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 bmr18573_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 -2.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.64 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 5.28 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 PHE -6.51 -1.90 0 10 ARG 2.90 1.04 1 11 PHE 0.85 0.28 1 12 ASP 0.23 -1.92 1 13 THR 4.55 3.62 1 14 ASN 0.54 -1.08 1 16 ASP 0.15 -0.71 1 18 LYS -5.51 -2.17 1 19 ILE -1.17 -1.02 1 20 SER -4.75 -2.05 1 21 LEU 4.85 3.64 1 22 SER 5.46 3.66 1 23 GLU 2.60 1.99 1 24 LEU 3.59 2.99 1 25 THR 6.87 5.63 1 26 ASP 3.78 3.28 1 27 ALA 4.53 2.73 1 28 LEU 4.79 2.54 1 29 ARG 4.64 3.37 1 30 THR 4.68 3.63 1 31 LEU 0.68 0.74 1 33 SER 0.41 -0.06 1 34 THR -0.15 -0.12 1 35 SER -1.72 -0.88 1 36 ALA 3.91 2.97 1 37 ASP 3.37 2.68 1 38 GLU 2.27 2.03 1 39 VAL 6.04 4.50 1 40 GLN 5.04 3.59 1 41 ARG 4.40 3.41 1 42 MET 3.83 3.66 1 43 MET 4.50 3.00 1 44 ALA 2.83 1.80 1 45 GLU 1.16 1.59 1 46 ILE 1.98 2.01 1 47 ASP 0.76 -0.98 1 48 THR 3.89 3.05 1 49 ASP 0.57 -0.79 1 51 ASP 0.63 0.01 1 54 ILE -2.25 -1.05 1 55 ASP -2.22 -1.87 1 56 PHE 4.75 4.10 1 57 ASN 4.33 3.42 1 58 GLU 2.68 2.30 1 59 PHE 4.22 4.60 1 60 ILE 4.86 3.18 1 61 SER 4.59 3.57 1 62 PHE 3.94 3.84 1 64 ASN 2.92 2.06 1 65 ALA -0.36 0.18 1 66 ASN -1.27 -0.06 1 69 LEU 2.57 2.39 1 70 MET 2.88 0.73 1 71 LYS 3.78 2.95 1 72 ASP 3.01 2.48 1 73 VAL 3.87 3.17 1 74 ALA 1.63 1.08 1 75 LYS 1.29 1.34 1 76 VAL -0.09 0.51 1 77 PHE -0.55 1.11 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18573_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 4.24 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.36 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 -1.59 _LACS_plot.Y_axis_chem_shift_offset 0.21 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 53 PHE -6.51 4.61 0 10 ARG 2.90 -1.86 1 11 PHE 0.85 -0.57 1 12 ASP 0.23 -2.15 1 13 THR 4.55 -0.93 1 14 ASN 0.54 -1.62 1 16 ASP 0.15 -0.86 1 18 LYS -5.51 3.34 1 19 ILE -1.17 0.15 1 20 SER -4.75 2.70 1 21 LEU 4.85 -1.21 1 22 SER 5.46 -1.80 1 23 GLU 2.60 -0.61 1 24 LEU 3.59 -0.60 1 25 THR 6.87 -1.24 1 26 ASP 3.78 -0.50 1 27 ALA 4.53 -1.80 1 28 LEU 4.79 -2.25 1 29 ARG 4.64 -1.27 1 30 THR 4.68 -1.05 1 31 LEU 0.68 0.06 1 33 SER 0.41 -0.47 1 34 THR -0.15 0.03 1 35 SER -1.72 0.84 1 36 ALA 3.91 -0.94 1 37 ASP 3.37 -0.69 1 38 GLU 2.27 -0.24 1 39 VAL 6.04 -1.54 1 40 GLN 5.04 -1.45 1 41 ARG 4.40 -0.99 1 42 MET 3.83 -0.17 1 43 MET 4.50 -1.50 1 44 ALA 2.83 -1.03 1 45 GLU 1.16 0.43 1 46 ILE 1.98 0.03 1 47 ASP 0.76 -1.74 1 48 THR 3.89 -0.84 1 49 ASP 0.57 -1.36 1 51 ASP 0.63 -0.62 1 54 ILE -2.25 1.20 1 55 ASP -2.22 0.35 1 56 PHE 4.75 -0.65 1 57 ASN 4.33 -0.91 1 58 GLU 2.68 -0.38 1 59 PHE 4.22 0.38 1 60 ILE 4.86 -1.68 1 61 SER 4.59 -1.02 1 62 PHE 3.94 -0.10 1 64 ASN 2.92 -0.86 1 65 ALA -0.36 0.54 1 66 ASN -1.27 1.21 1 69 LEU 2.57 -0.18 1 70 MET 2.88 -2.15 1 71 LYS 3.78 -0.83 1 72 ASP 3.01 -0.53 1 73 VAL 3.87 -0.70 1 74 ALA 1.63 -0.55 1 75 LYS 1.29 0.05 1 76 VAL -0.09 0.60 1 77 PHE -0.55 1.66 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18573_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 0.