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 bmr26758_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 -3.09 _LACS_plot.Line_1_terminator_val_x_2 1.99 _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 -1.98 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 4.54 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 277 LEU 0.30 -2.87 0 62 PHE -0.14 -3.27 0 12 TYR -3.06 -1.67 1 13 ARG -3.39 -1.95 1 15 GLU -0.49 -0.87 1 16 VAL -0.37 -0.53 1 18 LYS 5.00 1.27 1 19 THR -1.53 -0.64 1 20 ALA 0.96 -0.08 1 21 TRP -0.28 -0.49 1 24 ARG 1.38 0.25 1 25 ALA 3.09 1.20 1 26 VAL 2.20 -0.07 1 27 TYR -0.27 -1.78 1 28 ARG -3.88 -2.92 1 29 ASP 2.93 0.06 1 30 LEU 1.76 0.54 1 31 GLN -4.32 -3.93 1 40 ALA -4.63 -1.73 1 41 VAL -2.88 -1.48 1 43 SER -3.50 -1.98 1 44 ALA -5.11 -2.07 1 45 VAL -2.50 -1.62 1 46 ASP -1.11 -1.38 1 48 ARG 3.08 1.84 1 49 THR -2.47 -1.20 1 51 ALA -0.88 -0.85 1 52 LYS 1.47 1.42 1 63 GLN 1.87 0.93 1 64 SER -3.81 -2.11 1 65 GLU 5.18 3.77 1 66 LEU 4.20 2.96 1 67 PHE 4.98 3.36 1 68 ALA 3.46 2.42 1 69 LYS 3.89 2.26 1 85 ASN -0.51 0.81 1 86 VAL -2.33 -0.82 1 87 ILE 0.35 -0.38 1 89 LEU -3.43 -1.96 1 90 LEU 0.84 1.66 1 96 ASP 0.14 1.02 1 97 GLU 0.30 1.81 1 98 THR -6.27 -3.24 1 99 LEU 3.99 1.53 1 100 ASP 3.83 2.47 1 101 ASP -1.02 -0.46 1 102 PHE 0.40 -1.26 1 114 THR -1.77 -2.40 1 115 ASP -4.62 -1.86 1 116 LEU 2.53 1.75 1 118 LYS 4.35 2.79 1 119 LEU 3.61 2.99 1 120 MET 2.25 2.77 1 121 LYS 2.11 0.77 1 125 LEU 0.11 -0.20 1 127 GLU 4.45 3.52 1 128 ASP 4.54 2.04 1 129 ARG 3.75 2.71 1 130 ILE 6.30 5.21 1 131 GLN 4.99 3.57 1 132 PHE 1.44 1.34 1 145 HIS 0.20 1.69 1 146 ALA 4.29 2.01 1 147 ALA 0.93 -0.49 1 160 ALA -2.16 -1.58 1 161 VAL -6.05 -3.45 1 162 ASN -4.83 -3.35 1 163 GLU 3.87 2.13 1 164 ASP 0.48 -0.05 1 166 GLU 0.71 -0.82 1 167 LEU -5.01 -2.21 1 185 TYR -0.24 -0.46 1 186 VAL 1.08 -0.20 1 187 VAL 0.20 -0.77 1 258 ALA 2.86 1.98 1 259 LYS 5.37 4.02 1 260 ASN 4.05 2.51 1 261 TYR 3.27 2.68 1 262 MET 2.86 1.66 1 263 LYS 3.66 1.81 1 265 LEU 0.41 -0.62 1 267 GLU 1.22 0.14 1 268 LEU -2.50 -1.69 1 269 GLU -1.63 -1.55 1 270 LYS 0.56 0.03 1 271 LYS -1.98 -1.86 1 272 ASP -0.76 -0.97 1 273 PHE 5.06 2.82 1 274 ALA 3.89 1.97 1 275 SER 1.78 1.61 1 276 ILE 1.10 0.77 1 278 THR 3.66 2.46 1 279 ASN 1.79 0.34 1 280 ALA -2.87 -1.69 1 281 SER -1.20 -2.24 1 283 LEU 2.65 2.34 1 284 ALA 3.82 1.80 1 285 VAL 6.73 4.47 1 286 ASN 2.77 3.92 1 293 VAL -3.51 -2.82 1 294 LEU 5.01 3.65 1 295 ASP 0.25 -0.77 1 296 ALA 2.20 2.33 1 298 GLN -1.02 -1.25 1 299 ARG -0.29 0.02 1 300 