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 bmr16966_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -2.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 5.28 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 22 HIS -0.69 3.29 0 10 ARG 1.95 1.38 1 11 GLU -0.79 -0.74 1 12 MET -0.86 1.05 1 13 THR -2.18 -0.92 1 14 SER 2.00 1.43 1 15 GLN 4.70 3.17 1 16 GLU 2.44 2.40 1 17 LEU 3.22 2.65 1 18 LEU 4.92 3.87 1 19 GLU 3.60 3.24 1 20 PHE 2.51 3.13 1 23 SER 5.01 3.81 1 24 HIS 5.07 6.37 1 25 VAL 5.85 4.69 1 26 ALA 4.27 3.32 1 27 ALA 3.12 2.43 1 28 ILE 2.10 1.10 1 29 LEU -1.11 -0.73 1 31 HIS -2.69 0.55 1 32 SER 1.23 1.05 1 33 SER -2.52 -1.45 1 35 ASP 2.83 1.77 1 36 ALA 0.68 0.80 1 37 VAL -4.46 -2.11 1 39 GLN 4.75 3.38 1 40 ASP -2.58 -1.39 1 41 GLN -1.52 -0.32 1 44 THR 4.18 2.44 1 45 GLU 0.04 0.60 1 46 LEU -1.11 -0.06 1 48 PHE 2.13 2.86 1 49 ASP -3.06 -1.73 1 50 SER 4.99 4.17 1 51 LEU 3.72 2.81 1 52 THR 4.26 3.40 1 53 ALA 3.63 3.51 1 54 VAL 5.00 3.99 1 56 LEU 3.81 2.57 1 57 ARG 7.10 4.61 1 58 ASN 5.10 3.05 1 59 GLN 3.65 3.14 1 60 LEU 3.62 2.62 1 61 GLN 4.50 4.37 1 62 GLN 4.04 3.05 1 63 ALA 0.39 1.61 1 64 THR -1.70 0.50 1 66 LEU -2.82 -1.37 1 67 ALA -0.27 -1.20 1 68 LEU -4.34 -1.73 1 70 ALA 2.60 2.82 1 71 THR 0.94 -0.61 1 72 LEU 3.99 4.44 1 73 VAL 4.16 2.50 1 74 PHE 1.28 0.42 1 75 GLU 0.23 1.10 1 76 HIS -2.72 -0.56 1 78 THR -6.00 -2.39 1 79 VAL 7.08 5.53 1 80 ARG 4.09 3.90 1 81 ARG 3.52 2.84 1 82 LEU 4.25 3.25 1 83 ALA 3.85 3.14 1 84 ASP 3.06 2.89 1 85 HIS 4.85 5.11 1 86 ILE 5.55 3.92 1 88 GLN 2.00 1.40 1 89 GLN -1.60 -0.86 1 90 LEU 0.48 1.54 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16966_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 3.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.11 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -1.82 _LACS_plot.Y_axis_chem_shift_offset -0.46 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 22 HIS -0.69 3.98 0 10 ARG 1.95 -0.57 1 11 GLU -0.79 0.05 1 12 MET -0.86 1.91 1 13 THR -2.18 1.26 1 14 SER 2.00 -0.57 1 15 GLN 4.70 -1.53 1 16 GLU 2.44 -0.04 1 17 LEU 3.22 -0.57 1 18 LEU 4.92 -1.05 1 19 GLU 3.60 -0.36 1 20 PHE 2.51 0.62 1 23 SER 5.01 -1.20 1 24 HIS 5.07 1.30 1 25 VAL 5.85 -1.16 1 26 ALA 4.27 -0.95 1 27 ALA 3.12 -0.69 1 28 ILE 2.10 -1.00 1 29 LEU -1.11 0.38 1 31 HIS -2.69 3.24 1 32 SER 1.23 -0.18 1 33 SER -2.52 1.07 1 35 ASP 2.83 -1.06 1 36 ALA 0.68 0.12 1 37 VAL -4.46 2.35 1 39 GLN 4.75 -1.37 1 40 ASP -2.58 1.19 1 41 GLN -1.52 1.20 1 44 THR 4.18 -1.74 1 45 GLU 0.04 0.56 1 46 LEU -1.11 1.05 1 48 PHE 2.13 0.73 1 49 ASP -3.06 1.33 1 50 SER 4.99 -0.82 1 51 LEU 3.72 -0.91 1 52 THR 4.26 -0.86 1 53 ALA 3.63 -0.12 1 54 VAL 5.00 -1.01 1 56 LEU 3.81 -1.24 1 57 ARG 7.10 -2.49 1 58 ASN 5.10 -2.05 1 59 GLN 3.65 -0.51 1 60 LEU 3.62 -1.00 1 61 GLN 4.50 -0.13 1 62 GLN 4.04 -0.99 1 63 ALA 0.39 1.22 1 64 THR -1.70 2.20 1 66 LEU -2.82 1.45 1 67 ALA -0.27 -0.93 1 68 LEU -4.34 2.61 1 70 ALA 2.60 0.22 1 71 THR 0.94 -1.55 1 72 LEU 3.99 0.45 1 73 VAL 4.16 -1.66 1 74 PHE 1.28 -0.86 1 75 GLU 0.23 0.87 1 76 HIS -2.72 2.16 1 78 THR -6.00 3.61 1 79 VAL 7.08 -1.55 1 80 ARG 4.09 -0.19 1 81 ARG 3.52 -0.68 1 82 LEU 4.25 -1.00 1 83 ALA 3.85 -0.71 1 84 ASP 3.06 -0.17 1 85 HIS 4.85 0.26 1 86 ILE 5.55 -1.63 1 88 GLN 2.00 -0.60 1 89 GLN -1.60 0.74 1 90 LEU 0.48 1.06 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16966_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 0.