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 bmr4094_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 -3.38 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.32 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.42 _LACS_plot.Line_2_terminator_val_x_2 7.60 _LACS_plot.Line_2_terminator_val_y_2 5.78 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 84 ILE 5.20 0.90 0 10 THR 5.30 3.80 1 11 LEU 3.50 2.80 1 12 GLN 4.60 3.70 1 13 GLU 3.20 2.50 1 14 ILE 5.90 4.90 1 15 ILE 5.60 4.00 1 16 LYS 4.60 3.70 1 17 THR 7.20 5.30 1 18 LEU 3.80 3.20 1 19 ASN 4.40 2.60 1 20 SER 4.40 3.50 1 21 LEU 0.80 2.10 1 22 THR 1.50 0.90 1 23 GLU 0.60 0.70 1 24 GLN -1.70 -1.30 1 25 LYS 0.50 0.10 1 26 THR -3.90 -2.10 1 27 LEU 2.60 2.50 1 29 THR 4.40 2.50 1 30 GLU -0.30 -0.70 1 31 LEU 1.10 -0.20 1 32 THR -2.30 -0.60 1 33 VAL -6.60 -3.60 1 34 THR 2.90 2.30 1 35 ASP -0.20 -1.40 1 36 ILE 1.50 0.30 1 37 PHE 3.40 1.70 1 38 ALA 1.90 1.10 1 39 ALA -0.40 -0.50 1 40 SER 0.50 0.30 1 41 LYS 1.40 0.70 1 42 ASP 0.60 0.20 1 43 THR -0.70 -0.40 1 44 THR -2.40 -1.10 1 45 GLU 3.50 2.90 1 46 LYS 5.30 4.30 1 47 GLU 3.60 3.20 1 48 THR 7.60 5.40 1 49 PHE 3.50 0.80 1 51 ARG 4.60 4.10 1 52 ALA 3.60 2.80 1 53 ALA 5.00 3.20 1 54 THR 6.60 5.60 1 55 VAL 5.40 4.10 1 56 LEU 3.90 3.00 1 57 ARG 3.50 2.40 1 58 GLN 4.60 3.10 1 59 PHE 5.90 5.00 1 60 TYR 4.00 2.90 1 61 SER 4.50 3.20 1 62 HIS 1.00 1.50 1 63 HIS 0.80 0.30 1 64 GLU 5.70 4.60 1 65 LYS -0.30 -1.90 1 66 ASP -2.10 -0.80 1 67 THR 4.80 3.50 1 68 ARG 3.50 2.50 1 70 LEU 1.90 2.10 1 72 ALA -2.50 -0.40 1 73 THR -5.60 -3.00 1 74 ALA 3.80 2.50 1 75 GLN 4.70 3.60 1 76 GLN 4.40 3.40 1 77 PHE 3.80 2.70 1 78 HIS 4.00 4.60 1 80 HIS 3.10 4.80 1 81 LYS 4.90 3.20 1 82 GLN 3.50 2.80 1 83 LEU 5.40 3.80 1 85 ARG 5.00 3.90 1 86 PHE 3.30 1.80 1 87 LEU 3.10 3.30 1 88 LYS 4.80 4.00 1 89 ARG 3.50 2.90 1 90 LEU 3.10 2.90 1 91 ASP 2.70 3.40 1 92 ARG 4.50 3.30 1 93 ASN 2.50 3.10 1 94 LEU 3.20 3.20 1 95 TRP 3.50 3.00 1 97 LEU 1.20 1.50 1 98 ALA 0.60 1.60 1 100 LEU -3.30 -1.50 1 101 ASN -0.10 0.60 1 102 SER -0.90 -0.90 1 105 VAL -1.90 -0.80 1 106 LYS -0.70 -0.80 1 107 GLU 0.90 0.70 1 108 ALA -1.70 -0.70 