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 bmr27783_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -8.96 _LACS_plot.Line_1_terminator_val_y_1 -3.52 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.24 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.76 _LACS_plot.Line_2_terminator_val_x_2 7.82 _LACS_plot.Line_2_terminator_val_y_2 5.22 _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 398 GLN -0.33 -3.44 0 216 TYR 0.03 -3.61 0 34 SER -3.56 -2.16 1 35 ILE -6.91 -2.61 1 36 GLN -0.59 0.33 1 38 HIS 1.95 2.27 1 40 ALA -5.67 -3.18 1 41 LEU -7.00 -1.37 1 43 THR -3.27 -3.14 1 44 ALA -7.05 -3.02 1 45 ASP -1.51 1.21 1 47 HIS 0.82 2.65 1 48 SER -0.86 0.00 1 50 GLU 0.48 0.47 1 51 VAL 4.24 2.12 1 52 LEU -0.53 0.35 1 53 GLN -7.58 -2.21 1 54 MET -5.10 -1.91 1 55 SER 0.58 0.12 1 56 LEU 3.78 2.35 1 57 ASN 0.85 -0.39 1 58 ALA 4.75 3.63 1 59 ALA 4.68 2.91 1 60 THR 4.72 3.30 1 61 PHE 2.64 2.77 1 62 LEU 0.04 -1.12 1 64 GLN -5.40 -2.59 1 65 GLU 0.53 0.25 1 67 THR 3.89 2.32 1 68 VAL 2.91 1.46 1 69 LEU 2.07 1.99 1 70 ARG 3.72 1.89 1 72 GLN -0.91 -0.58 1 73 THR -3.81 -2.90 1 74 LEU 3.51 1.87 1 75 ALA 3.69 1.83 1 76 ALA 0.44 0.15 1 77 LEU 0.15 1.70 1 78 LEU -2.46 -1.86 1 80 GLU 2.07 1.08 1 81 GLN 3.15 1.83 1 82 TRP 6.87 5.51 1 84 ALA 2.90 1.66 1 85 LEU 4.35 2.57 1 86 GLN 3.16 2.58 1 87 ALA 1.87 0.62 1 88 ALA 0.44 0.99 1 89 LEU -1.72 -2.44 1 95 ASP 2.18 1.40 1 96 ALA -0.61 -1.01 1 97 LEU 0.51 0.10 1 98 GLN -3.92 -2.00 1 99 TYR -2.82 -1.02 1 100 ARG -4.18 -2.32 1 101 ALA -5.04 -1.62 1 102 THR -0.67 -0.69 1 103 LEU -2.54 -1.53 1 104 ASP -0.14 -0.66 1 105 TRP -4.49 -1.99 1 107 ALA 2.62 1.55 1 108 ALA -1.69 0.02 1 110 HIS 0.36 0.96 1 111 LEU -5.17 -2.00 1 112 SER -0.44 -0.86 1 113 LEU -3.75 -2.35 1 114 THR -0.16 0.20 1 115 VAL -3.96 -2.73 1 116 HIS -1.77 0.42 1 117 ARG -4.23 -1.66 1 118 VAL -1.65 -1.85 1 129 THR -1.56 -1.17 1 130 GLU -3.30 -1.53 1 131 ALA 0.76 -0.25 1 132 TRP -1.41 -1.39 1 142 ASN 3.92 2.36 1 143 ALA 3.16 2.00 1 144 MET 4.54 2.60 1 145 SER 4.29 2.78 1 146 ALA 3.71 1.91 1 147 LEU 4.49 2.60 1 148 GLU 3.05 2.07 1 149 SER 0.84 0.43 1 150 ALA -0.22 -2.43 1 157 ALA 3.68 2.42 1 158 GLU 4.08 3.04 1 159 VAL 5.11 3.17 1 160 ALA 4.73 3.38 1 161 THR 5.29 3.45 1 162 GLN 