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 bmr30531_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.52 _LACS_plot.Line_1_terminator_val_y_1 -3.20 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.34 _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 5.89 _LACS_plot.Line_2_terminator_val_y_2 4.19 _LACS_plot.Y_axis_chem_shift_offset 0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 HIS -4.87 0.73 0 41 LEU -9.52 -2.81 0 48 ILE -0.59 -3.48 0 10 PHE 3.64 3.31 1 11 ILE 5.21 4.80 1 12 ASN 3.95 2.64 1 13 ASN 3.53 3.43 1 14 VAL 4.90 3.05 1 15 THR 5.90 4.44 1 16 SER 3.89 2.91 1 17 ASN -0.07 0.63 1 20 TYR -1.66 0.31 1 21 HIS 4.26 2.47 1 22 SER 3.21 1.88 1 23 TRP -0.97 -1.02 1 24 HIS -2.83 -0.69 1 25 LEU -0.11 0.69 1 26 VAL -5.00 -2.37 1 27 SER -4.02 -1.82 1 29 ASP -2.21 -0.58 1 30 LEU -4.41 -1.18 1 31 ILE -0.11 -1.56 1 32 VAL -1.83 -0.89 1 33 LYS 4.27 1.24 1 34 ASP 2.62 1.21 1 35 VAL -1.06 -0.69 1 37 TYR -4.42 -1.61 1 38 LYS -0.24 -1.98 1 39 LYS 1.05 2.09 1 40 LEU -3.35 1.30 1 43 TRP 0.30 0.06 1 44 SER 1.26 -0.93 1 46 GLN -2.88 -1.14 1 47 THR -2.22 -0.88 1 50 TYR -5.58 -2.06 1 51 ALA -2.14 -0.01 1 52 ASP 3.22 1.67 1 53 ASN 1.56 0.81 1 54 LYS -3.41 -1.54 1 55 PHE -2.95 -0.38 1 56 TYR -5.84 -1.96 1 57 VAL -4.27 -3.60 1 58 VAL -1.00 -1.55 1 59 LYS -2.93 -1.15 1 60 ASN 3.43 1.84 1 61 ASP 2.12 0.95 1 62 VAL -3.06 -0.99 1 63 ALA -2.88 -2.52 1 64 LEU -2.60 -2.04 1 66 PHE -1.29 -0.68 1 67 SER 4.16 2.90 1 68 ASP -2.97 -1.90 1 69 LEU 2.78 2.07 1 70 GLU 4.61 2.49 1 71 ALA 2.63 1.96 1 73 ARG 5.58 4.23 1 74 ALA 3.42 1.91 1 75 TYR 2.70 3.36 1 76 LEU 2.76 1.88 1 77 THR 1.91 1.29 1 78 SER 0.64 0.69 1 79 ARG 0.78 -0.01 1 80 ALA -0.78 -0.70 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30531_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.52 _LACS_plot.Line_1_terminator_val_y_1 6.32 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.66 _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 5.89 _LACS_plot.Line_2_terminator_val_y_2 -1.70 _LACS_plot.Y_axis_chem_shift_offset 0.28 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 42 HIS -4.87 5.60 0 41 LEU -9.52 6.71 0 48 ILE -0.59 -2.89 0 10 PHE 3.64 -0.33 1 11 ILE 5.21 -0.41 1 12 ASN 3.95 -1.31 1 13 ASN 3.53 -0.10 1 14 VAL 4.90 -1.85 1 15 THR 5.90 -1.46 1 16 SER 3.89 -0.98 1 17 ASN -0.07 0.70 1 20 TYR -1.66 1.97 1 21 HIS 4.26 -1.79 1 22 SER 3.21 -1.33 1 23 TRP -0.97 -0.05 1 24 HIS -2.83 2.14 1 25 LEU -0.11 0.80 1 26 VAL -5.00 2.63 1 27 SER -4.02 2.20 1 29 ASP -2.21 1.63 1 30 LEU -4.41 3.23 1 31 ILE -0.11 -1.45 1 32 VAL -1.83 0.94 1 33 LYS 4.27 -3.03 1 34 ASP 2.62 -1.41 1 35 VAL -1.06 0.37 1 37 TYR -4.42 2.81 1 38 LYS -0.24 -1.74 1 39 LYS 1.05 1.04 1 40 LEU -3.35 4.65 1 43 TRP 0.30 -0.24 1 44 SER 1.26 -2.19 1 46 GLN -2.88 1.74 1 47 THR -2.22 1.34 1 50 TYR -5.58 3.52 1 51 ALA -2.14 2.13 1 52 ASP 3.22 -1.55 1 53 ASN 1.56 -0.75 1 54 LYS -3.41 1.87 1 55 PHE -2.95 2.57 1 56 TYR -5.84 3.88 1 57 VAL -4.27 0.67 1 58 VAL -1.00 -0.55 1 59 LYS -2.93 1.78 1 60 ASN 3.43 -1.59 1 61 ASP 2.12 -1.17 1 62 VAL -3.06 2.07 1 63 ALA -2.88 0.36 1 64 LEU -2.60 0.56 1 66 PHE -1.29 0.61 1 67 SER 4.16 -1.26 1 68 ASP -2.97 1.07 1 69 LEU 2.78 -0.71 1 70 GLU 4.61 -2.12 1 71 ALA 2.63 -0.67 1 73 ARG 5.58 -1.35 1 74 ALA 3.42 -1.51 1 75 TYR 2.70 0.66 1 76 LEU 2.76 -0.88 1 77 THR 1.91 -0.62 1 78 SER 0.64 0.05 1 79 ARG 0.78 -0.79 1 80 ALA -0.78 0.08 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30531_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -9.52 _LACS_plot.Line_1_terminator_val_y_1 1.