1 109 ASP 0.50 0.80 1 110 GLN -4.00 -1.00 1 111 SER -5.30 -2.40 1 112 THR -0.30 0.30 1 113 LEU 6.00 3.10 1 114 GLU 4.10 3.20 1 115 ASN 3.50 3.10 1 116 PHE 3.00 3.40 1 117 LEU 3.40 2.50 1 118 GLU 3.70 2.60 1 119 ARG 4.70 2.50 1 120 LEU 2.90 2.20 1 121 LYS 5.40 4.30 1 122 THR 6.40 5.20 1 123 ILE 4.20 3.80 1 124 MET 3.80 1.30 1 125 ARG 4.80 3.70 1 126 GLU 3.60 2.70 1 127 LYS 3.20 2.60 1 128 TYR 1.30 1.30 1 129 SER 3.60 2.80 1 130 LYS 1.60 0.70 1 132 SER -0.10 0.00 1 133 SER 0.80 1.80 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4094_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 3.22 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.68 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.58 _LACS_plot.Line_2_terminator_val_x_2 7.60 _LACS_plot.Line_2_terminator_val_y_2 -1.82 _LACS_plot.Y_axis_chem_shift_offset -0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 84 ILE 5.20 -4.30 0 10 THR 5.30 -1.50 1 11 LEU 3.50 -0.70 1 12 GLN 4.60 -0.90 1 13 GLU 3.20 -0.70 1 14 ILE 5.90 -1.00 1 15 ILE 5.60 -1.60 1 16 LYS 4.60 -0.90 1 17 THR 7.20 -1.90 1 18 LEU 3.80 -0.60 1 19 ASN 4.40 -1.80 1 20 SER 4.40 -0.90 1 21 LEU 0.80 1.30 1 22 THR 1.50 -0.60 1 23 GLU 0.60 0.10 1 24 GLN -1.70 0.40 1 25 LYS 0.50 -0.40 1 26 THR -3.90 1.80 1 27 LEU 2.60 -0.10 1 29 THR 4.40 -1.90 1 30 GLU -0.30 -0.40 1 31 LEU 1.10 -1.30 1 32 THR -2.30 1.70 1 33 VAL -6.60 3.00 1 34 THR 2.90 -0.60 1 35 ASP -0.20 -1.20 1 36 ILE 1.50 -1.20 1 37 PHE 3.40 -1.70 1 38 ALA 1.90 -0.80 1 39 ALA -0.40 -0.10 1 40 SER 0.50 -0.20 1 41 LYS 1.40 -0.70 1 42 ASP 0.60 -0.40 1 43 THR -0.70 0.30 1 44 THR -2.40 1.30 1 45 GLU 3.50 -0.60 1 46 LYS 5.30 -1.00 1 47 GLU 3.60 -0.40 1 48 THR 7.60 -2.20 1 49 PHE 3.50 -2.70 1 51 ARG 4.60 -0.50 1 52 ALA 3.60 -0.80 1 53 ALA 5.00 -1.80 1 54 THR 6.60 -1.00 1 55 VAL 5.40 -1.30 1 56 LEU 3.90 -0.90 1 57 ARG 3.50 -1.10 1 58 GLN 4.60 -1.50 1 59 PHE 5.90 -0.90 1 60 TYR 4.00 -1.10 1 61 SER 4.50 -1.30 1 62 HIS 1.00 0.50 1 63 HIS 0.80 -0.50 1 64 GLU 5.70 -1.10 1 65 LYS -0.30 -1.60 1 66 ASP -2.10 1.30 1 67 THR 4.80 -1.30 1 68 ARG 3.50 -1.00 1 70 LEU 1.90 0.20 1 72 ALA -2.50 2.10 1 73 THR -5.60 2.60 1 74 ALA 3.80 -1.30 1 75 GLN 4.70 -1.10 1 76 GLN 4.40 -1.00 1 77 PHE 3.80 -1.10 1 78 HIS 4.00 0.60 1 80 HIS 3.10 1.70 1 81 LYS 4.90 -1.70 1 82 GLN 3.50 -0.70 1 83 LEU 5.40 -1.60 1 85 ARG 5.00 -1.10 1 86 PHE 3.30 -1.50 1 87 LEU 3.10 0.20 1 88 LYS 4.80 -0.80 1 89 ARG 3.50 -0.60 1 90 LEU 3.10 -0.20 1 91 ASP 2.70 0.70 1 92 ARG 4.50 -1.20 1 93 ASN 2.50 0.60 1 94 LEU 3.20 0.00 1 95 TRP 3.50 -0.50 1 97 LEU 1.20 0.30 1 98 ALA 0.60 1.00 1 100 LEU -3.30 1.80 1 101 ASN -0.10 0.70 1 102 SER -0.90 0.00 1 105 VAL -1.90 1.10 1 106 LYS -0.70 -0.10 1 107 GLU 0.90 -0.20 1 108 ALA -1.70 1.00 1 109 ASP 0.50 0.30 1 110 GLN -4.00 3.00 1 111 SER -5.30 2.90 1 112 THR -0.30 0.60 1 113 LEU 6.00 -2.90 1 114 GLU 4.10 -0.90 1 115 ASN 3.50 -0.40 1 116 PHE 3.00 0.40 1 117 LEU 3.40 -0.90 1 118 GLU 3.70 -1.10 1 119 ARG 4.70 -2.20 1 120 LEU 2.90 -0.70 1 121 LYS 5.40 -1.10 1 122 THR 6.40 -1.20 1 123 ILE 4.20 -0.40 1 124 MET 3.80 -2.50 1 125 ARG 4.80 -1.10 1 126 GLU 3.60 -0.90 1 127 LYS 3.20 -0.60 1 128 TYR 1.30 0.00 1 129 SER 3.60 -0.80 1 130 LYS 1.60 -0.90 1 132 SER -0.10 0.10 1 133 SER 0.80 1.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4094_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 0.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.12 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 7.60 _LACS_plot.Line_2_terminator_val_y_2 -0.62 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 57 ARG 3.50 -1.17 0 10 THR 5.30 -0.36 1 11 LEU 3.50 -0.38 1 12 GLN 4.60 -0.60 1 13 GLU 3.20 -0.33 1 14 ILE 5.90 -0.60 1 15 ILE 5.60 -0.71 1 16 LYS 4.60 -0.33 1 17 THR 7.20 -0.70 1 18 LEU 3.80 -0.34 1 19 ASN 4.40 -0.41 1 20 SER 4.40 -0.21 1 21 LEU 0.80 -0.27 1 22 THR 1.50 0.06 1 23 GLU 0.60 -0.07 1 24 GLN -1.70 0.19 1 25 LYS 0.50 0.16 1 26 THR -3.90 0.55 1 27 LEU 2.60 -0.06 1 29 THR 4.40 -0.11 1 30 GLU -0.30 0.19 1 31 LEU 1.10 0.14 1 32 THR -2.30 0.74 1 33 VAL -6.60 0.55 1 34 THR 2.90 -0.19 1 35 ASP -0.20 0.08 1 36 ILE 1.50 -0.02 1 37 PHE 3.40 -0.14 1 38 ALA 1.90 -0.06 1 39 ALA -0.40 0.19 1 40 SER 0.50 -0.06 1 41 LYS 1.40 0.01 1 42 ASP 0.60 0.04 1 43 THR -0.70 0.19 1 44 THR -2.40 0.18 1 45 GLU 3.50 -0.61 1 46 LYS 5.30 -0.44 1 47 