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 bmr6130_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 -5.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.51 _LACS_plot.Line_2_terminator_val_x_2 6.33 _LACS_plot.Line_2_terminator_val_y_2 2.46 _LACS_plot.Y_axis_chem_shift_offset 2.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 ILE 3.60 -3.18 0 10 GLU -3.16 -3.43 1 12 MET 0.17 -1.16 1 13 THR -0.40 -1.85 1 15 HIS 4.02 2.67 1 16 SER 4.73 0.92 1 18 THR 6.34 1.30 1 19 SER 3.93 0.30 1 20 THR 6.21 2.47 1 21 ILE 5.29 2.66 1 22 GLU 3.70 0.93 1 24 LYS 2.03 -0.23 1 27 LYS -0.67 -2.95 1 28 LEU 0.94 -2.69 1 29 GLN 2.95 -0.64 1 31 VAL 3.45 -0.75 1 32 GLN -0.12 -1.47 1 33 ARG -3.17 -2.84 1 34 ILE -3.60 -4.74 1 35 LYS -4.73 -4.73 1 36 VAL -0.58 -3.20 1 37 SER -3.93 -5.51 1 38 LEU 2.71 0.26 1 39 ASP 3.79 0.53 1 40 ASN -0.60 -3.32 1 41 GLN 4.32 -1.17 1 42 GLU -7.64 -4.34 1 43 ALA -5.26 -5.09 1 44 THR 1.20 -1.51 1 45 ILE -3.75 -3.05 1 46 VAL -0.30 -3.24 1 47 TYR -5.99 -5.37 1 48 GLN -2.80 -4.18 1 50 HIS 1.97 -0.09 1 51 LEU -3.12 -2.64 1 52 ILE -2.07 -3.12 1 53 SER -6.51 -5.25 1 54 VAL 5.91 2.12 1 55 GLU 4.82 1.31 1 56 GLU 2.48 -0.05 1 57 MET 5.01 3.00 1 58 LYS 3.93 1.83 1 59 LYS 3.89 0.72 1 60 GLN 5.13 0.68 1 61 ILE 5.60 3.05 1 62 GLU 3.71 0.24 1 63 ALA 2.84 -0.68 1 64 MET 0.01 -1.25 1 66 PHE -2.14 -3.56 1 68 ALA -5.67 -4.67 1 69 PHE -4.32 -4.02 1 70 VAL 3.44 0.29 1 71 LYS 0.41 -1.49 1 72 LYS -2.02 -2.45 1 73 ILE -0.87 -2.33 1 74 GLU -2.67 -3.13 1 76 ARG 0.67 -1.02 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6130_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 1.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.51 _LACS_plot.Line_2_terminator_val_x_2 6.33 _LACS_plot.Line_2_terminator_val_y_2 -3.87 _LACS_plot.Y_axis_chem_shift_offset 2.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 ILE 3.60 -6.78 0 10 GLU -3.16 -0.27 1 12 MET 0.17 -1.33 1 13 THR -0.40 -1.45 1 15 HIS 4.02 -1.35 1 16 SER 4.73 -3.81 1 18 THR 6.34 -5.04 1 19 SER 3.93 -3.63 1 20 THR 6.21 -3.74 1 21 ILE 5.29 -2.63 1 22 GLU 3.70 -2.77 1 24 LYS 2.03 -2.26 1 27 LYS -0.67 -2.28 1 28 LEU 0.94 -3.63 1 29 GLN 2.95 -3.59 1 31 VAL 3.45 -4.20 1 32 GLN -0.12 -1.35 1 33 ARG -3.17 0.33 1 34 ILE -3.60 -1.14 1 35 LYS -4.73 0.00 1 36 VAL -0.58 -2.62 1 37 SER -3.93 -1.58 1 38 LEU 2.71 -2.45 1 39 ASP 3.79 -3.26 1 40 ASN -0.60 -2.72 1 41 GLN 4.32 -5.49 1 42 GLU -7.64 3.30 1 43 ALA -5.26 0.17 1 44 THR 1.20 -2.71 1 45 ILE -3.75 0.70 1 46 VAL -0.30 -2.94 1 47 TYR -5.99 0.62 1 48 GLN -2.80 -1.38 1 50 HIS 1.97 -2.06 1 51 LEU -3.12 0.48 1 52 ILE -2.07 -1.05 1 53 SER -6.51 1.26 1 54 VAL 5.91 -3.79 1 55 GLU 4.82 -3.51 1 56 GLU 2.48 -2.53 1 57 MET 5.01 -2.01 1 58 LYS 3.93 -2.10 1 59 LYS 3.89 -3.17 1 60 GLN 5.13 -4.45 1 61 ILE 5.60 -2.55 1 62 GLU 3.71 -3.47 1 63 ALA 2.84 -3.52 1 64 MET 0.01 -1.26 1 66 PHE -2.14 -1.42 1 68 ALA -5.67 1.00 1 69 PHE -4.32 0.30 1 70 VAL 3.44 -3.15 1 71 LYS 0.41 -1.90 1 72 LYS -2.02 -0.43 1 73 ILE -0.87 -1.46 1 74 GLU -2.67 -0.46 1 76 ARG 0.67 -1.69 