.40 1 76 ALA 2.41 -0.17 1 77 GLU -0.16 -0.05 1 78 ARG 1.14 -0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27148_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.31 _LACS_plot.Line_1_terminator_val_y_1 -2.72 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.94 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 5.72 _LACS_plot.Line_2_terminator_val_y_2 2.64 _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 20 PHE -4.42 -3.58 0 37 GLN -6.31 -1.75 0 10 LEU 3.30 2.22 1 11 LEU 4.34 0.29 1 12 SER 4.38 2.45 1 13 GLU 3.38 2.87 1 14 ILE 4.34 0.96 1 16 LYS 3.44 2.62 1 17 GLU 2.19 1.94 1 18 GLN 1.23 0.83 1 21 ASN -3.88 -1.19 1 22 ILE -3.86 -0.61 1 23 THR -1.97 -2.20 1 24 TYR -0.51 -0.61 1 25 LEU -2.36 -2.86 1 26 ASP 0.75 -0.42 1 27 ILE -0.61 -0.11 1 28 ASP 2.13 0.33 1 29 GLU -0.00 0.62 1 30 LEU -0.60 0.57 1 31 SER -1.22 1.13 1 32 ALA 2.83 -0.04 1 33 ASN 0.06 0.58 1 35 GLN -0.79 -0.23 1 36 TYR 0.70 0.08 1 39 LEU -3.81 -2.37 1 40 ALA -1.99 -2.96 1 41 GLU -2.58 -1.65 1 42 LEU -2.79 0.50 1 44 THR -0.90 -1.98 1 48 THR -2.55 -2.49 1 49 VAL -3.07 -2.10 1 51 HIS -2.99 0.64 1 53 SER -4.88 -0.82 1 59 ASN 3.30 2.46 1 60 ALA 4.62 0.92 1 61 GLN 5.73 1.74 1 62 SER 4.28 1.40 1 63 ASP 1.30 1.19 1 64 ALA 4.83 1.48 1 65 ALA 3.37 1.47 1 66 HIS 3.25 3.41 1 67 ASN 4.44 1.51 1 68 ALA 2.89 1.50 1 69 LEU 3.34 3.11 1 70 GLN 3.86 2.42 1 71 TYR 3.73 0.67 1 72 LEU 3.46 2.37 1 73 LYS 3.73 1.89 1 74 ILE 4.03 3.06 1 75 ILE 4.57 2.21 1 76 ALA 2.41 1.38 1 77 GLU -0.16 0.27 1 78 ARG 1.14 -0.86 1 stop_ save_