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 bmr6057_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.10 _LACS_plot.Line_1_terminator_val_y_1 -3.10 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.10 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.97 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 3.65 _LACS_plot.Y_axis_chem_shift_offset 0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 PHE -6.20 0.80 0 10 ILE 0.20 -1.10 1 11 LEU 0.20 -1.20 1 12 GLN -0.30 0.20 1 13 THR -2.00 -1.90 1 14 TYR -6.70 -2.10 1 15 ARG -5.80 -3.30 1 16 ALA -2.10 -1.70 1 17 ILE 0.80 -0.50 1 18 ALA -4.30 -2.00 1 19 ASP 1.50 -1.60 1 20 TYR -2.50 -0.50 1 21 GLU -1.70 -2.20 1 22 LYS 0.70 0.00 1 23 THR -0.80 -0.70 1 24 SER -1.20 -0.40 1 26 SER -0.10 -0.30 1 27 GLU -2.90 -1.00 1 28 MET -3.10 -1.00 1 29 ALA -2.20 -1.60 1 30 LEU -5.10 -1.70 1 31 SER -2.90 -2.00 1 32 THR 5.00 3.10 1 34 ASP 1.30 1.50 1 35 VAL -0.30 -1.10 1 36 VAL -5.30 -4.30 1 37 GLU -3.60 -2.50 1 38 VAL 2.30 0.40 1 39 VAL 2.80 1.40 1 40 GLU -4.00 -1.10 1 41 LYS -1.10 -2.00 1 42 SER -1.40 -1.20 1 43 GLU 2.50 0.90 1 44 SER 0.40 1.30 1 46 TRP -1.40 -1.60 1 47 TRP -6.00 -4.20 1 48 PHE 0.40 -0.80 1 50 GLN -5.30 -2.40 1 51 MET -1.70 -0.10 1 52 LYS 6.10 2.10 1 53 ALA 1.20 0.10 1 54 LYS -1.90 -1.10 1 55 ARG -3.60 -1.60 1 57 TRP -1.20 -0.30 1 58 ILE -5.30 -2.20 1 60 ALA 4.60 1.50 1 61 SER 2.10 0.80 1 62 PHE 3.20 2.10 1 63 LEU -5.80 -2.60 1 64 GLU -3.80 -2.40 1 66 LEU 2.50 1.10 1 67 ASP 1.30 0.70 1 68 SER -3.00 -1.70 1 70 ASP -0.30 0.10 1 71 GLU -0.60 -1.90 1 72 THR 2.30 1.80 1 73 GLU 0.00 -0.40 1 74 ASP 2.40 1.50 1 76 GLU 0.90 0.00 1 78 ASN -1.70 -2.90 1 79 TYR 5.10 3.20 1 80 ALA 3.20 1.50 1 82 GLU -5.30 -1.40 1 84 TYR -7.10 -1.30 1 85 VAL -5.30 -3.30 1 86 ALA 1.20 -0.70 1 87 ILE 0.00 -1.00 1 88 LYS -2.90 -1.30 1 89 ALA -0.70 -0.90 1 90 TYR -1.70 0.60 1 91 THR -1.00 -1.40 1 92 ALA -0.60 0.20 1 93 VAL 1.10 0.50 1 94 GLU -3.70 -2.20 1 96 ASP 0.10 -2.00 1 97 GLU -4.20 -2.10 1 98 VAL -2.80 -1.60 1 99 SER -0.70 -0.90 1 100 LEU -4.20 -1.80 1 101 LEU -2.00 -2.60 1 102 GLU 3.30 1.80 1 104 GLU 1.20 1.70 1 105 ALA -1.50 -1.40 1 106 VAL -6.10 -3.40 1 107 GLU -4.70 -2.80 1 108 VAL 2.20 1.00 1 109 ILE -1.80 -1.60 1 110 HIS -6.10 -0.90 1 111 LYS 0.40 -1.80 1 112 LEU -0.20 -0.10 1 113 LEU 1.60 1.00 1 114 ASP 1.30 -1.30 1 116 TRP 1.60 -0.40 1 117 TRP -5.20 -3.80 1 118 VAL 2.20 -0.40 1 119 ILE -6.00 -3.30 1 120 ARG -5.20 -2.30 1 121 LYS -1.50 -1.50 1 122 ASP 4.70 2.60 1 123 ASP 1.20 0.40 1 124 VAL 0.00 -0.10 1 125 THR -4.00 -2.60 1 127 TYR -1.90 0.90 1 130 SER 4.50 1.40 1 131 MET 1.30 0.60 1 132 TYR -2.20 -5.00 1 133 LEU -5.30 -2.10 1 134 GLN -5.50 -2.00 1 135 LYS 2.30 1.00 1 136 SER 1.80 0.90 1 138 GLN -1.00 -1.20 1 139 ASP 0.00 -0.20 1 140 VAL 2.10 0.70 1 141 SER 1.40 1.00 1 142 GLN 2.70 1.10 1 143 ALA 2.20 1.10 1 144 GLN 2.80 1.30 1 145 ARG 2.10 0.80 1 146 GLN 0.90 -0.40 1 147 ILE 2.30 0.70 1 148 LYS 1.50 0.00 1 149 ARG 0.10 -0.50 1 151 ALA 1.90 -0.40 1 154 ARG -0.30 -0.80 1 155 ARG 4.90 1.90 1 156 SER 3.00 0.80 1 157 SER 0.00 0.50 1 158 ILE 2.50 0.40 1 159 ARG 0.90 -0.30 1 160 ASN 1.60 -0.30 1 161 ALA -0.50 -0.70 1 162 HIS -1.90 0.20 1 163 SER -3.80 -3.30 1 164 ILE 2.00 0.30 1 165 HIS -3.40 -0.20 1 166 GLN 1.90 0.70 1 167 ARG -1.60 -1.80 1 168 SER -1.40 -0.90 1 169 ARG 0.70 -0.50 1 170 LYS 1.80 0.30 1 171 ARG -1.80 -1.80 1 172 LEU 1.40 -0.20 1 173 SER -2.20 -1.40 1 174 GLN 5.50 3.40 1 175 ASP 3.20 2.70 1 176 ALA 3.50 2.30 1 177 TYR 6.20 5.40 1 178 ARG 5.50 3.70 1 179 ARG 4.90 3.10 1 180 ASN 3.60 1.70 1 181 SER 4.30 3.50 1 182 VAL 5.80 3.90 1 183 ARG 4.60 2.60 1 184 PHE 4.20 3.30 1 185 LEU 3.70 1.90 1 186 GLN 3.80 2.10 1 187 GLN 2.70 1.20 1 188 ARG 2.10 0.80 1 189 ARG 1.90 0.50 1 190 ARG 1.50 0.20 1 191 GLN 0.40 -0.30 1 192 ALA 0.30 -0.30 1 193 ARG 1.30 1.00 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6057_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.10 _LACS_plot.Line_1_terminator_val_y_1 4.00 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.90 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.03 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 -2.54 _LACS_plot.Y_axis_chem_shift_offset 0.60 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 128 PHE -6.20 7.00 0 10 ILE 0.20 -1.30 1 11 LEU 0.20 -1.40 1 12 GLN -0.30 0.50 1 13 THR -2.00 0.10 1 14 TYR -6.70 4.60 1 15 ARG -5.80 2.50 1 16 ALA -2.10 0.40 1 17 ILE 0.80 -1.30 1 18 ALA -4.30 2.30 1 19 ASP 1.50 -3.10 1 20 TYR -2.50 2.00 1 21 GLU -1.70 -0.50 1 22 LYS 0.70 -0.70 1 23 THR -0.80 0.10 1 24 SER -1.20 0.80 1 26 SER -0.10 -0.20 1 27 GLU -2.90 1.90 1 28 MET -3.10 2.10 1 29 ALA -2.20 0.60 1 30 LEU -5.10 3.40 1 31 SER -2.90 0.90 1 32 THR 5.00 -1.90 1 34 ASP 1.30 0.20 1 35 VAL -0.30 -0.80 1 36 VAL -5.30 1.00 1 37 GLU -3.60 1.10 1 38 VAL 2.30 -1.90 1 39 VAL 2.80 -1.40 1 40 GLU -4.00 2.90 1 41 LYS -1.10 -0.90 1 42 SER -1.40 0.20 1 43 GLU 2.50 -1.60 1 44 SER 0.40 0.90 1 46 TRP -1.40 -0.20 1 47 TRP -6.00 1.80 1 48 PHE 0.40 -1.20 1 50 GLN -5.30 2.90 1 51 MET -1.70 1.60 1 52 LYS 6.10 -4.00 1 53 ALA 1.20 -1.10 1 54 LYS -1.90 0.80 1 55 ARG -3.60 2.00 1 57 TRP -1.20 0.90 1 58 ILE -5.30 3.10 1 60 ALA 4.60 -3.10 1 61 SER 2.10 -1.30 1 62 PHE 3.20 -1.10 1 63 LEU -5.80 3.20 1 64 GLU -3.80 1.40 1 66 LEU 2.50 -1.40 1 67 ASP 1.30 -0.60 1 68 SER -3.00 1.30 1 70 ASP -0.30 0.40 1 71 GLU -0.60 -1.30 1 72 THR 2.30 -0.50 1 73 GLU 0.00 -0.40 1 74 ASP 2.40 -0.90 1 76 GLU 0.90 -0.90 1 78 ASN -1.70 -1.20 1 79 TYR 5.10 -1.90 1 80 ALA 3.20 -1.70 1 82 GLU -5.30 3.90 1 84 TYR -7.10 5.80 1 85 VAL -5.30 2.00 1 86 ALA 1.20 -1.90 1 87 ILE 0.00 -1.00 1 88 LYS -2.90 1.60 1 89 ALA -0.70 -0.20 1 90 TYR -1.70 2.30 1 91 THR -1.00 -0.40 1 92 ALA -0.60 0.80 1 93 VAL 1.10 -0.60 1 94 GLU -3.70 1.50 1 96 ASP 0.10 -2.10 1 97 GLU -4.20 2.10 1 98 VAL -2.80 1.20 1 99 SER -0.70 -0.20 1 100 LEU -4.20 2.40 1 101 LEU -2.00 -0.60 1 102 GLU 3.30 -1.50 1 104 GLU 1.20 0.50 1 105 ALA -1.50 0.10 1 106 VAL -6.10 2.70 1 107 GLU -4.70 1.90 1 108 VAL 2.20 -1.20 1 109 ILE -1.80 0.20 1 110 HIS -6.10 5.20 1 111 LYS 0.40 -2.20 1 112 LEU -0.20 0.10 1 113 LEU 1.60 -0.60 1 114 ASP 1.30 -2.60 1 116 TRP 1.60 -2.00 1 117 TRP -5.20 1.40 1 118 VAL 2.20 -2.60 1 119 ILE -6.00 2.70 1 120 ARG -5.20 2.90 1 121 LYS -1.50 0.00 1 122 ASP 4.70 -2.10 1 123 ASP 1.20 -0.80 1 124 VAL 0.00 -0.10 1 125 THR -4.00 1.40 1 127 TYR -1.90 2.80 1 130 SER 4.50 -3.10 1 131 MET 1.30 -0.70 1 132 TYR -2.20 -2.80 1 133 LEU -5.30 3.20 1 134 GLN -5.50 3.50 1 135 LYS 2.30 -1.30 1 136 SER 1.80 -0.90 1 138 GLN -1.00 -0.20 1 139 ASP 0.00 -0.20 1 140 VAL 2.10 -1.40 1 141 SER 1.40 -0.40 1 142 GLN 2.70 -1.60 1 143 ALA 2.20 -1.10 1 144 GLN 2.80 -1.50 1 145 ARG 2.10 -1.30 1 146 GLN 0.90 -1.30 1 147 ILE 2.30 -1.60 1 148 LYS 1.50 -1.50 1 149 ARG 0.10 -0.60 1 151 ALA 1.90 -2.30 1 154 ARG -0.30 -0.50 1 155 ARG 4.90 -3.00 1 156 SER 3.00 -2.20 1 157 SER 0.00 0.50 1 158 ILE 2.50 -2.10 1 159 ARG 0.90 -1.20 1 160 ASN 1.60 -1.90 1 161 ALA -0.50 -0.20 1 162 HIS -1.90 2.10 1 163 SER -3.80 0.50 1 164 ILE 2.00 -1.70 1 165 HIS -3.40 3.20 1 166 GLN 1.90 -1.20 1 167 ARG -1.60 -0.20 1 168 SER -1.40 0.50 1 169 ARG 0.70 -1.20 1 170 LYS 1.80 -1.50 1 171 ARG -1.80 0.00 1 172 LEU 1.40 -1.60 1 173 SER -2.20 0.80 1 174 GLN 5.50 -2.10 1 175 ASP 3.20 -0.50 1 176 ALA 3.50 -1.20 1 177 TYR 6.20 -0.80 1 178 ARG 5.50 -1.80 1 179 ARG 4.90 -1.80 1 180 ASN 3.60 -1.90 1 181 SER 4.30 -0.80 1 182 VAL 5.80 -1.90 1 183 ARG 4.60 -2.00 1 184 PHE 4.20 -0.90 1 185 LEU 3.70 -1.80 1 186 GLN 3.80 -1.70 1 187 GLN 2.70 -1.50 1 188 ARG 2.10 -1.30 1 189 ARG 1.90 -1.40 1 190 ARG 1.50 -1.30 1 191 GLN 0.40 -0.70 1 192 ALA 0.30 -0.60 1 193 ARG 1.30 -0.30 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr6057_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.10 _LACS_plot.Line_1_terminator_val_y_1 -1.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.39 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.64 _LACS_plot.Line_2_terminator_val_x_2 6.19 _LACS_plot.Line_2_terminator_val_y_2 1.46 _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 177 TYR 6.20 3.10 0 91 THR -1.00 -3.40 0 28 MET -3.10 -3.70 0 111 LYS 0.40 -3.10 0 163 SER -3.80 1.60 0 179 ARG 4.90 3.40 0 165 HIS -3.40 1.80 0 119 ILE -6.00 -3.70 0 88 LYS -2.90 -3.80 0 52 LYS 6.10 -0.80 0 110 HIS -6.10 0.60 0 122 ASP 4.70 -1.70 0 94 GLU -3.70 2.00 0 10 ILE 0.20 -0.50 1 11 LEU 0.20 -0.40 1 12 GLN -0.30 -0.10 1 13 THR -2.00 -0.80 1 14 TYR -6.70 -2.50 1 15 ARG -5.80 -0.90 1 16 ALA -2.10 1.60 1 17 ILE 0.80 -2.00 1 18 ALA -4.30 -3.30 1 19 ASP 1.50 -1.50 1 20 TYR -2.50 -1.60 1 21 GLU -1.70 -1.90 1 22 LYS 0.70 0.70 1 23 THR -0.80 -0.30 1 26 SER -0.10 0.20 1 27 GLU -2.90 -1.40 1 29 ALA -2.20 -0.40 1 30 LEU -5.10 -0.50 1 31 SER -2.90 -1.30 1 32 THR 5.00 1.00 1 34 ASP 1.30 -1.20 1 35 VAL -0.30 0.00 1 36 VAL -5.30 -1.70 1 37 GLU -3.60 0.20 1 38 VAL 2.30 -1.90 1 39 VAL 2.80 0.40 1 40 GLU -4.00 -1.60 1 41 LYS -1.10 -1.40 1 42 SER -1.40 1.70 1 43 GLU 2.50 -0.60 1 44 SER 0.40 0.60 1 46 TRP -1.40 -1.70 1 47 TRP -6.00 -1.00 1 48 PHE 0.40 -0.50 1 50 GLN -5.30 -2.20 