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 bmr17922_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -3.21 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.25 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.08 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 3.85 _LACS_plot.Y_axis_chem_shift_offset 0.67 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 125 GLN 4.60 -1.40 0 15 ALA 3.00 1.40 1 16 VAL 6.10 3.40 1 17 ARG 6.20 2.00 1 18 GLU 3.40 1.20 1 19 ARG 5.30 3.10 1 20 MET 3.90 4.00 1 21 ARG 5.10 2.90 1 22 ARG 2.10 0.50 1 23 ALA 1.80 -1.10 1 24 GLU -0.70 -0.70 1 26 ALA 0.00 -0.60 1 27 ALA 0.20 -0.50 1 28 GLU 0.00 -0.40 1 30 VAL 1.30 -0.10 1 32 ALA 0.50 -0.50 1 33 VAL 0.80 -0.50 1 35 ARG 1.10 -0.30 1 36 ASP 1.20 0.30 1 37 LEU 1.90 0.20 1 38 GLU 0.80 -0.10 1 39 LYS 1.50 0.00 1 42 ALA 0.10 -0.60 1 43 ILE 1.20 -0.40 1 51 THR -0.30 -0.90 1 52 ASN 0.20 1.40 1 54 ALA 0.00 -0.70 1 56 ALA 1.30 0.30 1 57 TRP 1.20 -0.40 1 58 LEU 1.10 -0.10 1 59 GLU 0.60 -0.30 1 60 ALA 0.60 -0.50 1 61 GLN 0.60 -0.40 1 62 GLU 0.20 -0.50 1 63 GLU 0.20 -0.20 1 64 GLU 0.50 -0.10 1 65 GLU 0.20 -0.30 1 66 VAL 1.20 -0.10 1 68 PHE 0.60 -0.40 1 70 VAL -2.80 -4.50 1 73 GLN -2.90 -0.50 1 74 VAL -0.60 -1.80 1 76 LEU 1.40 0.90 1 79 MET 3.00 -0.40 1 80 THR -5.40 -3.30 1 81 TYR 4.80 2.90 1 82 LYS 3.80 2.00 1 83 ALA 2.60 1.40 1 84 ALA 5.60 2.40 1 85 VAL 6.30 4.00 1 86 ASP 5.10 3.00 1 87 LEU 3.90 2.30 1 89 HIS 5.40 5.20 1 90 PHE 4.90 3.00 1 91 LEU 5.50 1.50 1 93 GLU 2.80 1.40 1 94 LYS 1.80 -0.30 1 97 LEU -0.90 -0.60 1 98 GLU 1.70 0.80 1 100 LEU -0.10 -0.70 1 101 ILE 2.60 0.30 1 102 TYR 1.50 1.10 1 103 SER -4.20 -2.10 1 104 GLN 4.40 2.20 1 105 LYS 4.60 2.30 1 106 ARG 5.80 4.40 1 107 GLN 6.70 4.00 1 108 ASP 4.60 2.90 1 109 ILE 5.60 4.10 1 110 LEU 5.20 3.40 1 111 ASP 4.80 3.30 1 112 LEU 4.50 2.20 1 113 TRP 6.20 3.40 1 114 VAL 6.50 4.20 1 115 TYR 1.80 0.70 1 116 HIS 2.20 3.40 1 117 THR 1.10 1.00 1 118 GLN -1.70 -0.50 1 120 TYR -0.20 -1.80 1 121 PHE 1.90 0.70 1 123 ASP -1.80 -2.00 1 124 TRP -3.60 -3.00 1 126 ASN -3.60 -2.20 1 127 TYR -4.60 -1.40 1 128 THR 2.80 -0.70 1 133 ILE 2.60 1.10 1 134 ARG -0.70 -4.20 1 135 TYR 1.60 1.00 1 137 LEU 3.50 1.10 1 138 THR 2.40 0.60 1 139 PHE 1.50 -2.10 1 141 TRP -1.80 -2.20 1 143 PHE -3.50 -1.60 1 144 LYS -6.00 -4.50 1 145 LEU -2.10 -3.40 1 146 VAL -3.00 -2.30 1 148 VAL -0.10 -1.00 1 149 GLU -0.30 -0.60 1 151 GLU 0.50 -0.40 1 152 LYS 0.60 -0.80 1 153 VAL 0.70 -0.50 1 154 GLU 0.20 -0.50 1 155 GLU 0.10 -0.60 1 156 ALA 0.40 -0.50 1 157 ASN -0.20 -0.40 1 158 GLU 