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 bmr17210_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 -3.05 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.73 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.19 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 7.46 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 334 ILE 0.39 -3.04 0 13 ASN -4.79 0.18 1 14 SER -1.92 0.14 1 16 VAL -6.06 -3.56 1 17 ALA -7.22 -2.72 1 18 ILE -6.71 -2.13 1 19 MET 1.95 -1.48 1 20 ASP -1.53 -2.08 1 22 THR 0.72 0.13 1 23 THR -2.08 -0.61 1 25 ARG -3.75 -0.74 1 26 VAL 1.54 0.84 1 27 LEU -1.53 -1.18 1 28 GLU -1.37 -0.70 1 29 ASN -1.66 -1.65 1 30 ALA 2.98 2.38 1 31 GLU 2.72 1.99 1 33 ASP -3.46 -0.85 1 34 ARG 1.55 2.06 1 35 THR -3.53 -1.33 1 36 THR -4.88 -1.77 1 39 ILE -3.68 -0.60 1 40 ILE -4.41 -0.03 1 41 ALA -8.53 -2.76 1 42 TYR -1.23 -1.02 1 43 THR -2.01 -0.55 1 45 ASP 0.14 -0.45 1 47 GLU -1.98 -0.71 1 48 THR 0.15 -0.17 1 49 LEU -5.18 -2.52 1 50 VAL -3.96 -1.26 1 52 GLN 9.92 7.09 1 54 ALA 0.93 1.23 1 55 LYS 4.06 3.97 1 56 ARG 3.19 3.00 1 57 GLN -1.88 -1.81 1 58 ALA 3.59 3.28 1 59 VAL 3.80 2.68 1 60 THR 0.44 -0.05 1 61 ASN -0.06 -0.05 1 63 GLN 3.61 3.09 1 64 ASN -2.46 -0.85 1 65 THR 3.25 2.03 1 66 LEU -1.24 -1.28 1 67 PHE -3.75 -3.15 1 68 ALA 3.79 1.58 1 69 ILE 3.39 -0.23 1 70 LYS 1.12 3.00 1 71 ARG 2.07 2.11 1 72 LEU -2.74 -0.48 1 73 ILE 1.15 2.04 1 75 ARG -1.75 -0.04 1 76 ARG -0.55 -1.24 1 77 PHE 4.54 4.15 1 78 GLN 1.32 0.19 1 79 ASP -0.16 0.65 1 80 GLU 4.22 3.99 1 81 GLU 3.44 2.59 1 82 VAL 4.82 3.78 1 83 GLN 3.33 2.40 1 84 ARG 3.85 2.96 1 85 ASP 4.12 2.90 1 86 VAL 5.04 4.34 1 87 SER 1.84 2.15 1 88 ILE -0.71 0.97 1 89 MET -0.19 -2.38 1 91 PHE -5.80 -4.55 1 92 LYS 0.22 0.73 1 93 ILE -0.11 0.57 1 94 ILE -6.11 -1.73 1 95 ALA -1.12 -1.82 1 96 ALA 0.11 -1.82 1 98 ASN 0.44 -0.65 1 100 ASP 2.14 1.55 1 101 ALA -0.32 0.38 1 102 TRP -6.36 -2.25 1 103 VAL -4.76 -1.96 1 104 GLU -5.08 -1.61 1 105 VAL -3.37 -0.97 1 106 LYS 4.11 1.06 1 108 GLN -2.71 -1.74 1 109 LYS 0.45 0.56 1 110 MET -4.48 -0.51 1 111 ALA -3.02 -1.72 1 114 GLN 3.43 3.33 1 115 ILE 3.01 2.21 1 117 ALA 2.20 2.80 1 118 GLU 3.71 2.21 1 119 VAL 5.11 3.99 1 120 LEU 4.10 3.13 1 121 LYS 4.57 4.51 1 122 LYS 3.95 2.76 1 123 MET 2.90 2.51 1 124 LYS 2.25 4.06 1 125 LYS 3.04 2.56 1 126 THR 5.85 5.33 1 127 ALA 2.88 2.98 1 128 GLU 3.82 3.49 1 129 ASP 4.14 2.95 1 130 TYR 2.74 3.45 1 131 LEU -0.84 1.12 1 133 GLU -2.98 -0.91 1 135 VAL -1.26 0.34 1 136 THR -2.00 -0.79 1 137 GLU -6.28 -0.71 1 138 ALA -7.92 -1.72 1 139 VAL -1.31 0.14 1 140 ILE -4.25 -1.67 1 141 THR -2.08 -1.87 1 142 VAL -5.53 -4.63 1 146 PHE 1.23 -1.36 1 147 ASN -2.06 -1.85 1 148 ASP 4.66 4.35 1 149 ALA 3.85 2.95 1 150 GLN 3.56 3.81 1 151 ARG 6.25 5.36 1 152 GLN 4.52 3.19 1 153 ALA 1.67 2.37 1 155 LYS 6.15 5.16 1 156 ASP 4.34 3.45 1 157 ALA 3.38 2.58 1 159 ARG 5.15 3.96 1 160 ILE 4.59 4.27 1 161 ALA -1.12 0.08 1 163 LEU -4.47 -2.81 1 164 GLU -0.58 -0.81 1 165 VAL 3.14 0.44 1 166 LYS 0.64 0.15 1 167 ARG -5.06 -1.05 1 168 ILE -1.59 -2.13 1 169 ILE -6.29 -3.41 1 170 ASN -1.17 -1.24 1 171 GLU 7.09 4.36 1 173 THR 6.22 4.28 1 174 ALA 4.23 3.30 1 175 ALA 3.66 2.73 1 176 ALA 2.99 2.86 1 177 LEU 3.11 2.82 1 183 LYS 0.46 -0.09 1 185 THR 0.37 0.70 1 187 ASN 0.27 0.05 1 188 ARG -5.31 -1.50 1 189 THR 0.92 0.53 1 190 ILE -5.26 -2.33 1 191 ALA -5.42 -2.94 1 192 VAL -0.25 -0.26 1 193 TYR -2.23 -0.75 1 194 ASP -4.07 -2.65 1 195 LEU -3.74 -1.40 1 201 ASP -6.15 -1.27 1 202 ILE -7.45 -5.37 1 203 SER -3.85 -0.74 1 204 ILE -0.71 -2.13 1 205 ILE -4.56 -0.58 1 206 GLU -3.25 -1.47 1 207 ILE -1.61 -1.01 1 208 ASP -3.90 -1.95 1 209 GLU -3.32 -1.15 1 210 VAL -1.56 -0.06 1 211 ASP 2.84 1.55 1 213 GLU -2.72 -1.58 1 214 LYS -1.90 -0.73 1 215 THR -2.48 -1.47 1 216 PHE -3.13 -1.25 1 217 GLU -4.79 -1.51 1 218 VAL 2.64 1.45 1 219 LEU 0.05 0.61 1 220 ALA -4.75 0.15 1 221 THR -2.68 -0.97 1 222 ASN -3.06 -0.05 1 224 ASP -3.16 -0.15 1 225 THR 2.45 1.33 1 226 HIS -0.14 -0.93 1 227 LEU -2.37 -0.71 1 231 ASP 1.34 1.85 1 233 ASP 5.36 3.79 1 234 SER 4.14 3.63 1 235 ARG 1.80 0.89 1 236 LEU 3.04 2.40 1 237 ILE 5.96 5.96 1 238 ASN 4.56 3.89 1 239 TYR 2.91 3.19 1 240 LEU 3.82 3.18 1 241 VAL 5.15 4.65 1 242 GLU 3.92 2.90 1 243 GLU 3.22 2.79 1 245 LYS 3.85 3.76 1 246 LYS 4.05 3.56 1 247 ASP 0.74 2.65 1 248 GLN -1.08 -0.31 1 250 ILE -5.39 -1.41 1 251 ASP -2.06 -1.95 1 252 LEU 1.56 1.72 1 253 ARG 4.05 2.96 1 254 ASN 0.14 0.05 1 255 ASP -3.06 -1.75 1 257 LEU 4.13 2.75 1 258 ALA 2.58 2.48 1 259 MET 4.42 0.69 1 260 GLN 4.32 3.54 1 261 ARG 3.79 3.88 1 262 LEU 2.21 2.62 1 263 LYS 4.93 3.70 1 264 GLU 2.11 2.33 1 265 ALA 1.03 1.74 1 266 ALA 2.95 2.88 1 267 GLU 4.67 3.29 1 268 LYS 3.95 3.56 1 269 ALA 3.41 2.19 1 270 LYS 6.15 4.16 1 271 ILE 6.03 5.01 1 274 SER 3.68 2.34 1 275 SER -0.20 0.68 1 276 ALA -4.02 -1.22 1 277 GLN 0.21 0.88 1 278 GLN -1.78 -0.31 1 279 THR -1.18 -1.07 1 280 ASP -2.76 -0.65 1 281 VAL 2.74 0.94 1 282 ASN -2.76 -1.35 1 283 LEU -5.13 -2.27 1 285 TYR 5.14 1.25 1 286 ILE -0.51 -0.93 1 