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 bmr16464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.71 _LACS_plot.Line_1_terminator_val_y_1 -4.30 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -2.25 _LACS_plot.Line_2_terminator_val_x_2 9.45 _LACS_plot.Line_2_terminator_val_y_2 6.61 _LACS_plot.Y_axis_chem_shift_offset 0.78 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 22 PHE -2.44 -6.52 0 10 ASP -1.00 -1.34 1 11 VAL -0.11 -1.63 1 12 ARG 4.61 2.37 1 14 LYS -1.22 -1.78 1 15 ARG 0.89 -0.70 1 16 VAL -1.61 -1.52 1 17 PHE -0.50 -1.41 1 19 ARG -3.74 -2.04 1 20 VAL -6.38 -3.83 1 23 ASN 2.12 -1.00 1 24 VAL -0.83 -4.36 1 26 MET -2.61 -2.84 1 27 GLU -4.36 0.87 1 30 ALA -4.20 -3.05 1 31 ILE 1.41 0.78 1 32 THR 2.45 0.52 1 33 ASP -2.34 1.72 1 34 ASP -1.25 -2.11 1 35 THR 8.68 6.69 1 36 ARG 6.98 4.80 1 37 ILE 3.35 1.88 1 38 ARG 4.67 3.14 1 39 ALA 1.04 1.35 1 40 ALA -0.84 -0.41 1 41 LEU 8.40 4.04 1 43 THR 5.38 3.84 1 44 ILE 5.92 5.10 1 45 ARG 5.68 4.02 1 46 TYR 4.34 3.78 1 47 LEU 4.38 3.06 1 48 ILE 5.41 4.78 1 49 GLU 2.99 1.68 1 50 HIS 2.69 1.96 1 52 ALA -1.49 -0.93 1 53 LYS 0.97 -0.56 1 54 VAL 3.56 2.23 1 55 ILE -0.96 -1.20 1 56 LEU -4.57 -2.46 1 57 ALA -8.11 -4.05 1 58 SER -2.35 -2.03 1 59 HIS -4.71 -0.13 1 60 LEU -0.18 0.77 1 62 ARG -2.80 -2.45 1 64 LYS 4.63 -0.26 1 66 LYS -4.23 -3.11 1 67 VAL 3.76 1.01 1 69 GLU 4.66 3.22 1 70 GLU 3.38 1.69 1 71 LEU -0.23 -2.00 1 72 ARG 1.09 1.70 1 73 LEU 2.45 0.29 1 74 ASP 6.25 4.74 1 75 ALA 4.61 2.46 1 76 VAL 5.99 3.75 1 77 ALA 4.70 2.80 1 78 LYS 4.02 2.49 1 79 ARG 3.01 0.06 1 80 LEU 4.95 2.73 1 82 GLU 2.76 1.91 1 83 LEU 1.94 1.53 1 84 LEU -0.83 -0.34 1 85 GLU 3.64 0.21 1 86 ARG -3.70 -3.03 1 88 VAL -1.92 -1.31 1 89 ALA -1.42 -1.31 1 90 LYS -2.35 -1.55 1 91 THR -2.14 -1.99 1 92 ASN 0.32 -0.02 1 93 GLU -6.57 -2.18 1 94 ALA -2.61 -0.62 1 95 VAL -6.07 -3.39 1 97 ASP 4.63 3.64 1 98 GLU 4.03 2.34 1 99 VAL 6.20 3.90 1 100 LYS 5.67 3.82 1 101 ALA 3.84 1.88 1 102 ALA 3.63 1.93 1 103 VAL 5.60 3.36 1 104 ASP 2.97 2.11 1 105 ARG 0.37 -0.06 1 106 LEU 1.28 0.61 1 107 ASN -3.26 -2.11 1 108 GLU 3.63 2.65 1 110 ASP -2.15 -0.36 1 111 VAL -2.75 -1.81 1 112 LEU -6.27 -2.35 1 113 LEU -4.01 -2.22 1 114 LEU -0.94 -1.67 1 116 ASN 1.02 0.10 1 117 VAL 4.80 2.44 1 118 ARG 2.22 1.40 1 119 PHE 0.35 -3.73 1 120 TYR -2.36 -3.05 1 123 GLU 4.38 2.10 1 124 GLU 2.30 0.99 1 125 LYS -0.30 -1.12 1 126 ASN 1.61 -1.25 1 129 GLU 3.56 1.87 1 130 LEU 3.26 0.84 1 131 ALA 4.90 2.87 1 132 LYS 4.21 2.49 1 133 ALA 4.10 1.82 1 134 PHE 1.31 -0.51 1 135 ALA 2.34 1.48 1 136 GLU 1.50 0.91 1 137 LEU 0.09 -0.13 1 138 ALA -7.87 -2.26 1 139 ASP -2.73 0.55 1 140 LEU -3.74 -0.59 1 141 TYR -4.14 -2.70 1 142 