5.13 3.19 1 163 THR 6.30 4.78 1 164 VAL 7.40 4.88 1 166 GLU 4.03 2.76 1 167 LEU 1.27 1.93 1 211 GLN 5.20 1.63 1 212 ALA 4.11 1.12 1 214 ALA 4.09 2.33 1 215 LEU 4.95 3.13 1 217 THR 3.49 2.38 1 218 ARG -0.58 0.35 1 219 HIS -1.22 0.06 1 220 LEU 3.89 2.69 1 221 LEU -2.60 -0.21 1 222 ARG 3.02 -0.52 1 223 LEU -2.49 -0.39 1 224 THR -0.39 -0.14 1 225 ALA 2.88 2.35 1 226 ASP -2.75 -1.74 1 227 THR 3.10 1.20 1 228 ARG 0.39 -0.66 1 229 ALA -0.57 -0.63 1 230 ALA -0.81 -1.32 1 231 ALA -1.51 -1.13 1 232 VAL -1.85 -1.13 1 237 VAL 4.43 2.82 1 238 LEU -0.68 -2.77 1 239 ASN -0.24 -0.81 1 241 GLN 1.89 2.24 1 242 THR -2.68 -1.85 1 243 ASN 2.75 1.23 1 244 ALA -1.53 -0.85 1 248 LEU -2.52 -1.67 1 251 ALA -2.01 -2.78 1 252 VAL 4.61 2.48 1 253 LEU 0.35 -0.63 1 254 ARG 2.99 1.67 1 255 ALA 1.87 1.20 1 256 THR 0.74 -0.14 1 257 SER -1.40 -0.17 1 300 ASP 4.21 2.63 1 301 LEU 2.52 1.20 1 302 ARG 6.70 4.73 1 303 THR 6.01 4.33 1 304 THR 7.40 5.37 1 305 LEU 4.68 2.71 1 306 GLU 4.46 3.48 1 307 TYR 4.68 2.89 1 308 LEU 4.55 2.96 1 310 ARG 5.42 3.60 1 311 GLU 3.43 1.73 1 312 LEU 4.37 2.58 1 337 ARG 4.46 3.36 1 338 VAL 5.99 3.64 1 339 ALA 4.13 2.49 1 340 LEU 3.39 2.24 1 341 ALA 2.34 1.64 1 342 ALA 2.79 0.99 1 343 ALA 2.31 0.91 1 344 HIS 1.41 2.05 1 349 HIS 3.61 5.08 1 350 ASP 2.52 2.18 1 351 THR 4.36 3.62 1 352 LEU 3.89 1.13 1 353 SER -0.28 -0.78 1 354 ASP -1.59 -0.36 1 356 ALA 2.77 1.35 1 357 LEU 1.53 0.57 1 358 ASP 1.83 0.18 1 359 LEU 3.49 2.48 1 360 LEU 4.54 3.64 1 362 LEU 3.44 2.75 1 363 MET -3.61 -3.74 1 364 ARG 4.20 0.79 1 365 ALA -4.67 -1.54 1 368 LEU -5.57 -1.58 1 369 ILE -2.13 -1.25 1 370 LEU -2.19 -1.41 1 371 ARG -2.30 -0.59 1 372 PHE -4.58 -0.79 1 373 GLU 2.69 0.26 1 375 ARG -3.28 -1.74 1 376 TRP -8.20 -4.42 1 377 GLN -4.51 -1.05 1 378 THR -4.20 -2.30 1 379 LEU -4.18 -0.78 1 381 GLU -0.08 -0.86 1 382 VAL -2.53 -2.18 1 387 ALA 1.78 1.35 1 388 VAL 7.83 4.80 1 389 ASP 4.65 3.72 1 390 ALA 4.02 2.30 1 391 LEU 4.11 2.87 1 392 LEU 4.87 2.36 1 393 ALA 3.67 1.60 1 394 TRP 6.99 3.26 1 395 LEU 4.14 1.96 1 396 GLU 1.95 0.87 1 397 THR -0.35 -0.23 1 401 ALA -1.68 -1.49 1 402 LEU -2.03 0.06 1 403 VAL -2.96 -1.16 1 404 GLN -3.10 -2.81 1 405 THR 1.46 -0.50 1 406 ASP -0.19 -1.08 1 407 ALA 0.49 -1.69 1 408 LEU 4.72 3.14 1 410 