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 bmr25464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 -2.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.55 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 5.15 _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 33 TRP -8.20 -1.60 0 20 PHE -6.50 -0.30 0 25 ASN -2.10 -3.40 0 10 ASP 0.50 0.30 1 11 ASN -0.90 -0.50 1 13 PHE 1.50 0.60 1 14 ASP -0.10 0.20 1 15 ASP 0.20 0.30 1 16 GLU 0.60 0.80 1 17 ASP -0.40 0.10 1 19 MET -3.90 -1.70 1 21 PHE -6.70 -2.20 1 22 VAL 0.60 0.50 1 23 LEU -7.60 -3.30 1 24 ILE -7.00 -2.20 1 26 ASP 3.50 2.30 1 27 GLU -0.50 -0.90 1 28 GLU 4.60 1.20 1 29 GLN -0.70 -0.80 1 30 HIS -4.20 -0.30 1 31 SER -3.70 -0.90 1 32 LEU -0.40 0.90 1 35 THR 3.40 1.80 1 36 PHE 1.20 -0.80 1 37 ALA -3.60 -2.30 1 38 ASP 1.50 0.80 1 39 VAL 1.70 1.30 1 41 ALA 1.60 0.80 1 43 TRP -4.20 -1.80 1 44 ARG -4.40 -2.10 1 45 VAL 2.30 1.50 1 46 VAL -2.80 -1.70 1 47 PHE -1.10 1.00 1 49 GLU -1.60 -0.30 1 50 ALA -5.20 -1.10 1 51 SER -1.10 -0.20 1 52 ARG 6.00 5.00 1 53 ALA 3.80 2.80 1 54 SER 4.30 3.60 1 56 VAL 6.10 4.80 1 57 GLU 3.10 2.70 1 58 TYR 5.90 4.30 1 59 VAL 6.70 5.20 1 60 ASP 3.40 2.90 1 61 GLN 1.60 1.00 1 62 HIS 2.30 2.30 1 63 TRP 1.20 1.30 1 64 THR 0.60 0.30 1 65 ASP 0.20 0.20 1 66 ILE 0.30 0.00 1 67 ARG 0.10 -0.10 1 69 LYS 0.20 0.10 1 70 SER 0.30 1.60 1 75 LEU 0.60 0.30 1 76 ALA 0.30 0.20 1 77 SER -0.20 -0.10 1 79 GLN -0.30 -0.10 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 5.31 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.45 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -1.55 _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 33 TRP -8.20 6.60 0 20 PHE -6.50 6.20 0 25 ASN -2.10 -1.30 0 10 ASP 0.50 -0.20 1 11 ASN -0.90 0.40 1 13 PHE 1.50 -0.90 1 14 ASP -0.10 0.30 1 15 ASP 0.20 0.10 1 16 GLU 0.60 0.20 1 17 ASP -0.40 0.50 1 19 MET -3.90 2.20 1 21 PHE -6.70 4.50 1 22 VAL 0.60 -0.10 1 23 LEU -7.60 4.30 1 24 ILE -7.00 4.80 1 26 ASP 3.50 -1.20 1 27 GLU -0.50 -0.40 1 28 GLU 4.60 -3.40 1 29 GLN -0.70 -0.10 1 30 HIS -4.20 3.90 1 31 SER -3.70 2.80 1 32 LEU -0.40 1.30 1 35 THR 3.40 -1.60 1 36 PHE 1.20 -2.00 1 37 ALA -3.60 1.30 1 38 ASP 1.50 -0.70 1 39 VAL 1.70 -0.40 1 41 ALA 1.60 -0.80 1 43 TRP -4.20 2.40 1 44 ARG -4.40 2.30 1 45 VAL 2.30 -0.80 1 46 VAL -2.80 1.10 1 47 PHE -1.10 2.10 1 49 GLU -1.60 1.30 1 50 ALA -5.20 4.10 1 51 SER -1.10 0.90 1 52 ARG 6.00 -1.00 1 53 ALA 3.80 -1.00 1 54 SER 4.30 -0.70 1 56 VAL 6.10 -1.30 1 57 GLU 3.10 -0.40 1 58 TYR 5.90 -1.60 1 59 VAL 6.70 -1.50 1 60 ASP 3.40 -0.50 1 61 GLN 1.60 -0.60 1 62 HIS 2.30 0.00 1 63 TRP 1.20 0.10 1 64 THR 0.60 -0.30 1 65 ASP 0.20 0.00 1 66 ILE 0.30 -0.30 1 67 ARG 0.10 -0.20 1 69 LYS 0.20 -0.10 1 70 SER 0.30 1.30 1 75 LEU 0.60 -0.30 1 76 ALA 0.30 -0.10 1 77 SER -0.20 0.10 1 79 GLN -0.30 0.