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 bmr17196_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.12 _LACS_plot.Line_1_terminator_val_y_1 -2.77 _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 -1.91 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 5.01 _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 39 GLN 0.38 -1.93 0 10 GLN -0.51 -0.41 1 11 VAL -3.02 -1.18 1 12 GLU -3.56 -1.16 1 14 MET -0.37 0.87 1 15 SER -1.47 1.06 1 18 HIS 4.00 4.96 1 20 VAL 5.47 4.16 1 21 ASN 3.40 3.03 1 22 ALA 3.40 2.58 1 23 ILE 5.37 4.68 1 24 GLU 4.58 4.07 1 25 SER 4.31 3.38 1 26 SER 4.56 3.28 1 27 VAL 5.00 3.79 1 28 LYS 2.92 1.85 1 29 GLU 0.34 0.39 1 30 LEU 0.60 -0.23 1 31 ASN 2.21 1.20 1 33 VAL 2.32 0.75 1 34 GLU -1.54 0.06 1 35 GLN -3.78 -0.76 1 36 VAL -3.50 -1.92 1 37 LYS -4.38 -1.61 1 38 VAL 0.70 0.10 1 40 LEU 3.86 3.55 1 41 ALA 3.62 2.34 1 42 GLU -0.45 0.01 1 44 THR -6.12 -3.13 1 45 VAL -2.84 -0.94 1 46 GLU -4.13 -2.27 1 47 VAL -4.99 -2.69 1 48 THR 0.34 0.15 1 49 ILE -5.53 -2.49 1 50 ASP -0.85 -1.48 1 51 SER 2.14 1.68 1 52 SER 1.64 1.65 1 53 VAL -1.37 0.79 1 54 VAL -5.14 -2.68 1 55 THR -5.70 -2.67 1 56 LEU 4.31 3.38 1 57 LYS 4.54 3.39 1 58 ASP 3.02 3.03 1 59 ILE 4.02 3.07 1 60 VAL 6.15 5.13 1 61 ALA 3.69 2.68 1 62 VAL 4.62 3.52 1 63 ILE 5.70 5.56 1 64 GLU 3.62 2.71 1 65 ASP 2.88 2.48 1 66 GLN -0.34 -0.27 1 68 TYR -1.43 -0.67 1 69 ASP -2.31 -0.58 1 70 VAL 1.04 0.09 1 71 GLN -1.43 -0.17 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17196_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.12 _LACS_plot.Line_1_terminator_val_y_1 3.35 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -1.14 _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 39 GLN 0.38 -2.31 0 10 GLN -0.51 0.10 1 11 VAL -3.02 1.84 1 12 GLU -3.56 2.40 1 14 MET -0.37 1.24 1 15 SER -1.47 2.53 1 18 HIS 4.00 0.96 1 20 VAL 5.47 -1.31 1 21 ASN 3.40 -0.37 1 22 ALA 3.40 -0.82 1 23 ILE 5.37 -0.69 1 24 GLU 4.58 -0.51 1 25 SER 4.31 -0.93 1 26 SER 4.56 -1.28 1 27 VAL 5.00 -1.21 1 28 LYS 2.92 -1.07 1 29 GLU 0.34 0.05 1 30 LEU 0.60 -0.83 1 31 ASN 2.21 -1.01 1 33 VAL 2.32 -1.57 1 34 GLU -1.54 1.60 1 35 GLN -3.78 3.02 1 36 VAL -3.50 1.58 1 37 LYS -4.38 2.77 1 38 VAL 0.70 -0.60 1 40 LEU 3.86 -0.31 1 41 ALA 3.62 -1.28 1 42 GLU -0.45 0.46 1 44 THR -6.12 2.99 1 45 VAL -2.84 1.90 1 46 GLU -4.13 1.86 1 47 VAL -4.99 2.30 1 48 THR 0.34 -0.19 1 49 ILE -5.53 3.04 1 50 ASP -0.85 -0.63 1 51 SER 2.14 -0.46 1 52 SER 1.64 0.01 1 53 VAL -1.37 2.16 1 54 VAL -5.14 2.46 1 55 THR -5.70 3.03 1 56 LEU 4.31 -0.93 1 57 LYS 4.54 -1.15 1 58 ASP 3.02 0.01 1 59 ILE 4.02 -0.95 1 60 VAL 6.15 -1.02 1 61 ALA 3.69 -1.01 1 62 VAL 4.62 -1.10 1 63 ILE 5.70 -0.14 1 64 GLU 3.62 -0.91 1 65 ASP 2.88 -0.40 1 66 GLN -0.34 0.07 1 68 TYR -1.43 0.76 1 69 ASP -2.31 1.73 1 70 VAL 1.04 -0.95 1 71 GLN -1.43 1.