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 bmr16447_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -9.74 _LACS_plot.Line_1_terminator_val_y_1 -4.31 _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 -2.37 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 5.96 _LACS_plot.Y_axis_chem_shift_offset 0.83 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 368 HIS -3.47 1.94 0 22 PHE -3.81 -7.02 0 10 ASP -0.84 -1.32 1 11 VAL -0.02 -1.61 1 12 ARG 4.86 2.46 1 14 LYS -1.08 -1.78 1 15 ARG 0.76 -0.86 1 16 VAL -1.48 -1.52 1 17 PHE -0.99 -1.53 1 19 ARG -3.42 -2.27 1 20 VAL -6.11 -4.06 1 21 ASP -1.92 -2.88 1 23 ASN 2.48 -0.70 1 24 VAL -1.15 -4.40 1 26 MET -5.75 -1.42 1 27 GLU -3.05 -0.89 1 30 ALA -4.14 -3.03 1 31 ILE 1.32 0.59 1 32 THR 2.39 0.45 1 33 ASP -0.75 -0.21 1 34 ASP -0.68 -1.69 1 35 THR 8.60 6.79 1 36 ARG 5.64 3.77 1 37 ILE 4.76 2.76 1 38 ARG 5.14 3.23 1 39 ALA 2.64 1.35 1 40 ALA -0.77 -0.18 1 41 LEU 8.35 4.02 1 43 THR 5.37 4.14 1 44 ILE 5.92 5.18 1 45 ARG 5.55 3.92 1 46 TYR 4.48 3.98 1 47 LEU 4.39 3.04 1 48 ILE 5.58 4.85 1 49 GLU 3.11 1.68 1 50 HIS 2.85 2.07 1 52 ALA -1.52 -0.95 1 53 LYS 0.95 -0.58 1 54 VAL 3.55 2.24 1 55 ILE -1.13 -1.09 1 56 LEU -4.10 -2.45 1 57 ALA -7.84 -4.14 1 58 SER -2.81 -1.93 1 59 HIS -4.98 -0.06 1 60 LEU -1.68 0.16 1 62 ARG -2.17 -2.81 1 64 LYS 4.25 -0.36 1 66 LYS -4.10 -3.01 1 67 VAL 3.78 0.92 1 68 VAL -2.22 -1.43 1 69 GLU 4.93 3.31 1 70 GLU 3.34 1.67 1 71 LEU -0.39 -2.14 1 72 ARG 1.05 1.71 1 73 LEU 2.70 0.18 1 74 ASP 6.22 4.73 1 75 ALA 4.51 2.44 1 76 VAL 6.23 3.65 1 77 ALA 4.58 2.78 1 78 LYS 4.03 2.49 1 79 ARG 3.00 0.06 1 80 LEU 4.99 2.71 1 82 GLU 2.88 1.97 1 83 LEU 2.13 1.60 1 84 LEU -0.61 -0.26 1 85 GLU 3.72 0.23 1 86 ARG -3.56 -2.94 1 88 VAL -1.79 -1.30 1 89 ALA -1.35 -1.30 1 90 LYS -1.97 -1.38 1 91 THR -2.21 -2.10 1 92 ASN 0.46 -0.12 1 93 GLU -6.57 -2.31 1 94 ALA -2.54 -0.66 1 95 VAL -6.18 -3.40 1 99 VAL 6.32 3.96 1 100 LYS 5.66 3.83 1 101 ALA 3.89 1.88 1 102 ALA 3.73 1.99 1 103 VAL 5.61 3.45 1 104 ASP 3.12 2.17 1 105 ARG 0.39 -0.04 1 106 LEU 1.37 0.63 1 107 ASN -3.32 -2.13 1 108 GLU 3.69 2.74 1 110 ASP -2.08 -0.45 1 111 VAL -2.83 -1.83 1 112 LEU -5.98 -2.26 1 113 LEU -3.73 -2.10 1 114 LEU -0.95 -1.68 1 115 GLU -0.78 -1.99 1 116 ASN 1.01 0.19 1 117 VAL 5.11 2.80 1 118 ARG 3.06 1.40 1 119 PHE 0.09 -3.52 1 120 TYR -1.93 -2.96 1 123 GLU 4.67 2.21 1 124 GLU 2.88 1.22 1 125 LYS -0.18 -0.95 1 126 ASN 1.47 -1.22 1 127 ASP -3.61 -2.24 1 129 GLU 3.55 1.87 1 130 LEU 3.17 0.86 1 131 ALA 4.91 2.88 1 132 LYS 4.19 2.42 1 133 ALA 4.08 1.82 1 134 PHE 1.28 -0.79 1 135 ALA 2.19 1.47 1 136 GLU 1.63 0.98 1 137 LEU 0.09 -0.23 1 138 ALA -7.53 -2.28 1 139 ASP -2.94 0.45 1 140 LEU -3.75 -0.58 1 141 