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 bmr15486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.01 _LACS_plot.Line_1_terminator_val_y_1 -1.88 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.27 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 5.47 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 15 THR -6.01 -2.80 0 44 HIS 1.53 4.22 0 55 TYR -4.97 -0.70 0 10 LEU 3.20 1.68 1 11 ARG 4.41 2.66 1 12 LYS 1.58 0.83 1 14 THR 1.23 0.64 1 16 ILE 5.64 4.58 1 17 ASP 3.81 3.49 1 18 THR 5.15 4.36 1 19 LEU 4.03 3.60 1 20 GLU 4.10 3.47 1 21 ARG 4.40 3.59 1 22 VAL 5.74 4.62 1 23 ILE 6.05 5.41 1 24 GLU 3.10 2.65 1 25 LYS 2.47 2.40 1 26 ASN 2.44 3.02 1 27 LYS 4.42 3.06 1 28 TYR 0.79 0.59 1 29 GLU -1.93 0.08 1 30 LEU -2.92 -1.24 1 31 SER -1.99 -0.90 1 32 ASP 4.45 3.82 1 33 ASP 3.73 2.76 1 34 GLU 1.79 1.97 1 35 LEU 3.74 2.37 1 36 GLU 3.49 3.27 1 37 LEU 2.29 2.34 1 38 PHE 4.93 4.31 1 39 TYR 3.66 1.62 1 40 SER 4.50 3.67 1 41 ALA 2.32 2.47 1 42 ALA 7.10 5.10 1 43 ASP 4.38 3.40 1 45 ARG 3.37 1.14 1 46 LEU 3.97 3.43 1 47 ALA 4.90 3.65 1 48 GLU 2.46 3.28 1 49 LEU 1.46 2.10 1 50 THR 5.91 5.07 1 51 MET 0.03 -1.63 1 52 ASN 2.67 0.80 1 53 LYS -4.39 -1.06 1 54 LEU -1.72 -1.45 1 56 ASP 2.11 1.80 1 57 LYS -2.90 -1.30 1 58 ILE 0.93 -0.98 1 61 THR 2.90 1.78 1 62 VAL 4.64 3.06 1 63 TRP 1.38 1.38 1 64 GLN 2.95 1.83 1 65 HIS -0.67 1.44 1 66 VAL 0.26 0.16 1 67 LYS 1.24 0.48 1 68 HIS -0.20 0.76 1 69 HIS 1.39 2.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.01 _LACS_plot.Line_1_terminator_val_y_1 4.13 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.51 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.73 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -1.63 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 15 THR -6.01 3.21 0 44 HIS 1.53 2.69 0 55 TYR -4.97 4.27 0 10 LEU 3.20 -1.52 1 11 ARG 4.41 -1.75 1 12 LYS 1.58 -0.75 1 14 THR 1.23 -0.59 1 16 ILE 5.64 -1.06 1 17 ASP 3.81 -0.32 1 18 THR 5.15 -0.79 1 19 LEU 4.03 -0.43 1 20 GLU 4.10 -0.63 1 21 ARG 4.40 -0.81 1 22 VAL 5.74 -1.12 1 23 ILE 6.05 -0.64 1 24 GLU 3.10 -0.45 1 25 LYS 2.47 -0.07 1 26 ASN 2.44 0.58 1 27 LYS 4.42 -1.36 1 28 TYR 0.79 -0.20 1 29 GLU -1.93 2.01 1 30 LEU -2.92 1.68 1 31 SER -1.99 1.09 1 32 ASP 4.45 -0.63 1 33 ASP 3.73 -0.97 1 34 GLU 1.79 0.18 1 35 LEU 3.74 -1.37 1 36 GLU 3.49 -0.22 1 37 LEU 2.29 0.05 1 38 PHE 4.93 -0.62 1 39 TYR 3.66 -2.04 1 40 SER 4.50 -0.83 1 41 ALA 2.32 0.15 1 42 ALA 7.10 -2.00 1 43 ASP 4.38 -0.98 1 45 ARG 3.37 -2.23 1 46 LEU 3.97 -0.54 1 47 ALA 4.90 -1.25 1 48 GLU 2.46 0.82 1 49 LEU 1.46 0.64 1 50 THR 5.91 -0.84 1 51 MET 0.03 -1.66 1 52 ASN 2.67 -1.87 1 53 LYS -4.39 3.33 1 54 LEU -1.72 0.27 1 56 ASP 2.11 -0.31 1 57 LYS -2.90 1.60 1 58 ILE 0.93 -1.91 1 61 THR 2.90 -1.12 1 62 VAL 4.64 -1.58 1 63 TRP 1.38 0.00 1 64 GLN 2.95 -1.12 1 65 HIS -0.67 2.11 1 66 VAL 0.26 -0.10 1 67 LYS 1.24 -0.76 1 68 HIS -0.20 0.96 1 69 HIS 1.39 0.79 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.01 _LACS_plot.Line_1_terminator_val_y_1 0.