GLN 2.36 0.78 1 411 LEU -0.12 0.71 1 412 TRP 0.57 -1.50 1 414 ALA 2.82 0.11 1 416 ALA 4.20 2.56 1 417 ASP 1.91 0.79 1 418 LEU 0.39 -1.26 1 419 ALA 4.83 3.69 1 421 SER -1.12 -0.24 1 422 ALA -1.12 -1.87 1 423 ALA 1.63 1.22 1 425 LEU -3.76 -0.33 1 426 LEU 0.08 -0.53 1 427 ALA -8.96 -2.95 1 428 ILE -5.60 -2.89 1 429 SER -0.85 -2.48 1 434 TRP 4.17 0.85 1 435 SER 4.84 3.26 1 436 GLU -2.64 -2.46 1 438 LEU -2.57 -0.68 1 439 VAL -2.61 -1.84 1 440 TRP 0.76 2.22 1 441 LEU -4.63 -2.13 1 442 ARG -6.39 -2.93 1 446 ARG -1.12 -1.05 1 447 LEU -3.52 -1.25 1 448 GLU -3.49 -2.30 1 449 VAL 0.66 -1.29 1 450 ALA 1.24 1.25 1 494 LEU 4.56 2.57 1 495 ARG 7.25 4.52 1 496 ASP 4.90 3.48 1 497 THR 6.02 4.59 1 498 LEU 3.74 2.38 1 499 THR 6.08 4.78 1 501 ALA 1.77 1.19 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27783_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -8.96 _LACS_plot.Line_1_terminator_val_y_1 5.44 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.76 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.24 _LACS_plot.Line_2_terminator_val_x_2 7.82 _LACS_plot.Line_2_terminator_val_y_2 -2.60 _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 398 GLN -0.33 -3.11 0 216 TYR 0.03 -3.64 0 34 SER -3.56 1.40 1 35 ILE -6.91 4.30 1 36 GLN -0.59 0.92 1 38 HIS 1.95 0.32 1 40 ALA -5.67 2.49 1 41 LEU -7.00 5.63 1 43 THR -3.27 0.13 1 44 ALA -7.05 4.03 1 45 ASP -1.51 2.72 1 47 HIS 0.82 1.83 1 48 SER -0.86 0.86 1 50 GLU 0.48 -0.01 1 51 VAL 4.24 -2.12 1 52 LEU -0.53 0.88 1 53 GLN -7.58 5.37 1 54 MET -5.10 3.19 1 55 SER 0.58 -0.46 1 56 LEU 3.78 -1.43 1 57 ASN 0.85 -1.24 1 58 ALA 4.75 -1.12 1 59 ALA 4.68 -1.77 1 60 THR 4.72 -1.42 1 61 PHE 2.64 0.13 1 62 LEU 0.04 -1.16 1 64 GLN -5.40 2.81 1 65 GLU 0.53 -0.28 1 67 THR 3.89 -1.57 1 68 VAL 2.91 -1.45 1 69 LEU 2.07 -0.08 1 70 ARG 3.72 -1.83 1 72 GLN -0.91 0.33 1 73 THR -3.81 0.91 1 74 LEU 3.51 -1.64 1 75 ALA 3.69 -1.86 1 76 ALA 0.44 -0.29 1 77 LEU 0.15 1.55 1 78 LEU -2.46 0.60 1 80 GLU 2.07 -0.99 1 81 GLN 3.15 -1.32 1 82 TRP 6.87 -1.36 1 84 ALA 2.90 -1.24 1 85 LEU 4.35 -1.78 1 86 GLN 3.16 -0.58 1 87 ALA 1.87 -1.25 1 88 ALA 0.44 0.55 1 89 LEU -1.72 -0.72 1 95 ASP 2.18 -0.78 1 96 ALA -0.61 -0.40 1 97 LEU 0.51 -0.41 1 98 GLN -3.92 1.92 1 99 TYR -2.82 