VAL -5.08 -4.14 1 143 ASN -1.55 -2.21 1 144 ASP -5.63 -2.22 1 145 ALA -1.72 -3.16 1 146 PHE 6.35 4.73 1 148 ALA -2.56 -3.03 1 149 ALA 3.09 1.91 1 150 HIS 0.65 0.63 1 151 ARG -0.59 -4.13 1 152 ALA 0.17 -3.15 1 153 HIS -9.71 -3.65 1 154 ALA 6.58 4.23 1 155 SER 3.67 2.18 1 156 THR -0.47 -0.33 1 157 GLU 1.69 3.30 1 159 ILE 4.19 2.33 1 160 ALA 1.35 0.17 1 161 HIS 2.24 0.60 1 162 TYR -1.13 0.57 1 163 LEU -6.62 -3.54 1 165 ALA -5.08 -1.60 1 166 VAL -6.33 -4.81 1 167 ALA -2.22 -1.92 1 169 PHE 1.54 -0.86 1 170 LEU 4.73 2.38 1 171 MET 2.42 2.77 1 172 GLU 2.45 2.76 1 173 LYS 3.81 2.73 1 174 GLU 5.53 2.09 1 175 LEU 4.00 2.04 1 176 GLU 3.27 2.42 1 177 VAL 5.64 3.79 1 178 LEU 4.70 2.41 1 180 LYS 4.11 2.39 1 181 ALA 3.18 1.22 1 182 LEU 0.63 -0.56 1 183 SER 4.12 2.50 1 184 ASN -0.89 -1.88 1 186 ASP 3.28 0.09 1 187 ARG -1.44 -0.25 1 189 PHE -3.37 -4.28 1 190 THR -2.56 -1.31 1 191 ALA -5.08 -3.48 1 192 ILE -0.61 -1.82 1 193 ILE -2.36 -1.50 1 198 VAL -0.80 -2.32 1 200 ASP 0.19 1.53 1 201 LYS 1.18 1.72 1 202 ILE 6.10 4.31 1 204 VAL 2.38 0.34 1 205 ILE 5.51 3.46 1 206 ASP 3.20 3.38 1 207 ASN 2.08 1.41 1 208 LEU 5.12 2.64 1 209 LEU 2.79 1.41 1 210 GLU -0.12 -0.84 1 211 LYS -2.23 0.51 1 212 VAL -0.92 -2.06 1 213 ASP 0.17 2.55 1 214 ASN -5.77 -2.10 1 215 LEU -4.20 -2.15 1 216 ILE -0.63 -1.39 1 217 ILE -3.77 -4.14 1 221 LEU 3.44 2.06 1 222 ALA 3.07 1.50 1 223 TYR 9.46 5.40 1 224 THR 6.59 5.70 1 225 PHE 5.58 4.09 1 226 VAL 6.27 4.75 1 227 LYS 1.98 0.51 1 228 ALA 3.01 1.70 1 229 LEU 0.76 -0.04 1 231 HIS -2.72 -1.12 1 232 ASP -0.40 0.23 1 233 VAL -1.39 -3.30 1 235 LYS 1.34 -1.55 1 236 SER 1.20 0.29 1 237 LEU 2.60 1.61 1 238 LEU -2.53 -0.68 1 239 GLU -1.84 -3.60 1 240 GLU 3.86 2.88 1 241 ASP 2.17 0.34 1 242 LYS -2.04 -3.31 1 243 ILE 5.88 4.22 1 244 GLU 4.56 2.35 1 245 LEU 3.52 1.62 1 246 ALA 5.70 2.45 1 247 LYS 4.99 3.59 1 248 SER 4.64 2.83 1 249 PHE 1.77 -1.34 1 250 MET 5.41 4.60 1 251 GLU 3.63 2.13 1 252 LYS 4.73 2.94 1 253 ALA 5.25 3.03 1 254 LYS 4.33 2.61 1 255 GLU 2.98 2.19 1 256 LYS -0.07 -1.15 1 258 VAL -0.94 -0.62 1 259 ARG 2.74 0.63 1 260 PHE -3.45 -1.64 1 261 TYR -1.55 -0.11 1 262 MET -3.53 -2.66 1 264 VAL -0.88 -1.95 1 265 ASP -1.42 -1.97 1 266 VAL -6.21 -2.82 1 267 VAL 0.38 -0.76 1 268 VAL -5.71 -5.16 1 269 ALA -8.43 -2.82 1 270 ASP 2.11 -0.23 1 273 ALA -3.32 -0.75 1 275 ASP -0.02 -2.43 1 276 ALA -2.24 -0.71 1 277 ASN 1.31 0.97 1 278 THR -5.39 -2.79 1 279 LYS -3.89 -1.34 1 280 VAL 0.66 -0.86 1 281 VAL -5.93 -5.58 1 283 ILE 1.09 0.78 1 284 ASP 0.13 -1.89 1 285 ALA -1.96 -2.30 1 286 ILE 1.95 -0.17 1 288 ALA 2.62 1.83 1 289 ASP 0.92 -0.91 1 290 TYR -3.32 -1.62 1 291 SER -3.00 -1.90 1 292 ALA 1.50 -0.85 1 293 LEU -0.67 -0.69 1 294 ASP -2.65 -0.79 1 295 ILE 0.95 0.26 1 298 LYS 5.49 2.73 1 299 THR 7.33 5.27 1 300 ARG 4.20 3.71 1 301 GLU 3.44 2.52 1 302 LEU 3.20 2.27 1 303 TYR 3.40 -0.72 1 304 ARG 5.87 3.69 1 305 ASP 5.05 3.16 1 306 VAL 5.06 2.89 1 307 ILE 7.12 5.07 1 308 ARG 4.07 2.61 1 309 GLU -0.79 -1.19 1 310 SER 0.22 0.61 1 311 LYS -0.34 -0.57 1 312 LEU -1.94 -0.34 1 313 VAL -4.04 -2.39 1 314 VAL -2.08 -1.73 1 315 TRP -7.64 -4.96 1 316 ASN -3.22 0.97 1 319 MET -3.86 0.31 1 321 VAL 2.33 -2.17 1 322 PHE 2.73 0.91 1 323 GLU 5.07 2.54 1 324 MET -2.48 -1.22 1 325 ASP 4.54 3.42 1 326 ALA 3.40 1.12 1 327 PHE -0.39 -2.98 1 328 ALA -0.45 0.24 1 329 HIS 3.33 4.35 1 332 LYS 5.81 3.83 1 333 ALA 3.61 1.78 1 334 ILE 4.78 0.59 1 335 ALA 4.35 2.91 1 336 GLU 3.49 2.77 1 337 ALA 3.23 1.59 1 338 LEU 3.33 1.95 1 339 ALA 1.70 1.68 1 340 GLU -0.59 -0.99 1 341 ALA 2.23 -1.28 1 342 LEU 3.25 1.74 1 343 ASP -0.31 -0.59 1 344 THR 0.08 0.29 1 345 TYR 0.27 -0.62 1 346 SER -4.60 -2.66 1 347 VAL -2.46 -2.17 1 348 ILE -3.83 -3.17 1 352 ASP 4.28 3.62 1 353 SER 7.42 5.22 1 354 ALA 4.41 2.13 1 355 ALA 3.42 1.78 1 356 ALA 6.13 2.23 1 357 VAL 7.10 4.54 1 358 GLU 3.06 1.69 1 359 LYS 4.87 2.63 1 360 PHE -1.36 -2.72 1 362 LEU -3.12 -1.65 1 363 ALA 4.57 3.45 1 364 ASP 2.44 0.42 1 365 LYS -0.45 -1.66 1 366 MET -2.13 -3.65 1 367 ASP 5.02 4.16 1 368 HIS -2.66 1.92 1 369 ILE 0.12 -3.16 1 370 SER -2.33 -2.66 1 371 THR 0.83 1.30 1 375 ALA 3.07 2.60 1 376 SER 6.80 4.92 1 377 LEU 3.94 2.75 1 378 GLU 5.17 3.22 1 379 PHE 4.31 3.53 1 380 MET 2.66 2.75 1 381 GLU 1.04 2.00 1 383 LYS -0.24 -0.67 1 384 GLN 0.43 -1.48 1 385 LEU 0.14 -2.79 1 388 VAL 2.94 2.00 1 389 VAL 4.35 2.76 1 390 ALA 0.68 0.02 1 391 LEU -0.16 -1.48 1 392 GLU 0.02 0.78 1 393 ASP 0.27 0.51 1 394 LYS 2.82 2.39 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.71 _LACS_plot.Line_1_terminator_val_y_1 5.41 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -2.16 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.25 _LACS_plot.Line_2_terminator_val_x_2 9.45 _LACS_plot.Line_2_terminator_val_y_2 -2.84 _LACS_plot.Y_axis_chem_shift_offset 0.78 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 22 PHE -2.44 -4.08 0 10 ASP -1.00 -0.34 1 11 VAL -0.11 -1.52 1 12 ARG 4.61 -2.24 1 14 LYS -1.22 -0.56 1 15 ARG 0.89 -1.59 1 16 VAL -1.61 0.09 1 17 PHE -0.50 -0.91 1 19 ARG -3.74 1.70 1 20 VAL -6.38 2.55 1 23 ASN 2.12 -3.12 1 24 VAL -0.83 -3.53 1 26 MET -2.61 -0.23 1 27 GLU -4.36 5.23 1 30 ALA -4.20 1.15 1 31 ILE 1.41 -0.63 1 32 THR 2.45 -1.93 1 33 ASP -2.34 4.06 1 34 ASP -1.25 -0.86 1 35 THR 8.68 -1.99 1 36 ARG 6.98 -2.18 1 37 ILE 3.35 -1.47 1 38 ARG 4.67 -1.53 1 39 ALA 1.04 0.31 1 40 ALA -0.84 0.43 1 41 LEU 