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 bmr18029_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 -4.19 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.32 _LACS_plot.Line_2_terminator_val_x_2 8.80 _LACS_plot.Line_2_terminator_val_y_2 6.62 _LACS_plot.Y_axis_chem_shift_offset 0.78 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 THR -8.10 -3.40 0 10 LYS 0.40 -0.60 1 11 ARG -0.10 -0.80 1 12 ASP 0.10 -0.40 1 13 THR 0.00 -0.50 1 14 LYS 0.30 -0.50 1 15 PHE 0.50 0.00 1 16 ARG -0.20 -0.50 1 17 GLU 0.30 0.20 1 18 ASP 0.90 -1.60 1 22 ASP -1.10 -2.40 1 23 ARG 4.30 3.40 1 24 GLU 4.50 3.70 1 25 GLU 3.00 2.30 1 26 LEU 4.60 2.50 1 28 ARG 4.70 4.30 1 29 HIS 3.30 4.10 1 30 SER 5.20 4.50 1 31 TRP 2.70 1.80 1 32 ALA 5.00 1.90 1 33 VAL 6.40 4.90 1 34 LEU 4.60 3.10 1 35 HIS 8.80 3.90 1 36 THR 6.70 4.90 1 37 LEU 6.50 4.10 1 38 ALA 2.40 1.90 1 39 ALA 1.90 1.60 1 40 TYR 0.10 0.10 1 41 TYR -3.70 -2.80 1 43 ASP 4.50 3.80 1 44 LEU -3.20 -4.60 1 46 THR 0.30 -1.90 1 48 GLU 4.50 3.00 1 49 GLN 4.40 3.60 1 50 GLN 3.80 2.60 1 51 GLN 3.70 2.20 1 52 ASP 4.00 2.60 1 53 MET 4.60 0.90 1 54 ALA 5.00 2.50 1 55 GLN 4.70 2.50 1 56 PHE 6.20 4.90 1 57 ILE 4.30 0.30 1 58 HIS 4.40 5.20 1 59 LEU 2.70 2.80 1 60 PHE 5.60 4.10 1 61 SER 4.00 3.00 1 62 LYS 3.00 1.80 1 63 PHE -1.40 -0.70 1 64 TYR 0.80 -1.40 1 68 GLU 4.10 2.10 1 70 ALA 3.70 2.30 1 71 GLU 3.70 2.50 1 74 ARG 5.90 4.60 1 75 LYS 4.70 3.10 1 76 ARG 5.40 3.50 1 77 LEU 2.00 0.80 1 78 ALA 2.70 1.10 1 79 ARG -0.30 -0.50 1 80 ASN -0.50 -1.50 1 81 HIS -0.80 -1.10 1 84 THR 0.50 -2.90 1 85 ARG 3.80 4.00 1 87 ARG 5.60 5.20 1 88 ALA 4.70 3.00 1 89 ALA 3.10 1.70 1 90 PHE 1.40 1.80 1 91 THR 2.90 2.20 1 92 GLN 4.50 2.90 1 93 TRP 5.90 5.10 1 94 LEU 2.60 1.40 1 96 HIS 5.10 4.70 1 97 LEU 4.70 2.60 1 98 HIS 3.70 1.20 1 99 ASN 4.00 1.60 1 100 GLU 5.00 3.60 1 101 VAL 6.70 3.90 1 102 ASN 6.10 3.20 1 103 ARG 4.70 3.10 1 104 LYS 3.80 2.40 1 105 LEU -0.40 -1.30 1 107 LYS -1.60 -2.50 1 109 ASP 0.90 -0.10 1 110 PHE -2.30 -1.40 1 111 ASP 0.10 -1.90 1 113 SER 4.40 2.60 1 114 LYS 0.20 -1.50 1 115 VAL 5.40 4.20 1 116 ASP 5.00 2.50 1 117 GLU 2.40 2.90 1 118 ARG 0.90 0.20 1 119 TRP -3.00 -2.00 1 120 ARG 0.40 3.20 1 121 ASP 0.70 2.00 1 123 TRP -2.30 -1.70 1 124 LYS 3.40 1.90 1 125 ASP 1.10 -0.90 1 127 SER 3.90 2.40 1 129 ASP 2.10 2.10 