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 bmr17673_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.59 _LACS_plot.Line_1_terminator_val_y_1 -2.50 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.13 _LACS_plot.Line_2_terminator_val_x_2 4.08 _LACS_plot.Line_2_terminator_val_y_2 2.53 _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 50 HIS 3.89 5.35 0 10 ASN 4.09 2.59 1 11 GLU -0.38 1.10 1 12 GLN 0.44 0.03 1 13 VAL -5.76 -2.67 1 14 LEU -3.50 -1.24 1 15 ALA -6.59 -2.55 1 16 SER -1.23 -1.06 1 17 TRP -4.03 -2.61 1 18 SER 2.57 1.10 1 19 ASP 0.13 -0.78 1 20 SER 3.56 2.11 1 21 ARG -1.09 -0.99 1 22 PHE -1.38 0.04 1 23 TYR -3.45 -0.09 1 25 ALA -5.92 -1.62 1 26 LYS -5.18 -2.20 1 27 VAL 2.83 1.86 1 28 THR 1.24 0.38 1 29 ALA -2.20 0.91 1 30 VAL 0.65 0.48 1 31 ASN -0.66 -0.01 1 32 LYS 3.30 2.11 1 33 ASP -0.20 -1.31 1 35 THR -4.10 -1.16 1 36 TYR -4.26 -0.89 1 37 THR 1.81 1.26 1 38 VAL -6.49 -4.46 1 39 LYS -3.81 -1.99 1 40 PHE -0.53 1.91 1 41 TYR 3.37 2.01 1 42 ASP 0.86 -1.53 1 44 VAL 2.43 1.77 1 45 VAL -1.64 -1.12 1 46 GLN -6.34 -1.06 1 47 THR 1.19 0.93 1 48 VAL -6.09 -3.15 1 49 LYS -0.16 0.91 1 51 ILE 2.35 1.61 1 52 HIS -2.72 0.11 1 53 VAL -2.05 -0.90 1 54 LYS -5.51 -1.98 1 55 ALA -0.31 -0.30 1 56 PHE 0.61 1.16 1 57 SER -1.37 -0.95 1 58 LYS 0.84 0.54 1 59 ASP 0.56 0.44 1 60 GLN 0.37 0.36 1 61 ASN -0.03 -0.02 1 62 ILE 0.47 0.25 1 63 VAL 0.84 0.51 1 65 ASN -0.04 0.06 1 66 ALA 0.53 0.52 1 67 ARG 0.87 0.59 1 69 SER 0.32 0.38 1 70 ARG 0.99 0.68 1 71 ALA 0.13 0.16 1 73 SER -0.20 0.03 1 74 SER -0.20 0.03 1 76 LEU 0.37 0.12 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17673_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.59 _LACS_plot.Line_1_terminator_val_y_1 4.09 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.06 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.87 _LACS_plot.Line_2_terminator_val_x_2 4.08 _LACS_plot.Line_2_terminator_val_y_2 -1.55 _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 50 HIS 3.89 1.46 0 10 ASN 4.09 -1.50 1 11 GLU -0.38 1.48 1 12 GLN 0.44 -0.41 1 13 VAL -5.76 3.09 1 14 LEU -3.50 2.26 1 15 ALA -6.59 4.04 1 16 SER -1.23 0.17 1 17 TRP -4.03 1.42 1 18 SER 2.57 -1.47 1 19 ASP 0.13 -0.91 1 20 SER 3.56 -1.45 1 21 ARG -1.09 0.10 1 22 PHE -1.38 1.42 1 23 TYR -3.45 3.36 1 25 ALA -5.92 4.30 1 26 LYS -5.18 2.98 1 27 VAL 2.83 -0.97 1 28 THR 1.24 -0.86 1 29 ALA -2.20 3.11 1 30 VAL 0.65 -0.17 1 31 ASN -0.66 0.65 1 32 LYS 3.30 -1.19 1 33 ASP -0.20 -1.11 1 35 THR -4.10 2.94 1 36 TYR -4.26 3.37 1 37 THR 1.81 -0.55 1 38 VAL -6.49 2.03 1 39 LYS -3.81 1.82 1 40 PHE -0.53 2.44 1 41 TYR 3.37 -1.36 1 42 ASP 0.86 -2.39 1 44 VAL 2.43 -0.66 1 45 VAL -1.64 0.52 1 46 GLN -6.34 5.28 1 47 THR 1.19 -0.26 1 48 VAL -6.09 2.94 1 49 LYS -0.16 1.07 1 51 ILE 2.35 -0.74 1 52 HIS -2.72 2.83 1 53 VAL -2.05 1.15 1 54 LYS -5.51 3.53 1 55 ALA -0.31 0.01 1 56 PHE 0.61 0.55 1 57 SER -1.37 0.42 1 58 LYS 0.84 -0.30 1 59 ASP 0.56 -0.12 1 60 GLN 0.37 -0.01 1 61 ASN -0.03 0.01 1 62 ILE 0.47 -0.22 1 63 VAL 0.84 -0.33 1 65 ASN -0.04 0.10 1 66 ALA 0.53 -0.01 1 67 ARG 0.87 -0.28 1 69 SER 0.32 0.06 1 70 ARG 0.99 -0.31 1 71 ALA 0.13 0.03 1 73 SER -0.20 0.23 1 74 SER -0.20 0.23 1 76 LEU 0.37 -0.25 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17673_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.59 _LACS_plot.Line_1_terminator_val_y_1 0.76 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 4.08 _LACS_plot.Line_2_terminator_val_y_2 -0.42 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 THR 1.19 1.00 0 10 ASN 4.09 -0.50 1 11 GLU -0.38 -0.15 1 12 GLN 0.44 0.49 1 13 VAL -5.76 0.58 1 14 LEU -3.50 0.66 1 15 ALA -6.59 1.55 1 16 SER -1.23 0.05 1 17 TRP -4.03 0.58 1 18 SER 2.57 -0.56 1 19 ASP 0.13 -0.20 1 20 SER 3.56 -0.55 1 21 ARG -1.09 0.13 1 22 PHE -1.38 0.21 1 23 TYR -3.45 0.30 1 25 ALA -5.92 0.48 1 26 LYS -5.18 0.90 1 27 VAL 2.83 -0.16 1 28 THR 1.24 0.33 1 29 ALA -2.20 0.12 1 30 VAL 0.65 -0.02 1 31 ASN -0.66 0.20 1 32 LYS 3.30 -0.14 1 33 ASP -0.20 -0.11 1 35 THR -4.10 0.47 1 36 TYR -4.26 0.62 1 37 THR 1.81 0.77 1 38 VAL -6.49 1.13 1 39 LYS -3.81 0.74 1 40 PHE -0.53 0.13 1 41 TYR 3.37 -0.15 1 42 ASP 0.86 -0.33 1 44 VAL 2.43 -0.28 1 45 VAL -1.64 1.15 1 46 GLN -6.34 0.50 1 48 VAL -6.09 0.88 1 49 LYS -0.16 0.12 1 50 HIS 3.89 -0.25 1 51 ILE 2.35 0.09 1 52 HIS -2.72 0.24 1 53 VAL -2.05 0.88 1 54 LYS -5.51 0.50 1 55 ALA -0.31 0.12 1 56 PHE 0.61 -0.36 1 57 SER -1.37 -0.10 1 58 LYS 0.84 -0.14 1 59 ASP 0.56 -0.11 1 60 GLN 0.37 -0.09 1 61 ASN -0.03 -0.02 1 62 ILE 0.47 0.00 1 63 VAL 0.84 -0.01 1 65 ASN -0.04 -0.02 1 66 ALA 0.53 0.02 1 67 ARG 0.87 -0.03 1 69 SER 0.32 -0.01 1 70 ARG 0.99 0.00 1 71 ALA 0.13 -0.06 1 73 SER -0.20 -0.01 1 74 SER -0.20 -0.01 1 76 LEU 0.37 0.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17673_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.59 _LACS_plot.Line_1_terminator_val_y_1 -1.64 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.08 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.66 _LACS_plot.Line_2_terminator_val_x_2 4.08 _LACS_plot.Line_2_terminator_val_y_2 0.12 _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 39 LYS -3.81 1.45 0 50 HIS 3.89 2.72 0 38 VAL -6.49 -3.91 0 10 ASN 4.09 -1.33 1 11 GLU -0.38 -0.56 1 12 GLN 0.44 -1.08 1 13 VAL -5.76 -1.52 1 14 LEU -3.50 -2.31 1 15 ALA -6.59 -1.58 1 16 SER -1.23 -0.35 1 17 TRP -4.03 0.53 1 18 SER 2.57 -0.95 1 19 ASP 0.13 -0.10 1 20 SER 3.56 -1.51 1 21 ARG -1.09 -2.11 1 22 PHE -1.38 0.04 1 25 ALA -5.92 -3.33 1 26 LYS -5.18 -0.18 1 27 VAL 2.83 0.74 1 28 THR 1.24 0.57 1 29 ALA -2.20 -2.89 1 30 VAL 0.65 -0.79 1 32 LYS 3.30 -0.48 1 33 ASP -0.20 0.74 1 35 THR -4.10 -1.05 1 36 TYR -4.26 -0.01 1 37 THR 1.81 -0.71 1 40 PHE -0.53 2.31 1 41 TYR 3.37 -1.01 1 42 ASP 0.86 0.51 1 44 VAL 2.43 -1.69 1 45 VAL -1.64 0.34 1 46 GLN -6.34 -2.04 1 47 THR 1.19 -0.20 1 48 VAL -6.09 -1.46 1 49 LYS -0.16 1.51 1 51 ILE 2.35 -0.05 1 52 HIS -2.72 -1.42 1 53 VAL -2.05 -2.31 1 54 LYS -5.51 -2.78 1 55 ALA -0.31 -0.13 1 56 PHE 0.61 -0.42 1 58 LYS 0.84 -0.34 1 62 ILE 0.47 -0.07 1 63 VAL 0.84 0.44 1 65 ASN -0.04 0.02 1 66 ALA 0.53 0.07 1 67 ARG 0.87 0.81 1 69 SER 0.32 -0.30 1 stop_ save_