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 bmr18555_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 -2.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.15 _LACS_plot.Line_2_terminator_val_x_2 6.30 _LACS_plot.Line_2_terminator_val_y_2 4.77 _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 98 ILE -7.78 -0.28 0 10 THR -0.54 -0.15 1 11 LEU 3.04 2.53 1 12 TYR 0.63 3.85 1 13 ALA 3.17 2.45 1 15 LEU 2.35 2.00 1 19 THR 2.34 1.82 1 20 ALA -4.90 -1.27 1 21 VAL 1.05 -0.19 1 22 ILE -4.21 -0.88 1 23 SER -3.16 -0.92 1 24 TRP 2.72 2.44 1 25 ALA 3.80 2.82 1 26 GLU 0.63 1.15 1 27 LEU -0.53 -0.17 1 28 GLN 3.34 2.76 1 30 PHE 3.40 2.68 1 31 PHE 3.05 2.04 1 32 ALA -0.69 -0.67 1 33 ARG -2.18 -0.44 1 35 ALA -3.15 -0.69 1 36 LEU -5.23 -1.87 1 37 LEU -3.77 -2.10 1 38 GLN -3.32 -2.27 1 39 VAL -1.86 1.31 1 40 ASP 2.79 2.74 1 41 ALA 0.46 0.49 1 42 ALA -2.36 -1.58 1 43 LEU -1.61 -1.48 1 44 ASP 2.74 3.51 1 45 LEU 6.30 3.81 1 46 VAL 2.29 2.52 1 47 GLU 5.14 2.92 1 48 VAL 3.69 3.11 1 49 ALA 3.69 3.13 1 50 GLU 1.97 2.40 1 51 ALA 2.46 2.63 1 52 LEU 2.28 2.09 1 53 ALA 1.88 0.86 1 55 ASP 0.55 -1.64 1 56 ASP 3.91 3.17 1 57 ARG 3.59 2.83 1 58 GLU 3.54 3.23 1 59 LYS 5.71 4.93 1 60 VAL 3.72 2.69 1 61 ALA 3.81 2.41 1 62 ALA 3.31 2.31 1 63 TRP 2.44 2.47 1 64 LEU 3.05 2.26 1 65 SER -7.69 -2.44 1 69 LEU -3.51 -1.32 1 70 SER 1.03 0.69 1 71 LYS 2.91 2.16 1 72 VAL 3.49 3.53 1 74 GLU 4.57 3.03 1 75 ASP 2.18 1.49 1 76 ALA 2.94 2.44 1 77 ALA 3.88 3.20 1 78 LYS 2.37 2.82 1 79 ASP 3.72 1.10 1 80 PHE 3.11 2.74 1 81 LEU 2.05 2.23 1 82 GLU 0.99 2.24 1 83 ARG 2.05 2.03 1 84 ASP 3.64 2.56 1 86 THR -3.99 -1.83 1 87 LEU -3.69 -1.75 1 88 TRP -7.66 -2.03 1 89 ALA -4.02 -1.64 1 90 VAL 1.81 1.06 1 91 VAL -1.53 -1.77 1 92 VAL 2.53 1.64 1 93 ALA -4.17 -1.33 1 95 TRP -0.00 0.77 1 96 VAL -1.69 -2.10 1 97 VAL -7.16 -2.78 1 99 GLN -0.20 -0.44 1 100 GLU -1.26 -1.17 1 101 ARG -0.66 -0.17 1 102 ALA -0.47 0.04 1 103 GLU 0.07 0.02 1 104 LYS -0.36 0.07 1 105 ALA -0.19 -0.17 1 106 THR 0.26 0.21 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18555_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 5.02 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.85 _LACS_plot.Line_2_terminator_val_x_2 6.30 _LACS_plot.Line_2_terminator_val_y_2 -1.53 _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 98 ILE -7.78 7.50 0 10 THR -0.54 0.39 1 11 LEU 3.04 -0.51 1 12 TYR 0.63 3.22 1 13 ALA 3.17 -0.72 1 15 LEU 2.35 -0.35 1 19 THR 2.34 -0.52 1 20 ALA -4.90 3.63 1 21 VAL 1.05 -1.24 1 22 ILE -4.21 3.33 1 23 SER -3.16 2.24 1 24 TRP 2.72 -0.28 1 25 ALA 3.80 -0.98 1 26 GLU 0.63 0.52 1 27 LEU -0.53 0.36 1 28 GLN 3.34 -0.58 1 30 PHE 3.40 -0.72 1 31 PHE 3.05 -1.01 