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18029_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 3.91 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.09 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.32 _LACS_plot.Line_2_terminator_val_x_2 8.80 _LACS_plot.Line_2_terminator_val_y_2 -2.18 _LACS_plot.Y_axis_chem_shift_offset 0.78 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 THR -8.10 4.70 0 10 LYS 0.40 -1.00 1 11 ARG -0.10 -0.70 1 12 ASP 0.10 -0.50 1 13 THR 0.00 -0.50 1 14 LYS 0.30 -0.80 1 15 PHE 0.50 -0.50 1 16 ARG -0.20 -0.30 1 17 GLU 0.30 -0.10 1 18 ASP 0.90 -2.50 1 22 ASP -1.10 -1.30 1 23 ARG 4.30 -0.90 1 24 GLU 4.50 -0.80 1 25 GLU 3.00 -0.70 1 26 LEU 4.60 -2.10 1 28 ARG 4.70 -0.40 1 29 HIS 3.30 0.80 1 30 SER 5.20 -0.70 1 31 TRP 2.70 -0.90 1 32 ALA 5.00 -3.10 1 33 VAL 6.40 -1.50 1 34 LEU 4.60 -1.50 1 35 HIS 8.80 -4.90 1 36 THR 6.70 -1.80 1 37 LEU 6.50 -2.40 1 38 ALA 2.40 -0.50 1 39 ALA 1.90 -0.30 1 40 TYR 0.10 0.00 1 41 TYR -3.70 0.90 1 43 ASP 4.50 -0.70 1 44 LEU -3.20 -1.40 1 46 THR 0.30 -2.20 1 48 GLU 4.50 -1.50 1 49 GLN 4.40 -0.80 1 50 GLN 3.80 -1.20 1 51 GLN 3.70 -1.50 1 52 ASP 4.00 -1.40 1 53 MET 4.60 -3.70 1 54 ALA 5.00 -2.50 1 55 GLN 4.70 -2.20 1 56 PHE 6.20 -1.30 1 57 ILE 4.30 -4.00 1 58 HIS 4.40 0.80 1 59 LEU 2.70 0.10 1 60 PHE 5.60 -1.50 1 61 SER 4.00 -1.00 1 62 LYS 3.00 -1.20 1 63 PHE -1.40 0.70 1 64 TYR 0.80 -2.20 1 68 GLU 4.10 -2.00 1 70 ALA 3.70 -1.40 1 71 GLU 3.70 -1.20 1 74 ARG 5.90 -1.30 1 75 LYS 4.70 -1.60 1 76 ARG 5.40 -1.90 1 77 LEU 2.00 -1.20 1 78 ALA 2.70 -1.60 1 79 ARG -0.30 -0.20 1 80 ASN -0.50 -1.00 1 81 HIS -0.80 -0.30 1 84 THR 0.50 -3.40 1 85 ARG 3.80 0.20 1 87 ARG 5.60 -0.40 1 88 ALA 4.70 -1.70 1 89 ALA 3.10 -1.40 1 90 PHE 1.40 0.40 1 91 THR 2.90 -0.70 1 92 GLN 4.50 -1.60 1 93 TRP 5.90 -0.80 1 94 LEU 2.60 -1.20 1 96 HIS 5.10 -0.40 1 97 LEU 4.70 -2.10 1 98 HIS 3.70 -2.50 1 99 ASN 4.00 -2.40 1 100 GLU 5.00 -1.40 1 101 VAL 6.70 -2.80 1 102 ASN 6.10 -2.90 1 103 ARG 4.70 -1.60 1 104 LYS 3.80 -1.40 1 105 LEU -0.40 -0.90 1 107 LYS -1.60 -0.90 1 109 ASP 0.90 -1.00 1 110 PHE -2.30 0.90 1 111 ASP 0.10 -2.00 1 113 SER 4.40 -1.80 1 114 LYS 0.20 -1.70 1 115 VAL 5.40 -1.20 1 116 ASP 5.00 -2.50 1 117 GLU 2.40 0.50 1 118 ARG 0.90 -0.70 1 119 TRP -3.00 1.00 1 120 ARG 0.40 2.80 1 121 ASP 0.70 1.30 1 123 TRP -2.30 0.60 1 124 LYS 3.40 -1.50 1 125 ASP 1.10 -2.00 1 127 SER 3.90 -1.50 1 129 ASP 2.10 0.