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 bmr6594_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.00 _LACS_plot.Line_1_terminator_val_y_1 -3.16 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.28 _LACS_plot.Line_2_terminator_val_x_2 5.20 _LACS_plot.Line_2_terminator_val_y_2 4.24 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 ARG -9.00 -4.30 0 50 ASP 1.20 -1.50 0 10 GLN -1.30 -1.00 1 11 SER 0.00 0.30 1 12 LYS 0.50 0.50 1 14 TYR 0.30 0.40 1 15 TRP -1.00 -0.50 1 16 GLN -0.30 0.40 1 17 GLU 0.20 0.20 1 18 ASP 1.60 1.40 1 19 GLU 1.60 1.40 1 20 ASP -0.40 0.20 1 21 ALA -2.40 -0.70 1 23 ALA -6.10 -2.40 1 25 ASN 2.60 4.20 1 30 VAL 0.50 0.50 1 31 PHE 3.10 2.00 1 32 THR -2.90 -1.60 1 33 THR 2.70 0.90 1 34 THR 0.60 0.40 1 35 VAL -0.90 0.00 1 36 ARG -0.60 0.20 1 37 ARG -4.00 -0.40 1 38 HIS -1.60 1.00 1 39 HIS 2.90 2.40 1 41 ARG 2.30 3.30 1 42 ASN 1.90 1.90 1 45 TYR 0.70 -0.10 1 46 VAL -7.50 -2.10 1 47 LEU 3.20 3.50 1 52 SER 1.50 1.60 1 53 ARG 0.60 1.70 1 54 HIS -5.40 -2.30 1 55 ARG -5.10 -0.60 1 56 ALA -0.30 -0.40 1 57 ALA -0.40 0.00 1 58 ILE 4.00 2.70 1 60 MET -1.00 -0.70 1 61 ARG 0.00 -0.40 1 63 ILE 3.10 1.10 1 64 THR -1.40 -0.60 1 65 GLU -6.80 -1.80 1 67 GLU 1.90 2.60 1 69 VAL 5.20 4.40 1 71 ASP 3.70 3.30 1 72 ALA 5.20 4.50 1 74 TYR 3.10 2.60 1 75 LEU 2.80 2.40 1 76 ALA 1.70 1.70 1 77 LEU 2.50 1.50 1 78 ARG 1.30 1.20 1 79 SER 0.90 1.00 1 80 SER 0.70 0.70 1 81 ASN 0.50 0.40 1 82 MET 0.20 0.50 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6594_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.00 _LACS_plot.Line_1_terminator_val_y_1 5.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.03 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.72 _LACS_plot.Line_2_terminator_val_x_2 5.20 _LACS_plot.Line_2_terminator_val_y_2 -0.96 _LACS_plot.Y_axis_chem_shift_offset -0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 ARG -9.00 4.70 0 50 ASP 1.20 -2.70 0 10 GLN -1.30 0.30 1 11 SER 0.00 0.30 1 12 LYS 0.50 0.00 1 14 TYR 0.30 0.10 1 15 TRP -1.00 0.50 1 16 GLN -0.30 0.70 1 17 GLU 0.20 0.00 1 18 ASP 1.60 -0.20 1 19 GLU 1.60 -0.20 1 20 ASP -0.40 0.60 1 21 ALA -2.40 1.70 1 23 ALA -6.10 3.70 1 25 ASN 2.60 1.60 1 30 VAL 0.50 0.00 1 31 PHE 3.10 -1.10 1 32 THR -2.90 1.30 1 33 THR 2.70 -1.80 1 34 THR 0.60 -0.20 1 35 VAL -0.90 0.90 1 36 ARG -0.60 0.80 1 37 ARG -4.00 3.60 1 38 HIS -1.60 2.60 1 39 HIS 2.90 -0.50 1 41 ARG 2.30 1.00 1 42 ASN 1.90 0.00 1 45 TYR 0.70 -0.80 1 46 VAL -7.50 5.40 1 47 LEU 3.20 0.30 1 52 SER 1.50 0.10 1 53 ARG 0.60 1.10 1 54 HIS -5.40 3.10 1 55 ARG -5.10 4.50 1 56 ALA -0.30 -0.10 1 57 ALA -0.40 0.40 1 58 ILE 4.00 -1.30 1 60 MET -1.00 0.30 1 61 ARG 0.00 -0.40 1 63 ILE 3.10 -2.00 1 64 THR -1.40 0.80 1 65 GLU -6.80 5.00 1 67 GLU 1.90 0.70 1 69 VAL 5.20 -0.80 1 71 ASP 3.70 -0.40 1 72 ALA 5.20 -0.70 1 74 TYR 3.10 -0.50 1 75 LEU 2.80 -0.40 1 76 ALA 1.70 0.00 1 77 LEU 2.50 -1.00 1 78 ARG 1.30 -0.10 1 79 SER 0.90 0.10 1 80 SER 0.70 0.00 1 81 ASN 0.50 -0.10 1 82 MET 0.20 0.30 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6594_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.00 _LACS_plot.Line_1_terminator_val_y_1 0.