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 bmr30061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 -2.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.64 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.54 _LACS_plot.Line_2_terminator_val_x_2 3.34 _LACS_plot.Line_2_terminator_val_y_2 1.64 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 HIS 0.29 2.53 0 40 TYR -2.70 1.53 0 10 SER -0.42 -0.25 1 11 HIS -0.53 1.50 1 12 ILE 0.10 -0.89 1 13 SER 1.08 1.47 1 14 LYS -2.63 -0.79 1 15 TYR -4.68 -1.72 1 16 ILE -2.87 -0.88 1 17 LEU -5.80 -2.16 1 18 ARG -6.04 -2.25 1 19 TRP -3.26 0.46 1 20 ARG 0.26 0.51 1 22 LYS 2.17 2.06 1 23 ASN 2.90 1.28 1 24 SER -1.84 -0.63 1 25 VAL 0.21 -1.09 1 27 ARG 0.17 0.26 1 28 TRP 0.72 0.49 1 29 LYS 0.66 -0.15 1 30 GLU -6.99 -1.95 1 31 ALA -4.52 -0.97 1 32 THR 0.72 0.61 1 33 ILE -3.56 0.24 1 36 HIS 0.16 1.38 1 37 LEU -1.55 -0.67 1 38 ASN -1.56 -1.60 1 39 SER -4.04 -1.46 1 41 THR 0.92 0.00 1 42 ILE 1.24 1.02 1 43 LYS -3.73 -1.67 1 45 LEU -1.22 -1.19 1 46 LYS -3.81 -3.11 1 49 VAL -1.10 -0.15 1 50 VAL 1.38 0.12 1 51 TYR -1.53 0.03 1 52 GLU -5.09 -2.34 1 54 GLN -4.44 -1.23 1 55 LEU -3.43 -1.24 1 56 ILE -1.75 -0.91 1 57 SER -2.72 -1.81 1 58 ILE 0.96 -0.26 1 59 GLN -1.30 -0.45 1 60 GLN 3.35 2.70 1 61 TYR 2.25 0.13 1 64 GLN -3.40 -1.32 1 65 GLU -3.79 -1.36 1 66 VAL -1.85 -0.33 1 67 THR -0.81 0.24 1 68 ARG -1.63 -0.29 1 69 PHE -1.66 -1.07 1 70 ASP -3.71 -1.27 1 71 PHE -2.51 -0.34 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 4.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.36 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.46 _LACS_plot.Line_2_terminator_val_x_2 3.34 _LACS_plot.Line_2_terminator_val_y_2 -1.70 _LACS_plot.Y_axis_chem_shift_offset -0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 63 HIS 0.29 2.24 0 40 TYR -2.70 4.23 0 10 SER -0.42 0.17 1 11 HIS -0.53 2.03 1 12 ILE 0.10 -0.99 1 13 SER 1.08 0.39 1 14 LYS -2.63 1.84 1 15 TYR -4.68 2.96 1 16 ILE -2.87 1.99 1 17 LEU -5.80 3.64 1 18 ARG -6.04 3.79 1 19 TRP -3.26 3.72 1 20 ARG 0.26 0.25 1 22 LYS 2.17 -0.11 1 23 ASN 2.90 -1.62 1 24 SER -1.84 1.21 1 25 VAL 0.21 -1.30 1 27 ARG 0.17 0.09 1 28 TRP 0.72 -0.23 1 29 LYS 0.66 -0.81 1 30 GLU -6.99 5.04 1 31 ALA -4.52 3.55 1 32 THR 0.72 -0.11 1 33 ILE -3.56 3.80 1 36 HIS 0.16 1.22 1 37 LEU -1.55 0.88 1 38 ASN -1.56 -0.04 1 39 SER -4.04 2.58 1 41 THR 0.92 -0.92 1 42 ILE 1.24 -0.22 1 43 LYS -3.73 2.06 1 45 LEU -1.22 0.03 1 46 LYS -3.81 0.70 1 49 VAL -1.10 0.95 1 50 VAL 1.38 -1.26 1 51 TYR -1.53 1.56 1 52 GLU -5.09 2.75 1 54 GLN -4.44 3.21 1 55 LEU -3.43 2.19 1 56 ILE -1.75 0.84 1 57 SER -2.72 0.91 1 58 ILE 0.96 -1.22 1 59 GLN -1.30 0.85 1 60 GLN 3.35 -0.65 1 61 TYR 2.25 -2.12 1 64 GLN -3.40 2.08 1 65 GLU -3.79 2.43 1 66 VAL -1.85 1.52 1 67 THR -0.81 1.05 1 68 ARG -1.63 1.34 1 69 PHE -1.66 0.59 1 70 ASP -3.71 2.44 