TYR -4.11 -2.76 1 142 VAL -4.87 -4.13 1 143 ASN -2.00 -2.34 1 144 ASP -4.41 -1.98 1 145 ALA -2.58 -3.61 1 146 PHE 5.34 4.54 1 148 ALA -2.50 -2.20 1 149 ALA 1.84 0.82 1 150 HIS 1.42 1.40 1 151 ARG -2.58 -3.94 1 152 ALA 0.81 -2.07 1 153 HIS -9.74 -3.81 1 154 ALA 7.53 4.77 1 155 SER 3.39 2.47 1 156 THR -1.40 -0.33 1 157 GLU 2.76 3.96 1 159 ILE 4.11 2.24 1 160 ALA 1.16 -0.06 1 161 HIS 2.49 0.92 1 162 TYR -1.39 0.44 1 163 LEU -6.58 -3.69 1 165 ALA -5.48 -1.86 1 166 VAL -6.25 -4.72 1 167 ALA -1.99 -1.71 1 169 PHE 2.41 0.34 1 170 LEU 4.46 2.91 1 171 MET 2.29 2.21 1 172 GLU 3.06 2.62 1 173 LYS 4.20 2.41 1 174 GLU 5.02 2.32 1 175 LEU 4.12 1.86 1 176 GLU 2.94 2.31 1 177 VAL 5.35 3.77 1 178 LEU 5.23 2.39 1 180 LYS 5.23 3.16 1 181 ALA 4.61 1.78 1 182 LEU 0.72 -0.27 1 183 SER 0.67 1.06 1 184 ASN -0.84 -1.35 1 186 ASP -0.20 0.11 1 187 ARG -2.58 -2.68 1 189 PHE -3.78 -4.60 1 190 THR -2.45 -1.35 1 191 ALA -6.34 -3.42 1 192 ILE -0.25 -1.44 1 193 ILE -2.03 -3.82 1 197 LYS -3.41 -2.34 1 198 VAL 4.54 2.95 1 199 LYS 4.81 3.28 1 200 ASP 1.61 1.18 1 201 LYS -3.06 -3.32 1 202 ILE 5.95 4.67 1 204 VAL 5.11 2.97 1 205 ILE 7.45 5.40 1 206 ASP 2.89 3.48 1 207 ASN 2.39 3.06 1 208 LEU 5.30 1.95 1 209 LEU 3.78 2.82 1 210 GLU 0.38 -0.24 1 211 LYS -3.38 -0.04 1 212 VAL -0.58 -1.42 1 213 ASP 0.56 2.72 1 214 ASN -5.29 -1.99 1 215 LEU -3.63 -1.82 1 216 ILE -1.03 -1.52 1 217 ILE -5.79 -3.69 1 221 LEU 3.65 2.13 1 222 ALA 3.72 1.24 1 223 TYR 8.23 3.87 1 224 THR 7.13 5.71 1 225 PHE 5.37 3.52 1 226 VAL 6.01 4.62 1 227 LYS 2.19 0.64 1 228 ALA 3.14 1.69 1 229 LEU 0.91 -0.05 1 231 HIS -2.12 -0.62 1 232 ASP -0.42 0.19 1 233 VAL -0.91 -3.28 1 235 LYS 0.84 -1.46 1 236 SER 2.12 0.92 1 237 LEU 2.80 1.08 1 238 LEU -3.59 -1.47 1 239 GLU -1.37 -2.00 1 240 GLU 3.93 3.00 1 241 ASP 2.15 -0.05 1 242 LYS -0.97 -2.46 1 243 ILE 6.18 4.12 1 244 GLU 4.65 2.42 1 245 LEU 3.78 1.70 1 246 ALA 6.87 2.78 1 247 LYS 5.31 3.69 1 248 SER 4.27 3.04 1 249 PHE 3.09 1.02 1 250 MET 5.47 4.61 1 251 GLU 3.62 2.23 1 252 LYS 4.73 2.92 1 253 ALA 5.13 2.80 1 254 LYS 4.71 2.91 1 255 GLU 3.10 2.22 1 256 LYS -0.07 -1.03 1 258 VAL -0.84 -0.62 1 259 ARG 2.63 0.49 1 260 PHE -3.58 -1.77 1 261 TYR -1.98 -0.18 1 262 MET -3.85 -2.54 1 264 VAL -0.89 -2.16 1 265 ASP -1.10 -1.79 1 266 VAL -6.04 -2.74 1 267 VAL 0.80 -0.55 1 268 VAL -5.85 -5.38 1 269 ALA -8.43 -2.72 1 270 ASP 2.08 -0.25 1 271 ARG -3.01 -1.81 1 273 ALA -3.55 -0.96 1 275 ASP 0.14 -2.35 1 276 ALA -2.23 -0.64 1 277 ASN 1.21 0.88 1 278 THR -5.40 -2.77 1 279 LYS -3.96 -1.39 1 280 VAL 0.36 -0.96 1 281 VAL -5.58 -5.58 1 283 ILE -0.22 -0.22 1 284 ASP -0.20 -2.01 1 285 ALA -1.86 -2.30 1 286 ILE 1.90 -0.11 1 288 ALA 2.74 2.00 1 289 ASP 1.09 -0.69 1 290 TYR -3.15 -1.30 