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 bmr7004_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 -3.51 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 1.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.89 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 4.95 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 HIS 4.50 6.50 0 11 SER 2.90 1.50 1 12 VAL 1.60 2.40 1 13 TRP -0.90 -1.00 1 14 SER -3.80 -1.20 1 15 TRP 0.70 2.00 1 16 ASP 4.30 3.30 1 17 GLN 6.20 3.20 1 18 GLN 4.90 2.80 1 19 VAL 5.20 3.90 1 20 ALA 2.90 1.70 1 21 LYS 1.50 -0.90 1 23 ALA 2.70 1.90 1 24 ALA 1.40 1.10 1 26 GLU -7.30 -2.10 1 27 ALA -1.40 -0.60 1 28 TRP 0.40 -1.00 1 29 THR -1.60 -0.30 1 31 VAL 4.60 2.20 1 32 ARG -1.60 -3.40 1 33 ASN -3.40 -0.70 1 35 SER 5.50 4.10 1 36 ALA 1.50 2.50 1 37 LYS 4.80 3.60 1 38 LEU 4.50 2.90 1 39 HIS 2.70 3.50 1 40 MET 2.50 3.50 1 41 VAL 4.30 3.30 1 42 ALA -0.60 0.20 1 43 MET 2.00 2.60 1 44 ARG -6.00 -3.80 1 45 ARG 3.10 2.10 1 47 ASP 0.20 1.00 1 48 ARG -7.10 -2.70 1 49 ALA -7.70 -4.00 1 50 PHE -2.50 -1.20 1 51 TYR -2.80 -0.20 1 52 TYR -4.10 -1.50 1 53 HIS -3.50 -2.60 1 54 SER -2.90 -1.80 1 55 ASN 4.50 3.60 1 56 GLU -0.20 0.10 1 58 LYS 4.50 0.90 1 59 GLU -5.30 -3.10 1 60 ILE 0.70 0.80 1 61 VAL -2.00 -1.30 1 63 ILE -3.30 -0.60 1 64 ALA -6.80 -2.60 1 65 GLU -6.90 -2.30 1 66 ILE 3.10 0.20 1 67 ILE -0.40 0.30 1 68 ARG -1.50 2.00 1 69 GLU -0.00 -0.10 1 70 ALA 0.20 0.10 1 71 TYR 0.10 -1.20 1 73 ASP -1.20 -0.80 1 75 THR 0.20 0.20 1 76 ASP -3.50 -2.00 1 77 ALA 2.10 1.50 1 78 SER 0.40 1.60 1 80 LYS -0.40 0.50 1 81 PHE 0.90 1.30 1 82 VAL -6.00 -3.00 1 84 VAL -4.90 -2.90 1 85 ASP -1.30 -0.80 1 86 ILE -5.80 -2.30 1 87 LYS -6.30 -2.70 1 88 ALA 0.40 1.20 1 89 ASP -0.80 1.10 1 90 LYS -1.00 -0.80 1 92 LEU 2.00 0.30 1 93 LYS 3.60 2.80 1 94 THR -3.20 -1.90 1 96 VAL -0.80 -0.80 1 97 THR -1.60 -0.80 1 98 LEU 3.50 2.80 1 99 ALA 3.50 2.50 1 100 ALA 3.50 2.40 1 101 VAL 6.10 4.70 1 102 LYS 3.10 2.70 1 103 ALA -0.60 -0.60 1 104 GLU -3.90 -2.70 1 106 ARG 2.70 2.10 1 107 LEU 0.10 -1.40 1 108 ALA 2.50 2.70 1 109 ASP -1.20 -0.90 1 110 MET 0.30 1.60 1 111 ALA 5.50 3.70 1 112 LEU 1.20 1.90 1 113 MET -1.80 -0.20 1 114 LYS 0.20 1.10 1 115 TYR -1.80 -2.00 1 116 SER 3.40 2.90 1 117 ARG 0.60 -0.30 1 118 LEU -1.20 -0.20 1 119 SER 1.80 2.00 1 120 VAL -1.60 0.10 1 121 GLN -5.10 -2.10 1 123 VAL -3.30 -0.40 1 124 THR -1.30 -0.40 1 125 ALA 4.30 3.00 1 126 GLU 3.60 3.10 1 127 GLU 2.40 2.50 1 128 TRP 4.00 3.30 1 129 LYS 3.90 3.60 1 130 LEU 3.60 2.80 1 131 VAL 7.10 4.50 1 133 LYS 4.60 3.50 1 134 MET 2.90 4.00 1 137 LEU -0.60 -1.00 1 138 LEU -0.80 -0.80 1 139 GLU -0.70 -0.10 1 140 