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 bmr30197_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.14 _LACS_plot.Line_1_terminator_val_y_1 -2.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.60 _LACS_plot.Line_2_terminator_val_x_2 6.16 _LACS_plot.Line_2_terminator_val_y_2 5.17 _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 23 ILE 5.46 0.54 0 10 SER -0.38 0.82 1 11 HIS -1.32 1.68 1 13 PHE -1.10 -1.57 1 15 VAL -3.39 -1.00 1 16 GLU -1.66 -1.10 1 17 VAL -6.14 -3.43 1 18 ASP -3.08 -0.98 1 19 SER 4.28 3.79 1 20 ASP -0.43 -0.93 1 21 THR 2.77 2.78 1 22 SER -3.48 -1.29 1 24 PHE 5.20 5.08 1 25 GLN 4.00 3.45 1 26 LEU 4.19 3.40 1 27 LYS 5.39 4.76 1 28 GLU 3.55 3.57 1 29 VAL 5.16 4.31 1 30 VAL 6.17 4.74 1 31 ALA 3.62 3.21 1 32 LYS 3.28 2.46 1 33 ARG 3.09 2.62 1 34 GLN -1.89 -1.30 1 36 VAL -3.39 -2.08 1 38 ALA 3.49 3.01 1 39 ASP 2.21 1.12 1 40 GLN -0.19 -0.30 1 41 LEU -1.72 -0.87 1 42 ARG -3.99 -1.65 1 43 VAL -0.21 -0.66 1 44 ILE -3.13 -1.80 1 45 PHE -4.69 -0.65 1 46 ALA 2.45 0.21 1 48 LYS -3.53 -1.37 1 49 GLU -1.41 -0.92 1 50 LEU -1.62 -1.35 1 51 ARG -0.87 -0.52 1 52 ASN 1.47 2.17 1 53 ASP 0.59 -0.65 1 54 TRP -2.40 -2.16 1 55 THR -4.07 -2.00 1 56 VAL 5.70 4.57 1 57 GLN 3.10 2.69 1 58 ASN 1.61 1.26 1 60 ASP 2.75 1.19 1 61 LEU 2.05 1.25 1 62 ASP 0.48 0.00 1 63 GLN 0.74 0.64 1 64 GLN -0.37 0.03 1 66 ILE -2.88 -0.85 1 67 VAL -0.24 -0.05 1 68 HIS -2.48 0.90 1 69 ILE -1.31 -1.12 1 70 VAL -5.90 -3.38 1 71 GLN -2.09 -0.90 1 72 ARG -0.19 0.20 1 74 TRP -0.67 -0.30 1 75 ARG -0.51 -0.21 1 76 LYS 1.14 1.68 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30197_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.14 _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 -1.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.40 _LACS_plot.Line_2_terminator_val_x_2 6.16 _LACS_plot.Line_2_terminator_val_y_2 -0.99 _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 23 ILE 5.46 -4.92 0 10 SER -0.38 1.20 1 11 HIS -1.32 3.00 1 13 PHE -1.10 -0.47 1 15 VAL -3.39 2.39 1 16 GLU -1.66 0.56 1 17 VAL -6.14 2.71 1 18 ASP -3.08 2.10 1 19 SER 4.28 -0.49 1 20 ASP -0.43 -0.50 1 21 THR 2.77 0.01 1 22 SER -3.48 2.19 1 24 PHE 5.20 -0.12 1 25 GLN 4.00 -0.55 1 26 LEU 4.19 -0.79 1 27 LYS 5.39 -0.63 1 28 GLU 3.55 0.02 1 29 VAL 5.16 -0.85 1 30 VAL 6.17 -1.43 1 31 ALA 3.62 -0.41 1 32 LYS 3.28 -0.82 1 33 ARG 3.09 -0.47 1 34 GLN -1.89 0.59 1 36 VAL -3.39 1.31 1 38 ALA 3.49 -0.48 1 39 ASP 2.21 -1.09 1 40 GLN -0.19 -0.11 1 41 LEU -1.72 0.85 1 42 ARG -3.99 2.34 1 43 VAL -0.21 -0.45 1 44 ILE -3.13 1.33 1 45 PHE -4.69 4.04 1 46 ALA 2.45 -2.24 1 48 LYS -3.53 2.16 1 49 GLU -1.41 0.49 1 50 LEU -1.62 0.27 1 51 ARG -0.87 0.35 1 52 ASN 1.47 0.70 1 53 ASP 0.59 -1.24 1 54 TRP -2.40 0.24 1 55 THR -4.07 2.07 1 56 VAL 5.70 -1.13 1 57 GLN 3.10 -0.41 1 58 ASN 1.61 -0.35 1 60 ASP 2.75 -1.56 1 61 LEU 2.05 -0.80 1 62 ASP 0.48 -0.48 1 63 GLN 0.74 -0.10 1 64 GLN -0.37 0.40 1 66 ILE -2.88 2.03 1 67 VAL -0.24 0.19 1 68 HIS -2.48 3.38 1 69 ILE -1.31 0.19 1 70 VAL -5.90 2.52 1 71 GLN -2.09 1.19 1 72 ARG -0.19 0.39 