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 bmr30070_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.36 _LACS_plot.Line_1_terminator_val_y_1 -6.49 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.84 _LACS_plot.Line_2_terminator_val_x_2 5.08 _LACS_plot.Line_2_terminator_val_y_2 0.85 _LACS_plot.Y_axis_chem_shift_offset 2.59 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 TYR -3.28 -7.17 0 22 MET 0.11 -2.70 1 24 LYS -1.01 -3.16 1 25 ALA -1.74 -4.00 1 27 TYR -2.78 -3.79 1 28 ASP -3.84 -4.22 1 29 ILE -2.83 -1.70 1 30 VAL -4.47 -5.63 1 32 SER -0.89 -3.49 1 33 ASP 3.96 -0.27 1 34 ASN 0.07 -2.94 1 35 ARG -0.32 -2.53 1 36 TRP -4.62 -4.58 1 38 ILE -6.24 -3.24 1 39 ARG -0.25 -3.15 1 40 HIS 0.17 -1.95 1 41 ASP 3.93 -1.16 1 42 ASP -0.29 -1.74 1 43 ASP 1.16 -1.24 1 45 THR -0.96 -2.93 1 47 ASP -3.78 -3.88 1 48 TYR 0.82 -1.64 1 49 SER -4.47 -4.35 1 50 SER 2.88 0.53 1 51 LYS 5.08 0.46 1 52 GLU 3.00 -0.24 1 53 ALA 2.61 -0.80 1 54 ALA 4.18 0.58 1 55 PHE 4.51 0.41 1 56 GLU 3.31 -0.34 1 57 ALA 3.34 -0.28 1 58 ALA 3.97 -0.41 1 60 ALA 4.02 -0.45 1 61 ALA 1.28 -1.10 1 62 ALA 5.04 1.38 1 63 SER 3.49 0.32 1 64 ASN 3.69 0.17 1 65 ALA 2.73 0.88 1 66 ILE 4.39 0.20 1 67 LYS 0.99 -2.44 1 68 PHE -1.21 -3.27 1 70 HIS -0.89 -2.83 1 71 GLU -4.09 -4.74 1 72 VAL -4.20 -3.21 1 73 ARG -1.65 -3.64 1 74 ILE -2.87 -4.09 1 75 THR -9.36 -6.17 1 76 VAL -0.11 -2.67 1 79 ASN 0.12 -2.68 1 80 ASP 0.46 -2.01 1 82 SER 0.46 -2.48 1 83 GLU 0.31 -2.39 1 84 THR 0.34 -2.59 1 85 ASN 0.60 -2.38 1 86 LEU 0.24 -2.65 1 88 VAL 0.18 -2.88 1 89 ILE -0.53 -3.04 1 90 THR 0.26 -0.97 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30070_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.36 _LACS_plot.Line_1_terminator_val_y_1 2.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.84 _LACS_plot.Line_2_terminator_val_x_2 5.08 _LACS_plot.Line_2_terminator_val_y_2 -4.23 _LACS_plot.Y_axis_chem_shift_offset 2.59 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 26 TYR -3.28 -3.89 0 22 MET 0.11 -2.81 1 24 LYS -1.01 -2.15 1 25 ALA -1.74 -2.26 1 27 TYR -2.78 -1.01 1 28 ASP -3.84 -0.38 1 29 ILE -2.83 1.13 1 30 VAL -4.47 -1.16 1 32 SER -0.89 -2.60 1 33 ASP 3.96 -4.23 1 34 ASN 0.07 -3.01 1 35 ARG -0.32 -2.21 1 36 TRP -4.62 0.04 1 38 ILE -6.24 3.00 1 39 ARG -0.25 -2.90 1 40 HIS 0.17 -2.12 1 41 ASP 3.93 -5.09 1 42 ASP -0.29 -1.45 1 43 ASP 1.16 -2.40 1 45 THR -0.96 -1.97 1 47 ASP -3.78 -0.10 1 48 TYR 0.82 -2.46 1 49 SER -4.47 0.12 1 50 SER 2.88 -2.35 1 51 LYS 5.08 -4.62 1 52 GLU 3.00 -3.24 1 53 ALA 2.61 -3.41 1 54 ALA 4.18 -3.60 1 55 PHE 4.51 -4.10 1 56 GLU 3.31 -3.65 1 57 ALA 3.34 -3.62 1 58 ALA 3.97 -4.38 1 60 ALA 4.02 -4.47 1 61 ALA 1.28 -2.38 1 62 ALA 5.04 -3.66 1 63 SER 3.49 -3.17 1 64 ASN 3.69 -3.52 1 65 ALA 2.73 -1.85 1 66 ILE 4.39 -4.19 1 67 LYS 0.99 -3.43 1 68 PHE -1.21 -2.06 1 70 HIS -0.89 -1.94 1 71 GLU -4.09 -0.65 1 72 VAL -4.20 0.99 1 73 ARG -1.65 -1.99 1 74 ILE -2.87 -1.22 1 75 THR -9.36 3.19 1 76 VAL -0.11 -2.56 1 79 ASN 0.12 -2.80 1 80 ASP 0.46 -2.47 1 82 SER 0.46 -2.94 1 83 GLU 0.31 -2.70 1 84 THR 0.34 -2.93 1 85 ASN 0.60 -2.98 1 86 LEU 0.24 -2.89 1 88 VAL 0.18 -3.06 1 89 ILE -0.53 -2.51 1 90 THR 0.26 -1.23 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30070_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 0.68 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.22 _LACS_plot.Line_2_terminator_val_x_2 5.08 _LACS_plot.Line_2_terminator_val_y_2 -0.65 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 ALA 2.61 -1.56 0 22 MET 0.11 -0.14 1 24 LYS -1.01 0.06 1 25 ALA -1.74 0.03 1 26 TYR -3.28 0.31 1 27 TYR -2.78 0.45 1 28 ASP -3.84 -0.42 1 29 ILE -2.83 0.76 1 30 VAL -4.47 0.77 1 32 SER -0.89 -0.27 1 33 ASP 3.96 -0.46 1 34 ASN 0.07 0.33 1 35 ARG -0.32 0.31 1 36 TRP -4.62 0.44 1 38 ILE -6.24 0.47 1 39 ARG -0.25 0.31 1 40 HIS 0.17 -0.06 1 41 ASP 3.93 -0.02 1 42 ASP -0.29 -0.35 1 45 THR 1.16 0.22 1 47 ASP -0.96 0.19 1 48 TYR -3.78 0.19 1 49 SER 0.82 0.21 1 50 SER -4.47 -0.01 1 51 LYS 2.88 -0.38 1 52 GLU 5.08 -0.62 1 53 ALA 3.00 -0.34 1 55 PHE 4.18 -0.70 1 56 GLU 4.51 -0.93 1 57 ALA 3.31 -0.36 1 58 ALA 3.34 -0.79 1 60 ALA 3.97 -0.73 1 61 ALA 4.02 -0.19 1 62 ALA 1.28 -0.55 1 63 SER 5.04 0.19 1 64 ASN 3.49 -0.43 1 65 ALA 3.69 -0.47 1 66 ILE 2.73 -0.69 1 67 LYS 4.39 -0.49 1 68 PHE 0.99 -0.18 1 70 HIS -1.21 -0.13 1 71 GLU -0.89 -0.09 1 72 VAL -4.09 1.31 1 73 ARG -4.20 1.12 1 74 ILE -1.65 -0.35 1 75 THR -2.87 0.99 1 79 ASN -0.11 0.05 1 80 ASP 0.12 -0.05 1 82 SER 0.46 -0.10 1 83 GLU 0.46 -0.02 1 84 THR 0.31 -0.19 1 85 ASN 0.34 -0.09 1 86 LEU 0.60 -0.09 1 88 VAL 0.24 -0.09 1 89 ILE 0.18 0.03 1 90 THR -0.53 -0.05 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30070_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.24 _LACS_plot.Line_1_terminator_val_y_1 -5.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.93 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.55 _LACS_plot.Line_2_terminator_val_x_2 5.08 _LACS_plot.Line_2_terminator_val_y_2 -0.63 _LACS_plot.Y_axis_chem_shift_offset 2.71 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 ILE -6.24 -3.29 0 90 THR 0.26 1.44 0 25 ALA -1.74 -7.42 0 22 MET 0.11 -2.17 1 24 LYS -1.01 -3.87 1 26 TYR -3.28 -2.88 1 27 TYR -2.78 -4.61 1 28 ASP -3.84 -4.72 1 29 ILE -2.83 -4.08 1 30 VAL -4.47 -4.50 1 32 SER -0.89 -4.41 1 33 ASP 3.96 -3.77 1 34 ASN 0.07 -4.28 1 35 ARG -0.32 -5.17 1 36 TRP -4.62 -3.90 1 39 ARG -0.25 -2.83 1 40 HIS 0.17 -5.37 1 41 ASP 3.93 -4.05 1 42 ASP -0.29 -2.14 1 43 ASP 1.16 -0.21 1 45 THR -0.96 -5.23 1 47 ASP -3.78 -1.83 1 48 TYR 0.82 -3.69 1 49 SER -4.47 -4.33 1 50 SER 2.88 -1.31 1 51 LYS 5.08 -1.57 1 52 GLU 3.00 0.18 1 53 ALA 2.61 -2.34 1 54 ALA 4.18 -1.22 1 55 PHE 4.51 0.07 1 56 GLU 3.31 0.13 1 57 ALA 3.34 -1.93 1 58 ALA 3.97 -0.01 1 60 ALA 4.02 0.33 1 61 ALA 1.28 -1.76 1 62 ALA 5.04 1.49 1 63 SER 3.49 -1.93 1 64 ASN 3.69 -0.06 1 65 ALA 2.73 1.09 1 66 ILE 4.39 -1.53 1 67 LYS 0.99 -2.90 1 68 PHE -1.21 -2.10 1 70 HIS -0.89 -4.17 1 71 GLU -4.09 -2.99 1 72 VAL -4.20 -3.65 1 73 ARG -1.65 -3.35 1 74 ILE -2.87 -4.17 1 75 THR -0.11 -2.42 1 79 ASN 0.12 -2.15 1 80 ASP 0.46 -2.44 1 82 SER 0.46 -2.63 1 83 GLU 0.31 -3.15 1 84 THR 0.34 -2.81 1 85 ASN 0.60 -2.48 1 86 LEU 0.24 -2.98 1 88 VAL 0.18 -2.77 1 89 ILE -0.53 -4.03 1 stop_ save_