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 bmr5233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.37 _LACS_plot.Line_1_terminator_val_y_1 -1.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.86 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.04 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 6.58 _LACS_plot.Y_axis_chem_shift_offset -0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 100 GLN -1.18 3.21 0 10 ALA 3.05 1.18 1 11 GLN 1.22 1.20 1 13 ARG 1.16 0.74 1 14 ALA 1.96 0.76 1 15 MET 1.75 0.93 1 17 THR -1.52 0.63 1 18 LYS 5.57 4.24 1 19 ARG 7.19 5.35 1 20 GLU 4.81 3.29 1 21 ALA 4.92 3.21 1 23 LEU 4.74 4.08 1 24 LYS 4.65 2.98 1 25 VAL 6.24 3.92 1 26 LEU 5.13 3.11 1 27 GLU 3.32 2.65 1 28 ASN 0.11 0.92 1 29 LEU 2.36 1.02 1 32 GLU 5.22 3.70 1 33 GLU 3.93 3.21 1 34 LEU 4.75 3.24 1 35 LYS 6.54 4.87 1 36 LYS 5.23 4.23 1 37 PHE 4.61 4.48 1 38 LYS 4.99 5.01 1 39 MET 4.73 4.03 1 40 LYS 3.23 2.57 1 41 LEU 4.19 2.89 1 43 THR -0.41 1.50 1 46 LEU -5.37 -1.64 1 47 ARG 0.49 1.23 1 48 GLU 2.80 2.45 1 50 PHE -0.77 0.52 1 51 GLU -2.67 -0.83 1 52 ARG 1.32 -0.23 1 57 ALA 3.20 1.66 1 58 LEU 0.76 1.04 1 60 GLN 1.03 0.69 1 61 LEU 0.20 0.67 1 62 ASP -1.23 -0.95 1 63 ILE 7.25 6.03 1 64 VAL 7.74 5.42 1 65 ASP 4.29 3.58 1 66 LEU 4.27 3.95 1 67 THR 8.96 8.21 1 68 ASP 6.27 4.56 1 69 LYS 3.59 2.51 1 70 LEU 4.16 4.01 1 71 VAL 6.34 5.20 1 72 ALA 4.13 2.92 1 73 SER 3.92 4.17 1 74 TYR -1.30 0.10 1 75 TYR 5.40 3.10 1 76 GLU 6.71 6.21 1 77 ASP 5.23 4.36 1 78 TYR 4.90 2.10 1 79 ALA 6.83 4.45 1 80 ALA 6.71 3.82 1 81 GLU 3.83 3.86 1 82 LEU 4.08 3.25 1 83 VAL 9.23 6.23 1 84 VAL 8.40 6.60 1 85 ALA 5.59 3.69 1 86 VAL 7.67 5.69 1 87 LEU 5.12 3.95 1 88 ARG 7.61 5.56 1 89 ASP 3.47 3.78 1 90 MET -0.93 2.25 1 91 ARG 5.32 2.21 1 92 MET 1.17 0.54 1 93 LEU 6.45 4.77 1 94 GLU 3.75 3.56 1 95 GLU 6.70 4.68 1 96 ALA 5.88 3.33 1 97 ALA 5.34 2.79 1 98 ARG 4.86 3.87 1 99 LEU 3.66 2.58 1 101 ARG 1.91 1.24 1 102 ALA 2.62 1.10 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.37 _LACS_plot.Line_1_terminator_val_y_1 3.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.96 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 -2.65 _LACS_plot.Y_axis_chem_shift_offset -0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 100 GLN -1.18 4.39 0 10 ALA 3.05 -1.87 1 11 GLN 1.22 -0.02 1 13 ARG 1.16 -0.42 1 14 ALA 1.96 -1.20 1 15 MET 1.75 -0.82 1 17 THR -1.52 2.15 1 18 LYS 5.57 -1.33 1 19 ARG 7.19 -1.84 1 20 GLU 4.81 -1.52 1 21 ALA 4.92 -1.71 1 23 LEU 4.74 -0.66 1 24 LYS 4.65 -1.67 1 25 VAL 6.24 -2.32 1 26 LEU 5.13 -2.02 1 27 GLU 3.32 -0.67 1 28 