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 bmr4230_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.30 _LACS_plot.Line_1_terminator_val_y_1 -2.03 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.27 _LACS_plot.Line_2_terminator_val_x_2 7.59 _LACS_plot.Line_2_terminator_val_y_2 6.52 _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 28 ALA 1.80 14.70 0 10 VAL 7.60 5.80 1 11 VAL 7.50 5.70 1 12 GLN 5.20 4.30 1 13 ARG 3.80 3.50 1 14 TYR 4.30 4.10 1 15 VAL 6.00 5.30 1 16 ALA 3.60 3.00 1 17 ALA 3.90 3.10 1 18 LEU 3.10 3.70 1 19 ASN 2.50 3.50 1 20 ALA -1.10 -0.20 1 22 ASP -0.90 -1.70 1 23 LEU 3.00 3.60 1 24 ASP 4.30 3.90 1 26 ILE 4.00 4.50 1 27 VAL 5.90 5.00 1 29 LEU 1.50 0.90 1 30 PHE -1.29 0.31 1 31 ALA -2.50 -0.90 1 32 ASP 3.10 2.90 1 33 ASP -0.50 -2.20 1 34 ALA -4.00 -0.10 1 35 THR -4.50 -1.70 1 36 VAL -4.50 -1.20 1 37 GLU -4.10 -1.50 1 38 ASP -2.70 -1.10 1 40 VAL 4.10 3.70 1 42 SER -2.80 -0.60 1 43 GLU -0.00 0.90 1 45 ARG -1.80 -1.40 1 46 SER -2.90 -1.10 1 48 THR 5.70 5.60 1 49 ALA 4.80 3.80 1 50 ALA 2.20 2.30 1 51 ILE 5.80 5.30 1 53 GLU 2.80 3.20 1 54 PHE 3.90 3.60 1 55 PHE 6.40 6.20 1 56 ALA 4.20 3.40 1 57 ASN 3.10 3.20 1 58 SER 4.60 3.90 1 59 LEU 0.90 -0.20 1 60 LYS 2.90 2.90 1 61 LEU -2.50 -1.20 1 63 LEU -3.70 -0.60 1 64 ALA -2.30 -1.00 1 65 VAL -2.20 -0.90 1 66 GLU -5.10 -1.30 1 67 LEU 0.00 1.10 1 68 THR 0.20 -0.10 1 69 GLN -8.30 -0.90 1 70 GLU -2.30 -1.00 1 71 VAL 2.30 2.30 1 73 ALA -3.60 -1.00 1 74 VAL -1.60 -1.30 1 75 ALA 2.90 1.80 1 76 ASN 5.50 6.10 1 77 GLU -6.80 -0.70 1 78 ALA -6.30 -1.80 1 79 ALA -6.10 -1.70 1 80 PHE -3.70 -2.20 1 81 ALA -4.10 -1.30 1 82 PHE -2.70 -1.60 1 83 THR -4.40 -1.80 1 84 VAL -2.80 -0.90 1 85 SER -3.50 -1.30 1 86 PHE -2.20 -1.10 1 87 GLU -4.10 -1.30 1 88 PHE -2.60 0.10 1 89 GLN 4.00 1.20 1 91 ARG -2.90 -1.10 1 92 LYS 0.30 0.80 1 93 THR -0.60 0.90 1 94 VAL -3.50 -0.90 1 95 VAL -2.70 -1.50 1 96 ALA -3.80 -2.00 1 98 ILE -2.90 1.00 1 100 HIS -7.20 -0.60 1 101 PHE -8.20 -4.80 1 102 ARG -3.10 -0.50 1 103 PHE -3.80 -0.30 1 104 ASN -3.00 -2.40 1 106 ALA -0.70 -0.70 1 108 LYS -3.20 -2.00 1 109 VAL 3.40 1.80 1 110 VAL -2.30 -0.90 1 111 SER -2.30 -0.90 1 112 MET -5.30 -0.70 1 114 ALA -4.10 -0.90 1 115 LEU 1.30 1.90 1 116 PHE -0.70 -0.10 1 118 GLU 3.40 3.70 1 119 LYS 2.40 0.70 1 120 ASN -2.30 0.40 1 121 ILE 0.50 0.80 1 122 HIS -2.90 -0.80 1 