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 bmr18216_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 -3.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.36 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 6.65 _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 37 LYS 4.33 -0.26 0 10 LYS 3.45 1.87 1 11 VAL 7.63 5.52 1 12 ILE 8.60 6.93 1 13 GLU 3.96 3.55 1 14 MET 2.98 4.01 1 15 VAL 6.32 4.90 1 16 ALA 4.31 3.44 1 17 GLU 2.36 2.64 1 18 LYS 2.45 0.83 1 19 LEU 1.05 -0.87 1 20 ASN 3.07 0.96 1 21 LYS -6.62 -3.61 1 22 ASP -0.78 0.02 1 23 LYS 4.33 3.41 1 24 ALA 1.77 1.69 1 25 ILE -0.35 -0.73 1 26 ILE 1.85 0.42 1 27 THR -5.34 -2.88 1 28 THR 5.69 3.51 1 29 ASP -0.46 0.01 1 30 SER 3.73 3.28 1 31 ARG -1.32 -1.68 1 32 PHE 6.33 4.88 1 33 ILE 5.08 3.19 1 34 GLU 6.75 5.88 1 35 ASP 1.39 1.80 1 36 LEU 1.15 -0.36 1 38 ALA -1.96 -0.49 1 39 ASP -2.89 -1.38 1 40 SER 0.11 1.93 1 41 LEU 4.08 2.77 1 42 ASP 3.14 2.94 1 43 THR 6.24 4.86 1 44 VAL 5.91 4.67 1 45 GLU 3.69 3.02 1 46 LEU 4.38 3.29 1 47 MET 3.75 2.52 1 48 MET 3.49 3.54 1 49 ALA 3.54 2.40 1 50 ILE 5.95 3.81 1 51 GLU 3.51 3.82 1 52 VAL 4.10 3.48 1 53 GLU 2.30 2.22 1 54 TYR 1.01 1.58 1 56 ILE -5.58 -2.32 1 57 ASP -3.27 -1.25 1 58 ILE 1.37 0.65 1 60 ASP 4.46 3.77 1 61 ASP 3.11 2.00 1 62 GLU 1.50 0.75 1 63 ALA 3.75 2.90 1 64 THR 2.88 2.32 1 65 LYS 0.40 0.39 1 66 ILE 2.82 1.15 1 67 LYS -2.46 -0.12 1 68 THR -7.24 -3.36 1 69 VAL 6.96 5.31 1 70 SER 3.96 2.92 1 71 ASP 2.72 3.60 1 72 VAL 5.20 4.03 1 73 ILE 5.55 5.01 1 74 LYS 4.04 3.67 1 75 TYR 4.03 4.12 1 76 ILE 4.28 4.28 1 77 LYS 4.69 4.09 1 78 GLU 2.05 1.75 1 79 ARG 0.70 -0.03 1 80 GLN 0.42 0.41 1 81 SER 0.98 2.15 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18216_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 3.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.68 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.64 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -1.94 _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 37 LYS 4.33 -4.59 0 10 LYS 3.45 -1.58 1 11 VAL 7.63 -2.11 1 12 ILE 8.60 -1.67 1 13 GLU 3.96 -0.41 1 14 MET 2.98 1.03 1 15 VAL 6.32 -1.42 1 16 ALA 4.31 -0.87 1 17 GLU 2.36 0.28 1 18 LYS 2.45 -1.62 1 19 LEU 1.05 -1.92 1 20 ASN 3.07 -2.11 1 21 LYS -6.62 3.01 1 22 ASP -0.78 0.80 1 23 LYS 4.33 -0.92 1 24 