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 bmr36058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 -2.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.39 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 5.30 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 HIS -5.48 0.20 0 12 LEU -1.52 -0.65 1 13 SER -1.49 -0.79 1 14 VAL 4.15 2.96 1 15 ASN 0.82 -0.03 1 16 THR 2.94 2.42 1 17 THR -4.63 -1.78 1 18 VAL 4.96 3.58 1 19 GLU 5.14 3.70 1 20 ASP 2.65 3.17 1 21 VAL 5.96 4.80 1 22 LYS 5.58 5.26 1 23 HIS 3.67 3.13 1 24 TYR 4.96 4.25 1 25 PHE 6.74 5.91 1 26 GLU 1.85 1.12 1 27 GLN 2.34 2.06 1 28 PHE 1.24 1.62 1 30 LYS 2.01 1.77 1 31 VAL -0.67 -0.21 1 32 ASP 0.70 1.50 1 33 ASP -3.45 -0.27 1 34 ALA -3.45 -0.67 1 35 MET -3.07 -0.85 1 36 LEU -2.43 -1.83 1 37 MET 0.40 -1.27 1 38 PHE -1.85 0.75 1 39 ASP -2.38 -1.09 1 40 LYS 2.94 2.17 1 41 THR 3.97 3.07 1 42 THR -0.74 -0.14 1 43 ASN 2.59 1.53 1 44 ARG -3.70 -1.45 1 45 HIS -0.99 1.11 1 46 ARG -0.87 0.19 1 48 PHE -6.08 -3.21 1 50 PHE -6.05 -1.43 1 51 VAL -3.05 -1.19 1 52 THR -0.64 -0.63 1 53 PHE -2.13 0.14 1 54 GLU 1.24 1.98 1 55 SER -3.07 -1.90 1 56 GLU 3.01 2.68 1 57 ASP 3.85 2.73 1 58 ILE 3.82 0.77 1 59 VAL 6.45 4.98 1 60 GLU 3.54 2.59 1 61 LYS 3.66 2.89 1 62 VAL 5.69 4.28 1 64 GLU 2.84 2.25 1 65 ILE 3.18 3.44 1 66 HIS 5.88 5.03 1 67 PHE -2.04 -0.73 1 69 GLU -2.38 -1.16 1 70 ILE -1.17 -0.19 1 71 ASN 3.43 1.41 1 72 ASN 3.16 1.82 1 73 LYS -4.33 -2.06 1 74 MET 0.82 -0.69 1 75 VAL -2.18 -2.30 1 76 GLU -4.65 -1.76 1 78 LYS -4.83 -1.32 1 79 LYS 2.86 2.50 1 80 ALA -0.78 -0.38 1 81 GLN -0.54 -0.26 1 83 LYS 0.89 0.49 1 84 GLU -0.20 0.05 1 85 VAL 0.40 0.08 1 86 MET -0.13 -0.12 1 87 SER -0.25 -0.08 1 89 THR 0.14 0.15 1 91 SER -0.30 0.07 1 92 ALA 0.30 0.32 1 93 ARG 0.65 0.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 3.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.61 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -1.43 _LACS_plot.Y_axis_chem_shift_offset -0.08 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 68 HIS -5.48 5.68 0 12 LEU -1.52 0.87 1 13 SER -1.49 0.70 1 14 VAL 4.15 -1.19 1 15 ASN 0.82 -0.85 1 16 THR 2.94 -0.52 1 17 THR -4.63 2.85 1 18 VAL 4.96 -1.38 1 19 GLU 5.14 -1.44 1 20 ASP 2.65 0.52 1 21 VAL 5.96 -1.16 1 22 LYS 5.58 -0.32 1 23 HIS 3.67 -0.54 1 24 TYR 4.96 -0.71 1 25 PHE 6.74 -0.83 1 26 GLU 1.85 -0.73 1 27 GLN 2.34 -0.28 