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 bmr16285_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 -2.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 -1.55 _LACS_plot.Line_2_terminator_val_x_2 6.78 _LACS_plot.Line_2_terminator_val_y_2 5.21 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 HIS 6.78 6.80 0 55 ILE -0.64 -3.40 0 10 THR -0.79 -0.59 1 11 ALA -1.78 -0.65 1 12 VAL -2.37 -0.99 1 13 VAL -1.78 -1.57 1 15 ARG -1.10 -0.64 1 16 VAL -3.54 -0.99 1 17 GLU -2.70 -1.24 1 18 ILE -1.81 -0.47 1 20 LYS -0.27 1.50 1 21 LEU -3.92 -1.50 1 23 GLN -1.72 -0.93 1 25 GLU -0.36 -0.07 1 26 ASN -2.49 -0.67 1 27 LEU -3.34 -1.50 1 28 ILE -1.22 -0.47 1 29 LEU -0.41 1.43 1 31 PHE -1.71 -1.17 1 32 SER -3.87 -1.77 1 33 ILE -7.08 -2.23 1 37 ILE 4.63 3.63 1 39 GLN -2.89 -2.10 1 40 ASP -1.35 -0.94 1 42 SER 3.74 2.91 1 43 GLN 0.04 -0.93 1 46 PHE 0.05 0.00 1 47 SER -1.52 -1.77 1 48 GLU 1.40 1.69 1 49 ASP -1.39 -1.18 1 50 LYS 2.66 0.33 1 52 ASP 0.36 0.57 1 53 LYS 0.90 -0.26 1 56 TYR -6.80 -2.54 1 57 VAL 1.73 0.77 1 58 THR 0.98 0.00 1 59 ARG -2.85 0.53 1 60 VAL -2.18 -0.21 1 61 SER 1.99 1.16 1 62 GLU 2.57 1.69 1 66 ALA 1.14 1.69 1 68 ILE 3.46 3.04 1 69 ALA -2.37 -0.07 1 71 LEU -2.17 -0.33 1 72 GLN -4.64 -2.10 1 73 ILE 3.45 2.45 1 75 ASP 2.12 1.74 1 77 ILE 2.28 1.28 1 78 MET 0.33 -0.04 1 79 GLN -6.40 -0.93 1 81 ASN 3.37 1.09 1 86 THR 3.32 2.93 1 88 VAL -5.30 -3.33 1 91 ASP 2.71 3.50 1 92 GLN 3.55 3.17 1 93 ALA 2.90 2.86 1 94 ARG 5.34 4.04 1 95 LYS 4.42 3.26 1 96 ARG 3.58 1.70 1 97 LEU 0.77 1.43 1 98 THR -0.78 -1.17 1 99 LYS 2.66 1.50 1 100 ARG 3.00 2.29 1 101 SER 0.82 -0.01 1 102 GLU -2.70 -1.83 1 103 GLU 0.23 1.10 1 104 VAL -3.54 -2.16 1 107 LEU -3.92 -1.50 1 108 LEU -2.75 -0.91 1 109 VAL -7.05 -4.50 1 110 THR -2.54 -1.17 1 112 GLN 0.63 0.83 1 113 SER 0.24 -0.01 1 114 LEU 0.18 0.26 1 116 LYS 0.32 0.33 1 117 ALA -0.03 -0.07 1 118 VAL 0.55 0.18 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16285_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 4.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.45 _LACS_plot.Line_2_terminator_val_x_2 6.78 _LACS_plot.Line_2_terminator_val_y_2 -1.57 _LACS_plot.Y_axis_chem_shift_offset 0.01 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 90 HIS 6.78 0.02 0 55 ILE -0.64 -2.76 0 10 THR -0.79 0.20 1 11 ALA -1.78 1.13 1 12 VAL -2.37 1.38 1 13 VAL -1.78 0.21 1 15 ARG -1.10 0.46 1 16 VAL -3.54 2.55 1 17 GLU -2.70 1.46 1 18 ILE -1.81 1.34 1 20 LYS -0.27 1.77 1 21 LEU -3.92 2.42 1 23 GLN -1.72 0.79 1 