1 51 MET -1.70 -1.40 1 53 ALA 1.20 -0.70 1 54 LYS -1.90 -1.90 1 55 ARG -3.60 -0.40 1 57 TRP -1.20 0.20 1 60 ALA 4.60 1.50 1 61 SER 2.10 0.60 1 62 PHE 3.20 -1.70 1 63 LEU -5.80 -0.70 1 66 LEU 2.50 1.00 1 67 ASP 1.30 -0.40 1 70 ASP -0.30 -1.90 1 71 GLU -0.60 0.90 1 72 THR 2.30 2.00 1 73 GLU 0.00 -0.50 1 74 ASP 2.40 0.40 1 76 GLU 0.90 0.30 1 78 ASN -1.70 0.50 1 79 TYR 5.10 -0.10 1 80 ALA 3.20 1.50 1 82 GLU -5.30 0.70 1 84 TYR -7.10 -1.60 1 85 VAL -5.30 -1.00 1 86 ALA 1.20 1.70 1 87 ILE 0.00 -1.90 1 89 ALA -0.70 -0.30 1 90 TYR -1.70 -2.30 1 92 ALA -0.60 0.10 1 93 VAL 1.10 0.50 1 96 ASP 0.10 -0.70 1 97 GLU -4.20 -0.40 1 98 VAL -2.80 -2.30 1 99 SER -0.70 -0.10 1 100 LEU -4.20 -0.90 1 101 LEU -2.00 -0.70 1 102 GLU 3.30 1.00 1 104 GLU 1.20 -1.90 1 105 ALA -1.50 -0.10 1 106 VAL -6.10 -1.70 1 107 GLU -4.70 -0.50 1 108 VAL 2.20 0.30 1 109 ILE -1.80 -1.20 1 112 LEU -0.20 1.30 1 113 LEU 1.60 -1.70 1 114 ASP 1.30 1.90 1 116 TRP 1.60 -1.20 1 117 TRP -5.20 -0.70 1 118 VAL 2.20 -0.10 1 120 ARG -5.20 -1.70 1 121 LYS -1.50 -1.20 1 123 ASP 1.20 -0.40 1 124 VAL 0.00 -1.10 1 125 THR -4.00 -0.30 1 127 TYR -1.90 0.60 1 130 SER 4.50 2.30 1 131 MET 1.30 0.00 1 132 TYR -2.20 -1.30 1 133 LEU -5.30 -1.80 1 134 GLN -5.50 -1.80 1 135 LYS 2.30 0.10 1 136 SER 1.80 1.00 1 138 GLN -1.00 -0.80 1 139 ASP 0.00 0.70 1 140 VAL 2.10 0.60 1 141 SER 1.40 1.30 1 142 GLN 2.70 1.30 1 143 ALA 2.20 1.50 1 144 GLN 2.80 1.50 1 145 ARG 2.10 0.60 1 146 GLN 0.90 0.10 1 147 ILE 2.30 0.20 1 148 LYS 1.50 -0.20 1 149 ARG 0.10 -0.50 1 154 ARG -0.30 2.40 1 155 ARG 4.90 1.40 1 156 SER 3.00 0.50 1 157 SER 0.00 -0.80 1 158 ILE 2.50 -0.20 1 159 ARG 0.90 -0.20 1 160 ASN 1.60 -1.20 1 161 ALA -0.50 -0.30 1 162 HIS -1.90 -0.40 1 164 ILE 2.00 -0.70 1 166 GLN 1.90 -0.20 1 167 ARG -1.60 -1.00 1 168 SER -1.40 0.10 1 169 ARG 0.70 -0.20 1 170 LYS 1.80 -0.30 1 171 ARG -1.80 -0.70 1 172 LEU 1.40 -1.20 1 173 SER -2.20 0.50 1 174 GLN 5.50 2.30 1 175 ASP 3.20 1.30 1 176 ALA 3.50 2.50 1 178 ARG 5.50 2.10 1 180 ASN 3.60 2.20 1 181 SER 4.30 0.90 1 182 VAL 5.80 2.30 1 183 ARG 4.60 2.10 1 184 PHE 4.20 2.20 1 185 LEU 3.70 2.20 1 186 GLN 3.80 2.10 1 187 GLN 2.70 1.30 1 188 ARG 2.10 0.90 1 189 ARG 1.90 0.50 1 190 ARG 1.50 0.10 1 191 GLN 0.40 -0.50 1 192 ALA 0.30 -1.20 1 stop_ save_