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 bmr16715_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -3.48 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.55 _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 7.57 _LACS_plot.Line_2_terminator_val_y_2 5.44 _LACS_plot.Y_axis_chem_shift_offset 0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 175 HIS 1.92 6.41 0 11 ARG 0.48 -0.22 1 12 GLN 0.76 0.33 1 13 SER -1.62 -0.11 1 15 ALA 0.10 -0.02 1 16 LYS 0.50 -0.05 1 18 HIS -2.47 1.17 1 19 LEU 0.65 -0.02 1 20 ALA 0.49 0.18 1 21 GLU -0.43 -0.48 1 22 GLN 0.57 0.48 1 23 PHE -1.78 -2.89 1 24 ALA -2.54 -1.98 1 25 VAL 4.44 2.21 1 27 GLU 1.31 0.85 1 28 ILE -1.14 -2.76 1 29 ILE -1.73 -2.43 1 30 THR -0.38 -0.16 1 31 ASP -2.50 -0.96 1 32 MET 3.51 2.24 1 33 ALA -0.14 -0.86 1 34 LYS 6.07 1.11 1 35 LYS 1.76 -0.09 1 36 GLU -4.03 -2.24 1 37 TRP -3.10 -2.47 1 38 LYS -3.22 -2.04 1 39 VAL 1.95 0.98 1 41 LEU 1.21 0.52 1 43 ILE -2.31 -1.20 1 45 GLN -1.35 -0.57 1 48 PHE 0.13 0.04 1 51 ILE -2.13 -1.01 1 52 TYR -4.98 -2.69 1 53 LEU 0.90 0.88 1 54 ALA -4.16 -1.38 1 55 ASP -6.05 -2.51 1 56 MET 2.01 1.10 1 57 ASN 1.95 1.04 1 58 SER -1.69 -1.01 1 59 SER 1.82 1.39 1 60 GLU -1.41 -1.06 1 61 SER 0.10 -0.07 1 62 VAL 2.80 0.97 1 64 SER 2.42 1.61 1 65 ASP -0.28 -1.21 1 66 ALA -0.33 0.28 1 69 VAL -5.72 -4.00 1 70 VAL -5.67 -4.72 1 71 LYS -2.25 -1.34 1 72 VAL -3.83 -1.95 1 73 GLU -4.13 -0.60 1 75 SER 1.22 1.08 1 76 ASP 0.67 -0.20 1 77 ASN 0.20 0.39 1 80 LEU 4.66 2.56 1 81 PHE 3.88 2.96 1 82 THR 6.20 4.54 1 83 GLU 3.78 3.90 1 84 LEU 4.04 2.90 1 85 LYS 4.64 2.93 1 86 PHE 4.92 2.71 1 87 TYR 6.36 4.92 1 88 GLN 3.11 2.07 1 89 ARG 1.68 1.53 1 90 ALA -2.21 -0.42 1 91 ALA -3.07 -1.92 1 92 LYS 4.47 1.69 1 94 GLU 4.33 2.55 1 95 GLN 2.72 2.59 1 96 ILE 4.33 3.73 1 97 GLN 4.28 2.94 1 98 LYS 4.38 3.20 1 99 TRP 3.63 3.23 1 100 ILE 5.83 4.98 1 101 ARG 4.02 2.83 1 102 THR 4.71 3.86 1 103 ARG 1.27 -1.30 1 104 LYS 5.60 0.56 1 105 LEU -2.57 -1.77 1 106 LYS 3.07 1.72 1 107 TYR -2.88 -2.74 1 108 LEU -3.95 -1.67 1 110 VAL -2.85 -1.34 1 112 LYS 0.79 0.20 1 113 TYR -5.58 -2.78 1 114 TRP -0.79 0.03 1 116 SER -2.89 -0.73 1 118 LEU -4.79 -1.80 1 119 HIS -5.27 0.96 1 120 ASP -2.06 -1.09 1 121 LYS -1.80 -1.10 1 122 ASN 2.30 0.94 1 124 LYS -2.98 -1.81 1 125 SER -1.40 -0.91 1 126 TYR -1.90 -0.37 1 127 ARG -2.33 -1.59 1 128 PHE -6.35 -3.02 1 129 MET -5.99 -0.78 1 130 ILE 0.35 -2.42 1 131 MET -6.07 -1.68 1 132 ASP 0.05 1.91 1 133 ARG -1.30 -1.10 1 134 PHE -3.64 0.18 1 136 SER 0.20 0.85 1 137 ASP -3.60 -1.05 1 138 LEU 2.51 1.04 1 139 GLN 6.45 2.28 1 140 LYS 3.93 2.92 1 141 ILE 3.84 3.17 1 142 TYR 3.44 2.52 1 143 GLU 4.47 2.96 1 144 ALA 3.31 1.76 1 145 ASN -0.41 -0.27 1 146 ALA 4.06 0.62 1 147 LYS 5.85 0.01 1 148 ARG -4.22 -1.11 1 149 PHE -7.26 -4.10 1 150 SER -1.64 -0.77 1 151 ARG 4.50 4.07 1 152 LYS 4.61 3.36 1 153 THR 6.38 4.94 1 154 VAL 7.58 6.07 1 155 LEU 5.47 3.14 1 156 GLN 3.96 3.38 1 157 LEU 2.17 2.46 1 160 ARG 2.16 1.92 1 161 ILE 6.19 4.00 1 162 LEU 5.02 3.56 1 163 ASP 5.25 4.04 1 165 LEU 2.65 0.97 1 166 GLU 4.19 3.22 1 167 TYR 5.82 4.97 1 171 HIS 4.01 2.33 1 172 GLU 5.52 2.28 1 173 TYR -5.18 0.30 