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 bmr11331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.28 _LACS_plot.Line_1_terminator_val_y_1 -2.19 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.82 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 4.42 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 MET -5.76 -0.43 0 11 VAL 0.27 0.09 1 13 ASP 0.34 0.39 1 14 THR 1.41 0.95 1 15 HIS 0.60 1.80 1 16 LEU 0.52 0.08 1 17 ARG 0.66 0.47 1 19 ILE 0.19 0.17 1 20 THR -2.33 -1.19 1 22 LEU 2.63 2.41 1 23 ASP -0.29 1.05 1 24 HIS -0.19 1.57 1 25 GLU 2.50 2.19 1 26 ASN 0.81 0.74 1 27 GLU -4.08 -1.68 1 28 LYS -0.63 -0.87 1 29 VAL 1.73 0.38 1 30 ASN -1.14 -0.13 1 32 TYR -5.09 -2.04 1 34 VAL 2.88 2.42 1 35 SER 5.07 3.96 1 36 ASP -0.89 0.45 1 37 ASP 2.70 1.03 1 38 GLN -5.63 -1.52 1 39 LEU 0.55 -0.08 1 40 ILE -4.51 -0.94 1 42 ALA 3.10 3.01 1 43 LEU 5.40 2.95 1 45 LYS -1.46 -0.74 1 46 LEU 0.73 2.66 1 47 VAL -3.73 -1.72 1 49 ARG 2.63 1.55 1 50 HIS -3.44 -1.80 1 51 ARG 3.02 2.93 1 52 ASP -0.07 -0.95 1 53 HIS -6.28 -1.30 1 54 GLN 0.48 -0.19 1 55 VAL -5.77 -2.90 1 56 ALA -6.00 -2.09 1 57 SER 0.08 0.27 1 58 LEU 2.18 1.32 1 59 ASN 1.46 1.29 1 60 ASP 1.68 1.54 1 61 ARG 1.98 0.92 1 62 PHE 2.11 1.49 1 63 GLU 1.71 1.63 1 64 LYS 2.01 1.31 1 65 LEU 2.00 1.56 1 66 LYS 2.78 2.10 1 67 GLN 1.96 1.57 1 68 THR 2.22 1.96 1 69 LEU 1.76 1.31 1 70 GLU 0.94 0.84 1 71 MET 1.21 0.98 1 72 ASN 0.71 0.52 1 73 LEU 1.03 0.80 1 74 THR 1.44 1.16 1 75 ASN 0.59 0.34 1 76 LEU 0.59 0.53 1 77 VAL 0.65 0.32 1 78 LYS 0.09 -0.02 1 79 SER -0.28 -0.11 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.28 _LACS_plot.Line_1_terminator_val_y_1 4.09 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.18 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 -0.97 _LACS_plot.Y_axis_chem_shift_offset -0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 31 MET -5.76 5.33 0 11 VAL 0.27 -0.18 1 13 ASP 0.34 0.05 1 14 THR 1.41 -0.46 1 15 HIS 0.60 1.20 1 16 LEU 0.52 -0.44 1 17 ARG 0.66 -0.19 1 19 ILE 0.19 -0.02 1 20 THR -2.33 1.14 1 22 LEU 2.63 -0.22 1 23 ASP -0.29 1.34 1 24 HIS -0.19 1.76 1 25 GLU 2.50 -0.31 1 26 ASN 0.81 -0.07 1 27 GLU -4.08 2.40 1 28 LYS -0.63 -0.24 1 29 VAL 1.73 -1.35 1 30 ASN -1.14 1.01 1 32 TYR -5.09 3.05 1 34 VAL 2.88 -0.46 1 35 SER 5.07 -1.11 1 36 ASP -0.89 1.34 1 37 ASP 2.70 -1.67 1 38 GLN -5.63 4.11 1 39 LEU 0.55 -0.63 1 40 ILE -4.51 3.57 1 42 ALA 3.10 -0.09 1 43 LEU 5.40 -2.45 1 45 LYS -1.46 0.72 1 46 LEU 0.73 1.93 1 47 VAL -3.73 2.01 1 49 ARG 2.63 -1.08 1 50 HIS -3.44 1.64 1 51 ARG 3.02 -0.09 1 52 ASP -0.07 -0.88 1 53 HIS -6.28 4.98 1 54 GLN 0.48 -0.67 1 55 VAL -5.77 2.87 1 56 ALA -6.00 3.91 1 57 SER 0.08 0.19 1 58 LEU 2.18 -0.86 1 59 ASN 1.46 -0.17 1 60 ASP 1.68 -0.14 1 61 ARG 1.98 -1.06 1 62 PHE 2.11 -0.62 1 63 GLU 1.71 -0.08 1 64 LYS 2.01 -0.70 1 65 LEU 2.00 -0.44 1 66 LYS 2.78 -0.68 1 67 GLN 1.96 -0.39 1 68 THR 2.22 -0.26 1 69 LEU 1.76 -0.45 1 70 GLU 0.94 -0.10 1 71 MET 1.21 -0.23 1 72 ASN 0.71 -0.19 1 73 LEU 1.03 -0.23 1 74 THR 1.44 -0.28 1 75 ASN 0.59 -0.25 1 76 LEU 0.59 -0.06 1 77 VAL 0.65 -0.33 1 78 LYS 0.09 -0.11 1 79 SER -0.28 0.17 