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6130_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 0.91 _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 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.33 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _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 46 VAL -0.30 1.04 0 10 GLU -3.16 0.14 1 12 MET 0.17 0.12 1 13 THR -0.40 0.09 1 15 HIS 4.02 -0.31 1 16 SER 4.73 -0.20 1 18 THR 6.34 -0.83 1 19 SER 3.93 -0.27 1 20 THR 6.21 -0.43 1 21 ILE 5.29 -0.73 1 22 GLU 3.70 -0.77 1 24 LYS 2.03 -0.15 1 25 ILE 3.60 -0.45 1 27 LYS -0.67 -0.02 1 28 LEU 0.94 -0.23 1 29 GLN 2.95 -0.39 1 31 VAL 3.45 -0.22 1 32 GLN -0.12 -0.05 1 33 ARG -3.17 0.17 1 34 ILE -3.60 1.03 1 35 LYS -4.73 0.35 1 36 VAL -0.58 0.42 1 37 SER -3.93 0.27 1 38 LEU 2.71 -0.50 1 39 ASP 3.79 -0.51 1 40 ASN -0.60 -0.06 1 41 GLN 4.32 -0.82 1 42 GLU -7.64 1.04 1 43 ALA -5.26 0.84 1 44 THR 1.20 0.53 1 45 ILE -3.75 0.51 1 47 TYR -5.99 1.07 1 48 GLN -2.80 0.35 1 50 HIS 1.97 -0.18 1 51 LEU -3.12 -0.04 1 52 ILE -2.07 0.21 1 53 SER -6.51 0.51 1 54 VAL 5.91 -1.02 1 55 GLU 4.82 -0.64 1 56 GLU 2.48 -0.41 1 57 MET 5.01 -1.00 1 58 LYS 3.93 -0.88 1 59 LYS 3.89 -0.36 1 60 GLN 5.13 -0.42 1 61 ILE 5.60 -0.55 1 62 GLU 3.71 -0.25 1 63 ALA 2.84 -0.27 1 64 MET 0.01 -0.34 1 66 PHE -2.14 0.17 1 68 ALA -5.67 1.13 1 69 PHE -4.32 0.06 1 70 VAL 3.44 -0.43 1 71 LYS 0.41 0.08 1 72 LYS -2.02 0.06 1 73 ILE -0.87 0.36 1 74 GLU -2.67 0.11 1 76 ARG 0.67 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6130_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.64 _LACS_plot.Line_1_terminator_val_y_1 -5.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.97 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.62 _LACS_plot.Line_2_terminator_val_x_2 6.33 _LACS_plot.Line_2_terminator_val_y_2 -0.30 _LACS_plot.Y_axis_chem_shift_offset 2.76 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 52 ILE -2.07 -8.70 0 10 GLU -3.16 -3.85 1 12 MET 0.17 -1.60 1 13 THR -0.40 -2.97 1 16 SER 4.73 -0.79 1 18 THR 6.34 -0.84 1 19 SER 3.93 -0.09 1 20 THR 6.21 -0.79 1 21 ILE 5.29 -1.15 1 22 GLU 3.70 1.26 1 24 LYS 2.03 -0.20 1 25 ILE 3.60 -1.29 1 27 LYS -0.67 -2.05 1 28 LEU 0.94 -2.58 1 29 GLN 2.95 -3.11 1 31 VAL 3.45 -3.15 1 32 GLN -0.12 -2.03 1 33 ARG -3.17 -5.60 1 34 ILE -3.60 -7.13 1 35 LYS -4.73 -3.73 1 36 VAL -0.58 -4.89 1 37 SER -3.93 -1.84 1 38 LEU 2.71 -0.62 1 39 ASP 3.79 -1.58 1 40 ASN -0.60 -4.15 1 41 GLN 4.32 -3.99 1 42 GLU -7.64 -4.78 1 43 ALA -5.26 -5.00 1 44 THR 1.20 -3.27 1 45 ILE -3.75 -5.00 1 46 VAL -0.30 -2.95 1 47 TYR -5.99 -6.21 1 48 GLN -2.80 -1.43 1 50 HIS 1.97 -1.30 1 51 LEU -3.12 -4.57 1 53 SER -6.51 -1.83 1 54 VAL 5.91 -1.58 1 55 GLU 4.82 -0.36 1 56 GLU 2.48 -0.56 1 57 MET 5.01 -1.79 1 58 LYS 3.93 -1.74 1 59 LYS 3.89 0.69 1 60 GLN 5.13 0.07 1 61 ILE 5.60 -0.67 1 62 GLU 3.71 2.61 1 63 ALA 2.84 -1.19 1 64 MET 0.01 -3.64 1 66 PHE -2.14 -5.42 1 68 ALA -5.67 -4.39 1 69 PHE -4.32 -3.24 1 70 VAL 3.44 -3.16 1 71 LYS 0.41 -3.23 1 72 LYS -2.02 -4.68 1 73 ILE -0.87 -3.20 1 74 GLU -2.67 -3.37 1 76 ARG 0.67 1.99 1 stop_ save_