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 5.20 _LACS_plot.Line_2_terminator_val_y_2 -0.41 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 ARG -9.00 1.89 0 10 GLN -1.30 -0.04 1 11 SER 0.00 -0.07 1 12 LYS 0.50 -0.04 1 14 TYR 0.30 -0.12 1 15 TRP -1.00 -0.20 1 16 GLN -0.30 -0.39 1 17 GLU 0.20 -0.19 1 18 ASP 1.60 -0.54 1 19 GLU 1.60 -0.37 1 20 ASP -0.40 0.02 1 21 ALA -2.40 0.32 1 23 ALA -6.10 0.25 1 25 ASN 2.60 -0.29 1 30 VAL 0.50 -0.31 1 31 PHE 3.10 0.05 1 32 THR -2.90 0.43 1 33 THR 2.70 0.03 1 34 THR 0.60 0.11 1 35 VAL -0.90 -0.08 1 36 ARG -0.60 -0.92 1 37 ARG -4.00 0.12 1 38 HIS -1.60 0.43 1 39 HIS 2.90 -0.02 1 41 ARG 2.30 0.29 1 42 ASN 1.90 -0.09 1 45 TYR 0.70 0.29 1 46 VAL -7.50 1.66 1 47 LEU 3.20 -0.19 1 50 ASP 1.20 0.53 1 52 SER 1.50 -0.35 1 53 ARG 0.60 -0.44 1 54 HIS -5.40 0.86 1 55 ARG -5.10 0.32 1 56 ALA -0.30 -0.13 1 57 ALA -0.40 0.13 1 58 ILE 4.00 -0.14 1 60 MET -1.00 0.26 1 61 ARG 0.00 0.12 1 63 ILE 3.10 -0.17 1 64 THR -1.40 0.09 1 65 GLU -6.80 0.35 1 67 GLU 1.90 -0.09 1 69 VAL 5.20 -0.34 1 71 ASP 3.70 -0.15 1 72 ALA 5.20 -0.74 1 74 TYR 3.10 -0.63 1 75 LEU 2.80 -0.25 1 76 ALA 1.70 -0.25 1 77 LEU 2.50 -0.27 1 78 ARG 1.30 -0.10 1 79 SER 0.90 -0.07 1 80 SER 0.70 -0.05 1 81 ASN 0.50 -0.05 1 82 MET 0.20 0.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6594_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.00 _LACS_plot.Line_1_terminator_val_y_1 -2.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.30 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 5.20 _LACS_plot.Line_2_terminator_val_y_2 1.10 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 71 ASP 3.70 3.70 0 68 ARG -9.00 -1.00 0 10 GLN -1.30 0.00 1 11 SER 0.00 -0.10 1 12 LYS 0.50 0.30 1 14 TYR 0.30 -1.20 1 15 TRP -1.00 -1.10 1 16 GLN -0.30 -0.50 1 17 GLU 0.20 0.40 1 18 ASP 1.60 1.20 1 19 GLU 1.60 -0.20 1 20 ASP -0.40 -1.30 1 21 ALA -2.40 -0.60 1 23 ALA -6.10 -2.30 1 25 ASN 2.60 -1.10 1 30 VAL 0.50 0.20 1 31 PHE 3.10 0.90 1 32 THR -2.90 0.50 1 33 THR 2.70 -0.50 1 34 THR 0.60 -2.10 1 35 VAL -0.90 -0.70 1 36 ARG -0.60 -0.90 1 37 ARG -4.00 -0.20 1 38 HIS -1.60 0.90 1 39 HIS 2.90 -0.40 1 41 ARG 2.30 -0.10 1 42 ASN 1.90 -1.10 1 45 TYR 0.70 -0.40 1 46 VAL -7.50 -1.50 1 47 LEU 3.20 2.00 1 50 ASP 1.20 -1.30 1 52 SER 1.50 1.80 1 53 ARG 0.60 0.50 1 54 HIS -5.40 -0.80 1 55 ARG -5.10 -2.00 1 56 ALA -0.30 -1.10 1 57 ALA -0.40 -0.20 1 58 ILE 4.00 0.90 1 60 MET -1.00 -0.10 1 61 ARG 0.00 -0.20 1 63 ILE 3.10 -0.30 1 64 THR -1.40 -1.40 1 65 GLU -6.80 -1.70 1 67 GLU 1.90 -1.20 1 69 VAL 5.20 1.80 1 72 ALA 5.20 1.10 1 74 TYR 3.10 2.10 1 75 LEU 2.80 2.70 1 76 ALA 1.70 1.40 1 77 LEU 2.50 1.10 1 78 ARG 1.30 0.40 1 79 SER 0.90 -0.20 1 80 SER 0.70 0.00 1 81 ASN 0.50 -0.30 1 82 MET 0.20 0.30 1 stop_ save_