1 74 TRP -0.67 0.37 1 75 ARG -0.51 0.30 1 76 LYS 1.14 0.54 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30197_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.14 _LACS_plot.Line_1_terminator_val_y_1 0.75 _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 0.28 _LACS_plot.Line_2_terminator_val_x_2 6.16 _LACS_plot.Line_2_terminator_val_y_2 -0.69 _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 69 ILE -1.31 1.14 0 10 SER -0.38 0.11 1 11 HIS -1.32 0.13 1 13 PHE -1.10 0.21 1 15 VAL -3.39 0.16 1 16 GLU -1.66 0.69 1 17 VAL -6.14 0.60 1 18 ASP -3.08 0.31 1 19 SER 4.28 -0.49 1 20 ASP -0.43 0.10 1 21 THR 2.77 -0.15 1 22 SER -3.48 0.72 1 23 ILE 5.46 -0.33 1 24 PHE 5.20 -0.64 1 25 GLN 4.00 -0.32 1 26 LEU 4.19 -0.35 1 27 LYS 5.39 -0.74 1 28 GLU 3.55 -0.54 1 29 VAL 5.16 -0.46 1 30 VAL 6.17 -0.71 1 31 ALA 3.62 -0.51 1 32 LYS 3.28 -0.30 1 33 ARG 3.09 -0.42 1 34 GLN -1.89 -0.28 1 36 VAL -3.39 0.39 1 38 ALA 3.49 -0.62 1 39 ASP 2.21 -0.14 1 40 GLN -0.19 0.05 1 41 LEU -1.72 0.75 1 42 ARG -3.99 0.20 1 43 VAL -0.21 0.64 1 44 ILE -3.13 0.71 1 45 PHE -4.69 0.41 1 46 ALA 2.45 -0.52 1 48 LYS -3.53 0.35 1 49 GLU -1.41 0.69 1 50 LEU -1.62 0.26 1 51 ARG -0.87 -0.42 1 52 ASN 1.47 -0.32 1 53 ASP 0.59 0.04 1 54 TRP -2.40 0.50 1 55 THR -4.07 0.79 1 56 VAL 5.70 -0.64 1 57 GLN 3.10 -0.16 1 58 ASN 1.61 -0.09 1 60 ASP 2.75 -0.18 1 61 LEU 2.05 -0.53 1 62 ASP 0.48 -0.09 1 63 GLN 0.74 0.04 1 64 GLN -0.37 0.12 1 66 ILE -2.88 0.46 1 67 VAL -0.24 0.28 1 68 HIS -2.48 0.30 1 70 VAL -5.90 0.57 1 71 GLN -2.09 0.55 1 72 ARG -0.19 -0.10 1 74 TRP -0.67 -0.02 1 75 ARG -0.51 -0.16 1 76 LYS 1.14 -0.32 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30197_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.14 _LACS_plot.Line_1_terminator_val_y_1 -2.07 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.67 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 6.16 _LACS_plot.Line_2_terminator_val_y_2 1.87 _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 55 THR -4.07 1.80 0 11 HIS -1.32 1.65 1 15 VAL -3.39 -2.67 1 16 GLU -1.66 -0.70 1 17 VAL -6.14 -2.38 1 18 ASP -3.08 1.20 1 19 SER 4.28 -1.08 1 20 ASP -0.43 -0.39 1 21 THR 2.77 -0.74 1 22 SER -3.48 0.94 1 23 ILE 5.46 2.32 1 24 PHE 5.20 1.18 1 25 GLN 4.00 3.12 1 26 LEU 4.19 0.50 1 28 GLU 3.55 2.66 1 29 VAL 5.16 2.98 1 30 VAL 6.17 0.32 1 31 ALA 3.62 2.63 1 32 LYS 3.28 2.48 1 33 ARG 3.09 1.74 1 34 GLN -1.89 0.25 1 38 ALA 3.49 1.67 1 39 ASP 2.21 0.83 1 40 GLN -0.19 -1.11 1 41 LEU -1.72 -0.93 1 42 ARG -3.99 -1.87 1 43 VAL -0.21 -2.53 1 44 ILE -3.13 -1.55 1 45 PHE -4.69 -1.13 1 46 ALA 2.45 -0.23 1 48 LYS -3.53 -2.24 1 49 GLU -1.41 0.20 1 50 LEU -1.62 -1.91 1 51 ARG -0.87 0.60 1 52 ASN 1.47 0.53 1 53 ASP 0.59 0.70 1 54 TRP -2.40 -0.62 1 56 VAL 5.70 1.94 1 57 GLN 3.10 1.84 1 58 ASN 1.61 1.16 1 60 ASP 2.75 -0.18 1 61 LEU 2.05 -0.86 1 62 ASP 0.48 0.20 1 64 GLN -0.37 -0.33 1 66 ILE -2.88 -1.83 1 67 VAL -0.24 -2.07 1 68 HIS -2.48 0.31 1 69 ILE -1.31 -1.96 1 70 VAL -5.90 -1.51 1 71 GLN -2.09 -0.24 1 74 TRP -0.67 -0.43 1 75 ARG -0.51 -1.84 1 stop_ save_