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 bmr6330_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 -2.71 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.54 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.59 _LACS_plot.Line_2_terminator_val_x_2 8.39 _LACS_plot.Line_2_terminator_val_y_2 6.47 _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 144 HIS 5.00 7.40 0 125 GLU -2.70 3.70 0 10 ALA -6.10 -2.30 1 13 LEU -5.30 -2.40 1 14 ILE 1.50 0.20 1 15 ILE -2.00 -2.00 1 16 PHE -6.30 -2.40 1 17 ARG -6.80 -3.60 1 18 ARG 1.40 -1.60 1 20 LEU 1.50 0.90 1 21 ILE -0.50 -0.70 1 23 LYS -0.40 0.00 1 24 VAL 1.70 1.10 1 25 ASP 0.80 0.20 1 26 ASN -0.10 0.20 1 27 ASN -0.30 0.00 1 28 ALA 1.00 1.30 1 29 ILE -2.00 -1.10 1 30 GLU -7.60 -2.90 1 31 PHE -3.10 -0.60 1 32 LEU -0.80 -1.40 1 33 LEU -5.90 -1.70 1 34 LEU -3.30 -2.10 1 36 ALA 0.20 0.60 1 37 SER 0.20 0.20 1 38 ASP -2.90 -1.90 1 40 ILE 0.60 -0.30 1 43 TRP -2.90 -1.70 1 44 THR -2.00 -0.90 1 47 LYS -1.30 -0.50 1 49 HIS 0.10 1.20 1 50 VAL -0.20 0.00 1 51 GLU -0.30 -0.50 1 54 GLU -1.70 -0.70 1 55 ASP -2.70 -0.90 1 56 ASP 3.60 4.00 1 57 LEU 3.90 2.20 1 58 GLU 3.70 2.90 1 59 THR 7.70 5.80 1 60 ALA 4.10 3.30 1 61 LEU 2.90 2.70 1 62 ARG 5.80 3.80 1 63 ALA 3.70 2.30 1 64 THR 8.40 6.50 1 65 GLN -0.20 4.30 1 66 GLU 2.60 2.90 1 68 ALA -2.80 -1.70 1 70 ILE -1.20 -0.30 1 71 GLU -2.40 -1.10 1 72 ALA 3.40 3.00 1 74 GLN -1.40 -0.30 1 75 LEU -5.60 -1.60 1 76 THR -1.30 -0.70 1 77 ILE 1.90 -0.80 1 78 ILE 0.70 -2.70 1 79 GLU 0.70 0.90 1 81 PHE -1.70 -0.60 1 82 LYS -1.70 -0.30 1 83 ARG -6.40 -3.00 1 84 GLU -3.00 -1.90 1 85 LEU -2.20 -1.10 1 86 ASN -3.30 -0.70 1 88 VAL -0.80 -0.70 1 89 ALA -3.20 -1.40 1 90 ARG 4.60 1.10 1 91 ASN 3.80 3.20 1 95 THR -2.30 -0.50 1 96 VAL -4.60 -2.80 1 97 ILE -2.20 -1.80 1 98 TYR -5.10 -0.40 1 99 TRP -2.40 0.50 1 100 LEU -3.70 -0.80 1 101 ALA -7.60 -1.60 1 102 GLU -5.90 -3.30 1 103 VAL 0.40 -1.20 1 104 LYS 2.40 2.20 1 105 ASP -3.10 -2.20 1 106 TYR 2.70 3.60 1 107 ASP -0.80 -1.10 1 108 VAL 1.30 -0.40 1 109 GLU -0.60 -0.40 1 110 ILE -0.70 -3.10 1 111 ARG -2.40 -1.60 1 112 LEU -1.50 -1.00 1 113 SER -4.10 -1.50 1 114 HIS 2.70 2.90 1 115 GLU 0.70 0.90 1 116 HIS -3.30 1.80 1 118 ALA -3.80 -0.80 1 119 TYR -5.00 -1.70 1 120 ARG -5.60 -0.30 1 121 TRP -2.50 -1.80 1 122 LEU -6.40 -1.40 1 124 LEU 5.10 4.20 1 126 GLU 2.90 2.70 1 127 ALA 4.00 2.50 1 129 GLN 3.80 2.50 1 130 LEU 2.10 0.90 1 131 ALA 2.30 1.20 1 134 LYS 5.00 4.20 1 135 GLU 5.00 3.60 1 137 LYS 4.60 4.00 1 138 ALA 3.60 2.30 1 139 ALA 4.50 3.20 1 140 LEU 3.90 2.90 1 141 GLN -1.10 3.80 1 142 GLU 3.60 2.70 1 145 GLN 4.30 3.20 1 146 PHE 4.20 3.80 1 147 LEU 2.30 1.90 1 149 SER 1.10 0.90 1 150 ILE 0.90 