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 bmr15170_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.31 _LACS_plot.Line_1_terminator_val_y_1 -3.76 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.09 _LACS_plot.Line_2_terminator_val_x_2 9.76 _LACS_plot.Line_2_terminator_val_y_2 6.29 _LACS_plot.Y_axis_chem_shift_offset 0.72 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 178 GLN -9.31 -0.61 0 10 THR 4.27 3.07 1 12 LEU -0.59 -1.39 1 13 ARG -4.32 -2.29 1 14 PHE -7.93 -3.25 1 18 PHE 5.43 0.63 1 19 ALA 3.71 3.94 1 21 LEU 0.30 -0.74 1 26 LEU 2.86 2.30 1 27 ALA 2.52 1.98 1 33 ALA -1.76 -1.00 1 34 GLU -5.20 -2.69 1 36 VAL -1.18 -2.24 1 37 TYR 0.49 1.58 1 38 SER -4.78 -2.16 1 39 ASN -4.76 0.09 1 40 GLU -2.35 -0.63 1 41 TRP -2.21 -2.59 1 42 ASP -1.30 0.03 1 43 LYS 4.31 2.35 1 44 TYR 4.54 1.47 1 45 ALA 5.03 2.03 1 46 GLN 5.47 3.70 1 47 GLU 3.04 2.35 1 48 VAL 2.81 1.85 1 49 TYR 4.38 4.23 1 50 GLU 3.87 2.71 1 51 MET 3.09 3.12 1 52 ASN 0.66 2.48 1 53 PHE 0.58 -0.13 1 55 GLU -3.97 -0.94 1 58 GLU 0.56 -0.30 1 60 ASP -0.76 -0.21 1 61 ILE 2.87 0.25 1 62 THR 2.93 1.92 1 63 GLN -1.26 -1.94 1 64 VAL 0.63 -0.33 1 65 ASN 0.98 0.60 1 66 GLU 4.51 1.97 1 67 LYS 3.95 1.96 1 68 THR 0.27 -0.57 1 69 ILE -1.95 -4.81 1 77 ALA -2.66 0.70 1 79 PHE -2.24 -3.12 1 82 GLN -1.00 -1.64 1 83 ALA -0.40 -1.70 1 84 PHE -0.79 -1.14 1 85 SER 0.33 -1.27 1 86 ILE 0.69 -0.54 1 87 SER -0.21 -0.16 1 89 LYS 1.12 0.05 1 90 GLN 1.62 0.22 1 91 LYS 0.30 -0.82 1 93 PHE 3.42 3.17 1 94 GLU 2.91 1.45 1 95 ASP 1.94 1.47 1 96 SER -0.06 0.61 1 97 ARG 5.52 2.85 1 99 THR -4.78 -1.80 1 102 PHE 5.01 3.07 1 103 ASP 4.04 3.72 1 105 ALA 4.73 2.35 1 106 ARG 5.15 2.05 1 124 PHE 3.76 4.36 1 125 ALA 2.25 1.20 1 126 SER -1.31 -1.45 1 127 HIS 2.47 4.18 1 128 ASP 2.41 0.37 1 129 ASN 2.93 1.17 1 131 ASN 3.13 2.90 1 132 THR 6.10 2.87 1 133 LEU 4.98 2.22 1 134 GLU 4.30 3.02 1 135 VAL 5.70 3.43 1 136 VAL 6.26 3.96 1 146 SER -2.48 -1.77 1 147 PHE -1.71 0.93 1 148 HIS -2.94 -0.80 1 149 ALA -5.31 -2.03 1 150 LYS -1.49 0.00 1 151 VAL 1.27 -0.92 1 152 LEU -3.05 -2.10 1 153 ASN -3.34 -2.53 1 154 ALA 4.50 3.44 1 155 LEU 3.79 1.19 1 156 ASP -0.46 0.56 1 157 TYR -0.14 -0.93 1 159 ILE -7.87 -8.72 1 171 PHE -3.62 -1.69 1 172 ARG 2.69 1.55 1 173 ASN 4.59 2.89 1 174 ASP 3.38 0.67 1 175 LEU 1.50 -0.04 1 176 ASN 2.30 0.20 1 177 ILE 2.95 -1.69 1 179 