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 bmr10047_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.76 _LACS_plot.Line_1_terminator_val_y_1 -1.96 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.87 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.11 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 6.35 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 LEU 7.30 3.39 0 10 LYS -1.24 -0.16 1 11 THR -2.44 -1.10 1 12 LYS 4.67 3.65 1 13 GLU 4.76 3.84 1 14 GLN 4.56 3.65 1 15 LEU 2.90 2.47 1 16 ALA 3.83 2.75 1 17 ILE 3.86 2.95 1 19 LYS 4.55 4.39 1 20 SER 4.73 3.73 1 21 PHE 4.32 4.25 1 22 PHE 2.15 3.28 1 23 LEU 2.62 2.71 1 24 GLN 0.48 0.85 1 26 GLN 3.45 2.18 1 27 TRP -1.89 -1.69 1 28 ALA -0.01 -0.75 1 29 ARG -2.76 -1.41 1 30 ARG 5.96 4.90 1 31 GLU 3.98 3.09 1 32 ASP 2.05 2.44 1 33 TYR 4.87 3.05 1 34 GLN 4.63 3.75 1 35 LYS 4.08 3.09 1 36 LEU 2.26 2.88 1 37 GLU 3.25 3.51 1 38 GLN 4.31 3.37 1 39 ILE 2.50 2.88 1 40 THR -0.50 1.67 1 42 LEU -1.84 -0.93 1 44 ARG 2.21 2.22 1 46 GLU 5.29 5.07 1 47 ILE 5.29 4.98 1 48 ILE 3.52 2.86 1 49 GLN 6.52 5.37 1 50 TRP 6.82 6.47 1 51 PHE 4.03 2.94 1 53 ASP 7.93 5.28 1 54 THR 5.12 5.59 1 55 ARG 5.13 4.37 1 56 TYR 2.90 2.54 1 57 ALA 3.05 2.49 1 58 LEU 2.99 2.00 1 59 LYS 1.15 1.61 1 60 HIS -1.24 -0.84 1 62 GLN -2.17 -2.19 1 63 LEU 3.29 2.44 1 64 LYS -2.29 -2.64 1 65 TRP 0.95 1.36 1 66 PHE -0.92 -0.33 1 67 ARG 0.03 0.21 1 68 ASP 0.34 0.51 1 69 ASN 0.21 0.42 1 70 ALA -0.17 0.14 1 71 SER 0.09 0.09 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10047_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.76 _LACS_plot.Line_1_terminator_val_y_1 0.80 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.89 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset -0.33 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 18 LEU 7.30 -3.91 0 10 LYS -1.24 1.08 1 11 THR -2.44 1.34 1 12 LYS 4.67 -1.02 1 13 GLU 4.76 -0.92 1 14 GLN 4.56 -0.91 1 15 LEU 2.90 -0.43 1 16 ALA 3.83 -1.08 1 17 ILE 3.86 -0.91 1 19 LYS 4.55 -0.16 1 20 SER 4.73 -1.00 1 21 PHE 4.32 -0.07 1 22 PHE 2.15 1.13 1 23 LEU 2.62 0.09 1 24 GLN 0.48 0.37 1 26 GLN 3.45 -1.27 1 27 TRP -1.89 0.20 1 28 ALA -0.01 -0.74 1 29 ARG -2.76 1.35 1 30 ARG 5.96 -1.06 1 31 GLU 3.98 -0.89 1 32 ASP 2.05 0.39 1 33 TYR 4.87 -1.82 1 34 GLN 4.63 -0.88 1 35 LYS 4.08 -0.99 1 36 LEU 2.26 0.62 1 37 GLU 3.25 0.26 1 38 GLN 4.31 -0.94 1 39 ILE 2.50 0.38 1 40 THR -0.50 2.17 1 42 LEU -1.84 0.91 1 44 ARG 2.21 0.01 1 46 GLU 5.29 -0.22 1 47 ILE 5.29 -0.31 1 48 ILE 3.52 -0.66 1 49 GLN 6.52 -1.15 1 50 TRP 6.82 -0.35 1 51 PHE 4.03 -1.09 1 53 ASP 7.93 -2.65 1 54 THR 5.12 0.47 1 55 ARG 5.13 -0.76 1 56 TYR 2.90 -0.36 1 57 ALA 3.05 -0.56 1 58 LEU 2.99 -0.99 1 59 LYS 1.15 0.46 1 60 HIS -1.24 0.40 1 62 GLN -2.17 -0.02 1 63 LEU 3.29 -0.85 1 64 LYS -2.29 -0.35 1 65 TRP 0.95 0.41 1 66 PHE -0.92 0.59 1 67 ARG 0.03 0.18 1 68 ASP 0.34 0.17 1 69 ASN 0.21 0.21 1 70 ALA -0.17 0.31 1 71 SER 0.09 0.