VAL -0.12 -1.36 1 301 THR -2.41 -1.50 1 302 ALA 6.13 3.34 1 304 GLU 2.18 1.68 1 316 ASP -1.07 -0.77 1 317 THR 0.36 -0.42 1 318 GLU -0.48 -0.68 1 319 ASP -0.37 -0.43 1 320 GLU -0.09 -0.19 1 322 GLN 0.57 -0.80 1 323 VAL -1.78 -1.58 1 324 GLN -0.69 -1.08 1 325 LYS 2.10 0.40 1 326 TYR 1.57 0.67 1 327 ASP -0.50 -1.82 1 328 ASP -0.45 -0.76 1 329 SER 5.22 3.94 1 330 PHE 1.43 0.26 1 331 ASP 4.27 2.89 1 332 ASP -0.61 -0.69 1 333 VAL -0.36 -0.79 1 334 ASP 1.07 0.33 1 348 VAL 5.86 3.55 1 349 LEU 3.53 1.67 1 350 SER 0.05 -0.31 1 351 PHE 1.91 1.50 1 352 LYS -3.75 -4.27 1 356 GLN 0.43 -0.43 1 357 LEU 0.85 -0.16 1 359 ALA -0.05 -0.53 1 360 ARG 0.83 -0.32 1 361 VAL 0.42 -0.48 1 362 SER -0.63 -0.56 1 363 LYS 0.76 -0.25 1 364 GLU -0.08 -0.55 1 365 THR 0.02 -0.41 1 367 LEU 1.36 1.30 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26758_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 3.18 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 -1.80 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.02 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 -2.18 _LACS_plot.Y_axis_chem_shift_offset 0.54 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 277 LEU 0.30 -3.17 0 62 PHE -0.14 -3.13 0 12 TYR -3.06 1.39 1 13 ARG -3.39 1.44 1 15 GLU -0.49 -0.38 1 16 VAL -0.37 -0.16 1 18 LYS 5.00 -3.73 1 19 THR -1.53 0.89 1 20 ALA 0.96 -1.04 1 21 TRP -0.28 -0.21 1 24 ARG 1.38 -1.13 1 25 ALA 3.09 -1.89 1 26 VAL 2.20 -2.27 1 27 TYR -0.27 -1.51 1 28 ARG -3.88 0.96 1 29 ASP 2.93 -2.87 1 30 LEU 1.76 -1.22 1 31 GLN -4.32 0.39 1 40 ALA -4.63 2.90 1 41 VAL -2.88 1.40 1 43 SER -3.50 1.52 1 44 ALA -5.11 3.04 1 45 VAL -2.50 0.88 1 46 ASP -1.11 -0.27 1 48 ARG 3.08 -1.24 1 49 THR -2.47 1.27 1 51 ALA -0.88 0.03 1 52 LYS 1.47 -0.05 1 63 GLN 1.87 -0.94 1 64 SER -3.81 1.70 1 65 GLU 5.18 -1.41 1 66 LEU 4.20 -1.24 1 67 PHE 4.98 -1.62 1 68 ALA 3.46 -1.04 1 69 LYS 3.89 -1.63 1 85 ASN -0.51 1.32 1 86 VAL -2.33 1.51 1 87 ILE 0.35 -0.73 1 89 LEU -3.43 1.47 1 90 LEU 0.84 0.82 1 96 ASP 0.14 0.88 1 97 GLU 0.30 1.51 1 98 THR -6.27 3.03 1 99 LEU 3.99 -2.46 1 100 ASP 3.83 -1.36 1 101 ASP -1.02 0.56 1 102 PHE 0.40 -1.66 1 114 THR -1.77 -0.63 1 115 ASP -4.62 2.76 1 116 LEU 2.53 -0.78 1 118 LYS 4.35 -1.56 1 119 LEU 3.61 -0.62 1 120 MET 2.25 0.52 1 121 LYS 2.11 -1.34 1 125 LEU 0.11 -0.31 1 127 GLU 4.45 -0.93 1 128 ASP 4.54 -2.50 1 129 ARG 3.75 -1.04 1 130 ILE 6.30 -1.09 1 131 GLN 4.99 -1.42 1 132 PHE 1.44 -0.10 1 145 HIS 0.20 1.49 1 146 ALA 4.29 -2.28 1 147 ALA 0.93 -1.42 1 160 ALA -2.16 0.58 1 161 