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 bmr30231_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.40 _LACS_plot.Line_1_terminator_val_y_1 -3.34 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.78 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.54 _LACS_plot.Line_2_terminator_val_x_2 9.30 _LACS_plot.Line_2_terminator_val_y_2 7.09 _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 93 THR 5.90 -1.90 0 10 ALA -1.10 -1.80 1 12 ASP 0.30 0.00 1 13 ARG -0.50 -0.50 1 16 GLU -0.30 0.20 1 17 GLN -3.00 -1.20 1 18 ILE -5.50 -2.10 1 19 ARG -1.10 -0.70 1 20 ILE -4.50 -1.60 1 21 PHE -4.90 -1.50 1 22 PHE -3.90 -1.40 1 23 LYS -1.90 -0.80 1 24 THR -2.70 -2.20 1 25 MET 2.90 2.20 1 26 LYS 0.30 0.70 1 27 GLN -2.60 -0.50 1 28 VAL 0.60 0.00 1 29 VAL -2.90 -0.70 1 31 ALA -5.10 -2.00 1 32 LYS -0.70 -0.80 1 33 ALA -7.30 -2.30 1 34 VAL -0.10 -0.60 1 37 SER -1.30 -0.40 1 38 THR -3.40 -1.60 1 39 VAL 7.20 5.00 1 41 ASP 3.60 3.40 1 42 VAL 4.90 3.70 1 43 ALA 5.40 3.50 1 44 HIS 2.20 2.30 1 45 LYS 1.90 1.50 1 46 ASN -1.60 0.10 1 48 VAL 0.10 -0.70 1 49 ASP 1.80 -0.10 1 50 LEU -3.00 -1.30 1 51 GLU 0.20 1.70 1 65 VAL -7.10 -2.80 1 66 ILE -1.30 0.70 1 67 LEU -0.80 0.70 1 68 GLU -1.50 -0.20 1 69 GLU 9.30 7.30 1 71 LEU 3.40 1.90 1 72 TYR 4.60 4.50 1 73 ARG 2.90 2.00 1 74 LYS 2.40 2.10 1 75 LEU 1.30 0.60 1 77 GLU 0.20 0.80 1 79 SER -1.60 -0.40 1 80 ASP 5.00 3.60 1 82 GLU 4.30 3.10 1 83 TYR 5.10 4.20 1 84 ASP 3.60 3.20 1 85 LEU 2.40 2.40 1 86 ILE 4.70 3.60 1 87 ASP 2.00 2.30 1 88 GLN -1.20 -1.00 1 89 ALA -0.80 -1.00 1 90 PHE 1.60 1.00 1 92 ALA 0.50 0.80 1 95 THR 0.90 -2.50 1 96 SER 2.90 3.80 1 97 ARG -8.40 -4.10 1 98 LEU 0.30 -0.80 1 102 LEU -3.70 -2.50 1 103 ARG -3.10 -3.80 1 104 VAL 2.80 1.20 1 105 ASP -2.90 -1.50 1 106 LYS 4.40 3.20 1 107 SER 3.40 2.90 1 108 PHE 1.10 -0.10 1 109 GLU 3.30 2.80 1 110 ASN 4.20 2.50 1 111 ALA -1.60 0.30 1 112 VAL -1.60 -1.50 1 113 PHE -1.40 -0.70 1 114 THR 2.50 1.70 1 115 VAL 0.00 -0.10 1 117 ARG -1.50 -0.50 1 118 ALA -0.70 -0.50 1 119 THR -0.10 -0.20 1 120 LYS 0.20 0.20 1 121 ASN 0.30 0.10 1 122 MET 0.30 0.10 1 123 ALA 0.00 0.00 1 124 VAL 0.20 0.10 1 125 ASP 0.20 0.30 1 127 PHE 0.20 0.10 1 128 LYS -0.90 -0.60 1 130 LYS 0.20 0.00 1 132 HIS 0.70 2.20 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30231_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.40 _LACS_plot.Line_1_terminator_val_y_1 5.