8.40 -4.36 1 43 THR 5.38 -1.54 1 44 ILE 5.92 -0.82 1 45 ARG 5.68 -1.66 1 46 TYR 4.34 -0.56 1 47 LEU 4.38 -1.32 1 48 ILE 5.41 -0.63 1 49 GLU 2.99 -1.31 1 50 HIS 2.69 -0.73 1 52 ALA -1.49 0.56 1 53 LYS 0.97 -1.53 1 54 VAL 3.56 -1.33 1 55 ILE -0.96 -0.24 1 56 LEU -4.57 2.11 1 57 ALA -8.11 4.06 1 58 SER -2.35 0.32 1 59 HIS -4.71 4.58 1 60 LEU -0.18 0.95 1 62 ARG -2.80 0.35 1 64 LYS 4.63 -4.89 1 66 LYS -4.23 1.12 1 67 VAL 3.76 -2.75 1 69 GLU 4.66 -1.44 1 70 GLU 3.38 -1.69 1 71 LEU -0.23 -1.77 1 72 ARG 1.09 0.61 1 73 LEU 2.45 -2.16 1 74 ASP 6.25 -1.51 1 75 ALA 4.61 -2.15 1 76 VAL 5.99 -2.24 1 77 ALA 4.70 -1.90 1 78 LYS 4.02 -1.53 1 79 ARG 3.01 -2.95 1 80 LEU 4.95 -2.22 1 82 GLU 2.76 -0.85 1 83 LEU 1.94 -0.41 1 84 LEU -0.83 0.49 1 85 GLU 3.64 -3.43 1 86 ARG -3.70 0.67 1 88 VAL -1.92 0.61 1 89 ALA -1.42 0.11 1 90 LYS -2.35 0.80 1 91 THR -2.14 0.15 1 92 ASN 0.32 -0.34 1 93 GLU -6.57 4.39 1 94 ALA -2.61 1.99 1 95 VAL -6.07 2.68 1 97 ASP 4.63 -0.99 1 98 GLU 4.03 -1.69 1 99 VAL 6.20 -2.30 1 100 LYS 5.67 -1.85 1 101 ALA 3.84 -1.96 1 102 ALA 3.63 -1.70 1 103 VAL 5.60 -2.24 1 104 ASP 2.97 -0.86 1 105 ARG 0.37 -0.43 1 106 LEU 1.28 -0.67 1 107 ASN -3.26 1.15 1 108 GLU 3.63 -0.98 1 110 ASP -2.15 1.79 1 111 VAL -2.75 0.94 1 112 LEU -6.27 3.92 1 113 LEU -4.01 1.79 1 114 LEU -0.94 -0.73 1 116 ASN 1.02 -0.92 1 117 VAL 4.80 -2.36 1 118 ARG 2.22 -0.82 1 119 PHE 0.35 -4.08 1 120 TYR -2.36 -0.69 1 123 GLU 4.38 -2.28 1 124 GLU 2.30 -1.31 1 125 LYS -0.30 -0.82 1 126 ASN 1.61 -2.86 1 129 GLU 3.56 -1.69 1 130 LEU 3.26 -2.42 1 131 ALA 4.90 -2.03 1 132 LYS 4.21 -1.72 1 133 ALA 4.10 -2.28 1 134 PHE 1.31 -1.82 1 135 ALA 2.34 -0.86 1 136 GLU 1.50 -0.59 1 137 LEU 0.09 -0.22 1 138 ALA -7.87 5.61 1 139 ASP -2.73 3.28 1 140 LEU -3.74 3.15 1 141 TYR -4.14 1.44 1 142 VAL -5.08 0.94 1 143 ASN -1.55 -0.66 1 144 ASP -5.63 3.41 1 145 ALA -1.72 -1.44 1 146 PHE 6.35 -1.62 1 148 ALA -2.56 -0.47 1 149 ALA 3.09 -1.18 1 150 HIS 0.65 -0.02 1 151 ARG -0.59 -3.54 1 152 ALA 0.17 -3.32 1 153 HIS -9.71 6.06 1 154 ALA 6.58 -2.35 1 155 SER 3.67 -1.49 1 156 THR -0.47 0.14 1 157 GLU 1.69 1.61 1 159 ILE 4.19 -1.86 1 160 ALA 1.35 -1.18 1 161 HIS 2.24 -1.64 1 162 TYR -1.13 1.70 1 163 LEU -6.62 3.08 1 165 ALA -5.08 3.48 1 166 VAL -6.33 1.52 1 167 ALA -2.22 0.30 1 169 PHE 1.54 -2.40 1 170 LEU 4.73 -2.35 1 171 MET 2.42 0.35 1 172 GLU 2.45 0.31 1 173 LYS 3.81 -1.08 1 174 GLU 5.53 -3.44 1 175 LEU 4.00 -1.96 1 176 GLU 3.27 -0.85 1 177 VAL 5.64 -1.85 1 178 LEU 4.70 -2.29 1 180 LYS 4.11 -1.72 1 181 ALA 3.18 -1.96 1 182 LEU 0.63 -1.19 1 183 SER 4.12 -1.62 1 184 ASN -0.89 -0.99 1 186 ASP 3.28 -3.19 1 187 ARG -1.44 1.19 1 189 PHE -3.37 -0.91 1 190 THR -2.56 1.25 1 191 ALA -5.08 