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 bmr25674_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 -3.45 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.26 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.99 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 4.86 _LACS_plot.Y_axis_chem_shift_offset 0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 VAL -6.71 -8.37 0 15 ASN 1.30 -0.64 1 16 TYR -0.76 1.20 1 17 ARG 3.76 2.81 1 18 GLU -1.99 -1.69 1 19 HIS -2.72 0.51 1 21 LYS 1.09 0.43 1 22 LEU -3.75 -2.10 1 24 ALA 7.91 5.23 1 26 LEU 3.30 3.26 1 27 VAL 3.13 1.84 1 28 ASP 6.20 3.95 1 29 VAL 7.44 4.55 1 30 TYR 3.98 4.19 1 31 GLU 3.98 2.80 1 32 LEU 5.79 2.22 1 37 ARG 5.63 4.27 1 38 GLN 4.47 2.62 1 39 LEU 0.35 -1.25 1 40 ASP 4.56 1.76 1 41 PHE 0.43 0.48 1 42 LYS 1.04 -0.54 1 43 VAL -1.35 -0.93 1 49 LEU -5.36 -3.24 1 50 THR -1.29 -0.88 1 51 GLU 5.52 4.08 1 52 TYR 4.03 2.29 1 53 GLU 1.68 1.38 1 54 MET 4.28 4.63 1 56 ASN 4.07 2.64 1 63 LEU 2.42 1.05 1 64 LEU 0.04 -0.70 1 65 LEU 3.42 -1.37 1 66 ASP -3.83 -2.15 1 67 LYS 2.73 1.06 1 69 VAL 2.72 1.85 1 70 TYR -1.52 -3.34 1 80 TYR -4.83 -2.77 1 81 GLU -4.45 -2.78 1 82 ASN -2.36 0.24 1 83 PHE 3.60 0.43 1 85 ASN -5.07 -1.79 1 87 PHE -3.71 -1.17 1 88 MET -3.05 -0.71 1 89 VAL 0.92 0.44 1 91 VAL 4.92 2.18 1 92 ASP 0.50 -2.28 1 93 ALA 0.22 0.45 1 95 ASN -4.52 -2.49 1 97 TYR -0.98 -1.90 1 98 ARG -2.47 -1.92 1 108 ILE 5.83 3.82 1 109 LEU 3.54 2.59 1 110 LYS 5.33 3.36 1 111 LEU 3.85 2.12 1 112 MET 5.11 4.04 1 113 GLN 2.40 1.80 1 114 GLU 0.17 -0.54 1 115 LYS -1.77 -2.80 1 116 GLU 0.03 -1.60 1 117 THR 0.06 -1.21 1 119 LEU 0.10 -0.07 1 120 ASN -2.82 -1.57 1 121 VAL -0.91 -1.64 1 122 PHE -4.79 -5.02 1 123 LEU -5.00 -2.65 1 124 LEU -3.23 -2.71 1 125 ASP -2.57 -2.78 1 126 MET -4.02 -0.93 1 128 ARG -1.45 -0.91 1 134 ASP 0.09 -0.29 1 135 ASP 0.02 -0.49 1 136 THR 0.79 0.34 1 137 ILE 0.78 -0.30 1 139 ILE 1.15 -0.10 1 149 ILE -1.52 -1.61 1 150 VAL -0.80 -0.33 1 151 PHE -5.00 -3.11 1 153 TYR -3.00 -2.16 1 154 ALA -2.04 -2.49 1 159 ALA 0.59 -0.14 1 160 GLU 1.13 0.13 1 161 ALA 0.47 -0.17 1 162 PHE 0.91 -0.21 1 163 GLU -0.11 -0.43 1 164 ILE 1.26 0.09 1 165 GLN 0.93 -0.07 1 169 LEU 0.39 -1.14 1 170 ALA -2.55 -1.48 1 171 ASN -2.03 1.17 1 173 ILE 5.31 3.00 1 175 MET 4.53 -0.71 1 176 LYS 5.54 3.24 1 177 PHE 2.00 2.14 1 178 LEU 3.32 2.30 1 179 LYS 5.41 