1 174 VAL -3.33 -3.22 1 177 ASP 0.23 -0.88 1 178 ILE 3.52 3.24 1 179 LYS -1.00 -1.31 1 180 ALA 7.02 3.39 1 181 SER 4.07 2.71 1 182 ASN -1.13 -1.13 1 183 LEU -2.59 -2.62 1 184 LEU -4.07 -3.11 1 185 LEU -1.09 -1.93 1 186 ASN 0.25 1.17 1 187 TYR 3.30 2.51 1 188 LYS -0.49 -0.89 1 189 ASN -1.25 -1.08 1 191 ASP 0.04 0.52 1 192 GLN -0.61 -0.52 1 193 VAL -4.36 -3.37 1 194 TYR -4.42 -1.87 1 195 LEU -3.58 -1.70 1 196 VAL -3.73 -2.82 1 197 ASP 3.78 0.86 1 198 TYR 0.33 -0.83 1 200 LEU -0.55 -1.93 1 201 ALA 0.89 0.54 1 202 TYR -4.14 -0.86 1 203 ARG 1.21 -2.34 1 204 TYR 0.75 0.23 1 207 GLU 3.41 -0.14 1 209 VAL 0.77 -0.97 1 211 LYS 1.33 0.18 1 212 GLU -0.81 -0.79 1 213 TYR 3.78 2.36 1 214 LYS -1.47 -0.34 1 215 GLU 0.15 -1.02 1 216 ASP -3.17 -2.06 1 218 LYS 1.92 0.42 1 219 ARG -0.51 -1.44 1 221 HIS 2.67 1.71 1 222 ASP 1.03 0.90 1 224 THR 3.48 1.08 1 225 ILE 4.01 2.64 1 226 GLU 6.17 3.36 1 227 PHE -3.55 -2.01 1 228 THR 2.21 0.99 1 229 SER -2.15 -0.35 1 230 ILE 7.32 6.09 1 231 ASP 5.05 3.69 1 232 ALA 4.37 2.77 1 233 HIS 5.28 5.22 1 234 ASN 0.06 -0.10 1 236 VAL -1.41 -2.56 1 237 ALA 1.92 -0.14 1 240 ARG 5.30 4.47 1 241 ARG 4.81 2.55 1 243 ASP 2.97 2.90 1 244 LEU 2.96 1.07 1 245 GLU 2.07 2.71 1 246 ILE 3.94 3.41 1 247 LEU 4.01 2.37 1 249 TYR 2.66 0.70 1 251 MET 4.64 5.17 1 252 ILE 5.48 4.90 1 253 GLN 4.17 2.90 1 254 TRP -1.22 -0.10 1 255 LEU -0.18 1.48 1 256 THR -2.03 0.49 1 258 HIS -4.09 0.15 1 259 LEU -2.99 -1.54 1 261 TRP 1.32 -1.93 1 262 GLU 1.94 0.30 1 263 ASP 1.98 0.17 1 264 ASN 0.70 -1.01 1 265 LEU 2.95 0.68 1 266 LYS 1.77 -0.11 1 267 ASP -3.11 -2.49 1 269 LYS 4.88 3.08 1 270 TYR 3.98 2.11 1 271 VAL 7.35 4.88 1 272 ARG 4.88 3.19 1 273 ASP 4.68 2.75 1 274 SER 4.12 3.29 1 275 LYS 5.46 4.12 1 276 ILE 6.02 4.88 1 277 ARG 4.77 3.14 1 278 TYR 4.52 3.26 1 279 ARG 3.35 2.12 1 280 GLU 1.81 1.06 1 281 ASN -1.05 -1.85 1 282 ILE 4.48 2.07 1 283 ALA 5.01 3.12 1 284 SER 3.41 2.83 1 285 LEU 5.62 3.04 1 286 MET 4.20 0.61 1 287 ASP 2.86 2.48 1 288 LYS 1.65 0.55 1 290 PHE -0.30 -0.78 1 292 GLU 0.76 -0.06 1 293 LYS 2.76 1.57 1 294 ASN 0.49 -0.92 1 295 LYS 0.17 -0.06 1 298 GLU 4.58 1.73 1 299 ILE 4.45 0.54 1 300 ALA 4.85 3.02 1 301 LYS 3.82 2.57 1 302 TYR 5.45 4.86 1 303 MET 3.91 2.66 1 304 GLU 2.80 2.22 1 305 THR 7.00 4.91 1 306 VAL 5.47 3.84 1 307 LYS 3.32 1.95 1 308 LEU 0.17 -0.19 1 309 LEU -0.37 -0.44 1 310 ASP -1.32 -0.92 1 311 TYR 5.47 5.12 1 312 THR -0.96 -1.59 1 313 GLU -2.04 -0.14 1 314 LYS -0.25 -0.35 1 316 LEU 1.59 -2.92 1 317 TYR 5.43 4.86 1 318 GLU 3.67 2.30 1 319 ASN 3.97 2.52 1 320 LEU 4.15 2.70 1 321 ARG 5.56 4.29 1 322 ASP 3.78 3.51 1 323 ILE 4.61 4.26 1 324 LEU 5.77 2.51 1 325 LEU 4.42 2.86 1 326 GLN 4.99 2.55 1 328 LEU 3.63 1.88 1 329 LYS 4.61 2.94 1 330 ALA 3.77 2.27 1 331 ILE 1.26 -0.48 1 333 SER -4.69 -3.21 1 334 LYS -1.84 -1.60 1 335 ASP 1.60 -1.12 1 336 ASP -1.66 -2.33 1 338 LYS -0.09 -1.47 1 339 LEU 0.82 -0.12 1 340 ASP 1.40 0.02 1 341 LEU 0.18 0.06 1 342 SER -0.12 -0.45 1 343 VAL 0.33 -0.38 1 344 VAL -0.23 -0.47 1 345 GLU -0.58 -0.47 1 346 ASN -1.22 1.07 1 349 LEU 0.85 0.17 1 350 LYS 0.43 -0.22 1 351 ALA -0.08 -0.31 1 352 LYS 0.32 -0.18 1 353 THR -0.27 -0.30 1 354 