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 bmr16404_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 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.72 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.49 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 5.49 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 HIS -3.50 2.10 0 10 MET 4.60 4.30 1 11 ALA 4.00 2.70 1 12 GLU 4.20 4.70 1 13 TYR 3.10 2.50 1 14 LYS 4.40 3.00 1 15 GLN 4.50 3.10 1 16 LEU 2.20 2.20 1 17 THR 3.40 2.70 1 18 LEU 1.30 1.50 1 19 ASN -1.30 -0.50 1 22 GLU 0.80 0.70 1 24 ILE -4.60 -1.40 1 25 VAL -2.60 -0.70 1 26 ALA -4.50 -1.00 1 29 MET 0.60 0.20 1 30 ASN -1.90 -0.60 1 31 GLU 2.90 1.90 1 32 GLU 0.50 0.50 1 33 ASN -1.10 -1.60 1 34 PHE 2.50 2.40 1 35 PHE 3.30 1.80 1 36 GLU -3.10 -1.40 1 37 TRP -4.90 -2.60 1 38 GLU -4.70 -2.20 1 39 ALA -6.20 -2.50 1 40 LEU -2.40 -0.80 1 41 ILE -2.60 -1.70 1 42 MET -0.60 -1.60 1 45 GLU 0.30 0.50 1 46 ASP 3.50 1.60 1 47 THR -6.40 -1.70 1 49 PHE 0.50 0.30 1 50 GLU 1.30 0.90 1 51 PHE 5.20 2.10 1 53 VAL -0.50 -0.30 1 54 PHE -3.20 -1.50 1 56 ALA -7.60 -2.50 1 57 ILE -4.30 -2.00 1 58 LEU -4.00 -1.10 1 59 SER -1.90 -2.20 1 60 PHE -0.30 0.60 1 62 LEU 2.60 1.70 1 63 ASP -0.50 -2.30 1 64 TYR 1.40 2.70 1 66 LEU 4.40 2.70 1 67 SER -1.10 -0.70 1 70 LYS -2.80 -1.40 1 71 MET -4.30 -0.90 1 72 ARG -5.10 -2.30 1 73 PHE 1.30 2.20 1 74 THR 1.50 -0.50 1 76 GLU -0.20 0.20 1 77 MET -6.00 -2.50 1 78 PHE 0.60 0.70 1 81 ASN -1.60 -0.10 1 82 ILE -2.40 -1.30 1 83 TYR 3.40 3.40 1 85 ASP 0.30 -0.80 1 87 ARG 2.00 2.30 1 88 VAL 1.40 1.70 1 90 ILE -4.10 -1.70 1 91 SER 1.30 1.00 1 92 ILE 3.00 2.60 1 93 LEU -1.00 -2.10 1 94 HIS -0.80 1.20 1 95 ALA -0.30 -0.30 1 98 ASP -0.10 -0.20 1 99 ASP 0.20 0.30 1 101 MET 0.60 -0.30 1 103 TYR -0.20 -0.30 1 104 GLU -0.20 0.20 1 105 SER 1.30 1.00 1 106 SER 0.40 -0.10 1 107 ALA 0.00 -0.10 1 108 GLU -0.10 0.20 1 109 ARG -4.30 -2.70 1 110 TRP 2.60 2.40 1 111 SER 0.40 0.20 1 113 VAL 1.50 -0.70 1 114 GLN 0.70 -1.40 1 115 SER -4.60 -2.20 1 116 VAL 7.10 5.20 1 117 GLU 4.10 4.20 1 118 LYS 3.80 2.90 1 119 ILE 5.30 4.90 1 120 LEU 5.00 3.20 1 121 LEU 3.90 2.90 1 122 SER 5.00 3.90 1 123 VAL 6.40 4.40 1 124 VAL 7.40 6.00 1 125 SER 3.90 3.10 1 126 MET 3.40 1.70 1 127 LEU 4.10 2.60 1 128 ALA 1.00 1.40 1 129 GLU -2.60 -1.10 1 131 ASN -1.70 -1.10 1 132 ASP 0.60 0.20 1 133 GLU 1.10 0.90 1 134 SER -0.60 -0.50 1 136 ALA 3.40 1.80 1 137 ASN -1.00 -1.90 1 138 VAL 4.70 3.50 1 139 ASP 4.20 3.30 1 140 ALA 4.70 2.00 1 141 SER 6.50 4.50 1 142 LYS 4.00 3.20 1 143 MET 2.20 3.50 1 144 TRP 3.90 3.30 1 145 ARG 2.30 2.60 1 146 ASP 0.80 1.50 1 147 ASP -0.70 -1.80 1 148 ARG 4.70 2.60 1 149 GLU 3.80 3.00 1 150 GLN 4.20 2.40 1 151 PHE 5.70 5.00 1 152 TYR 3.00 1.10 1 153 LYS 4.60 3.80 1 154 ILE 4.90 3.10 1 155 ALA 3.40 3.10 1 156 LYS 4.40 3.20 1 157 GLN 4.40 3.00 1 158 ILE 4.30 1.60 1 159 VAL 6.80 5.40 1 160 GLN 5.30 3.90 1 161 LYS 3.80 3.10 1 162 SER 5.80 3.80 1 163 LEU -0.60 -0.40 1 165 LEU -0.70 0.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16404_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 4.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.28 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.51 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 -1.91 _LACS_plot.Y_axis_chem_shift_offset 0.03 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 79 HIS -3.50 5.60 0 10 MET 4.60 -0.30 1 11 ALA 4.00 -1.30 1 12 GLU 4.20 0.50 1 13 TYR 3.10 -0.60 1 14 LYS 4.40 -1.40 1 15 GLN 4.50 -1.40 1 16 LEU 2.20 0.00 1 17 THR 3.40 -0.70 1 18 LEU 1.30 0.20 1 19 ASN -1.30 0.80 1 22 GLU 0.80 -0.10 1 24 ILE -4.60 3.20 1 25 VAL -2.60 1.90 1 26 ALA -4.50 3.50 1 29 MET 0.60 -0.40 1 30 ASN -1.90 1.30 1 31 GLU 2.90 -1.00 1 32 GLU 0.50 0.00 1 33 ASN -1.10 -0.50 1 34 PHE 2.50 -0.10 1 35 PHE 3.30 -1.50 1 36 GLU -3.10 1.70 1 37 TRP -4.90 2.30 1 38 GLU -4.70 2.50 1 39 ALA -6.20 3.70 1 40 LEU -2.40 1.60 1 41 ILE -2.60 0.90 1 42 MET -0.60 -1.00 1 45 GLU 0.30 0.20 1 46 ASP 3.50 -1.90 1 47 THR -6.40 4.70 1 49 PHE 0.50 -0.20 1 50 GLU 1.30 -0.40 1 51 PHE 5.20 -3.10 1 53 VAL -0.50 0.20 1 54 PHE -3.20 1.70 1 56 ALA -7.60 5.10 1 57 ILE -4.30 2.30 1 58 LEU -4.00 2.90 1 59 SER -1.90 -0.30 1 60 PHE -0.30 0.90 1 62 LEU 2.60 -0.90 1 63 ASP -0.50 -1.80 1 64 TYR 1.40 1.30 1 66 LEU 4.40 -1.70 1 67 SER -1.10 0.40 1 70 LYS -2.80 1.40 1 71 MET -4.30 3.40 1 72 ARG -5.10 2.80 1 73 PHE 1.30 0.90 1 74 THR 1.50 -2.00 1 76 GLU -0.20 0.40 1 77 MET -6.00 3.50 1 78 PHE 0.60 0.10 1 81 ASN -1.60 1.50 1 82 ILE -2.40 1.10 1 83 TYR 3.40 0.00 1 85 ASP 0.30 -1.10 1 87 ARG 2.00 0.30 1 88 VAL 1.40 0.30 1 90 ILE -4.10 2.40 1 91 SER 1.30 -0.30 1 92 ILE 3.00 -0.40 1 93 LEU -1.00 -1.10 1 94 HIS -0.80 2.00 1 95 ALA -0.30 0.00 1 98 ASP -0.10 -0.10 1 99 ASP 0.20 0.10 1 101 MET 0.60 -0.90 1 103 TYR -0.20 -0.10 1 104 GLU -0.20 0.40 1 105 SER 