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 bmr16517_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -2.56 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.01 _LACS_plot.Line_2_terminator_val_x_2 9.40 _LACS_plot.Line_2_terminator_val_y_2 6.94 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 114 TYR 9.40 3.80 0 100 GLU -7.00 -1.30 0 10 TYR -2.90 -1.40 1 12 ILE -4.00 -1.80 1 13 LYS 2.50 3.00 1 14 ASN 2.20 -0.40 1 16 ASP 3.00 3.30 1 17 THR 7.20 5.60 1 18 MET 2.10 0.60 1 19 LYS 4.40 3.80 1 20 LYS 3.60 3.30 1 21 ALA 2.00 1.90 1 22 ARG 4.70 4.50 1 23 ILE 4.70 3.90 1 24 TRP 5.00 5.60 1 25 LEU 5.80 4.60 1 26 GLU 4.00 2.90 1 27 ASP 3.30 2.20 1 28 HIS 3.20 1.70 1 30 ILE -0.40 -1.10 1 31 ASP -0.10 0.40 1 32 TYR -4.70 -1.80 1 33 THR -1.00 0.00 1 34 PHE -4.10 -3.80 1 35 HIS -1.80 -0.10 1 36 ASP -4.40 -3.30 1 37 TYR 0.50 0.80 1 38 LYS 3.00 1.50 1 39 LYS -0.20 1.30 1 40 GLU 1.90 1.30 1 42 LEU -1.60 -0.60 1 43 ASP -3.70 -2.60 1 44 ALA 3.90 2.90 1 45 GLU 3.90 3.20 1 46 THR 6.90 4.80 1 47 LEU 3.70 2.80 1 48 ASP 5.30 3.30 1 49 ARG 5.60 4.30 1 50 PHE 2.50 -0.20 1 51 LEU 0.82 0.82 1 52 LYS 2.90 2.50 1 53 THR -0.20 0.80 1 54 VAL -1.60 -0.70 1 56 TRP 5.70 3.50 1 57 GLU 5.30 3.60 1 58 GLN 0.10 0.30 1 59 LEU -1.80 0.50 1 60 LEU -0.20 0.30 1 61 ASN 0.30 -1.80 1 62 ARG 2.30 1.60 1 63 ALA -0.90 -0.70 1 65 THR 4.50 3.70 1 66 THR 7.00 5.20 1 67 PHE 3.60 3.80 1 68 ARG 3.90 3.20 1 69 LYS 0.60 0.50 1 70 LEU 1.40 0.70 1 72 GLU 3.90 3.90 1 73 ASP 4.30 2.50 1 74 VAL 3.60 2.80 1 75 ARG 3.40 3.60 1 76 SER 2.50 2.20 1 77 ASN -1.40 -0.50 1 78 VAL 2.20 1.40 1 79 ASP -3.40 -2.70 1 80 ALA 3.60 3.10 1 81 ALA 3.10 2.30 1 82 SER 3.10 2.00 1 83 ALA 2.80 3.10 1 84 ARG 5.10 4.10 1 85 GLU 3.20 2.60 1 86 LEU 3.20 3.00 1 87 MET 3.20 4.60 1 88 LEU 2.50 1.90 1 89 ALA 1.50 1.60 1 90 GLN -2.40 -0.30 1 92 SER 5.00 3.70 1 93 MET -0.60 1.50 1 94 VAL 2.10 0.90 1 95 LYS 2.20 2.60 1 96 ARG -5.50 -1.30 1 98 VAL 1.10 1.80 1 99 LEU -4.20 -0.80 1 101 ARG -0.90 0.70 1 102 ASP 1.70 1.10 1 104 LYS -0.20 -0.70 1 105 LEU -3.80 -0.80 1 106 MET -3.70 -0.10 1 107 VAL -1.30 -0.80 1 109 PHE -1.30 1.20 1 110 LYS -2.90 -0.70 1 112 ALA 2.70 2.40 1 113 GLN 4.70 4.40 1 115 GLU 3.40 3.50 1 116 ALA 3.00 2.10 1 117 TYR 2.80 3.20 1 118 PHE 0.65 0.15 1 119 LYS 3.00 1.10 1 120 LEU 0.20 1.40 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16517_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 4.