ASN 0.11 0.81 1 29 LEU 2.36 -1.34 1 32 GLU 5.22 -1.52 1 33 GLU 3.93 -0.72 1 34 LEU 4.75 -1.51 1 35 LYS 6.54 -1.67 1 36 LYS 5.23 -1.00 1 37 PHE 4.61 -0.13 1 38 LYS 4.99 0.02 1 39 MET 4.73 -0.70 1 40 LYS 3.23 -0.66 1 41 LEU 4.19 -1.30 1 43 THR -0.41 1.91 1 46 LEU -5.37 3.73 1 47 ARG 0.49 0.74 1 48 GLU 2.80 -0.35 1 50 PHE -0.77 1.29 1 51 GLU -2.67 1.84 1 52 ARG 1.32 -1.55 1 57 ALA 3.20 -1.54 1 58 LEU 0.76 0.28 1 60 GLN 1.03 -0.34 1 61 LEU 0.20 0.47 1 62 ASP -1.23 0.28 1 63 ILE 7.25 -1.22 1 64 VAL 7.74 -2.32 1 65 ASP 4.29 -0.71 1 66 LEU 4.27 -0.32 1 67 THR 8.96 -0.75 1 68 ASP 6.27 -1.71 1 69 LYS 3.59 -1.08 1 70 LEU 4.16 -0.15 1 71 VAL 6.34 -1.14 1 72 ALA 4.13 -1.21 1 73 SER 3.92 0.25 1 74 TYR -1.30 1.40 1 75 TYR 5.40 -2.30 1 76 GLU 6.71 -0.50 1 77 ASP 5.23 -0.87 1 78 TYR 4.90 -2.80 1 79 ALA 6.83 -2.38 1 80 ALA 6.71 -2.89 1 81 GLU 3.83 0.03 1 82 LEU 4.08 -0.83 1 83 VAL 9.23 -3.00 1 84 VAL 8.40 -1.80 1 85 ALA 5.59 -1.90 1 86 VAL 7.67 -1.98 1 87 LEU 5.12 -1.17 1 88 ARG 7.61 -2.05 1 89 ASP 3.47 0.31 1 90 MET -0.93 3.18 1 91 ARG 5.32 -3.11 1 92 MET 1.17 -0.63 1 93 LEU 6.45 -1.68 1 94 GLU 3.75 -0.19 1 95 GLU 6.70 -2.02 1 96 ALA 5.88 -2.55 1 97 ALA 5.34 -2.55 1 98 ARG 4.86 -0.99 1 99 LEU 3.66 -1.08 1 101 ARG 1.91 -0.67 1 102 ALA 2.62 -1.52 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.37 _LACS_plot.Line_1_terminator_val_y_1 0.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.20 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _LACS_plot.Y_axis_chem_shift_offset -0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 71 VAL 6.34 0.56 0 10 ALA 3.05 -0.04 1 11 GLN 1.22 -0.05 1 13 ARG 1.16 -0.56 1 14 ALA 1.96 0.02 1 15 MET 1.75 0.05 1 17 THR -1.52 0.12 1 18 LYS 5.57 -0.26 1 19 ARG 7.19 -0.66 1 20 GLU 4.81 -0.42 1 21 ALA 4.92 -0.26 1 23 LEU 4.74 -0.42 1 24 LYS 4.65 -0.31 1 25 VAL 6.24 -0.26 1 26 LEU 5.13 -0.52 1 27 GLU 3.32 -0.41 1 28 ASN 0.11 0.02 1 29 LEU 2.36 0.26 1 32 GLU 5.22 -0.38 1 33 GLU 3.93 -0.38 1 34 LEU 4.75 -0.25 1 35 LYS 6.54 -0.34 1 36 LYS 5.23 -0.22 1 37 PHE 4.61 -0.57 1 38 LYS 4.99 -0.56 1 39 MET 4.73 -0.34 1 40 LYS 3.23 -0.15 1 41 LEU 4.19 -0.42 1 43 THR -0.41 0.08 1 46 LEU -5.37 0.36 1 47 ARG 0.49 -0.20 1 48 GLU 2.80 -0.19 1 50 PHE -0.77 0.36 1 51 GLU -2.67 0.29 1 52 ARG 1.32 -0.12 1 57 ALA 3.20 0.00 1 58 LEU 0.76 -0.19 1 60 GLN 1.03 0.12 1 61 LEU 0.20 0.18 1 62 ASP -1.23 0.01 1 63 ILE 7.25 -0.45 1 64 VAL 7.74 -0.58 1 65 ASP 4.29 -0.26 1 66 LEU 4.27 -0.29 1 67 THR 8.96 -0.83 1 68 ASP 6.27 -0.33 1 69 LYS 3.59 -0.12 1 70 LEU 4.16 -0.26 1 72 ALA 4.13 -0.06 1 73 SER 3.92 -0.40 1 74 TYR -1.30 0.41 1 75 TYR 