287 THR 1.42 -0.87 1 288 ALA -3.22 -0.12 1 289 ASP -2.26 -1.25 1 290 ALA 2.90 2.63 1 291 THR 0.92 1.13 1 294 LYS -5.45 -3.24 1 295 HIS -5.36 -0.65 1 296 MET -3.28 -0.61 1 297 ASN 0.14 0.95 1 298 ILE -4.31 -0.23 1 299 LYS -0.05 -0.34 1 300 VAL -1.86 -0.46 1 301 THR -2.89 -1.77 1 302 ARG 5.15 4.26 1 303 ALA 3.78 2.88 1 304 LYS 3.95 1.16 1 305 LEU 4.43 3.76 1 306 GLU 4.85 3.80 1 307 SER 3.43 2.92 1 308 LEU 0.38 1.74 1 309 VAL -1.56 -1.76 1 310 GLU 5.67 4.59 1 311 ASP 4.34 2.65 1 312 LEU 3.06 2.32 1 313 VAL 6.44 5.04 1 314 ASN 4.64 3.05 1 315 ARG 3.75 3.26 1 316 SER 2.74 1.85 1 317 ILE 2.69 -0.03 1 318 GLU 7.92 4.69 1 321 LYS 4.38 3.87 1 322 VAL 5.21 4.31 1 323 ALA 4.21 2.57 1 324 LEU 5.14 3.72 1 325 GLN 4.35 3.43 1 327 ALA -0.50 -0.41 1 329 LEU -5.64 -1.68 1 330 SER -3.96 -1.55 1 331 VAL 5.75 4.55 1 332 SER 2.74 1.85 1 333 ASP -0.76 1.55 1 335 ASP 1.33 3.35 1 336 ASP -6.26 -0.85 1 337 VAL -2.39 -1.69 1 338 ILE -2.92 -2.15 1 339 LEU -0.29 -1.36 1 340 VAL -3.50 -1.06 1 343 GLN -0.90 -0.43 1 344 THR 2.17 1.98 1 345 ARG 2.34 1.56 1 346 MET 0.32 1.29 1 348 MET 4.02 4.69 1 349 VAL 6.04 4.84 1 350 GLN 6.72 4.59 1 351 LYS 3.15 2.96 1 352 LYS 4.08 2.52 1 353 VAL 6.56 5.62 1 354 ALA 2.75 2.41 1 355 GLU 2.30 2.45 1 356 PHE 4.98 4.16 1 357 PHE 3.33 3.28 1 359 LYS -3.36 -1.78 1 363 LYS 0.59 0.14 1 364 ASP 1.46 -0.31 1 365 VAL 1.00 1.80 1 368 ASP 0.69 1.74 1 369 GLU -2.33 0.17 1 370 ALA 3.58 3.77 1 372 ALA 3.80 2.74 1 373 ILE 5.89 4.58 1 375 ALA 4.28 2.98 1 376 ALA 4.45 2.58 1 377 VAL 6.66 4.86 1 378 GLN 4.59 2.84 1 381 VAL 3.97 3.27 1 382 LEU 3.40 2.40 1 383 THR 1.29 1.03 1 385 ASP 1.02 2.57 1 386 VAL -1.54 -0.71 1 387 LYS -1.34 -0.24 1 388 ASP 1.56 0.74 1 389 VAL -2.74 -0.13 1 390 LEU -2.26 -0.62 1 391 LEU 0.46 -0.21 1 392 LEU 0.64 1.57 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17210_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 5.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.81 _LACS_plot.Line_2_terminator_val_x_2 9.91 _LACS_plot.Line_2_terminator_val_y_2 -2.45 _LACS_plot.Y_axis_chem_shift_offset -0.14 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 334 ILE 0.39 -3.43 0 13 ASN -4.79 4.97 1 14 SER -1.92 2.06 1 16 VAL -6.06 2.50 1 17 ALA -7.22 4.50 1 18 ILE -6.71 4.58 1 19 MET 1.95 -3.43 1 20 ASP -1.53 -0.55 1 22 THR 0.72 -0.59 1 23 THR -2.08 1.47 1 25 ARG -3.75 3.01 1 26 VAL 1.54 -0.70 1 27 LEU -1.53 0.35 1 28 GLU -1.37 0.67 1 29 ASN -1.66 0.01 1 30 ALA 2.98 -0.60 1 31 GLU 2.72 -0.73 1 33 ASP -3.46 2.61 1 34 