1 32 ALA -0.69 0.02 1 33 ARG -2.18 1.74 1 35 ALA -3.15 2.46 1 36 LEU -5.23 3.36 1 37 LEU -3.77 1.67 1 38 GLN -3.32 1.05 1 39 VAL -1.86 3.17 1 40 ASP 2.79 -0.05 1 41 ALA 0.46 0.03 1 42 ALA -2.36 0.78 1 43 LEU -1.61 0.13 1 44 ASP 2.74 0.77 1 45 LEU 6.30 -2.49 1 46 VAL 2.29 0.23 1 47 GLU 5.14 -2.22 1 48 VAL 3.69 -0.58 1 49 ALA 3.69 -0.56 1 50 GLU 1.97 0.43 1 51 ALA 2.46 0.17 1 52 LEU 2.28 -0.19 1 53 ALA 1.88 -1.02 1 55 ASP 0.55 -2.19 1 56 ASP 3.91 -0.74 1 57 ARG 3.59 -0.76 1 58 GLU 3.54 -0.31 1 59 LYS 5.71 -0.78 1 60 VAL 3.72 -1.03 1 61 ALA 3.81 -1.40 1 62 ALA 3.31 -1.00 1 63 TRP 2.44 0.03 1 64 LEU 3.05 -0.79 1 65 SER -7.69 5.25 1 69 LEU -3.51 2.19 1 70 SER 1.03 -0.34 1 71 LYS 2.91 -0.75 1 72 VAL 3.49 0.04 1 74 GLU 4.57 -1.54 1 75 ASP 2.18 -0.69 1 76 ALA 2.94 -0.50 1 77 ALA 3.88 -0.68 1 78 LYS 2.37 0.45 1 79 ASP 3.72 -2.62 1 80 PHE 3.11 -0.37 1 81 LEU 2.05 0.18 1 82 GLU 0.99 1.25 1 83 ARG 2.05 -0.02 1 84 ASP 3.64 -1.08 1 86 THR -3.99 2.16 1 87 LEU -3.69 1.94 1 88 TRP -7.66 5.63 1 89 ALA -4.02 2.38 1 90 VAL 1.81 -0.75 1 91 VAL -1.53 -0.24 1 92 VAL 2.53 -0.89 1 93 ALA -4.17 2.84 1 95 TRP -0.00 0.77 1 96 VAL -1.69 -0.41 1 97 VAL -7.16 4.38 1 99 GLN -0.20 -0.24 1 100 GLU -1.26 0.09 1 101 ARG -0.66 0.49 1 102 ALA -0.47 0.51 1 103 GLU 0.07 -0.05 1 104 LYS -0.36 0.43 1 105 ALA -0.19 0.02 1 106 THR 0.26 -0.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18555_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 0.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 6.30 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _LACS_plot.Y_axis_chem_shift_offset -0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 97 VAL -7.16 1.84 0 10 THR -0.54 -0.13 1 11 LEU 3.04 -0.13 1 12 TYR 0.63 -0.19 1 13 ALA 3.17 -0.30 1 15 LEU 2.35 -0.38 1 19 THR 2.34 0.18 1 20 ALA -4.90 0.39 1 21 VAL 1.05 0.30 1 22 ILE -4.21 0.27 1 23 SER -3.16 0.26 1 24 TRP 2.72 -0.41 1 25 ALA 3.80 -0.51 1 26 GLU 0.63 -0.34 1 27 LEU -0.53 0.04 1 28 GLN 3.34 -0.47 1 30 PHE 3.40 -0.05 1 31 PHE 3.05 -0.56 1 32 ALA -0.69 0.11 1 33 ARG -2.18 0.52 1 35 ALA -3.15 1.05 1 36 LEU -5.23 0.78 1 37 LEU -3.77 0.93 1 38 GLN -3.32 0.62 1 39 VAL -1.86 -0.24 1 40 ASP 2.79 -0.30 1 41 ALA 0.46 -0.10 1 42 ALA -2.36 -0.01 1 43 LEU -1.61 0.07 1 44 ASP 2.74 -0.79 1 45 LEU 6.30 -1.00 1 46 VAL 2.29 -0.18 1 47 GLU 5.14 -0.37 1 48 VAL 3.69 -0.46 1 49 ALA 3.69 -0.70 1 50 GLU 1.97 0.06 1 51 ALA 2.46 -0.27 1 52 LEU 2.28 -0.24 1 53 ALA 1.88 -0.27 1 55 ASP 0.55 0.11 1 56 ASP 3.91 -0.53 1 57 ARG 3.59 -0.38 1 58 GLU 3.54 -0.84 1 59 LYS 5.71 -0.45 1 60 VAL 3.72 -0.29 1 61 ALA 3.81 -0.18 1 62 ALA 3.31 0.18 1 63 TRP 2.44 0.27 1 64 LEU 3.05 -0.14 1 65 SER -7.69 0.83 1 69 LEU -3.51 0.20 