1 28 PHE 1.24 0.38 1 30 LYS 2.01 -0.24 1 31 VAL -0.67 0.46 1 32 ASP 0.70 0.80 1 33 ASP -3.45 3.18 1 34 ALA -3.45 2.78 1 35 MET -3.07 2.22 1 36 LEU -2.43 0.60 1 37 MET 0.40 -1.67 1 38 PHE -1.85 2.60 1 39 ASP -2.38 1.29 1 40 LYS 2.94 -0.77 1 41 THR 3.97 -0.90 1 42 THR -0.74 0.60 1 43 ASN 2.59 -1.06 1 44 ARG -3.70 2.25 1 45 HIS -0.99 2.10 1 46 ARG -0.87 1.06 1 48 PHE -6.08 2.87 1 50 PHE -6.05 4.62 1 51 VAL -3.05 1.86 1 52 THR -0.64 0.01 1 53 PHE -2.13 2.27 1 54 GLU 1.24 0.74 1 55 SER -3.07 1.17 1 56 GLU 3.01 -0.33 1 57 ASP 3.85 -1.12 1 58 ILE 3.82 -3.05 1 59 VAL 6.45 -1.47 1 60 GLU 3.54 -0.95 1 61 LYS 3.66 -0.77 1 62 VAL 5.69 -1.41 1 64 GLU 2.84 -0.59 1 65 ILE 3.18 0.26 1 66 HIS 5.88 -0.85 1 67 PHE -2.04 1.31 1 69 GLU -2.38 1.22 1 70 ILE -1.17 0.98 1 71 ASN 3.43 -2.02 1 72 ASN 3.16 -1.34 1 73 LYS -4.33 2.27 1 74 MET 0.82 -1.51 1 75 VAL -2.18 -0.12 1 76 GLU -4.65 2.89 1 78 LYS -4.83 3.51 1 79 LYS 2.86 -0.36 1 80 ALA -0.78 0.40 1 81 GLN -0.54 0.28 1 83 LYS 0.89 -0.40 1 84 GLU -0.20 0.25 1 85 VAL 0.40 -0.32 1 86 MET -0.13 0.01 1 87 SER -0.25 0.17 1 89 THR 0.14 0.01 1 91 SER -0.30 0.37 1 92 ALA 0.30 0.02 1 93 ARG 0.65 -0.17 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 0.54 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.13 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 -0.68 _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 50 PHE -6.05 1.22 0 68 HIS -5.48 -0.20 0 69 GLU -2.38 -0.64 0 26 GLU 1.85 0.72 0 12 LEU -1.52 -0.22 1 13 SER -1.49 -0.34 1 14 VAL 4.15 -0.59 1 15 ASN 0.82 0.02 1 16 THR 2.94 -0.18 1 17 THR -4.63 0.40 1 18 VAL 4.96 -0.63 1 19 GLU 5.14 -0.53 1 20 ASP 2.65 -0.30 1 21 VAL 5.96 -0.62 1 22 LYS 5.58 -0.62 1 23 HIS 3.67 -0.22 1 24 TYR 4.96 -0.48 1 25 PHE 6.74 -0.21 1 27 GLN 2.34 -0.34 1 28 PHE 1.24 -0.25 1 30 LYS 2.01 -0.12 1 31 VAL -0.67 -0.18 1 32 ASP 0.70 -0.03 1 33 ASP -3.45 0.03 1 34 ALA -3.45 0.54 1 35 MET -3.07 0.19 1 36 LEU -2.43 0.26 1 37 MET 0.40 0.22 1 38 PHE -1.85 0.02 1 39 ASP -2.38 0.15 1 40 LYS 2.94 -0.15 1 41 THR 3.97 -0.16 1 42 THR -0.74 -0.03 1 43 ASN 2.59 -0.32 1 44 ARG -3.70 0.34 1 45 HIS -0.99 -0.11 1 46 ARG -0.87 -0.01 1 48 PHE -6.08 0.83 1 51 VAL -3.05 0.21 1 52 THR -0.64 0.55 1 53 PHE -2.13 0.35 1 54 GLU 1.24 -0.15 1 55 SER -3.07 0.33 1 56 GLU 3.01 -0.35 1 57 ASP 3.85 -0.30 1 58 ILE 3.82 -0.57 1 59 VAL 6.45 -1.20 1 60 GLU 3.54 -0.51 1 61 LYS 3.66 -0.23 1 62 