GLU 3.60 -0.46 1 48 THR 7.60 -0.57 1 49 PHE 3.50 -0.08 1 51 ARG 4.60 -0.42 1 52 ALA 3.60 -0.07 1 53 ALA 5.00 -0.28 1 54 THR 6.60 -0.50 1 55 VAL 5.40 -0.24 1 56 LEU 3.90 -0.30 1 58 GLN 4.60 -0.47 1 59 PHE 5.90 -0.25 1 60 TYR 4.00 -0.24 1 61 SER 4.50 -0.01 1 62 HIS 1.00 -0.12 1 63 HIS 0.80 0.35 1 64 GLU 5.70 -0.35 1 65 LYS -0.30 0.22 1 66 ASP -2.10 0.00 1 67 THR 4.80 -0.42 1 68 ARG 3.50 -0.21 1 70 LEU 1.90 -0.55 1 72 ALA -2.50 0.43 1 73 THR -5.60 0.40 1 74 ALA 3.80 -0.15 1 75 GLN 4.70 -0.08 1 76 GLN 4.40 -0.17 1 77 PHE 3.80 -0.01 1 78 HIS 4.00 -0.43 1 80 HIS 3.10 -0.09 1 81 LYS 4.90 -0.64 1 82 GLN 3.50 -0.55 1 83 LEU 5.40 -0.26 1 84 ILE 5.20 -0.57 1 85 ARG 5.00 -0.52 1 86 PHE 3.30 -0.12 1 87 LEU 3.10 -0.18 1 88 LYS 4.80 -0.48 1 89 ARG 3.50 -0.28 1 90 LEU 3.10 -0.20 1 91 ASP 2.70 -0.31 1 92 ARG 4.50 -0.24 1 93 ASN 2.50 -0.12 1 94 LEU 3.20 -0.46 1 95 TRP 3.50 -0.37 1 97 LEU 1.20 -0.14 1 98 ALA 0.60 -0.06 1 100 LEU -3.30 0.07 1 101 ASN -0.10 0.14 1 102 SER -0.90 0.20 1 105 VAL -1.90 0.03 1 106 LYS -0.70 0.08 1 107 GLU 0.90 -0.17 1 108 ALA -1.70 0.17 1 109 ASP 0.50 -0.01 1 110 GLN -4.00 0.76 1 111 SER -5.30 0.58 1 112 THR -0.30 0.11 1 113 LEU 6.00 -0.34 1 114 GLU 4.10 -0.38 1 115 ASN 3.50 -0.28 1 116 PHE 3.00 -0.19 1 117 LEU 3.40 -0.41 1 118 GLU 3.70 -0.33 1 119 ARG 4.70 -0.44 1 120 LEU 2.90 -0.51 1 121 LYS 5.40 -0.65 1 122 THR 6.40 -0.51 1 123 ILE 4.20 -0.30 1 124 MET 3.80 -0.02 1 125 ARG 4.80 -0.32 1 126 GLU 3.60 -0.20 1 127 LYS 3.20 -0.16 1 128 TYR 1.30 0.05 1 129 SER 3.60 -0.26 1 130 LYS 1.60 0.03 1 132 SER -0.10 0.00 1 133 SER 0.80 -0.16 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr4094_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.60 _LACS_plot.Line_1_terminator_val_y_1 -1.70 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.98 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.22 _LACS_plot.Line_2_terminator_val_x_2 7.19 _LACS_plot.Line_2_terminator_val_y_2 2.51 _LACS_plot.Y_axis_chem_shift_offset -0.37 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 133 SER 0.80 3.90 0 73 THR -5.60 0.10 0 33 VAL -6.60 -1.80 0 10 THR 5.30 1.90 1 11 LEU 3.50 0.80 1 12 GLN 4.60 