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 bmr26579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -0.70 _LACS_plot.Line_1_terminator_val_y_1 -0.46 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.49 _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 2.10 _LACS_plot.Line_2_terminator_val_y_2 1.61 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 THR 2.10 1.85 0 19 ALA 0.34 1.73 0 28 GLU 0.68 2.07 0 16 HIS -0.23 1.05 1 17 TYR 0.22 0.19 1 23 ASN 0.05 0.01 1 24 ALA -0.02 0.30 1 25 SER 0.55 0.42 1 27 TRP -0.60 -0.36 1 32 ASN 0.14 0.02 1 33 ALA -0.07 0.26 1 34 SER 0.39 0.37 1 36 VAL -0.01 0.01 1 37 SER -0.19 -0.15 1 38 VAL 0.53 0.41 1 39 ALA 0.40 0.50 1 40 SER 0.96 0.67 1 41 ALA 0.86 0.79 1 42 ALA 0.78 0.65 1 43 LEU 0.68 0.57 1 44 ALA 0.63 0.57 1 45 ALA 0.67 0.63 1 46 SER 0.47 0.39 1 47 ALA 0.60 0.67 1 48 ALA 0.41 0.47 1 49 SER 0.52 0.37 1 50 ARG 0.25 0.23 1 51 VAL 0.09 0.04 1 52 ALA -0.32 0.10 1 53 THR -0.28 -0.22 1 54 SER -0.03 0.02 1 58 SER 1.00 0.77 1 60 SER 0.59 0.50 1 62 PHE 1.05 1.82 1 66 ASP -0.54 -0.46 1 67 PHE 0.61 0.40 1 68 ASN 0.43 0.22 1 69 HIS 0.50 1.08 1 71 LEU 0.54 0.30 1 72 LYS 0.19 0.07 1 73 ASP 0.37 0.31 1 74 TRP -0.70 -0.37 1 75 ASP -0.47 -0.49 1 76 TYR 1.16 0.72 1 77 ASN 0.12 0.23 1 82 LEU -0.41 -0.22 1 83 THR -0.26 -0.35 1 84 THR 0.11 -0.04 1 85 ASN 0.06 0.11 1 86 ALA -0.16 0.16 1 89 GLN 0.20 0.24 1 90 TRP -0.39 -0.38 1 91 ASP 0.19 0.17 1 92 LEU 0.38 0.30 1 93 VAL 0.41 0.29 1 95 ASP 0.26 0.36 1 96 LEU 0.64 0.35 1 98 TRP -0.42 -0.42 1 99 GLN -0.04 0.16 1 100 VAL 0.45 0.29 1 101 ILE 0.01 -0.30 1 102 LEU -0.45 -0.25 1 103 GLU -0.61 -0.06 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -0.70 _LACS_plot.Line_1_terminator_val_y_1 0.24 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.54 _LACS_plot.Line_2_terminator_val_x_2 2.10 _LACS_plot.Line_2_terminator_val_y_2 -0.49 _LACS_plot.Y_axis_chem_shift_offset -0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 THR 2.10 -0.25 0 19 ALA 0.34 1.39 0 28 GLU 0.68 1.39 0 16 HIS -0.23 1.28 1 17 TYR 0.22 -0.03 1 23 ASN 0.05 -0.04 1 24 ALA -0.02 0.32 1 25 SER 0.55 -0.13 1 27 TRP -0.60 0.24 1 32 ASN 0.14 -0.12 1 33 ALA -0.07 0.33 1 34 SER 0.39 -0.02 1 36 VAL -0.01 0.02 1 37 SER -0.19 0.04 1 38 VAL 0.53 -0.12 1 39 ALA 0.40 0.10 1 40 SER 0.96 -0.29 1 41 ALA 0.86 -0.07 1 42 ALA 0.78 -0.13 1 43 LEU 0.68 -0.11 1 44 ALA 0.63 -0.06 1 45 ALA 0.67 -0.04 1 46 SER 0.47 -0.08 1 47 ALA 0.60 0.07 1 48 ALA 0.41 0.06 1 49 SER 0.52 -0.15 1 50 ARG 0.25 -0.02 1 51 VAL 0.09 -0.05 1 52 ALA -0.32 0.42 1 53 THR -0.28 0.06 1 54 SER -0.03 0.05 1 58 SER 1.00 -0.23 1 60 SER 0.59 -0.09 1 62 PHE 1.05 0.77 1 66 ASP -0.54 0.08 1 67 PHE 0.61 -0.21 1 68 ASN 0.43 -0.21 1 69 HIS 0.50 0.58 1 71 LEU 0.54 -0.24 1 72 LYS 0.19 -0.12 1 73 ASP 0.37 -0.06 1 74 TRP -0.70 0.33 1 75 ASP -0.47 -0.02 1 76 TYR 1.16 -0.44 1 77 ASN 0.12 0.11 1 82 LEU -0.41 0.19 1 83 THR -0.26 -0.09 1 84 THR 0.11 -0.15 1 85 ASN 0.06 0.05 1 86 ALA -0.16 0.32 1 89 GLN 0.20 0.04 1 90 TRP -0.39 0.01 1 91 ASP 0.19 -0.02 1 92 LEU 0.38 -0.08 1 93 VAL 0.41 -0.12 1 95 ASP 0.26 0.10 1 96 LEU 0.64 -0.29 1 98 TRP -0.42 0.00 1 99 GLN -0.04 0.20 1 100 VAL 0.45 -0.16 1 101 ILE 0.01 -0.31 1 102 LEU -0.45 0.20 1 103 GLU -0.61 