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18029_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 0.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.23 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.09 _LACS_plot.Line_2_terminator_val_x_2 8.80 _LACS_plot.Line_2_terminator_val_y_2 -0.77 _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 86 THR -8.10 0.12 0 10 LYS 0.40 -0.07 1 11 ARG -0.10 -0.03 1 12 ASP 0.10 -0.05 1 13 THR 0.00 -0.12 1 14 LYS 0.30 -0.07 1 15 PHE 0.50 -0.08 1 16 ARG -0.20 -0.03 1 17 GLU 0.30 -0.14 1 18 ASP 0.90 -0.20 1 22 ASP -1.10 -0.11 1 23 ARG 4.30 -0.47 1 24 GLU 4.50 -0.25 1 25 GLU 3.00 -0.45 1 26 LEU 4.60 -0.11 1 28 ARG 4.70 0.19 1 29 HIS 3.30 -0.09 1 30 SER 5.20 -0.41 1 31 TRP 2.70 -0.53 1 32 ALA 5.00 -0.55 1 33 VAL 6.40 -0.80 1 34 LEU 4.60 -0.74 1 35 HIS 8.80 -1.14 1 36 THR 6.70 -0.26 1 37 LEU 6.50 -0.68 1 38 ALA 2.40 -0.46 1 39 ALA 1.90 -0.69 1 40 TYR 0.10 -0.27 1 41 TYR -3.70 0.19 1 43 ASP 4.50 -0.19 1 44 LEU -3.20 0.64 1 46 THR 0.30 0.17 1 48 GLU 4.50 -0.47 1 49 GLN 4.40 -0.12 1 50 GLN 3.80 -0.20 1 51 GLN 3.70 -0.32 1 52 ASP 4.00 -0.17 1 53 MET 4.60 -0.10 1 54 ALA 5.00 -0.85 1 55 GLN 4.70 -0.06 1 56 PHE 6.20 -0.55 1 57 ILE 4.30 -0.61 1 58 HIS 4.40 -0.64 1 59 LEU 2.70 -0.60 1 60 PHE 5.60 -1.15 1 61 SER 4.00 -0.67 1 62 LYS 3.00 -0.51 1 63 PHE -1.40 -0.04 1 64 TYR 0.80 -0.85 1 70 ALA 3.70 -0.42 1 71 GLU 3.70 -0.14 1 74 ARG 5.90 -0.53 1 75 LYS 4.70 -0.31 1 76 ARG 5.40 -0.33 1 77 LEU 2.00 0.00 1 78 ALA 2.70 -0.17 1 79 ARG -0.30 0.07 1 80 ASN -0.50 0.13 1 81 HIS -0.80 -0.01 1 84 THR 0.50 -0.52 1 85 ARG 3.80 -0.65 1 87 ARG 5.60 -0.12 1 88 ALA 4.70 -0.43 1 89 ALA 3.10 -0.23 1 90 PHE 1.40 0.54 1 91 THR 2.90 -0.60 1 92 GLN 4.50 -0.48 1 93 TRP 5.90 -0.55 1 94 LEU 2.60 -0.97 1 96 HIS 5.10 -0.32 1 97 LEU 4.70 -0.61 1 98 HIS 3.70 -1.22 1 99 ASN 4.00 0.02 1 100 GLU 5.00 -0.47 1 101 VAL 6.70 -0.83 1 102 ASN 6.10 -0.75 1 103 ARG 4.70 -0.38 1 104 LYS 3.80 -0.34 1 105 LEU -0.40 0.01 1 107 LYS -1.60 0.16 1 109 ASP 0.90 -0.45 1 110 PHE -2.30 -0.77 1 111 ASP 0.10 -0.47 1 113 SER 4.40 -0.07 1 114 LYS 0.20 0.31 1 115 VAL 5.40 -0.26 1 116 ASP 5.00 -0.10 1 117 GLU 2.40 -0.98 1 118 ARG 0.90 0.07 1 119 TRP -3.00 0.32 1 120 ARG 0.40 0.21 1 121 ASP 0.70 -0.20 1 123 TRP -2.30 0.14 1 124 LYS 3.40 -0.24 1 125 ASP 1.10 -0.26 1 127 SER 