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11331_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.28 _LACS_plot.Line_1_terminator_val_y_1 0.51 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.16 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _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 50 HIS -3.44 -1.31 0 11 VAL 0.27 -0.06 1 13 ASP 0.34 -0.04 1 14 THR 1.41 -0.18 1 15 HIS 0.60 -0.16 1 16 LEU 0.52 -0.08 1 17 ARG 0.66 -0.06 1 19 ILE 0.19 0.09 1 20 THR -2.33 0.49 1 22 LEU 2.63 -0.26 1 23 ASP -0.29 -0.11 1 24 HIS -0.19 0.01 1 25 GLU 2.50 -0.15 1 26 ASN 0.81 -0.06 1 27 GLU -4.08 0.17 1 28 LYS -0.63 0.23 1 29 VAL 1.73 -0.33 1 30 ASN -1.14 0.02 1 31 MET -5.76 0.35 1 32 TYR -5.09 0.37 1 34 VAL 2.88 -0.66 1 35 SER 5.07 -0.34 1 36 ASP -0.89 0.16 1 37 ASP 2.70 -0.47 1 38 GLN -5.63 0.32 1 39 LEU 0.55 0.54 1 40 ILE -4.51 0.72 1 42 ALA 3.10 -0.27 1 43 LEU 5.40 -0.44 1 45 LYS -1.46 -0.33 1 46 LEU 0.73 -0.10 1 47 VAL -3.73 0.51 1 49 ARG 2.63 -0.22 1 51 ARG 3.02 0.29 1 52 ASP -0.07 0.16 1 53 HIS -6.28 0.05 1 54 GLN 0.48 0.13 1 55 VAL -5.77 1.33 1 56 ALA -6.00 0.50 1 57 SER 0.08 0.15 1 58 LEU 2.18 -0.23 1 59 ASN 1.46 -0.21 1 60 ASP 1.68 -0.14 1 61 ARG 1.98 -0.33 1 62 PHE 2.11 -0.24 1 63 GLU 1.71 -0.31 1 64 LYS 2.01 -0.16 1 65 LEU 2.00 -0.18 1 66 LYS 2.78 -0.31 1 67 GLN 1.96 -0.08 1 68 THR 2.22 -0.15 1 69 LEU 1.76 -0.11 1 70 GLU 0.94 -0.19 1 71 MET 1.21 -0.10 1 72 ASN 0.71 -0.06 1 73 LEU 1.03 0.00 1 74 THR 1.44 -0.11 1 75 ASN 0.59 -0.06 1 76 LEU 0.59 -0.02 1 77 VAL 0.65 -0.06 1 78 LYS 0.09 0.06 1 79 SER -0.28 0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11331_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 -1.94 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.54 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.76 _LACS_plot.Line_2_terminator_val_x_2 5.39 _LACS_plot.Line_2_terminator_val_y_2 1.66 _LACS_plot.Y_axis_chem_shift_offset 0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 ALA 3.10 3.51 0 31 MET -5.76 -4.08 0 37 ASP 2.70 -2.24 0 11 VAL 0.27 0.05 1 13 ASP 0.34 0.68 1 14 THR 1.41 0.36 1 15 HIS 0.60 1.44 1 16 LEU 0.52 -0.42 1 17 ARG 0.66 0.35 1 19 ILE 0.19 -0.51 1 20 THR -2.33 -0.66 1 22 LEU 2.63 0.53 1 23 ASP -0.29 -0.60 1 24 HIS -0.19 -0.29 1 25 GLU 2.50 0.11 1 26 ASN 0.81 -0.31 1 27 GLU -4.08 -0.56 1 28 LYS -0.63 0.80 1 29 VAL 1.73 -0.49 1 30 ASN -1.14 -1.02 1 32 TYR -5.09 -2.64 1 34 VAL 2.88 2.16 1 35 SER 5.07 0.38 1 36 ASP -0.89 -1.66 1 38 GLN -5.63 -1.52 1 39 LEU 0.55 -1.05 1 40 ILE -4.51 -2.68 1 43 LEU 5.40 2.07 1 45 LYS -1.46 -1.53 1 46 LEU 0.73 0.77 1 47 VAL -3.73 0.18 1 49 ARG 2.63 -0.03 1 50 HIS -3.44 1.11 1 51 ARG 3.02 1.47 1 54 GLN 0.48 -1.39 1 55 VAL -5.77 -1.35 1 56 ALA -6.00 -1.54 1 57 SER 0.08 0.49 1 58 LEU 2.18 0.14 1 59 ASN 1.46 0.71 1 60 ASP 1.68 0.75 1 61 ARG 1.98 0.46 1 62 PHE 2.11 0.76 1 63 GLU 1.71 1.17 1 64 LYS 2.01 1.45 1 65 LEU 2.00 0.45 1 66 LYS 2.78 0.84 1 67 GLN 1.96 1.23 1 68 THR 2.22 0.55 1 69 LEU 1.76 0.47 1 70 GLU 0.94 0.71 1 71 MET 1.21 0.05 1 72 ASN 0.71 0.47 1 73 LEU 1.03 0.43 1 74 THR 1.44 -0.10 1 75 ASN 0.59 -0.07 1 76 LEU 0.59 -0.24 1 77 VAL 0.65 -0.13 1 78 LYS 0.09 -0.17 1 79 SER -0.28 -0.11 1 stop_ save_