3.08 1 180 ASP 1.90 1.08 1 181 ARG -0.83 -0.51 1 182 LEU 2.44 2.14 1 183 LEU 1.54 -1.30 1 184 GLU -0.20 -0.03 1 185 ASP 0.84 -1.95 1 186 LYS -5.05 -2.29 1 187 LYS 0.60 0.27 1 188 ILE 2.76 0.49 1 189 THR 6.55 2.81 1 190 VAL 4.71 2.68 1 191 LEU 3.62 3.28 1 192 LEU 4.63 2.37 1 193 ASP 4.47 3.09 1 194 GLU 4.64 2.59 1 195 VAL 6.49 3.93 1 196 ALA 4.65 2.55 1 197 GLU 3.60 2.05 1 198 ASP 4.56 2.86 1 199 MET 3.51 3.35 1 201 LYS 0.84 -0.03 1 208 LYS 0.05 -0.41 1 209 GLN 1.18 0.13 1 211 LEU -2.24 -0.83 1 212 GLU -3.98 -2.21 1 213 ILE -3.06 -2.16 1 214 ARG -3.81 -2.62 1 215 SER -2.83 -1.16 1 220 LYS 3.75 0.59 1 221 ARG -3.31 -1.43 1 222 ALA -7.26 -2.44 1 223 LEU 4.75 1.92 1 224 THR 0.09 -0.99 1 225 ASP 4.57 1.44 1 227 ILE -0.58 -1.14 1 228 GLN -0.25 0.05 1 230 THR 0.48 -0.02 1 234 ALA 2.20 1.03 1 235 GLU 1.91 0.86 1 236 SER 1.76 0.89 1 237 LEU 2.39 0.24 1 238 VAL 4.89 2.98 1 239 ARG 3.98 2.14 1 241 LEU 3.78 2.04 1 242 GLN 4.40 2.50 1 244 ALA 2.47 1.25 1 245 LYS 2.02 0.22 1 246 ALA 2.22 0.74 1 247 HIS -1.90 -0.10 1 248 GLU -0.16 -0.49 1 249 LEU -1.21 -0.83 1 251 GLU -0.46 -0.77 1 252 SER 1.28 0.78 1 253 MET -5.03 -1.06 1 255 LEU -1.79 -1.46 1 256 LYS -0.96 -1.38 1 257 PHE -2.05 -0.99 1 258 ASP 4.78 3.39 1 261 VAL 1.18 0.21 1 262 GLN -3.43 -2.01 1 263 ILE -5.10 -3.61 1 264 GLN -2.32 -1.54 1 265 LEU -3.48 -1.97 1 267 PHE -6.26 -2.14 1 268 ALA -5.27 -1.71 1 269 ALA -2.95 -1.21 1 278 TYR -6.42 -4.52 1 279 THR -4.31 -3.24 1 280 SER -3.09 -1.71 1 281 ILE 2.85 -0.14 1 282 VAL 1.03 0.21 1 283 TYR -1.58 0.84 1 284 LYS -2.65 -2.49 1 287 GLU 3.52 1.27 1 288 ILE 1.57 -0.96 1 289 ILE 0.68 -0.09 1 290 MET -2.03 -0.87 1 292 ASP -4.06 -0.58 1 293 ALA -4.86 -3.02 1 294 TYR -2.83 -2.38 1 295 VAL -2.56 -3.00 1 296 THR -2.44 -2.27 1 297 ASP 3.87 0.87 1 298 PHE 3.50 2.09 1 300 LEU 4.27 2.44 1 301 ASP 1.93 1.72 1 302 LEU 1.29 -0.43 1 303 ASP 1.89 0.21 1 304 ILE -0.08 -2.45 1 305 ASP -2.77 -1.63 1 307 LYS 4.53 1.91 1 308 ASP 0.17 0.11 1 309 ALA -4.69 -2.13 1 310 ASN 3.26 1.57 1 311 LYS -4.26 -3.80 1 313 THR -2.37 -1.41 1 315 GLU 7.36 4.36 1 316 GLU 0.81 1.84 1 317 THR -1.02 -0.52 1 319 SER -0.71 -2.76 1 320 TYR -1.74 -0.41 1 321 LEU 2.62 0.91 1 322 VAL -0.79 -2.06 1 324 LYS 3.83 1.42 1 325 ASP -0.30 0.03 1 326 LEU -0.16 -1.29 1 328 LYS -0.38 -0.88 1 329 HIS 3.93 1.45 1 331 LEU -2.37 -1.54 1 332 TYR -3.02 -0.66 1 333 THR -1.24 