ASN -0.78 -0.89 1 180 PHE 1.92 1.03 1 181 GLN -4.17 -3.10 1 182 PHE 4.19 2.25 1 186 PHE -3.17 -2.76 1 187 GLU 0.48 0.25 1 188 LEU 1.89 0.14 1 189 ASN -2.05 -1.05 1 190 THR -1.81 -0.55 1 191 PHE -1.40 -0.47 1 192 VAL 9.76 6.50 1 193 LYS 4.75 1.19 1 194 ASP 1.68 2.01 1 195 LEU -0.62 -1.66 1 196 LEU 1.15 -0.73 1 199 ASP 3.82 2.49 1 200 SER 4.07 1.99 1 201 GLU -0.89 -0.22 1 202 VAL -1.47 -2.19 1 203 GLU 3.41 2.34 1 204 HIS 2.69 2.27 1 205 LEU 0.23 -1.19 1 206 VAL 2.37 0.97 1 207 ILE -2.83 -2.20 1 208 ASP -1.61 -1.58 1 210 LYS 2.54 0.31 1 211 ASP 0.87 -2.00 1 212 LEU 1.13 0.23 1 213 VAL -1.45 -0.94 1 214 MET 1.50 -2.31 1 215 THR 1.00 -0.04 1 216 ASN -4.21 -1.14 1 217 GLN -1.02 -1.21 1 218 GLU 0.03 -1.00 1 219 ILE -0.66 -0.86 1 220 GLU 0.20 0.25 1 221 GLN -2.13 -2.06 1 222 THR -0.73 -2.18 1 223 THR -3.65 -2.76 1 225 LYS -4.14 -1.77 1 226 THR -0.95 -2.02 1 227 VAL -1.00 -1.03 1 228 ARG 1.30 0.00 1 231 ILE -6.60 -2.27 1 232 VAL -4.23 -3.80 1 234 LYS 0.78 -0.86 1 237 GLN 3.85 2.03 1 240 ARG -4.02 -1.09 1 241 ILE -2.49 -3.11 1 242 TYR -2.44 -0.84 1 243 SER -0.31 -1.17 1 247 ILE -2.60 -2.94 1 248 ALA -0.03 -1.48 1 250 THR 0.75 0.52 1 251 LEU 2.44 0.29 1 252 SER -3.76 -2.53 1 253 ALA -0.47 -0.30 1 254 TYR -2.86 -1.76 1 258 ILE 3.02 1.15 1 259 PHE 0.59 -2.93 1 260 ALA 0.16 0.66 1 262 THR -0.90 -0.52 1 265 TYR -4.03 -1.19 1 266 LEU -1.45 -2.15 1 267 VAL -0.52 -1.32 1 268 ASN 2.65 0.61 1 270 LYS -3.18 -2.39 1 271 THR -3.21 -3.59 1 272 ARG -6.04 -2.35 1 278 GLU 6.68 1.94 1 280 ALA 4.24 1.77 1 282 VAL 4.10 1.78 1 283 MET -0.42 -2.52 1 285 TYR 3.70 1.59 1 287 ASP 4.15 1.54 1 288 SER 1.15 -0.40 1 289 TYR 0.19 0.34 1 290 LYS 1.09 -0.15 1 291 VAL -1.84 -2.59 1 292 HIS 3.17 4.69 1 294 SER 0.40 -2.30 1 295 THR 6.24 4.15 1 296 SER 4.89 2.76 1 297 GLN 4.45 1.08 1 298 ALA 4.65 2.45 1 299 TYR 3.18 1.38 1 300 LYS 4.59 3.14 1 301 GLN 5.44 2.28 1 302 PHE 7.99 5.63 1 304 ASN -2.81 -1.63 1 305 SER -3.36 -3.26 1 306 VAL -4.54 -4.25 1 307 VAL 0.31 -2.62 1 308 ILE 6.16 2.42 1 309 ASN 6.40 3.71 1 310 VAL 5.71 4.03 1 311 LEU 3.83 2.52 1 312 GLN 3.52 4.69 1 313 TYR 5.77 3.89 1 314 ILE 6.96 5.03 1 315 ALA 4.26 2.41 1 316 TYR 5.73 4.39 1 317 ASN 5.06 2.29 1 318 ILE 7.25 5.27 1 320 SER 4.17 2.49 1 322 LEU 2.58 1.33 1 323 ASN 1.19 0.41 1 324 LEU 2.29 0.90 1 325 GLU 0.84 -0.10 1 326 HIS 0.52 0.54 