1 291 SER -2.86 -1.92 1 292 ALA 1.84 -0.73 1 293 LEU -1.83 -0.47 1 294 ASP -2.59 -0.79 1 295 ILE 1.09 0.55 1 298 LYS 5.46 2.62 1 299 THR 7.47 5.29 1 300 ARG 4.37 3.77 1 301 GLU 3.53 2.62 1 302 LEU 3.39 2.36 1 303 TYR 4.11 -0.54 1 304 ARG 5.77 3.57 1 305 ASP 5.23 3.19 1 306 VAL 5.58 3.23 1 307 ILE 7.42 5.40 1 308 ARG 4.09 2.71 1 309 GLU -0.39 -1.01 1 310 SER 0.17 0.27 1 311 LYS -0.17 -0.39 1 312 LEU -2.55 -0.57 1 313 VAL -4.61 -2.84 1 314 VAL -3.13 -2.60 1 315 TRP -5.94 -4.51 1 316 ASN -1.66 -0.44 1 319 MET -5.10 -1.24 1 321 VAL 3.29 -0.64 1 322 PHE 2.78 1.23 1 323 GLU 3.66 1.49 1 324 MET -1.96 -0.91 1 325 ASP 4.51 3.50 1 326 ALA 3.22 1.15 1 327 PHE -0.59 -2.64 1 328 ALA -0.81 0.01 1 329 HIS 3.57 4.56 1 332 LYS 5.48 3.49 1 333 ALA 3.96 1.68 1 334 ILE 4.80 0.44 1 335 ALA 3.86 2.64 1 336 GLU 3.36 2.65 1 337 ALA 3.07 1.56 1 338 LEU 3.65 1.92 1 339 ALA 2.00 1.84 1 340 GLU -0.46 -0.83 1 341 ALA 1.97 -1.40 1 342 LEU 3.61 2.12 1 343 ASP -0.24 -0.45 1 344 THR 0.22 0.28 1 345 TYR -0.12 -0.64 1 346 SER -3.85 -2.38 1 347 VAL -1.13 -1.64 1 348 ILE -0.58 -3.39 1 354 ALA 4.30 2.32 1 355 ALA 3.80 1.80 1 356 ALA 5.04 1.99 1 357 VAL 6.95 4.55 1 358 GLU 3.10 1.90 1 359 LYS 4.56 2.49 1 360 PHE -0.86 -2.41 1 362 LEU -3.05 -1.68 1 363 ALA 4.70 3.45 1 364 ASP 2.68 0.64 1 365 LYS -0.54 -1.79 1 366 MET -2.86 -3.66 1 367 ASP 4.71 3.95 1 369 ILE 0.23 -1.32 1 370 SER -0.17 -0.32 1 371 THR 0.64 0.47 1 375 ALA 3.53 2.57 1 376 SER 5.04 3.69 1 377 LEU 4.82 3.06 1 378 GLU 5.12 3.21 1 379 PHE 4.10 3.62 1 380 MET 3.74 2.65 1 381 GLU 0.43 0.33 1 383 LYS 0.71 -0.27 1 384 GLN -0.19 -2.20 1 385 LEU 0.89 -2.22 1 388 VAL 4.30 2.76 1 389 VAL 4.28 2.45 1 390 ALA 0.64 -0.08 1 391 LEU 0.11 -1.14 1 392 GLU 0.20 0.83 1 393 ASP -0.01 0.31 1 394 LYS 2.65 2.40 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16447_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -9.74 _LACS_plot.Line_1_terminator_val_y_1 5.43 _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 -0.37 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 -2.64 _LACS_plot.Y_axis_chem_shift_offset 0.83 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 368 HIS -3.47 5.41 0 22 PHE -3.81 -3.21 0 10 ASP -0.84 -0.48 1 11 VAL -0.02 -1.59 1 12 ARG 4.86 -2.40 1 14 LYS -1.08 -0.70 1 15 ARG 0.76 -1.62 1 16 VAL -1.48 -0.04 1 17 PHE -0.99 -0.54 1 19 ARG -3.42 1.15 1 20 VAL -6.11 2.05 1 21 ASP -1.92 -0.96 1 23 ASN 2.48 -3.18 1 24 VAL -1.15 -3.25 1 26 MET -5.75 4.33 1 27 GLU -3.05 2.16 1 30 ALA -4.14 1.11 1 31 ILE 1.32 -0.73 1 32 THR 2.39 -1.94 1 33 ASP -0.75 0.54 1 34 ASP -0.68 -1.01 1 35 THR 8.60 -1.81 1 36 ARG 5.64 -1.87 1 37 ILE 4.76 -2.00 1 38 ARG 5.14 -1.91 1 39 ALA 2.64 -1.29 1 40 ALA -0.77 0.59 1 41 LEU 