1.30 -0.30 1 106 SER 0.40 -0.50 1 107 ALA 0.00 -0.10 1 108 GLU -0.10 0.30 1 109 ARG -4.30 1.60 1 110 TRP 2.60 -0.20 1 111 SER 0.40 -0.20 1 113 VAL 1.50 -2.20 1 114 GLN 0.70 -2.10 1 115 SER -4.60 2.40 1 116 VAL 7.10 -1.90 1 117 GLU 4.10 0.10 1 118 LYS 3.80 -0.90 1 119 ILE 5.30 -0.40 1 120 LEU 5.00 -1.80 1 121 LEU 3.90 -1.00 1 122 SER 5.00 -1.10 1 123 VAL 6.40 -2.00 1 124 VAL 7.40 -1.40 1 125 SER 3.90 -0.80 1 126 MET 3.40 -1.70 1 127 LEU 4.10 -1.50 1 128 ALA 1.00 0.40 1 129 GLU -2.60 1.50 1 131 ASN -1.70 0.60 1 132 ASP 0.60 -0.40 1 133 GLU 1.10 -0.20 1 134 SER -0.60 0.10 1 136 ALA 3.40 -1.60 1 137 ASN -1.00 -0.90 1 138 VAL 4.70 -1.20 1 139 ASP 4.20 -0.90 1 140 ALA 4.70 -2.70 1 141 SER 6.50 -2.00 1 142 LYS 4.00 -0.80 1 143 MET 2.20 1.30 1 144 TRP 3.90 -0.60 1 145 ARG 2.30 0.30 1 146 ASP 0.80 0.70 1 147 ASP -0.70 -1.10 1 148 ARG 4.70 -2.10 1 149 GLU 3.80 -0.80 1 150 GLN 4.20 -1.80 1 151 PHE 5.70 -0.70 1 152 TYR 3.00 -1.90 1 153 LYS 4.60 -0.80 1 154 ILE 4.90 -1.80 1 155 ALA 3.40 -0.30 1 156 LYS 4.40 -1.20 1 157 GLN 4.40 -1.40 1 158 ILE 4.30 -2.70 1 159 VAL 6.80 -1.40 1 160 GLN 5.30 -1.40 1 161 LYS 3.80 -0.70 1 162 SER 5.80 -2.00 1 163 LEU -0.60 0.20 1 165 LEU -0.70 1.00 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16404_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 0.83 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.19 _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 7.40 _LACS_plot.Line_2_terminator_val_y_2 -0.70 _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 26 ALA -4.50 1.13 0 91 SER 1.30 -0.94 0 36 GLU -3.10 1.13 0 50 GLU 1.30 -1.01 0 10 MET 4.60 -0.45 1 11 ALA 4.00 -0.12 1 12 GLU 4.20 -0.14 1 13 TYR 3.10 -0.10 1 14 LYS 4.40 -0.57 1 15 GLN 4.50 -0.29 1 16 LEU 2.20 -0.25 1 17 THR 3.40 -0.39 1 18 LEU 1.30 -0.15 1 19 ASN -1.30 0.05 1 22 GLU 0.80 -0.24 1 24 ILE -4.60 0.74 1 25 VAL -2.60 0.20 1 29 MET 0.60 -0.02 1 30 ASN -1.90 -0.21 1 31 GLU 2.90 -0.82 1 32 GLU 0.50 -0.08 1 33 ASN -1.10 0.45 1 34 PHE 2.50 -0.69 1 35 PHE 3.30 -0.25 1 37 TRP -4.90 0.70 1 38 GLU -4.70 0.90 1 39 ALA -6.20 1.13 1 40 LEU -2.40 0.36 1 41 ILE -2.60 0.35 1 42 MET -0.60 0.50 1 45 GLU 0.30 -0.59 1 46 ASP 3.50 -0.38 1 47 THR -6.40 0.62 1 49 PHE 0.50 0.11 1 51 PHE 5.20 -0.48 1 53 VAL -0.50 -0.11 1 54 PHE -3.20 -0.26 1 56 ALA -7.60 0.83 1 57 ILE -4.30 0.90 1 58 LEU -4.00 0.61 1 59 SER -1.90 0.58 1 60 PHE -0.30 -0.63 1 62 LEU 2.60 -0.36 1 63 ASP -0.50 0.07 1 64 TYR 1.40 -0.31 1 66 LEU 4.40 -0.20 1 67 SER -1.10 -0.14 1 70 LYS -2.80 -0.08 1 71 MET -4.30 0.78 1 72 ARG -5.10 0.74 1 73 PHE 1.30 0.33 1 74 THR 1.50 0.12 1 76 GLU -0.20 -0.26 1 77 MET -6.00 0.22 1 78 PHE 0.60 -0.10 1 79 HIS -3.50 0.46 1 81 ASN -1.60 0.29 1 82 ILE -2.40 0.41 1 83 TYR 3.40 -0.26 1 85 ASP 0.30 -0.08 1 87 ARG 2.00 0.16 1 88 VAL 1.40 -0.27 1 90 ILE -4.10 0.63 1 92 ILE 3.00 -0.16 1 93 LEU -1.00 0.18 1 94 HIS -0.80 0.04 1 95 ALA -0.30 0.05 1 98 ASP -0.10 -0.03 1 99 ASP 0.20 -0.17 1 101 MET 0.60 -0.13 1 103 TYR -0.20 -0.04 1 104 GLU -0.20 -0.10 1 105 SER 1.30 -0.15 1 106 SER 0.40 -0.07 1 107 ALA 0.00 -0.07 1 108 GLU -0.10 -0.27 1 109 ARG -4.30 0.58 1 110 TRP 2.60 -0.46 1 111 SER 0.40 -0.39 1 113 VAL 1.50 0.10 1 114 GLN 0.70 0.11 1 115 SER -4.60 0.48 1 116 VAL 7.10 -0.57 1 117 GLU 4.10 -0.68 1 118 LYS 3.80 -0.32 1 119 ILE 5.30 -0.63 1 120 LEU 5.00 -0.52 1 121 LEU 3.90 -0.25 1 122 SER 5.00 -0.17 1 123 VAL 6.40 -0.48 1 124 VAL 7.40 -0.68 1 125 SER 3.90 -0.22 1 126 MET 3.40 -0.28 1 127 LEU 4.10 -0.65 1 128 ALA 1.00 0.04 1 129 GLU -2.60 -0.40 1 131 ASN -1.70 -0.08 1 132 ASP 0.60 -0.25 1 133 GLU 1.10 -0.24 1 134 SER -0.60 -0.20 1 136 ALA 3.40 -0.69 1 137 ASN -1.00 0.06 1 138 VAL 4.70 -0.41 1 139 ASP 4.20 -0.11 1 140 ALA 4.70 -0.45 1 141 SER 6.50 -0.48 1 142 LYS 4.00 -0.36 1 143 MET 2.20 -0.40 1 144 TRP 3.90 -1.11 1 145 ARG 2.30 -0.46 1 146 ASP 0.80 0.03 1 147 ASP -0.70 0.16 1 148 ARG 4.70 -0.84 1 149 GLU 3.80 -0.37 1 150 GLN 4.20 -0.25 1 151 PHE 5.70 -0.55 1 152 TYR 3.00 -0.10 1 153 LYS 4.60 -0.30 1 154 ILE 4.90 -0.61 1 155 ALA 3.40 -0.44 1 156 LYS 4.40 -0.23 1 157 GLN 4.40 -0.19 1 158 ILE 4.30 -0.33 1 159 VAL 6.80 -0.40 1 160 GLN 5.30 -0.41 1 161 LYS 3.80 -0.09 1 162 SER 5.80 -0.08 1 163 LEU -0.60 0.12 1 165 LEU -0.70 -0.08 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16404_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 -2.63 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.66 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.75 _LACS_plot.Line_2_terminator_val_x_2 7.40 _LACS_plot.Line_2_terminator_val_y_2 2.49 _LACS_plot.Y_axis_chem_shift_offset 0.04 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 19 ASN -1.30 6.80 0 129 GLU -2.60 6.30 0 10 MET 4.60 2.60 1 11 ALA 4.00 3.60 1 12 GLU 4.20 2.90 1 13 TYR 3.10 1.60 1 14 LYS 4.40 2.20 1 15 GLN 4.50 2.30 1 16 LEU 2.20 0.60 1 17 THR 3.40 1.60 1 18 LEU 