HIS -0.80 1.00 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7004_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.70 _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 -0.84 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 1.11 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -2.15 _LACS_plot.Y_axis_chem_shift_offset -0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 34 HIS 4.50 2.00 0 11 SER 2.90 -1.40 1 12 VAL 1.60 0.80 1 13 TRP -0.90 -0.10 1 14 SER -3.80 2.60 1 15 TRP 0.70 1.30 1 16 ASP 4.30 -1.00 1 17 GLN 6.20 -3.00 1 18 GLN 4.90 -2.10 1 19 VAL 5.20 -1.30 1 20 ALA 2.90 -1.20 1 21 LYS 1.50 -2.40 1 23 ALA 2.70 -0.80 1 24 ALA 1.40 -0.30 1 26 GLU -7.30 5.20 1 27 ALA -1.40 0.80 1 28 TRP 0.40 -1.40 1 29 THR -1.60 1.30 1 31 VAL 4.60 -2.40 1 32 ARG -1.60 -1.80 1 33 ASN -3.40 2.70 1 35 SER 5.50 -1.40 1 36 ALA 1.50 1.00 1 37 LYS 4.80 -1.20 1 38 LEU 4.50 -1.60 1 39 HIS 2.70 0.80 1 40 MET 2.50 1.00 1 41 VAL 4.30 -1.00 1 42 ALA -0.60 0.80 1 43 MET 2.00 0.60 1 44 ARG -6.00 2.20 1 45 ARG 3.10 -1.00 1 47 ASP 0.20 0.80 1 48 ARG -7.10 4.40 1 49 ALA -7.70 3.70 1 50 PHE -2.50 1.30 1 51 TYR -2.80 2.60 1 52 TYR -4.10 2.60 1 53 HIS -3.50 0.90 1 54 SER -2.90 1.10 1 55 ASN 4.50 -0.90 1 56 GLU -0.20 0.30 1 58 LYS 4.50 -3.60 1 59 GLU -5.30 2.20 1 60 ILE 0.70 0.10 1 61 VAL -2.00 0.70 1 63 ILE -3.30 2.70 1 64 ALA -6.80 4.20 1 65 GLU -6.90 4.60 1 66 ILE 3.10 -2.90 1 67 ILE -0.40 0.70 1 68 ARG -1.50 3.50 1 69 GLU -0.00 -0.10 1 70 ALA 0.20 -0.10 1 71 TYR 0.10 -1.30 1 73 ASP -1.20 0.40 1 75 THR 0.20 0.00 1 76 ASP -3.50 1.50 1 77 ALA 2.10 -0.60 1 78 SER 0.40 1.20 1 80 LYS -0.40 0.90 1 81 PHE 0.90 0.40 1 82 VAL -6.00 3.00 1 84 VAL -4.90 2.00 1 85 ASP -1.30 0.50 1 86 ILE -5.80 3.50 1 87 LYS -6.30 3.60 1 88 ALA 0.40 0.80 1 89 ASP -0.80 1.90 1 90 LYS -1.00 0.20 1 92 LEU 2.00 -1.70 1 93 LYS 3.60 -0.80 1 94 THR -3.20 1.30 1 96 VAL -0.80 0.00 1 97 THR -1.60 0.80 1 98 LEU 3.50 -0.70 1 99 ALA 3.50 -1.00 1 100 ALA 3.50 -1.10 1 101 VAL 6.10 -1.40 1 102 LYS 3.10 -0.40 1 103 ALA -0.60 0.00 1 104 GLU -3.90 1.20 1 106 ARG 2.70 -0.60 1 107 LEU 0.10 -1.50 1 108 ALA 2.50 0.20 1 109 ASP -1.20 0.30 1 110 MET 0.30 1.30 1 111 ALA 5.50 -1.80 1 112 LEU 1.20 0.70 1 113 MET -1.80 1.60 1 114 LYS 0.20 0.90 1 115 TYR -1.80 -0.20 1 116 SER 3.40 -0.50 1 117 ARG 0.60 -0.90 1 118 LEU -1.20 1.00 1 119 SER 1.80 0.20 1 120 VAL -1.60 1.70 1 121 GLN -5.10 3.00 1 123 VAL -3.30 2.90 1 124 THR -1.30 0.90 1 125 ALA 4.30 -1.30 1 126 GLU 3.60 -0.50 1 127 GLU 2.40 0.10 1 128 TRP 4.00 -0.70 1 129 LYS 3.90 -0.30 1 130 LEU 3.60 -0.80 1 131 VAL 7.10 -2.60 1 133 LYS 4.60 -1.10 1 134 MET 2.90 1.10 1 137 LEU -0.60 -0.40 1 138 LEU -0.80 0.00 1 139 GLU -0.70 0.60 1 140 HIS -0.80 1.80 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7004_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 0.87 _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 0.17 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _LACS_plot.Y_axis_chem_shift_offset 0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 32 ARG -1.60 -1.02 0 85 ASP -1.30 1.37 0 11 SER 2.90 -0.27 1 12 VAL 1.60 -0.05 1 13 TRP -0.90 0.53 1 14 SER -3.80 0.29 1 15 TRP 0.70 -1.13 1 16 ASP 4.30 -0.78 1 17 GLN 6.20 -0.94 1 18 GLN 4.90 -0.57 1 19 VAL 5.20 -1.20 1 20 ALA 2.90 -0.28 1 21 LYS 1.50 -0.09 1 23 ALA 2.70 -0.33 1 24 ALA 1.40 -0.29 1 26 GLU -7.30 0.48 1 27 ALA -1.40 0.79 1 28 TRP 0.40 -0.02 1 29 THR -1.60 -0.22 1 31 VAL 4.60 -0.35 1 33 ASN -3.40 0.19 1 34 HIS 4.50 -0.49 1 35 SER 5.50 -0.42 1 36 ALA 1.50 -0.07 1 37 LYS 4.80 -0.50 1 38 LEU 4.50 -0.52 1 39 HIS 2.70 -0.09 1 40 MET 2.50 -0.40 1 41 VAL 4.30 -0.67 1 42 ALA -0.60 -0.07 1 43 MET 2.00 -0.64 1 44 ARG -6.00 0.45 1 45 ARG 3.10 -0.62 1 47 ASP 0.20 -0.04 1 48 ARG -7.10 1.06 1 49 ALA -7.70 1.29 1 50 PHE -2.50 0.74 1 51 TYR -2.80 0.08 1 52 TYR -4.10 0.52 1 53 HIS -3.50 1.09 1 54 SER -2.90 0.00 1 55 ASN 4.50 -0.52 1 56 GLU -0.20 -0.17 1 58 LYS 4.50 -0.32 1 59 GLU -5.30 0.56 1 60 ILE 0.70 0.13 1 61 VAL -2.00 0.06 1 63 ILE -3.30 0.93 1 64 ALA -6.80 1.09 1 65 GLU -6.90 0.86 1 66 ILE 3.10 0.11 1 67 ILE -0.40 0.59 1 68 ARG -1.50 0.07 1 69 GLU -0.00 -0.51 1 70 ALA 0.20 0.44 1 71 TYR 0.10 0.18 1 73 ASP -1.20 -0.29 1 75 THR 0.20 -0.06 1 76 ASP -3.50 0.15 1 77 ALA 2.10 -0.15 1 78 SER 0.40 -0.12 1 80 LYS -0.40 -0.20 1 81 PHE 0.90 -0.05 1 82 VAL -6.00 1.02 1 84 VAL -4.90 0.36 1 86 ILE -5.80 1.25 1 87 LYS -6.30 0.71 1 88 ALA 0.40 -0.34 1 89 ASP -0.80 0.40 1 90 LYS -1.00 0.56 1 92 LEU 2.00 -0.30 1 93 LYS 3.60 -0.32 1 94 THR -3.20 -0.06 1 96 VAL -0.80 -0.01 1 97 THR -1.60 0.11 1 98 LEU 3.50 -0.40 1 99 ALA 3.50 -0.40 1 100 ALA 3.50 -0.36 1 101 VAL 6.10 -0.76 1 102 LYS 3.10 -0.38 1 103 ALA -0.60 -0.08 1 104 GLU -3.90 0.19 1 106 ARG 2.70 -0.16 1 107 LEU 0.10 0.33 1 108 ALA 2.50 -0.38 1 109 ASP -1.20 0.10 1 110 MET 0.30 -0.11 1 111 ALA 5.50 -0.23 1 112 LEU 1.20 -0.24 1 113 MET -1.80 -0.16 1 114 LYS 0.20 -0.26 1 115 TYR -1.80 0.45 1 116 SER 3.40 -0.33 1 117 ARG 0.60 0.13 1 118 LEU -1.20 0.10 1 119 SER 1.80 -0.21 1 120 VAL -1.60 0.79 1 121 GLN -5.10 0.30 1 123 VAL -3.30 0.02 1 124 THR -1.30 0.07 1 125 ALA 4.30 -0.30 1 126 GLU 3.60 -0.35 1 127 GLU 2.40 -0.64 1 128 TRP 4.00 -0.74 1 129 LYS 3.90 -0.58 1 130 LEU 3.60 -0.24 1 131 VAL 7.10 -0.56 1 133 LYS 4.60 -0.33 1 134 MET 2.90 -0.60 1 137 