0.60 1 151 GLU -6.50 -0.30 1 152 ALA 0.20 1.20 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6330_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 4.89 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.46 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.41 _LACS_plot.Line_2_terminator_val_x_2 8.39 _LACS_plot.Line_2_terminator_val_y_2 -1.92 _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 144 HIS 5.00 2.40 0 125 GLU -2.70 6.40 0 10 ALA -6.10 3.80 1 13 LEU -5.30 2.90 1 14 ILE 1.50 -1.30 1 15 ILE -2.00 0.00 1 16 PHE -6.30 3.90 1 17 ARG -6.80 3.20 1 18 ARG 1.40 -3.00 1 20 LEU 1.50 -0.60 1 21 ILE -0.50 -0.20 1 23 LYS -0.40 0.40 1 24 VAL 1.70 -0.60 1 25 ASP 0.80 -0.60 1 26 ASN -0.10 0.30 1 27 ASN -0.30 0.30 1 28 ALA 1.00 0.30 1 29 ILE -2.00 0.90 1 30 GLU -7.60 4.70 1 31 PHE -3.10 2.50 1 32 LEU -0.80 -0.60 1 33 LEU -5.90 4.20 1 34 LEU -3.30 1.20 1 36 ALA 0.20 0.40 1 37 SER 0.20 0.00 1 38 ASP -2.90 1.00 1 40 ILE 0.60 -0.90 1 43 TRP -2.90 1.20 1 44 THR -2.00 1.10 1 47 LYS -1.30 0.80 1 49 HIS 0.10 1.10 1 50 VAL -0.20 0.20 1 51 GLU -0.30 -0.20 1 54 GLU -1.70 1.00 1 55 ASP -2.70 1.80 1 56 ASP 3.60 0.40 1 57 LEU 3.90 -1.70 1 58 GLU 3.70 -0.80 1 59 THR 7.70 -1.90 1 60 ALA 4.10 -0.80 1 61 LEU 2.90 -0.20 1 62 ARG 5.80 -2.00 1 63 ALA 3.70 -1.40 1 64 THR 8.40 -1.90 1 65 GLN -0.20 4.50 1 66 GLU 2.60 0.30 1 68 ALA -2.80 1.10 1 70 ILE -1.20 0.90 1 71 GLU -2.40 1.30 1 72 ALA 3.40 -0.40 1 74 GLN -1.40 1.10 1 75 LEU -5.60 4.00 1 76 THR -1.30 0.60 1 77 ILE 1.90 -2.70 1 78 ILE 0.70 -3.40 1 79 GLU 0.70 0.20 1 81 PHE -1.70 1.10 1 82 LYS -1.70 1.40 1 83 ARG -6.40 3.40 1 84 GLU -3.00 1.10 1 85 LEU -2.20 1.10 1 86 ASN -3.30 2.60 1 88 VAL -0.80 0.10 1 89 ALA -3.20 1.80 1 90 ARG 4.60 -3.50 1 91 ASN 3.80 -0.60 1 95 THR -2.30 1.80 1 96 VAL -4.60 1.80 1 97 ILE -2.20 0.40 1 98 TYR -5.10 4.70 1 99 TRP -2.40 2.90 1 100 LEU -3.70 2.90 1 101 ALA -7.60 6.00 1 102 GLU -5.90 2.60 1 103 VAL 0.40 -1.60 1 104 LYS 2.40 -0.20 1 105 ASP -3.10 0.90 1 106 TYR 2.70 0.90 1 107 ASP -0.80 -0.30 1 108 VAL 1.30 -1.70 1 109 GLU -0.60 0.20 1 110 ILE -0.70 -2.40 1 111 ARG -2.40 0.80 1 112 LEU -1.50 0.50 1 113 SER -4.10 2.60 1 114 HIS 2.70 0.20 1 115 GLU 0.70 0.20 1 116 HIS -3.30 5.10 1 118 ALA -3.80 3.00 1 119 TYR -5.00 3.30 1 120 ARG -5.60 5.30 1 121 TRP -2.50 0.70 1 122 LEU -6.40 5.00 1 124 LEU 5.10 -0.90 1 126 GLU 2.90 -0.20 1 127 ALA 4.00 -1.50 1 129 GLN 3.80 -1.30 1 130 LEU 2.10 -1.20 1 131 ALA 2.30 -1.10 1 134 LYS 5.00 -0.80 1 135 GLU 5.00 -1.40 1 137 LYS 4.60 -0.60 1 138 ALA 3.60 -1.30 1 139 ALA 4.50 -1.30 1 140 LEU 3.90 -1.00 1 141 GLN -1.10 4.90 1 142 GLU 3.60 -0.90 1 145 GLN 4.30 -1.10 1 146 PHE 4.20 -0.40 1 147 LEU 2.30 -0.40 1 149 SER 1.10 -0.20 1 150 ILE 0.90 -0.30 1 151 GLU -6.50 6.20 1 152 ALA 0.20 1.