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.20 _LACS_plot.Line_1_terminator_val_y_1 0.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.16 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 24 ILE -7.00 1.52 0 30 HIS -4.20 1.33 0 39 VAL 1.70 -1.08 0 33 TRP -8.20 0.31 0 32 LEU -0.40 1.02 0 10 ASP 0.50 -0.04 1 11 ASN -0.90 -0.10 1 13 PHE 1.50 -0.12 1 14 ASP -0.10 -0.02 1 15 ASP 0.20 -0.03 1 16 GLU 0.60 -0.12 1 17 ASP -0.40 0.21 1 19 MET -3.90 0.41 1 20 PHE -6.50 0.39 1 21 PHE -6.70 1.01 1 23 LEU -7.60 1.30 1 25 ASN -2.10 -0.04 1 26 ASP 3.50 -0.28 1 27 GLU -0.50 0.19 1 28 GLU 4.60 -0.76 1 29 GLN -0.70 -0.06 1 31 SER -3.70 0.27 1 35 THR 3.40 -0.62 1 36 PHE 1.20 -0.11 1 37 ALA -3.60 0.39 1 38 ASP 1.50 -0.16 1 41 ALA 1.60 -0.14 1 43 TRP -4.20 0.29 1 44 ARG -4.40 0.38 1 45 VAL 2.30 -0.14 1 46 VAL -2.80 0.56 1 47 PHE -1.10 -0.17 1 49 GLU -1.60 -0.12 1 50 ALA -5.20 0.32 1 51 SER -1.10 0.27 1 52 ARG 6.00 -0.93 1 53 ALA 3.80 -0.29 1 54 SER 4.30 -0.12 1 56 VAL 6.10 -0.63 1 57 GLU 3.10 -0.28 1 58 TYR 5.90 -0.66 1 59 VAL 6.70 -0.76 1 60 ASP 3.40 -0.23 1 61 GLN 1.60 -0.33 1 62 HIS 2.30 -0.35 1 64 THR 0.60 -0.17 1 66 ILE 0.30 -0.01 1 69 LYS 0.20 0.01 1 70 SER 0.30 0.11 1 75 LEU 0.60 -0.02 1 76 ALA 0.30 0.01 1 77 SER -0.20 -0.02 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 -2.11 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.55 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.66 _LACS_plot.Line_2_terminator_val_x_2 6.70 _LACS_plot.Line_2_terminator_val_y_2 1.74 _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 21 PHE -6.70 1.70 0 10 ASP 0.50 -1.00 1 13 PHE 1.50 -0.10 1 14 ASP -0.10 -0.50 1 15 ASP 0.20 0.40 1 16 GLU 0.60 0.00 1 17 ASP -0.40 0.00 1 19 MET -3.90 -0.30 1 20 PHE -6.50 -1.60 1 22 VAL 0.60 -1.30 1 23 LEU -7.60 -1.40 1 24 ILE -7.00 -2.10 1 25 ASN -2.10 2.50 1 26 ASP 3.50 0.40 1 27 GLU -0.50 -1.50 1 28 GLU 4.60 -1.40 1 29 GLN -0.70 -1.40 1 30 HIS -4.20 1.80 1 31 SER -3.70 -1.40 1 32 LEU -0.40 0.60 1 35 THR 3.40 1.40 1 36 PHE 1.20 -1.30 1 37 ALA -3.60 -0.50 1 38 ASP 1.50 0.40 1 41 ALA 1.60 1.20 1 43 TRP -4.20 -1.20 1 44 ARG -4.40 -1.40 1 45 VAL 2.30 1.30 1 46 VAL -2.80 -2.10 1 49 GLU -1.60 -1.70 1 50 ALA -5.20 -2.70 1 51 SER -1.10 0.40 1 52 ARG 6.00 1.90 1 53 ALA 3.80 3.20 1 54 SER 4.30 2.90 1 56 VAL 6.10 1.50 1 57 GLU 3.10 1.30 1 59 VAL 6.70 0.00 1 60 ASP 3.40 2.00 1 61 GLN 1.60 0.70 1 69 LYS 0.20 -0.70 1 stop_ save_