8.35 -4.33 1 43 THR 5.37 -1.23 1 44 ILE 5.92 -0.74 1 45 ARG 5.55 -1.63 1 46 TYR 4.48 -0.50 1 47 LEU 4.39 -1.35 1 48 ILE 5.58 -0.73 1 49 GLU 3.11 -1.43 1 50 HIS 2.85 -0.78 1 52 ALA -1.52 0.57 1 53 LYS 0.95 -1.53 1 54 VAL 3.55 -1.31 1 55 ILE -1.13 0.04 1 56 LEU -4.10 1.65 1 57 ALA -7.84 3.70 1 58 SER -2.81 0.88 1 59 HIS -4.98 4.92 1 60 LEU -1.68 1.84 1 62 ARG -2.17 -0.64 1 64 LYS 4.25 -4.61 1 66 LYS -4.10 1.09 1 67 VAL 3.78 -2.86 1 68 VAL -2.22 0.79 1 69 GLU 4.93 -1.62 1 70 GLU 3.34 -1.67 1 71 LEU -0.39 -1.75 1 72 ARG 1.05 0.66 1 73 LEU 2.70 -2.52 1 74 ASP 6.22 -1.49 1 75 ALA 4.51 -2.07 1 76 VAL 6.23 -2.58 1 77 ALA 4.58 -1.80 1 78 LYS 4.03 -1.54 1 79 ARG 3.00 -2.94 1 80 LEU 4.99 -2.28 1 82 GLU 2.88 -0.91 1 83 LEU 2.13 -0.53 1 84 LEU -0.61 0.35 1 85 GLU 3.72 -3.49 1 86 ARG -3.56 0.62 1 88 VAL -1.79 0.49 1 89 ALA -1.35 0.05 1 90 LYS -1.97 0.59 1 91 THR -2.21 0.11 1 92 ASN 0.46 -0.58 1 93 GLU -6.57 4.26 1 94 ALA -2.54 1.88 1 95 VAL -6.18 2.78 1 99 VAL 6.32 -2.36 1 100 LYS 5.66 -1.83 1 101 ALA 3.89 -2.01 1 102 ALA 3.73 -1.74 1 103 VAL 5.61 -2.16 1 104 ASP 3.12 -0.95 1 105 ARG 0.39 -0.43 1 106 LEU 1.37 -0.74 1 107 ASN -3.32 1.19 1 108 GLU 3.69 -0.95 1 110 ASP -2.08 1.63 1 111 VAL -2.83 1.00 1 112 LEU -5.98 3.72 1 113 LEU -3.73 1.63 1 114 LEU -0.95 -0.73 1 115 GLU -0.78 -1.21 1 116 ASN 1.01 -0.82 1 117 VAL 5.11 -2.31 1 118 ARG 3.06 -1.66 1 119 PHE 0.09 -3.61 1 120 TYR -1.93 -1.03 1 123 GLU 4.67 -2.46 1 124 GLU 2.88 -1.66 1 125 LYS -0.18 -0.77 1 126 ASN 1.47 -2.69 1 127 ASP -3.61 1.37 1 129 GLU 3.55 -1.68 1 130 LEU 3.17 -2.31 1 131 ALA 4.91 -2.03 1 132 LYS 4.19 -1.77 1 133 ALA 4.08 -2.26 1 134 PHE 1.28 -2.07 1 135 ALA 2.19 -0.72 1 136 GLU 1.63 -0.65 1 137 LEU 0.09 -0.32 1 138 ALA -7.53 5.25 1 139 ASP -2.94 3.39 1 140 LEU -3.75 3.17 1 141 TYR -4.11 1.35 1 142 VAL -4.87 0.74 1 143 ASN -2.00 -0.34 1 144 ASP -4.41 2.43 1 145 ALA -2.58 -1.03 1 146 PHE 5.34 -0.80 1 148 ALA -2.50 0.30 1 149 ALA 1.84 -1.02 1 150 HIS 1.42 -0.02 1 151 ARG -2.58 -1.36 1 152 ALA 0.81 -2.88 1 153 HIS -9.74 5.93 1 154 ALA 7.53 -2.76 1 155 SER 3.39 -0.92 1 156 THR -1.40 1.07 1 157 GLU 2.76 1.20 1 159 ILE 4.11 -1.87 1 160 ALA 1.16 -1.22 1 161 HIS 2.49 -1.57 1 162 TYR -1.39 1.83 1 163 LEU -6.58 2.89 1 165 ALA -5.48 3.62 1 166 VAL -6.25 1.53 1 167 ALA -1.99 0.28 1 169 PHE 2.41 -2.07 1 170 LEU 4.46 -1.55 1 171 MET 2.29 -0.08 1 172 GLU 3.06 -0.44 1 173 LYS 4.20 -1.79 1 174 GLU 5.02 -2.70 1 175 LEU 4.12 -2.26 1 176 GLU 2.94 -0.63 1 177 VAL 5.35 -1.58 1 178 LEU 5.23 -2.84 1 180 LYS 5.23 -2.07 1 181 ALA 4.61 -2.83 1 182 LEU 0.72 -0.99 1 183 SER 0.67 0.39 1 184 ASN -0.84 -0.51 1 186 ASP -0.20 0.31 1 187 ARG -2.58 -0.10 1 189 PHE -3.78 -0.82 1 190 THR -2.45 1.10 1 191 ALA -6.34 