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 bmr30457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.08 _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 1.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.98 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 4.86 _LACS_plot.Y_axis_chem_shift_offset -0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 ASP -2.76 0.11 0 13 VAL -6.08 -3.77 0 10 LEU 2.25 2.66 1 11 LEU -1.63 -1.19 1 14 SER -0.63 -0.17 1 16 SER -0.68 -1.17 1 17 ALA -0.05 0.74 1 18 ASN -2.39 -2.37 1 19 GLU 4.16 3.94 1 20 GLN 4.88 3.72 1 21 GLU 2.66 2.69 1 22 LEU 3.30 3.70 1 23 LYS 4.89 4.20 1 24 LYS 4.36 3.85 1 26 TYR 3.22 3.05 1 27 ARG 4.70 3.57 1 28 LYS 3.85 3.37 1 29 ALA 2.84 2.48 1 30 ALA 3.97 2.69 1 31 LEU 2.52 2.36 1 32 LYS 2.12 2.04 1 33 TYR -0.43 0.33 1 34 HIS -0.24 1.90 1 36 ASP 0.48 0.35 1 37 LYS 2.46 3.54 1 39 THR -0.12 -1.25 1 42 THR 5.82 4.89 1 43 GLU 3.55 2.85 1 44 LYS 3.63 2.16 1 45 PHE 4.78 4.33 1 46 LYS 4.77 3.75 1 47 GLU 3.15 3.28 1 48 ILE 4.00 3.70 1 49 SER 3.97 4.15 1 50 GLU 3.03 2.43 1 51 ALA 2.87 2.75 1 52 PHE 3.79 4.02 1 53 GLU 3.20 2.73 1 54 ILE 4.73 3.82 1 55 LEU 1.63 1.64 1 56 ASN -0.43 0.15 1 57 ASP -3.74 -2.05 1 59 GLN 3.74 3.32 1 60 LYS 3.71 3.70 1 61 ARG 5.44 4.44 1 62 GLU 3.23 3.10 1 63 ILE 4.25 3.53 1 64 TYR 4.22 3.76 1 65 ASP 3.23 2.73 1 66 GLN 0.82 2.01 1 67 TYR -2.39 0.28 1 69 LEU 3.22 4.28 1 70 GLU 5.01 3.48 1 71 ALA 1.63 2.01 1 72 ALA 3.20 2.80 1 73 ARG 2.09 2.77 1 74 SER 0.61 1.01 1 78 SER -0.07 -0.33 1 79 PHE -0.54 -0.25 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 2.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.02 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 -0.95 _LACS_plot.Y_axis_chem_shift_offset -0.45 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 ASP -2.76 2.87 0 13 VAL -6.08 2.31 0 10 LEU 2.25 0.41 1 11 LEU -1.63 0.44 1 14 SER -0.63 0.46 1 16 SER -0.68 -0.49 1 17 ALA -0.05 0.79 1 18 ASN -2.39 0.02 1 19 GLU 4.16 -0.22 1 20 GLN 4.88 -1.16 1 21 GLU 2.66 0.03 1 22 LEU 3.30 0.40 1 23 LYS 4.89 -0.69 1 24 LYS 4.36 -0.51 1 26 TYR 3.22 -0.17 1 27 ARG 4.70 -1.13 1 28 LYS 3.85 -0.48 1 29 ALA 2.84 -0.36 1 30 ALA 3.97 -1.28 1 31 LEU 2.52 -0.16 1 32 LYS 2.12 -0.08 1 33 TYR -0.43 0.76 1 34 HIS -0.24 2.14 1 36 ASP 0.48 -0.13 1 37 LYS 2.46 1.08 1 39 THR -0.12 -1.13 1 42 THR 5.82 -0.93 1 43 GLU 3.55 -0.70 1 44 LYS 3.63 -1.47 1 45 PHE 4.78 -0.45 1 46 LYS 4.77 -1.02 1 47 GLU 3.15 0.13 1 48 ILE 4.00 -0.30 1 49 SER 3.97 0.18 1 50 GLU 3.03 -0.60 1 51 ALA 2.87 -0.12 1 52 PHE 3.79 0.23 1 53 GLU 3.20 -0.47 1 54 ILE 4.73 -0.91 1 55 LEU 1.63 0.01 1 56 ASN -0.43 0.58 1 57 ASP -3.74 1.69 1 59 GLN 3.74 -0.42 1 60 LYS 3.71 -0.01 1 61 ARG 5.44 -1.00 1 62 GLU 3.23 -0.13 1 63 ILE 4.25 -0.72 1 64 TYR 4.22 -0.46 1 65 ASP 3.23 -0.50 1 66 GLN 0.82 1.19 1 67 TYR -2.39 2.67 1 69 LEU 3.22 1.06 1 70 GLU 5.01 -1.53 1 71 ALA 1.63 0.38 1 72 ALA 3.20 -0.40 1 73 ARG 2.09 0.68 1 74 SER 0.61 0.40 1 78 SER -0.07 -0.26 1 79 PHE -0.54 0.29 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 0.