Opened 5 months ago
Last modified 5 months ago
#17897 assigned defect
QScore: model is None
Reported by: | Owned by: | Tristan Croll | |
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Priority: | normal | Milestone: | |
Component: | Third Party | Version: | |
Keywords: | Cc: | ||
Blocked By: | Blocking: | ||
Notify when closed: | Platform: | all | |
Project: | ChimeraX |
Description (last modified by )
The following bug report has been submitted: Platform: Linux-6.8.0-60-generic-x86_64-with-glibc2.35 ChimeraX Version: 1.9 (2024-12-11 19:11:19 UTC) Description Replace this text with list of actions that caused this problem to occur Log: Startup Messages --- note | available bundle cache has not been initialized yet UCSF ChimeraX version: 1.9 (2024-12-11) © 2016-2024 Regents of the University of California. All rights reserved. How to cite UCSF ChimeraX > open "/home/em301/Documents/dynein d/dynein-d_APO_tail/MDFF_IDA-all- > APO-J851_HC872.pdb" "/home/em301/Documents/dynein d/dynein- > d_APO_tail/J1539_011_volume_map_sharp.mrc" Chain information for MDFF_IDA-all-APO-J851_HC872.pdb #1 --- Chain | Description A | No description available B | No description available C | No description available E | No description available La Lb | No description available Opened J1539_011_volume_map_sharp.mrc as #2, grid size 560,560,560, pixel 0.873, shown at level 0.0456, step 4, values float32 > ui tool show "Model-map Q-Score" > transparency #2 60 > style #1 stick Changed 36940 atom styles > color #1 byhetero > qscore #1 toVolume #2 useGui false pointsPerShell 8 shellRadiusStep 0.100 > maxShellRadius 2.00 referenceGaussianSigma 0.60 logDetails true assignAttr > false Chain Number Name Qavg Qworst Qbb Qsc ------------------------------------------------------- A 65 VAL 0.116 -0.558 0.110 0.332 A 66 THR 0.412 -0.331 0.517 0.242 A 67 TYR 0.366 -0.146 0.351 0.336 A 68 SER 0.434 0.061 0.479 0.253 A 69 HIS 0.252 -0.569 0.405 0.204 A 70 LEU 0.605 0.435 0.530 0.388 A 71 LEU 0.297 -0.356 0.356 0.278 A 72 PRO 0.682 0.514 0.659 0.404 A 73 LYS 0.388 0.110 0.393 0.321 A 74 VAL 0.567 0.256 0.430 0.416 A 75 MET 0.132 -0.403 0.178 0.250 A 76 ALA 0.603 0.445 0.487 0.408 A 77 PRO 0.367 -0.096 0.337 0.337 A 78 PHE 0.372 -0.219 0.526 0.265 A 79 GLU 0.436 -0.267 0.385 0.384 A 80 THR 0.429 -0.371 0.533 0.244 A 81 ARG 0.395 -0.154 0.228 0.387 A 82 SER 0.374 -0.279 0.206 0.509 A 83 GLY 0.084 -0.394 0.179 N/A A 84 GLU 0.356 -0.117 0.197 0.430 A 85 THR 0.419 0.071 0.413 0.326 A 86 PRO 0.398 0.015 0.351 0.354 A 87 ARG 0.544 0.132 0.391 0.424 A 88 LYS 0.312 -0.052 0.390 0.279 A 89 VAL 0.256 -0.377 0.259 0.300 A 90 LEU 0.262 -0.120 0.219 0.320 A 91 ILE 0.468 0.186 0.431 0.349 A 92 GLN 0.382 0.099 0.382 0.328 A 93 ARG 0.304 -0.213 0.258 0.322 A 94 ARG 0.537 0.273 0.390 0.420 A 95 ARG 0.515 0.231 0.488 0.374 A 96 ARG 0.525 0.195 0.504 0.375 A 97 GLN 0.297 -0.316 0.134 0.393 A 98 PHE 0.703 0.399 0.485 0.542 A 99 ALA 0.509 0.268 0.482 0.298 A 100 ALA 0.513 0.310 0.478 0.308 A 101 GLN 0.480 0.193 0.388 0.405 A 102 ASP 0.315 -0.705 0.482 0.143 A 103 VAL 0.546 0.322 0.489 0.365 A 104 ALA 0.482 0.053 