ILE 0.30 -0.01 1 355 THR -1.36 0.54 1 356 LYS 0.87 0.24 1 357 LYS 0.68 0.03 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16715_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 3.78 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.45 _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 7.57 _LACS_plot.Line_2_terminator_val_y_2 -2.13 _LACS_plot.Y_axis_chem_shift_offset 0.38 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 175 HIS 1.92 4.49 0 11 ARG 0.48 -0.70 1 12 GLN 0.76 -0.43 1 13 SER -1.62 1.51 1 15 ALA 0.10 -0.12 1 16 LYS 0.50 -0.55 1 18 HIS -2.47 3.64 1 19 LEU 0.65 -0.67 1 20 ALA 0.49 -0.31 1 21 GLU -0.43 -0.05 1 22 GLN 0.57 -0.09 1 23 PHE -1.78 -1.11 1 24 ALA -2.54 0.56 1 25 VAL 4.44 -2.23 1 27 GLU 1.31 -0.46 1 28 ILE -1.14 -1.62 1 29 ILE -1.73 -0.70 1 30 THR -0.38 0.22 1 31 ASP -2.50 1.54 1 32 MET 3.51 -1.27 1 33 ALA -0.14 -0.72 1 34 LYS 6.07 -4.96 1 35 LYS 1.76 -1.85 1 36 GLU -4.03 1.79 1 37 TRP -3.10 0.63 1 38 LYS -3.22 1.18 1 39 VAL 1.95 -0.97 1 41 LEU 1.21 -0.69 1 43 ILE -2.31 1.11 1 45 GLN -1.35 0.78 1 48 PHE 0.13 -0.09 1 51 ILE -2.13 1.12 1 52 TYR -4.98 2.29 1 53 LEU 0.90 -0.02 1 54 ALA -4.16 2.78 1 55 ASP -6.05 3.54 1 56 MET 2.01 -0.91 1 57 ASN 1.95 -0.91 1 58 SER -1.69 0.68 1 59 SER 1.82 -0.43 1 60 GLU -1.41 0.35 1 61 SER 0.10 -0.17 1 62 VAL 2.80 -1.83 1 64 SER 2.42 -0.81 1 65 ASP -0.28 -0.93 1 66 ALA -0.33 0.61 1 69 VAL -5.72 1.72 1 70 VAL -5.67 0.95 1 71 LYS -2.25 0.91 1 72 VAL -3.83 1.88 1 73 GLU -4.13 3.53 1 75 SER 1.22 -0.14 1 76 ASP 0.67 -0.87 1 77 ASN 0.20 0.19 1 80 LEU 4.66 -2.10 1 81 PHE 3.88 -0.92 1 82 THR 6.20 -1.66 1 83 GLU 3.78 0.12 1 84 LEU 4.04 -1.14 1 85 LYS 4.64 -1.71 1 86 PHE 4.92 -2.21 1 87 TYR 6.36 -1.44 1 88 GLN 3.11 -1.04 1 89 ARG 1.68 -0.15 1 90 ALA -2.21 1.79 1 91 ALA -3.07 1.15 1 92 LYS 4.47 -2.78 1 94 GLU 4.33 -1.78 1 95 GLN 2.72 -0.13 1 96 ILE 4.33 -0.60 1 97 GLN 4.28 -1.34 1 98 LYS 4.38 -1.18 1 99 TRP 3.63 -0.40 1 100 ILE 5.83 -0.85 1 101 ARG 4.02 -1.19 1 102 THR 4.71 -0.85 1 103 ARG 1.27 -2.57 1 104 LYS 5.60 -5.04 1 105 LEU -2.57 0.80 1 106 LYS 3.07 -1.35 1 107 TYR -2.88 0.14 1 108 LEU -3.95 2.28 1 110 VAL -2.85 1.51 1 112 LYS 0.79 -0.59 1 113 TYR -5.58 2.80 1 114 TRP -0.79 0.82 1 116 SER -2.89 2.16 1 118 LEU -4.79 2.99 1 119 HIS -5.27 6.23 1 120 ASP -2.06 0.97 1 121 LYS -1.80 0.70 1 122 ASN 2.30 -1.36 1 124 LYS -2.98 1.17 1 125 SER -1.40 0.49 1 126 TYR -1.90 1.53 1 127 ARG -2.33 0.74 1 128 PHE -6.35 3.33 1 129 MET -5.99 5.21 1 130 ILE 0.35 -2.77 1 131 MET -6.07 4.39 1 132 ASP 0.05 1.86 1 133 ARG -1.30 0.20 1 134 PHE -3.64 3.82 1 136 SER 0.20 0.65 1 137 ASP -3.60 2.55 1 138 LEU 2.51 -1.47 1 139 GLN 6.45 -4.17 1 140 LYS 3.93 -1.01 1 141 ILE 3.84 -0.67 1 142 TYR 3.44 -0.92 1 143 GLU 4.47 -1.51 1 144 ALA 3.31 -1.55 1 145 ASN -0.41 0.14 1 146 ALA 4.06 -3.44 1 147 LYS 5.85 -5.84 1 148 ARG -4.22 3.11 1 149 PHE -7.26 3.16 1 150 SER -1.64 0.87 1 151 ARG 4.50 -0.43 1 152 LYS 4.61 -1.25 1 153 THR 6.38 -1.44 1 154 VAL 7.58 -1.51 1 155 LEU 5.47 -2.33 1 156 GLN 3.96 -0.58 1 157 LEU 2.17 0.29 1 160 ARG 2.16 -0.24 1 161 ILE 6.19 -2.19 1 162 LEU 5.02 -1.46 1 163 ASP 5.25 -1.21 1 165 LEU 2.65 -1.68 1 166 GLU 