1.60 1 192 ILE -0.61 -1.21 1 193 ILE -2.36 0.86 1 198 VAL -0.80 -1.52 1 200 ASP 0.19 1.34 1 201 LYS 1.18 0.54 1 202 ILE 6.10 -1.79 1 204 VAL 2.38 -2.04 1 205 ILE 5.51 -2.05 1 206 ASP 3.20 0.18 1 207 ASN 2.08 -0.67 1 208 LEU 5.12 -2.48 1 209 LEU 2.79 -1.38 1 210 GLU -0.12 -0.72 1 211 LYS -2.23 2.74 1 212 VAL -0.92 -1.14 1 213 ASP 0.17 2.38 1 214 ASN -5.77 3.67 1 215 LEU -4.20 2.05 1 216 ILE -0.63 -0.76 1 217 ILE -3.77 -0.37 1 221 LEU 3.44 -1.38 1 222 ALA 3.07 -1.57 1 223 TYR 9.46 -4.06 1 224 THR 6.59 -0.89 1 225 PHE 5.58 -1.49 1 226 VAL 6.27 -1.52 1 227 LYS 1.98 -1.47 1 228 ALA 3.01 -1.31 1 229 LEU 0.76 -0.80 1 231 HIS -2.72 1.60 1 232 ASP -0.40 0.63 1 233 VAL -1.39 -1.91 1 235 LYS 1.34 -2.89 1 236 SER 1.20 -0.91 1 237 LEU 2.60 -0.99 1 238 LEU -2.53 1.85 1 239 GLU -1.84 -1.76 1 240 GLU 3.86 -0.98 1 241 ASP 2.17 -1.83 1 242 LYS -2.04 -1.27 1 243 ILE 5.88 -1.66 1 244 GLU 4.56 -2.21 1 245 LEU 3.52 -1.90 1 246 ALA 5.70 -3.25 1 247 LYS 4.99 -1.40 1 248 SER 4.64 -1.81 1 249 PHE 1.77 -3.11 1 250 MET 5.41 -0.81 1 251 GLU 3.63 -1.50 1 252 LYS 4.73 -1.79 1 253 ALA 5.25 -2.22 1 254 LYS 4.33 -1.72 1 255 GLU 2.98 -0.79 1 256 LYS -0.07 -1.08 1 258 VAL -0.94 0.32 1 259 ARG 2.74 -2.11 1 260 PHE -3.45 1.81 1 261 TYR -1.55 1.44 1 262 MET -3.53 0.87 1 264 VAL -0.88 -1.07 1 265 ASP -1.42 -0.55 1 266 VAL -6.21 3.39 1 267 VAL 0.38 -1.14 1 268 VAL -5.71 0.55 1 269 ALA -8.43 5.61 1 270 ASP 2.11 -2.34 1 273 ALA -3.32 2.57 1 275 ASP -0.02 -2.41 1 276 ALA -2.24 1.53 1 277 ASN 1.31 -0.34 1 278 THR -5.39 2.60 1 279 LYS -3.89 2.55 1 280 VAL 0.66 -1.52 1 281 VAL -5.93 0.35 1 283 ILE 1.09 -0.31 1 284 ASP 0.13 -2.02 1 285 ALA -1.96 -0.34 1 286 ILE 1.95 -2.12 1 288 ALA 2.62 -0.79 1 289 ASP 0.92 -1.83 1 290 TYR -3.32 1.70 1 291 SER -3.00 1.10 1 292 ALA 1.50 -2.35 1 293 LEU -0.67 -0.02 1 294 ASP -2.65 1.86 1 295 ILE 0.95 -0.69 1 298 LYS 5.49 -2.76 1 299 THR 7.33 -2.06 1 300 ARG 4.20 -0.49 1 301 GLU 3.44 -0.92 1 302 LEU 3.20 -0.93 1 303 TYR 3.40 -4.12 1 304 ARG 5.87 -2.18 1 305 ASP 5.05 -1.89 1 306 VAL 5.06 -2.17 1 307 ILE 7.12 -2.05 1 308 ARG 4.07 -1.46 1 309 GLU -0.79 -0.40 1 310 SER 0.22 0.39 1 311 LYS -0.34 -0.23 1 312 LEU -1.94 1.60 1 313 VAL -4.04 1.65 1 314 VAL -2.08 0.35 1 315 TRP -7.64 2.68 1 316 ASN -3.22 4.19 1 319 MET -3.86 4.17 1 321 VAL 2.33 -4.50 1 322 PHE 2.73 -1.82 1 323 GLU 5.07 -2.53 1 324 MET -2.48 1.26 1 325 ASP 4.54 -1.12 1 326 ALA 3.40 -2.28 1 327 PHE -0.39 -2.59 1 328 ALA -0.45 0.69 1 329 HIS 3.33 1.02 1 332 LYS 5.81 -1.98 1 333 ALA 3.61 -1.83 1 334 ILE 4.78 -4.19 1 335 ALA 4.35 -1.44 1 336 GLU 3.49 -0.72 1 337 ALA 3.23 -1.64 1 338 LEU 3.33 -1.38 1 339 ALA 1.70 -0.02 1 340 GLU -0.59 -0.40 1 341 ALA 2.23 -3.51 1 