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.85 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.99 _LACS_plot.Line_2_terminator_val_x_2 9.40 _LACS_plot.Line_2_terminator_val_y_2 -2.46 _LACS_plot.Y_axis_chem_shift_offset -0.35 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 114 TYR 9.40 -5.60 0 100 GLU -7.00 5.70 0 10 TYR -2.90 1.50 1 12 ILE -4.00 2.20 1 13 LYS 2.50 0.50 1 14 ASN 2.20 -2.60 1 16 ASP 3.00 0.30 1 17 THR 7.20 -1.60 1 18 MET 2.10 -1.50 1 19 LYS 4.40 -0.60 1 20 LYS 3.60 -0.30 1 21 ALA 2.00 -0.10 1 22 ARG 4.70 -0.20 1 23 ILE 4.70 -0.80 1 24 TRP 5.00 0.60 1 25 LEU 5.80 -1.20 1 26 GLU 4.00 -1.10 1 27 ASP 3.30 -1.10 1 28 HIS 3.20 -1.50 1 30 ILE -0.40 -0.70 1 31 ASP -0.10 0.50 1 32 TYR -4.70 2.90 1 33 THR -1.00 1.00 1 34 PHE -4.10 0.30 1 35 HIS -1.80 1.70 1 36 ASP -4.40 1.10 1 37 TYR 0.50 0.30 1 38 LYS 3.00 -1.50 1 39 LYS -0.20 1.50 1 40 GLU 1.90 -0.60 1 42 LEU -1.60 1.00 1 43 ASP -3.70 1.10 1 44 ALA 3.90 -1.00 1 45 GLU 3.90 -0.70 1 46 THR 6.90 -2.10 1 47 LEU 3.70 -0.90 1 48 ASP 5.30 -2.00 1 49 ARG 5.60 -1.30 1 50 PHE 2.50 -2.70 1 51 LEU 0.82 0.00 1 52 LYS 2.90 -0.40 1 53 THR -0.20 1.00 1 54 VAL -1.60 0.90 1 56 TRP 5.70 -2.20 1 57 GLU 5.30 -1.70 1 58 GLN 0.10 0.20 1 59 LEU -1.80 2.30 1 60 LEU -0.20 0.50 1 61 ASN 0.30 -2.10 1 62 ARG 2.30 -0.70 1 63 ALA -0.90 0.20 1 65 THR 4.50 -0.80 1 66 THR 7.00 -1.80 1 67 PHE 3.60 0.20 1 68 ARG 3.90 -0.70 1 69 LYS 0.60 -0.10 1 70 LEU 1.40 -0.70 1 72 GLU 3.90 0.00 1 73 ASP 4.30 -1.80 1 74 VAL 3.60 -0.80 1 75 ARG 3.40 0.20 1 76 SER 2.50 -0.30 1 77 ASN -1.40 0.90 1 78 VAL 2.20 -0.80 1 79 ASP -3.40 0.70 1 80 ALA 3.60 -0.50 1 81 ALA 3.10 -0.80 1 82 SER 3.10 -1.10 1 83 ALA 2.80 0.30 1 84 ARG 5.10 -1.00 1 85 GLU 3.20 -0.60 1 86 LEU 3.20 -0.20 1 87 MET 3.20 1.40 1 88 LEU 2.50 -0.60 1 89 ALA 1.50 0.10 1 90 GLN -2.40 2.10 1 92 SER 5.00 -1.30 1 93 MET -0.60 2.10 1 94 VAL 2.10 -1.20 1 95 LYS 2.20 0.40 1 96 ARG -5.50 4.20 1 98 VAL 1.10 0.70 1 99 LEU -4.20 3.40 1 101 ARG -0.90 1.60 1 102 ASP 1.70 -0.60 1 104 LYS -0.20 -0.50 1 105 LEU -3.80 3.00 1 106 MET -3.70 3.60 1 107 VAL -1.30 0.50 1 109 PHE -1.30 2.50 1 110 LYS -2.90 