123 ALA -1.30 -0.10 1 125 ALA -0.30 1.50 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4230_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.30 _LACS_plot.Line_1_terminator_val_y_1 6.27 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.73 _LACS_plot.Line_2_terminator_val_x_2 7.59 _LACS_plot.Line_2_terminator_val_y_2 -1.07 _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 28 ALA 1.80 12.90 0 10 VAL 7.60 -1.80 1 11 VAL 7.50 -1.80 1 12 GLN 5.20 -0.90 1 13 ARG 3.80 -0.30 1 14 TYR 4.30 -0.20 1 15 VAL 6.00 -0.70 1 16 ALA 3.60 -0.60 1 17 ALA 3.90 -0.80 1 18 LEU 3.10 0.60 1 19 ASN 2.50 1.00 1 20 ALA -1.10 0.90 1 22 ASP -0.90 -0.80 1 23 LEU 3.00 0.60 1 24 ASP 4.30 -0.40 1 26 ILE 4.00 0.50 1 27 VAL 5.90 -0.90 1 29 LEU 1.50 -0.60 1 30 PHE -1.29 1.60 1 31 ALA -2.50 1.60 1 32 ASP 3.10 -0.20 1 33 ASP -0.50 -1.70 1 34 ALA -4.00 3.90 1 35 THR -4.50 2.80 1 36 VAL -4.50 3.30 1 37 GLU -4.10 2.60 1 38 ASP -2.70 1.60 1 40 VAL 4.10 -0.40 1 42 SER -2.80 2.20 1 43 GLU -0.00 0.90 1 45 ARG -1.80 0.40 1 46 SER -2.90 1.80 1 48 THR 5.70 -0.10 1 49 ALA 4.80 -1.00 1 50 ALA 2.20 0.10 1 51 ILE 5.80 -0.50 1 53 GLU 2.80 0.40 1 54 PHE 3.90 -0.30 1 55 PHE 6.40 -0.20 1 56 ALA 4.20 -0.80 1 57 ASN 3.10 0.10 1 58 SER 4.60 -0.70 1 59 LEU 0.90 -1.10 1 60 LYS 2.90 0.00 1 61 LEU -2.50 1.30 1 63 LEU -3.70 3.10 1 64 ALA -2.30 1.30 1 65 VAL -2.20 1.30 1 66 GLU -5.10 3.80 1 67 LEU 0.00 1.10 1 68 THR 0.20 -0.30 1 69 GLN -8.30 7.40 1 70 GLU -2.30 1.30 1 71 VAL 2.30 0.00 1 73 ALA -3.60 2.60 1 74 VAL -1.60 0.30 1 75 ALA 2.90 -1.10 1 76 ASN 5.50 0.60 1 77 GLU -6.80 6.10 1 78 ALA -6.30 4.50 1 79 ALA -6.10 4.40 1 80 PHE -3.70 1.50 1 81 ALA -4.10 2.80 1 82 PHE -2.70 1.10 1 83 THR -4.40 2.60 1 84 VAL -2.80 1.90 1 85 SER -3.50 2.20 1 86 PHE -2.20 1.10 1 87 GLU -4.10 2.80 1 88 PHE -2.60 2.70 1 89 GLN 4.00 -2.80 1 91 ARG -2.90 1.80 1 92 LYS 0.30 0.50 1 93 THR -0.60 1.50 1 94 VAL -3.50 2.60 1 95 VAL -2.70 1.20 1 96 ALA -3.80 1.80 1 98 ILE -2.90 3.90 1 100 HIS -7.20 6.60 1 101 PHE -8.20 3.40 1 102 ARG -3.10 2.60 1 103 PHE -3.80 3.50 1 104 ASN -3.00 0.60 1 106 ALA -0.70 0.00 1 108 LYS -3.20 1.20 1 109 VAL 3.40 -1.60 1 110 VAL -2.30 1.40 1 111 SER -2.30 1.40 1 112 MET -5.30 4.60 1 114 ALA -4.10 3.20 1 115 LEU 1.30 0.60 1 116 PHE -0.70 0.60 1 118 GLU 3.40 0.30 1 119 LYS 2.40 -1.70 1 120 ASN -2.30 2.70 1 121 ILE 0.50 0.30 1 122 HIS -2.90 2.10 1 123 ALA -1.30 1.20 1 125 ALA -0.30 1.80 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4230_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.30 _LACS_plot.Line_1_terminator_val_y_1 1.26 _LACS_plot.Line_1_terminator_val_x_2 2.00 _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 0.36 _LACS_plot.Line_2_terminator_val_x_2 7.59 _LACS_plot.Line_2_terminator_val_y_2 -0.92 _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 69 GLN -8.30 0.17 0 10 VAL 7.60 -0.70 1 11 VAL 7.50 -1.02 1 12 GLN 5.20 -0.60 1 13 ARG 3.80 -0.32 1 14 TYR 4.30 -0.65 1 15 VAL 6.00 -0.98 1 16 ALA 3.60 -0.15 1 17 ALA 3.90 -0.04 1 18 LEU 3.10 -0.51 1 19 ASN 2.50 -0.10 1 20 ALA -1.10 0.12 1 22 ASP -0.90 -0.04 1 23 LEU 3.00 -0.57 1 24 ASP 4.30 -0.38 1 26 ILE 4.00 -0.61 1 27 VAL 5.90 -0.61 1 28 ALA 1.80 -0.09 1 29 LEU 1.50 -0.28 1 30 PHE -1.29 -0.02 1 31 ALA -2.50 -0.11 1 32 ASP 3.10 -0.21 1 33 ASP -0.50 0.06 1 34 ALA -4.00 0.47 1 35 THR -4.50 1.04 1 36 VAL -4.50 0.52 1 37 GLU -4.10 0.08 1 38 ASP -2.70 -0.04 1 40 VAL 4.10 -0.29 1 42 SER -2.80 0.12 1 43 GLU -0.00 -0.21 1 45 ARG -1.80 0.18 1 46 SER -2.90 0.82 1 48 THR 5.70 -0.60 1 49 ALA 4.80 -0.21 1 50 ALA 2.20 -0.13 1 51 ILE 5.80 -0.78 1 53 GLU 2.80 -0.34 1 54 PHE 3.90 -0.43 1 55 PHE 6.40 -0.74 1 56 ALA 4.20 -0.37 1 57 ASN 3.10 -0.39 1 58 SER 4.60 -0.47 1 59 LEU 0.90 0.10 1 60 LYS 2.90 -0.29 1 61 LEU -2.50 0.10 1 63 LEU -3.70 0.48 1 64 ALA -2.30 0.75 1 65 VAL -2.20 1.29 1 66 GLU -5.10 0.36 1 67 LEU 0.00 0.37 1 68 THR 0.20 0.13 1 70 GLU -2.30 0.14 1 71 VAL 2.30 -0.19 1 73 ALA -3.60 1.10 1 74 VAL -1.60 0.07 1 75 ALA 2.90 -0.42 1 76 ASN 5.50 -0.77 1 77 GLU -6.80 1.25 1 78 ALA -6.30 1.45 1 79 ALA -6.10 1.50 1 80 PHE -3.70 0.49 1 81 ALA -4.10 0.69 1 82 PHE -2.70 0.87 1 83 THR -4.40 0.86 1 84 VAL -2.80 0.72 1 85 SER -3.50 1.39 1 86 PHE -2.20 0.42 1 87 GLU -4.10 0.67 1 88 PHE -2.60 0.28 1 89 GLN 4.00 -0.73 1 91 ARG -2.90 0.34 1 92 LYS 0.30 0.30 1 93 THR -0.60 0.25 1 94 VAL -3.50 0.68 1 95 VAL -2.70 0.80 1 96 ALA -3.80 0.88 1 98 ILE -2.90 0.67 1 100 HIS -7.20 0.67 1 101 PHE -8.20 1.20 1 102 ARG -3.10 0.87 1 103 PHE -3.80 0.64 1 104 ASN -3.00 0.20 1 106 ALA -0.70 0.11 1 108 LYS -3.20 0.18 1 109 VAL 3.40 -1.02 1 110 VAL -2.30 0.40 1 111 SER -2.30 0.96 1 112 MET -5.30 1.00 1 114 ALA -4.10 0.92 1 115 LEU 1.30 -0.01 1 116 PHE -0.70 -0.17 1 118 GLU 3.40 -0.31 