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 bmr11144_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -3.79 _LACS_plot.Line_1_terminator_val_y_1 -1.77 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.25 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 4.87 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 46 HIS 1.29 3.61 0 11 ASP -0.07 0.13 1 13 SER 0.85 0.63 1 14 TYR -1.74 -1.09 1 15 SER -0.14 -0.56 1 16 ARG 2.31 1.34 1 17 THR 0.23 -0.04 1 18 ALA 3.28 3.48 1 19 LEU 5.14 3.13 1 20 TYR 6.38 3.89 1 21 ASP 4.01 2.92 1 22 LEU 2.57 2.53 1 23 LEU -0.09 -0.02 1 25 VAL -3.76 -3.01 1 27 SER 2.63 1.56 1 28 THR -0.13 -1.58 1 29 ALA -0.74 0.07 1 30 THR -2.49 -1.22 1 31 GLN 5.05 3.42 1 32 ALA 3.68 2.84 1 33 GLN 3.52 2.96 1 34 ILE 5.74 4.96 1 35 LYS 4.59 4.27 1 36 ALA 3.62 2.60 1 37 ALA 2.44 2.57 1 38 TYR 4.45 3.42 1 39 TYR 5.90 4.07 1 40 ARG 4.45 3.62 1 41 GLN 3.52 2.52 1 43 PHE 4.05 3.39 1 44 LEU 1.88 2.09 1 45 TYR 1.49 0.90 1 48 ASP 3.16 2.21 1 49 ARG -0.29 -0.10 1 50 ASN -1.73 0.06 1 51 SER 2.22 1.24 1 53 SER -1.03 -1.11 1 54 ALA 3.36 2.40 1 55 GLU 3.48 2.88 1 56 ALA 3.72 2.66 1 57 ALA 3.78 2.64 1 58 GLU 3.54 2.74 1 59 ARG 4.75 3.36 1 60 PHE 5.29 4.59 1 61 THR 6.39 5.20 1 62 ARG 4.48 3.64 1 63 ILE 5.03 4.37 1 64 SER 5.55 4.22 1 65 GLN 4.01 2.78 1 66 ALA 2.99 2.36 1 67 TYR 2.14 2.46 1 68 VAL 5.94 4.27 1 69 VAL 3.07 2.54 1 70 LEU 1.52 1.37 1 72 SER -3.77 -4.01 1 73 ALA 4.19 3.33 1 74 THR 4.62 3.55 1 75 LEU 3.57 2.63 1 76 ARG 5.54 4.52 1 77 ARG 4.31 3.24 1 78 LYS 4.49 4.57 1 79 TYR 3.57 3.00 1 80 ASP 3.45 2.83 1 81 ARG -0.12 0.20 1 83 LEU -2.47 -1.01 1 84 LEU -0.22 0.53 1 85 SER -3.79 -1.46 1 86 ASP 3.92 3.31 1 87 GLU 3.20 2.47 1 88 ASP 1.76 2.32 1 89 LEU 0.79 0.52 1 90 ARG 0.45 0.58 1 94 SER 1.30 2.04 1 97 SER -0.12 0.06 1 98 SER -0.18 0.08 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11144_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -3.79 _LACS_plot.Line_1_terminator_val_y_1 2.02 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.88 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.75 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -1.52 _LACS_plot.Y_axis_chem_shift_offset -0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 46 HIS 1.29 2.32 0 11 ASP -0.07 0.20 1 13 SER 0.85 -0.22 1 14 TYR -1.74 0.65 1 15 SER -0.14 -0.42 1 16 ARG 2.31 -0.97 1 17 THR 0.23 -0.27 1 18 ALA 3.28 0.20 1 19 LEU 5.14 -2.01 1 20 TYR 6.38 -2.49 1 21 ASP 4.01 -1.09 1 22 LEU 2.57 -0.04 1 23 LEU -0.09 0.07 1 25 VAL -3.76 0.75 1 