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 bmr25955_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -2.95 _LACS_plot.Line_1_terminator_val_y_1 -1.53 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.31 _LACS_plot.Line_2_terminator_val_x_2 6.86 _LACS_plot.Line_2_terminator_val_y_2 5.26 _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 53 LEU 1.11 -0.79 0 20 HIS 2.16 3.84 0 11 GLU -0.45 -0.03 1 12 THR -0.57 0.03 1 13 ASP -0.68 0.25 1 15 SER 4.16 3.04 1 16 GLU -1.24 -0.57 1 17 ILE 2.19 1.82 1 18 LEU 5.27 2.99 1 19 ASP 4.28 3.25 1 21 LEU 3.90 2.74 1 22 TYR 5.71 5.39 1 23 GLU 2.90 2.86 1 24 PHE 2.94 3.46 1 25 LEU 2.66 1.85 1 26 ASP 1.64 3.19 1 27 LYS 0.56 -0.77 1 31 ASP 3.63 3.24 1 32 SER 3.30 1.98 1 33 ASP 0.16 1.12 1 34 ALA 2.17 1.88 1 35 VAL 3.74 2.22 1 36 LYS 3.56 1.93 1 37 PHE 1.92 1.83 1 38 GLU 3.93 3.52 1 39 HIS 4.18 3.53 1 40 HIS 2.36 2.40 1 41 PHE 1.03 -0.58 1 42 GLU -1.31 -1.00 1 43 GLU -1.64 -1.19 1 44 SER 4.40 3.05 1 51 TYR -2.95 -1.45 1 54 GLU 5.06 4.78 1 55 GLN 4.51 3.06 1 56 ALA 2.44 2.42 1 57 VAL 6.49 4.81 1 58 LYS 5.45 4.29 1 59 LYS 3.43 2.67 1 60 LEU 2.05 2.14 1 61 VAL 2.61 1.88 1 62 LYS 1.89 0.22 1 63 ARG 1.69 0.60 1 64 ALA -0.35 -0.09 1 65 ALA 0.35 0.21 1 67 GLN 0.13 0.18 1 68 ASP -0.10 0.11 1 69 ASP -0.31 -0.07 1 70 VAL 0.46 0.39 1 73 ASP 0.72 0.08 1 74 LEU 3.58 3.27 1 75 ARG 6.14 4.79 1 76 ALA 3.47 2.55 1 77 LYS 4.24 3.24 1 78 VAL 6.86 5.00 1 79 MET 5.19 4.65 1 81 ARG 4.20 2.41 1 82 LEU 3.84 3.05 1 83 ASP 3.70 3.31 1 84 LEU 3.48 2.96 1 85 ILE 3.69 3.86 1 86 ARG 3.62 2.89 1 87 SER 0.70 0.93 1 89 GLN -1.16 -0.36 1 90 SER 0.29 0.09 1 91 VAL -0.20 -0.26 1 93 GLU 0.38 0.43 1 94 HIS -1.23 0.54 1 95 ASP -0.21 0.24 1 96 VAL 1.28 0.85 1 97 ALA -0.36 -0.35 1 101 SER 0.01 0.00 1 102 SER -0.04 0.00 1 103 SER -0.27 -0.14 1 104 ALA -0.02 0.08 1 106 GLN -0.22 0.03 1 107 GLU -0.62 -0.01 1 108 SER 0.77 1.82 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25955_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -2.95 _LACS_plot.Line_1_terminator_val_y_1 1.42 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.69 _LACS_plot.Line_2_terminator_val_x_2 6.86 _LACS_plot.Line_2_terminator_val_y_2 -1.60 _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 53 LEU 1.11 -1.90 0 20 HIS 2.16 1.68 0 11 GLU -0.45 0.42 1 12 THR -0.57 0.60 1 13 ASP -0.68 0.93 1 15 SER 4.16 -1.12 1 16 GLU -1.24 0.67 1 17 ILE 2.19 -0.37 1 18 LEU 5.27 -2.28 1 19 ASP 4.28 -1.03 1 21 LEU 3.90 -1.16 1 22 TYR 5.71 -0.32 1 23 GLU 