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr15170_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.31 _LACS_plot.Line_1_terminator_val_y_1 5.55 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.09 _LACS_plot.Line_2_terminator_val_x_2 9.76 _LACS_plot.Line_2_terminator_val_y_2 -3.47 _LACS_plot.Y_axis_chem_shift_offset 0.72 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 178 GLN -9.31 8.70 0 10 THR 4.27 -1.20 1 12 LEU -0.59 -0.80 1 13 ARG -4.32 2.03 1 14 PHE -7.93 4.68 1 18 PHE 5.43 -4.80 1 19 ALA 3.71 0.23 1 21 LEU 0.30 -1.04 1 26 LEU 2.86 -0.56 1 27 ALA 2.52 -0.54 1 33 ALA -1.76 0.76 1 34 GLU -5.20 2.51 1 36 VAL -1.18 -1.06 1 37 TYR 0.49 1.09 1 38 SER -4.78 2.62 1 39 ASN -4.76 4.85 1 40 GLU -2.35 1.72 1 41 TRP -2.21 -0.38 1 42 ASP -1.30 1.33 1 43 LYS 4.31 -1.96 1 44 TYR 4.54 -3.07 1 45 ALA 5.03 -3.00 1 46 GLN 5.47 -1.77 1 47 GLU 3.04 -0.69 1 48 VAL 2.81 -0.96 1 49 TYR 4.38 -0.15 1 50 GLU 3.87 -1.16 1 51 MET 3.09 0.03 1 52 ASN 0.66 1.82 1 53 PHE 0.58 -0.71 1 55 GLU -3.97 3.03 1 58 GLU 0.56 -0.86 1 60 ASP -0.76 0.55 1 61 ILE 2.87 -2.62 1 62 THR 2.93 -1.01 1 63 GLN -1.26 -0.68 1 64 VAL 0.63 -0.96 1 65 ASN 0.98 -0.38 1 66 GLU 4.51 -2.54 1 67 LYS 3.95 -1.99 1 68 THR 0.27 -0.84 1 69 ILE -1.95 -2.86 1 77 ALA -2.66 3.36 1 79 PHE -2.24 -0.88 1 82 GLN -1.00 -0.64 1 83 ALA -0.40 -1.30 1 84 PHE -0.79 -0.35 1 85 SER 0.33 -1.60 1 86 ILE 0.69 -1.23 1 87 SER -0.21 0.05 1 89 LYS 1.12 -1.07 1 90 GLN 1.62 -1.40 1 91 LYS 0.30 -1.12 1 93 PHE 3.42 -0.25 1 94 GLU 2.91 -1.46 1 95 ASP 1.94 -0.47 1 96 SER -0.06 0.67 1 97 ARG 5.52 -2.67 1 99 THR -4.78 2.98 1 102 PHE 5.01 -1.94 1 103 ASP 4.04 -0.32 1 105 ALA 4.73 -2.38 1 106 ARG 5.15 -3.10 1 124 PHE 3.76 0.60 1 125 ALA 2.25 -1.05 1 126 SER -1.31 -0.14 1 127 HIS 2.47 1.71 1 128 ASP 2.41 -2.04 1 129 ASN 2.93 -1.76 1 131 ASN 3.13 -0.23 1 132 THR 6.10 -3.23 1 133 LEU 4.98 -2.76 1 134 GLU 4.30 -1.28 1 135 VAL 5.70 -2.27 1 136 VAL 6.26 -2.30 1 146 SER -2.48 0.71 1 147 PHE -1.71 2.64 1 148 HIS -2.94 2.14 1 149 ALA -5.31 3.28 1 150 LYS -1.49 1.49 1 151 VAL 1.27 -2.19 1 152 LEU -3.05 0.95 1 153 ASN -3.34 0.81 1 154 ALA 4.50 -1.06 1 155 LEU 3.79 -2.60 1 156 ASP -0.46 1.02 1 157 TYR -0.14 -0.79 1 159 ILE -7.87 -0.85 1 171 PHE -3.62 1.93 1 172 ARG 2.69 -1.14 1 173 ASN 4.59 -1.70 1 174 ASP 3.38 -2.71 1 175 LEU 1.50 -1.54 1 176 ASN 2.30 -2.10 1 177 ILE 2.95 -4.64 1 179 ASN -0.78 -0.11 1 180 PHE 1.92 -0.89 1 181 GLN -4.17 1.07 1 182 PHE 4.19 -1.94 1 186 PHE -3.17 0.41 1 187 GLU 0.48 -0.23 1 188 LEU 1.89 -1.75 1 189 ASN -2.05 1.00 1 190 THR -1.81 1.26 1 191 PHE -1.40 0.93 1 192 VAL 9.76 -3.26 1 193 LYS 4.75 -3.56 1 194 ASP 1.68 0.33 1 195 LEU -0.62 -1.04 1 196 LEU 1.15 -1.88 1 199 ASP 3.82 -1.33 1 200 SER 4.07 -2.08 1 201 GLU -0.89 0.67 1 202 VAL -1.47 -0.72 1 203 GLU 3.41 -1.07 1 204 HIS 2.69 -0.42 1 205 LEU 0.23 -1.42 1 206 VAL 2.37 -1.40 1 207 ILE -2.83 0.63 1 208 ASP -1.61 0.03 1 210 LYS 2.54 -2.23 1 211 ASP 0.87 -2.87 1 212 LEU 1.13 -0.90 1 213 VAL -1.45 0.51 1 214 MET 1.50 -3.81 1 215 THR 1.00 -1.04 1 216 ASN -4.21 3.07 1 217 GLN -1.02 -0.19 1 218 GLU 0.03 -1.03 1 219 ILE -0.66 -0.20 1 220 GLU 0.20 0.05 1 221 GLN -2.13 0.07 1 222 THR -0.73 -1.45 1 223 THR -3.65 0.89 1 225 LYS -4.14 2.37 1 226 THR -0.95 -1.07 1 227 VAL -1.00 -0.03 1 228 ARG 1.30 -1.30 1 231 ILE -6.60 4.33 1 232 VAL -4.23 0.43 1 234 LYS 0.78 -1.64 1 237 GLN 3.85 -1.82 1 240 ARG -4.02 2.93 1 241 ILE -2.49 -0.62 1 242 TYR -2.44 1.60 1 243 SER -0.31 -0.86 1 247 ILE -2.60 -0.34 1 248 ALA -0.03 -1.45 1 250 THR 0.75 -0.23 1 251 LEU 2.44 -2.15 1 252 SER -3.76 1.23 1 253 ALA -0.47 0.17 1 254 TYR -2.86 1.10 1 258 ILE 3.02 -1.87 1 259 PHE 0.59 -3.52 1 260 ALA 0.16 0.50 1 262 THR -0.90 0.38 1 265 TYR -4.03 2.84 1 266 LEU -1.45 -0.70 1 267 VAL -0.52 -0.80 1 268 ASN 2.65 -2.04 1 270 LYS -3.18 0.79 1 271 THR -3.21 -0.38 1 272 ARG -6.04 3.69 1 278 GLU 6.68 -4.74 1 280 ALA 4.24 -2.47 1 282 VAL 4.10 -2.32 1 283 MET -0.42 -2.10 1 285 TYR 3.70 -2.11 1 287 ASP 4.15 -2.61 1 288 SER 1.15 -1.55 1 289 TYR 0.19 0.15 1 290 LYS 1.09 -1.24 1 291 VAL -1.84 -0.75 1 292 HIS 3.17 1.52 1 294 SER 0.40 -2.70 1 295 THR 6.24 -2.09 1 296 SER 4.89 -2.13 1 297 GLN 4.45 -3.37 1 298 ALA 4.65 -2.20 1 299 TYR 3.18 -1.80 1 300 LYS 4.59 -1.45 1 301 GLN 5.44 -3.16 1 302 PHE 7.99 -2.36 1 304 ASN -2.81 1.18 1 305 SER -3.36 0.10 1 306 VAL -4.54 0.29 1 307 VAL 0.31 -2.93 1 308 ILE 6.16 -3.74 1 309 ASN 6.40 -2.69 1 310 VAL 5.71 -1.68 1 311 LEU 3.83 -1.31 1 312 GLN 3.52 1.17 1 313 TYR 5.77 -1.88 1 314 ILE 6.96 -1.93 1 315 ALA 4.26 -1.85 1 316 TYR 5.73 -1.34 1 317 ASN 5.06 -2.77 1 318 ILE 7.25 -1.98 1 320 SER 4.17 -1.68 1 322 LEU 2.58 -1.25 1 323 ASN 1.19 -0.78 1 324 LEU 2.29 -1.39 1 325 GLU 0.84 -0.94 1 326 HIS 0.52 0.02 1 stop_ save_