27 SER 2.63 -1.07 1 28 THR -0.13 -1.45 1 29 ALA -0.74 0.81 1 30 THR -2.49 1.27 1 31 GLN 5.05 -1.63 1 32 ALA 3.68 -0.84 1 33 GLN 3.52 -0.56 1 34 ILE 5.74 -0.78 1 35 LYS 4.59 -0.32 1 36 ALA 3.62 -1.02 1 37 ALA 2.44 0.13 1 38 TYR 4.45 -1.03 1 39 TYR 5.90 -1.83 1 40 ARG 4.45 -0.83 1 41 GLN 3.52 -1.00 1 43 PHE 4.05 -0.66 1 44 LEU 1.88 0.21 1 45 TYR 1.49 -0.59 1 48 ASP 3.16 -0.95 1 49 ARG -0.29 0.19 1 50 ASN -1.73 1.79 1 51 SER 2.22 -0.98 1 53 SER -1.03 -0.08 1 54 ALA 3.36 -0.96 1 55 GLU 3.48 -0.60 1 56 ALA 3.72 -1.06 1 57 ALA 3.78 -1.14 1 58 GLU 3.54 -0.80 1 59 ARG 4.75 -1.39 1 60 PHE 5.29 -0.70 1 61 THR 6.39 -1.19 1 62 ARG 4.48 -0.84 1 63 ILE 5.03 -0.66 1 64 SER 5.55 -1.33 1 65 GLN 4.01 -1.23 1 66 ALA 2.99 -0.63 1 67 TYR 2.14 0.32 1 68 VAL 5.94 -1.67 1 69 VAL 3.07 -0.53 1 70 LEU 1.52 -0.15 1 72 SER -3.77 -0.24 1 73 ALA 4.19 -0.86 1 74 THR 4.62 -1.07 1 75 LEU 3.57 -0.94 1 76 ARG 5.54 -1.02 1 77 ARG 4.31 -1.07 1 78 LYS 4.49 0.08 1 79 TYR 3.57 -0.57 1 80 ASP 3.45 -0.62 1 81 ARG -0.12 0.32 1 83 LEU -2.47 1.46 1 84 LEU -0.22 0.75 1 85 SER -3.79 2.33 1 86 ASP 3.92 -0.61 1 87 GLU 3.20 -0.73 1 88 ASP 1.76 0.56 1 89 LEU 0.79 -0.27 1 90 ARG 0.45 0.13 1 94 SER 1.30 0.74 1 97 SER -0.12 0.18 1 98 SER -0.18 0.26 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11144_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -3.79 _LACS_plot.Line_1_terminator_val_y_1 0.30 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.18 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.15 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 -0.56 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 27 SER 2.63 -2.33 0 11 ASP -0.07 -0.03 1 13 SER 0.85 -0.08 1 14 TYR -1.74 0.18 1 15 SER -0.14 0.10 1 16 ARG 2.31 -0.28 1 17 THR 0.23 0.62 1 18 ALA 3.28 -0.13 1 19 LEU 5.14 -0.45 1 20 TYR 6.38 -0.74 1 21 ASP 4.01 -0.25 1 22 LEU 2.57 -0.32 1 23 LEU -0.09 -0.09 1 25 VAL -3.76 0.51 1 28 THR -0.13 -0.21 1 29 ALA -0.74 0.05 1 30 THR -2.49 0.23 1 31 GLN 5.05 -0.22 1 32 ALA 3.68 -0.11 1 33 GLN 3.52 -0.22 1 34 ILE 5.74 -0.58 1 35 LYS 4.59 -0.34 1 36 ALA 3.62 -0.13 1 37 ALA 2.44 -0.12 1 38 TYR 4.45 -0.59 1 39 TYR 5.90 -0.71 1 40 ARG 4.45 -0.18 1 41 GLN 3.52 -0.03 1 43 PHE 4.05 -0.45 1 44 LEU 1.88 -0.56 1 45 TYR 1.49 -0.12 1 46 HIS 1.29 -1.15 1 48 ASP 3.16 -0.17 1 49 ARG -0.29 0.07 1 50 ASN -1.73 0.16 1 51 SER 2.22 -0.25 1 53 SER -1.03 0.09 1 54 ALA 3.36 -0.08 1 55 GLU 3.48 -0.24 1 56 ALA 3.72 -0.14 1 57 ALA 3.78 -0.09 1 58 GLU 3.54 -0.25 1 59 ARG 4.75 -0.51 1 60 PHE 5.29 -0.64 1 61 THR 