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17196_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.12 _LACS_plot.Line_1_terminator_val_y_1 0.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.35 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _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 48 THR 0.34 0.88 0 10 GLN -0.51 0.37 1 11 VAL -3.02 0.64 1 12 GLU -3.56 0.28 1 14 MET -0.37 0.56 1 15 SER -1.47 0.24 1 18 HIS 4.00 -0.09 1 20 VAL 5.47 -0.59 1 21 ASN 3.40 -0.26 1 22 ALA 3.40 -0.08 1 23 ILE 5.37 -0.73 1 24 GLU 4.58 -0.77 1 25 SER 4.31 -0.42 1 26 SER 4.56 -0.32 1 27 VAL 5.00 -0.41 1 28 LYS 2.92 -0.54 1 29 GLU 0.34 -0.30 1 30 LEU 0.60 -0.16 1 31 ASN 2.21 -0.30 1 33 VAL 2.32 -0.05 1 34 GLU -1.54 0.06 1 35 GLN -3.78 0.28 1 36 VAL -3.50 0.82 1 37 LYS -4.38 0.38 1 38 VAL 0.70 0.19 1 39 GLN 0.38 0.42 1 40 LEU 3.86 -0.53 1 41 ALA 3.62 -0.27 1 42 GLU -0.45 -0.10 1 44 THR -6.12 1.14 1 45 VAL -2.84 0.34 1 46 GLU -4.13 0.90 1 47 VAL -4.99 0.93 1 49 ILE -5.53 1.14 1 50 ASP -0.85 0.38 1 51 SER 2.14 0.47 1 52 SER 1.64 0.00 1 53 VAL -1.37 0.03 1 54 VAL -5.14 0.52 1 55 THR -5.70 0.47 1 56 LEU 4.31 -0.47 1 57 LYS 4.54 -0.47 1 58 ASP 3.02 -0.28 1 59 ILE 4.02 -0.66 1 60 VAL 6.15 -0.87 1 61 ALA 3.69 -0.12 1 62 VAL 4.62 -0.25 1 63 ILE 5.70 -0.64 1 64 GLU 3.62 0.23 1 65 ASP 2.88 -0.15 1 66 GLN -0.34 -0.08 1 68 TYR -1.43 0.11 1 69 ASP -2.31 0.31 1 70 VAL 1.04 0.51 1 71 GLN -1.43 0.18 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17196_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.12 _LACS_plot.Line_1_terminator_val_y_1 -2.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.61 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 6.15 _LACS_plot.Line_2_terminator_val_y_2 2.21 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 22 ALA 3.40 -6.92 0 10 GLN -0.51 -1.29 1 11 VAL -3.02 -1.33 1 12 GLU -3.56 -0.21 1 15 SER -1.47 -0.43 1 18 HIS 4.00 3.85 1 20 VAL 5.47 1.10 1 21 ASN 3.40 2.81 1 23 ILE 5.37 0.50 1 24 GLU 4.58 2.18 1 25 SER 4.31 2.20 1 26 SER 4.56 2.41 1 27 VAL 5.00 0.60 1 28 LYS 2.92 -0.14 1 29 GLU 0.34 0.87 1 30 LEU 0.60 -0.49 1 31 ASN 2.21 0.33 1 33 VAL 2.32 -0.82 1 34 GLU -1.54 -0.23 1 35 GLN -3.78 -2.91 1 36 VAL -3.50 -3.70 1 37 LYS -4.38 -1.27 1 38 VAL 0.70 -0.88 1 39 GLN 0.38 -0.31 1 40 LEU 3.86 1.58 1 41 ALA 3.62 1.54 1 42 GLU -0.45 0.29 1 44 THR -6.12 -0.97 1 45 VAL -2.84 -2.31 1 46 GLU -4.13 -0.05 1 47 VAL -4.99 -2.02 1 48 THR 0.34 0.06 1 49 ILE -5.53 -2.79 1 50 ASP -0.85 1.30 1 51 SER 2.14 0.50 1 52 SER 1.64 0.12 1 53 VAL -1.37 -2.04 1 54 VAL -5.14 -4.85 1 55 THR -5.70 0.80 1 56 LEU 4.31 0.64 1 57 LYS 4.54 2.19 1 58 ASP 3.02 1.98 1 59 ILE 4.02 0.86 1 60 VAL 6.15 0.99 1 61 ALA 3.69 2.23 1 62 VAL 4.62 2.38 1 63 ILE 5.70 2.18 1 64 GLU 3.62 -4.69 1 65 ASP 2.88 1.48 1 66 GLN -0.34 -0.43 1 68 TYR -1.43 -2.33 1 69 ASP -2.31 -0.62 1 70 VAL 1.04 -0.48 1 stop_ save_