25 GLU -0.36 0.29 1 26 ASN -2.49 1.82 1 27 LEU -3.34 1.84 1 28 ILE -1.22 0.75 1 29 LEU -0.41 1.84 1 31 PHE -1.71 0.54 1 32 SER -3.87 2.10 1 33 ILE -7.08 4.85 1 37 ILE 4.63 -1.00 1 39 GLN -2.89 0.79 1 40 ASP -1.35 0.41 1 42 SER 3.74 -0.83 1 43 GLN 0.04 -0.97 1 46 PHE 0.05 -0.05 1 47 SER -1.52 -0.25 1 48 GLU 1.40 0.29 1 49 ASP -1.39 0.21 1 50 LYS 2.66 -2.33 1 52 ASP 0.36 0.21 1 53 LYS 0.90 -1.16 1 56 TYR -6.80 4.26 1 57 VAL 1.73 -0.96 1 58 THR 0.98 -0.98 1 59 ARG -2.85 3.38 1 60 VAL -2.18 1.97 1 61 SER 1.99 -0.83 1 62 GLU 2.57 -0.88 1 66 ALA 1.14 0.55 1 68 ILE 3.46 -0.42 1 69 ALA -2.37 2.30 1 71 LEU -2.17 1.84 1 72 GLN -4.64 2.54 1 73 ILE 3.45 -1.00 1 75 ASP 2.12 -0.38 1 77 ILE 2.28 -1.00 1 78 MET 0.33 -0.37 1 79 GLN -6.40 5.47 1 81 ASN 3.37 -2.28 1 86 THR 3.32 -0.39 1 88 VAL -5.30 1.97 1 91 ASP 2.71 0.79 1 92 GLN 3.55 -0.38 1 93 ALA 2.90 -0.04 1 94 ARG 5.34 -1.30 1 95 LYS 4.42 -1.16 1 96 ARG 3.58 -1.88 1 97 LEU 0.77 0.66 1 98 THR -0.78 -0.39 1 99 LYS 2.66 -1.16 1 100 ARG 3.00 -0.71 1 101 SER 0.82 -0.83 1 102 GLU -2.70 0.87 1 103 GLU 0.23 0.87 1 104 VAL -3.54 1.38 1 107 LEU -3.92 2.42 1 108 LEU -2.75 1.84 1 109 VAL -7.05 2.55 1 110 THR -2.54 1.37 1 112 GLN 0.63 0.20 1 113 SER 0.24 -0.25 1 114 LEU 0.18 0.08 1 116 LYS 0.32 0.01 1 117 ALA -0.03 -0.04 1 118 VAL 0.55 -0.37 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16285_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 0.85 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.17 _LACS_plot.Line_2_terminator_val_x_2 6.78 _LACS_plot.Line_2_terminator_val_y_2 -0.78 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 109 VAL -7.05 1.47 0 71 LEU -2.17 -0.59 0 33 ILE -7.08 1.53 0 10 THR -0.79 -0.03 1 11 ALA -1.78 0.23 1 12 VAL -2.37 0.09 1 13 VAL -1.78 0.73 1 15 ARG -1.10 0.69 1 16 VAL -3.54 0.18 1 17 GLU -2.70 0.58 1 18 ILE -1.81 -0.04 1 20 LYS -0.27 -0.31 1 21 LEU -3.92 0.20 1 23 GLN -1.72 0.12 1 25 GLU -0.36 -0.13 1 26 ASN -2.49 0.05 1 27 LEU -3.34 0.55 1 28 ILE -1.22 0.03 1 29 LEU -0.41 -0.15 1 31 PHE -1.71 0.54 1 32 SER -3.87 0.29 1 37 ILE 4.63 -0.06 1 39 GLN -2.89 0.08 1 40 ASP -1.35 -0.10 1 42 SER 3.74 -0.33 1 43 GLN 0.04 -0.14 1 46 PHE 0.05 -0.28 1 47 SER -1.52 -0.28 1 48 GLU 1.40 -0.24 1 49 ASP -1.39 -0.09 1 50 LYS 2.66 -0.15 1 52 ASP 0.36 -0.14 1 53 LYS 0.90 0.28 1 55 ILE -0.64 0.60 1 56 TYR -6.80 0.85 1 57 VAL 1.73 0.23 1 58 THR 0.98 0.04 1 59 ARG -2.85 -0.01 1 60 VAL -2.18 0.19 1 61 SER 1.99 -0.20 1 62 GLU 2.57 -0.20 1 66 ALA 1.14 -0.25 1 68 ILE 3.46 -0.44 1 69 ALA -2.37 -0.03 1 72 GLN -4.64 0.20 1 73 ILE 3.45 -0.93 1 75 ASP 2.12 -0.21 1 77 ILE 2.28 -0.33 1 78 MET 0.33 -0.05 1 79 GLN -6.40 0.88 1 81 ASN 3.37 -0.28 1 86 THR 3.32 -0.18 1 88 VAL -5.30 0.73 1 90 HIS 6.78 -0.88 1 91 ASP 2.71 -0.35 1 92 GLN 3.55 -0.56 1 93 ALA 2.90 -0.50 1 94 ARG 5.34 -0.79 1 95 LYS 4.42 -0.61 1 96 ARG 3.58 -0.49 1 97 LEU 0.77 -0.36 1 98 THR -0.78 0.16 1 99 LYS 2.66 -0.20 1 100 ARG 3.00 -0.45 1 101 SER 0.82 -0.25 1 102 GLU -2.70 0.15 1 103 GLU 0.23 -0.35 1 104 VAL -3.54 0.69 1 107 LEU -3.92 0.89 1 108 LEU -2.75 0.67 1 110 THR -2.54 0.76 1 112 GLN 0.63 0.10 1 113 SER 0.24 -0.10 1 114 LEU 0.18 0.00 1 116 LYS 0.32 -0.12 1 117 ALA -0.03 -0.07 1 118 VAL 0.55 -0.13 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16285_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.08 _LACS_plot.Line_1_terminator_val_y_1 -2.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 -1.21 _LACS_plot.Line_2_terminator_val_x_2 6.78 _LACS_plot.Line_2_terminator_val_y_2 2.42 _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 37 ILE 4.63 -1.11 0 90 HIS 6.78 3.33 0 33 ILE -7.08 -0.88 0 94 ARG 5.34 3.78 0 88 VAL -5.30 0.47 0 10 THR -0.79 -1.21 1 11 ALA -1.78 -1.02 1 12 VAL -2.37 -1.37 1 15 ARG -1.10 -0.30 1 16 VAL -3.54 -2.56 1 17 GLU -2.70 -2.85 1 18 ILE -1.81 -1.76 1 20 LYS -0.27 -1.02 1 21 LEU -3.92 -1.90 1 23 GLN -1.72 -0.61 1 25 GLU -0.36 -0.69 1 26 ASN -2.49 -1.61 1 27 LEU -3.34 -1.27 1 28 ILE -1.22 -0.75 1 29 LEU -0.41 -0.89 1 31 PHE -1.71 -3.64 1 32 SER -3.87 -1.29 1 39 GLN -2.89 -0.92 1 42 SER 3.74 0.63 1 43 GLN 0.04 -1.09 1 46 PHE 0.05 -0.88 1 48 GLU 1.40 -0.33 1 49 ASP -1.39 0.27 1 50 LYS 2.66 -0.30 1 52 ASP 0.36 0.40 1 53 LYS 0.90 0.26 1 55 ILE -0.64 -1.46 1 57 VAL 1.73 0.49 1 58 THR 0.98 0.33 1 59 ARG -2.85 -2.04 1 60 VAL -2.18 -1.05 1 61 SER 1.99 0.71 1 62 GLU 2.57 1.47 1 66 ALA 1.14 -0.23 1 68 ILE 3.46 0.87 1 69 ALA -2.37 -0.43 1 71 LEU -2.17 -3.08 1 72 GLN -4.64 -0.83 1 73 ILE 3.45 0.71 1 75 ASP 2.12 -1.60 1 77 ILE 2.28 -2.20 1 78 MET 0.33 1.55 1 79 GLN -6.40 -1.38 1 81 ASN 3.37 -0.62 1 86 THR 3.32 0.60 1 91 ASP 2.71 2.24 1 92 GLN 3.55 3.22 1 93 ALA 2.90 0.93 1 95 LYS 4.42 2.58 1 96 ARG 3.58 2.30 1 97 LEU 0.77 -1.29 1 98 THR -0.78 0.03 1 99 LYS 2.66 1.75 1 100 ARG 3.00 -0.24 1 101 SER 0.82 -0.60 1 102 GLU -2.70 -1.47 1 103 GLU 0.23 -1.92 1 107 LEU -3.92 -1.18 1 108 LEU -2.75 -1.35 1 109 VAL -7.05 -1.67 1 110 THR -2.54 -1.74 1 112 GLN 0.63 0.22 1 113 SER 0.24 -0.21 1 114 LEU 0.18 -0.39 1 116 LYS 0.32 -0.38 1 118 VAL 0.55 0.01 1 stop_ save_