2.20 1 112 ALA 2.70 -0.30 1 113 GLN 4.70 -0.30 1 115 GLU 3.40 0.10 1 116 ALA 3.00 -0.90 1 117 TYR 2.80 0.40 1 118 PHE 0.65 -0.50 1 119 LYS 3.00 -1.90 1 120 LEU 0.20 1.20 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16517_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 0.90 _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 0.28 _LACS_plot.Line_2_terminator_val_x_2 9.40 _LACS_plot.Line_2_terminator_val_y_2 -1.01 _LACS_plot.Y_axis_chem_shift_offset -0.05 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 80 ALA 3.60 -1.90 0 21 ALA 2.00 -1.78 0 10 TYR -2.90 0.86 1 12 ILE -4.00 1.16 1 13 LYS 2.50 -0.23 1 14 ASN 2.20 -0.05 1 16 ASP 3.00 -0.18 1 17 THR 7.20 -0.35 1 18 MET 2.10 -0.49 1 19 LYS 4.40 -0.52 1 20 LYS 3.60 -0.53 1 22 ARG 4.70 -0.85 1 23 ILE 4.70 -0.46 1 24 TRP 5.00 -0.39 1 25 LEU 5.80 -0.34 1 26 GLU 4.00 -0.15 1 27 ASP 3.30 -0.37 1 28 HIS 3.20 -0.48 1 30 ILE -0.40 -0.13 1 31 ASP -0.10 0.01 1 32 TYR -4.70 0.95 1 33 THR -1.00 0.12 1 34 PHE -4.10 0.90 1 35 HIS -1.80 -0.49 1 36 ASP -4.40 -0.17 1 38 LYS 3.00 -0.02 1 39 LYS -0.20 0.10 1 40 GLU 1.90 -0.07 1 42 LEU -1.60 0.61 1 43 ASP -3.70 0.16 1 44 ALA 3.90 -0.54 1 45 GLU 3.90 -0.43 1 46 THR 6.90 -0.85 1 47 LEU 3.70 -0.83 1 48 ASP 5.30 -0.15 1 49 ARG 5.60 -0.23 1 50 PHE 2.50 -0.07 1 52 LYS 2.90 -0.14 1 53 THR -0.20 0.22 1 54 VAL -1.60 0.10 1 56 TRP 5.70 -0.67 1 57 GLU 5.30 -1.08 1 58 GLN 0.10 -0.17 1 59 LEU -1.80 -0.12 1 60 LEU -0.20 0.07 1 62 ARG 2.30 -0.89 1 63 ALA -0.90 0.14 1 65 THR 4.50 -0.47 1 66 THR 7.00 -0.53 1 67 PHE 3.60 -0.49 1 68 ARG 3.90 -0.55 1 69 LYS 0.60 -0.13 1 70 LEU 1.40 -0.33 1 72 GLU 3.90 -0.70 1 73 ASP 4.30 -0.35 1 74 VAL 3.60 -0.38 1 75 ARG 3.40 -0.55 1 76 SER 2.50 -0.09 1 77 ASN -1.40 0.27 1 78 VAL 2.20 -0.27 1 79 ASP -3.40 -0.26 1 81 ALA 3.10 -0.29 1 82 SER 3.10 -0.23 1 83 ALA 2.80 -0.50 1 84 ARG 5.10 -0.60 1 85 GLU 3.20 -0.46 1 86 LEU 3.20 -0.31 1 87 MET 3.20 -0.80 1 88 LEU 2.50 -0.45 1 89 ALA 1.50 -0.11 1 92 SER 5.00 -0.16 1 93 MET -0.60 0.08 1 94 VAL 2.10 -0.04 1 95 LYS 2.20 -0.38 1 98 VAL 1.10 0.34 1 99 LEU -4.20 1.07 1 100 GLU -7.00 0.70 1 102 ASP 1.70 -0.19 1 104 LYS -0.20 0.33 1 105 LEU -3.80 1.08 1 106 MET -3.70 0.10 1 107 VAL -1.30 0.57 1 112 ALA 2.70 -0.18 1 113 GLN 4.70 -0.21 1 114 TYR 9.40 -0.75 1 115 GLU 3.40 -0.19 1 116 ALA 3.00 -0.11 1 117 TYR 2.80 -0.66 1 119 LYS 3.00 -0.11 1 120 LEU 0.20 -0.04 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16517_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.00 _LACS_plot.Line_1_terminator_val_y_1 -2.