ARG 1.55 0.51 1 35 THR -3.53 2.20 1 36 THR -4.88 3.11 1 39 ILE -3.68 3.08 1 40 ILE -4.41 4.38 1 41 ALA -8.53 5.77 1 42 TYR -1.23 0.21 1 43 THR -2.01 1.46 1 45 ASP 0.14 -0.59 1 47 GLU -1.98 1.27 1 48 THR 0.15 -0.32 1 49 LEU -5.18 2.66 1 50 VAL -3.96 2.70 1 52 GLN 9.92 -2.83 1 54 ALA 0.93 0.30 1 55 LYS 4.06 -0.09 1 56 ARG 3.19 -0.19 1 57 GLN -1.88 0.07 1 58 ALA 3.59 -0.31 1 59 VAL 3.80 -1.12 1 60 THR 0.44 -0.49 1 61 ASN -0.06 0.01 1 63 GLN 3.61 -0.52 1 64 ASN -2.46 1.61 1 65 THR 3.25 -1.22 1 66 LEU -1.24 -0.04 1 67 PHE -3.75 0.60 1 68 ALA 3.79 -2.21 1 69 ILE 3.39 -3.62 1 70 LYS 1.12 1.88 1 71 ARG 2.07 0.04 1 72 LEU -2.74 2.26 1 73 ILE 1.15 0.89 1 75 ARG -1.75 1.71 1 76 ARG -0.55 -0.69 1 77 PHE 4.54 -0.39 1 78 GLN 1.32 -1.13 1 79 ASP -0.16 0.81 1 80 GLU 4.22 -0.23 1 81 GLU 3.44 -0.85 1 82 VAL 4.82 -1.04 1 83 GLN 3.33 -0.93 1 84 ARG 3.85 -0.89 1 85 ASP 4.12 -1.22 1 86 VAL 5.04 -0.70 1 87 SER 1.84 0.31 1 88 ILE -0.71 1.68 1 89 MET -0.19 -2.19 1 91 PHE -5.80 1.25 1 92 LYS 0.22 0.51 1 93 ILE -0.11 0.68 1 94 ILE -6.11 4.38 1 95 ALA -1.12 -0.70 1 96 ALA 0.11 -1.93 1 98 ASN 0.44 -1.09 1 100 ASP 2.14 -0.59 1 101 ALA -0.32 0.70 1 102 TRP -6.36 4.11 1 103 VAL -4.76 2.80 1 104 GLU -5.08 3.47 1 105 VAL -3.37 2.40 1 106 LYS 4.11 -3.05 1 108 GLN -2.71 0.97 1 109 LYS 0.45 0.11 1 110 MET -4.48 3.97 1 111 ALA -3.02 1.30 1 114 GLN 3.43 -0.10 1 115 ILE 3.01 -0.80 1 117 ALA 2.20 0.60 1 118 GLU 3.71 -1.50 1 119 VAL 5.11 -1.12 1 120 LEU 4.10 -0.97 1 121 LYS 4.57 -0.06 1 122 LYS 3.95 -1.19 1 123 MET 2.90 -0.39 1 124 LYS 2.25 1.81 1 125 LYS 3.04 -0.48 1 126 THR 5.85 -0.52 1 127 ALA 2.88 0.10 1 128 GLU 3.82 -0.33 1 129 ASP 4.14 -1.19 1 130 TYR 2.74 0.71 1 131 LEU -0.84 1.96 1 133 GLU -2.98 2.07 1 135 VAL -1.26 1.60 1 136 THR -2.00 1.21 1 137 GLU -6.28 5.57 1 138 ALA -7.92 6.20 1 139 VAL -1.31 1.45 1 140 ILE -4.25 2.58 1 141 THR -2.08 0.21 1 142 VAL -5.53 0.90 1 146 PHE 1.23 -2.59 1 147 ASN -2.06 0.21 1 148 ASP 4.66 -0.31 1 149 ALA 3.85 -0.90 1 150 GLN 3.56 0.25 1 151 ARG 6.25 -0.89 1 152 GLN 4.52 -1.33 1 153 ALA 1.67 0.70 1 155 LYS 6.15 -0.99 1 156 ASP 4.34 -0.89 1 157 ALA 3.38 -0.80 1 159 ARG 5.15 -1.19 1 160 ILE 4.59 -0.32 1 161 ALA -1.12 1.20 1 163 LEU -4.47 1.66 1 164 GLU -0.58 -0.23 1 165 VAL 3.14 -2.70 1 166 LYS 0.64 -0.49 1 167 ARG -5.06 4.01 1 168 ILE -1.59 -0.54 1 169 ILE -6.29 2.88 1 170 ASN -1.17 -0.07 1 171 GLU 7.09 -2.73 1 173 THR 6.22 -1.94 1 174 ALA 4.23 -0.93 1 175 ALA 3.66 -0.93 1 176 ALA 2.99 -0.13 1 177 LEU 3.11 -0.29 1 183 LYS 0.46 -0.55 