0.50 -0.20 1 160 GLU 0.50 -0.40 1 164 LEU 1.50 -0.20 1 165 LEU 0.80 -0.50 1 166 HIS -2.20 -1.20 1 173 MET 0.40 -0.50 1 174 ASP 0.40 -0.30 1 175 ASP -0.40 -0.80 1 177 GLU 1.30 -0.10 1 178 LYS 0.40 -1.00 1 179 GLU -0.50 -0.40 1 180 VAL 1.80 0.00 1 181 LEU -5.50 -2.90 1 182 VAL -5.80 -4.00 1 183 TRP 3.70 4.00 1 184 LYS -4.10 -1.60 1 185 PHE 0.20 -0.90 1 186 ASP -2.70 -1.70 1 187 SER 3.60 2.10 1 188 LYS 4.60 2.10 1 189 LEU 3.60 0.30 1 190 ALA 1.70 -0.30 1 191 PHE -0.90 -0.40 1 193 HIS -2.50 -3.90 1 194 MET 4.60 2.20 1 195 ALA 2.20 2.60 1 196 ARG 3.00 0.90 1 197 GLU 2.40 0.90 1 198 LEU 0.20 0.70 1 199 HIS -2.10 -1.70 1 201 GLU 4.50 1.10 1 202 TYR 2.20 0.10 1 203 TYR 1.10 0.20 1 204 LYS 1.50 0.50 1 207 ALA 1.80 0.10 1 208 ALA 0.60 -0.30 1 209 ALA 0.80 -0.30 1 210 LEU 1.10 -0.30 1 211 GLU 0.00 -0.50 1 213 HIS 5.50 2.90 1 214 HIS 4.40 2.90 1 215 HIS 1.30 3.40 1 216 HIS -0.40 0.70 1 217 HIS 0.60 2.20 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17922_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 2.79 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.75 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.08 _LACS_plot.Line_2_terminator_val_x_2 6.69 _LACS_plot.Line_2_terminator_val_y_2 -2.84 _LACS_plot.Y_axis_chem_shift_offset 0.67 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 125 GLN 4.60 -6.00 0 15 ALA 3.00 -1.60 1 16 VAL 6.10 -2.70 1 17 ARG 6.20 -4.20 1 18 GLU 3.40 -2.20 1 19 ARG 5.30 -2.20 1 20 MET 3.90 0.10 1 21 ARG 5.10 -2.20 1 22 ARG 2.10 -1.60 1 23 ALA 1.80 -2.90 1 24 GLU -0.70 0.00 1 26 ALA 0.00 -0.60 1 27 ALA 0.20 -0.70 1 28 GLU 0.00 -0.40 1 30 VAL 1.30 -1.40 1 32 ALA 0.50 -1.00 1 33 VAL 0.80 -1.30 1 35 ARG 1.10 -1.40 1 36 ASP 1.20 -0.90 1 37 LEU 1.90 -1.70 1 38 GLU 0.80 -0.90 1 39 LYS 1.50 -1.50 1 42 ALA 0.10 -0.70 1 43 ILE 1.20 -1.60 1 51 THR -0.30 -0.60 1 52 ASN 0.20 1.20 1 54 ALA 0.00 -0.70 1 56 ALA 1.30 -1.00 1 57 TRP 1.20 -1.60 1 58 LEU 1.10 -1.20 1 59 GLU 0.60 -0.90 1 60 ALA 0.60 -1.10 1 61 GLN 0.60 -1.00 1 62 GLU 0.20 -0.70 1 63 GLU 0.20 -0.40 1 64 GLU 0.50 -0.60 1 65 GLU 0.20 -0.50 1 66 VAL 1.20 -1.30 1 68 PHE 0.60 -1.00 1 70 VAL -2.80 -1.70 1 73 GLN -2.90 2.40 1 74 VAL -0.60 -1.20 1 76 LEU 1.40 -0.50 1 79 MET 3.00 -3.40 1 80 THR -5.40 2.10 1 81 TYR 4.80 -1.90 1 82 LYS 3.80 -1.80 1 83 ALA 2.60 -1.20 1 84 ALA 5.60 -3.20 1 85 VAL 6.30 -2.30 1 86 ASP 5.10 -2.10 1 87 LEU 3.90 -1.60 1 89 HIS 5.40 -0.20 1 90 PHE 4.90 -1.90 1 91 LEU 5.50 -4.00 1 93 GLU 2.80 -1.40 1 94 LYS 1.80 -2.10 1 97 LEU -0.90 0.30 1 98 GLU 1.70 -0.90 1 100 LEU -0.10 -0.60 1 101 