0.495 0.244 A 105 GLU 0.606 0.052 0.441 0.517 A 106 LEU 0.359 -0.166 0.314 0.336 A 107 VAL 0.222 -0.488 0.153 0.340 A 108 HIS 0.564 0.134 0.568 0.398 A 109 GLY 0.399 0.287 0.360 N/A A 110 GLU 0.558 0.458 0.515 0.420 A 111 GLY 0.512 0.390 0.424 N/A A 112 VAL 0.450 -0.128 0.555 0.259 A 113 ALA 0.155 -0.376 0.206 0.269 A 114 GLN 0.318 -0.328 0.155 0.399 A 115 PRO 0.100 -0.591 0.036 0.297 A 116 PRO 0.517 0.173 0.451 0.390 A 117 GLN 0.560 0.045 0.583 0.364 A 118 GLU 0.383 -0.433 0.509 0.248 A 119 LEU 0.394 -0.445 0.524 0.261 A 120 PHE 0.537 0.343 0.432 0.435 A 121 PRO 0.297 -0.170 0.482 0.202 A 122 LEU 0.633 0.474 0.583 0.381 A 123 GLU 0.288 -0.432 0.415 0.216 A 124 VAL 0.507 0.057 0.575 0.286 A 125 PHE 0.231 -0.245 0.271 0.263 A 126 ASP 0.217 -0.406 0.350 0.144 A 127 ASN 0.382 0.097 0.358 0.344 A 128 THR 0.544 0.059 0.428 0.424 A 129 ASN 0.607 0.471 0.492 0.469 A 130 PHE 0.472 0.066 0.426 0.386 A 131 GLU 0.545 -0.192 0.414 0.474 A 132 SER 0.345 0.176 0.310 0.349 A 133 ARG 0.259 -0.013 0.155 0.329 A 134 MET 0.183 -0.326 0.255 0.246 A 135 HIS 0.505 0.048 0.317 0.482 A 136 PRO 0.609 0.329 0.536 0.415 A 137 GLU 0.364 -0.488 0.576 0.185 A 138 TRP 0.437 0.014 0.507 0.341 A 139 VAL 0.439 -0.075 0.353 0.372 A 140 PRO 0.422 0.058 0.381 0.356 A 141 ARG 0.407 -0.217 0.164 0.416 A 142 ARG 0.270 -0.615 0.063 0.366 A 143 PRO 0.395 -0.260 0.259 0.402 A 144 GLY 0.743 0.552 0.556 N/A A 145 VAL 0.547 0.321 0.480 0.372 A 146 PRO 0.638 0.504 0.556 0.427 A 147 LEU 0.206 -0.240 0.392 0.206 A 148 THR 0.582 0.245 0.430 0.456 A 149 SER 0.443 -0.052 0.419 0.336 A 150 GLY 0.508 0.350 0.422 N/A A 151 ARG 0.594 0.292 0.502 0.418 A 152 ALA 0.229 -0.278 0.284 0.244 A 153 LEU 0.450 0.143 0.384 0.359 A 154 VAL 0.110 -0.552 -0.094 0.410 A 155 ALA 0.340 0.149 0.321 0.327 A 156 HIS 0.442 -0.143 0.326 0.420 A 157 ASP 0.485 0.057 0.483 0.369 A 158 ASP 0.260 -0.183 0.265 0.287 A 159 GLY -0.217 -0.460 0.008 N/A A 160 THR 0.304 -0.555 0.433 0.210 A 161 GLY 0.324 -0.108 0.317 N/A A 162 HIS 0.479 0.216 0.440 0.391 A 163 SER 0.124 -0.825 0.090 0.349 A 164 VAL -0.167 -0.739 0.014 0.152 A 165 VAL 0.500 0.152 0.395 0.389 A 166 ASP 0.479 0.159 0.422 0.422 A 167 TRP 0.541 -0.331 0.327 0.483 A 168 VAL 0.156 -0.244 0.247 0.238 A 169 PRO 0.306 0.120 0.265 0.330 A 170 CYS 0.374 -0.059 0.286 0.413 A 171 THR 0.364 0.112 0.273 0.382 A 172 VAL 0.317 -0.095 0.278 0.332 A 173 VAL 0.343 0.008 0.424 0.263 A 174 ASP 0.446 -0.039 0.511 0.289 A 175 PHE 0.610 0.279 0.443 0.487 A 176 ASP 0.416 0.128 0.405 0.354 A 177 GLU 0.600 0.283 0.513 0.463 A 178 ALA 0.549 0.448 0.467 0.371 A 179 THR 0.543 0.163 0.419 0.429 A 180 ASN 0.635 0.476 0.538 0.461 A 181 SER 0.573 0.318 0.513 0.379 A 182 TYR 0.584 0.381 0.516 0.445 A 183 GLY 0.552 0.535 0.447 N/A A 184 VAL 0.623 0.144 0.579 0.365 A 185 THR 0.427 -0.200 0.589 0.200 A 186 LEU 0.362 -0.223 0.552 0.228 A 187 HIS 0.424 0.017 0.444 0.338 A 188 GLN 0.428 0.051 0.323 0.397 A 189 LEU 0.367 -0.220 0.380 0.311 A 190 ALA 0.101 -0.457 0.164 0.264 A 191 HIS 0.501 -0.443 0.476 0.391 A 192 SER 0.206 -0.413 0.439 0.028 A 193 GLY 0.347 0.312 0.330 N/A A 194 ASN 0.340 -0.410 0.168 0.444 A 195 GLY 