LEU -0.60 0.10 1 138 LEU -0.80 0.02 1 139 GLU -0.70 -0.18 1 140 HIS -0.80 -0.21 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr7004_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.70 _LACS_plot.Line_1_terminator_val_y_1 -2.65 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.57 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.91 _LACS_plot.Line_2_terminator_val_x_2 7.10 _LACS_plot.Line_2_terminator_val_y_2 2.47 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 133 LYS 4.60 4.80 0 49 ALA -7.70 -0.30 0 11 SER 2.90 -0.80 1 12 VAL 1.60 -0.30 1 13 TRP -0.90 -0.50 1 14 SER -3.80 -0.40 1 15 TRP 0.70 0.00 1 16 ASP 4.30 3.60 1 17 GLN 6.20 1.80 1 18 GLN 4.90 3.90 1 19 VAL 5.20 3.20 1 20 ALA 2.90 1.00 1 21 LYS 1.50 2.30 1 23 ALA 2.70 -0.30 1 24 ALA 1.40 1.40 1 26 GLU -7.30 -2.30 1 27 ALA -1.40 -0.80 1 28 TRP 0.40 -1.10 1 29 THR -1.60 0.80 1 31 VAL 4.60 1.90 1 32 ARG -1.60 -2.60 1 35 SER 5.50 0.90 1 36 ALA 1.50 1.10 1 37 LYS 4.80 0.80 1 38 LEU 4.50 2.70 1 39 HIS 2.70 2.40 1 40 MET 2.50 3.20 1 41 VAL 4.30 -1.00 1 42 ALA -0.60 0.60 1 43 MET 2.00 -0.30 1 44 ARG -6.00 -0.80 1 45 ARG 3.10 1.50 1 47 ASP 0.20 -1.40 1 48 ARG -7.10 -2.00 1 50 PHE -2.50 -2.30 1 51 TYR -2.80 -2.70 1 52 TYR -4.10 -2.40 1 53 HIS -3.50 -0.10 1 54 SER -2.90 0.40 1 55 ASN 4.50 -0.30 1 56 GLU -0.20 -0.80 1 58 LYS 4.50 -1.10 1 59 GLU -5.30 -2.70 1 60 ILE 0.70 -0.40 1 61 VAL -2.00 -0.20 1 63 ILE -3.30 -2.10 1 64 ALA -6.80 -3.30 1 65 GLU -6.90 -1.30 1 66 ILE 3.10 -0.20 1 67 ILE -0.40 -0.90 1 68 ARG -1.50 -1.90 1 69 GLU -0.00 -2.00 1 70 ALA 0.20 -1.30 1 75 THR 0.20 -1.00 1 76 ASP -3.50 -0.40 1 77 ALA 2.10 0.70 1 78 SER 0.40 1.30 1 80 LYS -0.40 0.10 1 81 PHE 0.90 0.10 1 82 VAL -6.00 -2.00 1 84 VAL -4.90 -2.30 1 85 ASP -1.30 0.40 1 86 ILE -5.80 -2.70 1 87 LYS -6.30 -1.20 1 88 ALA 0.40 -2.60 1 89 ASP -0.80 -1.30 1 92 LEU 2.00 -0.60 1 93 LYS 3.60 0.40 1 96 VAL -0.80 -0.80 1 97 THR -1.60 0.10 1 98 LEU 3.50 0.90 1 99 ALA 3.50 2.20 1 100 ALA 3.50 2.90 1 101 VAL 6.10 2.20 1 102 LYS 3.10 0.40 1 103 ALA -0.60 -1.80 1 106 ARG 2.70 1.10 1 107 LEU 0.10 -1.30 1 108 ALA 2.50 0.00 1 109 ASP -1.20 -0.50 1 110 MET 0.30 1.60 1 111 ALA 5.50 0.80 1 112 LEU 1.20 0.80 1 113 MET -1.80 1.20 1 114 LYS 0.20 0.10 1 115 TYR -1.80 0.90 1 116 SER 3.40 1.10 1 117 ARG 0.60 -0.40 1 118 LEU -1.20 -0.20 1 119 SER 1.80 -1.30 1 120 VAL -1.60 -2.00 1 123 VAL -3.30 -2.00 1 124 THR -1.30 0.30 1 125 ALA 4.30 2.20 1 126 GLU 3.60 3.20 1 127 GLU 2.40 1.20 1 128 TRP 4.00 2.10 1 129 LYS 3.90 2.50 1 130 LEU 3.60 0.90 1 131 VAL 7.10 2.20 1 134 MET 2.90 1.00 1 137 LEU -0.60 -1.60 1 138 LEU -0.80 -1.60 1 139 GLU -0.70 1.20 1 stop_ save_