4.19 -0.97 1 167 TYR 5.82 -0.85 1 171 HIS 4.01 -1.68 1 172 GLU 5.52 -3.24 1 173 TYR -5.18 5.48 1 174 VAL -3.33 0.11 1 177 ASP 0.23 -1.11 1 178 ILE 3.52 -0.28 1 179 LYS -1.00 -0.31 1 180 ALA 7.02 -3.63 1 181 SER 4.07 -1.36 1 182 ASN -1.13 0.00 1 183 LEU -2.59 -0.03 1 184 LEU -4.07 0.96 1 185 LEU -1.09 -0.84 1 186 ASN 0.25 0.92 1 187 TYR 3.30 -0.79 1 188 LYS -0.49 -0.40 1 189 ASN -1.25 0.17 1 191 ASP 0.04 0.48 1 192 GLN -0.61 0.09 1 193 VAL -4.36 0.99 1 194 TYR -4.42 2.55 1 195 LEU -3.58 1.88 1 196 VAL -3.73 0.91 1 197 ASP 3.78 -2.92 1 198 TYR 0.33 -1.16 1 200 LEU -0.55 -1.38 1 201 ALA 0.89 -0.35 1 202 TYR -4.14 3.28 1 203 ARG 1.21 -3.55 1 204 TYR 0.75 -0.52 1 207 GLU 3.41 -3.55 1 209 VAL 0.77 -1.74 1 211 LYS 1.33 -1.15 1 212 GLU -0.81 0.02 1 213 TYR 3.78 -1.42 1 214 LYS -1.47 1.13 1 215 GLU 0.15 -1.17 1 216 ASP -3.17 1.11 1 218 LYS 1.92 -1.50 1 219 ARG -0.51 -0.93 1 221 HIS 2.67 -0.96 1 222 ASP 1.03 -0.13 1 224 THR 3.48 -2.40 1 225 ILE 4.01 -1.37 1 226 GLU 6.17 -2.81 1 227 PHE -3.55 1.54 1 228 THR 2.21 -1.22 1 229 SER -2.15 1.80 1 230 ILE 7.32 -1.23 1 231 ASP 5.05 -1.36 1 232 ALA 4.37 -1.60 1 233 HIS 5.28 -0.06 1 234 ASN 0.06 -0.16 1 236 VAL -1.41 -1.15 1 237 ALA 1.92 -2.06 1 240 ARG 5.30 -0.83 1 241 ARG 4.81 -2.26 1 243 ASP 2.97 -0.07 1 244 LEU 2.96 -1.89 1 245 GLU 2.07 0.64 1 246 ILE 3.94 -0.53 1 247 LEU 4.01 -1.64 1 249 TYR 2.66 -1.96 1 251 MET 4.64 0.53 1 252 ILE 5.48 -0.58 1 253 GLN 4.17 -1.27 1 254 TRP -1.22 1.12 1 255 LEU -0.18 1.66 1 256 THR -2.03 2.52 1 258 HIS -4.09 4.24 1 259 LEU -2.99 1.45 1 261 TRP 1.32 -3.25 1 262 GLU 1.94 -1.64 1 263 ASP 1.98 -1.81 1 264 ASN 0.70 -1.71 1 265 LEU 2.95 -2.27 1 266 LYS 1.77 -1.88 1 267 ASP -3.11 0.62 1 269 LYS 4.88 -1.80 1 270 TYR 3.98 -1.87 1 271 VAL 7.35 -2.47 1 272 ARG 4.88 -1.69 1 273 ASP 4.68 -1.93 1 274 SER 4.12 -0.83 1 275 LYS 5.46 -1.34 1 276 ILE 6.02 -1.14 1 277 ARG 4.77 -1.63 1 278 TYR 4.52 -1.26 1 279 ARG 3.35 -1.23 1 280 GLU 1.81 -0.75 1 281 ASN -1.05 -0.80 1 282 ILE 4.48 -2.41 1 283 ALA 5.01 -1.89 1 284 SER 3.41 -0.58 1 285 LEU 5.62 -2.58 1 286 MET 4.20 -3.59 1 287 ASP 2.86 -0.38 1 288 LYS 1.65 -1.10 1 290 PHE -0.30 -0.48 1 292 GLU 0.76 -0.82 1 293 LYS 2.76 -1.19 1 294 ASN 0.49 -1.41 1 295 LYS 0.17 -0.23 1 298 GLU 4.58 -2.85 1 299 ILE 4.45 -3.91 1 300 ALA 4.85 -1.83 1 301 LYS 3.82 -1.25 1 302 TYR 5.45 -0.59 1 303 MET 3.91 -1.25 1 304 GLU 2.80 -0.58 1 305 THR 7.00 -2.09 1 306 VAL 5.47 -1.63 1 307 LYS 3.32 -1.37 1 308 LEU 0.17 -0.36 1 309 LEU -0.37 -0.07 1 310 ASP -1.32 0.40 1 311 TYR 5.47 -0.35 1 312 THR -0.96 -0.63 1 313 GLU -2.04 1.90 1 314 LYS -0.25 -0.10 1 316 LEU 1.59 -4.51 1 317 TYR 5.43 -0.57 1 318 GLU 3.67 -1.37 1 319 ASN 3.97 -1.45 1 320 LEU 4.15 -1.45 1 321 ARG 5.56 -1.27 1 322 ASP 3.78 -0.27 1 323 ILE 4.61 -0.35 1 324 LEU 5.77 -3.26 1 325 LEU 4.42 -1.56 1 326 GLN 4.99 -2.44 1 328 LEU 3.63 -1.75 1 329 LYS 4.61 -1.67 1 330 ALA 3.77 -1.50 1 331 ILE 1.26 -1.74 1 333 SER -4.69 1.48 1 334 LYS -1.84 0.24 1 335 ASP 1.60 -2.72 1 336 ASP -1.66 -0.67 1 338 LYS -0.09 -1.38 1 339 LEU 0.82 -0.94 1 340 ASP 1.40 -1.38 1 341 LEU 0.18 -0.12 1 342 SER -0.12 -0.33 1 343 VAL 0.33 -0.71 1 344 VAL -0.23 -0.24 1 