2.92 1 192 ILE -0.25 -1.19 1 193 ILE -2.03 -1.79 1 197 LYS -3.41 1.07 1 198 VAL 4.54 -1.59 1 199 LYS 4.81 -1.53 1 200 ASP 1.61 -0.43 1 201 LYS -3.06 -0.26 1 202 ILE 5.95 -1.28 1 204 VAL 5.11 -2.14 1 205 ILE 7.45 -2.05 1 206 ASP 2.89 0.59 1 207 ASN 2.39 0.67 1 208 LEU 5.30 -3.35 1 209 LEU 3.78 -0.96 1 210 GLU 0.38 -0.62 1 211 LYS -3.38 3.34 1 212 VAL -0.58 -0.84 1 213 ASP 0.56 2.16 1 214 ASN -5.29 3.30 1 215 LEU -3.63 1.81 1 216 ILE -1.03 -0.49 1 217 ILE -5.79 2.10 1 221 LEU 3.65 -1.52 1 222 ALA 3.72 -2.48 1 223 TYR 8.23 -4.36 1 224 THR 7.13 -1.42 1 225 PHE 5.37 -1.85 1 226 VAL 6.01 -1.39 1 227 LYS 2.19 -1.55 1 228 ALA 3.14 -1.45 1 229 LEU 0.91 -0.96 1 231 HIS -2.12 1.50 1 232 ASP -0.42 0.61 1 233 VAL -0.91 -2.37 1 235 LYS 0.84 -2.30 1 236 SER 2.12 -1.20 1 237 LEU 2.80 -1.72 1 238 LEU -3.59 2.12 1 239 GLU -1.37 -0.63 1 240 GLU 3.93 -0.93 1 241 ASP 2.15 -2.20 1 242 LYS -0.97 -1.49 1 243 ILE 6.18 -2.06 1 244 GLU 4.65 -2.23 1 245 LEU 3.78 -2.08 1 246 ALA 6.87 -4.09 1 247 LYS 5.31 -1.62 1 248 SER 4.27 -1.23 1 249 PHE 3.09 -2.07 1 250 MET 5.47 -0.86 1 251 GLU 3.62 -1.39 1 252 LYS 4.73 -1.81 1 253 ALA 5.13 -2.33 1 254 LYS 4.71 -1.80 1 255 GLU 3.10 -0.88 1 256 LYS -0.07 -0.96 1 258 VAL -0.84 0.22 1 259 ARG 2.63 -2.14 1 260 PHE -3.58 1.81 1 261 TYR -1.98 1.80 1 262 MET -3.85 1.31 1 264 VAL -0.89 -1.27 1 265 ASP -1.10 -0.69 1 266 VAL -6.04 3.30 1 267 VAL 0.80 -1.35 1 268 VAL -5.85 0.47 1 269 ALA -8.43 5.71 1 270 ASP 2.08 -2.33 1 271 ARG -3.01 1.20 1 273 ALA -3.55 2.59 1 275 ASP 0.14 -2.49 1 276 ALA -2.23 1.59 1 277 ASN 1.21 -0.33 1 278 THR -5.40 2.63 1 279 LYS -3.96 2.57 1 280 VAL 0.36 -1.32 1 281 VAL -5.58 0.00 1 283 ILE -0.22 0.00 1 284 ASP -0.20 -1.81 1 285 ALA -1.86 -0.44 1 286 ILE 1.90 -2.01 1 288 ALA 2.74 -0.74 1 289 ASP 1.09 -1.78 1 290 TYR -3.15 1.85 1 291 SER -2.86 0.94 1 292 ALA 1.84 -2.57 1 293 LEU -1.83 1.36 1 294 ASP -2.59 1.80 1 295 ILE 1.09 -0.54 1 298 LYS 5.46 -2.84 1 299 THR 7.47 -2.18 1 300 ARG 4.37 -0.60 1 301 GLU 3.53 -0.91 1 302 LEU 3.39 -1.03 1 303 TYR 4.11 -4.65 1 304 ARG 5.77 -2.20 1 305 ASP 5.23 -2.04 1 306 VAL 5.58 -2.35 1 307 ILE 7.42 -2.02 1 308 ARG 4.09 -1.38 1 309 GLU -0.39 -0.62 1 310 SER 0.17 0.10 1 311 LYS -0.17 -0.22 1 312 LEU -2.55 1.98 1 313 VAL -4.61 1.77 1 314 VAL -3.13 0.53 1 315 TRP -5.94 1.43 1 316 ASN -1.66 1.22 1 319 MET -5.10 3.86 1 321 VAL 3.29 -3.93 1 322 PHE 2.78 -1.55 1 323 GLU 3.66 -2.17 1 324 MET -1.96 1.05 1 325 ASP 4.51 -1.01 1 326 ALA 3.22 -2.07 1 327 PHE -0.59 -2.05 1 328 ALA -0.81 0.82 1 329 HIS 3.57 0.99 1 332 LYS 5.48 -1.99 1 333 ALA 3.96 -2.28 1 334 ILE 4.80 -4.36 1 335 ALA 3.86 -1.22 1 336 GLU 3.36 -0.71 1 337 ALA 3.07 -1.51 1 338 LEU 3.65 -1.73 1 339 ALA 2.00 -0.16 1 340 GLU -0.46 -0.37 1 341 ALA 1.97 -3.37 1 342 LEU 3.61 -1.49 1 343 ASP -0.24 -0.21 1 344 THR 0.22 0.06 1 345 TYR -0.12 -0.52 1 346 SER -3.85 1.47 1 347 VAL -1.13 -0.51 1 348 ILE -0.58 -2.81 1 354 ALA 4.30 -1.98 1 355 ALA 3.80 -2.00 1 356 ALA 5.04 -3.05 1 357 VAL 6.95 -2.40 1 358 GLU 3.10 -1.20 1 359 LYS 4.56 -2.07 1 360 PHE -0.86 -1.55 1 362 LEU -3.05 1.37 1 363 ALA 4.70 -1.25 1 364 ASP 2.68 -2.04 1 365 LYS -0.54 -1.25 1 366 MET -2.86 -0.80 1 367 ASP 4.71 -0.76 1 369 ILE 0.23 -1.55 1 370 SER -0.17 -0.15 1 371 THR 0.64 -0.17 1 375 ALA 3.53 -0.96 1 376 SER 5.04 -1.35 1 377 LEU 4.82 -1.76 1 378 GLU 5.12 -1.91 1 379 PHE 4.10 -0.48 1 380 MET 3.74 -1.09 1 381 GLU 0.43 -0.10 1 383 LYS 0.71 -0.98 1 384 GLN -0.19 -2.01 1 385 LEU 0.89 -3.11 1 388 VAL 4.30 -1.54 1 389 VAL 4.28 -1.83 1 390 ALA 0.64 -0.72 1 391 LEU 0.11 -1.25 1 392 GLU 0.20 0.63 1 393 ASP -0.01 0.32 1 394 LYS 2.65 -0.25 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16447_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -9.74 _LACS_plot.Line_1_terminator_val_y_1 -4.06 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.50 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.07 _LACS_plot.Line_2_terminator_val_x_2 8.60 _LACS_plot.Line_2_terminator_val_y_2 2.81 _LACS_plot.Y_axis_chem_shift_offset 0.31 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 153 HIS -9.74 3.01 0 10 ASP -0.84 0.97 1 11 VAL -0.02 -0.66 1 12 ARG 4.86 2.56 1 14 LYS -1.08 -0.71 1 15 ARG 0.76 0.10 1 16 VAL -1.48 -3.25 1 17 PHE -0.99 -2.19 1 19 ARG -3.42 -2.66 1 20 VAL -6.11 -1.30 1 21 ASP -1.92 -1.26 1 22 PHE -3.81 -1.35 1 23 ASN 2.48 -0.51 1 24 VAL -1.15 -3.13 1 26 MET -5.75 -0.33 1 27 GLU -3.05 -0.32 1 30 ALA -4.14 -1.40 1 31 ILE 1.32 1.59 1 32 THR 2.39 0.26 1 33 ASP -0.75 0.06 1 34 ASP -0.68 1.46 1 35 THR 8.60 2.12 1 36 ARG 5.64 3.24 1 37 ILE 4.76 1.06 1 38 ARG 5.14 3.95 1 39 ALA 2.64 0.67 1 40 ALA -0.77 0.10 1 41 LEU 8.35 -1.92 1 43 THR 5.37 0.31 1 44 ILE 5.92 1.23 1 45 ARG 5.55 2.09 1 46 TYR 4.48 3.08 1 47 LEU 4.39 0.59 1 48 ILE 5.58 3.89 1 49 GLU 3.11 1.35 1 50 HIS 2.85 -0.26 1 52 ALA -1.52 -0.60 1 53 LYS 0.95 -1.52 1 54 VAL 3.55 -3.76 1 55 ILE -1.13 -2.24 1 56 LEU -4.10 -3.32 1 57 ALA -7.84 -1.63 1 58 SER -2.81 -1.31 1 59 HIS -4.98 -0.97 1 60 LEU -1.68 -1.21 1 62 ARG -2.17 -3.01 1 64 LYS 4.25 0.83 1 66 LYS -4.10 -2.83 1 67 VAL 3.78 -0.22 1 68 VAL -2.22 0.33 1 69 GLU 4.93 2.40 1 70 GLU 3.34 -0.09 1 71 LEU -0.39 -1.57 1 72 ARG 1.05 3.52 1 73 LEU 2.70 -0.45 1 74 ASP 6.22 1.57 1 75 ALA 4.51 3.61 1 76 VAL 6.23 0.21 1 77 ALA 4.58 1.58 1 78 LYS 4.03 2.70 1 79 ARG 3.00 1.57 1 80 LEU 4.99 0.70 1 82 GLU 2.88 3.34 1 83 LEU 2.13 1.78 1 84 LEU -0.61 -0.96 1 85 GLU 3.72 -1.32 1 86 ARG -3.56 -3.81 1 88 VAL -1.79 -0.63 1 89 ALA -1.35 -2.52 1 90 LYS -1.97 -0.01 1 91 THR -2.21 -0.70 1 92 ASN 0.46 -0.75 1 93 GLU -6.57 -1.04 1 94 ALA -2.54 -4.99 1 95 VAL -6.18 -0.25 1 99 VAL 6.32 1.17 1 100 LYS 5.66 2.10 1 101 ALA 3.89 1.98 1 102 ALA 3.73 3.27 1 103 VAL 5.61 2.95 1 104 ASP 3.12 0.89 1 105 ARG 0.39 0.89 1 106 LEU 1.37 -0.89 1 107 ASN -3.32 0.00 1 108 GLU 3.69 1.23 1 110 ASP -2.08 -1.81 1 111 VAL -2.83 -2.30 1 112 LEU -5.98 -4.90 1 113 LEU -3.73 -3.51 1 114 LEU -0.95 -0.36 1 115 GLU -0.78 -2.55 1 116 ASN 1.01 2.47 1 117 VAL 5.11 1.41 1 118 ARG 3.06 -0.55 1 119 PHE 0.09 -1.51 1 120 TYR -1.93 0.17 1 123 GLU 4.67 3.86 1 124 GLU 2.88 -0.48 1 125 LYS -0.18 -0.24 1 126 ASN 1.47 -0.40 1 127 ASP -3.61 -0.26 1 129 GLU 3.55 3.02 1 130 LEU 3.17 -0.53 1 131 ALA 4.91 0.79 1 132 LYS 4.19 1.31 1 133 ALA 4.08 3.31 1 134 PHE 1.28 2.01 1 135 ALA 2.19 1.46 1 136 GLU 1.63 1.23 1 137 LEU 0.09 -2.23 1 138 ALA -7.53 -4.91 1 139 ASP -2.94 -0.26 1 140 LEU -3.75 -5.47 1 141 TYR -4.11 -3.61 1 142 VAL -4.87 -3.21 1 143 ASN -2.00 -0.32 1 144 ASP -4.41 0.40 1 145 ALA -2.58 -0.77 1 146 PHE 5.34 0.68 1 148 ALA -2.50 -0.16 1 149 ALA 1.84 -1.53 1 150 HIS 1.42 0.02 1 151 ARG -2.58 -2.53 1 152 ALA 0.81 -5.54 1 154 ALA 7.53 1.90 1 155 SER 3.39 0.60 1 156 THR -1.40 -1.13 1 157 GLU 2.76 0.56 1 159 ILE 4.11 -1.55 1 160 ALA 1.16 -1.17 1 161 HIS 2.49 0.95 1 162 TYR -1.39 -1.38 1 163 LEU -6.58 -4.11 1 165 ALA -5.48 -2.09 1 166 VAL -6.25 -2.53 1 167 ALA -1.99 1.14 1 169 PHE 2.41 3.89 1 170 LEU 4.46 1.87 1 171 MET 2.29 0.96 1 172 GLU 3.06 0.39 1 173 LYS 4.20 1.55 1 174 GLU 5.02 1.83 1 175 LEU 4.12 3.58 1 176 GLU 2.94 2.39 1 177 VAL 5.35 2.36 1 178 LEU 5.23 1.51 1 180 LYS 5.23 1.82 1 181 ALA 4.61 -2.13 1 182 LEU 0.72 1.10 1 183 SER 0.67 -0.31 1 184 ASN -0.84 -5.08 1 186 ASP -0.20 -2.73 1 187 ARG -2.58 -1.26 1 190 THR -2.45 -2.45 1 191 ALA -6.34 -3.31 1 192 ILE -0.25 -2.32 1 193 ILE -2.03 -2.63 1 197 LYS -3.41 0.47 1 198 VAL 4.54 3.27 1 199 LYS 4.81 0.36 1 200 ASP 1.61 0.89 1 201 LYS -3.06 -0.44 1 202 ILE 5.95 0.16 1 204 VAL 5.11 0.46 1 205 ILE 7.45 0.19 1 206 ASP 2.89 2.29 1 207 ASN 2.39 3.11 1 208 LEU 5.30 2.69 1 209 LEU 3.78 -1.13 1 210 GLU 0.38 0.23 1 211 LYS -3.38 0.52 1 212 VAL -0.58 -1.37 1 213 ASP 0.56 -0.46 1 214 ASN -5.29 -2.35 1 215 LEU -3.63 -4.83 1 216 ILE -1.03 -1.80 1 217 ILE -5.79 -0.48 1 221 LEU 3.65 -0.17 1 222 ALA 3.72 2.25 1 223 TYR 8.23 1.14 1 224 THR 7.13 0.85 1 225 PHE 5.37 1.27 1 226 VAL 6.01 1.89 1 227 LYS 2.19 4.59 1 228 ALA 3.14 0.78 1 229 LEU 0.91 -0.33 1 231 HIS -2.12 0.06 1 232 ASP -0.42 0.97 1 233 VAL -0.91 0.70 1 235 LYS 0.84 0.15 1 236 SER 2.12 -1.99 1 237 LEU 2.80 -1.33 1 238 LEU -3.59 -1.40 1 239 GLU -1.37 -0.01 1 240 GLU 3.93 0.95 1 241 ASP 2.15 0.73 1 