VAL -6.05 2.60 1 162 ASN -4.83 1.48 1 163 GLU 3.87 -1.74 1 164 ASP 0.48 -0.53 1 166 GLU 0.71 -1.53 1 167 LEU -5.01 2.80 1 185 TYR -0.24 -0.22 1 186 VAL 1.08 -1.28 1 187 VAL 0.20 -0.97 1 258 ALA 2.86 -0.88 1 259 LYS 5.37 -1.35 1 260 ASN 4.05 -1.54 1 261 TYR 3.27 -0.59 1 262 MET 2.86 -1.20 1 263 LYS 3.66 -1.85 1 265 LEU 0.41 -1.03 1 267 GLU 1.22 -1.08 1 268 LEU -2.50 0.81 1 269 GLU -1.63 0.08 1 270 LYS 0.56 -0.53 1 271 LYS -1.98 0.12 1 272 ASP -0.76 -0.21 1 273 PHE 5.06 -2.24 1 274 ALA 3.89 -1.92 1 275 SER 1.78 -0.17 1 276 ILE 1.10 -0.33 1 278 THR 3.66 -1.20 1 279 ASN 1.79 -1.45 1 280 ALA -2.87 1.18 1 281 SER -1.20 -1.04 1 283 LEU 2.65 -0.31 1 284 ALA 3.82 -2.02 1 285 VAL 6.73 -2.26 1 286 ASN 2.77 1.15 1 293 VAL -3.51 0.69 1 294 LEU 5.01 -1.36 1 295 ASP 0.25 -1.02 1 296 ALA 2.20 0.13 1 298 GLN -1.02 -0.23 1 299 ARG -0.29 0.31 1 300 VAL -0.12 -1.24 1 301 THR -2.41 0.91 1 302 ALA 6.13 -2.79 1 304 GLU 2.18 -0.50 1 316 ASP -1.07 0.30 1 317 THR 0.36 -0.78 1 318 GLU -0.48 -0.20 1 319 ASP -0.37 -0.06 1 320 GLU -0.09 -0.10 1 322 GLN 0.57 -1.37 1 323 VAL -1.78 0.20 1 324 GLN -0.69 -0.39 1 325 LYS 2.10 -1.70 1 326 TYR 1.57 -0.90 1 327 ASP -0.50 -1.32 1 328 ASP -0.45 -0.31 1 329 SER 5.22 -1.28 1 330 PHE 1.43 -1.17 1 331 ASP 4.27 -1.38 1 332 ASP -0.61 -0.08 1 333 VAL -0.36 -0.43 1 334 ASP 1.07 -0.74 1 348 VAL 5.86 -2.31 1 349 LEU 3.53 -1.86 1 350 SER 0.05 -0.36 1 351 PHE 1.91 -0.41 1 352 LYS -3.75 -0.52 1 356 GLN 0.43 -0.86 1 357 LEU 0.85 -1.01 1 359 ALA -0.05 -0.48 1 360 ARG 0.83 -1.15 1 361 VAL 0.42 -0.90 1 362 SER -0.63 0.07 1 363 LYS 0.76 -1.01 1 364 GLU -0.08 -0.47 1 365 THR 0.02 -0.43 1 367 LEU 1.36 -0.06 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr26758_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -6.27 _LACS_plot.Line_1_terminator_val_y_1 -2.28 _LACS_plot.Line_1_terminator_val_x_2 1.99 _LACS_plot.Line_1_terminator_val_y_2 0.43 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.90 _LACS_plot.Line_2_terminator_val_x_2 6.72 _LACS_plot.Line_2_terminator_val_y_2 1.91 _LACS_plot.Y_axis_chem_shift_offset 0.24 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 367 LEU 1.36 -7.02 0 145 HIS 0.20 7.39 0 12 TYR -3.06 -3.98 1 13 ARG -3.39 -0.36 1 15 GLU -0.49 -0.50 1 16 VAL -0.37 0.27 1 18 LYS 5.00 -1.15 1 19 THR -1.53 -2.11 1 20 ALA 0.96 -1.25 1 21 TRP -0.28 -1.21 1 24 ARG 1.38 0.40 1 25 ALA 3.09 -0.45 1 26 VAL 2.20 -1.57 1 27 TYR -0.27 -1.27 1 28 ARG -3.88 -1.74 1 29 ASP 2.93 -1.96 1 30 LEU 1.76 1.79 1 31 GLN -4.32 -2.80 1 40 ALA -4.63 -2.90 