1.05 1 334 ARG -1.49 -1.00 1 335 LEU -0.96 -2.04 1 336 SER -1.24 -0.99 1 338 LEU 2.68 2.29 1 339 GLN 6.32 1.50 1 340 LYS 1.17 0.30 1 341 LEU 0.44 -0.02 1 342 LYS 1.13 0.26 1 343 GLU -3.10 -2.61 1 345 LEU 3.59 0.11 1 346 VAL -3.61 -3.10 1 351 LEU -4.62 -2.50 1 352 SER -2.43 -2.34 1 353 TYR -3.18 -2.37 1 354 GLN -5.30 -1.94 1 355 TYR -0.74 0.00 1 356 SER 2.12 0.95 1 358 LEU -1.63 -1.45 1 359 GLU 0.53 0.21 1 360 ASP -0.75 -0.42 1 361 THR 0.62 0.22 1 362 VAL -0.88 -1.47 1 363 GLU -5.48 -2.70 1 364 ASP -5.39 -1.79 1 365 LYS -3.23 -0.87 1 366 GLN -3.86 -0.95 1 367 GLU -1.71 -0.81 1 368 VAL -2.47 -2.02 1 369 ASN -2.57 -2.33 1 370 VAL -0.43 -3.22 1 372 LYS -0.51 -1.39 1 374 LEU 3.95 0.46 1 375 ILE -1.49 -2.58 1 376 ALA 3.06 0.90 1 377 LYS 2.85 1.45 1 378 LEU 1.56 0.17 1 379 ASP 2.40 0.24 1 380 MET 3.19 2.57 1 381 HIS 0.39 0.96 1 382 ARG 2.66 0.27 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25674_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 3.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.74 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.01 _LACS_plot.Line_2_terminator_val_x_2 7.90 _LACS_plot.Line_2_terminator_val_y_2 -3.04 _LACS_plot.Y_axis_chem_shift_offset 0.58 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 44 VAL -6.71 -1.66 0 15 ASN 1.30 -1.94 1 16 TYR -0.76 1.96 1 17 ARG 3.76 -0.95 1 18 GLU -1.99 0.30 1 19 HIS -2.72 3.23 1 21 LYS 1.09 -0.66 1 22 LEU -3.75 1.65 1 24 ALA 7.91 -2.68 1 26 LEU 3.30 -0.04 1 27 VAL 3.13 -1.29 1 28 ASP 6.20 -2.25 1 29 VAL 7.44 -2.89 1 30 TYR 3.98 0.21 1 31 GLU 3.98 -1.18 1 32 LEU 5.79 -3.57 1 37 ARG 5.63 -1.36 1 38 GLN 4.47 -1.85 1 39 LEU 0.35 -1.60 1 40 ASP 4.56 -2.80 1 41 PHE 0.43 0.05 1 42 LYS 1.04 -1.58 1 43 VAL -1.35 0.42 1 49 LEU -5.36 2.12 1 50 THR -1.29 0.41 1 51 GLU 5.52 -1.44 1 52 TYR 4.03 -1.74 1 53 GLU 1.68 -0.30 1 54 MET 4.28 0.35 1 56 ASN 4.07 -1.43 1 63 LEU 2.42 -1.37 1 64 LEU 0.04 -0.74 1 65 LEU 3.42 -4.79 1 66 ASP -3.83 1.68 1 67 LYS 2.73 -1.67 1 69 VAL 2.72 -0.87 1 70 TYR -1.52 -1.82 1 80 TYR -4.83 2.06 1 81 GLU -4.45 1.67 1 82 ASN -2.36 2.60 1 83 PHE 3.60 -3.17 1 85 ASN -5.07 3.28 1 87 PHE -3.71 2.54 1 88 MET -3.05 2.34 1 89 VAL 0.92 -0.48 1 91 VAL 4.92 -2.74 1 92 ASP 0.50 -2.78 1 93 ALA 0.22 0.23 1 95 ASN -4.52 2.03 1 97 TYR -0.98 -0.92 1 98 ARG -2.47 0.55 1 108 ILE 5.83 -2.01 1 109 LEU 3.54 -0.95 1 110 LYS 5.33 -1.97 1 111 LEU 3.85 -1.73 1 112 MET 5.11 -1.07 1 113 GLN 2.40 -0.60 1 114 GLU 0.17 -0.71 1 115 LYS -1.77 -1.03 1 116 GLU 0.03 -1.63 1 117 THR 0.06 -1.27 1 119 LEU 0.10 -0.17 1 120 ASN -2.82 1.25 1 121 VAL -0.91 -0.73 1 122 PHE -4.79 -0.23 1 123 LEU -5.00 2.35 1 124 LEU -3.23 0.52 1 125 ASP -2.57 -0.21 1 126 MET -4.02 3.09 1 128 ARG -1.45 0.54 1 134 ASP 0.09 -0.38 1 135 ASP 0.02 -0.51 1 136 THR 0.79 -0.45 1 137 ILE 0.78 -1.08 1 139 ILE 1.15 -1.25 1 149 ILE -1.52 -0.09 1 150 VAL -0.80 0.47 1 151 PHE -5.00 1.89 1 153 TYR -3.00 0.84 1 154 ALA -2.04 -0.45 1 159 ALA 0.59 -0.73 1 160 GLU 1.13 -1.00 1 161 ALA 0.47 -0.64 1 162 PHE 0.91 -1.12 1 163 GLU -0.11 -0.32 1 164 ILE 1.26 -1.17 1 165 GLN 0.93 -1.00 1 169 LEU 0.39 -1.53 1 170 ALA -2.55 1.07 1 171 ASN -2.03 3.20 1 173 ILE 5.31 -2.31 1 175 MET 4.53 -5.24 1 176 LYS 5.54 -2.30 1 177 PHE 2.00 0.14 1 178 LEU 3.32 -1.02 1 179 LYS 5.41 -2.33 1 180 ASP 1.90 -0.82 1 181 ARG -0.83 0.32 1 182 LEU 2.44 -0.30 1 183 LEU 1.54 -2.84 1 184 GLU -0.20 0.17 1 185 ASP 0.84 -2.79 1 186 LYS -5.05 2.76 1 187 LYS 0.60 -0.33 1 188 ILE 2.76 -2.27 1 189 THR 6.55 -3.74 1 190 VAL 4.71 -2.03 1 191 LEU 3.62 -0.34 1 192 LEU 4.63 -2.26 1 193 ASP 4.47 -1.38 1 194 GLU 4.64 -2.05 1 195 VAL 6.49 -2.56 1 196 ALA 4.65 -2.10 1 197 GLU 3.60 -1.55 1 198 ASP 4.56 -1.70 1 199 MET 3.51 -0.16 1 201 LYS 0.84 -0.87 1 208 LYS 0.05 -0.46 1 209 GLN 1.18 -1.05 1 211 LEU -2.24 1.41 1 212 GLU -3.98 1.77 1 213 ILE -3.06 0.90 1 214 ARG -3.81 1.19 1 215 SER -2.83 1.67 1 220 LYS 3.75 -3.16 1 221 ARG -3.31 1.88 1 222 ALA -7.26 4.82 1 223 LEU 4.75 -2.83 1 224 THR 0.09 -1.08 1 225 ASP 4.57 -3.13 1 227 ILE -0.58 -0.56 1 228 GLN -0.25 0.30 1 230 THR 0.48 -0.50 1 234 ALA 2.20 -1.17 1 235 GLU 1.91 -1.05 1 236 SER 1.76 -0.87 1 237 LEU 2.39 -2.15 1 238 VAL 4.89 -1.91 1 239 ARG 3.98 -1.84 1 241 LEU 3.78 -1.74 1 242 GLN 4.40 -1.90 1 244 ALA 2.47 -1.22 1 245 LYS 2.02 -1.80 1 246 ALA 2.22 -1.48 1 247 HIS -1.90 1.80 1 248 GLU -0.16 -0.33 1 249 LEU -1.21 0.38 1 251 GLU -0.46 -0.31 1 252 SER 1.28 -0.50 1 253 MET -5.03 3.97 1 255 LEU -1.79 0.33 1 256 LYS -0.96 -0.42 1 257 PHE -2.05 1.06 1 258 ASP 4.78 -1.39 1 261 VAL 1.18 -0.97 1 262 GLN -3.43 1.42 1 263 ILE -5.10 1.49 1 264 GLN -2.32 0.78 1 265 LEU -3.48 1.51 1 267 PHE -6.26 4.12 1 268 ALA -5.27 3.56 1 269 ALA -2.95 1.74 1 278 TYR -6.42 1.90 1 279 THR -4.31 1.07 1 280 SER -3.09 1.38 1 281 ILE 2.85 -2.99 1 282 VAL 1.03 -0.82 1 283 TYR -1.58 2.42 1 284 LYS -2.65 0.16 1 287 GLU 3.52 -2.25 1 288 ILE 1.57 -2.53 1 289 ILE 0.68 -0.77 1 290 MET -2.03 1.16 1 292 ASP -4.06 3.48 1 293 ALA -4.86 1.84 1 294 TYR -2.83 0.45 1 295 VAL -2.56 -0.44 1 296 THR -2.44 0.17 1 297 ASP 3.87 -3.00 1 298 PHE 3.50 -1.41 1 300 LEU 4.27 -1.83 1 301 ASP 1.93 -0.21 1 302 LEU 1.29 -1.72 1 303 ASP 1.89 -1.68 1 304 ILE -0.08 -2.37 1 305 ASP -2.77 1.14 1 307 LYS 4.53 -2.62 1 308 ASP 0.17 -0.06 1 309 ALA -4.69 2.56 1 310 ASN 3.26 -1.69 1 311 LYS -4.26 0.46 1 313 THR -2.37 0.96 1 315 GLU 7.36 -3.00 1 316 GLU 0.81 1.03 1 317 THR -1.02 0.50 1 319 SER -0.71 -2.05 1 320 TYR -1.74 1.33 1 321 LEU 2.62 -1.71 1 322 VAL -0.79 -1.27 1 324 LYS 3.83 -2.41 1 325 ASP -0.30 0.33 1 326 LEU -0.16 -1.13 1 328 LYS -0.38 -0.50 1 329 HIS 3.93 -2.48 1 331 LEU -2.37 0.83 1 332 TYR -3.02 2.36 1 333 THR -1.24 2.29 1 334 ARG -1.49 0.49 1 335 LEU -0.96 -1.08 1 336 SER -1.24 0.25 1 338 LEU 2.68 -0.39 1 339 GLN 6.32 -4.82 1 340 LYS 1.17 -0.87 1 341 LEU 0.44 -0.46 1 342 LYS 1.13 -0.87 1 343 GLU -3.10 0.49 1 345 LEU 3.59 -3.48 1 346 VAL -3.61 0.51 1 351 LEU -4.62 2.12 1 352 SER -2.43 0.09 1 353 TYR -3.18 0.81 1 354 GLN -5.30 3.36 1 355 TYR -0.74 0.74 1 356 SER 2.12 -1.17 1 358 LEU -1.63 0.18 1 359 GLU 0.53 -0.32 1 360 ASP -0.75 0.33 1 361 THR 0.62 -0.40 1 362 VAL -0.88 -0.59 1 363 GLU -5.48 2.78 1 364 ASP -5.39 3.60 1 365 LYS -3.23 2.36 1 366 GLN -3.86 2.91 1 367 GLU -1.71 0.90 1 368 VAL -2.47 0.45 1 369 ASN -2.57 0.24 1 370 VAL -0.43 -2.79 1 372 LYS -0.51 -0.88 1 374 LEU 3.95 -3.49 1 375 ILE -1.49 -1.09 1 376 ALA 3.06 -2.16 1 377 LYS 2.85 -1.40 1 378 LEU 1.56 -1.39 1 379 ASP 2.40 -2.16 1 380 MET 3.19 -0.62 1 381 HIS 0.39 0.57 1 382 ARG 2.66 -2.39 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr25674_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 -2.74 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.27 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.10 _LACS_plot.Line_2_terminator_val_x_2 7.43 _LACS_plot.Line_2_terminator_val_y_2 2.17 _LACS_plot.Y_axis_chem_shift_offset 0.39 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 345 LEU 3.59 -5.88 0 15 ASN 1.30 -0.47 1 16 TYR -0.76 0.24 1 17 ARG 3.76 2.42 1 18 GLU -1.99 -2.35 1 19 HIS -2.72 -0.60 1 21 LYS 1.09 0.63 1 26 LEU 3.30 -1.16 1 27 VAL 3.13 1.79 1 