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 bmr11214_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.92 _LACS_plot.Line_1_terminator_val_y_1 -6.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.99 _LACS_plot.Line_2_terminator_val_x_2 5.26 _LACS_plot.Line_2_terminator_val_y_2 -0.05 _LACS_plot.Y_axis_chem_shift_offset 2.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 HIS -0.16 1.08 0 10 PHE -4.83 -3.43 1 11 VAL -5.27 -5.84 1 12 ALA -2.55 -2.85 1 13 LEU -0.18 -2.09 1 14 PHE -7.75 -6.32 1 15 ASP -0.33 -2.22 1 16 TYR -2.95 -2.08 1 17 GLN -2.78 -5.26 1 18 ALA -0.63 -2.07 1 19 ARG -0.29 -1.70 1 20 THR -4.95 -5.05 1 21 ALA 1.72 -1.23 1 22 GLU -0.59 -2.38 1 23 ASP -2.77 -3.27 1 24 LEU -4.98 -4.12 1 25 SER -0.67 -2.39 1 26 PHE -1.70 -3.60 1 27 ARG -4.79 -5.39 1 28 ALA 2.66 -1.22 1 30 ASP 1.18 -1.10 1 31 LYS -1.10 -3.50 1 32 LEU -5.67 -4.27 1 33 GLN -3.23 -4.49 1 34 VAL 1.65 -1.69 1 35 LEU -0.96 -2.49 1 36 ASP -2.34 -2.01 1 37 THR 0.22 -4.14 1 38 SER 3.78 0.91 1 39 HIS -0.57 -2.39 1 40 GLU 2.09 -0.87 1 42 TRP -3.61 -4.12 1 43 TRP -7.10 -7.28 1 44 LEU -1.46 -2.91 1 45 ALA -7.92 -4.47 1 46 ARG -6.14 -4.62 1 48 LEU 0.23 -1.88 1 49 GLU -1.84 -3.22 1 50 LYS 0.09 -2.57 1 51 LYS -0.41 -2.83 1 53 THR -0.17 -2.66 1 55 LEU 0.65 -2.16 1 57 GLN -0.49 -2.69 1 58 GLN 0.33 -2.35 1 59 LEU -0.19 -1.97 1 60 GLN -5.32 -4.55 1 62 TYR 0.34 -0.76 1 63 ILE -3.38 -4.52 1 65 SER 5.26 -0.37 1 66 ASN 2.68 -2.55 1 67 TYR 0.44 -2.13 1 68 VAL -7.37 -6.39 1 69 ALA -6.16 -4.60 1 70 GLU 1.64 -1.13 1 71 ASP -2.87 -3.61 1 72 SER -0.13 -2.53 1 75 SER 0.00 -2.60 1 76 SER -0.09 -2.55 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11214_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.92 _LACS_plot.Line_1_terminator_val_y_1 1.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -3.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.99 _LACS_plot.Line_2_terminator_val_x_2 5.26 _LACS_plot.Line_2_terminator_val_y_2 -5.31 _LACS_plot.Y_axis_chem_shift_offset 2.22 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 47 HIS -0.16 1.24 0 10 PHE -4.83 1.40 1 11 VAL -5.27 -0.57 1 12 ALA -2.55 -0.30 1 13 LEU -0.18 -1.91 1 14 PHE -7.75 1.43 1 15 ASP -0.33 -1.89 1 16 TYR -2.95 0.87 1 17 GLN -2.78 -2.48 1 18 ALA -0.63 -1.44 1 19 ARG -0.29 -1.41 1 20 THR -4.95 -0.10 1 21 ALA 1.72 -2.95 1 22 GLU -0.59 -1.79 1 23 ASP -2.77 -0.50 1 24 LEU -4.98 0.86 1 25 SER -0.67 -1.72 1 26 PHE -1.70 -1.90 1 27 ARG -4.79 -0.60 1 28 ALA 2.66 -3.88 1 30 ASP 1.18 -2.28 1 31 LYS -1.10 -2.40 1 32 LEU -5.67 1.40 1 33 GLN -3.23 -1.26 1 34 VAL 1.65 -3.34 1 35 LEU -0.96 -1.53 1 36 ASP -2.34 0.33 1 37 THR 0.22 -4.36 1 38 SER 3.78 -2.87 1 39 HIS -0.57 -1.82 1 40 GLU 2.09 -2.96 1 42 TRP -3.61 -0.51 1 43 TRP -7.10 -0.18 1 44 LEU -1.46 -1.45 1 45 ALA -7.92 3.45 1 46 ARG -6.14 1.52 1 48 LEU 0.23 -2.11 1 49 GLU -1.84 -1.38 1 50 LYS 0.09 -2.66 1 51 LYS -0.41 -2.42 1 53 THR -0.17 -2.49 1 55 LEU 0.65 -2.81 1 57 GLN -0.49 -2.20 1 58 GLN 0.33 -2.68 1 59 LEU -0.19 -1.78 1 60 GLN -5.32 0.77 1 62 TYR 0.34 -1.10 1 63 ILE -3.38 -1.14 1 65 SER 5.26 -5.63 1 66 ASN 2.68 -5.23 1 67 TYR 0.44 -2.57 1 68 VAL -7.37 0.98 1 69 ALA -6.16 1.56 1 70 GLU 1.64 -2.77 1 71 ASP -2.87 -0.74 1 72 SER -0.13 -2.40 1 