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 bmr36162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.15 _LACS_plot.Line_1_terminator_val_y_1 -2.59 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.71 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.44 _LACS_plot.Line_2_terminator_val_x_2 8.21 _LACS_plot.Line_2_terminator_val_y_2 6.53 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 LEU -8.15 -2.67 0 10 GLN 3.98 3.08 1 11 ARG 4.08 5.09 1 12 ILE 3.59 1.59 1 13 ALA 4.54 3.15 1 14 SER 6.31 5.73 1 15 LYS 5.76 4.38 1 16 ASN 3.61 2.36 1 17 GLN 3.87 3.40 1 18 LEU 4.29 3.47 1 19 GLU 2.97 3.84 1 20 SER 4.03 3.41 1 21 ILE 5.22 3.20 1 22 ALA 6.04 4.49 1 23 TYR 6.23 5.31 1 24 SER 4.49 3.55 1 25 LEU 3.41 3.33 1 26 LYS 5.37 4.56 1 27 ASN 3.96 3.40 1 28 THR 6.49 5.25 1 29 ILE 4.77 1.25 1 30 SER 4.13 3.37 1 31 GLU -0.76 -0.28 1 32 ALA 0.88 1.50 1 34 ASP 1.20 0.22 1 35 LYS 1.47 1.95 1 37 GLU -1.12 -0.68 1 38 GLN 4.85 3.85 1 39 ALA 3.80 3.02 1 40 ASP 2.89 2.88 1 41 LYS 5.77 4.55 1 42 ASP 4.23 3.23 1 43 THR 6.26 5.23 1 44 VAL 6.49 5.33 1 45 THR 8.00 6.66 1 46 LYS 4.57 3.55 1 47 LYS 2.54 0.74 1 48 ALA 5.63 4.07 1 49 GLU 4.24 3.47 1 50 GLU 2.87 2.89 1 51 THR 8.21 6.35 1 52 ILE 5.50 4.86 1 53 SER 4.49 3.46 1 54 TRP 6.36 5.06 1 55 LEU 3.88 3.91 1 56 ASP 2.99 2.93 1 57 SER -0.26 0.70 1 58 ASN 0.95 0.32 1 59 THR 4.52 3.91 1 60 THR 0.52 -0.55 1 61 ALA 0.44 0.07 1 62 SER -2.92 -0.60 1 63 LYS 4.32 4.81 1 64 GLU 5.44 4.22 1 65 GLU 2.87 3.10 1 66 PHE 4.37 3.30 1 67 ASP 4.95 3.37 1 68 ASP 4.18 3.26 1 69 LYS 2.87 1.18 1 70 LEU 4.74 3.11 1 71 LYS 4.50 3.45 1 72 GLU 2.32 2.70 1 73 LEU 3.50 2.99 1 74 GLN 4.79 4.08 1 75 ASP 4.01 3.06 1 76 ILE 1.10 0.37 1 77 ALA 0.86 2.20 1 78 ASN 3.72 3.44 1 80 ILE 3.99 1.03 1 81 MET 4.39 3.48 1 82 SER 3.66 2.98 1 83 LYS 2.56 1.98 1 84 LEU 1.42 0.44 1 85 TYR 1.66 1.26 1 86 GLN 0.45 0.38 1 87 ALA -0.23 0.06 1 90 ALA -0.07 0.09 1 94 ALA 0.12 0.16 1 95 ALA -0.20 -0.02 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.15 _LACS_plot.Line_1_terminator_val_y_1 5.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.29 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.56 _LACS_plot.Line_2_terminator_val_x_2 8.21 _LACS_plot.Line_2_terminator_val_y_2 -1.68 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 LEU -8.15 5.48 0 10 GLN 3.98 -0.90 1 11 ARG 4.08 1.01 1 12 ILE 3.59 -2.00 1 13 ALA 4.54 -1.39 1 14 SER 6.31 -0.58 1 15 LYS 5.76 -1.38 1 16 ASN 3.61 -1.25 1 17 GLN 3.87 -0.47 1 18 LEU 4.29 -0.82 1 19 GLU 2.97 0.87 1 20 