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.33 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 5.89 _LACS_plot.Line_2_terminator_val_y_2 -0.84 _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 47 THR -2.22 1.37 0 41 LEU -9.52 1.55 0 48 ILE -0.59 1.24 0 10 PHE 3.64 -0.34 1 11 ILE 5.21 -1.02 1 12 ASN 3.95 -0.41 1 13 ASN 3.53 -0.38 1 14 VAL 4.90 -0.31 1 15 THR 5.90 -0.26 1 16 SER 3.89 -0.30 1 17 ASN -0.07 -0.03 1 20 TYR -1.66 -0.14 1 21 HIS 4.26 -0.95 1 22 SER 3.21 -0.37 1 23 TRP -0.97 -0.35 1 24 HIS -2.83 0.41 1 25 LEU -0.11 0.46 1 26 VAL -5.00 0.40 1 27 SER -4.02 0.39 1 29 ASP -2.21 0.53 1 30 LEU -4.41 0.16 1 31 ILE -0.11 0.74 1 32 VAL -1.83 0.02 1 33 LYS 4.27 -0.61 1 34 ASP 2.62 -0.64 1 35 VAL -1.06 -0.34 1 37 TYR -4.42 -0.24 1 38 LYS -0.24 0.28 1 39 LYS 1.05 -0.26 1 40 LEU -3.35 0.73 1 42 HIS -4.87 1.31 1 43 TRP 0.30 -0.36 1 44 SER 1.26 -0.97 1 46 GLN -2.88 0.72 1 50 TYR -5.58 1.36 1 51 ALA -2.14 0.11 1 52 ASP 3.22 -0.48 1 53 ASN 1.56 -0.55 1 54 LYS -3.41 0.12 1 55 PHE -2.95 0.67 1 56 TYR -5.84 0.43 1 57 VAL -4.27 1.07 1 58 VAL -1.00 0.76 1 59 LYS -2.93 0.29 1 60 ASN 3.43 -0.49 1 61 ASP 2.12 -0.57 1 62 VAL -3.06 -0.02 1 63 ALA -2.88 0.26 1 64 LEU -2.60 0.16 1 66 PHE -1.29 0.02 1 67 SER 4.16 -0.54 1 68 ASP -2.97 -0.16 1 69 LEU 2.78 -0.88 1 70 GLU 4.61 -0.68 1 71 ALA 2.63 -0.27 1 73 ARG 5.58 -1.17 1 74 ALA 3.42 -0.42 1 75 TYR 2.70 -0.56 1 76 LEU 2.76 -0.50 1 77 THR 1.91 -0.26 1 78 SER 0.64 -0.16 1 79 ARG 0.78 -0.32 1 80 ALA -0.78 -0.15 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30531_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.52 _LACS_plot.Line_1_terminator_val_y_1 -3.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.23 _LACS_plot.Line_2_terminator_val_x_2 5.89 _LACS_plot.Line_2_terminator_val_y_2 1.43 _LACS_plot.Y_axis_chem_shift_offset 0.53 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 41 LEU -9.52 -1.01 0 10 PHE 3.64 0.72 1 11 ILE 5.21 2.66 1 12 ASN 3.95 2.31 1 13 ASN 3.53 2.50 1 14 VAL 4.90 1.82 1 15 THR 5.90 2.40 1 16 SER 3.89 1.11 1 17 ASN -0.07 0.58 1 20 TYR -1.66 -2.26 1 21 HIS 4.26 1.19 1 22 SER 3.21 -2.09 1 23 TRP -0.97 0.06 1 24 HIS -2.83 0.72 1 25 LEU -0.11 -1.50 1 26 VAL -5.00 -3.68 1 27 SER -4.02 -1.24 1 29 ASP -2.21 -0.29 1 30 LEU -4.41 -3.77 1 31 ILE -0.11 0.12 1 32 VAL -1.83 -0.01 1 33 LYS 4.27 -2.04 1 34 ASP 2.62 -2.02 1 35 VAL -1.06 -3.77 1 37 TYR -4.42 -1.68 1 38 LYS -0.24 0.01 1 39 LYS 1.05 -1.44 1 40 LEU -3.35 -2.93 1 42 HIS -4.87 -0.42 1 43 TRP 0.30 -1.35 1 44 SER 1.26 -0.17 1 46 GLN -2.88 -1.35 1 47 THR -2.22 -0.52 1 48 ILE -0.59 -0.86 1 50 TYR -5.58 -1.83 1 51 ALA -2.14 -1.36 1 52 ASP 3.22 -1.93 1 53 ASN 1.56 -2.18 1 54 LYS -3.41 -2.70 1 55 PHE -2.95 -1.15 1 56 TYR -5.84 -0.72 1 57 VAL -4.27 -3.26 1 58 VAL -1.00 -0.82 1 59 LYS -2.93 -1.10 1 60 ASN 3.43 -1.64 1 61 ASP 2.12 -2.74 1 62 VAL -3.06 -2.74 1 63 ALA -2.88 -2.11 1 66 PHE -1.29 2.18 1 67 SER 4.16 -1.00 1 68 ASP -2.97 -1.65 1 69 LEU 2.78 -0.22 1 70 GLU 4.61 2.21 1 71 ALA 2.63 2.23 1 73 ARG 5.58 2.32 1 74 ALA 3.42 2.20 1 75 TYR 2.70 2.18 1 76 LEU 2.76 2.13 1 77 THR 1.91 0.20 1 78 SER 0.64 -0.04 1 79 ARG 0.78 -1.25 1 stop_ save_