0.55 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -0.70 _LACS_plot.Line_1_terminator_val_y_1 0.01 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.11 _LACS_plot.Line_2_terminator_val_x_2 2.10 _LACS_plot.Line_2_terminator_val_y_2 -0.23 _LACS_plot.Y_axis_chem_shift_offset 0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 55 THR 2.10 -0.27 0 28 GLU 0.68 -0.48 0 16 HIS -0.23 -0.15 1 17 TYR 0.22 -0.06 1 19 ALA 0.34 -0.40 1 23 ASN 0.05 -0.11 1 24 ALA -0.02 -0.01 1 25 SER 0.55 -0.12 1 27 TRP -0.60 -0.03 1 32 ASN 0.14 -0.14 1 33 ALA -0.07 -0.05 1 34 SER 0.39 -0.05 1 36 VAL -0.01 0.03 1 37 SER -0.19 0.03 1 38 VAL 0.53 -0.04 1 39 ALA 0.40 -0.03 1 40 SER 0.96 -0.14 1 41 ALA 0.86 -0.07 1 42 ALA 0.78 -0.09 1 43 LEU 0.68 -0.09 1 44 ALA 0.63 -0.09 1 45 ALA 0.67 -0.05 1 46 SER 0.47 -0.09 1 47 ALA 0.60 -0.06 1 48 ALA 0.41 -0.05 1 49 SER 0.52 -0.08 1 50 ARG 0.25 0.02 1 51 VAL 0.09 -0.02 1 52 ALA -0.32 0.06 1 53 THR -0.28 0.02 1 54 SER -0.03 0.06 1 58 SER 1.00 -0.07 1 60 SER 0.59 -0.05 1 62 PHE 1.05 -0.30 1 66 ASP -0.54 -0.13 1 67 PHE 0.61 -0.14 1 68 ASN 0.43 -0.18 1 69 HIS 0.50 -0.16 1 71 LEU 0.54 -0.04 1 72 LYS 0.19 -0.12 1 73 ASP 0.37 -0.11 1 74 TRP -0.70 -0.07 1 75 ASP -0.47 -0.13 1 76 TYR 1.16 -0.24 1 77 ASN 0.12 -0.13 1 82 LEU -0.41 0.12 1 83 THR -0.26 0.07 1 84 THR 0.11 -0.02 1 85 ASN 0.06 -0.07 1 86 ALA -0.16 -0.03 1 89 GLN 0.20 -0.13 1 90 TRP -0.39 0.02 1 91 ASP 0.19 -0.12 1 92 LEU 0.38 -0.10 1 93 VAL 0.41 -0.03 1 95 ASP 0.26 -0.07 1 96 LEU 0.64 -0.11 1 98 TRP -0.42 -0.06 1 99 GLN -0.04 -0.19 1 100 VAL 0.45 -0.15 1 101 ILE 0.01 -0.05 1 102 LEU -0.45 0.04 1 103 GLU -0.61 -0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26579_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -0.70 _LACS_plot.Line_1_terminator_val_y_1 -0.40 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 2.10 _LACS_plot.Line_2_terminator_val_y_2 0.95 _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 THR 2.10 0.81 0 16 HIS -0.23 0.58 1 17 TYR 0.22 0.25 1 19 ALA 0.34 1.00 1 23 ASN 0.05 0.01 1 24 ALA -0.02 0.00 1 25 SER 0.55 0.40 1 27 TRP -0.60 -0.13 1 28 GLU 0.68 0.68 1 32 ASN 0.14 -0.14 1 33 ALA -0.07 -0.08 1 34 SER 0.39 0.52 1 36 VAL -0.01 -0.05 1 37 SER -0.19 0.10 1 38 VAL 0.53 0.05 1 39 ALA 0.40 0.49 1 40 SER 0.96 0.56 1 41 ALA 0.86 0.47 1 42 ALA 0.78 0.77 1 43 LEU 0.68 0.35 1 44 ALA 0.63 0.46 1 45 ALA 0.67 0.67 1 46 SER 0.47 0.41 1 47 ALA 0.60 0.26 1 48 ALA 0.41 0.36 1 49 SER 0.52 0.02 1 50 ARG 0.25 -0.05 1 51 VAL 0.09 -0.35 1 52 ALA -0.32 0.01 1 53 THR -0.28 -0.02 1 54 SER -0.03 0.12 1 58 SER 1.00 0.45 1 60 SER 0.59 0.35 1 62 PHE 1.05 0.45 1 66 ASP -0.54 -0.08 1 67 PHE 0.61 -0.10 1 68 ASN 0.43 -0.08 1 69 HIS 0.50 0.68 1 71 LEU 0.54 -0.31 1 72 LYS 0.19 -0.43 1 73 ASP 0.37 -0.49 1 74 TRP -0.70 -0.50 1 75 ASP -0.47 -0.20 1 76 TYR 1.16 0.01 1 77 ASN 0.12 0.18 1 82 LEU -0.41 -0.27 1 83 THR -0.26 -0.10 1 84 THR 0.11 -0.42 1 85 ASN 0.06 -0.33 1 86 ALA -0.16 -0.23 1 89 GLN 0.20 -0.25 1 90 TRP -0.39 -0.22 1 91 ASP 0.19 -0.39 1 92 LEU 0.38 -0.26 1 93 VAL 0.41 0.03 1 95 ASP 0.26 0.07 1 96 LEU 0.64 0.51 1 98 TRP -0.42 -0.01 1 99 GLN -0.04 -0.58 1 100 VAL 0.45 -0.49 1 101 ILE 0.01 -0.45 1 102 LEU -0.45 -0.62 1 103 GLU -0.61 -1.22 1 stop_ save_