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 bmr17525_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -4.59 _LACS_plot.Line_1_terminator_val_y_1 -4.60 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 2.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 5.56 _LACS_plot.Y_axis_chem_shift_offset -0.41 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 HIS -1.59 3.32 0 11 LEU 4.79 3.82 1 12 ASP 3.15 3.20 1 13 LYS 3.90 4.02 1 14 PHE 3.77 4.10 1 16 SER 5.30 4.50 1 18 ILE 4.10 3.58 1 19 ILE 4.68 4.50 1 20 PHE 2.60 0.95 1 21 SER 2.43 3.15 1 23 LYS -1.80 -2.20 1 25 ILE 4.01 4.78 1 26 GLU 5.93 3.95 1 27 THR 4.92 3.78 1 28 SER 5.83 5.03 1 29 TYR 5.65 2.97 1 30 SER -0.45 0.35 1 31 ALA -0.68 0.19 1 32 LYS 2.26 1.53 1 34 ILE 1.46 0.68 1 35 HIS 2.77 3.92 1 36 GLU 2.94 2.10 1 37 LYS 2.39 2.07 1 38 ILE 4.84 4.72 1 40 GLU 2.66 2.79 1 41 ALA 4.25 2.89 1 42 HIS 5.21 7.06 1 43 ASP 4.36 3.17 1 51 ASN 0.42 0.20 1 52 ALA -2.09 -1.91 1 63 LEU 4.85 3.86 1 64 LYS 2.73 2.75 1 65 LYS 1.27 0.85 1 66 THR 1.45 2.45 1 67 TYR -4.59 -1.44 1 71 ASP 2.88 2.56 1 72 ILE 6.24 5.09 1 73 GLU 3.94 3.00 1 74 ARG 3.27 3.57 1 75 ILE 5.90 5.42 1 76 VAL 6.95 5.85 1 77 SER 3.63 3.16 1 79 LEU 4.86 3.81 1 80 GLU 2.67 3.62 1 81 ARG -0.42 -0.50 1 83 ASP 1.62 3.17 1 84 GLU -0.41 0.16 1 85 VAL 5.18 3.99 1 87 ALA 4.13 2.44 1 88 LYS 0.37 0.56 1 89 ASP 3.45 3.45 1 90 LEU 4.61 3.20 1 92 ALA 3.48 2.44 1 93 LYS 3.76 3.36 1 94 LEU 3.28 2.91 1 95 ARG 4.42 2.11 1 96 ASP 3.16 3.49 1 97 ALA 2.17 1.74 1 98 LEU 2.57 2.55 1 99 ASP 1.32 1.65 1 100 ARG -0.08 0.17 1 101 GLN 1.14 2.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17525_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -4.59 _LACS_plot.Line_1_terminator_val_y_1 -0.01 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.40 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.09 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 -1.38 _LACS_plot.Y_axis_chem_shift_offset -0.41 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 82 HIS -1.59 4.91 0 11 LEU 4.79 -0.97 1 12 ASP 3.15 0.05 1 13 LYS 3.90 0.12 1 14 PHE 3.77 0.33 1 16 SER 5.30 -0.80 1 18 ILE 4.10 -0.52 1 19 ILE 4.68 -0.18 1 20 PHE 2.60 -1.65 1 21 SER 2.43 0.72 1 23 LYS -1.80 -0.40 1 25 ILE 4.01 0.77 1 26 GLU 5.93 -1.98 1 27 THR 4.92 -1.14 1 28 SER 5.83 -0.80 1 29 TYR 5.65 -2.68 1 30 SER -0.45 0.80 1 31 ALA -0.68 0.87 1 32 LYS 2.26 -0.73 1 34 ILE 1.46 -0.78 1 35 HIS 2.77 1.15 1 36 GLU 2.94 -0.84 1 37 LYS 2.39 -0.32 1 38 ILE 4.84 -0.12 1 40 GLU 2.66 0.13 1 41 ALA 4.25 -1.36 1 42 HIS 5.21 1.85 1 43 ASP 4.36 -1.19 1 51 ASN 0.42 -0.22 1 52 ALA -2.09 0.18 1 63 LEU 4.85 -0.99 1 64 LYS 2.73 0.02 1 65 LYS 1.27 -0.42 1 66 THR 1.45 1.00 1 67 TYR -4.59 3.15 1 71 ASP 2.88 -0.32 1 72 ILE 6.24 -1.15 1 73 GLU 3.94 -0.94 1 74 ARG 3.27 0.30 1 75 ILE 5.90 -0.48 1 76 VAL 6.95 -1.10 1 77 SER 3.63 -0.47 1 79 LEU 4.86 -1.05 1 80 GLU 2.67 0.95 1 81 ARG -0.42 -0.08 1 83 ASP 1.62 1.55 1 84 GLU -0.41 0.57 1 85 VAL 5.18 -1.19 1 87 ALA 4.13 -1.69 1 88 LYS 0.37 0.19 1 89 ASP 3.45 0.00 1 90 LEU 4.61 -1.41 1 92 ALA 3.48 -1.04 1 93 LYS 3.76 -0.40 1 94 LEU 3.28 -0.37 1 95 ARG 4.42 -2.31 1 96 ASP 3.16 0.33 1 97 ALA 2.17 -0.43 1 98 LEU 2.57 -0.02 1 99 