1 70 SER 1.03 0.25 1 71 LYS 2.91 -0.11 1 72 VAL 3.49 -0.26 1 74 GLU 4.57 -0.35 1 75 ASP 2.18 -0.52 1 76 ALA 2.94 -1.19 1 77 ALA 3.88 -0.51 1 78 LYS 2.37 -0.39 1 79 ASP 3.72 -0.62 1 80 PHE 3.11 -0.38 1 81 LEU 2.05 -0.37 1 82 GLU 0.99 -0.13 1 83 ARG 2.05 -0.32 1 84 ASP 3.64 -0.36 1 86 THR -3.99 0.57 1 87 LEU -3.69 0.33 1 88 TRP -7.66 1.49 1 89 ALA -4.02 0.28 1 90 VAL 1.81 -0.05 1 91 VAL -1.53 0.05 1 92 VAL 2.53 -0.55 1 93 ALA -4.17 0.69 1 95 TRP -0.00 0.13 1 96 VAL -1.69 0.76 1 98 ILE -7.78 0.35 1 99 GLN -0.20 0.37 1 100 GLU -1.26 0.06 1 101 ARG -0.66 0.05 1 102 ALA -0.47 -0.09 1 103 GLU 0.07 -0.05 1 104 LYS -0.36 0.05 1 105 ALA -0.19 -0.07 1 106 THR 0.26 -0.09 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18555_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.78 _LACS_plot.Line_1_terminator_val_y_1 -2.95 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.83 _LACS_plot.Line_2_terminator_val_x_2 6.30 _LACS_plot.Line_2_terminator_val_y_2 2.74 _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 86 THR 3.64 -1.51 0 69 LEU -7.69 -3.09 0 98 ILE -7.16 -1.38 0 99 GLN -7.78 -2.18 0 89 ALA -7.66 -1.43 0 10 THR -0.54 1.70 1 11 LEU 3.04 0.00 1 12 TYR 0.63 0.81 1 13 ALA 3.17 2.51 1 19 THR 2.34 -0.52 1 20 ALA -4.90 -2.30 1 21 VAL 1.05 -0.13 1 22 ILE -4.21 -2.64 1 23 SER -3.16 0.59 1 24 TRP 2.72 1.63 1 25 ALA 3.80 2.94 1 26 GLU 0.63 0.59 1 27 LEU -0.53 0.67 1 30 PHE 3.34 2.67 1 31 PHE 3.40 3.35 1 32 ALA 3.05 0.58 1 33 ARG -0.69 0.28 1 35 ALA -2.18 -2.22 1 36 LEU -3.15 -1.19 1 37 LEU -5.23 -3.15 1 38 GLN -3.77 -1.28 1 39 VAL -3.32 -0.75 1 40 ASP -1.86 0.63 1 41 ALA 2.79 -0.56 1 42 ALA 0.46 0.32 1 43 LEU -2.36 -2.54 1 44 ASP -1.61 -0.18 1 45 LEU 2.74 -0.90 1 46 VAL 6.30 0.80 1 47 GLU 2.29 3.29 1 48 VAL 5.14 1.49 1 49 ALA 3.69 0.61 1 50 GLU 3.69 -0.21 1 51 ALA 1.97 2.15 1 52 LEU 2.46 2.83 1 53 ALA 2.28 1.49 1 55 ASP 1.88 2.67 1 56 ASP 0.55 2.70 1 57 ARG 3.91 -1.20 1 58 GLU 3.59 2.71 1 59 LYS 3.54 1.55 1 60 VAL 5.71 1.15 1 61 ALA 3.72 2.76 1 62 ALA 3.81 3.90 1 63 TRP 3.31 3.68 1 64 LEU 2.44 3.17 1 65 SER 3.05 1.92 1 70 SER -3.51 -1.54 1 71 LYS 1.03 0.40 1 72 VAL 2.91 -0.83 1 74 GLU 3.49 2.17 1 75 ASP 4.57 2.20 1 76 ALA 2.18 0.25 1 77 ALA 2.94 1.25 1 78 LYS 3.88 1.52 1 79 ASP 2.37 1.07 1 80 PHE 3.72 2.82 1 81 LEU 3.11 1.44 1 82 GLU 2.05 2.03 1 83 ARG 0.99 0.19 1 87 LEU -3.99 -3.03 1 88 TRP -3.69 -0.43 1 90 VAL -4.02 -3.19 1 91 VAL 1.81 -0.42 1 92 VAL -1.53 -2.54 1 95 TRP -4.17 -0.04 1 96 VAL -0.00 -2.54 1 97 VAL -1.69 -0.91 1 100 GLU -0.20 -0.78 1 101 ARG -1.26 -1.00 1 102 ALA -0.66 -0.09 1 103 GLU -0.47 -0.11 1 104 LYS 0.07 -0.40 1 105 ALA -0.36 -0.08 1 106 THR -0.19 -0.52 1 107 LEU 0.26 -1.46 1 stop_ save_