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 bmr34085_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -5.19 _LACS_plot.Line_1_terminator_val_y_1 -2.91 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -1.19 _LACS_plot.Line_2_terminator_val_x_2 9.76 _LACS_plot.Line_2_terminator_val_y_2 8.18 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 LEU 4.75 1.38 0 10 ALA 0.10 0.22 1 12 VAL -0.07 -0.02 1 13 SER -1.11 -0.32 1 14 ALA 2.60 2.48 1 15 ALA 1.89 1.50 1 17 ILE -0.70 -0.24 1 18 GLU 1.29 2.30 1 20 ASP 1.45 1.85 1 21 LEU 0.16 0.06 1 22 THR 9.76 8.37 1 23 ALA 4.27 3.44 1 24 ILE 4.41 4.57 1 25 TRP 5.76 4.94 1 26 GLN 4.98 4.57 1 27 ALA 2.86 2.13 1 28 LEU 2.39 2.77 1 29 PHE 0.31 1.02 1 30 ALA 3.39 0.79 1 31 LEU -2.31 -1.86 1 33 ALA -3.51 -1.11 1 34 VAL -3.73 -0.96 1 36 ARG 0.91 2.08 1 37 HIS -2.35 -0.21 1 38 GLN -0.65 1.72 1 39 ASP -3.19 0.21 1 40 PHE 1.87 4.17 1 41 PHE 2.38 2.62 1 42 ALA 3.71 2.94 1 43 LEU 0.58 0.73 1 46 ASP -3.26 -1.74 1 47 SER 6.03 4.64 1 48 GLN 4.78 3.81 1 49 LEU 2.94 3.22 1 51 LEU 4.89 5.10 1 52 ARG 1.51 0.89 1 54 LEU 3.72 3.45 1 55 ALA 6.19 5.26 1 56 GLN 4.37 4.51 1 57 LEU 3.56 3.69 1 58 ARG 3.81 3.16 1 59 GLU 1.47 2.42 1 60 ARG 3.21 2.29 1 61 HIS -1.49 1.00 1 63 VAL -1.59 -0.72 1 64 ASP -2.43 -1.33 1 65 LEU 3.67 4.42 1 67 LEU 4.08 3.33 1 68 ARG 4.04 4.97 1 70 LEU 1.37 2.32 1 71 TYR 3.57 3.68 1 72 GLU 0.34 0.51 1 73 ALA -0.95 -0.10 1 75 THR -5.19 -2.92 1 76 VAL 6.78 5.49 1 77 ALA 3.76 3.26 1 78 ARG 6.30 5.44 1 79 LEU 3.86 3.17 1 80 ALA 2.80 2.97 1 81 GLU 3.14 2.90 1 82 THR 6.16 5.28 1 83 ILE 5.70 3.35 1 84 VAL 4.34 3.49 1 85 ARG 4.00 3.25 1 87 ALA 0.01 0.17 1 88 ALA 0.02 0.31 1 90 ALA -0.63 0.08 1 92 SER -0.15 0.33 1 94 ASP 0.20 0.37 1 95 GLN 0.09 0.02 1 96 ASP 0.07 0.34 1 97 ASP 0.05 0.36 1 98 ALA 0.13 0.23 1 99 SER 0.61 0.90 1 100 GLU -1.01 -0.12 1 101 TYR -0.24 0.04 1 102 GLU -0.77 -0.15 1 103 GLU 0.40 0.72 1 105 VAL 1.31 0.43 1 106 ILE 1.46 0.95 1 107 ARG 1.49 2.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34085_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -5.19 _LACS_plot.Line_1_terminator_val_y_1 2.28 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.47 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.81 _LACS_plot.Line_2_terminator_val_x_2 9.76 _LACS_plot.Line_2_terminator_val_y_2 -1.58 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 LEU 4.75 -3.37 0 10 ALA 0.10 0.12 1 12 VAL -0.07 0.05 1 13 SER -1.11 0.79 1 14 ALA 2.60 -0.12 1 15 ALA 1.89 -0.39 1 17 ILE -0.70 0.46 1 18 GLU 1.29 1.01 1 20 ASP 1.45 0.40 1 21 LEU 0.16 -0.10 1 22 THR 9.76 -1.39 1 23 ALA 4.27 -0.83 1 24 ILE 4.41 0.16 1 25 TRP 5.76 -0.82 1 26 GLN 4.98 -0.41 1 27 ALA 