5.40 0.08 1 76 GLU 6.71 -0.56 1 77 ASP 5.23 -0.26 1 78 TYR 4.90 -0.42 1 79 ALA 6.83 -0.65 1 80 ALA 6.71 -0.43 1 81 GLU 3.83 -0.45 1 82 LEU 4.08 -0.48 1 83 VAL 9.23 -0.57 1 84 VAL 8.40 -0.70 1 85 ALA 5.59 -0.43 1 86 VAL 7.67 -0.68 1 87 LEU 5.12 -0.21 1 88 ARG 7.61 -0.65 1 89 ASP 3.47 -0.14 1 90 MET -0.93 -0.28 1 91 ARG 5.32 -0.65 1 92 MET 1.17 0.32 1 93 LEU 6.45 -0.51 1 94 GLU 3.75 -0.28 1 95 GLU 6.70 -0.44 1 96 ALA 5.88 -0.40 1 97 ALA 5.34 -0.22 1 98 ARG 4.86 -0.42 1 99 LEU 3.66 -0.46 1 100 GLN -1.18 -0.33 1 101 ARG 1.91 -0.08 1 102 ALA 2.62 -0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr5233_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.37 _LACS_plot.Line_1_terminator_val_y_1 -3.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.52 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.25 _LACS_plot.Line_2_terminator_val_x_2 9.23 _LACS_plot.Line_2_terminator_val_y_2 -0.24 _LACS_plot.Y_axis_chem_shift_offset 1.93 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 46 LEU -5.37 -2.17 0 10 ALA 3.05 -2.15 1 11 GLN 1.22 -1.66 1 13 ARG 1.16 -2.78 1 14 ALA 1.96 -2.51 1 15 MET 1.75 -1.91 1 17 THR -1.52 -1.84 1 18 LYS 5.57 -0.68 1 19 ARG 7.19 0.19 1 20 GLU 4.81 -0.96 1 21 ALA 4.92 -0.11 1 23 LEU 4.74 1.40 1 24 LYS 4.65 0.55 1 25 VAL 6.24 0.00 1 26 LEU 5.13 -0.40 1 27 GLU 3.32 -2.48 1 28 ASN 0.11 -1.82 1 29 LEU 2.36 -1.63 1 32 GLU 5.22 0.76 1 33 GLU 3.93 -0.06 1 34 LEU 4.75 -1.25 1 35 LYS 6.54 0.51 1 36 LYS 5.23 -1.31 1 37 PHE 4.61 -1.28 1 38 LYS 4.99 0.10 1 39 MET 4.73 1.58 1 40 LYS 3.23 0.51 1 41 LEU 4.19 -1.60 1 43 THR -0.41 -0.14 1 47 ARG 0.49 0.42 1 48 GLU 2.80 -1.93 1 50 PHE -0.77 -3.02 1 51 GLU -2.67 -2.40 1 52 ARG 1.32 1.93 1 57 ALA 3.20 -0.80 1 58 LEU 0.76 -2.14 1 60 GLN 1.03 -2.19 1 61 LEU 0.20 -2.53 1 62 ASP -1.23 -2.32 1 63 ILE 7.25 -0.84 1 64 VAL 7.74 -1.42 1 65 ASP 4.29 1.17 1 66 LEU 4.27 -2.67 1 67 THR 8.96 -0.99 1 68 ASP 6.27 -2.62 1 69 LYS 3.59 -2.60 1 70 LEU 4.16 -1.39 1 71 VAL 6.34 -0.30 1 72 ALA 4.13 -0.55 1 73 SER 3.92 -1.90 1 74 TYR -1.30 -2.90 1 75 TYR 5.40 -2.50 1 76 GLU 6.71 -1.80 1 77 ASP 5.23 -3.98 1 79 ALA 6.83 -2.70 1 80 ALA 6.71 -1.75 1 81 GLU 3.83 -3.16 1 82 LEU 4.08 -1.65 1 83 VAL 9.23 -0.74 1 84 VAL 8.40 -1.58 1 85 ALA 5.59 -2.94 1 86 VAL 7.67 -0.52 1 87 LEU 5.12 0.33 1 88 ARG 7.61 1.80 1 89 ASP 3.47 -0.50 1 90 MET -0.93 -3.56 1 91 ARG 5.32 1.00 1 92 MET 1.17 -2.18 1 93 LEU 6.45 0.53 1 94 GLU 3.75 0.14 1 95 GLU 6.70 -0.63 1 96 ALA 5.88 -1.40 1 97 ALA 5.34 0.00 1 98 ARG 4.86 0.30 1 99 LEU 3.66 -1.63 1 100 GLN -1.18 -1.50 1 101 ARG 1.91 -2.52 1 102 ALA 2.62 -3.90 1 stop_ save_