2.40 1 13 GLU 3.20 3.30 1 14 ILE 5.90 0.80 1 15 ILE 5.60 1.20 1 16 LYS 4.60 3.10 1 17 THR 7.20 1.50 1 18 LEU 3.80 1.40 1 19 ASN 4.40 2.20 1 20 SER 4.40 1.80 1 21 LEU 0.80 0.50 1 22 THR 1.50 0.50 1 23 GLU 0.60 -0.30 1 24 GLN -1.70 -1.50 1 25 LYS 0.50 0.00 1 26 THR -3.90 0.40 1 27 LEU 2.60 1.10 1 29 THR 4.40 -0.70 1 30 GLU -0.30 0.20 1 31 LEU 1.10 -1.10 1 32 THR -2.30 0.10 1 34 THR 2.90 -1.50 1 35 ASP -0.20 1.10 1 36 ILE 1.50 0.00 1 37 PHE 3.40 1.10 1 38 ALA 1.90 0.00 1 39 ALA -0.40 -0.30 1 40 SER 0.50 0.50 1 41 LYS 1.40 -0.30 1 42 ASP 0.60 -0.50 1 43 THR -0.70 -0.10 1 44 THR -2.40 0.90 1 45 GLU 3.50 0.50 1 46 LYS 5.30 1.90 1 47 GLU 3.60 2.00 1 49 PHE 3.50 1.20 1 51 ARG 4.60 2.00 1 52 ALA 3.60 0.60 1 53 ALA 5.00 1.20 1 54 THR 6.60 2.10 1 55 VAL 5.40 2.80 1 56 LEU 3.90 -0.20 1 57 ARG 3.50 3.60 1 58 GLN 4.60 2.00 1 59 PHE 5.90 3.30 1 60 TYR 4.00 1.70 1 61 SER 4.50 1.50 1 62 HIS 1.00 2.30 1 63 HIS 0.80 1.00 1 64 GLU 5.70 0.30 1 65 LYS -0.30 -1.70 1 66 ASP -2.10 1.40 1 67 THR 4.80 2.00 1 68 ARG 3.50 1.30 1 70 LEU 1.90 -1.30 1 72 ALA -2.50 -0.10 1 74 ALA 3.80 2.40 1 75 GLN 4.70 2.90 1 76 GLN 4.40 2.70 1 77 PHE 3.80 2.30 1 78 HIS 4.00 3.80 1 80 HIS 3.10 2.70 1 81 LYS 4.90 3.30 1 82 GLN 3.50 0.60 1 83 LEU 5.40 0.90 1 84 ILE 5.20 1.00 1 85 ARG 5.00 3.50 1 86 PHE 3.30 2.50 1 87 LEU 3.10 1.40 1 88 LYS 4.80 2.70 1 89 ARG 3.50 2.10 1 90 LEU 3.10 0.20 1 91 ASP 2.70 -0.60 1 92 ARG 4.50 3.60 1 93 ASN 2.50 2.30 1 94 LEU 3.20 0.80 1 95 TRP 3.50 4.10 1 97 LEU 1.20 1.00 1 98 ALA 0.60 0.20 1 100 LEU -3.30 -1.50 1 101 ASN -0.10 0.00 1 102 SER -0.90 -1.50 1 105 VAL -1.90 -0.90 1 106 LYS -0.70 -0.80 1 107 GLU 0.90 -1.00 1 108 ALA -1.70 -1.10 1 109 ASP 0.50 -1.00 1 110 GLN -4.00 0.10 1 111 SER -5.30 -0.40 1 112 THR -0.30 2.00 1 113 LEU 6.00 0.80 1 114 GLU 4.10 1.00 1 115 ASN 3.50 2.30 1 116 PHE 3.00 1.30 1 117 LEU 3.40 1.40 1 118 GLU 3.70 2.80 1 119 ARG 4.70 2.50 1 120 LEU 2.90 0.30 1 121 LYS 5.40 1.20 1 122 THR 6.40 1.70 1 123 ILE 4.20 2.50 1 124 MET 3.80 2.30 1 125 ARG 4.80 2.80 1 126 GLU 3.60 2.20 1 127 LYS 3.20 2.10 1 128 TYR 1.30 1.50 1 129 SER 3.60 1.00 1 130 LYS 1.60 0.50 1 132 SER -0.10 -1.10 1 stop_ save_