1 71 PHE -2.51 2.17 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 1.11 _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 0.34 _LACS_plot.Line_2_terminator_val_x_2 3.34 _LACS_plot.Line_2_terminator_val_y_2 -0.40 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 19 TRP -3.26 1.92 0 38 ASN -1.56 -1.09 0 10 SER -0.42 -0.02 1 11 HIS -0.53 -0.14 1 12 ILE 0.10 -0.14 1 13 SER 1.08 -0.09 1 14 LYS -2.63 0.20 1 15 TYR -4.68 0.92 1 16 ILE -2.87 0.66 1 17 LEU -5.80 1.15 1 18 ARG -6.04 1.71 1 20 ARG 0.26 0.49 1 22 LYS 2.17 -0.52 1 23 ASN 2.90 -0.33 1 24 SER -1.84 -0.02 1 25 VAL 0.21 0.23 1 27 ARG 0.17 -0.15 1 28 TRP 0.72 -0.50 1 29 LYS 0.66 -0.15 1 30 GLU -6.99 1.14 1 31 ALA -4.52 0.40 1 32 THR 0.72 0.63 1 33 ILE -3.56 0.41 1 36 HIS 0.16 0.14 1 37 LEU -1.55 0.09 1 39 SER -4.04 0.12 1 40 TYR -2.70 -0.17 1 41 THR 0.92 0.37 1 42 ILE 1.24 -0.58 1 43 LYS -3.73 0.52 1 45 LEU -1.22 0.04 1 46 LYS -3.81 0.55 1 49 VAL -1.10 -0.15 1 50 VAL 1.38 0.10 1 51 TYR -1.53 -0.15 1 52 GLU -5.09 0.75 1 54 GLN -4.44 0.80 1 55 LEU -3.43 0.78 1 56 ILE -1.75 0.84 1 57 SER -2.72 0.13 1 58 ILE 0.96 0.23 1 59 GLN -1.30 0.41 1 60 GLN 3.35 -0.42 1 61 TYR 2.25 0.03 1 63 HIS 0.29 -0.27 1 64 GLN -3.40 0.91 1 65 GLU -3.79 0.27 1 66 VAL -1.85 0.58 1 67 THR -0.81 0.36 1 68 ARG -1.63 0.88 1 69 PHE -1.66 0.38 1 70 ASP -3.71 1.14 1 71 PHE -2.51 0.56 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30061_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.99 _LACS_plot.Line_1_terminator_val_y_1 -2.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.24 _LACS_plot.Line_2_terminator_val_x_2 3.34 _LACS_plot.Line_2_terminator_val_y_2 0.24 _LACS_plot.Y_axis_chem_shift_offset 0.70 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 14 LYS -2.63 -4.96 0 10 SER -0.42 -0.33 1 11 HIS -0.53 0.74 1 12 ILE 0.10 -0.46 1 13 SER 1.08 0.42 1 15 TYR -4.68 -0.63 1 16 ILE -2.87 -2.20 1 17 LEU -5.80 -2.44 1 18 ARG -6.04 -0.24 1 19 TRP -3.26 -1.41 1 20 ARG 0.26 -2.32 1 22 LYS 2.17 0.44 1 23 ASN 2.90 -0.86 1 24 SER -1.84 -0.31 1 25 VAL 0.21 0.55 1 27 ARG 0.17 0.76 1 28 TRP 0.72 1.80 1 29 LYS 0.66 -1.62 1 30 GLU -6.99 -1.32 1 31 ALA -4.52 -2.49 1 32 THR 0.72 -0.50 1 33 ILE -3.56 -2.00 1 36 HIS 0.16 1.00 1 37 LEU -1.55 -1.58 1 38 ASN -1.56 -2.84 1 39 SER -4.04 -1.88 1 40 TYR -2.70 -2.63 1 41 THR 0.92 -2.11 1 42 ILE 1.24 -1.83 1 43 LYS -3.73 0.26 1 45 LEU -1.22 -1.64 1 46 LYS -3.81 -1.94 1 49 VAL -1.10 -1.22 1 50 VAL 1.38 -1.08 1 51 TYR -1.53 -1.42 1 52 GLU -5.09 -1.83 1 54 GLN -4.44 -2.08 1 55 LEU -3.43 -2.93 1 56 ILE -1.75 -0.44 1 57 SER -2.72 -0.97 1 58 ILE 0.96 -0.82 1 59 GLN -1.30 1.08 1 60 GLN 3.35 0.39 1 61 TYR 2.25 0.59 1 63 HIS 0.29 0.17 1 64 GLN -3.40 -1.23 1 65 GLU -3.79 -1.95 1 66 VAL -1.85 -1.01 1 67 THR -0.81 -1.25 1 68 ARG -1.63 -0.88 1 69 PHE -1.66 -4.20 1 70 ASP -3.71 0.07 1 71 PHE -2.51 -3.47 1 stop_ save_