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6330_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 0.86 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.24 _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 8.39 _LACS_plot.Line_2_terminator_val_y_2 -0.98 _LACS_plot.Y_axis_chem_shift_offset 0.00 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 102 GLU -5.90 -0.73 0 10 ALA -6.10 0.98 1 13 LEU -5.30 1.13 1 14 ILE 1.50 0.04 1 15 ILE -2.00 1.17 1 16 PHE -6.30 1.67 1 17 ARG -6.80 0.52 1 18 ARG 1.40 0.81 1 20 LEU 1.50 -0.18 1 21 ILE -0.50 -0.06 1 23 LYS -0.40 -0.04 1 24 VAL 1.70 -0.14 1 25 ASP 0.80 -0.18 1 26 ASN -0.10 -0.07 1 27 ASN -0.30 0.12 1 28 ALA 1.00 -0.01 1 29 ILE -2.00 0.47 1 30 GLU -7.60 0.43 1 31 PHE -3.10 0.84 1 32 LEU -0.80 -0.05 1 33 LEU -5.90 0.40 1 34 LEU -3.30 0.56 1 36 ALA 0.20 0.03 1 37 SER 0.20 -0.14 1 38 ASP -2.90 -0.03 1 40 ILE 0.60 -0.07 1 43 TRP -2.90 0.87 1 44 THR -2.00 0.56 1 47 LYS -1.30 0.57 1 49 HIS 0.10 0.15 1 50 VAL -0.20 -0.04 1 51 GLU -0.30 0.05 1 54 GLU -1.70 0.02 1 55 ASP -2.70 0.05 1 56 ASP 3.60 -0.16 1 57 LEU 3.90 -0.90 1 58 GLU 3.70 -0.54 1 59 THR 7.70 -0.63 1 60 ALA 4.10 -0.51 1 61 LEU 2.90 -0.51 1 62 ARG 5.80 -0.26 1 63 ALA 3.70 -0.20 1 64 THR 8.40 -0.75 1 65 GLN -0.20 -0.54 1 66 GLU 2.60 -0.44 1 68 ALA -2.80 0.31 1 70 ILE -1.20 -0.08 1 71 GLU -2.40 -0.17 1 72 ALA 3.40 -0.50 1 74 GLN -1.40 -0.02 1 75 LEU -5.60 0.74 1 76 THR -1.30 0.10 1 77 ILE 1.90 0.17 1 78 ILE 0.70 0.07 1 79 GLU 0.70 0.02 1 81 PHE -1.70 -0.36 1 82 LYS -1.70 -0.08 1 83 ARG -6.40 0.10 1 84 GLU -3.00 0.42 1 85 LEU -2.20 0.34 1 86 ASN -3.30 0.79 1 88 VAL -0.80 0.22 1 89 ALA -3.20 0.31 1 90 ARG 4.60 -0.46 1 91 ASN 3.80 -0.91 1 95 THR -2.30 0.89 1 96 VAL -4.60 0.85 1 97 ILE -2.20 0.52 1 98 TYR -5.10 0.92 1 99 TRP -2.40 0.32 1 100 LEU -3.70 1.00 1 101 ALA -7.60 1.02 1 103 VAL 0.40 0.41 1 104 LYS 2.40 -0.36 1 105 ASP -3.10 0.13 1 106 TYR 2.70 -1.11 1 107 ASP -0.80 -0.02 1 108 VAL 1.30 -0.33 1 109 GLU -0.60 -0.21 1 110 ILE -0.70 0.02 1 111 ARG -2.40 0.10 1 112 LEU -1.50 0.29 1 113 SER -4.10 0.35 1 114 HIS 2.70 -0.29 1 115 GLU 0.70 -0.53 1 116 HIS -3.30 0.43 1 118 ALA -3.80 0.22 1 119 TYR -5.00 1.24 1 120 ARG -5.60 0.04 1 121 TRP -2.50 0.60 1 122 LEU -6.40 0.55 1 124 LEU 5.10 -0.44 1 125 GLU -2.70 -0.54 1 126 GLU 2.90 -0.46 1 127 ALA 4.00 -0.60 1 129 GLN 3.80 -0.45 1 130 LEU 2.10 -0.37 1 131 ALA 2.30 -0.08 1 134 LYS 5.00 -0.51 1 135 GLU 5.00 -0.26 1 137 LYS 4.60 -0.51 1 138 ALA 3.60 -0.22 1 139 ALA 4.50 -0.32 1 140 LEU 3.90 -0.90 1 141 GLN -1.10 -0.54 1 142 GLU 3.60 -0.26 1 144 HIS 5.00 -0.85 1 145 GLN 4.30 -0.38 1 