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 bmr18331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 -4.66 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.20 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.46 _LACS_plot.Line_2_terminator_val_x_2 7.52 _LACS_plot.Line_2_terminator_val_y_2 5.69 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 THR -7.76 -3.84 0 10 ARG 2.22 3.51 1 11 VAL 6.90 5.48 1 12 LYS 6.50 5.71 1 13 LYS 4.11 3.52 1 14 ILE 4.31 2.84 1 15 VAL 6.32 4.89 1 16 ALA 4.17 3.09 1 17 GLU 2.46 2.22 1 18 GLN 3.27 2.22 1 19 LEU 0.74 -0.78 1 21 VAL -4.48 -3.51 1 22 LYS 0.62 0.09 1 23 GLU 4.83 4.31 1 24 GLU 3.32 1.97 1 25 GLU -0.00 -0.17 1 26 VAL 3.36 0.78 1 27 THR -2.70 -2.07 1 28 ASN 6.99 4.50 1 29 SER -0.25 -0.32 1 30 ALA 1.26 0.41 1 31 SER -2.32 -2.46 1 32 PHE 4.93 2.57 1 33 VAL 3.31 2.92 1 34 GLU 3.95 3.50 1 35 ASP 1.05 2.07 1 36 LEU -0.35 -0.60 1 38 ALA -0.95 0.02 1 39 ASP -3.18 -2.43 1 40 SER 0.01 2.00 1 41 LEU 3.82 2.45 1 42 ASP 2.84 3.02 1 43 THR 7.03 5.06 1 44 VAL 5.34 4.23 1 45 GLU 4.03 2.74 1 46 LEU 3.88 3.27 1 47 VAL 7.53 5.79 1 48 MET 3.94 3.86 1 49 ALA 3.26 2.43 1 50 LEU 3.44 3.13 1 51 GLU 3.30 3.23 1 52 GLU 2.32 2.18 1 53 GLU 2.55 1.78 1 54 PHE 1.88 0.61 1 55 GLU 2.97 0.36 1 56 THR -3.44 -1.66 1 57 GLU -2.30 -0.91 1 58 ILE 1.26 0.28 1 60 ASP 4.97 4.00 1 61 GLU 3.41 2.21 1 62 LYS 1.38 0.11 1 63 ALA 3.22 2.61 1 64 GLU 1.60 1.42 1 65 LYS -0.72 -1.46 1 66 ILE 2.92 0.86 1 67 THR -0.98 0.28 1 69 VAL 7.23 5.28 1 70 GLN 3.26 2.62 1 71 GLU 2.43 2.36 1 72 ALA 5.15 3.37 1 73 ILE 5.73 5.33 1 74 ASP 4.32 2.95 1 75 TYR 5.05 4.80 1 76 ILE 5.77 2.71 1 77 VAL 5.64 4.66 1 78 ALA 1.75 0.98 1 79 HIS 2.38 1.65 1 80 GLN 0.12 0.54 1 81 GLN 0.87 1.81 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 3.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.80 _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 7.52 _LACS_plot.Line_2_terminator_val_y_2 -1.83 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 THR -7.76 3.92 0 10 ARG 2.22 1.29 1 11 VAL 6.90 -1.42 1 12 LYS 6.50 -0.79 1 13 LYS 4.11 -0.59 1 14 ILE 4.31 -1.47 1 15 VAL 6.32 -1.43 1 16 ALA 4.17 -1.08 1 17 GLU 2.46 -0.24 1 18 GLN 3.27 -1.05 1 19 LEU 0.74 -1.52 1 21 VAL -4.48 0.97 1 22 LYS 0.62 -0.53 1 23 GLU 4.83 -0.52 1 24 GLU 3.32 -1.35 1 25 GLU -0.00 -0.17 1 26 VAL 3.36 -2.58 1 27 THR -2.70 0.63 1 28 ASN 6.99 -2.49 1 29 SER -0.25 -0.07 1 30 ALA 1.26 -0.85 1 31 SER -2.32 -0.14 1 32 PHE 4.93 -2.36 1 33 VAL 3.31 -0.39 1 34 GLU 3.95 -0.45 1 35 ASP 1.05 1.02 1 36 LEU -0.35 -0.25 1 38 ALA -0.95 0.97 1 39 ASP -3.18 0.75 1 40 SER 0.01 1.99 1 41 LEU 3.82 -1.37 1 42 ASP 2.84 0.18 1 43 THR 7.03 -1.97 1 44 VAL 5.34 -1.11 1 45 GLU 4.03 -1.29 1 46 LEU 3.88 -0.61 1 47 VAL 7.53 -1.74 1 48 MET 3.94 -0.08 1 49 ALA 3.26 -0.83 1 50 LEU 3.44 -0.31 1 51 GLU 3.30 -0.07 1 52 GLU 2.32 -0.14 1 53 GLU 2.55 -0.77 1 54 PHE 1.88 -1.27 1 55 GLU 2.97 -2.61 1 56 THR -3.44 1.78 1 57 GLU -2.30 1.39 1 58 ILE 1.26 -0.98 1 60 ASP 4.97 -0.97 1 61 GLU 3.41 -1.20 1 62 LYS 1.38 -1.27 1 63 ALA 3.22 -0.61 1 64 GLU 1.60 -0.18 1 65 LYS -0.72 -0.74 1 66 ILE 2.92 -2.06 1 67 THR -0.98 1.26 1 69 VAL 7.23 -1.95 1 70 GLN 3.26 -0.64 1 71 GLU 2.43 -0.07 1 72 ALA 5.15 -1.78 1 73 ILE 5.73 -0.40 1 74 ASP 4.32 -1.37 1 75 TYR 5.05 -0.25 1 76 ILE 5.77 -3.06 1 77 VAL 5.64 -0.98 1 78 ALA 1.75 -0.77 1 79 HIS 2.38 -0.73 1 80 GLN 0.12 0.42 1 81 GLN 0.87 0.94 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 0.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.14 _LACS_plot.Line_2_terminator_val_x_2 7.52 _LACS_plot.Line_2_terminator_val_y_2 -0.81 _LACS_plot.Y_axis_chem_shift_offset 0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 THR -7.76 0.32 0 10 ARG 2.22 -0.39 1 11 VAL 6.90 -0.59 1 12 LYS 6.50 -0.70 1 13 LYS 4.11 -0.42 1 14 ILE 4.31 -0.39 1 15 VAL 6.32 -0.87 1 16 ALA 4.17 -0.52 1 17 GLU 2.46 -0.41 1 18 GLN 3.27 -0.51 1 19 LEU 0.74 0.04 1 21 VAL -4.48 0.43 1 22 LYS 0.62 -0.14 1 23 GLU 4.83 -0.73 1 24 GLU 3.32 -0.31 1 25 GLU -0.00 -0.21 1 26 VAL 3.36 -0.45 1 27 THR -2.70 0.15 1 28 ASN 6.99 -0.88 1 29 SER -0.25 -0.18 1 30 ALA 1.26 -0.26 1 31 SER -2.32 0.24 1 32 PHE 4.93 -0.51 1 33 VAL 3.31 -0.02 1 34 GLU 3.95 -0.39 1 35 ASP 1.05 0.27 1 36 LEU -0.35 0.18 1 38 ALA -0.95 0.10 1 39 ASP -3.18 0.22 1 40 SER 0.01 -0.24 1 41 LEU 3.82 -0.16 1 42 ASP 2.84 -0.38 1 43 THR 7.03 -0.76 1 44 VAL 5.34 -0.52 1 45 GLU 4.03 -0.42 1 46 LEU 3.88 -0.56 1 47 VAL 7.53 -0.84 1 48 MET 3.94 -0.18 1 49 ALA 3.26 -0.15 1 50 LEU 3.44 -0.21 1 51 GLU 