ALA 1.77 -0.08 1 25 ILE -0.35 -0.38 1 26 ILE 1.85 -1.43 1 27 THR -5.34 2.46 1 28 THR 5.69 -2.18 1 29 ASP -0.46 0.47 1 30 SER 3.73 -0.45 1 31 ARG -1.32 -0.36 1 32 PHE 6.33 -1.45 1 33 ILE 5.08 -1.89 1 34 GLU 6.75 -0.87 1 35 ASP 1.39 0.41 1 36 LEU 1.15 -1.51 1 38 ALA -1.96 1.47 1 39 ASP -2.89 1.51 1 40 SER 0.11 1.82 1 41 LEU 4.08 -1.31 1 42 ASP 3.14 -0.20 1 43 THR 6.24 -1.38 1 44 VAL 5.91 -1.24 1 45 GLU 3.69 -0.67 1 46 LEU 4.38 -1.09 1 47 MET 3.75 -1.23 1 48 MET 3.49 0.05 1 49 ALA 3.54 -1.14 1 50 ILE 5.95 -2.14 1 51 GLU 3.51 0.31 1 52 VAL 4.10 -0.62 1 53 GLU 2.30 -0.08 1 54 TYR 1.01 0.57 1 56 ILE -5.58 3.26 1 57 ASP -3.27 2.02 1 58 ILE 1.37 -0.72 1 60 ASP 4.46 -0.69 1 61 ASP 3.11 -1.11 1 62 GLU 1.50 -0.75 1 63 ALA 3.75 -0.85 1 64 THR 2.88 -0.56 1 65 LYS 0.40 -0.01 1 66 ILE 2.82 -1.67 1 67 LYS -2.46 2.34 1 68 THR -7.24 3.88 1 69 VAL 6.96 -1.65 1 70 SER 3.96 -1.04 1 71 ASP 2.72 0.88 1 72 VAL 5.20 -1.17 1 73 ILE 5.55 -0.54 1 74 LYS 4.04 -0.37 1 75 TYR 4.03 0.09 1 76 ILE 4.28 0.00 1 77 LYS 4.69 -0.60 1 78 GLU 2.05 -0.30 1 79 ARG 0.70 -0.73 1 80 GLN 0.42 -0.01 1 81 SER 0.98 1.17 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18216_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 0.65 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.18 _LACS_plot.Line_2_terminator_val_x_2 8.59 _LACS_plot.Line_2_terminator_val_y_2 -0.80 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 THR -7.24 0.69 0 21 LYS -6.62 0.40 0 35 ASP 1.39 0.39 0 76 ILE 4.28 -0.92 0 10 LYS 3.45 -0.14 1 11 VAL 7.63 -0.52 1 12 ILE 8.60 -0.76 1 13 GLU 3.96 -0.48 1 14 MET 2.98 -0.31 1 15 VAL 6.32 -0.68 1 16 ALA 4.31 -0.54 1 17 GLU 2.36 -0.25 1 18 LYS 2.45 -0.13 1 19 LEU 1.05 0.15 1 20 ASN 3.07 -0.32 1 22 ASP -0.78 -0.22 1 23 LYS 4.33 -0.58 1 24 ALA 1.77 -0.21 1 25 ILE -0.35 0.24 1 26 ILE 1.85 -0.21 1 27 THR -5.34 0.51 1 28 THR 5.69 -0.61 1 29 ASP -0.46 0.08 1 30 SER 3.73 -0.41 1 31 ARG -1.32 0.30 1 32 PHE 6.33 -0.66 1 33 ILE 5.08 -0.13 1 34 GLU 6.75 -0.49 1 36 LEU 1.15 -0.07 1 37 LYS 4.33 -0.11 1 38 ALA -1.96 0.07 1 39 ASP -2.89 0.14 1 40 SER 0.11 -0.24 1 41 LEU 4.08 -0.15 1 42 ASP 3.14 -0.22 1 43 THR 6.24 -0.80 1 44 VAL 5.91 -0.47 1 45 GLU 3.69 -0.29 1 46 LEU 4.38 -0.34 1 47 MET 3.75 -0.34 1 48 MET 3.49 -0.14 1 49 ALA 3.54 -0.10 1 50 ILE 5.95 -0.45 1 51 GLU 3.51 -0.29 1 52 VAL 4.10 -0.39 1 53 GLU 2.30 -0.47 1 54 TYR 1.01 -0.07 1 56 ILE -5.58 0.52 1 57 ASP -3.27 0.30 1 58 ILE 1.37 -0.09 1 60 ASP 4.46 -0.41 1 61 ASP 3.11 -0.30 1 62 GLU 1.50 -0.11 1 63 ALA 3.75 -0.61 1 64 THR 2.88 -0.31 1 65 LYS 0.40 -0.09 1 66 ILE 2.82 -0.30 1 67 LYS -2.46 0.47 1 69 VAL 6.96 -0.66 1 70 SER 3.96 -0.38 1 71 ASP 2.72 -0.21 1 72 VAL 5.20 -0.41 1 73 ILE 5.55 -0.80 1 74 LYS 4.04 -0.46 1 75 TYR 4.03 -0.59 1 77 LYS 4.69 -0.52 1 78 GLU 2.05 -0.30 1 79 ARG 0.70 -0.07 1 80 GLN 0.42 0.06 1 81 SER 0.98 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18216_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.24 _LACS_plot.Line_1_terminator_val_y_1 -2.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.90 _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 8.59 _LACS_plot.Line_2_terminator_val_y_2 -0.03 _LACS_plot.Y_axis_chem_shift_offset 1.26 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 21 LYS -6.62 -3.59 0 68 THR -7.24 -1.27 0 56 ILE -5.58 -5.22 0 10 LYS 3.45 0.07 1 11 VAL 7.63 -0.21 1 12 ILE 8.60 -0.98 1 13 GLU 3.96 0.91 1 14 MET 2.98 0.33 1 15 VAL 6.32 -1.21 1 16 ALA 4.31 0.23 1 17 GLU 2.36 1.21 1 18 LYS 2.45 -0.65 1 19 LEU 1.05 -3.34 1 20 ASN 3.07 -2.92 1 22 ASP -0.78 -1.04 1 23 LYS 4.33 -1.00 1 24 ALA 1.77 -0.35 1 25 ILE -0.35 -2.88 1 26 ILE 1.85 -3.79 1 27 THR -5.34 -0.51 1 28 THR 5.69 -2.06 1 29 ASP -0.46 -2.05 1 30 SER 3.73 -3.46 1 31 ARG -1.32 0.36 1 32 PHE 6.33 -2.42 1 33 ILE 5.08 1.60 1 34 GLU 6.75 -0.88 1 35 ASP 1.39 -1.06 1 36 LEU 1.15 -4.64 1 37 LYS 4.33 -2.06 1 38 ALA -1.96 -2.20 1 39 ASP -2.89 -0.50 1 40 SER 0.11 -0.40 1 41 LEU 4.08 -2.28 1 42 ASP 3.14 0.56 1 44 VAL 5.91 0.28 1 45 GLU 3.69 1.73 1 46 LEU 4.38 -2.13 1 47 MET 3.75 0.73 1 48 MET 3.49 0.26 1 49 ALA 3.54 1.31 1 50 ILE 5.95 -0.89 1 51 GLU 3.51 1.80 1 52 VAL 4.10 0.40 1 53 GLU 2.30 -0.87 1 54 TYR 1.01 -1.87 1 57 ASP -3.27 -2.28 1 58 ILE 1.37 -4.41 1 60 ASP 4.46 -0.56 1 61 ASP 3.11 -0.14 1 62 GLU 1.50 0.51 1 63 ALA 3.75 0.14 1 64 THR 2.88 -1.64 1 65 LYS 0.40 -1.94 1 66 ILE 2.82 -3.91 1 67 LYS -2.46 -0.44 1 69 VAL 6.96 0.18 1 70 SER 3.96 -0.14 1 71 ASP 2.72 0.97 1 72 VAL 5.20 -1.89 1 73 ILE 5.55 -1.29 1 74 LYS 4.04 -0.79 1 75 TYR 4.03 0.22 1 76 ILE 4.28 0.33 1 77 LYS 4.69 1.19 1 78 GLU 2.05 -0.63 1 79 ARG 0.70 -1.72 1 80 GLN 0.42 -2.82 1 81 SER 0.98 2.11 1 stop_ save_