342 LEU 3.25 -1.51 1 343 ASP -0.31 -0.28 1 344 THR 0.08 0.21 1 345 TYR 0.27 -0.89 1 346 SER -4.60 1.94 1 347 VAL -2.46 0.29 1 348 ILE -3.83 0.66 1 352 ASP 4.28 -0.66 1 353 SER 7.42 -2.20 1 354 ALA 4.41 -2.28 1 355 ALA 3.42 -1.64 1 356 ALA 6.13 -3.90 1 357 VAL 7.10 -2.56 1 358 GLU 3.06 -1.37 1 359 LYS 4.87 -2.24 1 360 PHE -1.36 -1.36 1 362 LEU -3.12 1.47 1 363 ALA 4.57 -1.12 1 364 ASP 2.44 -2.02 1 365 LYS -0.45 -1.21 1 366 MET -2.13 -1.52 1 367 ASP 5.02 -0.86 1 368 HIS -2.66 4.58 1 369 ILE 0.12 -3.28 1 370 SER -2.33 -0.33 1 371 THR 0.83 0.47 1 375 ALA 3.07 -0.47 1 376 SER 6.80 -1.88 1 377 LEU 3.94 -1.19 1 378 GLU 5.17 -1.95 1 379 PHE 4.31 -0.78 1 380 MET 2.66 0.09 1 381 GLU 1.04 0.96 1 383 LYS -0.24 -0.43 1 384 GLN 0.43 -1.91 1 385 LEU 0.14 -2.93 1 388 VAL 2.94 -0.94 1 389 VAL 4.35 -1.59 1 390 ALA 0.68 -0.66 1 391 LEU -0.16 -1.32 1 392 GLU 0.02 0.76 1 393 ASP 0.27 0.24 1 394 LYS 2.82 -0.43 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16464_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.71 _LACS_plot.Line_1_terminator_val_y_1 -4.09 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.54 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.06 _LACS_plot.Line_2_terminator_val_x_2 9.45 _LACS_plot.Line_2_terminator_val_y_2 3.15 _LACS_plot.Y_axis_chem_shift_offset 0.29 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 153 HIS -9.71 2.54 0 10 ASP -1.00 0.94 1 11 VAL -0.11 -0.65 1 12 ARG 4.61 2.53 1 14 LYS -1.22 -0.62 1 15 ARG 0.89 -0.03 1 16 VAL -1.61 -3.17 1 17 PHE -0.50 -2.72 1 19 ARG -3.74 -2.52 1 20 VAL -6.38 -0.55 1 22 PHE -2.44 -1.55 1 23 ASN 2.12 1.25 1 24 VAL -0.83 -3.54 1 26 MET -2.61 0.20 1 27 GLU -4.36 -0.20 1 30 ALA -4.20 -1.40 1 31 ILE 1.41 1.59 1 32 THR 2.45 0.81 1 33 ASP -2.34 -1.16 1 34 ASP -1.25 0.48 1 35 THR 8.68 1.67 1 36 ARG 6.98 2.72 1 37 ILE 3.35 0.93 1 38 ARG 4.67 3.84 1 39 ALA 1.04 0.38 1 40 ALA -0.84 -0.47 1 41 LEU 8.40 -1.85 1 43 THR 5.38 0.72 1 44 ILE 5.92 1.26 1 45 ARG 5.68 2.11 1 46 TYR 4.34 3.21 1 47 LEU 4.38 0.57 1 48 ILE 5.41 3.83 1 49 GLU 2.99 1.39 1 50 HIS 2.69 -0.27 1 52 ALA -1.49 -0.56 1 53 LYS 0.97 -1.60 1 54 VAL 3.56 -3.78 1 55 ILE -0.96 -2.15 1 56 LEU -4.57 -2.84 1 57 ALA -8.11 -1.86 1 58 SER -2.35 -1.28 1 59 HIS -4.71 0.24 1 60 LEU -0.18 -1.71 1 62 ARG -2.80 -2.37 1 64 LYS 4.63 1.01 1 66 LYS -4.23 -2.91 1 67 VAL 3.76 -0.23 1 69 GLU 4.66 2.37 1 70 GLU 3.38 -0.06 1 71 LEU -0.23 -1.57 1 72 ARG 1.09 3.51 1 73 LEU 2.45 -0.36 1 74 ASP 6.25 1.55 1 75 ALA 4.61 3.55 1 76 VAL 5.99 0.29 1 77 ALA 4.70 1.68 1 78 LYS 4.02 2.65 1 79 ARG 3.01 1.60 1 80 LEU 4.95 0.67 1 82 GLU 2.76 3.35 1 83 LEU 1.94 1.79 1 84 LEU -0.83 -0.96 1 85 GLU 3.64 -1.34 1 86 ARG -3.70 -3.78 