VAL 5.69 -0.68 1 64 GLU 2.84 -0.30 1 65 ILE 3.18 -0.46 1 66 HIS 5.88 -0.58 1 67 PHE -2.04 0.86 1 70 ILE -1.17 -0.26 1 71 ASN 3.43 -0.52 1 72 ASN 3.16 -0.57 1 73 LYS -4.33 0.26 1 74 MET 0.82 0.37 1 75 VAL -2.18 0.75 1 76 GLU -4.65 0.52 1 78 LYS -4.83 0.38 1 79 LYS 2.86 -0.28 1 80 ALA -0.78 0.11 1 81 GLN -0.54 -0.17 1 83 LYS 0.89 -0.17 1 84 GLU -0.20 -0.13 1 85 VAL 0.40 -0.11 1 86 MET -0.13 -0.02 1 87 SER -0.25 -0.04 1 89 THR 0.14 -0.03 1 91 SER -0.30 -0.05 1 92 ALA 0.30 0.00 1 93 ARG 0.65 -0.07 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr36058_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.08 _LACS_plot.Line_1_terminator_val_y_1 -2.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.49 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.79 _LACS_plot.Line_2_terminator_val_x_2 6.73 _LACS_plot.Line_2_terminator_val_y_2 1.96 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 72 ASN 3.16 -2.20 0 17 THR -4.63 1.36 0 12 LEU -1.52 0.51 1 13 SER -1.49 1.96 1 14 VAL 4.15 -0.34 1 15 ASN 0.82 0.04 1 16 THR 2.94 -1.22 1 18 VAL 4.96 0.42 1 19 GLU 5.14 1.91 1 20 ASP 2.65 3.33 1 21 VAL 5.96 0.65 1 22 LYS 5.58 0.68 1 23 HIS 3.67 3.12 1 24 TYR 4.96 2.23 1 25 PHE 6.74 1.72 1 26 GLU 1.85 1.32 1 27 GLN 2.34 0.79 1 28 PHE 1.24 -0.41 1 30 LYS 2.01 0.22 1 31 VAL -0.67 -0.86 1 32 ASP 0.70 -0.29 1 33 ASP -3.45 -3.16 1 34 ALA -3.45 -3.65 1 35 MET -3.07 -2.71 1 36 LEU -2.43 -1.95 1 37 MET 0.40 -1.03 1 38 PHE -1.85 -0.70 1 39 ASP -2.38 0.08 1 40 LYS 2.94 1.02 1 41 THR 3.97 1.32 1 42 THR -0.74 0.71 1 43 ASN 2.59 -1.29 1 44 ARG -3.70 -0.50 1 45 HIS -0.99 2.27 1 46 ARG -0.87 0.98 1 48 PHE -6.08 -3.09 1 50 PHE -6.05 -0.43 1 51 VAL -3.05 -2.84 1 52 THR -0.64 -0.87 1 53 PHE -2.13 -0.65 1 54 GLU 1.24 -0.17 1 55 SER -3.07 0.71 1 56 GLU 3.01 1.01 1 57 ASP 3.85 2.22 1 58 ILE 3.82 0.88 1 59 VAL 6.45 1.51 1 60 GLU 3.54 2.31 1 61 LYS 3.66 2.68 1 62 VAL 5.69 3.84 1 64 GLU 2.84 0.47 1 65 ILE 3.18 2.19 1 67 PHE -2.04 -1.34 1 68 HIS -5.48 -1.18 1 69 GLU -2.38 -2.24 1 70 ILE -1.17 -0.10 1 71 ASN 3.43 -0.69 1 73 LYS -4.33 -2.52 1 74 MET 0.82 -0.40 1 75 VAL -2.18 -1.97 1 76 GLU -4.65 -0.92 1 78 LYS -4.83 -1.88 1 79 LYS 2.86 0.06 1 80 ALA -0.78 -1.56 1 81 GLN -0.54 -0.25 1 83 LYS 0.89 0.07 1 84 GLU -0.20 -0.34 1 85 VAL 0.40 -0.39 1 86 MET -0.13 -0.49 1 89 THR 0.14 1.60 1 91 SER -0.30 -0.24 1 92 ALA 0.30 -0.10 1 93 ARG 0.65 0.55 1 stop_ save_