1.80 1 100 ARG -4.18 1.86 1 101 ALA -5.04 3.42 1 102 THR -0.67 -0.02 1 103 LEU -2.54 1.01 1 104 ASP -0.14 -0.52 1 105 TRP -4.49 2.50 1 107 ALA 2.62 -1.07 1 108 ALA -1.69 1.71 1 110 HIS 0.36 0.60 1 111 LEU -5.17 3.17 1 112 SER -0.44 -0.42 1 113 LEU -3.75 1.40 1 114 THR -0.16 0.36 1 115 VAL -3.96 1.23 1 116 HIS -1.77 2.19 1 117 ARG -4.23 2.57 1 118 VAL -1.65 -0.20 1 129 THR -1.56 0.39 1 130 GLU -3.30 1.77 1 131 ALA 0.76 -1.01 1 132 TRP -1.41 0.02 1 142 ASN 3.92 -1.56 1 143 ALA 3.16 -1.16 1 144 MET 4.54 -1.94 1 145 SER 4.29 -1.51 1 146 ALA 3.71 -1.80 1 147 LEU 4.49 -1.89 1 148 GLU 3.05 -0.98 1 149 SER 0.84 -0.41 1 150 ALA -0.22 -2.21 1 157 ALA 3.68 -1.26 1 158 GLU 4.08 -1.04 1 159 VAL 5.11 -1.94 1 160 ALA 4.73 -1.35 1 161 THR 5.29 -1.84 1 162 GLN 5.13 -1.94 1 163 THR 6.30 -1.52 1 164 VAL 7.40 -2.52 1 166 GLU 4.03 -1.27 1 167 LEU 1.27 0.66 1 211 GLN 5.20 -3.57 1 212 ALA 4.11 -2.99 1 214 ALA 4.09 -1.76 1 215 LEU 4.95 -1.82 1 217 THR 3.49 -1.11 1 218 ARG -0.58 0.93 1 219 HIS -1.22 1.28 1 220 LEU 3.89 -1.20 1 221 LEU -2.60 2.39 1 222 ARG 3.02 -3.54 1 223 LEU -2.49 2.10 1 224 THR -0.39 0.25 1 225 ALA 2.88 -0.53 1 226 ASP -2.75 1.01 1 227 THR 3.10 -1.90 1 228 ARG 0.39 -1.05 1 229 ALA -0.57 -0.06 1 230 ALA -0.81 -0.51 1 231 ALA -1.51 0.38 1 232 VAL -1.85 0.72 1 237 VAL 4.43 -1.61 1 238 LEU -0.68 -2.09 1 239 ASN -0.24 -0.57 1 241 GLN 1.89 0.35 1 242 THR -2.68 0.83 1 243 ASN 2.75 -1.52 1 244 ALA -1.53 0.68 1 248 LEU -2.52 0.85 1 251 ALA -2.01 -0.77 1 252 VAL 4.61 -2.13 1 253 LEU 0.35 -0.98 1 254 ARG 2.99 -1.32 1 255 ALA 1.87 -0.67 1 256 THR 0.74 -0.88 1 257 SER -1.40 1.23 1 300 ASP 4.21 -1.58 1 301 LEU 2.52 -1.32 1 302 ARG 6.70 -1.97 1 303 THR 6.01 -1.68 1 304 THR 7.40 -2.03 1 305 LEU 4.68 -1.97 1 306 GLU 4.46 -0.98 1 307 TYR 4.68 -1.79 1 308 LEU 4.55 -1.59 1 310 ARG 5.42 -1.82 1 311 GLU 3.43 -1.70 1 312 LEU 4.37 -1.79 1 337 ARG 4.46 -1.10 1 338 VAL 5.99 -2.35 1 339 ALA 4.13 -1.64 1 340 LEU 3.39 -1.15 1 341 ALA 2.34 -0.70 1 342 ALA 2.79 -1.80 1 343 ALA 2.31 -1.40 1 344 HIS 1.41 0.64 1 349 HIS 3.61 1.47 1 350 ASP 2.52 -0.34 1 351 THR 4.36 -0.74 1 352 LEU 3.89 -2.76 1 353 SER -0.28 -0.50 1 354 ASP -1.59 1.23 1 356 ALA 2.77 -1.42 1 357 LEU 1.53 -0.96 1 358 ASP 1.83 -1.65 1 359 LEU 3.49 -1.01 1 360 LEU 4.54 -0.90 1 362 LEU 3.44 -0.69 1 363 MET -3.61 -0.13 1 364 ARG 4.20 -3.41 1 365 ALA -4.67 3.13 1 368 LEU -5.57 3.99 1 369 ILE -2.13 0.88 1 370 LEU -2.19 0.78 1 371 ARG -2.30 1.71 1 372 PHE -4.58 3.79 1 373 GLU 2.69 -2.43 1 375 ARG -3.28 1.54 1 376 TRP -8.20 3.78 1 377 GLN -4.51 3.46 1 378 THR -4.20 1.90 1 379 LEU -4.18 3.40 1 381 GLU -0.08 -0.78 1 382 VAL -2.53 0.35 1 387 ALA 1.78 -0.43 1 388 VAL 7.83 -3.03 1 389 ASP 4.65 -0.93 1 390 ALA 4.02 -1.72 1 391 LEU 4.11 -1.24 1 392 LEU 4.87 -2.51 1 393 ALA 3.67 -2.07 1 394 TRP 6.99 -3.73 1 395 LEU 4.14 -2.18 1 396 GLU 1.95 -1.08 1 397 THR -0.35 0.12 1 401 ALA -1.68 0.19 1 402 LEU -2.03 2.09 1 403 VAL -2.96 1.80 1 404 GLN -3.10 0.29 1 405 THR 1.46 -1.96 1 406 ASP -0.19 -0.89 1 407 ALA 0.49 -2.18 1 408 LEU 4.72 -1.58 1 410 GLN 2.36 -1.58 1 411 LEU -0.12 0.83 1 412 TRP 0.57 -2.07 1 414 ALA 2.82 -2.71 1 416 ALA 4.20 -1.64 1 417 ASP 1.91 -1.12 1 418 LEU 0.39 -1.65 1 419 ALA 4.83 -1.14 1 421 SER -1.12 0.88 1 422 ALA -1.12 -0.75 1 423 ALA 1.63 -0.41 1 425 LEU -3.76 3.43 1 426 LEU 0.08 -0.61 1 427 ALA -8.96 6.01 1 428 ILE -5.60 2.71 1 429 SER -0.85 -1.63 1 434 TRP 4.17 -3.32 1 435 SER 4.84 -1.58 1 436 GLU -2.64 0.18 1 438 LEU -2.57 1.89 1 439 VAL -2.61 0.77 1 440 TRP 0.76 1.46 1 441 LEU -4.63 2.50 1 442 ARG -6.39 3.46 1 446 ARG -1.12 0.07 1 447 LEU -3.52 2.27 1 448 GLU -3.49 1.19 1 449 VAL 0.66 -1.95 1 450 ALA 1.24 0.01 1 494 LEU 4.56 -1.99 1 495 ARG 7.25 -2.73 1 496 ASP 4.90 -1.42 1 497 THR 6.02 -1.43 1 498 LEU 3.74 -1.36 1 499 THR 6.08 -1.30 1 501 ALA 1.77 -0.58 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr27783_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -8.96 _LACS_plot.Line_1_terminator_val_y_1 -2.90 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.53 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -0.82 _LACS_plot.Line_2_terminator_val_x_2 7.82 _LACS_plot.Line_2_terminator_val_y_2 2.52 _LACS_plot.Y_axis_chem_shift_offset 0.12 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 376 TRP -8.20 -0.23 0 222 ARG 3.02 -4.19 0 34 SER -3.56 -1.77 1 35 ILE -6.91 -0.91 1 38 HIS 1.95 -0.29 1 40 ALA -5.67 -3.79 1 41 LEU -7.00 -2.78 1 43 THR -3.27 -0.64 1 44 ALA -7.05 -2.39 1 45 ASP -1.51 2.02 1 47 HIS 