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 -0.62 _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 54 ILE -2.25 0.85 0 19 ILE -1.17 0.84 0 53 PHE -6.51 0.30 0 10 ARG 2.90 -0.33 1 11 PHE 0.85 -0.33 1 12 ASP 0.23 -0.19 1 13 THR 4.55 -0.45 1 14 ASN 0.54 0.05 1 16 ASP 0.15 -0.17 1 18 LYS -5.51 0.82 1 20 SER -4.75 0.25 1 21 LEU 4.85 -0.25 1 22 SER 5.46 -0.39 1 23 GLU 2.60 -0.14 1 24 LEU 3.59 -0.49 1 25 THR 6.87 -0.67 1 26 ASP 3.78 -0.35 1 27 ALA 4.53 -0.44 1 28 LEU 4.79 -0.34 1 29 ARG 4.64 -0.11 1 30 THR 4.68 -0.34 1 31 LEU 0.68 -0.11 1 33 SER 0.41 0.06 1 34 THR -0.15 0.03 1 35 SER -1.72 0.10 1 36 ALA 3.91 -0.28 1 37 ASP 3.37 -0.31 1 38 GLU 2.27 -0.23 1 39 VAL 6.04 -0.70 1 40 GLN 5.04 -0.56 1 41 ARG 4.40 -0.35 1 42 MET 3.83 -0.45 1 43 MET 4.50 -0.56 1 44 ALA 2.83 -0.23 1 45 GLU 1.16 -0.31 1 46 ILE 1.98 -0.35 1 47 ASP 0.76 -0.02 1 48 THR 3.89 -0.35 1 49 ASP 0.57 0.04 1 51 ASP 0.63 -0.18 1 55 ASP -2.22 0.63 1 56 PHE 4.75 -0.99 1 57 ASN 4.33 -0.49 1 58 GLU 2.68 -0.21 1 59 PHE 4.22 -0.53 1 60 ILE 4.86 -0.63 1 61 SER 4.59 -0.34 1 62 PHE 3.94 -0.37 1 64 ASN 2.92 -0.47 1 65 ALA -0.36 -0.07 1 66 ASN -1.27 -0.10 1 69 LEU 2.57 -0.03 1 70 MET 2.88 0.00 1 71 LYS 3.78 -0.26 1 72 ASP 3.01 -0.03 1 73 VAL 3.87 -0.26 1 74 ALA 1.63 -0.01 1 75 LYS 1.29 -0.07 1 76 VAL -0.09 -0.02 1 77 PHE -0.55 -0.12 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18573_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.51 _LACS_plot.Line_1_terminator_val_y_1 -1.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.15 _LACS_plot.Line_2_terminator_val_x_2 6.87 _LACS_plot.Line_2_terminator_val_y_2 2.69 _LACS_plot.Y_axis_chem_shift_offset -0.51 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 77 PHE -0.55 4.70 0 10 ARG 2.90 2.00 1 11 PHE 0.85 1.50 1 12 ASP 0.23 0.40 1 13 THR 4.55 4.60 1 14 ASN 0.54 1.50 1 16 ASP 0.15 1.20 1 18 LYS -5.51 -1.90 1 19 ILE -1.17 -0.40 1 20 SER -4.75 -0.20 1 21 LEU 4.85 3.10 1 22 SER 5.46 2.10 1 23 GLU 2.60 4.00 1 24 LEU 3.59 0.10 1 25 THR 6.87 1.20 1 26 ASP 3.78 2.20 1 27 ALA 4.53 2.10 1 28 LEU 4.79 0.80 1 29 ARG 4.64 3.00 1 30 THR 4.68 0.80 1 31 LEU 0.68 -2.10 1 33 SER 0.41 0.30 1 34 THR -0.15 -0.50 1 35 SER -1.72 0.30 1 36 ALA 3.91 2.20 1 37 ASP 3.37 2.10 1 38 GLU 2.27 2.10 1 39 VAL 6.04 1.10 1 40 GLN 5.04 2.60 1 41 ARG 4.40 1.20 1 42 MET 3.83 1.80 1 43 MET 4.50 0.60 1 44 ALA 2.83 1.70 1 45 GLU 1.16 1.10 1 46 ILE 1.98 0.90 1 47 ASP 0.76 0.60 1 48 THR 3.89 2.20 1 49 ASP 0.57 1.80 1 51 ASP 0.63 0.60 1 53 PHE -6.51 -1.10 1 54 ILE -2.25 -0.10 1 55 ASP -2.22 -0.40 1 56 PHE 4.75 1.00 1 57 ASN 4.33 4.10 1 58 GLU 2.68 3.50 1 59 PHE 4.22 1.40 1 60 ILE 4.86 1.80 1 61 SER 4.59 2.80 1 62 PHE 3.94 2.40 1 64 ASN 2.92 1.30 1 65 ALA -0.36 -1.10 1 69 LEU 2.57 1.40 1 70 MET 2.88 1.00 1 71 LYS 3.78 1.80 1 72 ASP 3.01 2.60 1 73 VAL 3.87 0.70 1 74 ALA 1.63 0.10 1 75 LYS 1.29 0.60 1 76 VAL -0.09 -1.50 1 stop_ save_