ASP 1.32 0.33 1 100 ARG -0.08 0.25 1 101 GLN 1.14 0.89 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17525_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -4.59 _LACS_plot.Line_1_terminator_val_y_1 0.25 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.21 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _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 67 TYR -4.59 0.19 0 75 ILE 5.90 -1.49 0 11 LEU 4.79 -0.34 1 12 ASP 3.15 -0.30 1 13 LYS 3.90 -0.46 1 14 PHE 3.77 -0.50 1 16 SER 5.30 -0.51 1 18 ILE 4.10 -0.57 1 19 ILE 4.68 -0.39 1 20 PHE 2.60 -0.03 1 21 SER 2.43 -0.27 1 23 LYS -1.80 0.02 1 25 ILE 4.01 -0.34 1 26 GLU 5.93 -0.17 1 27 THR 4.92 -0.22 1 28 SER 5.83 -0.53 1 29 TYR 5.65 -0.14 1 30 SER -0.45 0.14 1 31 ALA -0.68 -0.16 1 32 LYS 2.26 0.14 1 34 ILE 1.46 -0.12 1 35 HIS 2.77 -0.67 1 36 GLU 2.94 -0.70 1 37 LYS 2.39 -0.53 1 38 ILE 4.84 -1.30 1 40 GLU 2.66 -0.32 1 41 ALA 4.25 -0.35 1 42 HIS 5.21 0.04 1 43 ASP 4.36 -0.42 1 51 ASN 0.42 -0.06 1 52 ALA -2.09 0.30 1 63 LEU 4.85 -0.70 1 64 LYS 2.73 -0.26 1 65 LYS 1.27 -0.10 1 66 THR 1.45 -0.52 1 71 ASP 2.88 -0.23 1 72 ILE 6.24 -1.05 1 73 GLU 3.94 -0.59 1 74 ARG 3.27 -0.31 1 76 VAL 6.95 -0.99 1 77 SER 3.63 0.18 1 79 LEU 4.86 -0.25 1 80 GLU 2.67 -0.48 1 81 ARG -0.42 0.05 1 82 HIS -1.59 -0.55 1 83 ASP 1.62 -0.25 1 84 GLU -0.41 0.17 1 85 VAL 5.18 -0.62 1 87 ALA 4.13 -0.67 1 88 LYS 0.37 -0.03 1 89 ASP 3.45 -0.28 1 90 LEU 4.61 -0.11 1 92 ALA 3.48 -0.04 1 93 LYS 3.76 -0.23 1 94 LEU 3.28 -0.31 1 95 ARG 4.42 -0.56 1 96 ASP 3.16 -0.30 1 97 ALA 2.17 -0.17 1 98 LEU 2.57 -0.31 1 99 ASP 1.32 -0.10 1 100 ARG -0.08 -0.02 1 101 GLN 1.14 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17525_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -4.59 _LACS_plot.Line_1_terminator_val_y_1 -1.53 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 -0.37 _LACS_plot.Line_2_terminator_val_x_2 6.94 _LACS_plot.Line_2_terminator_val_y_2 2.44 _LACS_plot.Y_axis_chem_shift_offset -0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 29 TYR 5.65 -3.18 0 67 TYR -4.59 -2.83 0 11 LEU 4.79 0.27 1 12 ASP 3.15 3.10 1 13 LYS 3.90 1.47 1 14 PHE 3.77 1.15 1 16 SER 5.30 1.14 1 18 ILE 4.10 3.89 1 20 PHE 2.60 0.80 1 21 SER 2.43 1.49 1 23 LYS -1.80 -1.81 1 25 ILE 4.01 0.20 1 26 GLU 5.93 1.75 1 27 THR 4.92 1.81 1 28 SER 5.83 1.65 1 30 SER -0.45 -0.73 1 31 ALA -0.68 0.68 1 32 LYS 2.26 2.64 1 34 ILE 1.46 -1.01 1 35 HIS 2.77 2.02 1 36 GLU 2.94 2.68 1 37 LYS 2.39 2.33 1 38 ILE 4.84 0.14 1 40 GLU 2.66 1.56 1 41 ALA 4.25 1.38 1 42 HIS 5.21 2.50 1 43 ASP 4.36 3.23 1 51 ASN 0.42 -1.14 1 63 LEU 4.85 1.21 1 64 LYS 2.73 1.75 1 65 LYS 1.27 0.22 1 66 THR 1.45 -1.50 1 71 ASP 2.88 1.58 1 72 ILE 6.24 1.32 1 73 GLU 3.94 2.01 1 74 ARG 3.27 2.88 1 75 ILE 5.90 0.42 1 76 VAL 6.95 1.29 1 77 SER 3.63 2.19 1 79 LEU 4.86 0.82 1 80 GLU 2.67 1.59 1 81 ARG -0.42 -1.58 1 83 ASP 1.62 1.89 1 84 GLU -0.41 1.37 1 85 VAL 5.18 1.38 1 87 ALA 4.13 0.42 1 88 LYS 0.37 4.43 1 89 ASP 3.45 2.24 1 90 LEU 4.61 1.20 1 92 ALA 3.48 2.88 1 93 LYS 3.76 3.85 1 94 LEU 3.28 0.56 1 95 ARG 4.42 1.92 1 96 ASP 3.16 1.38 1 97 ALA 2.17 1.79 1 98 LEU 2.57 0.75 1 99 ASP 1.32 0.40 1 100 ARG -0.08 -0.68 1 101 GLN 1.14 4.68 1 stop_ save_