146 PHE 4.20 -0.52 1 147 LEU 2.30 -0.59 1 149 SER 1.10 -0.14 1 150 ILE 0.90 -0.17 1 151 GLU -6.50 -0.14 1 152 ALA 0.20 -0.26 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6330_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.60 _LACS_plot.Line_1_terminator_val_y_1 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.60 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.94 _LACS_plot.Line_2_terminator_val_x_2 8.39 _LACS_plot.Line_2_terminator_val_y_2 2.76 _LACS_plot.Y_axis_chem_shift_offset 0.20 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 58 GLU 3.70 -7.60 0 60 ALA 4.10 -8.40 0 10 ALA -6.10 -2.00 1 13 LEU -5.30 -2.60 1 14 ILE 1.50 -1.70 1 15 ILE -2.00 0.00 1 16 PHE -6.30 -4.30 1 17 ARG -6.80 -2.60 1 18 ARG 1.40 -0.90 1 20 LEU 1.50 -0.50 1 23 LYS -0.40 0.20 1 24 VAL 1.70 -0.40 1 25 ASP 0.80 -0.60 1 26 ASN -0.10 -0.40 1 27 ASN -0.30 -0.60 1 28 ALA 1.00 -0.60 1 29 ILE -2.00 -1.00 1 30 GLU -7.60 -1.70 1 31 PHE -3.10 -0.50 1 32 LEU -0.80 -2.20 1 33 LEU -5.90 -3.30 1 34 LEU -3.30 -1.80 1 36 ALA 0.20 0.20 1 37 SER 0.20 -1.40 1 38 ASP -2.90 -0.80 1 47 LYS -1.30 -1.90 1 49 HIS 0.10 0.80 1 50 VAL -0.20 0.30 1 54 GLU -1.70 -0.10 1 55 ASP -2.70 0.20 1 56 ASP 3.60 0.90 1 57 LEU 3.90 1.40 1 59 THR 7.70 0.80 1 61 LEU 2.90 2.20 1 62 ARG 5.80 2.20 1 63 ALA 3.70 1.90 1 64 THR 8.40 1.50 1 65 GLN -0.20 3.20 1 66 GLU 2.60 3.30 1 68 ALA -2.80 -0.50 1 70 ILE -1.20 -1.60 1 71 GLU -2.40 1.00 1 72 ALA 3.40 2.30 1 74 GLN -1.40 -1.30 1 75 LEU -5.60 -2.20 1 76 THR -1.30 -0.60 1 77 ILE 1.90 0.10 1 78 ILE 0.70 0.00 1 79 GLU 0.70 0.90 1 81 PHE -1.70 -2.60 1 82 LYS -1.70 -1.60 1 83 ARG -6.40 -3.40 1 84 GLU -3.00 -1.70 1 85 LEU -2.20 -2.60 1 86 ASN -3.30 -1.60 1 90 ARG 4.60 -0.40 1 96 VAL -4.60 -3.10 1 97 ILE -2.20 -2.30 1 98 TYR -5.10 -0.50 1 99 TRP -2.40 -0.90 1 100 LEU -3.70 -1.30 1 101 ALA -7.60 -4.90 1 102 GLU -5.90 1.70 1 103 VAL 0.40 -0.40 1 104 LYS 2.40 -0.10 1 105 ASP -3.10 -1.50 1 106 TYR 2.70 -0.60 1 107 ASP -0.80 -0.80 1 108 VAL 1.30 -2.90 1 109 GLU -0.60 -1.60 1 110 ILE -0.70 -0.60 1 111 ARG -2.40 -1.80 1 112 LEU -1.50 0.30 1 113 SER -4.10 0.30 1 114 HIS 2.70 2.10 1 115 GLU 0.70 -0.70 1 116 HIS -3.30 -1.00 1 118 ALA -3.80 -3.10 1 119 TYR -5.00 -2.60 1 120 ARG -5.60 -2.70 1 121 TRP -2.50 1.20 1 122 LEU -6.40 -0.70 1 124 LEU 5.10 0.30 1 125 GLU -2.70 3.00 1 126 GLU 2.90 2.00 1 127 ALA 4.00 1.40 1 129 GLN 3.80 2.40 1 130 LEU 2.10 0.60 1 135 GLU 5.00 1.90 1 138 ALA 3.60 1.40 1 139 ALA 4.50 1.60 1 140 LEU 3.90 0.90 1 141 GLN -1.10 3.40 1 142 GLU 3.60 -7.40 1 144 HIS 5.00 3.10 1 145 GLN 4.30 2.80 1 146 PHE 4.20 2.70 1 147 LEU 2.30 2.10 1 149 SER 1.10 -0.40 1 150 ILE 0.90 -0.40 1 151 GLU -6.50 -1.60 1 stop_ save_