1 88 VAL -1.92 -0.74 1 89 ALA -1.42 -2.61 1 90 LYS -2.35 0.17 1 91 THR -2.14 -0.83 1 92 ASN 0.32 -0.72 1 93 GLU -6.57 -1.04 1 94 ALA -2.61 -5.00 1 95 VAL -6.07 -0.22 1 97 ASP 4.63 2.97 1 98 GLU 4.03 3.17 1 99 VAL 6.20 1.13 1 100 LYS 5.67 2.09 1 101 ALA 3.84 2.01 1 102 ALA 3.63 3.22 1 103 VAL 5.60 2.90 1 104 ASP 2.97 0.90 1 105 ARG 0.37 0.85 1 106 LEU 1.28 -0.88 1 107 ASN -3.26 0.03 1 108 GLU 3.63 1.25 1 110 ASP -2.15 -1.91 1 111 VAL -2.75 -2.24 1 112 LEU -6.27 -4.94 1 113 LEU -4.01 -3.34 1 114 LEU -0.94 -0.31 1 116 ASN 1.02 2.51 1 117 VAL 4.80 1.13 1 118 ARG 2.22 -0.36 1 119 PHE 0.35 -2.20 1 120 TYR -2.36 0.03 1 123 GLU 4.38 3.87 1 124 GLU 2.30 -0.58 1 125 LYS -0.30 -0.20 1 126 ASN 1.61 -0.38 1 129 GLU 3.56 3.07 1 130 LEU 3.26 -0.44 1 131 ALA 4.90 0.84 1 132 LYS 4.21 1.34 1 133 ALA 4.10 3.22 1 134 PHE 1.31 1.91 1 135 ALA 2.34 1.45 1 136 GLU 1.50 1.24 1 137 LEU 0.09 -2.00 1 138 ALA -7.87 -4.71 1 139 ASP -2.73 -0.18 1 140 LEU -3.74 -5.46 1 141 TYR -4.14 -3.47 1 142 VAL -5.08 -3.12 1 143 ASN -1.55 -0.57 1 144 ASP -5.63 1.74 1 145 ALA -1.72 -0.04 1 146 PHE 6.35 1.30 1 148 ALA -2.56 0.24 1 149 ALA 3.09 -1.30 1 150 HIS 0.65 0.38 1 151 ARG -0.59 -1.58 1 152 ALA 0.17 -4.99 1 154 ALA 6.58 1.96 1 155 SER 3.67 0.50 1 156 THR -0.47 -1.42 1 157 GLU 1.69 0.78 1 159 ILE 4.19 -1.59 1 160 ALA 1.35 -1.21 1 161 HIS 2.24 1.13 1 162 TYR -1.13 -1.51 1 163 LEU -6.62 -4.10 1 165 ALA -5.08 -2.05 1 166 VAL -6.33 -2.71 1 167 ALA -2.22 0.89 1 169 PHE 1.54 3.87 1 170 LEU 4.73 0.58 1 171 MET 2.42 0.76 1 172 GLU 2.45 0.22 1 173 LYS 3.81 1.58 1 174 GLU 5.53 1.85 1 175 LEU 4.00 3.70 1 176 GLU 3.27 2.65 1 177 VAL 5.64 3.42 1 178 LEU 4.70 1.65 1 180 LYS 4.11 2.08 1 181 ALA 3.18 0.42 1 182 LEU 0.63 0.29 1 183 SER 4.12 0.26 1 184 ASN -0.89 -3.65 1 186 ASP 3.28 -0.32 1 187 ARG -1.44 -0.04 1 189 PHE -3.37 -0.94 1 190 THR -2.56 -2.51 1 191 ALA -5.08 -3.08 1 192 ILE -0.61 -1.58 1 193 ILE -2.36 -0.84 1 200 ASP 0.19 1.45 1 201 LYS 1.18 0.88 1 202 ILE 6.10 -0.42 1 204 VAL 2.38 0.00 1 205 ILE 5.51 -1.12 1 206 ASP 3.20 1.92 1 207 ASN 2.08 4.71 1 208 LEU 5.12 2.27 1 209 LEU 2.79 -1.90 1 210 GLU -0.12 0.32 1 211 LYS -2.23 -0.11 1 212 VAL -0.92 -2.09 1 213 ASP 0.17 -0.36 1 214 ASN -5.77 -2.31 1 215 LEU -4.20 -4.42 1 216 ILE -0.63 -2.66 1 217 ILE -3.77 0.52 1 221 LEU 3.44 -1.44 1 222 ALA 3.07 1.31 1 223 TYR 9.46 0.41 1 224 THR 6.59 0.45 1 225 PHE 5.58 1.12 1 226 VAL 6.27 1.74 1 227 LYS 1.98 4.61 1 228 ALA 3.01 0.80 1 229 LEU 0.76 -0.59 1 231 HIS -2.72 -0.12 1 232 ASP -0.40 0.94 1 233 VAL -1.39 0.80 1 235 LYS 1.34 -0.01 1 236 SER 1.20 -2.78 1 237 LEU 2.60 -1.06 1 238 LEU -2.53 -2.74 1 239 GLU -1.84 -0.25 1 240 GLU 3.86 1.30 1 241 ASP 2.17 0.89 1 242 