0.82 2.59 1 48 SER -0.86 2.48 1 50 GLU 0.48 -0.46 1 51 VAL 4.24 -0.22 1 52 LEU -0.53 -0.65 1 53 GLN -7.58 -1.28 1 54 MET -5.10 -0.70 1 55 SER 0.58 3.18 1 56 LEU 3.78 -0.59 1 57 ASN 0.85 1.55 1 58 ALA 4.75 0.72 1 59 ALA 4.68 2.21 1 60 THR 4.72 1.55 1 61 PHE 2.64 0.34 1 62 LEU 0.04 0.80 1 64 GLN -5.40 -1.75 1 65 GLU 0.53 1.93 1 67 THR 3.89 1.45 1 68 VAL 2.91 1.37 1 69 LEU 2.07 -0.27 1 70 ARG 3.72 0.64 1 72 GLN -0.91 -0.39 1 73 THR -3.81 2.27 1 74 LEU 3.51 -0.16 1 75 ALA 3.69 0.61 1 76 ALA 0.44 1.59 1 77 LEU 0.15 -0.79 1 78 LEU -2.46 -1.71 1 80 GLU 2.07 1.64 1 81 GLN 3.15 0.87 1 82 TRP 6.87 -1.37 1 84 ALA 2.90 2.31 1 85 LEU 4.35 0.38 1 86 GLN 3.16 2.05 1 87 ALA 1.87 1.20 1 88 ALA 0.44 -0.26 1 89 LEU -1.72 1.84 1 95 ASP 2.18 -0.21 1 96 ALA -0.61 -0.16 1 97 LEU 0.51 -1.81 1 98 GLN -3.92 0.34 1 99 TYR -2.82 -2.23 1 100 ARG -4.18 -1.74 1 101 ALA -5.04 -2.01 1 102 THR -0.67 -1.03 1 103 LEU -2.54 -2.13 1 104 ASP -0.14 -1.25 1 107 ALA 2.62 -0.31 1 108 ALA -1.69 -0.55 1 110 HIS 0.36 1.30 1 111 LEU -5.17 -1.51 1 112 SER -0.44 -1.50 1 113 LEU -3.75 -2.29 1 114 THR -0.16 -0.54 1 115 VAL -3.96 -1.68 1 116 HIS -1.77 -3.22 1 117 ARG -4.23 -0.28 1 118 VAL -1.65 0.96 1 129 THR -1.56 -1.55 1 130 GLU -3.30 0.02 1 131 ALA 0.76 -0.84 1 132 TRP -1.41 -0.46 1 142 ASN 3.92 2.59 1 143 ALA 3.16 1.49 1 144 MET 4.54 3.01 1 145 SER 4.29 2.30 1 146 ALA 3.71 2.40 1 147 LEU 4.49 0.87 1 148 GLU 3.05 2.22 1 149 SER 0.84 -0.18 1 150 ALA -0.22 0.79 1 157 ALA 3.68 2.40 1 158 GLU 4.08 2.62 1 159 VAL 5.11 3.75 1 160 ALA 4.73 1.43 1 161 THR 5.29 2.16 1 162 GLN 5.13 2.93 1 163 THR 6.30 2.09 1 164 VAL 7.40 3.50 1 166 GLU 4.03 2.36 1 211 GLN 5.20 2.51 1 212 ALA 4.11 -1.71 1 214 ALA 4.09 3.67 1 215 LEU 4.95 1.78 1 216 TYR 0.03 1.27 1 217 THR 3.49 -1.95 1 218 ARG -0.58 -1.39 1 219 HIS -1.22 3.04 1 220 LEU 3.89 -2.46 1 221 LEU -2.60 -2.77 1 223 LEU -2.49 -2.49 1 224 THR -0.39 -0.48 1 225 ALA 2.88 -0.99 1 226 ASP -2.75 2.10 1 227 THR 3.10 -0.86 1 228 ARG 0.39 0.28 1 229 ALA -0.57 -0.29 1 230 ALA -0.81 -0.94 1 231 ALA -1.51 -0.01 1 232 VAL -1.85 -0.57 1 237 VAL 4.43 -0.49 1 238 LEU -0.68 -0.98 1 239 ASN -0.24 2.22 1 241 GLN 1.89 2.43 1 242 THR -2.68 1.26 1 243 ASN 2.75 -2.17 1 244 ALA -1.53 -1.58 1 248 LEU -2.52 1.06 1 251 ALA -2.01 0.30 1 252 VAL 4.61 1.60 1 253 LEU 0.35 -0.57 1 254 ARG 2.99 -0.33 1 255 ALA 1.87 -0.80 1 256 THR 0.74 1.84 1 300 ASP 4.21 2.68 1 301 LEU 2.52 1.40 1 302 ARG 6.70 1.85 1 303 THR 6.01 2.28 1 304 THR 7.40 1.12 1 305 LEU 4.68 1.05 1 306 GLU 4.46 2.98 1 307 TYR 4.68 2.78 1 308 LEU 4.55 1.60 1 310 ARG 5.42 3.45 1 311 GLU 3.43 3.14 1 312 LEU 4.37 -1.53 1 337 ARG 4.46 3.40 1 339 ALA 4.13 2.49 1 340 LEU 3.39 1.64 1 341 ALA 2.34 2.62 1 342 ALA 2.79 0.12 1 343 ALA 2.31 0.36 1 344 HIS 1.41 2.29 1 349 HIS 3.61 4.26 1 350 ASP 2.52 1.50 1 351 THR 4.36 1.69 1 352 LEU 3.89 -1.44 1 353 SER -0.28 -1.32 1 354 ASP -1.59 2.24 1 356 ALA 2.77 2.15 1 357 LEU 1.53 -0.16 1 358 ASP 1.83 -0.36 1 359 LEU 3.49 3.25 1 360 LEU 4.54 1.06 1 362 LEU 3.44 -2.44 1 363 MET -3.61 -1.10 1 364 ARG 4.20 -0.35 1 365 ALA -4.67 -1.16 1 368 LEU -5.57 -3.10 1 369 ILE -2.13 -2.03 1 370 LEU -2.19 -2.37 1 371 ARG -2.30 -3.39 1 372 PHE -4.58 0.50 1 373 GLU 2.69 0.04 1 375 ARG -3.28 -2.24 1 377 GLN -4.51 -1.46 1 378 THR -4.20 -0.71 1 379 LEU -4.18 -0.75 1 381 GLU -0.08 -1.81 1 382 VAL -2.53 -1.55 1 387 ALA 1.78 1.44 1 388 VAL 7.83 1.71 1 389 ASP 4.65 3.38 1 390 ALA 4.02 1.77 1 391 LEU 4.11 1.39 1 392 LEU 4.87 0.67 1 393 ALA 3.67 2.75 1 394 TRP 6.99 3.68 1 395 LEU 4.14 -0.93 1 396 GLU 1.95 1.14 1 397 THR -0.35 0.52 1 398 GLN -0.33 -1.33 1 401 ALA -1.68 -2.27 1 402 LEU -2.03 -1.20 1 403 VAL -2.96 -2.97 1 404 GLN -3.10 -2.07 1 405 THR 1.46 -2.79 1 406 ASP -0.19 -2.82 1 407 ALA 0.49 0.06 1 408 LEU 4.72 0.75 1 410 GLN 2.36 0.98 1 411 LEU -0.12 -1.06 1 412 TRP 0.57 -1.47 1 414 ALA 2.82 -0.18 1 416 ALA 4.20 1.42 1 417 ASP 1.91 0.26 1 418 LEU 0.39 -1.26 1 419 ALA 4.83 -2.05 1 421 SER -1.12 -0.60 1 422 ALA -1.12 -3.50 1 423 ALA 1.63 -1.73 1 425 LEU -3.76 -4.07 1 426 LEU 0.08 -3.70 1 427 ALA -8.96 -1.49 1 428 ILE -5.60 -2.08 1 429 SER -0.85 0.49 1 434 TRP 4.17 -0.60 1 435 SER 4.84 0.21 1 436 GLU -2.64 -0.71 1 438 LEU -2.57 -2.12 1 439 VAL -2.61 -1.45 1 440 TRP 0.76 -0.52 1 441 LEU -4.63 0.30 1 442 ARG -6.39 -2.98 1 446 ARG -1.12 -1.34 1 447 LEU -3.52 -1.75 1 448 GLU -3.49 -0.47 1 449 VAL 0.66 -0.88 1 495 ARG 7.25 3.09 1 496 ASP 4.90 3.00 1 497 THR 6.02 2.43 1 498 LEU 3.74 0.78 1 499 THR 6.08 2.20 1 501 ALA 1.77 1.24 1 stop_ save_