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 bmr19837_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 -2.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.42 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.77 _LACS_plot.Line_2_terminator_val_x_2 3.79 _LACS_plot.Line_2_terminator_val_y_2 3.03 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 233 HIS 2.39 3.25 0 242 ALA -7.28 -2.12 0 161 THR -0.78 -0.21 1 162 TRP -4.31 -1.15 1 163 LYS -4.73 -1.93 1 164 GLU 1.49 1.63 1 165 LYS -4.68 -1.60 1 166 ASP -0.43 -0.89 1 168 ALA -2.34 -1.25 1 169 VAL 2.21 2.14 1 171 ALA 2.02 2.94 1 172 GLU -1.12 -1.45 1 174 ARG -4.46 -1.26 1 175 VAL -5.52 -4.01 1 176 THR 0.71 0.19 1 177 ILE -6.64 -2.58 1 178 ASP -2.99 -1.62 1 180 THR -1.22 0.66 1 182 SER -3.29 -0.86 1 183 VAL -2.62 -0.73 1 186 GLU -3.93 -1.81 1 187 GLU 0.12 0.38 1 188 PHE -5.22 -3.53 1 192 LYS -5.03 -1.79 1 194 SER -3.54 -1.93 1 195 ASP 3.49 1.99 1 196 PHE -0.40 0.32 1 197 VAL 1.25 -0.20 1 198 LEU -4.49 -2.13 1 199 ALA 1.60 -0.63 1 200 MET 1.00 1.52 1 205 MET -4.28 -3.46 1 206 ILE 0.60 -0.94 1 211 ASP 3.79 2.99 1 213 ILE 2.06 2.06 1 214 LYS 3.01 2.39 1 217 LYS -4.66 -1.53 1 218 ALA 2.32 1.26 1 220 GLU -1.80 0.63 1 222 PHE -1.31 -1.91 1 223 THR -2.33 -1.04 1 224 ILE -4.20 -1.70 1 225 ASP -2.28 -0.34 1 226 VAL -5.76 -2.16 1 227 THR -0.90 -0.61 1 231 GLU -0.11 -1.33 1 234 ALA -0.97 -1.69 1 235 GLU 2.75 3.14 1 236 ASN 3.44 1.39 1 237 LEU -2.01 -1.09 1 238 LYS 2.57 1.96 1 243 LYS -4.77 -1.78 1 244 PHE -3.53 -0.90 1 245 ALA -0.41 -0.74 1 246 ILE -1.84 -2.29 1 247 ASN -2.32 -1.01 1 248 LEU -0.89 -0.43 1 249 LYS 1.66 2.07 1 251 VAL -1.72 -0.04 1 256 LEU -0.53 -0.48 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19837_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 4.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.58 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.23 _LACS_plot.Line_2_terminator_val_x_2 3.79 _LACS_plot.Line_2_terminator_val_y_2 -0.76 _LACS_plot.Y_axis_chem_shift_offset 0.19 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 233 HIS 2.39 0.86 0 242 ALA -7.28 5.16 0 161 THR -0.78 0.57 1 162 TRP -4.31 3.16 1 163 LYS -4.73 2.80 1 164 GLU 1.49 0.14 1 165 LYS -4.68 3.08 1 166 ASP -0.43 -0.46 1 168 ALA -2.34 1.09 1 169 VAL 2.21 -0.07 1 171 ALA 2.02 0.92 1 172 GLU -1.12 -0.33 1 174 ARG -4.46 3.20 1 175 VAL -5.52 1.51 1 176 THR 0.71 -0.52 1 177 ILE -6.64 4.06 1 178 ASP -2.99 1.37 1 180 THR -1.22 1.88 1 182 SER -3.29 2.43 1 183 VAL -2.62 1.89 1 186 GLU -3.93 