LYS -2.04 -0.99 1 243 ILE 5.88 0.89 1 244 GLU 4.56 3.02 1 245 LEU 3.52 0.49 1 246 ALA 5.70 1.82 1 247 LYS 4.99 2.70 1 248 SER 4.64 3.16 1 249 PHE 1.77 2.37 1 250 MET 5.41 2.86 1 251 GLU 3.63 2.33 1 252 LYS 4.73 1.76 1 253 ALA 5.25 0.94 1 254 LYS 4.33 3.54 1 255 GLU 2.98 2.23 1 256 LYS -0.07 0.41 1 258 VAL -0.94 -0.04 1 259 ARG 2.74 -3.40 1 260 PHE -3.45 -1.46 1 261 TYR -1.55 -3.56 1 262 MET -3.53 -3.50 1 264 VAL -0.88 0.20 1 265 ASP -1.42 -1.39 1 266 VAL -6.21 -2.94 1 267 VAL 0.38 0.01 1 268 VAL -5.71 -2.09 1 269 ALA -8.43 -0.05 1 270 ASP 2.11 -1.45 1 273 ALA -3.32 -0.79 1 275 ASP -0.02 -0.84 1 276 ALA -2.24 0.00 1 277 ASN 1.31 0.03 1 278 THR -5.39 0.20 1 279 LYS -3.89 -2.58 1 280 VAL 0.66 0.43 1 281 VAL -5.93 -3.40 1 283 ILE 1.09 -2.85 1 284 ASP 0.13 -0.50 1 285 ALA -1.96 -1.26 1 286 ILE 1.95 -1.91 1 288 ALA 2.62 0.42 1 289 ASP 0.92 -0.88 1 290 TYR -3.32 -1.33 1 291 SER -3.00 -1.27 1 292 ALA 1.50 -1.63 1 293 LEU -0.67 -2.46 1 294 ASP -2.65 0.33 1 295 ILE 0.95 0.28 1 298 LYS 5.49 3.96 1 299 THR 7.33 0.36 1 300 ARG 4.20 1.36 1 301 GLU 3.44 1.01 1 302 LEU 3.20 1.37 1 303 TYR 3.40 2.32 1 304 ARG 5.87 1.13 1 305 ASP 5.05 2.11 1 306 VAL 5.06 3.93 1 307 ILE 7.12 0.98 1 308 ARG 4.07 1.36 1 309 GLU -0.79 0.13 1 310 SER 0.22 -1.70 1 311 LYS -0.34 -0.06 1 312 LEU -1.94 -2.88 1 313 VAL -4.04 -2.24 1 314 VAL -2.08 -2.03 1 315 TRP -7.64 -1.70 1 316 ASN -3.22 -2.30 1 319 MET -3.86 -2.33 1 321 VAL 2.33 -1.86 1 322 PHE 2.73 -2.76 1 323 GLU 5.07 0.77 1 324 MET -2.48 -0.83 1 325 ASP 4.54 1.92 1 326 ALA 3.40 0.89 1 327 PHE -0.39 -0.80 1 328 ALA -0.45 -0.18 1 329 HIS 3.33 5.20 1 332 LYS 5.81 0.46 1 333 ALA 3.61 2.57 1 334 ILE 4.78 0.28 1 335 ALA 4.35 1.17 1 336 GLU 3.49 1.86 1 337 ALA 3.23 2.25 1 338 LEU 3.33 1.23 1 339 ALA 1.70 1.31 1 340 GLU -0.59 -0.76 1 341 ALA 2.23 -0.60 1 342 LEU 3.25 0.80 1 343 ASP -0.31 -1.54 1 344 THR 0.08 -2.04 1 345 TYR 0.27 -1.65 1 346 SER -4.60 -1.61 1 347 VAL -2.46 -1.39 1 348 ILE -3.83 -1.53 1 352 ASP 4.28 2.01 1 353 SER 7.42 0.31 1 354 ALA 4.41 1.07 1 355 ALA 3.42 2.20 1 356 ALA 6.13 -1.02 1 357 VAL 7.10 1.92 1 358 GLU 3.06 3.87 1 359 LYS 4.87 2.18 1 360 PHE -1.36 0.18 1 362 LEU -3.12 -0.27 1 363 ALA 4.57 1.13 1 364 ASP 2.44 0.38 1 365 LYS -0.45 -0.48 1 366 MET -2.13 0.38 1 367 ASP 5.02 1.08 1 368 HIS -2.66 -1.25 1 369 ILE 0.12 -1.22 1 370 SER -2.33 1.76 1 371 THR 0.83 0.21 1 375 ALA 3.07 1.54 1 376 SER 6.80 1.99 1 377 LEU 3.94 0.95 1 378 GLU 5.17 2.42 1 379 PHE 4.31 4.48 1 380 MET 2.66 0.33 1 383 LYS -0.24 -0.44 1 384 GLN 0.43 -0.11 1 388 VAL 2.94 1.88 1 389 VAL 4.35 0.33 1 390 ALA 0.68 -0.84 1 391 LEU -0.16 -0.17 1 392 GLU 0.02 0.18 1 393 ASP 0.27 -0.04 1 394 LYS 2.82 4.89 1 stop_ save_