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 bmr27497_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -3.20 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 1.07 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.98 _LACS_plot.Line_2_terminator_val_x_2 5.50 _LACS_plot.Line_2_terminator_val_y_2 3.70 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 GLU -4.10 2.20 0 40 PHE 3.80 -1.30 0 11 VAL 0.20 0.10 1 12 THR 0.80 1.60 1 15 GLN -0.80 0.60 1 16 LYS 0.20 -0.20 1 17 GLU -0.90 -0.40 1 18 LYS 0.60 0.60 1 19 GLN -2.50 1.70 1 22 ASP -4.80 -1.70 1 23 ILE 0.60 0.50 1 24 VAL -0.70 -0.90 1 25 LEU -2.50 0.10 1 26 TYR 1.40 1.10 1 30 VAL -5.00 -0.80 1 31 ARG -2.50 -1.20 1 32 VAL -6.40 -3.30 1 33 LEU -1.90 -1.10 1 34 GLU 1.70 1.80 1 36 GLU -0.80 -0.20 1 37 THR -0.70 -0.10 1 38 ALA -5.60 -2.10 1 39 ARG -1.50 -0.50 1 41 ARG -4.20 -1.20 1 43 ARG -4.70 -0.30 1 44 VAL -4.00 -2.40 1 45 THR -1.50 1.40 1 47 TYR -2.90 -0.10 1 49 GLN -0.70 -0.90 1 51 LYS -1.80 -1.20 1 52 VAL -6.20 -1.50 1 53 ASN -5.90 -2.40 1 54 TRP -5.40 -1.70 1 55 TYR -3.50 -1.80 1 56 LEU 3.80 2.30 1 57 ASN -1.90 -1.40 1 59 GLN 1.30 1.10 1 60 LEU 2.10 0.80 1 61 ILE -3.60 -2.20 1 62 ARG 2.20 1.90 1 63 LYS -2.30 -0.80 1 64 SER 1.00 0.80 1 66 ARG -3.00 -2.40 1 67 PHE -0.90 -1.10 1 68 ARG -3.50 -1.50 1 69 VAL -4.60 -0.90 1 70 ARG -3.50 -1.00 1 71 TYR -2.30 -1.50 1 72 ASP -1.00 -0.20 1 74 ILE -0.50 2.80 1 75 HIS -3.20 -0.40 1 76 TYR -2.00 -1.60 1 77 LEU -3.60 -1.70 1 78 ASP -0.20 -0.10 1 79 ILE -0.80 -0.60 1 80 VAL 2.00 -0.40 1 81 ASP -5.30 -3.50 1 83 LYS 5.50 3.80 1 84 SER 1.40 -1.00 1 85 TYR 1.80 2.00 1 86 ASP 1.60 2.50 1 87 THR -5.90 -1.40 1 89 GLU -1.10 -0.90 1 90 VAL -6.90 -2.90 1 91 LYS -6.30 -4.10 1 92 VAL -4.70 -2.70 1 93 THR -5.60 -2.80 1 94 ALA -7.00 -2.00 1 95 GLU -0.30 0.60 1 96 ASN -2.00 -1.50 1 98 GLU -5.20 -2.50 1 100 VAL -5.10 -1.80 1 101 ILE -7.80 -2.90 1 103 HIS -3.70 -1.30 1 104 LYS -7.20 -3.40 1 105 VAL -0.60 0.60 1 106 LYS -3.90 -1.70 1 107 LEU -4.40 -1.30 1 108 GLU -1.40 -2.90 1 109 ILE -2.00 -0.90 1 110 GLN -0.80 0.10 1 111 GLN 0.50 0.60 1 112 LEU -3.50 -0.90 1 113 GLU -1.80 1.80 1 118 HIS 0.70 2.60 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27497_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 4.60 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.92 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.02 _LACS_plot.Line_2_terminator_val_x_2 5.50 _LACS_plot.Line_2_terminator_val_y_2 -1.80 _LACS_plot.Y_axis_chem_shift_offset -0.23 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 GLU -4.10 6.30 0 40 PHE 3.80 -5.10 0 11 VAL 0.20 -0.10 1 12 THR 0.80 0.80 1 15 GLN -0.80 1.40 1 16 LYS 0.20 -0.40 1 17 GLU -0.90 0.50 1 18 LYS 0.60 0.00 1 19 GLN -2.50 4.20 1 22 ASP -4.80 3.10 1 23 ILE 0.60 -0.10 1 24 VAL -0.70 -0.20 1 25 LEU -2.50 2.60 1 26 TYR 1.40 -0.30 1 30 VAL -5.00 4.20 1 31 ARG -2.50 1.30 1 32 VAL -6.40 3.10 1 33 LEU -1.90 0.80 1 34 GLU 1.70 0.10 1 36 GLU -0.80 0.60 1 37 THR -0.70 0.60 1 38 ALA -5.60 3.50 1 39 ARG -1.50 1.00 1 41 ARG -4.20 3.00 1 43 ARG -4.70 4.40 1 44 VAL -4.00 1.60 1 45 THR -1.50 2.90 1 47 TYR -2.90 2.80 1 49 GLN -0.70 -0.20 1 51 LYS -1.80 0.60 1 52 VAL -6.20 4.70 1 53 ASN -5.90 3.50 1 54 TRP -5.40 3.70 1 55 TYR -3.50 1.70 1 56 LEU 3.80 -1.50 1 57 ASN -1.90 0.50 1 59 GLN 1.30 -0.20 1 60 LEU 2.10 -1.30 1 61 ILE -3.60 1.40 1 62 ARG 2.20 -0.30 1 63 LYS -2.30 1.50 1 64 SER 1.00 -0.20 1 66 ARG -3.00 0.60 1 67 PHE -0.90 -0.20 1 68 ARG -3.50 2.00 1 69 VAL -4.60 3.70 1 70 ARG -3.50 2.50 1 71 TYR -2.30 0.80 1 72 ASP -1.00 0.80 1 74 ILE -0.50 3.30 1 75 HIS -3.20 2.80 1 76 TYR -2.00 0.40 1 77 LEU -3.60 1.90 1 78 ASP -0.20 0.10 1 79 ILE -0.80 0.20 1 80 VAL 2.00 -2.40 1 81 ASP -5.30 1.80 1 83 LYS 5.50 -1.70 1 84 SER 1.40 -2.40 1 85 TYR 1.80 0.20 1 86 ASP 1.60 0.90 1 87 THR -5.90 4.50 1 89 GLU -1.10 0.20 1 90 VAL -6.90 4.00 1 91 LYS -6.30 2.20 1 92 VAL -4.70 2.00 1 93 THR -5.60 2.80 1 94 ALA -7.00 5.00 1 95 GLU -0.30 0.90 1 96 ASN -2.00 0.50 1 98 GLU -5.20 2.70 1 100 VAL -5.10 3.30 1 101 ILE -7.80 4.90 1 103 HIS -3.70 2.40 1 104 LYS -7.20 3.80 1 105 VAL -0.60 1.20 1 106 LYS -3.90 2.20 1 107 LEU -4.40 3.10 1 108 GLU -1.40 -1.50 1 109 ILE -2.00 1.10 1 110 GLN -0.80 0.90 1 111 GLN 0.50 0.10 1 112 LEU -3.50 2.60 1 113 GLU -1.80 3.60 1 118 HIS 0.70 1.90 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27497_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 0.96 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.14 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.31 _LACS_plot.Line_2_terminator_val_x_2 5.50 _LACS_plot.Line_2_terminator_val_y_2 -0.53 _LACS_plot.Y_axis_chem_shift_offset -0.09 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 83 LYS 5.50 0.29 0 19 GLN -2.50 0.09 1 22 ASP -4.80 0.13 1 23 ILE 0.60 -0.17 1 24 VAL -0.70 0.23 1 25 LEU -2.50 0.39 1 26 TYR 1.40 -0.59 1 30 VAL -5.00 0.30 1 31 ARG -2.50 1.28 1 32 VAL -6.40 0.61 1 33 LEU -1.90 0.31 1 34 GLU 1.70 -0.78 1 36 GLU -0.80 0.13 1 37 THR -0.70 0.92 1 38 ALA -5.60 0.10 1 39 ARG -1.50 0.90 1 40 PHE 3.80 0.32 1 41 ARG -4.20 1.29 1 43 ARG -4.70 0.86 1 44 VAL -4.00 0.41 1 45 THR -1.50 -0.46 1 47 TYR -2.90 0.37 1 49 GLN -0.70 0.10 1 51 LYS -1.80 0.75 1 52 VAL -6.20 0.12 1 53 ASN -5.90 0.79 1 54 TRP -5.40 0.56 1 55 TYR -3.50 0.88 1 56 LEU 3.80 -0.15 1 57 ASN -1.90 0.32 1 59 GLN 1.30 -0.84 1 60 LEU 2.10 -0.57 1 61 ILE -3.60 0.19 1 62 ARG 2.20 0.03 1 63 LYS -2.30 0.20 1 64 SER 1.00 -0.03 1 66 ARG -3.00 0.71 1 67 PHE -0.90 0.45 1 68 ARG -3.50 0.94 1 69 VAL -4.60 0.66 1 70 ARG -3.50 1.19 1 71 TYR -2.30 -0.20 1 72 ASP -1.00 -0.16 1 74 ILE -0.50 0.41 1 75 HIS -3.20 0.76 1 76 TYR -2.00 0.51 1 77 LEU -3.60 0.14 1 78 ASP -0.20 