2.86 -0.73 1 28 LEU 2.39 0.38 1 29 PHE 0.31 0.71 1 30 ALA 3.39 -2.60 1 31 LEU -2.31 0.45 1 33 ALA -3.51 2.40 1 34 VAL -3.73 2.77 1 36 ARG 0.91 1.17 1 37 HIS -2.35 2.14 1 38 GLN -0.65 2.37 1 39 ASP -3.19 3.40 1 40 PHE 1.87 2.30 1 41 PHE 2.38 0.24 1 42 ALA 3.71 -0.77 1 43 LEU 0.58 0.15 1 46 ASP -3.26 1.52 1 47 SER 6.03 -1.39 1 48 GLN 4.78 -0.97 1 49 LEU 2.94 0.28 1 51 LEU 4.89 0.21 1 52 ARG 1.51 -0.62 1 54 LEU 3.72 -0.27 1 55 ALA 6.19 -0.93 1 56 GLN 4.37 0.14 1 57 LEU 3.56 0.13 1 58 ARG 3.81 -0.65 1 59 GLU 1.47 0.95 1 60 ARG 3.21 -0.92 1 61 HIS -1.49 2.49 1 63 VAL -1.59 0.87 1 64 ASP -2.43 1.10 1 65 LEU 3.67 0.75 1 67 LEU 4.08 -0.75 1 68 ARG 4.04 0.93 1 70 LEU 1.37 0.95 1 71 TYR 3.57 0.11 1 72 GLU 0.34 0.17 1 73 ALA -0.95 0.85 1 75 THR -5.19 2.27 1 76 VAL 6.78 -1.29 1 77 ALA 3.76 -0.50 1 78 ARG 6.30 -0.86 1 79 LEU 3.86 -0.69 1 80 ALA 2.80 0.17 1 81 GLU 3.14 -0.24 1 82 THR 6.16 -0.88 1 83 ILE 5.70 -2.35 1 84 VAL 4.34 -0.85 1 85 ARG 4.00 -0.75 1 87 ALA 0.01 0.16 1 88 ALA 0.02 0.29 1 90 ALA -0.63 0.71 1 92 SER -0.15 0.48 1 94 ASP 0.20 0.17 1 95 GLN 0.09 -0.07 1 96 ASP 0.07 0.27 1 97 ASP 0.05 0.31 1 98 ALA 0.13 0.10 1 99 SER 0.61 0.29 1 100 GLU -1.01 0.89 1 101 TYR -0.24 0.28 1 102 GLU -0.77 0.62 1 103 GLU 0.40 0.32 1 105 VAL 1.31 -0.88 1 106 ILE 1.46 -0.51 1 107 ARG 1.49 0.81 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34085_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -5.19 _LACS_plot.Line_1_terminator_val_y_1 0.25 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.03 _LACS_plot.Line_2_terminator_val_x_2 9.76 _LACS_plot.Line_2_terminator_val_y_2 -0.62 _LACS_plot.Y_axis_chem_shift_offset 0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 SER 6.03 0.43 0 76 VAL 6.78 -1.36 0 10 ALA 0.10 -0.06 1 12 VAL -0.07 -0.01 1 13 SER -1.11 0.06 1 14 ALA 2.60 -0.39 1 15 ALA 1.89 -0.28 1 17 ILE -0.70 0.00 1 18 GLU 1.29 -0.43 1 20 ASP 1.45 -0.45 1 21 LEU 0.16 -0.39 1 22 THR 9.76 -0.13 1 23 ALA 4.27 -0.17 1 24 ILE 4.41 -0.26 1 25 TRP 5.76 -0.28 1 26 GLN 4.98 -0.45 1 27 ALA 2.86 -0.06 1 28 LEU 2.39 -0.44 1 29 PHE 0.31 -0.23 1 30 ALA 3.39 -0.27 1 31 LEU -2.31 0.33 1 33 ALA -3.51 0.18 1 34 VAL -3.73 0.04 1 36 ARG 0.91 -0.47 1 37 HIS -2.35 0.39 1 38 GLN -0.65 -0.06 1 39 ASP -3.19 0.24 1 40 PHE 1.87 0.28 1 41 PHE 2.38 -0.44 1 42 ALA 3.71 -0.14 1 43 LEU 0.58 -0.55 1 46 ASP -3.26 0.45 1 48 GLN 4.78 -0.27 1 49 LEU 2.94 -0.32 1 51 LEU 4.89 -0.63 1 52 ARG 1.51 -0.14 1 54 LEU 3.72 -0.42 1 55 ALA 6.19 -0.07 1 56 GLN 4.37 -0.25 1 57 LEU 3.56 -0.27 1 58 ARG 3.81 -0.26 1 59 GLU 1.47 -0.48 1 60 ARG 3.21 -0.29 1 61 HIS -1.49 0.17 1 63 VAL -1.59 -0.06 1 64 ASP -2.43 0.06 1 65 LEU 3.67 0.04 1 67 LEU 4.08 -0.30 1 68 