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.22 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.46 _LACS_plot.Line_2_terminator_val_x_2 9.30 _LACS_plot.Line_2_terminator_val_y_2 -2.21 _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 93 THR 5.90 -7.80 0 10 ALA -1.10 -0.70 1 12 ASP 0.30 -0.30 1 13 ARG -0.50 0.00 1 16 GLU -0.30 0.50 1 17 GLN -3.00 1.80 1 18 ILE -5.50 3.40 1 19 ARG -1.10 0.40 1 20 ILE -4.50 2.90 1 21 PHE -4.90 3.40 1 22 PHE -3.90 2.50 1 23 LYS -1.90 1.10 1 24 THR -2.70 0.50 1 25 MET 2.90 -0.70 1 26 LYS 0.30 0.40 1 27 GLN -2.60 2.10 1 28 VAL 0.60 -0.60 1 29 VAL -2.90 2.20 1 31 ALA -5.10 3.10 1 32 LYS -0.70 -0.10 1 33 ALA -7.30 5.00 1 34 VAL -0.10 -0.50 1 37 SER -1.30 0.90 1 38 THR -3.40 1.80 1 39 VAL 7.20 -2.20 1 41 ASP 3.60 -0.20 1 42 VAL 4.90 -1.20 1 43 ALA 5.40 -1.90 1 44 HIS 2.20 0.10 1 45 LYS 1.90 -0.40 1 46 ASN -1.60 1.70 1 48 VAL 0.10 -0.80 1 49 ASP 1.80 -1.90 1 50 LEU -3.00 1.70 1 51 GLU 0.20 1.50 1 65 VAL -7.10 4.30 1 66 ILE -1.30 2.00 1 67 LEU -0.80 1.50 1 68 GLU -1.50 1.30 1 69 GLU 9.30 -2.00 1 71 LEU 3.40 -1.50 1 72 TYR 4.60 -0.10 1 73 ARG 2.90 -0.90 1 74 LYS 2.40 -0.30 1 75 LEU 1.30 -0.70 1 77 GLU 0.20 0.60 1 79 SER -1.60 1.20 1 80 ASP 5.00 -1.40 1 82 GLU 4.30 -1.20 1 83 TYR 5.10 -0.90 1 84 ASP 3.60 -0.40 1 85 LEU 2.40 0.00 1 86 ILE 4.70 -1.10 1 87 ASP 2.00 0.30 1 88 GLN -1.20 0.20 1 89 ALA -0.80 -0.20 1 90 PHE 1.60 -0.60 1 92 ALA 0.50 0.30 1 95 THR 0.90 -3.40 1 96 SER 2.90 0.90 1 97 ARG -8.40 4.30 1 98 LEU 0.30 -1.10 1 102 LEU -3.70 1.20 1 103 ARG -3.10 -0.70 1 104 VAL 2.80 -1.60 1 105 ASP -2.90 1.40 1 106 LYS 4.40 -1.20 1 107 SER 3.40 -0.50 1 108 PHE 1.10 -1.20 1 109 GLU 3.30 -0.50 1 110 ASN 4.20 -1.70 1 111 ALA -1.60 1.90 1 112 VAL -1.60 0.10 1 113 PHE -1.40 0.70 1 114 THR 2.50 -0.80 1 115 VAL 0.00 -0.10 1 117 ARG -1.50 1.00 1 118 ALA -0.70 0.20 1 119 THR -0.10 -0.10 1 120 LYS 0.20 0.00 1 121 ASN 0.30 -0.20 1 122 MET 0.30 -0.20 1 123 ALA 0.00 0.00 1 124 VAL 0.20 -0.10 1 125 ASP 0.20 0.10 1 127 PHE 0.20 -0.10 1 128 LYS -0.90 0.30 1 130 LYS 0.20 -0.20 1 132 HIS 0.70 1.50 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30231_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 0.69 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 0.19 _LACS_plot.Line_2_terminator_val_x_2 9.30 _LACS_plot.Line_2_terminator_val_y_2 -0.94 _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 104 VAL 2.80 -2.59 0 16 GLU -0.30 -0.10 1 17 GLN -3.00 0.72 1 18 ILE -5.50 0.47 1 19 ARG -1.10 0.66 1 20 ILE -4.50 0.57 1 21 PHE -4.90 0.95 1 22 PHE -3.90 1.15 1 23 LYS -1.90 0.88 1 24 THR -2.70 0.58 1 25 MET 2.90 -0.29 1 27 GLN -2.60 0.39 1 31 ALA -5.10 0.28 1 32 LYS -0.70 0.26 1 33 ALA -7.30 0.40 1 34 VAL -0.10 0.12 1 37 SER -1.30 0.25 1 38 THR -3.40 1.26 1 39 VAL 7.20 -0.92 1 42 VAL 4.90 -0.49 1 43 ALA 5.40 -1.06 1 45 LYS 1.90 -0.07 1 46 ASN -1.60 0.21 1 48 VAL 0.10 -0.31 1 49 ASP 1.80 -0.20 1 50 LEU -3.00 0.11 1 67 LEU -0.80 0.19 1 68 GLU -1.50 -0.01 1 69 GLU 9.30 -0.61 1 71 LEU 3.40 -0.17 1 72 TYR 4.60 -0.88 1 73 ARG 2.90 -0.25 1 74 LYS 2.40 -0.21 1 75 LEU 1.30 -0.15 1 77 GLU 0.20 -0.24 1 79 SER -1.60 -0.05 1 80 ASP 5.00 -0.12 1 83 TYR 5.10 -0.38 1 84 ASP 3.60 -0.25 1 86 ILE 4.70 -0.78 1 87 ASP 2.00 -0.30 1 88 GLN -1.20 0.00 1 89 ALA -0.80 -0.01 1 90 PHE 1.60 -0.20 1 92 ALA 0.50 -0.19 1 95 THR 0.90 -0.87 1 96 SER 2.90 -0.30 1 103 ARG -3.10 -0.02 1 105 ASP -2.90 0.07 1 106 LYS 4.40 -0.35 1 108 PHE 1.10 -0.21 1 109 GLU 3.30 -0.33 1 110 ASN 4.20 -0.38 1 111 ALA -1.60 -0.07 1 112 VAL -1.60 0.41 1 113 PHE -1.40 0.07 1 114 THR 2.50 0.64 1 115 VAL 0.00 0.16 1 117 ARG -1.50 0.11 1 118 ALA -0.70 -0.06 1 119 THR -0.10 -0.09 1 123 ALA 0.00 0.05 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr30231_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.30 _LACS_plot.Line_1_terminator_val_y_1 -3.17 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -1.09 _LACS_plot.Line_2_terminator_val_x_2 5.90 _LACS_plot.Line_2_terminator_val_y_2 2.03 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 HIS 2.20 4.70 0 12 ASP 0.30 -0.40 1 13 ARG -0.50 -0.50 1 16 GLU -0.30 -1.10 1 17 GLN -3.00 -0.70 1 18 ILE -5.50 -2.30 1 19 ARG -1.10 -0.70 1 20 ILE -4.50 -4.10 1 21 PHE -4.90 -0.70 1 22 PHE -3.90 -1.00 1 23 LYS -1.90 -1.70 1 24 THR -2.70 -0.40 1 25 MET 2.90 0.20 1 26 LYS 0.30 -0.60 1 27 GLN -2.60 -1.90 1 28 VAL 0.60 -0.30 1 31 ALA -5.10 -2.50 1 32 LYS -0.70 -1.40 1 33 ALA -7.30 -2.70 1 34 VAL -0.10 0.60 1 37 SER -1.30 -1.40 1 41 ASP 3.60 2.70 1 42 VAL 4.90 3.40 1 43 ALA 5.40 1.60 1 45 LYS 1.90 0.50 1 46 ASN -1.60 -1.40 1 48 VAL 0.10 -0.50 1 49 ASP 1.80 -2.50 1 50 LEU -3.00 -3.10 1 65 VAL -7.10 -3.50 1 66 ILE -1.30 -0.20 1 67 LEU -0.80 1.50 1 68 GLU -1.50 0.60 1 71 LEU 3.40 -0.10 1 72 TYR 4.60 2.20 1 74 LYS 2.40 1.70 1 75 LEU 1.30 0.70 1 79 SER -1.60 -0.50 1 82 GLU 4.30 1.40 1 83 TYR 5.10 2.50 1 84 ASP 3.60 2.30 1 85 LEU 2.40 3.10 1 86 ILE 4.70 1.20 1 87 ASP 2.00 1.10 1 88 GLN -1.20 -0.40 1 89 ALA -0.80 -0.70 1 90 PHE 1.60 1.00 1 92 ALA 0.50 0.00 1 93 THR 5.90 1.60 1 95 THR 0.90 0.00 1 96 SER 2.90 -0.60 1 102 LEU -3.70 -3.20 1 103 ARG -3.10 -2.10 1 104 VAL 2.80 -0.70 1 105 ASP -2.90 -0.10 1 106 LYS 4.40 1.70 1 107 SER 3.40 0.60 1 108 PHE 1.10 -1.50 1 109 GLU 3.30 0.90 1 110 ASN 4.20 -1.70 1 111 ALA -1.60 -2.20 1 112 VAL -1.60 0.30 1 113 PHE -1.40 -0.60 1 114 THR 2.50 -1.00 1 117 ARG -1.50 -1.20 1 118 ALA -0.70 -0.30 1 119 THR -0.10 -0.30 1 120 LYS 0.20 -0.60 1 121 ASN 0.30 -0.10 1 122 MET 0.30 -0.50 1 123 ALA 0.00 0.00 1 124 VAL 0.20 -0.30 1 125 ASP 0.20 0.30 1 127 PHE 0.20 -0.50 1 stop_ save_