ILE 2.60 -2.30 1 102 TYR 1.50 -0.40 1 103 SER -4.20 2.10 1 104 GLN 4.40 -2.20 1 105 LYS 4.60 -2.30 1 106 ARG 5.80 -1.40 1 107 GLN 6.70 -2.70 1 108 ASP 4.60 -1.70 1 109 ILE 5.60 -1.50 1 110 LEU 5.20 -1.80 1 111 ASP 4.80 -1.50 1 112 LEU 4.50 -2.30 1 113 TRP 6.20 -2.80 1 114 VAL 6.50 -2.30 1 115 TYR 1.80 -1.10 1 116 HIS 2.20 1.20 1 117 THR 1.10 -0.10 1 118 GLN -1.70 1.20 1 120 TYR -0.20 -1.60 1 121 PHE 1.90 -1.20 1 123 ASP -1.80 -0.20 1 124 TRP -3.60 0.60 1 126 ASN -3.60 1.40 1 127 TYR -4.60 3.20 1 128 THR 2.80 -3.50 1 133 ILE 2.60 -1.50 1 134 ARG -0.70 -3.50 1 135 TYR 1.60 -0.60 1 137 LEU 3.50 -2.40 1 138 THR 2.40 -1.80 1 139 PHE 1.50 -3.60 1 141 TRP -1.80 -0.40 1 143 PHE -3.50 1.90 1 144 LYS -6.00 1.50 1 145 LEU -2.10 -1.30 1 146 VAL -3.00 0.70 1 148 VAL -0.10 -0.90 1 149 GLU -0.30 -0.30 1 151 GLU 0.50 -0.90 1 152 LYS 0.60 -1.40 1 153 VAL 0.70 -1.20 1 154 GLU 0.20 -0.70 1 155 GLU 0.10 -0.70 1 156 ALA 0.40 -0.90 1 157 ASN -0.20 -0.20 1 158 GLU 0.50 -0.70 1 160 GLU 0.50 -0.90 1 164 LEU 1.50 -1.70 1 165 LEU 0.80 -1.30 1 166 HIS -2.20 1.00 1 173 MET 0.40 -0.90 1 174 ASP 0.40 -0.70 1 175 ASP -0.40 -0.40 1 177 GLU 1.30 -1.40 1 178 LYS 0.40 -1.40 1 179 GLU -0.50 0.10 1 180 VAL 1.80 -1.80 1 181 LEU -5.50 2.60 1 182 VAL -5.80 1.80 1 183 TRP 3.70 0.30 1 184 LYS -4.10 2.50 1 185 PHE 0.20 -1.10 1 186 ASP -2.70 1.00 1 187 SER 3.60 -1.50 1 188 LYS 4.60 -2.50 1 189 LEU 3.60 -3.30 1 190 ALA 1.70 -2.00 1 191 PHE -0.90 0.50 1 193 HIS -2.50 -1.40 1 194 MET 4.60 -2.40 1 195 ALA 2.20 0.40 1 196 ARG 3.00 -2.10 1 197 GLU 2.40 -1.50 1 198 LEU 0.20 0.50 1 199 HIS -2.10 0.40 1 201 GLU 4.50 -3.40 1 202 TYR 2.20 -2.10 1 203 TYR 1.10 -0.90 1 204 LYS 1.50 -1.00 1 207 ALA 1.80 -1.70 1 208 ALA 0.60 -0.90 1 209 ALA 0.80 -1.10 1 210 LEU 1.10 -1.40 1 211 GLU 0.00 -0.50 1 213 HIS 5.50 -2.60 1 214 HIS 4.40 -1.50 1 215 HIS 1.30 2.10 1 216 HIS -0.40 1.10 1 217 HIS 0.60 1.60 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17922_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.00 _LACS_plot.Line_1_terminator_val_y_1 -2.47 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.56 _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 6.69 _LACS_plot.Line_2_terminator_val_y_2 2.30 _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 125 GLN 4.60 -4.70 0 15 ALA 3.00 2.50 1 16 VAL 6.10 1.00 1 17 ARG 6.20 2.40 1 18 GLU 3.40 1.50 1 19 ARG 5.30 3.70 1 21 ARG 5.10 1.80 1 22 ARG 2.10 -0.10 1 23 ALA 1.80 -1.50 1 24 GLU -0.70 0.20 1 26 ALA 0.00 -0.30 1 27 ALA 0.20 -0.10 1 28 GLU 0.00 0.40 1 30 VAL 1.30 0.60 1 32 ALA 0.50 