2.12 1 187 GLU 0.12 0.26 1 188 PHE -5.22 1.69 1 192 LYS -5.03 3.24 1 194 SER -3.54 1.61 1 195 ASP 3.49 -1.50 1 196 PHE -0.40 0.72 1 197 VAL 1.25 -1.45 1 198 LEU -4.49 2.36 1 199 ALA 1.60 -2.23 1 200 MET 1.00 0.52 1 205 MET -4.28 0.82 1 206 ILE 0.60 -1.54 1 211 ASP 3.79 -0.80 1 213 ILE 2.06 0.00 1 214 LYS 3.01 -0.62 1 217 LYS -4.66 3.13 1 218 ALA 2.32 -1.06 1 220 GLU -1.80 2.43 1 222 PHE -1.31 -0.60 1 223 THR -2.33 1.29 1 224 ILE -4.20 2.50 1 225 ASP -2.28 1.94 1 226 VAL -5.76 3.60 1 227 THR -0.90 0.29 1 231 GLU -0.11 -1.22 1 234 ALA -0.97 -0.72 1 235 GLU 2.75 0.39 1 236 ASN 3.44 -2.05 1 237 LEU -2.01 0.92 1 238 LYS 2.57 -0.61 1 243 LYS -4.77 2.99 1 244 PHE -3.53 2.63 1 245 ALA -0.41 -0.33 1 246 ILE -1.84 -0.45 1 247 ASN -2.32 1.31 1 248 LEU -0.89 0.46 1 249 LYS 1.66 0.41 1 251 VAL -1.72 1.68 1 256 LEU -0.53 0.05 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19837_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.28 _LACS_plot.Line_1_terminator_val_y_1 1.12 _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 0.35 _LACS_plot.Line_2_terminator_val_x_2 3.79 _LACS_plot.Line_2_terminator_val_y_2 -0.47 _LACS_plot.Y_axis_chem_shift_offset -0.06 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 176 THR 0.71 0.88 0 161 THR -0.78 0.03 1 162 TRP -4.31 0.41 1 163 LYS -4.73 0.65 1 164 GLU 1.49 0.10 1 165 LYS -4.68 0.46 1 166 ASP -0.43 0.25 1 168 ALA -2.34 -0.11 1 169 VAL 2.21 -0.25 1 171 ALA 2.02 -0.45 1 172 GLU -1.12 0.35 1 174 ARG -4.46 0.91 1 175 VAL -5.52 1.26 1 177 ILE -6.64 1.58 1 178 ASP -2.99 0.73 1 180 THR -1.22 0.48 1 182 SER -3.29 0.58 1 183 VAL -2.62 0.36 1 186 GLU -3.93 0.38 1 187 GLU 0.12 0.12 1 188 PHE -5.22 0.48 1 192 LYS -5.03 0.97 1 194 SER -3.54 0.63 1 195 ASP 3.49 -0.85 1 196 PHE -0.40 -0.21 1 197 VAL 1.25 0.39 1 198 LEU -4.49 0.07 1 199 ALA 1.60 -0.04 1 200 MET 1.00 -0.27 1 205 MET -4.28 0.61 1 206 ILE 0.60 0.17 1 211 ASP 3.79 -0.43 1 213 ILE 2.06 -0.30 1 214 LYS 3.01 -0.74 1 217 LYS -4.66 0.37 1 218 ALA 2.32 -0.44 1 220 GLU -1.80 0.27 1 222 PHE -1.31 0.39 1 223 THR -2.33 1.19 1 224 ILE -4.20 0.68 1 225 ASP -2.28 0.82 1 226 VAL -5.76 0.37 1 227 THR -0.90 0.63 1 231 GLU -0.11 0.18 1 233 HIS 2.39 -0.58 1 234 ALA -0.97 0.23 1 235 GLU 2.75 -0.56 1 236 ASN 3.44 -0.30 1 237 LEU -2.01 -0.30 1 238 LYS 2.57 -0.49 1 242 ALA -7.28 0.92 1 243 LYS -4.77 1.13 1 244 PHE -3.53 0.62 1 245 ALA -0.41 0.33 1 246 ILE -1.84 0.61 1 247 ASN -2.32 0.27 1 248 LEU -0.89 0.37 1 249 LYS 1.66 0.05 1 251 VAL -1.72 0.50 1 256 LEU -0.53 -0.08 1 stop_ save_