1 185 THR 0.37 0.33 1 187 ASN 0.27 -0.22 1 188 ARG -5.31 3.81 1 189 THR 0.92 -0.39 1 190 ILE -5.26 2.93 1 191 ALA -5.42 2.48 1 192 VAL -0.25 -0.01 1 193 TYR -2.23 1.48 1 194 ASP -4.07 1.42 1 195 LEU -3.74 2.34 1 201 ASP -6.15 4.88 1 202 ILE -7.45 2.08 1 203 SER -3.85 3.11 1 204 ILE -0.71 -1.42 1 205 ILE -4.56 3.98 1 206 GLU -3.25 1.78 1 207 ILE -1.61 0.60 1 208 ASP -3.90 1.95 1 209 GLU -3.32 2.17 1 210 VAL -1.56 1.50 1 211 ASP 2.84 -1.29 1 213 GLU -2.72 1.14 1 214 LYS -1.90 1.17 1 215 THR -2.48 1.01 1 216 PHE -3.13 1.88 1 217 GLU -4.79 3.28 1 218 VAL 2.64 -1.19 1 219 LEU 0.05 0.56 1 220 ALA -4.75 4.90 1 221 THR -2.68 1.71 1 222 ASN -3.06 3.01 1 224 ASP -3.16 3.01 1 225 THR 2.45 -1.12 1 226 HIS -0.14 -0.79 1 227 LEU -2.37 1.66 1 231 ASP 1.34 0.51 1 233 ASP 5.36 -1.57 1 234 SER 4.14 -0.51 1 235 ARG 1.80 -0.91 1 236 LEU 3.04 -0.64 1 237 ILE 5.96 0.00 1 238 ASN 4.56 -0.67 1 239 TYR 2.91 0.28 1 240 LEU 3.82 -0.64 1 241 VAL 5.15 -0.50 1 242 GLU 3.92 -1.02 1 243 GLU 3.22 -0.43 1 245 LYS 3.85 -0.09 1 246 LYS 4.05 -0.49 1 247 ASP 0.74 1.91 1 248 GLN -1.08 0.77 1 250 ILE -5.39 3.98 1 251 ASP -2.06 0.11 1 252 LEU 1.56 0.16 1 253 ARG 4.05 -1.09 1 254 ASN 0.14 -0.09 1 255 ASP -3.06 1.31 1 257 LEU 4.13 -1.38 1 258 ALA 2.58 -0.10 1 259 MET 4.42 -3.73 1 260 GLN 4.32 -0.78 1 261 ARG 3.79 0.09 1 262 LEU 2.21 0.41 1 263 LYS 4.93 -1.23 1 264 GLU 2.11 0.22 1 265 ALA 1.03 0.71 1 266 ALA 2.95 -0.07 1 267 GLU 4.67 -1.38 1 268 LYS 3.95 -0.39 1 269 ALA 3.41 -1.22 1 270 LYS 6.15 -1.99 1 271 ILE 6.03 -1.02 1 274 SER 3.68 -1.34 1 275 SER -0.20 0.88 1 276 ALA -4.02 2.80 1 277 GLN 0.21 0.67 1 278 GLN -1.78 1.47 1 279 THR -1.18 0.11 1 280 ASP -2.76 2.11 1 281 VAL 2.74 -1.80 1 282 ASN -2.76 1.41 1 283 LEU -5.13 2.86 1 285 TYR 5.14 -3.89 1 286 ILE -0.51 -0.42 1 287 THR 1.42 -2.29 1 288 ALA -3.22 3.10 1 289 ASP -2.26 1.01 1 290 ALA 2.90 -0.27 1 291 THR 0.92 0.21 1 294 LYS -5.45 2.21 1 295 HIS -5.36 4.71 1 296 MET -3.28 2.67 1 297 ASN 0.14 0.81 1 298 ILE -4.31 4.08 1 299 LYS -0.05 -0.29 1 300 VAL -1.86 1.40 1 301 THR -2.89 1.12 1 302 ARG 5.15 -0.89 1 303 ALA 3.78 -0.90 1 304 LYS 3.95 -2.79 1 305 LEU 4.43 -0.67 1 306 GLU 4.85 -1.05 1 307 SER 3.43 -0.51 1 308 LEU 0.38 1.36 1 309 VAL -1.56 -0.20 1 310 GLU 5.67 -1.08 1 311 ASP 4.34 -1.69 1 312 LEU 3.06 -0.74 1 313 VAL 6.44 -1.40 1 314 ASN 4.64 -1.59 1 315 ARG 3.75 -0.49 1 316 SER 2.74 -0.89 1 317 ILE 2.69 -2.72 1 318 GLU 7.92 -3.23 1 321 LYS 4.38 -0.51 1 322 VAL 5.21 -0.90 1 323 ALA 4.21 -1.64 1 324 LEU 5.14 -1.42 