242 LYS -0.97 -0.93 1 243 ILE 6.18 0.99 1 244 GLU 4.65 2.98 1 245 LEU 3.78 0.78 1 246 ALA 6.87 1.78 1 247 LYS 5.31 2.70 1 248 SER 4.27 3.22 1 249 PHE 3.09 2.39 1 250 MET 5.47 2.96 1 251 GLU 3.62 2.22 1 252 LYS 4.73 1.91 1 253 ALA 5.13 0.90 1 254 LYS 4.71 3.82 1 255 GLU 3.10 2.14 1 256 LYS -0.07 0.27 1 258 VAL -0.84 0.22 1 259 ARG 2.63 -3.25 1 260 PHE -3.58 -1.20 1 261 TYR -1.98 -3.60 1 262 MET -3.85 -3.73 1 264 VAL -0.89 0.38 1 265 ASP -1.10 -1.69 1 266 VAL -6.04 -2.53 1 267 VAL 0.80 -0.19 1 268 VAL -5.85 -1.82 1 269 ALA -8.43 0.07 1 270 ASP 2.08 -1.29 1 271 ARG -3.01 -2.73 1 273 ALA -3.55 -0.96 1 275 ASP 0.14 -0.81 1 276 ALA -2.23 -0.09 1 277 ASN 1.21 0.08 1 278 THR -5.40 0.22 1 279 LYS -3.96 -2.71 1 280 VAL 0.36 0.46 1 281 VAL -5.58 -3.57 1 283 ILE -0.22 -3.15 1 284 ASP -0.20 -0.46 1 285 ALA -1.86 -1.33 1 286 ILE 1.90 -1.64 1 288 ALA 2.74 0.47 1 289 ASP 1.09 -0.95 1 290 TYR -3.15 -1.38 1 291 SER -2.86 -1.27 1 292 ALA 1.84 -2.00 1 293 LEU -1.83 -1.85 1 294 ASP -2.59 0.37 1 295 ILE 1.09 0.68 1 298 LYS 5.46 3.85 1 299 THR 7.47 0.34 1 300 ARG 4.37 1.76 1 301 GLU 3.53 0.84 1 302 LEU 3.39 1.07 1 303 TYR 4.11 2.24 1 304 ARG 5.77 0.93 1 305 ASP 5.23 2.36 1 306 VAL 5.58 3.88 1 307 ILE 7.42 1.02 1 308 ARG 4.09 1.48 1 309 GLU -0.39 0.08 1 310 SER 0.17 -1.67 1 311 LYS -0.17 0.20 1 312 LEU -2.55 -2.72 1 313 VAL -4.61 -1.46 1 314 VAL -3.13 -2.08 1 315 TRP -5.94 -2.01 1 316 ASN -1.66 -1.11 1 319 MET -5.10 -1.77 1 321 VAL 3.29 -1.22 1 322 PHE 2.78 -2.07 1 323 GLU 3.66 0.43 1 324 MET -1.96 -0.69 1 325 ASP 4.51 2.04 1 326 ALA 3.22 0.74 1 327 PHE -0.59 -1.24 1 328 ALA -0.81 -0.01 1 329 HIS 3.57 5.17 1 332 LYS 5.48 0.55 1 333 ALA 3.96 2.83 1 334 ILE 4.80 0.07 1 335 ALA 3.86 1.03 1 336 GLU 3.36 1.91 1 337 ALA 3.07 2.53 1 338 LEU 3.65 1.59 1 339 ALA 2.00 1.22 1 340 GLU -0.46 -0.72 1 341 ALA 1.97 -0.89 1 342 LEU 3.61 0.95 1 343 ASP -0.24 -1.37 1 344 THR 0.22 -2.29 1 345 TYR -0.12 -1.18 1 346 SER -3.85 -1.67 1 347 VAL -1.13 -1.89 1 348 ILE -0.58 -0.17 1 354 ALA 4.30 1.06 1 355 ALA 3.80 3.09 1 356 ALA 5.04 -0.33 1 357 VAL 6.95 1.29 1 358 GLU 3.10 3.37 1 359 LYS 4.56 2.07 1 360 PHE -0.86 0.04 1 362 LEU -3.05 -0.17 1 363 ALA 4.70 1.22 1 364 ASP 2.68 0.38 1 365 LYS -0.54 -0.28 1 366 MET -2.86 0.25 1 367 ASP 4.71 0.97 1 368 HIS -3.47 -1.09 1 369 ILE 0.23 -1.16 1 370 SER -0.17 1.36 1 371 THR 0.64 1.17 1 375 ALA 3.53 1.66 1 376 SER 5.04 1.59 1 377 LEU 4.82 0.79 1 378 GLU 5.12 2.59 1 379 PHE 4.10 4.68 1 380 MET 3.74 0.18 1 381 GLU 0.43 -0.05 1 383 LYS 0.71 -0.45 1 384 GLN -0.19 -0.20 1 385 LEU 0.89 -1.29 1 388 VAL 4.30 1.69 1 389 VAL 4.28 0.37 1 390 ALA 0.64 -0.54 1 391 LEU 0.11 0.15 1 392 GLU 0.20 0.03 1 393 ASP -0.01 0.09 1 394 LYS 2.65 -5.38 1 stop_ save_