345 GLU -0.58 0.11 1 346 ASN -1.22 2.29 1 349 LEU 0.85 -0.68 1 350 LYS 0.43 -0.65 1 351 ALA -0.08 -0.23 1 352 LYS 0.32 -0.50 1 353 THR -0.27 -0.03 1 354 ILE 0.30 -0.31 1 355 THR -1.36 1.90 1 356 LYS 0.87 -0.63 1 357 LYS 0.68 -0.65 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16715_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 0.46 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.31 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.00 _LACS_plot.Line_2_terminator_val_x_2 7.57 _LACS_plot.Line_2_terminator_val_y_2 -0.74 _LACS_plot.Y_axis_chem_shift_offset 0.15 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 254 TRP -1.22 -1.25 0 13 SER -1.62 0.19 1 20 ALA 0.49 -0.18 1 21 GLU -0.43 -0.17 1 22 GLN 0.57 -0.36 1 23 PHE -1.78 -0.35 1 24 ALA -2.54 -0.12 1 25 VAL 4.44 0.09 1 27 GLU 1.31 -0.64 1 28 ILE -1.14 0.58 1 29 ILE -1.73 0.17 1 30 THR -0.38 0.75 1 31 ASP -2.50 -0.09 1 32 MET 3.51 -0.18 1 33 ALA -0.14 0.14 1 34 LYS 6.07 -0.80 1 35 LYS 1.76 -0.20 1 36 GLU -4.03 0.49 1 37 TRP -3.10 -0.22 1 38 LYS -3.22 0.37 1 39 VAL 1.95 0.04 1 41 LEU 1.21 -0.42 1 43 ILE -2.31 0.12 1 45 GLN -1.35 0.14 1 48 PHE 0.13 -0.08 1 51 ILE -2.13 0.69 1 52 TYR -4.98 0.42 1 53 LEU 0.90 0.62 1 54 ALA -4.16 -0.06 1 55 ASP -6.05 0.29 1 56 MET 2.01 -1.00 1 57 ASN 1.95 -0.57 1 59 SER 1.82 -0.11 1 60 GLU -1.41 -0.18 1 62 VAL 2.80 -0.02 1 64 SER 2.42 0.19 1 65 ASP -0.28 -0.55 1 66 ALA -0.33 -0.43 1 69 VAL -5.72 0.78 1 70 VAL -5.67 0.83 1 71 LYS -2.25 0.70 1 72 VAL -3.83 0.92 1 73 GLU -4.13 0.44 1 75 SER 1.22 -0.14 1 76 ASP 0.67 -0.52 1 77 ASN 0.20 -0.31 1 80 LEU 4.66 -0.21 1 81 PHE 3.88 -0.55 1 82 THR 6.20 0.03 1 83 GLU 3.78 -0.63 1 84 LEU 4.04 -0.43 1 85 LYS 4.64 -0.63 1 86 PHE 4.92 -1.20 1 87 TYR 6.36 -0.68 1 88 GLN 3.11 -1.18 1 89 ARG 1.68 -0.31 1 90 ALA -2.21 -0.29 1 91 ALA -3.07 0.03 1 92 LYS 4.47 -0.27 1 94 GLU 4.33 -0.34 1 95 GLN 2.72 -0.30 1 96 ILE 4.33 -0.19 1 97 GLN 4.28 -0.51 1 98 LYS 4.38 -0.36 1 100 ILE 5.83 -0.55 1 101 ARG 4.02 -0.54 1 102 THR 4.71 -0.58 1 103 ARG 1.27 -0.39 1 104 LYS 5.60 -0.55 1 105 LEU -2.57 -0.04 1 106 LYS 3.07 -0.30 1 107 TYR -2.88 -0.29 1 108 LEU -3.95 -0.33 1 112 LYS 0.79 -0.18 1 113 TYR -5.58 0.00 1 114 TRP -0.79 -0.43 1 116 SER -2.89 0.20 1 118 LEU -4.79 1.11 1 119 HIS -5.27 0.27 1 120 ASP -2.06 0.66 1 121 LYS -1.80 0.63 1 122 ASN 2.30 -0.48 1 124 LYS -2.98 0.08 1 125 SER -1.40 0.49 1 126 TYR -1.90 0.42 1 127 ARG -2.33 0.38 1 128 PHE -6.35 0.38 1 129 MET -5.99 0.43 1 130 ILE 0.35 0.50 1 131 MET -6.07 0.98 1 132 ASP 0.05 -0.32 1 133 ARG -1.30 -0.01 1 134 PHE -3.64 0.03 1 136 SER 0.20 -0.38 1 137 ASP -3.60 0.84 1 138 LEU 2.51 -0.38 1 139 GLN 6.45 -0.45 1 140 LYS 3.93 -0.41 1 141 ILE 3.84 -0.59 1 142 TYR 3.44 -1.17 1 143 GLU 4.47 -0.95 1 144 ALA 3.31 -0.22 1 145 ASN -0.41 -0.14 1 146 ALA 4.06 -0.67 1 147 LYS 5.85 -0.91 1 148 ARG -4.22 0.28 1 149 PHE -7.26 0.59 1 150 SER -1.64 -0.20 1 151 ARG 4.50 -0.06 1 152 LYS 4.61 -0.69 1 153 THR 6.38 -1.02 1 154 VAL 7.58 -0.25 1 155 LEU 5.47 -0.44 1 156 GLN 3.96 -0.46 1 157 LEU 2.17 -0.73 1 160 ARG 2.16 -0.39 1 161 ILE 6.19 -0.52 1 162 LEU 5.02 -0.46 1 163 ASP 5.25 -0.54 1 165 LEU 2.65 -0.74 1 