28 ASP 6.20 2.38 1 29 VAL 7.44 2.89 1 30 TYR 3.98 1.74 1 31 GLU 3.98 3.45 1 37 ARG 5.63 4.64 1 38 GLN 4.47 1.09 1 39 LEU 0.35 -2.97 1 40 ASP 4.56 -0.69 1 41 PHE 0.43 1.28 1 42 LYS 1.04 -1.07 1 43 VAL -1.35 -2.70 1 49 LEU -5.36 0.25 1 50 THR -1.29 0.70 1 51 GLU 5.52 1.26 1 52 TYR 4.03 1.85 1 53 GLU 1.68 3.00 1 54 MET 4.28 1.11 1 56 ASN 4.07 1.50 1 63 LEU 2.42 0.96 1 64 LEU 0.04 0.57 1 65 LEU 3.42 -3.02 1 66 ASP -3.83 -1.34 1 67 LYS 2.73 1.98 1 69 VAL 2.72 -1.04 1 70 TYR -1.52 -1.83 1 80 TYR -4.83 -3.06 1 81 GLU -4.45 -1.50 1 82 ASN -2.36 -1.00 1 83 PHE 3.60 -0.28 1 85 ASN -5.07 -1.89 1 87 PHE -3.71 -0.52 1 88 MET -3.05 -0.35 1 89 VAL 0.92 -1.10 1 91 VAL 4.92 0.86 1 92 ASP 0.50 -1.18 1 93 ALA 0.22 0.00 1 95 ASN -4.52 0.20 1 97 TYR -0.98 0.06 1 108 ILE 5.83 1.62 1 110 LYS 5.33 2.76 1 111 LEU 3.85 3.51 1 112 MET 5.11 2.09 1 113 GLN 2.40 -0.11 1 114 GLU 0.17 0.08 1 115 LYS -1.77 -0.13 1 116 GLU 0.03 0.22 1 117 THR 0.06 1.13 1 119 LEU 0.10 -3.73 1 120 ASN -2.82 -1.45 1 121 VAL -0.91 -2.89 1 122 PHE -4.79 -2.71 1 123 LEU -5.00 -4.06 1 124 LEU -3.23 -3.67 1 125 ASP -2.57 -0.88 1 126 MET -4.02 -0.58 1 128 ARG -1.45 -0.90 1 135 ASP 0.02 0.20 1 136 THR 0.79 -0.04 1 137 ILE 0.78 -0.60 1 149 ILE -1.52 -1.03 1 150 VAL -0.80 -4.18 1 151 PHE -5.00 -2.36 1 153 TYR -3.00 -2.52 1 159 ALA 0.59 0.11 1 160 GLU 1.13 -0.20 1 161 ALA 0.47 -0.40 1 162 PHE 0.91 -0.10 1 163 GLU -0.11 -0.16 1 164 ILE 1.26 0.00 1 165 GLN 0.93 0.00 1 169 LEU 0.39 -1.83 1 170 ALA -2.55 -1.42 1 171 ASN -2.03 2.23 1 175 MET 4.53 1.58 1 176 LYS 5.54 1.58 1 177 PHE 2.00 2.30 1 178 LEU 3.32 2.28 1 179 LYS 5.41 0.32 1 180 ASP 1.90 0.66 1 181 ARG -0.83 0.50 1 182 LEU 2.44 -2.37 1 183 LEU 1.54 -0.15 1 184 GLU -0.20 -0.21 1 185 ASP 0.84 -0.84 1 186 LYS -5.05 -2.90 1 187 LYS 0.60 2.93 1 188 ILE 2.76 -1.21 1 189 THR 6.55 1.47 1 190 VAL 4.71 1.49 1 191 LEU 3.62 1.78 1 192 LEU 4.63 0.60 1 193 ASP 4.47 3.50 1 194 GLU 4.64 2.80 1 195 VAL 6.49 1.46 1 196 ALA 4.65 3.25 1 197 GLU 3.60 2.80 1 198 ASP 4.56 3.28 1 199 MET 3.51 2.36 1 201 LYS 0.84 0.15 1 208 LYS 0.05 -0.92 1 211 LEU -2.24 -3.67 1 212 GLU -3.98 -1.89 1 213 ILE -3.06 0.62 1 214 ARG -3.81 -1.75 1 215 SER -2.83 -0.90 1 220 LYS 3.75 -1.86 1 221 ARG -3.31 -2.65 1 222 ALA -7.26 0.04 1 223 LEU 4.75 -0.89 1 224 THR 0.09 0.93 1 225 ASP 4.57 -1.60 1 227 ILE -0.58 0.86 1 228 GLN -0.25 -0.43 1 234 ALA 2.20 