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 -0.55 _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 34 HIS -0.24 -1.14 0 10 LEU 2.25 -0.32 1 11 LEU -1.63 -0.10 1 13 VAL -6.08 0.72 1 16 SER -0.68 -0.15 1 17 ALA -0.05 -0.04 1 18 ASN -2.39 0.22 1 19 GLU 4.16 -0.35 1 20 GLN 4.88 -0.24 1 21 GLU 2.66 -0.31 1 22 LEU 3.30 -0.29 1 23 LYS 4.89 -0.36 1 24 LYS 4.36 -0.31 1 26 TYR 3.22 -0.40 1 27 ARG 4.70 -0.83 1 28 LYS 3.85 -0.40 1 29 ALA 2.84 -0.15 1 30 ALA 3.97 -0.38 1 31 LEU 2.52 -0.36 1 32 LYS 2.12 -0.45 1 33 TYR -0.43 0.21 1 36 ASP 0.48 -0.06 1 39 THR -0.12 0.03 1 42 THR 5.82 -0.49 1 43 GLU 3.55 -0.27 1 44 LYS 3.63 -0.34 1 45 PHE 4.78 -0.54 1 46 LYS 4.77 -0.39 1 47 GLU 3.15 -0.26 1 48 ILE 4.00 -0.46 1 49 SER 3.97 -0.61 1 50 GLU 3.03 -0.42 1 51 ALA 2.87 -0.59 1 52 PHE 3.79 -0.86 1 53 GLU 3.20 -0.85 1 54 ILE 4.73 -0.73 1 55 LEU 1.63 -0.75 1 56 ASN -0.43 -0.54 1 59 GLN 3.74 -0.12 1 60 LYS 3.71 -0.30 1 61 ARG 5.44 -0.70 1 62 GLU 3.23 -0.19 1 63 ILE 4.25 -0.27 1 64 TYR 4.22 -0.45 1 65 ASP 3.23 -0.04 1 66 GLN 0.82 -0.29 1 67 TYR -2.39 0.20 1 69 LEU 3.22 -0.24 1 70 GLU 5.01 -0.40 1 71 ALA 1.63 -0.34 1 72 ALA 3.20 -0.37 1 73 ARG 2.09 -0.35 1 74 SER 0.61 -0.07 1 78 SER -0.07 -0.16 1 79 PHE -0.54 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30457_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 -2.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.49 _LACS_plot.Line_2_terminator_val_x_2 5.81 _LACS_plot.Line_2_terminator_val_y_2 2.62 _LACS_plot.Y_axis_chem_shift_offset -0.32 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 69 LEU 3.22 -3.51 0 37 LYS 2.46 6.71 0 10 LEU 2.25 0.41 1 11 LEU -1.63 0.44 1 13 VAL -6.08 -1.74 1 14 SER -0.63 0.18 1 16 SER -0.68 -0.10 1 17 ALA -0.05 0.11 1 18 ASN -2.39 0.23 1 19 GLU 4.16 2.06 1 20 GLN 4.88 3.22 1 21 GLU 2.66 3.62 1 22 LEU 3.30 0.89 1 23 LYS 4.89 2.35 1 24 LYS 4.36 2.94 1 26 TYR 3.22 0.05 1 27 ARG 4.70 2.61 1 28 LYS 3.85 2.35 1 29 ALA 2.84 1.59 1 30 ALA 3.97 1.91 1 31 LEU 2.52 0.63 1 32 LYS 2.12 1.22 1 33 TYR -0.43 -0.98 1 36 ASP 0.48 -1.06 1 39 THR -0.12 -0.30 1 41 ASP -2.76 -0.70 1 42 THR 5.82 1.51 1 43 GLU 3.55 2.88 1 44 LYS 3.63 2.50 1 45 PHE 4.78 2.65 1 46 LYS 4.77 2.49 1 47 GLU 3.15 3.45 1 48 ILE 4.00 0.94 1 49 SER 3.97 1.37 1 50 GLU 3.03 0.65 1 51 ALA 2.87 0.46 1 52 PHE 3.79 -0.35 1 53 GLU 3.20 2.82 1 54 ILE 4.73 -0.66 1 55 LEU 1.63 -0.40 1 56 ASN -0.43 -1.22 1 57 ASP -3.74 -1.25 1 59 GLN 3.74 3.02 1 60 LYS 3.71 1.99 1 61 ARG 5.44 1.24 1 62 GLU 3.23 3.01 1 63 ILE 4.25 1.71 1 64 TYR 4.22 3.44 1 65 ASP 3.23 1.25 1 66 GLN 0.82 1.33 1 67 TYR -2.39 1.42 1 70 GLU 5.01 3.23 1 71 ALA 1.63 1.79 1 72 ALA 3.20 1.38 1 73 ARG 2.09 1.71 1 74 SER 0.61 0.31 1 78 SER -0.07 -0.62 1 79 PHE -0.54 -0.18 1 stop_ save_