6.39 -0.48 1 62 ARG 4.48 -0.31 1 63 ILE 5.03 -0.69 1 64 SER 5.55 -0.37 1 65 GLN 4.01 -0.41 1 66 ALA 2.99 -0.54 1 67 TYR 2.14 -0.73 1 68 VAL 5.94 -1.00 1 69 VAL 3.07 -0.60 1 70 LEU 1.52 -0.71 1 72 SER -3.77 0.19 1 73 ALA 4.19 -0.34 1 74 THR 4.62 -0.35 1 75 LEU 3.57 -0.31 1 76 ARG 5.54 -0.72 1 77 ARG 4.31 -0.14 1 78 LYS 4.49 -0.45 1 79 TYR 3.57 -0.18 1 80 ASP 3.45 -0.20 1 81 ARG -0.12 0.00 1 83 LEU -2.47 0.17 1 84 LEU -0.22 -0.08 1 85 SER -3.79 0.27 1 86 ASP 3.92 -0.34 1 87 GLU 3.20 -0.43 1 88 ASP 1.76 -0.29 1 89 LEU 0.79 -0.27 1 90 ARG 0.45 -0.09 1 98 SER -0.18 0.00 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr11144_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -3.79 _LACS_plot.Line_1_terminator_val_y_1 -1.00 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.11 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.33 _LACS_plot.Line_2_terminator_val_x_2 6.39 _LACS_plot.Line_2_terminator_val_y_2 2.67 _LACS_plot.Y_axis_chem_shift_offset -0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 25 VAL -3.76 -2.22 0 85 SER -3.79 0.41 0 45 TYR 1.49 -2.42 0 11 ASP -0.07 -0.16 1 13 SER 0.85 -0.73 1 14 TYR -1.74 -0.75 1 15 SER -0.14 2.20 1 16 ARG 2.31 -1.36 1 17 THR 0.23 2.09 1 18 ALA 3.28 2.29 1 19 LEU 5.14 0.43 1 20 TYR 6.38 3.01 1 21 ASP 4.01 3.07 1 22 LEU 2.57 0.36 1 23 LEU -0.09 -1.72 1 27 SER 2.63 0.09 1 28 THR -0.13 -0.11 1 29 ALA -0.74 0.35 1 30 THR -2.49 1.12 1 31 GLN 5.05 2.98 1 32 ALA 3.68 3.36 1 33 GLN 3.52 3.90 1 34 ILE 5.74 0.08 1 35 LYS 4.59 0.99 1 36 ALA 3.62 2.94 1 37 ALA 2.44 2.01 1 38 TYR 4.45 1.51 1 39 TYR 5.90 3.16 1 40 ARG 4.45 2.46 1 41 GLN 3.52 2.75 1 43 PHE 4.05 1.91 1 44 LEU 1.88 1.33 1 46 HIS 1.29 3.02 1 48 ASP 3.16 1.66 1 49 ARG -0.29 -0.50 1 50 ASN -1.73 -0.38 1 51 SER 2.22 1.01 1 53 SER -1.03 1.15 1 54 ALA 3.36 2.51 1 55 GLU 3.48 2.56 1 56 ALA 3.72 1.04 1 57 ALA 3.78 2.79 1 58 GLU 3.54 2.31 1 59 ARG 4.75 2.00 1 60 PHE 5.29 2.73 1 61 THR 6.39 1.75 1 62 ARG 4.48 3.25 1 63 ILE 5.03 0.84 1 64 SER 5.55 1.86 1 65 GLN 4.01 1.88 1 66 ALA 2.99 0.93 1 67 TYR 2.14 1.69 1 68 VAL 5.94 0.31 1 69 VAL 3.07 -0.35 1 70 LEU 1.52 -0.10 1 72 SER -3.77 -0.34 1 73 ALA 4.19 2.71 1 74 THR 4.62 2.48 1 75 LEU 3.57 0.81 1 76 ARG 5.54 1.66 1 77 ARG 4.31 2.34 1 78 LYS 4.49 2.14 1 79 TYR 3.57 3.84 1 80 ASP 3.45 1.95 1 81 ARG -0.12 0.07 1 83 LEU -2.47 -0.77 1 84 LEU -0.22 -1.83 1 86 ASP 3.92 2.40 1 87 GLU 3.20 1.83 1 88 ASP 1.76 0.46 1 89 LEU 0.79 -0.43 1 90 ARG 0.45 0.49 1 94 SER 1.30 1.44 1 97 SER -0.12 0.05 1 98 SER -0.18 -0.69 1 stop_ save_