SER 4.03 -0.62 1 21 ILE 5.22 -2.02 1 22 ALA 6.04 -1.55 1 23 TYR 6.23 -0.92 1 24 SER 4.49 -0.94 1 25 LEU 3.41 -0.08 1 26 LYS 5.37 -0.81 1 27 ASN 3.96 -0.56 1 28 THR 6.49 -1.24 1 29 ILE 4.77 -3.52 1 30 SER 4.13 -0.76 1 31 GLU -0.76 0.48 1 32 ALA 0.88 0.62 1 34 ASP 1.20 -0.98 1 35 LYS 1.47 0.48 1 37 GLU -1.12 0.44 1 38 GLN 4.85 -1.00 1 39 ALA 3.80 -0.78 1 40 ASP 2.89 -0.01 1 41 LYS 5.77 -1.22 1 42 ASP 4.23 -1.00 1 43 THR 6.26 -1.03 1 44 VAL 6.49 -1.16 1 45 THR 8.00 -1.34 1 46 LYS 4.57 -1.02 1 47 LYS 2.54 -1.80 1 48 ALA 5.63 -1.56 1 49 GLU 4.24 -0.77 1 50 GLU 2.87 0.02 1 51 THR 8.21 -1.86 1 52 ILE 5.50 -0.64 1 53 SER 4.49 -1.03 1 54 TRP 6.36 -1.30 1 55 LEU 3.88 0.03 1 56 ASP 2.99 -0.06 1 57 SER -0.26 0.96 1 58 ASN 0.95 -0.63 1 59 THR 4.52 -0.61 1 60 THR 0.52 -1.07 1 61 ALA 0.44 -0.37 1 62 SER -2.92 2.32 1 63 LYS 4.32 0.49 1 64 GLU 5.44 -1.22 1 65 GLU 2.87 0.23 1 66 PHE 4.37 -1.07 1 67 ASP 4.95 -1.58 1 68 ASP 4.18 -0.92 1 69 LYS 2.87 -1.69 1 70 LEU 4.74 -1.63 1 71 LYS 4.50 -1.05 1 72 GLU 2.32 0.38 1 73 LEU 3.50 -0.51 1 74 GLN 4.79 -0.71 1 75 ASP 4.01 -0.95 1 76 ILE 1.10 -0.73 1 77 ALA 0.86 1.34 1 78 ASN 3.72 -0.28 1 80 ILE 3.99 -2.96 1 81 MET 4.39 -0.91 1 82 SER 3.66 -0.68 1 83 LYS 2.56 -0.58 1 84 LEU 1.42 -0.98 1 85 TYR 1.66 -0.40 1 86 GLN 0.45 -0.07 1 87 ALA -0.23 0.29 1 90 ALA -0.07 0.16 1 94 ALA 0.12 0.04 1 95 ALA -0.20 0.18 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.15 _LACS_plot.Line_1_terminator_val_y_1 0.40 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.06 _LACS_plot.Line_2_terminator_val_x_2 8.21 _LACS_plot.Line_2_terminator_val_y_2 -0.50 _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 LYS 5.76 -1.49 0 10 GLN 3.98 -0.13 1 11 ARG 4.08 -0.43 1 12 ILE 3.59 -0.50 1 13 ALA 4.54 -0.11 1 14 SER 6.31 -0.14 1 16 ASN 3.61 -0.30 1 17 GLN 3.87 -0.15 1 18 LEU 4.29 -0.24 1 19 GLU 2.97 -0.71 1 20 SER 4.03 -0.17 1 21 ILE 5.22 -0.25 1 22 ALA 6.04 -0.35 1 23 TYR 6.23 -0.44 1 24 SER 4.49 -0.11 1 25 LEU 3.41 -0.26 1 26 LYS 5.37 -0.56 1 27 ASN 3.96 -0.22 1 28 THR 6.49 -0.41 1 29 ILE 4.77 -0.47 1 30 SER 4.13 -0.17 1 31 GLU -0.76 0.11 1 32 ALA 0.88 -0.13 1 34 ASP 1.20 0.06 1 35 LYS 1.47 -0.25 1 36 LEU -8.15 0.37 1 37 GLU -1.12 -0.07 1 38 GLN 4.85 -0.72 1 39 ALA 3.80 -0.13 1 40 ASP 2.89 -0.15 1 41 LYS 5.77 -0.55 1 42 ASP 4.23 -0.30 1 43 THR 6.26 -0.49 1 44 VAL 6.49 -0.67 1 45 THR 8.00 -0.10 1 46 LYS 4.57 -0.20 1 47 LYS 2.54 0.05 1 48 ALA 5.63 -0.37 1 49 GLU 4.24 -0.36 1 50 GLU 2.87 -0.21 1 51 THR 8.21 0.18 1 52 ILE 5.50 -0.52 1 53 SER 4.49 -0.15 1 54 TRP 6.36 -0.57 1 55 LEU 3.88 -0.66 1 56 ASP 2.99 -0.25 1 57 SER -0.26 0.10 1 58 ASN 0.95 0.10 1 59 THR 4.52 -0.28 1 60 THR 0.52 0.00 1 61 ALA 0.44 -0.22 1 62 SER -2.92 -0.14 1 63 LYS 4.32 -0.17 1 64 GLU 5.44 -0.34 1 65 GLU 2.87 -0.26 1 66 PHE 4.37 -0.08 1 67 ASP 4.95 -0.22 1 68 ASP 4.18 -0.16 1 69 LYS 2.87 -0.47 1 70 LEU 4.74 -0.35 1 71 LYS 4.50 -0.22 1 72 GLU 2.32 -0.34 1 73 LEU 3.50 -0.40 1 74 GLN 4.79 -0.39 1 75 ASP 4.01 -0.21 1 76 ILE 1.10 -0.14 1 77 ALA 0.86 -0.18 1 78 ASN 3.72 -0.48 1 80 ILE 3.99 -0.18 1 81 MET 4.39 -0.26 1 82 SER 3.66 -0.24 1 83 LYS 2.56 -0.31 1 84 LEU 1.42 0.03 1 85 TYR 1.66 -0.09 1 86 GLN 0.45 0.05 1 87 ALA -0.23 -0.01 1 90 ALA -0.07 -0.01 1 94 ALA 0.12 0.00 1 95 ALA -0.20 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36162_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.15 _LACS_plot.Line_1_terminator_val_y_1 -2.17 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.19 _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 8.21 _LACS_plot.Line_2_terminator_val_y_2 3.06 _LACS_plot.Y_axis_chem_shift_offset -0.53 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 36 LEU -8.15 -1.53 0 10 GLN 3.98 2.23 1 11 ARG 4.08 1.78 1 12 ILE 3.59 1.64 1 13 ALA 4.54 3.67 1 15 LYS 5.76 0.88 1 16 ASN 3.61 3.56 1 17 GLN 3.87 1.01 1 18 LEU 4.29 -0.46 1 19 GLU 2.97 1.07 1 20 SER 4.03 3.04 1 21 ILE 5.22 1.33 1 22 ALA 6.04 1.68 1 23 TYR 6.23 2.92 1 25 LEU 3.41 1.06 1 26 LYS 5.37 2.58 1 27 ASN 3.96 2.50 1 29 ILE 4.77 2.09 1 30 SER 4.13 1.18 1 31 GLU -0.76 0.46 1 32 ALA 0.88 0.75 1 34 ASP 1.20 0.74 1 35 LYS 1.47 -0.61 1 37 GLU -1.12 1.65 1 38 GLN 4.85 1.50 1 39 ALA 3.80 2.72 1 40 ASP 2.89 1.62 1 41 LYS 5.77 2.34 1 42 ASP 4.23 1.88 1 45 THR 8.00 1.47 1 46 LYS 4.57 2.67 1 47 LYS 2.54 3.51 1 48 ALA 5.63 1.36 1 49 GLU 4.24 3.36 1 50 GLU 2.87 3.00 1 51 THR 8.21 0.63 1 53 SER 4.49 2.94 1 54 TRP 6.36 3.27 1 55 LEU 3.88 1.36 1 56 ASP 2.99 1.79 1 57 SER -0.26 -0.61 1 58 ASN 0.95 -0.36 1 59 THR 4.52 1.90 1 60 THR 0.52 -0.95 1 61 ALA 0.44 -3.47 1 62 SER -2.92 -0.35 1 63 LYS 4.32 0.74 1 64 GLU 5.44 2.20 1 65 GLU 2.87 3.55 1 67 ASP 4.95 3.43 1 68 ASP 4.18 2.84 1 69 LYS 2.87 3.01 1 70 LEU 4.74 0.14 1 71 LYS 4.50 1.47 1 72 GLU 2.32 2.38 1 73 LEU 3.50 0.52 1 74 GLN 4.79 2.08 1 75 ASP 4.01 2.69 1 76 ILE 1.10 0.79 1 78 ASN 3.72 0.97 1 80 ILE 3.99 3.09 1 81 MET 3.66 2.10 1 83 LYS 2.56 0.65 1 84 LEU 1.42 1.67 1 85 TYR 1.66 0.31 1 86 GLN 0.45 0.31 1 87 ALA -0.23 -0.23 1 90 ALA -0.07 -0.08 1 94 ALA 0.12 0.50 1 95 ALA -0.20 -0.06 1 stop_ save_