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.06 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -0.54 _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 22 HIS -0.69 -0.62 0 71 THR 0.94 0.47 0 78 THR -6.00 -0.08 0 10 ARG 1.95 -0.16 1 11 GLU -0.79 0.02 1 12 MET -0.86 0.05 1 13 THR -2.18 0.12 1 14 SER 2.00 -0.53 1 15 GLN 4.70 -0.27 1 16 GLU 2.44 -0.26 1 17 LEU 3.22 0.03 1 18 LEU 4.92 -0.31 1 19 GLU 3.60 -0.18 1 20 PHE 2.51 -0.18 1 23 SER 5.01 -0.54 1 24 HIS 5.07 -0.63 1 25 VAL 5.85 -0.49 1 26 ALA 4.27 -0.37 1 27 ALA 3.12 -0.17 1 28 ILE 2.10 -0.08 1 29 LEU -1.11 -0.22 1 31 HIS -2.69 0.07 1 32 SER 1.23 -0.15 1 33 SER -2.52 0.17 1 35 ASP 2.83 -0.34 1 36 ALA 0.68 -0.26 1 37 VAL -4.46 0.24 1 39 GLN 4.75 -0.75 1 40 ASP -2.58 0.38 1 41 GLN -1.52 -0.07 1 44 THR 4.18 0.12 1 45 GLU 0.04 0.15 1 46 LEU -1.11 0.14 1 48 PHE 2.13 -0.50 1 49 ASP -3.06 0.26 1 50 SER 4.99 -0.34 1 51 LEU 3.72 -0.03 1 52 THR 4.26 -0.29 1 53 ALA 3.63 -0.35 1 54 VAL 5.00 -0.34 1 56 LEU 3.81 -0.20 1 57 ARG 7.10 -0.67 1 58 ASN 5.10 -0.28 1 59 GLN 3.65 -0.16 1 60 LEU 3.62 -0.33 1 61 GLN 4.50 -0.17 1 62 GLN 4.04 -0.26 1 63 ALA 0.39 0.06 1 64 THR -1.70 0.02 1 66 LEU -2.82 0.02 1 67 ALA -0.27 0.16 1 68 LEU -4.34 0.33 1 70 ALA 2.60 -0.45 1 72 LEU 3.99 -0.40 1 73 VAL 4.16 -0.50 1 74 PHE 1.28 -0.09 1 75 GLU 0.23 -0.48 1 76 HIS -2.72 -0.28 1 79 VAL 7.08 -0.60 1 80 ARG 4.09 -0.58 1 81 ARG 3.52 -0.24 1 82 LEU 4.25 -0.27 1 83 ALA 3.85 -0.28 1 84 ASP 3.06 -0.26 1 85 HIS 4.85 -0.65 1 86 ILE 5.55 -0.89 1 88 GLN 2.00 -0.15 1 89 GLN -1.60 -0.03 1 90 LEU 0.48 -0.22 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16966_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -0.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.62 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 2.94 _LACS_plot.Y_axis_chem_shift_offset -1.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 78 THR -6.00 -0.10 0 10 ARG 1.95 3.10 1 11 GLU -0.79 0.52 1 12 MET -0.86 1.74 1 14 SER 2.00 2.59 1 15 GLN 4.70 3.00 1 16 GLU 2.44 3.95 1 17 LEU 3.22 3.36 1 18 LEU 4.92 1.13 1 19 GLU 3.60 3.50 1 20 PHE 2.51 2.94 1 22 HIS -0.69 4.41 1 23 SER 5.01 3.30 1 24 HIS 5.07 2.26 1 25 VAL 5.85 0.55 1 26 ALA 4.27 1.68 1 27 ALA 3.12 0.73 1 28 ILE 2.10 0.87 1 29 LEU -1.11 -0.25 1 32 SER 1.23 -0.24 1 35 ASP 2.83 0.60 1 36 ALA 0.68 -0.27 1 37 VAL -4.46 0.20 1 39 GLN 4.75 -1.17 1 40 ASP -2.58 -1.12 1 44 THR 4.18 2.90 1 45 GLU 0.04 1.76 1 46 LEU -1.11 0.22 1 48 PHE 2.13 0.49 1 49 ASP -3.06 2.04 1 50 SER 4.99 2.48 1 51 LEU 3.72 4.11 1 52 THR 4.26 3.29 1 53 ALA 3.63 3.86 1 54 VAL 5.00 2.14 1 56 LEU 3.81 1.16 1 57 ARG 7.10 3.24 1 58 ASN 5.10 1.27 1 59 GLN 3.65 4.42 1 60 LEU 3.62 3.72 1 61 GLN 4.50 3.30 1 62 GLN 4.04 2.69 1 63 ALA 0.39 1.29 1 64 THR -1.70 1.49 1 66 LEU -2.82 -1.02 1 67 ALA -0.27 -0.17 1 70 ALA 2.60 1.77 1 71 THR 0.94 0.42 1 72 LEU 3.99 0.11 1 73 VAL 4.16 -0.68 1 74 PHE 1.28 2.30 1 75 GLU 0.23 -0.11 1 79 VAL 7.08 1.03 1 80 ARG 4.09 3.23 1 81 ARG 3.52 4.06 1 82 LEU 4.25 0.84 1 83 ALA 3.85 2.71 1 84 ASP 3.06 0.46 1 85 HIS 4.85 4.92 1 86 ILE 5.55 2.58 1 88 GLN 2.00 1.49 1 89 GLN -1.60 0.02 1 stop_ save_