3.30 -0.35 1 52 GLU 2.32 -0.35 1 53 GLU 2.55 -0.48 1 54 PHE 1.88 -0.11 1 55 GLU 2.97 -0.43 1 56 THR -3.44 0.29 1 57 GLU -2.30 0.01 1 58 ILE 1.26 -0.27 1 60 ASP 4.97 -0.49 1 61 GLU 3.41 -0.28 1 62 LYS 1.38 -0.18 1 63 ALA 3.22 -0.81 1 64 GLU 1.60 -0.40 1 65 LYS -0.72 -0.06 1 66 ILE 2.92 -0.18 1 67 THR -0.98 0.33 1 69 VAL 7.23 -0.81 1 70 GLN 3.26 -0.67 1 71 GLU 2.43 -0.29 1 72 ALA 5.15 -0.32 1 73 ILE 5.73 -1.01 1 74 ASP 4.32 -0.49 1 75 TYR 5.05 -0.51 1 76 ILE 5.77 -0.74 1 77 VAL 5.64 -0.71 1 78 ALA 1.75 -0.27 1 79 HIS 2.38 -0.24 1 80 GLN 0.12 0.01 1 81 GLN 0.87 -0.24 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.76 _LACS_plot.Line_1_terminator_val_y_1 -1.67 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.96 _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 7.52 _LACS_plot.Line_2_terminator_val_y_2 2.05 _LACS_plot.Y_axis_chem_shift_offset -0.40 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 THR -7.76 -0.47 0 10 ARG 2.22 2.76 1 11 VAL 6.90 1.23 1 12 LYS 6.50 1.30 1 13 LYS 4.11 1.90 1 14 ILE 4.31 1.79 1 15 VAL 6.32 0.57 1 16 ALA 4.17 2.16 1 17 GLU 2.46 3.11 1 18 GLN 3.27 1.49 1 19 LEU 0.74 -0.33 1 21 VAL -4.48 -1.55 1 22 LYS 0.62 2.23 1 23 GLU 4.83 2.51 1 24 GLU 3.32 0.67 1 25 GLU -0.00 -0.55 1 26 VAL 3.36 -1.89 1 27 THR -2.70 0.60 1 28 ASN 6.99 -0.04 1 29 SER -0.25 -0.59 1 30 ALA 1.26 -1.25 1 31 SER -2.32 2.90 1 32 PHE 4.93 0.43 1 33 VAL 3.31 2.46 1 34 GLU 3.95 0.93 1 35 ASP 1.05 1.31 1 36 LEU -0.35 -0.62 1 38 ALA -0.95 -0.41 1 39 ASP -3.18 0.99 1 40 SER 0.01 1.28 1 41 LEU 3.82 1.23 1 42 ASP 2.84 3.18 1 43 THR 7.03 1.14 1 44 VAL 5.34 2.41 1 45 GLU 4.03 2.73 1 46 LEU 3.88 0.13 1 47 VAL 7.53 1.70 1 48 MET 3.94 2.47 1 49 ALA 3.26 3.65 1 50 LEU 3.44 1.17 1 52 GLU 2.32 2.36 1 53 GLU 2.55 0.67 1 54 PHE 1.88 -1.33 1 55 GLU 2.97 -1.76 1 56 THR -3.44 -2.99 1 57 GLU -2.30 -0.45 1 60 ASP 4.97 1.29 1 61 GLU 3.41 1.47 1 62 LYS 1.38 1.93 1 63 ALA 3.22 1.53 1 64 GLU 1.60 -0.10 1 65 LYS -0.72 -0.60 1 66 ILE 2.92 -2.42 1 67 THR -0.98 0.11 1 69 VAL 7.23 1.76 1 70 GLN 3.26 1.39 1 71 GLU 2.43 3.53 1 72 ALA 5.15 0.15 1 73 ILE 5.73 0.69 1 74 ASP 4.32 3.10 1 75 TYR 5.05 2.75 1 76 ILE 5.77 2.85 1 77 VAL 5.64 2.12 1 78 ALA 1.75 0.17 1 79 HIS 2.38 -0.27 1 80 GLN 0.12 -0.96 1 stop_ save_