1 41 VAL -2.88 0.41 1 43 SER -3.50 -2.04 1 44 ALA -5.11 -2.30 1 45 VAL -2.50 0.15 1 46 ASP -1.11 0.94 1 48 ARG 3.08 1.94 1 49 THR -2.47 1.53 1 51 ALA -0.88 -1.72 1 52 LYS 1.47 1.79 1 62 PHE -0.14 0.99 1 63 GLN 1.87 -0.89 1 64 SER -3.81 -1.09 1 65 GLU 5.18 0.28 1 66 LEU 4.20 2.08 1 67 PHE 4.98 2.15 1 68 ALA 3.46 1.16 1 69 LYS 3.89 2.28 1 85 ASN -0.51 -1.27 1 86 VAL -2.33 -1.00 1 87 ILE 0.35 -5.00 1 89 LEU -3.43 -0.03 1 96 ASP 0.14 1.12 1 97 GLU 0.30 -0.60 1 98 THR -6.27 -1.00 1 99 LEU 3.99 1.21 1 100 ASP 3.83 1.05 1 101 ASP -1.02 -0.65 1 102 PHE 0.40 -1.18 1 114 THR -1.77 -1.08 1 115 ASP -4.62 -0.65 1 116 LEU 2.53 0.33 1 118 LYS 4.35 3.18 1 119 LEU 3.61 1.30 1 120 MET 2.25 0.84 1 121 LYS 2.11 0.75 1 125 LEU 0.11 -0.48 1 127 GLU 4.45 1.66 1 128 ASP 4.54 2.66 1 129 ARG 3.75 1.96 1 130 ILE 6.30 0.60 1 131 GLN 4.99 1.94 1 132 PHE 1.44 3.51 1 146 ALA 4.29 1.22 1 147 ALA 0.93 -0.98 1 160 ALA -2.16 -1.27 1 161 VAL -6.05 -1.77 1 162 ASN -4.83 3.04 1 163 GLU 3.87 0.36 1 164 ASP 0.48 -1.49 1 166 GLU 0.71 -1.42 1 167 LEU -5.01 -1.18 1 185 TYR -0.24 -0.67 1 186 VAL 1.08 -0.74 1 187 VAL 0.20 -1.03 1 258 ALA 2.86 1.36 1 259 LYS 5.37 2.36 1 260 ASN 4.05 2.57 1 261 TYR 3.27 2.28 1 262 MET 2.86 2.56 1 263 LYS 3.66 0.84 1 265 LEU 0.41 -0.76 1 267 GLU 1.22 -0.38 1 268 LEU -2.50 -0.78 1 269 GLU -1.63 -1.03 1 270 LYS 0.56 0.26 1 271 LYS -1.98 -0.95 1 272 ASP -0.76 2.23 1 273 PHE 5.06 2.30 1 274 ALA 3.89 1.17 1 275 SER 1.78 0.27 1 276 ILE 1.10 0.03 1 277 LEU 0.30 -1.61 1 278 THR 3.66 0.00 1 279 ASN 1.79 -0.71 1 280 ALA -2.87 -0.87 1 283 LEU 2.65 0.56 1 284 ALA 3.82 1.50 1 285 VAL 6.73 0.39 1 286 ASN 2.77 1.43 1 293 VAL -3.51 0.47 1 294 LEU 5.01 -0.62 1 295 ASP 0.25 0.41 1 298 GLN -1.02 -0.04 1 299 ARG -0.29 -0.67 1 300 VAL -0.12 -2.47 1 301 THR -2.41 1.31 1 302 ALA 6.13 1.72 1 304 GLU 2.18 3.49 1 316 ASP -1.07 0.02 1 317 THR 0.36 -0.07 1 318 GLU -0.48 -0.35 1 319 ASP -0.37 -0.57 1 320 GLU -0.09 -0.23 1 322 GLN 0.57 -1.00 1 323 VAL -1.78 -2.01 1 324 GLN -0.69 0.25 1 325 LYS 2.10 0.36 1 326 TYR 1.57 -1.73 1 327 ASP -0.50 -1.58 1 328 ASP -0.45 2.35 1 329 SER 5.22 1.79 1 330 PHE 1.43 1.06 1 331 ASP 4.27 0.46 1 332 ASP -0.61 -0.53 1 333 VAL -0.36 -1.11 1 334 ASP 1.07 -0.95 1 348 VAL 5.86 1.73 1 349 LEU 3.53 1.25 1 350 SER 0.05 0.20 1 351 PHE 1.91 -1.70 1 352 LYS -3.75 -4.40 1 356 GLN 0.43 -0.21 1 357 LEU 0.85 0.15 1 359 ALA -0.05 -0.13 1 360 ARG 0.83 0.03 1 361 VAL 0.42 -0.21 1 362 SER -0.63 -0.18 1 363 LYS 0.76 -0.20 1 364 GLU -0.08 -0.30 1 365 THR 0.02 -0.54 1 stop_ save_