ARG 4.04 -0.17 1 70 LEU 1.37 -0.21 1 71 TYR 3.57 -0.39 1 72 GLU 0.34 -0.23 1 73 ALA -0.95 0.01 1 75 THR -5.19 0.87 1 77 ALA 3.76 -0.49 1 78 ARG 6.30 -0.24 1 79 LEU 3.86 -0.27 1 80 ALA 2.80 -0.50 1 81 GLU 3.14 -0.42 1 82 THR 6.16 -0.51 1 83 ILE 5.70 -0.28 1 84 VAL 4.34 -0.51 1 85 ARG 4.00 -0.24 1 86 LEU 4.75 -0.13 1 87 ALA 0.01 -0.04 1 88 ALA 0.02 -0.06 1 90 ALA -0.63 -0.06 1 92 SER -0.15 -0.04 1 94 ASP 0.20 -0.09 1 95 GLN 0.09 -0.04 1 96 ASP 0.07 0.23 1 97 ASP 0.05 -0.08 1 98 ALA 0.13 -0.04 1 99 SER 0.61 -0.14 1 100 GLU -1.01 -0.15 1 101 TYR -0.24 -0.03 1 102 GLU -0.77 -0.15 1 103 GLU 0.40 -0.22 1 105 VAL 1.31 -0.07 1 106 ILE 1.46 -0.12 1 107 ARG 1.49 -0.20 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr34085_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -5.19 _LACS_plot.Line_1_terminator_val_y_1 -1.99 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.83 _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 9.76 _LACS_plot.Line_2_terminator_val_y_2 3.05 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 ALA 6.19 -2.02 0 22 THR 9.76 0.99 0 10 ALA 0.10 0.38 1 12 VAL -0.07 -0.32 1 13 SER -1.11 0.13 1 14 ALA 2.60 0.89 1 15 ALA 1.89 1.59 1 17 ILE -0.70 0.22 1 18 GLU 1.29 0.80 1 20 ASP 1.45 1.20 1 21 LEU 0.16 0.25 1 23 ALA 4.27 3.62 1 24 ILE 4.41 2.30 1 25 TRP 5.76 1.93 1 26 GLN 4.98 2.18 1 27 ALA 2.86 2.62 1 28 LEU 2.39 0.78 1 29 PHE 0.31 -1.58 1 30 ALA 3.39 -1.68 1 31 LEU -2.31 0.75 1 33 ALA -3.51 -2.03 1 34 VAL -3.73 -0.87 1 36 ARG 0.91 -2.63 1 37 HIS -2.35 2.18 1 38 GLN -0.65 -1.14 1 39 ASP -3.19 -0.54 1 40 PHE 1.87 -0.37 1 41 PHE 2.38 4.69 1 42 ALA 3.71 2.79 1 43 LEU 0.58 -1.65 1 46 ASP -3.26 0.46 1 47 SER 6.03 0.85 1 48 GLN 4.78 3.50 1 49 LEU 2.94 2.12 1 51 LEU 4.89 1.10 1 52 ARG 1.51 1.37 1 54 LEU 3.72 -0.63 1 56 GLN 4.37 3.56 1 57 LEU 3.56 2.82 1 58 ARG 3.81 2.22 1 59 GLU 1.47 1.59 1 60 ARG 3.21 1.36 1 61 HIS -1.49 1.86 1 63 VAL -1.59 -2.73 1 64 ASP -2.43 -2.24 1 65 LEU 3.67 -1.47 1 67 LEU 4.08 1.16 1 68 ARG 4.04 0.34 1 70 LEU 1.37 -0.63 1 71 TYR 3.57 2.99 1 72 GLU 0.34 -0.81 1 73 ALA -0.95 -3.90 1 75 THR -5.19 -1.16 1 76 VAL 6.78 1.34 1 77 ALA 3.76 3.82 1 78 ARG 6.30 3.08 1 79 LEU 3.86 1.30 1 80 ALA 2.80 1.03 1 81 GLU 3.14 2.28 1 82 THR 6.16 0.75 1 83 ILE 5.70 1.39 1 84 VAL 4.34 2.06 1 85 ARG 4.00 2.24 1 86 LEU 4.75 0.23 1 87 ALA 0.01 -0.82 1 88 ALA 0.02 -0.82 1 90 ALA -0.63 -0.30 1 92 SER -0.15 0.73 1 94 ASP 0.20 -0.53 1 95 GLN 0.09 -0.49 1 96 ASP 0.07 -0.01 1 97 ASP 0.05 -0.17 1 98 ALA 0.13 0.22 1 99 SER 0.61 0.14 1 100 GLU -1.01 -0.47 1 101 TYR -0.24 -0.30 1 102 GLU -0.77 -0.65 1 103 GLU 0.40 0.55 1 105 VAL 1.31 -0.52 1 106 ILE 1.46 -1.15 1 107 ARG 1.49 4.52 1 stop_ save_