171 HIS 4.01 -0.45 1 172 GLU 5.52 -0.06 1 173 TYR -5.18 -0.41 1 174 VAL -3.33 0.12 1 175 HIS 1.92 -0.79 1 177 ASP 0.23 0.39 1 178 ILE 3.52 0.14 1 179 LYS -1.00 -0.06 1 180 ALA 7.02 -0.19 1 182 ASN -1.13 0.11 1 183 LEU -2.59 1.02 1 184 LEU -4.07 0.52 1 185 LEU -1.09 0.51 1 186 ASN 0.25 -0.30 1 187 TYR 3.30 -0.72 1 188 LYS -0.49 -0.30 1 189 ASN -1.25 -0.26 1 191 ASP 0.04 -0.23 1 192 GLN -0.61 -0.60 1 193 VAL -4.36 0.74 1 194 TYR -4.42 0.20 1 195 LEU -3.58 0.70 1 196 VAL -3.73 0.76 1 197 ASP 3.78 -0.67 1 198 TYR 0.33 -0.26 1 200 LEU -0.55 -0.02 1 201 ALA 0.89 -0.05 1 207 GLU 3.41 -0.62 1 209 VAL 0.77 -0.24 1 211 LYS 1.33 0.01 1 212 GLU -0.81 -0.21 1 213 TYR 3.78 -0.20 1 214 LYS -1.47 -0.36 1 215 GLU 0.15 -0.79 1 216 ASP -3.17 -0.07 1 218 LYS 1.92 -0.21 1 219 ARG -0.51 -0.01 1 221 HIS 2.67 -0.69 1 222 ASP 1.03 -0.26 1 224 THR 3.48 -0.09 1 225 ILE 4.01 -0.55 1 226 GLU 6.17 -0.70 1 227 PHE -3.55 -0.34 1 229 SER -2.15 -0.04 1 231 ASP 5.05 -0.38 1 232 ALA 4.37 -0.32 1 233 HIS 5.28 -0.69 1 234 ASN 0.06 -0.78 1 236 VAL -1.41 -0.21 1 237 ALA 1.92 -0.87 1 241 ARG 4.81 -0.54 1 245 GLU 2.07 -0.74 1 246 ILE 3.94 -0.33 1 249 TYR 2.66 -1.06 1 251 MET 4.64 -1.02 1 252 ILE 5.48 -0.59 1 253 GLN 4.17 -0.60 1 255 LEU -0.18 -0.80 1 256 THR -2.03 -0.20 1 258 HIS -4.09 0.28 1 259 LEU -2.99 -0.66 1 261 TRP 1.32 0.34 1 262 GLU 1.94 -0.51 1 263 ASP 1.98 -0.30 1 264 ASN 0.70 0.06 1 265 LEU 2.95 -0.51 1 266 LYS 1.77 -0.31 1 267 ASP -3.11 0.07 1 269 LYS 4.88 -0.63 1 270 TYR 3.98 -0.48 1 271 VAL 7.35 -0.43 1 272 ARG 4.88 -0.69 1 273 ASP 4.68 -0.93 1 274 SER 4.12 -0.49 1 275 LYS 5.46 -0.38 1 276 ILE 6.02 -0.83 1 277 ARG 4.77 -0.54 1 278 TYR 4.52 -0.77 1 279 ARG 3.35 -0.22 1 280 GLU 1.81 -0.56 1 281 ASN -1.05 0.07 1 282 ILE 4.48 -0.18 1 283 ALA 5.01 -0.35 1 284 SER 3.41 -0.19 1 285 LEU 5.62 -0.36 1 286 MET 4.20 -0.30 1 287 ASP 2.86 -0.40 1 288 LYS 1.65 -0.31 1 290 PHE -0.30 -0.01 1 292 GLU 0.76 -0.29 1 293 LYS 2.76 -0.34 1 294 ASN 0.49 -0.07 1 295 LYS 0.17 -0.60 1 298 GLU 4.58 -0.26 1 299 ILE 4.45 -0.53 1 300 ALA 4.85 -0.49 1 301 LYS 3.82 -0.40 1 302 TYR 5.45 -0.89 1 303 MET 3.91 -0.37 1 304 GLU 2.80 -0.53 1 305 THR 7.00 -0.65 1 306 VAL 5.47 -0.42 1 307 LYS 3.32 -0.47 1 308 LEU 0.17 -0.37 1 309 LEU -0.37 -0.33 1 310 ASP -1.32 -0.57 1 311 TYR 5.47 -0.82 1 312 THR -0.96 0.13 1 313 GLU -2.04 -0.62 1 314 LYS -0.25 -0.49 1 316 LEU 1.59 -0.45 1 317 TYR 5.43 -0.93 1 318 GLU 3.67 -0.35 1 319 ASN 3.97 -0.32 1 320 LEU 4.15 -0.34 1 321 ARG 5.56 -0.64 1 322 ASP 3.78 -0.33 1 323 ILE 4.61 -0.22 1 324 LEU 5.77 -0.43 1 325 LEU 4.42 -0.46 1 326 GLN 4.99 -0.42 1 328 LEU 3.63 -0.42 1 329 LYS 4.61 -0.31 1 330 ALA 3.77 0.13 1 331 ILE 1.26 -0.19 1 333 SER -4.69 0.18 1 334 LYS -1.84 -0.10 1 335 ASP 1.60 0.38 1 336 ASP -1.66 -0.21 1 338 LYS -0.09 -0.15 1 339 LEU 0.82 -0.43 1 340 ASP 1.40 -0.47 1 341 LEU 0.18 -0.34 1 342 SER -0.12 -0.09 1 343 VAL 0.33 -0.10 1 344 VAL -0.23 -0.15 1 345 GLU -0.58 -0.21 1 349 LEU 0.85 -0.19 1 351 ALA -0.08 -0.19 1 352 LYS 0.32 -0.16 1 353 THR -0.27 -0.15 1 354 ILE 0.30 -0.13 1 355 THR -1.36 -0.24 1 356 LYS 0.87 -0.21 1 357 LYS 0.68 -0.17 