2.90 -0.04 1 24 PHE 2.94 0.52 1 25 LEU 2.66 -0.81 1 26 ASP 1.64 1.55 1 27 LYS 0.56 -1.33 1 31 ASP 3.63 -0.39 1 32 SER 3.30 -1.32 1 33 ASP 0.16 0.96 1 34 ALA 2.17 -0.29 1 35 VAL 3.74 -1.52 1 36 LYS 3.56 -1.63 1 37 PHE 1.92 -0.09 1 38 GLU 3.93 -0.41 1 39 HIS 4.18 -0.65 1 40 HIS 2.36 0.04 1 41 PHE 1.03 -1.61 1 42 GLU -1.31 0.31 1 43 GLU -1.64 0.45 1 44 SER 4.40 -1.35 1 51 TYR -2.95 1.50 1 54 GLU 5.06 -0.28 1 55 GLN 4.51 -1.45 1 56 ALA 2.44 -0.02 1 57 VAL 6.49 -1.68 1 58 LYS 5.45 -1.16 1 59 LYS 3.43 -0.76 1 60 LEU 2.05 0.09 1 61 VAL 2.61 -0.73 1 62 LYS 1.89 -1.67 1 63 ARG 1.69 -1.09 1 64 ALA -0.35 0.26 1 65 ALA 0.35 -0.14 1 67 GLN 0.13 0.05 1 68 ASP -0.10 0.21 1 69 ASP -0.31 0.24 1 70 VAL 0.46 -0.07 1 73 ASP 0.72 -0.64 1 74 LEU 3.58 -0.31 1 75 ARG 6.14 -1.35 1 76 ALA 3.47 -0.92 1 77 LYS 4.24 -1.00 1 78 VAL 6.86 -1.86 1 79 MET 5.19 -0.54 1 81 ARG 4.20 -1.79 1 82 LEU 3.84 -0.79 1 83 ASP 3.70 -0.39 1 84 LEU 3.48 -0.52 1 85 ILE 3.69 0.17 1 86 ARG 3.62 -0.73 1 87 SER 0.70 0.23 1 89 GLN -1.16 0.80 1 90 SER 0.29 -0.20 1 91 VAL -0.20 -0.06 1 93 GLU 0.38 0.05 1 94 HIS -1.23 1.77 1 95 ASP -0.21 0.45 1 96 VAL 1.28 -0.43 1 97 ALA -0.36 0.01 1 101 SER 0.01 -0.01 1 102 SER -0.04 0.04 1 103 SER -0.27 0.13 1 104 ALA -0.02 0.10 1 106 GLN -0.22 0.25 1 107 GLU -0.62 0.61 1 108 SER 0.77 1.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25955_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -2.95 _LACS_plot.Line_1_terminator_val_y_1 0.18 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 6.86 _LACS_plot.Line_2_terminator_val_y_2 -0.60 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 51 TYR -2.95 -0.35 0 11 GLU -0.45 0.25 1 12 THR -0.57 -0.01 1 13 ASP -0.68 0.27 1 15 SER 4.16 -0.25 1 16 GLU -1.24 0.25 1 17 ILE 2.19 -0.26 1 18 LEU 5.27 -0.44 1 19 ASP 4.28 -0.22 1 20 HIS 2.16 -0.16 1 21 LEU 3.90 -0.22 1 22 TYR 5.71 -0.88 1 23 GLU 2.90 -0.27 1 24 PHE 2.94 -0.25 1 25 LEU 2.66 -0.45 1 26 ASP 1.64 -0.51 1 27 LYS 0.56 -0.09 1 31 ASP 3.63 -0.19 1 32 SER 3.30 -0.25 1 33 ASP 0.16 0.16 1 34 ALA 2.17 -0.50 1 35 VAL 3.74 -0.22 1 36 LYS 3.56 -0.30 1 37 PHE 1.92 -0.42 1 38 GLU 3.93 -0.64 1 40 HIS 2.36 -0.43 1 41 PHE 1.03 0.19 1 42 GLU -1.31 0.08 1 43 GLU -1.64 -0.20 1 44 SER 4.40 -0.32 1 54 GLU 5.06 -0.69 1 55 GLN 4.51 -0.45 1 56 ALA 2.44 -0.35 1 57 VAL 6.49 -0.63 1 58 LYS 5.45 -0.92 1 59 LYS 3.43 -0.37 1 60 LEU 2.05 -0.23 1 61 VAL 2.61 -0.11 1 62 LYS 1.89 0.01 1 63 ARG 1.69 -0.10 1 64 ALA -0.35 -0.01 1 65 ALA 0.35 -0.02 1 67 GLN 0.13 0.00 1 68 ASP -0.10 -0.05 1 69 ASP -0.31 -0.05 1 70 VAL 0.46 -0.11 1 73 ASP 0.72 0.01 1 74 LEU 3.58 -0.33 1 75 ARG 6.14 -0.66 1 76 ALA 3.47 -0.25 1 77 LYS 4.24 -0.25 1 78 VAL 6.86 -0.64 1 79 MET 5.19 -0.57 1 81 ARG 4.20 -0.10 1 82 LEU 3.84 -0.37 1 83 ASP 3.70 -0.23 1 84 LEU 3.48 -0.29 1 85 ILE 3.69 -0.42 1 86 ARG 3.62 -0.32 1 87 SER 0.70 -0.03 1 89 GLN -1.16 0.04 1 90 SER 0.29 -0.07 1 91 VAL -0.20 -0.03 1 93 GLU 0.38 -0.21 1 94 HIS -1.23 -0.12 1 95 ASP -0.21 -0.06 1 96 VAL 1.28 -0.14 1 97 ALA -0.36 -0.06 1 101 SER 0.01 -0.05 1 102 SER -0.04 0.03 1 103 SER -0.27 -0.02 1 104 ALA -0.02 -0.04 1 106 GLN -0.22 -0.03 1 107 GLU -0.62 -0.02 1 108 SER 0.77 -0.23 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25955_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -2.95 _LACS_plot.Line_1_terminator_val_y_1 -1.05 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.52 _LACS_plot.Line_2_terminator_val_x_2 6.86 _LACS_plot.Line_2_terminator_val_y_2 2.36 _LACS_plot.Y_axis_chem_shift_offset -0.10 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 20 HIS 2.16 5.24 0 11 GLU -0.45 -0.12 1 12 THR -0.57 -0.13 1 13 ASP -0.68 1.45 1 15 SER 4.16 1.33 1 16 GLU -1.24 1.10 1 17 ILE 2.19 -0.35 1 18 LEU 5.27 1.89 1 19 ASP 4.28 2.87 1 21 LEU 3.90 -0.40 1 22 TYR 5.71 1.22 1 23 GLU 2.90 0.99 1 24 PHE 2.94 1.49 1 25 LEU 2.66 2.53 1 26 ASP 1.64 0.99 1 27 LYS 0.56 -1.38 1 31 ASP 3.63 2.43 1 33 ASP 0.16 0.42 1 34 ALA 2.17 1.00 1 35 VAL 3.74 1.02 1 36 LYS 3.56 0.41 1 37 PHE 1.92 0.77 1 38 GLU 3.93 2.29 1 40 HIS 2.36 2.99 1 41 PHE 1.03 1.19 1 42 GLU -1.31 -0.59 1 43 GLU -1.64 -0.76 1 44 SER 4.40 1.20 1 51 TYR -2.95 0.20 1 53 LEU 1.11 -0.53 1 54 GLU 5.06 0.31 1 55 GLN 4.51 2.81 1 56 ALA 2.44 1.24 1 57 VAL 6.49 1.10 1 58 LYS 5.45 1.80 1 59 LYS 3.43 1.76 1 60 LEU 2.05 0.99 1 61 VAL 2.61 0.20 1 62 LYS 1.89 -0.10 1 63 ARG 1.69 0.32 1 64 ALA -0.35 -0.45 1 65 ALA 0.35 0.58 1 67 GLN 0.13 -0.35 1 68 ASP -0.10 -0.64 1 69 ASP -0.31 -0.47 1 70 VAL 0.46 -0.40 1 73 ASP 0.72 0.77 1 74 LEU 3.58 0.60 1 75 ARG 6.14 1.17 1 76 ALA 3.47 3.72 1 77 LYS 4.24 3.78 1 78 VAL 6.86 1.42 1 79 MET 5.19 1.69 1 81 ARG 4.20 2.13 1 83 ASP 3.70 2.83 1 84 LEU 3.48 1.98 1 85 ILE 3.69 3.76 1 86 ARG 3.62 1.32 1 87 SER 0.70 0.63 1 89 GLN -1.16 -0.66 1 90 SER 0.29 -0.65 1 91 VAL -0.20 -0.45 1 93 GLU 0.38 1.47 1 94 HIS -1.23 0.62 1 95 ASP -0.21 0.57 1 96 VAL 1.28 -0.77 1 97 ALA -0.36 -0.77 1 101 SER 0.01 0.22 1 103 SER -0.27 -0.97 1 104 ALA -0.02 -0.53 1 106 GLN -0.22 -0.07 1 107 GLU -0.62 -1.02 1 stop_ save_