75 SER 0.00 -2.60 1 76 SER -0.09 -2.46 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11214_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.92 _LACS_plot.Line_1_terminator_val_y_1 0.84 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.30 _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 5.26 _LACS_plot.Line_2_terminator_val_y_2 -0.66 _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 65 SER 5.26 -2.03 0 10 PHE -4.83 0.27 1 11 VAL -5.27 0.91 1 12 ALA -2.55 0.15 1 13 LEU -0.18 -0.44 1 14 PHE -7.75 0.25 1 15 ASP -0.33 -0.02 1 16 TYR -2.95 -0.13 1 17 GLN -2.78 -0.14 1 18 ALA -0.63 -0.55 1 19 ARG -0.29 -0.15 1 20 THR -4.95 0.26 1 21 ALA 1.72 -0.05 1 22 GLU -0.59 0.04 1 23 ASP -2.77 0.70 1 24 LEU -4.98 0.21 1 25 SER -0.67 0.40 1 26 PHE -1.70 0.40 1 27 ARG -4.79 0.63 1 28 ALA 2.66 -0.89 1 30 ASP 1.18 -0.06 1 31 LYS -1.10 0.59 1 32 LEU -5.67 0.56 1 33 GLN -3.23 0.61 1 34 VAL 1.65 -0.17 1 35 LEU -0.96 -0.13 1 36 ASP -2.34 0.10 1 37 THR 0.22 -0.30 1 38 SER 3.78 -0.48 1 39 HIS -0.57 0.01 1 40 GLU 2.09 -0.16 1 42 TRP -3.61 0.55 1 43 TRP -7.10 0.69 1 44 LEU -1.46 -0.32 1 45 ALA -7.92 0.92 1 46 ARG -6.14 0.87 1 47 HIS -0.16 -0.29 1 48 LEU 0.23 -0.03 1 49 GLU -1.84 -0.01 1 50 LYS 0.09 -0.10 1 51 LYS -0.41 -0.03 1 53 THR -0.17 -0.07 1 55 LEU 0.65 -0.10 1 57 GLN -0.49 -0.07 1 58 GLN 0.33 0.01 1 59 LEU -0.19 0.10 1 60 GLN -5.32 1.10 1 62 TYR 0.34 0.63 1 63 ILE -3.38 0.46 1 66 ASN 2.68 -0.20 1 67 TYR 0.44 0.17 1 68 VAL -7.37 1.16 1 69 ALA -6.16 0.52 1 70 GLU 1.64 -1.22 1 71 ASP -2.87 -0.05 1 72 SER -0.13 -0.15 1 75 SER 0.00 -0.10 1 76 SER -0.09 -0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11214_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.92 _LACS_plot.Line_1_terminator_val_y_1 -4.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -3.45 _LACS_plot.Line_2_terminator_val_x_2 5.26 _LACS_plot.Line_2_terminator_val_y_2 -1.71 _LACS_plot.Y_axis_chem_shift_offset 2.97 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 SER 5.26 -3.18 0 47 HIS -0.16 -0.11 0 45 ALA -7.92 -6.82 0 10 PHE -4.83 -4.50 1 11 VAL -5.27 -4.30 1 12 ALA -2.55 -0.93 1 13 LEU -0.18 -4.57 1 14 PHE -7.75 -5.14 1 15 ASP -0.33 -3.15 1 16 TYR -2.95 -5.20 1 17 GLN -2.78 -5.46 1 18 ALA -0.63 -1.95 1 19 ARG -0.29 -2.11 1 20 THR -4.95 -2.60 1 21 ALA 1.72 -2.41 1 22 GLU -0.59 -2.39 1 23 ASP -2.77 -4.17 1 24 LEU -4.98 -4.91 1 25 SER -0.67 -2.63 1 26 PHE -1.70 -5.25 1 27 ARG -4.79 -3.14 1 28 ALA 2.66 -1.97 1 30 ASP 1.18 -3.57 1 31 LYS -1.10 -3.25 1 32 LEU -5.67 -5.13 1 33 GLN -3.23 -3.14 1 34 VAL 1.65 -3.65 1 35 LEU -0.96 -3.28 1 36 ASP -2.34 -2.73 1 37 THR 0.22 -2.83 1 38 SER 3.78 -2.26 1 39 HIS -0.57 -1.91 1 40 GLU 2.09 -0.99 1 42 TRP -3.61 -4.38 1 43 TRP -7.10 -3.24 1 44 LEU -1.46 -4.77 1 46 ARG -6.14 -3.25 1 48 LEU 0.23 -2.70 1 49 GLU -1.84 -3.38 1 50 LYS 0.09 -2.95 1 51 LYS -0.41 -2.20 1 53 THR -0.17 -1.94 1 55 LEU 0.65 -1.99 1 57 GLN -0.49 -2.89 1 58 GLN 0.33 -2.88 1 59 LEU -0.19 -4.67 1 60 GLN -5.32 -3.86 1 62 TYR 0.34 -2.25 1 63 ILE -3.38 -5.49 1 66 ASN 2.68 -2.35 1 67 TYR 0.44 -3.63 1 68 VAL -7.37 -5.10 1 69 ALA -6.16 -4.23 1 70 GLU 1.64 -3.51 1 71 ASP -2.87 -3.57 1 72 SER -0.13 -2.35 1 75 SER 0.00 -2.53 1 76 SER -0.09 -3.29 1 stop_ save_