0.00 1 33 VAL 0.80 0.00 1 35 ARG 1.10 -1.00 1 36 ASP 1.20 2.90 1 37 LEU 1.90 0.30 1 38 GLU 0.80 0.30 1 39 LYS 1.50 0.00 1 42 ALA 0.10 -0.10 1 43 ILE 1.20 0.30 1 51 THR -0.30 -1.30 1 52 ASN 0.20 4.00 1 54 ALA 0.00 -0.10 1 56 ALA 1.30 -0.10 1 57 TRP 1.20 0.20 1 58 LEU 1.10 -0.20 1 59 GLU 0.60 -0.20 1 60 ALA 0.60 -0.10 1 61 GLN 0.60 0.10 1 62 GLU 0.20 -0.50 1 63 GLU 0.20 0.00 1 64 GLU 0.50 0.00 1 65 GLU 0.20 0.00 1 66 VAL 1.20 0.10 1 68 PHE 0.60 -0.30 1 70 VAL -2.80 0.90 1 73 GLN -2.90 0.60 1 74 VAL -0.60 -1.70 1 76 LEU 1.40 2.00 1 79 MET 3.00 -0.70 1 80 THR -5.40 -1.40 1 81 TYR 4.80 0.30 1 82 LYS 3.80 1.50 1 83 ALA 2.60 2.30 1 84 ALA 5.60 3.30 1 85 VAL 6.30 2.60 1 86 ASP 5.10 3.50 1 87 LEU 3.90 1.10 1 89 HIS 5.40 3.40 1 90 PHE 4.90 0.60 1 93 GLU 2.80 2.00 1 97 LEU -0.90 -1.80 1 98 GLU 1.70 1.60 1 100 LEU -0.10 -1.00 1 101 ILE 2.60 -0.20 1 102 TYR 1.50 0.30 1 104 GLN 4.40 1.20 1 105 LYS 4.60 2.90 1 106 ARG 5.80 1.40 1 107 GLN 6.70 1.30 1 108 ASP 4.60 2.20 1 110 LEU 5.20 0.70 1 111 ASP 4.80 4.60 1 112 LEU 4.50 0.80 1 113 TRP 6.20 3.80 1 114 VAL 6.50 1.80 1 115 TYR 1.80 1.80 1 116 HIS 2.20 2.90 1 117 THR 1.10 1.20 1 118 GLN -1.70 -3.00 1 120 TYR -0.20 0.40 1 123 ASP -1.80 0.00 1 124 TRP -3.60 1.40 1 126 ASN -3.60 -0.30 1 127 TYR -4.60 -0.70 1 133 ILE 2.60 -0.80 1 134 ARG -0.70 -0.70 1 135 TYR 1.60 -0.10 1 137 LEU 3.50 3.10 1 138 THR 2.40 -0.60 1 139 PHE 1.50 -0.90 1 141 TRP -1.80 1.60 1 143 PHE -3.50 -3.70 1 144 LYS -6.00 -3.60 1 145 LEU -2.10 -1.60 1 146 VAL -3.00 -1.00 1 148 VAL -0.10 -0.60 1 149 GLU -0.30 -0.30 1 151 GLU 0.50 -0.10 1 152 LYS 0.60 -0.20 1 153 VAL 0.70 -0.10 1 154 GLU 0.20 -0.20 1 155 GLU 0.10 -0.50 1 156 ALA 0.40 -0.40 1 157 ASN -0.20 0.00 1 158 GLU 0.50 0.30 1 160 GLU 0.50 -0.20 1 164 LEU 1.50 -0.50 1 165 LEU 0.80 -1.00 1 166 HIS -2.20 -0.40 1 173 MET 0.40 -0.40 1 174 ASP 0.40 -0.90 1 175 ASP -0.40 0.20 1 177 GLU 1.30 0.30 1 178 LYS 0.40 -0.50 1 179 GLU -0.50 -1.50 1 180 VAL 1.80 -1.80 1 181 LEU -5.50 -1.50 1 183 TRP 3.70 2.10 1 184 LYS -4.10 -2.20 1 185 PHE 0.20 -0.30 1 186 ASP -2.70 -0.80 1 187 SER 3.60 2.00 1 188 LYS 4.60 3.00 1 189 LEU 3.60 -1.10 1 190 ALA 1.70 -0.60 1 193 HIS -2.50 1.60 1 194 MET 4.60 1.40 1 195 ALA 2.20 -0.30 1 196 ARG 3.00 0.40 1 197 GLU 2.40 1.70 1 198 LEU 0.20 -0.40 1 199 HIS -2.10 -1.70 1 201 GLU 4.50 1.10 1 202 TYR 2.20 0.10 1 203 TYR 1.10 -0.40 1 204 LYS 1.50 0.10 1 207 ALA 1.80 -0.60 1 208 ALA 0.60 0.00 1 209 ALA 0.80 0.00 1 210 LEU 1.10 -0.10 1 211 GLU 0.00 -0.30 1 214 HIS 4.40 3.30 1 216 HIS -0.40 0.10 1 217 HIS 0.60 5.70 1 stop_ save_