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10047_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.76 _LACS_plot.Line_1_terminator_val_y_1 0.12 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 7.92 _LACS_plot.Line_2_terminator_val_y_2 -0.61 _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 53 ASP 7.93 -1.00 0 15 LEU 2.90 -0.75 0 10 LYS -1.24 0.31 1 11 THR -2.44 0.07 1 12 LYS 4.67 -0.37 1 13 GLU 4.76 -0.31 1 14 GLN 4.56 -0.57 1 16 ALA 3.83 -0.42 1 17 ILE 3.86 -0.43 1 18 LEU 7.30 -0.72 1 19 LYS 4.55 -0.44 1 20 SER 4.73 -0.27 1 21 PHE 4.32 -0.38 1 22 PHE 2.15 0.20 1 23 LEU 2.62 -0.20 1 24 GLN 0.48 0.01 1 26 GLN 3.45 -0.45 1 27 TRP -1.89 -0.05 1 28 ALA -0.01 -0.16 1 29 ARG -2.76 0.16 1 30 ARG 5.96 -0.38 1 31 GLU 3.98 -0.21 1 32 ASP 2.05 -0.04 1 33 TYR 4.87 -0.34 1 34 GLN 4.63 -0.21 1 35 LYS 4.08 -0.13 1 36 LEU 2.26 -0.32 1 37 GLU 3.25 -0.23 1 38 GLN 4.31 -0.27 1 39 ILE 2.50 0.04 1 40 THR -0.50 0.10 1 42 LEU -1.84 -0.09 1 44 ARG 2.21 -0.13 1 46 GLU 5.29 -0.45 1 47 ILE 5.29 -0.45 1 48 ILE 3.52 -0.26 1 49 GLN 6.52 -0.37 1 50 TRP 6.82 -0.80 1 51 PHE 4.03 -0.25 1 54 THR 5.12 -0.42 1 55 ARG 5.13 -0.36 1 56 TYR 2.90 -0.32 1 57 ALA 3.05 -0.45 1 58 LEU 2.99 -0.39 1 59 LYS 1.15 -0.25 1 60 HIS -1.24 0.05 1 62 GLN -2.17 0.04 1 63 LEU 3.29 -0.24 1 64 LYS -2.29 0.02 1 65 TRP 0.95 -0.32 1 66 PHE -0.92 0.00 1 67 ARG 0.03 -0.10 1 68 ASP 0.34 -0.05 1 69 ASN 0.21 0.04 1 70 ALA -0.17 0.03 1 71 SER 0.09 0.03 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr10047_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.76 _LACS_plot.Line_1_terminator_val_y_1 -1.00 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.13 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.54 _LACS_plot.Line_2_terminator_val_x_2 7.92 _LACS_plot.Line_2_terminator_val_y_2 3.57 _LACS_plot.Y_axis_chem_shift_offset -0.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 ASP 7.93 1.13 0 18 LEU 7.30 0.44 0 26 GLN 3.45 -1.70 0 10 LYS -1.24 0.31 1 11 THR -2.44 0.74 1 12 LYS 4.67 2.73 1 13 GLU 4.76 2.79 1 14 GLN 4.56 2.23 1 15 LEU 2.90 0.49 1 16 ALA 3.83 3.14 1 17 ILE 3.86 2.22 1 19 LYS 4.55 1.55 1 20 SER 4.73 2.80 1 21 PHE 4.32 2.15 1 22 PHE 2.15 0.62 1 23 LEU 2.62 0.71 1 24 GLN 0.48 0.49 1 27 TRP -1.89 -1.83 1 28 ALA -0.01 -0.90 1 29 ARG -2.76 1.28 1 30 ARG 5.96 2.53 1 31 GLU 3.98 2.46 1 32 ASP 2.05 1.88 1 33 TYR 4.87 2.10 1 34 GLN 4.63 2.31 1 35 LYS 4.08 2.28 1 36 LEU 2.26 3.35 1 37 GLU 3.25 2.09 1 38 GLN 4.31 2.72 1 39 ILE 2.50 1.35 1 40 THR -0.50 1.50 1 42 LEU -1.84 -1.96 1 44 ARG 2.21 2.99 1 46 GLU 5.29 1.34 1 47 ILE 5.29 3.41 1 48 ILE 3.52 1.15 1 49 GLN 6.52 4.46 1 50 TRP 6.82 2.50 1 51 PHE 4.03 3.04 1 54 THR 5.12 2.94 1 55 ARG 5.13 1.78 1 56 TYR 2.90 2.15 1 57 ALA 3.05 2.31 1 58 LEU 2.99 0.71 1 59 LYS 1.15 0.91 1 60 HIS -1.24 -0.70 1 62 GLN -2.17 -0.77 1 63 LEU 3.29 0.27 1 64 LYS -2.29 -0.15 1 65 TRP 0.95 -1.40 1 66 PHE -0.92 -1.05 1 67 ARG 0.03 -0.16 1 68 ASP 0.34 0.06 1 69 ASN 0.21 0.06 1 70 ALA -0.17 0.03 1 71 SER 0.09 -0.01 1 stop_ save_