1.30 -0.20 1 22 GLU 0.80 1.00 1 24 ILE -4.60 -1.60 1 25 VAL -2.60 -1.40 1 26 ALA -4.50 -1.30 1 29 MET 0.60 -0.30 1 30 ASN -1.90 -0.10 1 31 GLU 2.90 -0.80 1 32 GLU 0.50 -0.30 1 33 ASN -1.10 -0.40 1 34 PHE 2.50 -1.00 1 35 PHE 3.30 -0.90 1 36 GLU -3.10 -1.60 1 37 TRP -4.90 -1.00 1 38 GLU -4.70 -1.70 1 39 ALA -6.20 -2.70 1 40 LEU -2.40 -2.40 1 41 ILE -2.60 -1.70 1 42 MET -0.60 1.20 1 45 GLU 0.30 -0.90 1 46 ASP 3.50 -1.20 1 47 THR -6.40 1.90 1 49 PHE 0.50 -1.80 1 50 GLU 1.30 -1.80 1 51 PHE 5.20 -0.30 1 53 VAL -0.50 -1.70 1 54 PHE -3.20 -0.80 1 56 ALA -7.60 -2.00 1 57 ILE -4.30 -0.10 1 58 LEU -4.00 -3.60 1 59 SER -1.90 -0.20 1 60 PHE -0.30 -1.70 1 62 LEU 2.60 -1.00 1 63 ASP -0.50 0.40 1 64 TYR 1.40 -1.00 1 66 LEU 4.40 -0.10 1 70 LYS -2.80 -1.50 1 71 MET -4.30 -3.10 1 72 ARG -5.10 -1.00 1 73 PHE 1.30 -1.60 1 74 THR 1.50 -0.50 1 76 GLU -0.20 -0.40 1 77 MET -6.00 -2.10 1 78 PHE 0.60 5.00 1 79 HIS -3.50 0.70 1 81 ASN -1.60 -3.00 1 82 ILE -2.40 -0.40 1 83 TYR 3.40 2.10 1 85 ASP 0.30 0.40 1 87 ARG 2.00 -0.50 1 88 VAL 1.40 -1.30 1 90 ILE -4.10 0.60 1 91 SER 1.30 2.10 1 92 ILE 3.00 -3.60 1 93 LEU -1.00 -1.30 1 94 HIS -0.80 0.70 1 95 ALA -0.30 -0.40 1 98 ASP -0.10 -0.50 1 99 ASP 0.20 -0.20 1 101 MET 0.60 0.30 1 103 TYR -0.20 0.00 1 104 GLU -0.20 0.40 1 105 SER 1.30 0.30 1 106 SER 0.40 -0.30 1 107 ALA 0.00 -0.40 1 108 GLU -0.10 -0.70 1 109 ARG -4.30 -0.50 1 110 TRP 2.60 0.50 1 113 VAL 1.50 1.30 1 114 GLN 0.70 -3.40 1 115 SER -4.60 -0.20 1 116 VAL 7.10 1.50 1 117 GLU 4.10 0.60 1 118 LYS 3.80 4.00 1 119 ILE 5.30 1.00 1 120 LEU 5.00 1.40 1 121 LEU 3.90 3.10 1 122 SER 5.00 2.40 1 123 VAL 6.40 0.70 1 124 VAL 7.40 1.90 1 125 SER 3.90 1.70 1 126 MET 3.40 2.20 1 127 LEU 4.10 -0.90 1 128 ALA 1.00 0.30 1 131 ASN -1.70 -0.40 1 132 ASP 0.60 0.30 1 133 GLU 1.10 0.00 1 134 SER -0.60 0.30 1 136 ALA 3.40 -0.70 1 137 ASN -1.00 1.60 1 138 VAL 4.70 1.50 1 139 ASP 4.20 3.00 1 140 ALA 4.70 1.10 1 141 SER 6.50 3.20 1 142 LYS 4.00 1.20 1 143 MET 2.20 1.60 1 144 TRP 3.90 0.50 1 145 ARG 2.30 2.30 1 146 ASP 0.80 0.40 1 147 ASP -0.70 -1.40 1 148 ARG 4.70 1.30 1 149 GLU 3.80 3.20 1 150 GLN 4.20 1.80 1 151 PHE 5.70 1.50 1 152 TYR 3.00 2.70 1 153 LYS 4.60 3.10 1 154 ILE 4.90 2.00 1 155 ALA 3.40 1.60 1 156 LYS 4.40 3.10 1 157 GLN 4.40 2.80 1 158 ILE 4.30 3.80 1 159 VAL 6.80 3.00 1 160 GLN 5.30 2.90 1 161 LYS 3.80 4.00 1 162 SER 5.80 0.40 1 163 LEU -0.60 0.00 1 165 LEU -0.70 -5.60 1 stop_ save_