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.59 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.82 _LACS_plot.Line_2_terminator_val_x_2 9.40 _LACS_plot.Line_2_terminator_val_y_2 2.93 _LACS_plot.Y_axis_chem_shift_offset 0.18 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 54 VAL -1.60 4.50 0 10 TYR -2.90 1.60 1 12 ILE -4.00 -1.30 1 13 LYS 2.50 1.20 1 14 ASN 2.20 -2.10 1 16 ASP 3.00 1.70 1 17 THR 7.20 1.30 1 18 MET 2.10 2.00 1 20 LYS 3.60 1.90 1 21 ALA 2.00 0.90 1 22 ARG 4.70 1.90 1 23 ILE 4.70 0.80 1 24 TRP 5.00 0.00 1 25 LEU 5.80 1.00 1 26 GLU 4.00 4.60 1 27 ASP 3.30 1.10 1 28 HIS 3.20 -0.50 1 30 ILE -0.40 -0.90 1 31 ASP -0.10 -0.50 1 32 TYR -4.70 -2.10 1 33 THR -1.00 -1.80 1 36 ASP -4.40 2.20 1 37 TYR 0.50 2.80 1 42 LEU -1.60 -3.80 1 43 ASP -3.70 -0.90 1 44 ALA 3.90 0.30 1 45 GLU 3.90 2.70 1 46 THR 6.90 -0.40 1 47 LEU 3.70 0.40 1 48 ASP 5.30 2.80 1 49 ARG 5.60 3.80 1 50 PHE 2.50 2.60 1 52 LYS 2.90 1.70 1 53 THR -0.20 -0.90 1 56 TRP 5.70 1.40 1 57 GLU 5.30 1.40 1 58 GLN 0.10 -0.50 1 59 LEU -1.80 -2.50 1 60 LEU -0.20 -1.50 1 61 ASN 0.30 0.40 1 62 ARG 2.30 -1.10 1 63 ALA -0.90 0.50 1 65 THR 4.50 1.60 1 66 THR 7.00 1.40 1 67 PHE 3.60 1.10 1 68 ARG 3.90 0.50 1 69 LYS 0.60 0.80 1 72 GLU 3.90 1.00 1 73 ASP 4.30 1.30 1 74 VAL 3.60 1.90 1 75 ARG 3.40 2.20 1 76 SER 2.50 0.10 1 77 ASN -1.40 -0.90 1 78 VAL 2.20 -3.10 1 79 ASP -3.40 -2.60 1 80 ALA 3.60 0.90 1 81 ALA 3.10 2.90 1 82 SER 3.10 2.60 1 83 ALA 2.80 0.80 1 84 ARG 5.10 0.30 1 85 GLU 3.20 3.20 1 86 LEU 3.20 1.00 1 87 MET 3.20 -0.70 1 88 LEU 2.50 1.60 1 89 ALA 1.50 1.30 1 92 SER 5.00 -0.40 1 93 MET -0.60 -1.40 1 94 VAL 2.10 1.70 1 98 VAL 1.10 -2.80 1 99 LEU -4.20 -3.80 1 100 GLU -7.00 -2.40 1 101 ARG -0.90 -0.40 1 102 ASP 1.70 -0.60 1 104 LYS -0.20 -0.10 1 105 LEU -3.80 -0.40 1 106 MET -3.70 -1.80 1 107 VAL -1.30 -0.10 1 109 PHE -1.30 -3.10 1 112 ALA 2.70 2.50 1 113 GLN 4.70 2.40 1 114 TYR 9.40 1.20 1 115 GLU 3.40 2.20 1 116 ALA 3.00 1.90 1 117 TYR 2.80 1.40 1 118 PHE 0.65 -0.90 1 stop_ save_