0.45 1 79 ILE -0.80 -0.01 1 80 VAL 2.00 -0.73 1 81 ASP -5.30 0.30 1 84 SER 1.40 0.15 1 85 TYR 1.80 0.04 1 86 ASP 1.60 -0.51 1 87 THR -5.90 0.61 1 89 GLU -1.10 0.78 1 90 VAL -6.90 1.12 1 91 LYS -6.30 1.01 1 92 VAL -4.70 0.89 1 93 THR -5.60 0.88 1 94 ALA -7.00 1.04 1 95 GLU -0.30 -0.24 1 96 ASN -2.00 0.02 1 98 GLU -5.20 1.11 1 100 VAL -5.10 0.56 1 101 ILE -7.80 1.25 1 102 GLU -4.10 0.07 1 103 HIS -3.70 1.03 1 104 LYS -7.20 0.63 1 105 VAL -0.60 0.35 1 106 LYS -3.90 0.93 1 107 LEU -4.40 0.33 1 108 GLU -1.40 0.68 1 109 ILE -2.00 0.08 1 110 GLN -0.80 0.02 1 111 GLN 0.50 -0.14 1 112 LEU -1.80 -0.20 1 118 HIS 0.70 -0.41 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27497_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.80 _LACS_plot.Line_1_terminator_val_y_1 -2.39 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -0.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.17 _LACS_plot.Line_2_terminator_val_x_2 5.50 _LACS_plot.Line_2_terminator_val_y_2 0.23 _LACS_plot.Y_axis_chem_shift_offset 0.80 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 118 HIS 0.70 5.60 0 11 VAL 0.20 -2.40 1 16 LYS 0.20 -0.80 1 17 GLU -0.90 -0.50 1 18 LYS 0.60 0.00 1 19 GLN -2.50 1.00 1 22 ASP -4.80 -1.40 1 23 ILE 0.60 -2.50 1 24 VAL -0.70 -0.60 1 25 LEU -2.50 -2.60 1 26 TYR 1.40 -0.50 1 30 VAL -5.00 -2.20 1 31 ARG -2.50 -0.90 1 32 VAL -6.40 -1.80 1 33 LEU -1.90 -0.70 1 34 GLU 1.70 0.10 1 36 GLU -0.80 -1.80 1 37 THR -0.70 -1.40 1 38 ALA -5.60 -2.90 1 39 ARG -1.50 -1.30 1 40 PHE 3.80 -0.70 1 41 ARG -4.20 -1.60 1 43 ARG -4.70 -1.60 1 44 VAL -4.00 -1.50 1 45 THR -1.50 -1.90 1 47 TYR -2.90 -0.40 1 49 GLN -0.70 -0.10 1 51 LYS -1.80 -1.70 1 52 VAL -6.20 -3.80 1 53 ASN -5.90 -1.30 1 54 TRP -5.40 -1.10 1 55 TYR -3.50 -0.80 1 56 LEU 3.80 0.60 1 57 ASN -1.90 -0.90 1 59 GLN 1.30 -0.90 1 60 LEU 2.10 -1.20 1 61 ILE -3.60 -1.30 1 62 ARG 2.20 -0.20 1 63 LYS -2.30 1.60 1 64 SER 1.00 -2.30 1 66 ARG -3.00 -1.20 1 67 PHE -0.90 -1.00 1 68 ARG -3.50 -0.50 1 69 VAL -4.60 -2.00 1 70 ARG -3.50 -1.20 1 71 TYR -2.30 -0.40 1 72 ASP -1.00 -2.60 1 74 ILE -0.50 0.50 1 75 HIS -3.20 -1.10 1 76 TYR -2.00 -3.60 1 77 LEU -3.60 -1.60 1 78 ASP -0.20 -1.60 1 79 ILE -0.80 -1.10 1 80 VAL 2.00 -0.90 1 81 ASP -5.30 1.70 1 83 LYS 5.50 1.50 1 84 SER 1.40 0.30 1 85 TYR 1.80 -2.40 1 86 ASP 1.60 0.30 1 87 THR -5.90 -1.60 1 89 GLU -1.10 -2.60 1 90 VAL -6.90 -2.90 1 91 LYS -6.30 -2.80 1 92 VAL -4.70 -1.90 1 93 THR -5.60 -2.70 1 94 ALA -7.00 -2.00 1 95 GLU -0.30 0.10 1 96 ASN -2.00 0.20 1 98 GLU -5.20 -2.00 1 100 VAL -5.10 -4.60 1 101 ILE -7.80 -1.80 1 102 GLU -4.10 -1.30 1 103 HIS -3.70 -2.00 1 104 LYS -7.20 -2.20 1 105 VAL -0.60 -2.20 1 106 LYS -3.90 -2.70 1 107 LEU -4.40 -3.30 1 108 GLU -1.40 -0.40 1 109 ILE -2.00 -1.30 1 110 GLN -0.80 0.10 1 111 GLN 0.50 -0.40 1 112 LEU -3.50 0.60 1 113 GLU -1.80 0.10 1 stop_ save_