3.90 -0.42 1 129 ASP 2.10 -0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr18029_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.10 _LACS_plot.Line_1_terminator_val_y_1 -5.43 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.48 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.71 _LACS_plot.Line_2_terminator_val_x_2 8.80 _LACS_plot.Line_2_terminator_val_y_2 4.10 _LACS_plot.Y_axis_chem_shift_offset 0.66 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 86 THR -8.10 -0.10 0 12 ASP 0.10 -0.20 1 13 THR 0.00 -0.60 1 14 LYS 0.30 -0.60 1 15 PHE 0.50 -0.50 1 16 ARG -0.20 -0.60 1 17 GLU 0.30 -0.60 1 18 ASP 0.90 -1.90 1 22 ASP -1.10 -0.90 1 23 ARG 4.30 3.00 1 24 GLU 4.50 0.90 1 25 GLU 3.00 2.30 1 26 LEU 4.60 2.60 1 28 ARG 4.70 4.70 1 29 HIS 3.30 3.20 1 31 TRP 2.70 1.10 1 32 ALA 5.00 2.70 1 33 VAL 6.40 0.50 1 34 LEU 4.60 0.40 1 35 HIS 8.80 4.60 1 37 LEU 6.50 2.50 1 38 ALA 2.40 -1.00 1 39 ALA 1.90 0.80 1 40 TYR 0.10 -2.60 1 41 TYR -3.70 -3.40 1 43 ASP 4.50 0.90 1 44 LEU -3.20 -4.30 1 46 THR 0.30 -0.80 1 48 GLU 4.50 1.50 1 49 GLN 4.40 2.20 1 50 GLN 3.80 4.30 1 51 GLN 3.70 2.40 1 52 ASP 4.00 1.90 1 53 MET 4.60 0.90 1 54 ALA 5.00 1.20 1 55 GLN 4.70 1.50 1 56 PHE 6.20 0.40 1 57 ILE 4.30 1.40 1 58 HIS 4.40 5.90 1 59 LEU 2.70 0.80 1 60 PHE 5.60 1.20 1 61 SER 4.00 -1.10 1 62 LYS 3.00 0.90 1 63 PHE -1.40 -1.40 1 64 TYR 0.80 0.00 1 68 GLU 4.10 1.70 1 70 ALA 3.70 0.80 1 71 GLU 3.70 1.90 1 74 ARG 5.90 3.40 1 75 LYS 4.70 2.90 1 76 ARG 5.40 3.10 1 77 LEU 2.00 0.50 1 78 ALA 2.70 0.80 1 79 ARG -0.30 -0.90 1 80 ASN -0.50 -2.90 1 81 HIS -0.80 -1.00 1 84 THR 0.50 1.50 1 85 ARG 3.80 -1.40 1 87 ARG 5.60 2.50 1 88 ALA 4.70 0.90 1 89 ALA 3.10 3.10 1 90 PHE 1.40 2.20 1 91 THR 2.90 5.00 1 92 GLN 4.50 0.40 1 93 TRP 5.90 2.50 1 94 LEU 2.60 0.70 1 96 HIS 5.10 4.10 1 97 LEU 4.70 0.40 1 98 HIS 3.70 3.50 1 99 ASN 4.00 2.20 1 100 GLU 5.00 3.10 1 101 VAL 6.70 0.60 1 102 ASN 6.10 2.10 1 103 ARG 4.70 3.80 1 104 LYS 3.80 0.90 1 105 LEU -0.40 -0.80 1 107 LYS -1.60 -3.30 1 109 ASP 0.90 0.00 1 110 PHE -2.30 -1.10 1 111 ASP 0.10 -0.70 1 113 SER 4.40 1.60 1 114 LYS 0.20 0.90 1 115 VAL 5.40 1.50 1 116 ASP 5.00 2.20 1 117 GLU 2.40 0.10 1 118 ARG 0.90 0.40 1 119 TRP -3.00 -1.80 1 120 ARG 0.40 -1.30 1 121 ASP 0.70 0.40 1 123 TRP -2.30 3.20 1 124 LYS 3.40 -0.40 1 125 ASP 1.10 1.10 1 129 ASP 2.10 4.60 1 stop_ save_