1 325 GLN 4.35 -0.92 1 327 ALA -0.50 0.09 1 329 LEU -5.64 3.96 1 330 SER -3.96 2.41 1 331 VAL 5.75 -1.20 1 332 SER 2.74 -0.89 1 333 ASP -0.76 2.31 1 335 ASP 1.33 2.02 1 336 ASP -6.26 5.41 1 337 VAL -2.39 0.70 1 338 ILE -2.92 0.77 1 339 LEU -0.29 -1.07 1 340 VAL -3.50 2.44 1 343 GLN -0.90 0.47 1 344 THR 2.17 -0.19 1 345 ARG 2.34 -0.78 1 346 MET 0.32 0.97 1 348 MET 4.02 0.67 1 349 VAL 6.04 -1.20 1 350 GLN 6.72 -2.13 1 351 LYS 3.15 -0.19 1 352 LYS 4.08 -1.56 1 353 VAL 6.56 -0.94 1 354 ALA 2.75 -0.34 1 355 GLU 2.30 0.15 1 356 PHE 4.98 -0.82 1 357 PHE 3.33 -0.05 1 359 LYS -3.36 1.58 1 363 LYS 0.59 -0.45 1 364 ASP 1.46 -1.77 1 365 VAL 1.00 0.80 1 368 ASP 0.69 1.05 1 369 GLU -2.33 2.50 1 370 ALA 3.58 0.19 1 372 ALA 3.80 -1.06 1 373 ILE 5.89 -1.31 1 375 ALA 4.28 -1.30 1 376 ALA 4.45 -1.87 1 377 VAL 6.66 -1.80 1 378 GLN 4.59 -1.75 1 381 VAL 3.97 -0.70 1 382 LEU 3.40 -1.00 1 383 THR 1.29 -0.26 1 385 ASP 1.02 1.55 1 386 VAL -1.54 0.83 1 387 LYS -1.34 1.10 1 388 ASP 1.56 -0.82 1 389 VAL -2.74 2.61 1 390 LEU -2.26 1.64 1 391 LEU 0.46 -0.67 1 392 LEU 0.64 0.93 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr17210_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.53 _LACS_plot.Line_1_terminator_val_y_1 -3.73 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.69 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.02 _LACS_plot.Line_2_terminator_val_x_2 6.71 _LACS_plot.Line_2_terminator_val_y_2 2.63 _LACS_plot.Y_axis_chem_shift_offset 0.17 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 16 VAL -6.06 -5.90 0 227 LEU -2.37 -5.57 0 13 ASN -4.79 -0.49 1 14 SER -1.92 -2.50 1 17 ALA -7.22 -2.53 1 18 ILE -6.71 -1.83 1 19 MET 1.95 -1.58 1 20 ASP -1.53 -0.30 1 22 THR 0.72 -0.38 1 23 THR -2.08 -1.50 1 25 ARG -3.75 -1.63 1 26 VAL 1.54 -0.69 1 27 LEU -1.53 -1.72 1 28 GLU -1.37 -0.31 1 29 ASN -1.66 2.32 1 30 ALA 2.98 0.76 1 31 GLU 2.72 -0.40 1 33 ASP -3.46 1.29 1 34 ARG 1.55 -1.04 1 35 THR -3.53 -1.68 1 36 THR -4.88 -3.00 1 39 ILE -3.68 -3.13 1 40 ILE -4.41 -2.91 1 41 ALA -8.53 -3.30 1 42 TYR -1.23 1.47 1 45 ASP 0.14 -0.05 1 47 GLU -1.98 -0.66 1 48 THR 0.15 -0.63 1 49 LEU -5.18 -1.88 1 50 VAL -3.96 -0.35 1 54 ALA 0.93 1.76 1 55 LYS 4.06 2.49 1 56 ARG 3.19 0.62 1 57 GLN -1.88 -0.71 1 58 ALA 3.59 2.02 1 59 VAL 3.80 0.38 1 60 THR 0.44 -0.14 1 61 ASN -0.06 0.10 1 63 GLN 3.61 0.00 1 64 ASN -2.46 -1.75 1 65 THR 3.25 -2.49 1 66 LEU -1.24 -3.57 1 67 PHE -3.75 -4.28 1 68 ALA 3.79 -0.46 1 69 ILE 3.39 1.50 1 70 LYS 1.12 0.34 1 71 ARG 2.07 -0.37 1 