1 119 LYS 2.40 0.03 1 120 ASN -2.30 0.55 1 121 ILE 0.50 0.12 1 122 HIS -2.90 0.23 1 123 ALA -1.30 0.47 1 125 ALA -0.30 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4230_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.30 _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 0.60 _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 7.59 _LACS_plot.Line_2_terminator_val_y_2 2.37 _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 108 LYS -3.20 5.00 0 10 VAL 7.60 1.40 1 11 VAL 7.50 1.50 1 12 GLN 5.20 2.50 1 13 ARG 3.80 2.20 1 14 TYR 4.30 0.40 1 15 VAL 6.00 1.80 1 16 ALA 3.60 3.30 1 17 ALA 3.90 3.10 1 18 LEU 3.10 1.90 1 19 ASN 2.50 1.70 1 20 ALA -1.10 0.50 1 22 ASP -0.90 -1.40 1 23 LEU 3.00 0.70 1 24 ASP 4.30 3.10 1 26 ILE 4.00 1.90 1 27 VAL 5.90 2.30 1 28 ALA 1.80 1.00 1 29 LEU 1.50 0.20 1 30 PHE -1.29 0.50 1 31 ALA -2.50 0.40 1 32 ASP 3.10 0.20 1 33 ASP -0.50 -0.50 1 34 ALA -4.00 -1.60 1 35 THR -4.50 -0.40 1 36 VAL -4.50 -2.10 1 37 GLU -4.10 -3.40 1 40 VAL 4.10 -0.80 1 42 SER -2.80 -1.00 1 45 ARG -1.80 -0.60 1 46 SER -2.90 0.50 1 48 THR 5.70 1.10 1 49 ALA 4.80 2.90 1 50 ALA 2.20 -2.30 1 51 ILE 5.80 1.20 1 53 GLU 2.80 1.90 1 54 PHE 3.90 3.40 1 55 PHE 6.40 2.00 1 56 ALA 4.20 3.20 1 57 ASN 3.10 2.90 1 58 SER 4.60 -0.80 1 59 LEU 0.90 -0.40 1 60 LYS 2.90 0.40 1 63 LEU -3.70 -1.00 1 64 ALA -2.30 0.10 1 65 VAL -2.20 -0.80 1 66 GLU -5.10 -1.00 1 67 LEU 0.00 0.90 1 68 THR 0.20 0.00 1 69 GLN -8.30 0.70 1 70 GLU -2.30 0.60 1 71 VAL 2.30 0.80 1 73 ALA -3.60 -3.10 1 74 VAL -1.60 -4.60 1 76 ASN 5.50 -1.10 1 77 GLU -6.80 -3.00 1 78 ALA -6.30 -1.60 1 79 ALA -6.10 -1.80 1 80 PHE -3.70 -4.50 1 81 ALA -4.10 -1.30 1 82 PHE -2.70 -1.50 1 83 THR -4.40 -0.40 1 84 VAL -2.80 -1.80 1 85 SER -3.50 -0.70 1 86 PHE -2.20 -3.00 1 87 GLU -4.10 -1.30 1 89 GLN 4.00 0.10 1 91 ARG -2.90 -0.30 1 92 LYS 0.30 -0.40 1 93 THR -0.60 -2.80 1 94 VAL -3.50 -1.30 1 95 VAL -2.70 -1.50 1 98 ILE -2.90 -0.60 1 100 HIS -7.20 1.20 1 101 PHE -8.20 -0.70 1 102 ARG -3.10 -0.60 1 103 PHE -3.80 0.90 1 106 ALA -0.70 0.30 1 109 VAL 3.40 -0.20 1 110 VAL -2.30 -0.70 1 111 SER -2.30 -1.70 1 112 MET -5.30 -1.50 1 114 ALA -4.10 -2.60 1 115 LEU 1.30 -2.60 1 116 PHE -0.70 -4.20 1 118 GLU 3.40 2.70 1 119 LYS 2.40 0.60 1 120 ASN -2.30 -3.00 1 121 ILE 0.50 -1.60 1 122 HIS -2.90 0.10 1 123 ALA -1.30 0.50 1 125 ALA -0.30 4.70 1 stop_ save_