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr16715_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.26 _LACS_plot.Line_1_terminator_val_y_1 -2.87 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.44 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.03 _LACS_plot.Line_2_terminator_val_x_2 7.57 _LACS_plot.Line_2_terminator_val_y_2 2.34 _LACS_plot.Y_axis_chem_shift_offset 0.30 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 232 ALA 4.37 7.20 0 12 GLN 0.76 0.63 1 15 ALA 0.10 0.02 1 18 HIS -2.47 2.10 1 19 LEU 0.65 -0.56 1 20 ALA 0.49 -0.27 1 21 GLU -0.43 -0.57 1 22 GLN 0.57 -0.16 1 23 PHE -1.78 -1.33 1 24 ALA -2.54 -0.68 1 25 VAL 4.44 2.06 1 27 GLU 1.31 -2.50 1 28 ILE -1.14 0.30 1 29 ILE -1.73 -2.70 1 30 THR -0.38 0.04 1 31 ASP -2.50 2.49 1 32 MET 3.51 0.58 1 33 ALA -0.14 -1.33 1 34 LYS 6.07 -0.95 1 35 LYS 1.76 -1.04 1 36 GLU -4.03 -0.69 1 37 TRP -3.10 -3.24 1 38 LYS -3.22 -1.92 1 39 VAL 1.95 0.66 1 41 LEU 1.21 -0.88 1 43 ILE -2.31 -0.89 1 45 GLN -1.35 -0.50 1 48 PHE 0.13 -0.03 1 51 ILE -2.13 -1.62 1 52 TYR -4.98 0.09 1 53 LEU 0.90 -1.67 1 54 ALA -4.16 -3.92 1 55 ASP -6.05 -1.13 1 56 MET 2.01 0.06 1 57 ASN 1.95 -1.23 1 59 SER 1.82 0.22 1 60 GLU -1.41 0.28 1 61 SER 0.10 1.74 1 62 VAL 2.80 0.70 1 64 SER 2.42 0.32 1 65 ASP -0.28 -1.16 1 66 ALA -0.33 0.52 1 69 VAL -5.72 -2.47 1 70 VAL -5.67 -2.94 1 71 LYS -2.25 -1.12 1 72 VAL -3.83 -1.19 1 73 GLU -4.13 -1.35 1 75 SER 1.22 -0.55 1 76 ASP 0.67 -0.35 1 77 ASN 0.20 -0.40 1 80 LEU 4.66 1.02 1 81 PHE 3.88 1.76 1 82 THR 6.20 2.79 1 83 GLU 3.78 1.42 1 84 LEU 4.04 0.25 1 85 LYS 4.64 2.28 1 86 PHE 4.92 0.37 1 87 TYR 6.36 1.97 1 88 GLN 3.11 1.14 1 89 ARG 1.68 1.08 1 90 ALA -2.21 -1.96 1 91 ALA -3.07 -1.87 1 94 GLU 4.33 2.76 1 95 GLN 2.72 3.16 1 96 ILE 4.33 1.51 1 97 GLN 4.28 2.65 1 98 LYS 4.38 2.06 1 99 TRP 3.63 1.49 1 100 ILE 5.83 1.98 1 101 ARG 4.02 3.40 1 102 THR 4.71 1.43 1 103 ARG 1.27 -1.81 1 104 LYS 5.60 -0.48 1 105 LEU -2.57 -0.23 1 106 LYS 3.07 0.64 1 107 TYR -2.88 -5.77 1 108 LEU -3.95 -1.53 1 110 VAL -2.85 -1.52 1 112 LYS 0.79 -0.87 1 114 TRP -0.79 0.21 1 116 SER -2.89 -3.08 1 118 LEU -4.79 -1.18 1 119 HIS -5.27 -0.69 1 120 ASP -2.06 -1.03 1 121 LYS -1.80 -0.62 1 122 ASN 2.30 -0.34 1 124 LYS -2.98 -2.45 1 125 SER -1.40 -0.41 1 126 TYR -1.90 -0.96 1 127 ARG -2.33 -2.22 1 128 PHE -6.35 -2.51 1 129 MET -5.99 -3.56 1 130 ILE 0.35 -1.48 1 131 MET -6.07 -1.51 1 132 ASP 0.05 -3.91 1 133 ARG -1.30 -1.82 1 134 PHE -3.64 0.05 1 136 SER 0.20 -0.96 1 137 ASP -3.60 1.34 1 138 LEU 2.51 1.03 1 139 GLN 6.45 1.99 1 140 LYS 3.93 3.19 1 141 ILE 3.84 0.87 1 142 TYR 3.44 3.03 1 143 GLU 4.47 3.27 1 144 ALA 3.31 0.20 1 145 ASN -0.41 -1.43 1 146 ALA 4.06 -2.20 1 147 LYS 5.85 -2.23 1 148 ARG -4.22 -0.87 1 149 PHE -7.26 -0.28 1 150 SER -1.64 -1.08 1 151 ARG 4.50 0.93 1 152 LYS 4.61 0.44 1 153 THR 6.38 1.40 1 154 VAL 7.58 2.25 1 155 LEU 5.47 0.91 1 156 GLN 3.96 3.62 1 157 LEU 2.17 1.29 1 160 ARG 2.16 4.18 1 161 ILE 6.19 1.39 1 162 LEU 5.02 1.59 1 163 ASP 5.25 2.09 1 165 LEU 2.65 -0.74 1 166 GLU 4.19 0.96 1 167 TYR 5.82 3.59 1 171 HIS 4.01 -1.25 1 172 GLU 5.52 -2.74 1 173 TYR -5.18 -1.01 1 174 VAL -3.33 -1.32 1 175 HIS 1.92 3.56 1 177 ASP 0.23 -1.76 1 178 ILE 3.52 -3.29 1 179 LYS -1.00 0.04 1 180 ALA 7.02 0.39 1 181 SER 4.07 -1.19 1 182 ASN -1.13 -3.12 1 183 LEU -2.59 -3.92 1 184 LEU -4.07 -0.92 1 185 LEU -1.09 0.29 1 186 ASN 0.25 0.71 1 187 TYR 3.30 -0.55 1 188 LYS -0.49 -0.49 1 189 ASN -1.25 -1.24 1 191 ASP 0.04 -1.49 1 192 GLN -0.61 -3.01 1 193 VAL -4.36 -3.38 1 194 TYR -4.42 -2.34 1 195 LEU -3.58 -2.05 1 196 VAL -3.73 -2.42 1 197 ASP 3.78 -2.51 1 198 TYR 0.33 1.17 1 200 LEU -0.55 -1.08 1 201 ALA 0.89 -0.68 1 202 TYR -4.14 -2.12 1 203 ARG 1.21 -2.59 1 204 TYR 0.75 -2.81 1 207 GLU 3.41 -0.63 1 209 VAL 0.77 -1.46 1 211 LYS 1.33 1.05 1 212 GLU -0.81 0.61 1 213 TYR 3.78 -1.18 1 214 LYS -1.47 -2.84 1 215 GLU 0.15 -1.28 1 216 ASP -3.17 -0.27 1 218 LYS 1.92 0.65 1 219 ARG -0.51 -0.82 1 221 HIS 2.67 -0.28 1 222 ASP 1.03 -0.88 1 224 THR 3.48 2.38 1 225 ILE 4.01 -1.04 1 226 GLU 6.17 -0.48 1 227 PHE -3.55 -1.39 1 228 THR 2.21 -0.64 1 229 SER -2.15 0.20 1 230 ILE 7.32 1.60 1 231 ASP 5.05 1.27 1 233 HIS 5.28 1.68 1 234 ASN 0.06 0.11 1 236 VAL -1.41 -0.88 1 237 ALA 1.92 -0.88 1 240 ARG 5.30 3.25 1 241 ARG 4.81 0.72 1 243 ASP 2.97 1.47 1 244 LEU 2.96 2.57 1 245 GLU 2.07 0.25 1 246 ILE 3.94 2.88 1 247 LEU 4.01 0.00 1 249 TYR 2.66 3.36 1 251 MET 4.64 1.94 1 252 ILE 5.48 2.88 1 253 GLN 4.17 4.61 1 254 TRP -1.22 0.98 1 255 LEU -0.18 2.38 1 256 THR -2.03 0.95 1 258 HIS -4.09 -1.91 1 259 LEU -2.99 1.59 1 261 TRP 1.32 -0.15 1 262 GLU 1.94 -1.60 1 263 ASP 1.98 -0.04 1 264 ASN 0.70 -1.70 1 265 LEU 2.95 -0.57 1 266 LYS 1.77 -1.42 1 267 ASP -3.11 -1.36 1 269 LYS 4.88 1.12 1 270 TYR 3.98 2.75 1 271 VAL 7.35 -0.27 1 272 ARG 4.88 0.52 1 273 ASP 4.68 2.85 1 274 SER 4.12 0.44 1 275 LYS 5.46 3.44 1 276 ILE 6.02 1.93 1 277 ARG 4.77 3.40 1 278 TYR 4.52 -0.08 1 279 ARG 3.35 1.20 1 280 GLU 1.81 -0.09 1 281 ASN -1.05 -0.60 1 282 ILE 4.48 2.08 1 283 ALA 5.01 2.77 1 284 SER 3.41 2.87 1 285 LEU 5.62 0.84 1 286 MET 4.20 2.57 1 287 ASP 2.86 1.25 1 288 LYS 1.65 1.73 1 290 PHE -0.30 -2.44 1 292 GLU 0.76 -0.63 1 293 LYS 2.76 0.67 1 294 ASN 0.49 -1.39 1 295 LYS 0.17 0.27 1 298 GLU 4.58 0.71 1 299 ILE 4.45 1.20 1 300 ALA 4.85 1.48 1 301 LYS 3.82 3.29 1 302 TYR 5.45 0.72 1 303 MET 3.91 3.42 1 304 GLU 2.80 1.48 1 305 THR 7.00 2.35 1 306 VAL 5.47 1.67 1 307 LYS 3.32 -0.64 1 308 LEU 0.17 0.65 1 309 LEU -0.37 0.14 1 310 ASP -1.32 1.53 1 311 TYR 5.47 0.53 1 312 THR -0.96 0.44 1 313 GLU -2.04 -0.76 1 314 LYS -0.25 -1.17 1 316 LEU 1.59 0.04 1 317 TYR 5.43 1.64 1 318 GLU 3.67 1.52 1 319 ASN 3.97 2.75 1 320 LEU 4.15 0.52 1 321 ARG 5.56 1.80 1 322 ASP 3.78 2.54 1 323 ILE 4.61 2.31 1 324 LEU 5.77 2.31 1 325 LEU 4.42 3.17 1 326 GLN 4.99 3.77 1 328 LEU 3.63 1.30 1 329 LYS 4.61 3.94 1 330 ALA 3.77 2.06 1 331 ILE 1.26 0.01 1 333 SER -4.69 -1.77 1 334 LYS -1.84 -2.24 1 335 ASP 1.60 -0.77 1 336 ASP -1.66 1.11 1 338 LYS -0.09 -1.27 1 339 LEU 0.82 -1.58 1 340 ASP 1.40 -0.92 1 341 LEU 0.18 -0.02 1 342 SER -0.12 -0.55 1 343 VAL 0.33 -0.52 1 344 VAL -0.23 -0.64 1 345 GLU -0.58 -1.54 1 346 ASN -1.22 1.82 1 349 LEU 0.85 0.11 1 350 LYS 0.43 -0.28 1 351 ALA -0.08 -0.32 1 352 LYS 0.32 0.03 1 353 THR -0.27 -0.41 1 354 ILE 0.30 -0.25 1 355 THR -1.36 -0.25 1 356 LYS 0.87 0.11 1 stop_ save_