72 LEU -2.74 -0.43 1 73 ILE 1.15 -0.95 1 75 ARG -1.75 0.68 1 76 ARG -0.55 0.46 1 77 PHE 4.54 -0.36 1 78 GLN 1.32 -0.44 1 79 ASP -0.16 1.25 1 80 GLU 4.22 2.38 1 81 GLU 3.44 1.99 1 82 VAL 4.82 1.85 1 83 GLN 3.33 2.63 1 84 ARG 3.85 1.92 1 85 ASP 4.12 2.26 1 86 VAL 5.04 1.74 1 87 SER 1.84 0.15 1 88 ILE -0.71 0.39 1 91 PHE -5.80 -2.35 1 92 LYS 0.22 -1.94 1 93 ILE -0.11 -0.81 1 94 ILE -6.11 -2.91 1 95 ALA -1.12 0.07 1 98 ASN 0.44 1.91 1 100 ASP 2.14 -2.05 1 101 ALA -0.32 -3.08 1 102 TRP -6.36 -1.51 1 103 VAL -4.76 -1.93 1 104 GLU -5.08 -1.74 1 105 VAL -3.37 -0.77 1 106 LYS 4.11 0.04 1 108 GLN -2.71 -1.54 1 109 LYS 0.45 -0.52 1 110 MET -4.48 -3.86 1 111 ALA -3.02 1.40 1 114 GLN 3.43 0.89 1 117 ALA 2.20 1.52 1 118 GLU 3.71 3.95 1 119 VAL 5.11 2.29 1 120 LEU 4.10 0.99 1 121 LYS 4.57 2.46 1 122 LYS 3.95 3.06 1 123 MET 2.90 0.76 1 124 LYS 2.25 0.63 1 125 LYS 3.04 1.17 1 126 THR 5.85 2.00 1 127 ALA 2.88 0.74 1 128 GLU 3.82 4.19 1 129 ASP 4.14 1.74 1 130 TYR 2.74 1.62 1 131 LEU -0.84 1.26 1 133 GLU -2.98 -3.40 1 135 VAL -1.26 -1.02 1 136 THR -2.00 -0.18 1 137 GLU -6.28 -2.22 1 138 ALA -7.92 -1.92 1 139 VAL -1.31 -1.59 1 140 ILE -4.25 -2.05 1 141 THR -2.08 -0.56 1 146 PHE 1.23 2.00 1 147 ASN -2.06 1.14 1 148 ASP 4.66 1.92 1 149 ALA 3.85 4.10 1 150 GLN 3.56 3.44 1 151 ARG 6.25 1.80 1 152 GLN 4.52 2.04 1 153 ALA 1.67 1.60 1 155 LYS 6.15 3.00 1 156 ASP 4.34 1.57 1 157 ALA 3.38 1.35 1 159 ARG 5.15 5.25 1 160 ILE 4.59 0.88 1 161 ALA -1.12 -2.13 1 163 LEU -4.47 -2.36 1 164 GLU -0.58 -0.86 1 165 VAL 3.14 -0.56 1 166 LYS 0.64 0.90 1 167 ARG -5.06 -2.83 1 168 ILE -1.59 0.03 1 169 ILE -6.29 -2.98 1 170 ASN -1.17 2.68 1 173 THR 6.22 0.66 1 174 ALA 4.23 1.06 1 175 ALA 3.66 1.06 1 176 ALA 2.99 1.59 1 183 LYS 0.46 0.54 1 185 THR 0.37 0.55 1 187 ASN 0.27 0.63 1 188 ARG -5.31 -2.19 1 189 THR 0.92 -0.07 1 190 ILE -5.26 -2.59 1 191 ALA -5.42 -3.08 1 192 VAL -0.25 -2.79 1 193 TYR -2.23 -3.66 1 194 ASP -4.07 -0.97 1 201 ASP -6.15 -4.43 1 202 ILE -7.45 -2.73 1 203 SER -3.85 -2.57 1 204 ILE -0.71 -1.14 1 205 ILE -4.56 -3.62 1 206 GLU -3.25 -1.29 1 207 ILE -1.61 -1.62 1 208 ASP -3.90 -1.49 1 209 GLU -3.32 -1.42 1 210 VAL -1.56 -0.30 1 211 ASP 2.84 -0.56 1 213 GLU -2.72 -1.42 1 214 LYS -1.90 -1.15 1 215 THR -2.48 -1.50 1 216 PHE -3.13 -1.02 1 217 GLU -4.79 -1.89 1 218 VAL 2.64 -0.12 1 219 LEU 0.05 0.27 1 220 ALA -4.75 -2.41 1 221 THR -2.68 -2.33 1 222 ASN -3.06 -1.56 1 224 ASP -3.16 0.24 1 225 THR 2.45 -0.94 1 226 HIS -0.14 -1.26 1 231 ASP 1.34 2.80 1 233 ASP 5.36 