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.07 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -0.45 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 38 PHE 4.93 -1.22 0 58 ILE 0.93 -1.03 0 10 LEU 3.20 0.12 1 11 ARG 4.41 -0.31 1 12 LYS 1.58 -0.07 1 14 THR 1.23 -0.08 1 15 THR -6.01 0.54 1 16 ILE 5.64 -0.51 1 17 ASP 3.81 -0.19 1 18 THR 5.15 -0.29 1 19 LEU 4.03 0.22 1 20 GLU 4.10 -0.27 1 21 ARG 4.40 -0.10 1 22 VAL 5.74 -0.35 1 23 ILE 6.05 -0.31 1 24 GLU 3.10 -0.36 1 25 LYS 2.47 -0.08 1 26 ASN 2.44 -0.54 1 27 LYS 4.42 -0.57 1 28 TYR 0.79 0.05 1 29 GLU -1.93 0.07 1 30 LEU -2.92 0.23 1 31 SER -1.99 0.03 1 32 ASP 4.45 -0.32 1 33 ASP 3.73 -0.19 1 34 GLU 1.79 -0.18 1 35 LEU 3.74 -0.62 1 36 GLU 3.49 -0.18 1 37 LEU 2.29 -0.13 1 39 TYR 3.66 -0.39 1 40 SER 4.50 0.04 1 41 ALA 2.32 -0.24 1 42 ALA 7.10 -0.53 1 43 ASP 4.38 0.03 1 44 HIS 1.53 -0.61 1 45 ARG 3.37 0.00 1 46 LEU 3.97 -0.30 1 47 ALA 4.90 -0.52 1 48 GLU 2.46 -0.06 1 49 LEU 1.46 -0.13 1 50 THR 5.91 -0.38 1 51 MET 0.03 0.17 1 52 ASN 2.67 -0.38 1 53 LYS -4.39 -0.01 1 54 LEU -1.72 0.03 1 55 TYR -4.97 0.33 1 56 ASP 2.11 0.14 1 57 LYS -2.90 0.20 1 61 THR 2.90 -0.24 1 62 VAL 4.64 -0.38 1 63 TRP 1.38 -0.27 1 64 GLN 2.95 -0.20 1 65 HIS -0.67 -0.08 1 66 VAL 0.26 -0.04 1 67 LYS 1.24 -0.14 1 68 HIS -0.20 -0.22 1 69 HIS 1.39 -0.27 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15486_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.01 _LACS_plot.Line_1_terminator_val_y_1 -1.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.05 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.31 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 2.61 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 TYR -4.97 0.40 0 53 LYS -4.39 -3.13 0 15 THR -6.01 -0.41 0 10 LEU 3.20 2.59 1 11 ARG 4.41 -0.14 1 12 LYS 1.58 1.17 1 14 THR 1.23 -0.78 1 16 ILE 5.64 0.69 1 17 ASP 3.81 2.65 1 18 THR 5.15 2.08 1 19 LEU 4.03 0.70 1 20 GLU 4.10 3.02 1 21 ARG 4.40 3.19 1 22 VAL 5.74 3.23 1 23 ILE 6.05 0.79 1 24 GLU 3.10 1.21 1 25 LYS 2.47 2.33 1 26 ASN 2.44 1.78 1 27 LYS 4.42 -0.08 1 28 TYR 0.79 0.29 1 29 GLU -1.93 -0.36 1 30 LEU -2.92 -1.13 1 31 SER -1.99 -0.10 1 32 ASP 4.45 1.80 1 33 ASP 3.73 2.55 1 34 GLU 1.79 1.72 1 35 LEU 3.74 0.24 1 36 GLU 3.49 3.12 1 37 LEU 2.29 1.60 1 38 PHE 4.93 1.60 1 39 TYR 3.66 2.67 1 40 SER 4.50 3.36 1 41 ALA 2.32 0.31 1 42 ALA 7.10 1.83 1 43 ASP 4.38 1.60 1 44 HIS 1.53 4.08 1 45 ARG 3.37 1.57 1 46 LEU 3.97 2.75 1 47 ALA 4.90 1.47 1 48 GLU 2.46 4.06 1 49 LEU 1.46 2.26 1 50 THR 5.91 0.74 1 51 MET 0.03 0.15 1 52 ASN 2.67 -1.37 1 54 LEU -1.72 -0.73 1 56 ASP 2.11 0.03 1 57 LYS -2.90 -1.24 1 61 THR 2.90 1.80 1 62 VAL 4.64 1.30 1 63 TRP 1.38 1.53 1 64 GLN 2.95 0.47 1 65 HIS -0.67 0.65 1 66 VAL 0.26 -1.03 1 67 LYS 1.24 -0.44 1 68 HIS -0.20 -0.43 1 stop_ save_