1.01 1 235 GLU 1.91 0.96 1 236 SER 1.76 0.48 1 237 LEU 2.39 0.08 1 238 VAL 4.89 2.10 1 239 ARG 3.98 2.10 1 242 GLN 4.40 2.04 1 244 ALA 2.47 1.38 1 245 LYS 2.02 0.96 1 246 ALA 2.22 -2.80 1 247 HIS -1.90 1.32 1 248 GLU -0.16 -0.87 1 249 LEU -1.21 -0.80 1 251 GLU -0.46 0.00 1 252 SER 1.28 -0.34 1 253 MET -5.03 -2.51 1 255 LEU -1.79 -2.32 1 256 LYS -0.96 -0.63 1 257 PHE -2.05 2.52 1 258 ASP 4.78 1.40 1 261 VAL 1.18 -1.62 1 262 GLN -3.43 -0.53 1 263 ILE -5.10 -2.28 1 264 GLN -2.32 -1.94 1 265 LEU -3.48 -3.17 1 267 PHE -6.26 -0.67 1 268 ALA -5.27 -2.51 1 269 ALA -2.95 -1.50 1 278 TYR -6.42 -1.54 1 279 THR -4.31 -0.44 1 280 SER -3.09 -0.97 1 281 ILE 2.85 0.11 1 282 VAL 1.03 -0.04 1 283 TYR -1.58 -3.65 1 284 LYS -2.65 -3.30 1 287 GLU 3.52 -0.93 1 288 ILE 1.57 -1.66 1 289 ILE 0.68 -0.60 1 290 MET -2.03 -2.12 1 292 ASP -4.06 -3.28 1 293 ALA -4.86 -2.09 1 294 TYR -2.83 -1.86 1 295 VAL -2.56 0.35 1 296 THR -2.44 -3.33 1 297 ASP 3.87 -1.43 1 298 PHE 3.50 -0.10 1 300 LEU 4.27 1.99 1 301 ASP 1.93 0.44 1 302 LEU 1.29 -1.32 1 303 ASP 1.89 -1.79 1 304 ILE -0.08 -0.47 1 307 LYS 4.53 0.26 1 308 ASP 0.17 -1.09 1 309 ALA -4.69 -2.48 1 310 ASN 3.26 -0.83 1 311 LYS -4.26 2.10 1 313 THR -2.37 -0.40 1 315 GLU 7.36 3.44 1 316 GLU 0.81 0.94 1 317 THR -1.02 -0.39 1 319 SER -0.71 -1.91 1 320 TYR -1.74 1.24 1 321 LEU 2.62 0.43 1 322 VAL -0.79 0.30 1 324 LYS 3.83 0.13 1 325 ASP -0.30 -0.20 1 326 LEU -0.16 -1.40 1 328 LYS -0.38 -0.47 1 329 HIS 3.93 1.44 1 331 LEU -2.37 0.18 1 332 TYR -3.02 -0.49 1 333 THR -1.24 -2.91 1 334 ARG -1.49 -2.72 1 335 LEU -0.96 -2.62 1 336 SER -1.24 -1.41 1 338 LEU 2.68 0.07 1 339 GLN 6.32 -0.69 1 340 LYS 1.17 -0.28 1 341 LEU 0.44 -0.45 1 342 LYS 1.13 -0.29 1 343 GLU -3.10 -2.57 1 346 VAL -3.61 -1.50 1 351 LEU -4.62 -2.29 1 352 SER -2.43 -0.17 1 353 TYR -3.18 -3.63 1 354 GLN -5.30 -0.50 1 355 TYR -0.74 0.59 1 356 SER 2.12 1.44 1 358 LEU -1.63 -0.27 1 359 GLU 0.53 -0.28 1 360 ASP -0.75 -0.86 1 361 THR 0.62 -1.06 1 362 VAL -0.88 -2.90 1 363 GLU -5.48 -0.55 1 364 ASP -5.39 -1.81 1 365 LYS -3.23 -1.15 1 366 GLN -3.86 -2.33 1 367 GLU -1.71 -0.83 1 368 VAL -2.47 -4.04 1 369 ASN -2.57 1.49 1 370 VAL -0.43 -0.40 1 372 LYS -0.51 -1.80 1 374 LEU 3.95 -0.84 1 375 ILE -1.49 -0.30 1 376 ALA 3.06 0.88 1 377 LYS 2.85 0.77 1 378 LEU 1.56 -1.36 1 379 ASP 2.40 0.88 1 380 MET 3.19 -0.46 1 381 HIS 0.39 2.18 1 stop_ save_