3.00 1 234 SER 4.14 2.08 1 235 ARG 1.80 3.42 1 236 LEU 3.04 0.28 1 237 ILE 5.96 0.80 1 239 TYR 2.91 0.46 1 240 LEU 3.82 1.67 1 241 VAL 5.15 3.63 1 242 GLU 3.92 3.31 1 243 GLU 3.22 2.30 1 245 LYS 3.85 3.09 1 246 LYS 4.05 1.21 1 247 ASP 0.74 1.04 1 248 GLN -1.08 1.28 1 250 ILE -5.39 -2.52 1 251 ASP -2.06 0.58 1 252 LEU 1.56 -0.66 1 253 ARG 4.05 1.60 1 254 ASN 0.14 -1.50 1 255 ASP -3.06 -1.40 1 257 LEU 4.13 1.73 1 258 ALA 2.58 2.87 1 259 MET 4.42 3.95 1 260 GLN 4.32 3.26 1 261 ARG 3.79 4.02 1 262 LEU 2.21 0.15 1 263 LYS 4.93 1.83 1 264 GLU 2.11 2.49 1 265 ALA 1.03 2.75 1 266 ALA 2.95 0.59 1 267 GLU 4.67 1.42 1 268 LYS 3.95 2.00 1 269 ALA 3.41 0.71 1 270 LYS 6.15 2.29 1 274 SER 3.68 -1.54 1 275 SER -0.20 -1.62 1 277 GLN 0.21 0.41 1 278 GLN -1.78 -3.50 1 279 THR -1.18 -4.58 1 280 ASP -2.76 -0.56 1 281 VAL 2.74 -2.81 1 282 ASN -2.76 -1.09 1 283 LEU -5.13 -3.00 1 285 TYR 5.14 0.95 1 286 ILE -0.51 -2.38 1 287 THR 1.42 -3.02 1 288 ALA -3.22 -2.19 1 289 ASP -2.26 1.10 1 290 ALA 2.90 1.59 1 291 THR 0.92 0.19 1 294 LYS -5.45 -2.49 1 295 HIS -5.36 0.79 1 296 MET -3.28 -1.12 1 297 ASN 0.14 -1.87 1 298 ILE -4.31 -2.60 1 299 LYS -0.05 -0.42 1 300 VAL -1.86 -1.06 1 301 THR -2.89 0.32 1 302 ARG 5.15 1.16 1 303 ALA 3.78 2.81 1 304 LYS 3.95 2.40 1 305 LEU 4.43 0.53 1 306 GLU 4.85 1.93 1 308 LEU 0.38 1.55 1 309 VAL -1.56 0.39 1 310 GLU 5.67 0.47 1 311 ASP 4.34 2.30 1 312 LEU 3.06 0.44 1 313 VAL 6.44 4.14 1 314 ASN 4.64 3.49 1 315 ARG 3.75 1.69 1 316 SER 2.74 -2.39 1 317 ILE 2.69 1.78 1 321 LYS 4.38 3.48 1 322 VAL 5.21 0.79 1 323 ALA 4.21 1.78 1 324 LEU 5.14 1.18 1 327 ALA -0.50 -1.01 1 329 LEU -5.64 -1.92 1 330 SER -3.96 1.83 1 331 VAL 5.75 1.92 1 332 SER 2.74 0.37 1 333 ASP -0.76 -1.48 1 334 ILE 0.39 -1.30 1 335 ASP 1.33 -0.67 1 336 ASP -6.26 -3.28 1 338 ILE -2.92 -2.67 1 339 LEU -0.29 -2.28 1 340 VAL -3.50 -3.92 1 343 GLN -0.90 2.34 1 344 THR 2.17 -1.21 1 345 ARG 2.34 0.36 1 346 MET 0.32 0.40 1 348 MET 4.02 2.23 1 349 VAL 6.04 0.17 1 350 GLN 6.72 2.51 1 351 LYS 3.15 2.27 1 353 VAL 6.56 1.52 1 354 ALA 2.75 3.98 1 356 PHE 4.98 1.22 1 357 PHE 3.33 0.55 1 363 LYS 0.59 0.12 1 364 ASP 1.46 -0.96 1 368 ASP 0.69 0.92 1 369 GLU -2.33 -0.79 1 372 ALA 3.80 1.94 1 373 ILE 5.89 1.82 1 375 ALA 4.28 1.28 1 376 ALA 4.45 2.80 1 377 VAL 6.66 1.78 1 378 GLN 4.59 3.63 1 381 VAL 3.97 3.62 1 382 LEU 3.40 1.86 1 383 THR 1.29 1.08 1 385 ASP 1.02 -0.61 1 386 VAL -1.54 -1.05 1 387 LYS -1.34 -0.77 1 388 ASP 1.56 -1.46 1 390 LEU -2.26 -2.62 1 391 LEU 0.46 -1.84 1 stop_ save_