0.272 -0.431 0.287 N/A A 196 SER 0.284 -0.226 0.336 0.245 A 197 ALA 0.309 0.125 0.302 0.318 A 198 GLU 0.281 -0.018 0.194 0.356 A 199 ALA 0.141 0.000 0.214 0.240 A 200 ASP 0.412 -0.115 0.282 0.472 A 201 ALA 0.424 0.171 0.342 0.402 A 202 GLU 0.444 0.263 0.323 0.434 A 203 ASP 0.395 0.009 0.353 0.379 A 204 MET 0.495 -0.077 0.335 0.429 A 205 HIS 0.398 -0.443 0.371 0.355 A 206 VAL 0.537 0.252 0.446 0.385 A 207 MET 0.514 0.061 0.399 0.408 A 208 TRP 0.502 0.169 0.516 0.389 A 209 LEU 0.630 0.442 0.535 0.401 A 210 PRO 0.616 0.233 0.530 0.424 A 211 ARG 0.589 0.118 0.391 0.451 A 212 VAL 0.563 0.261 0.438 0.408 A 213 LYS 0.226 -0.320 0.357 0.243 A 214 VAL 0.399 -0.095 0.507 0.252 A 215 CYS 0.510 0.343 0.467 0.359 A 216 PHE 0.472 -0.144 0.279 0.449 A 217 SER 0.612 0.302 0.502 0.439 A 218 ALA 0.576 0.284 0.485 0.378 A 219 GLU 0.367 -0.209 0.354 0.335 A 220 ASP 0.589 0.224 0.473 0.518 A 221 PRO 0.512 0.257 0.441 0.393 A 222 ALA 0.360 -0.046 0.346 0.316 A 223 GLN 0.593 0.475 0.476 0.449 A 224 PHE 0.547 -0.109 0.350 0.478 A 225 ALA 0.369 0.091 0.395 0.253 A 226 ARG 0.432 -0.009 0.458 0.333 A 227 ARG 0.575 0.291 0.504 0.406 A 228 HIS 0.449 -0.014 0.388 0.392 A 229 ALA 0.521 0.079 0.440 0.374 A 230 GLU 0.612 0.087 0.567 0.439 A 231 ALA 0.345 -0.121 0.410 0.200 A 232 HIS 0.700 0.574 0.566 0.523 A 233 ARG 0.480 -0.060 0.320 0.408 A 234 SER 0.427 -0.250 0.548 0.163 A 235 ARG 0.612 0.215 0.452 0.446 A 236 ALA 0.280 -0.113 0.341 0.223 A 237 ARG 0.670 0.107 0.479 0.472 A 238 ALA 0.651 0.263 0.545 0.380 A 239 GLU 0.554 0.358 0.530 0.405 A 240 SER 0.415 0.121 0.354 0.381 A 241 LEU 0.530 0.004 0.398 0.402 A 242 LEU 0.316 -0.138 0.148 0.386 A 243 ARG 0.650 0.227 0.452 0.469 A 244 TYR 0.567 -0.019 0.419 0.471 A 245 ASN 0.709 0.452 0.531 0.541 A 246 LEU 0.476 -0.046 0.294 0.417 A 247 TYR 0.707 0.319 0.505 0.548 A 248 VAL 0.048 -0.390 0.095 0.254 A 249 ASP 0.260 -0.248 0.361 0.190 A 250 SER 0.177 -0.802 0.081 0.423 A 251 MET 0.298 -0.184 0.353 0.276 A 252 PRO 0.235 -0.478 0.504 0.142 A 253 THR 0.647 0.433 0.627 0.365 A 254 ASP 0.169 -0.334 0.424 0.006 A 255 ASP 0.364 0.113 0.312 0.379 A 256 ILE 0.259 -0.000 0.301 0.281 A 257 PRO 0.554 0.378 0.524 0.379 A 258 PRO 0.258 0.047 0.222 0.316 A 259 LEU 0.314 -0.069 0.286 0.321 A 260 THR 0.346 -0.053 0.212 0.413 A 261 ASN 0.501 0.188 0.376 0.450 A 262 GLU 0.485 0.260 0.538 0.331 A 263 GLN 0.471 -0.560 0.286 0.453 A 264 VAL 0.439 -0.295 0.420 0.332 A 265 ASN 0.644 0.422 0.496 0.503 A 266 ARG 0.496 0.024 0.371 0.401 A 267 MET 0.451 -0.011 0.374 0.375 A 268 LEU 0.368 -0.440 0.508 0.252 A 269 SER 0.542 0.022 0.414 0.461 A 270 PHE 0.553 -0.189 0.329 0.491 A 271 ALA 0.674 0.562 0.571 0.371 A 272 LEU 0.365 -0.068 0.374 0.312 A 273 ASN 0.650 0.168 0.454 0.539 A 274 SER 0.381 0.278 0.318 0.383 A 275 LYS 0.329 -0.069 0.412 0.280 A 276 LYS 0.279 0.004 0.411 0.252 A 277 LEU 0.456 -0.101 0.542 0.291 A 278 LYS 0.458 -0.253 0.313 0.390 A 279 ASP 0.526 -0.069 0.379 0.528 A 280 LYS 0.354 -0.056 0.280 0.344 A 281 LEU 0.406 -0.257 0.375 0.337 A 282 MET 0.374 0.071 0.310 0.354 A 283 ASP 0.511 0.156 0.432 0.454 A 284 THR 0.639 0.370 0.571 0.400 A 285 SER 0.646 0.455 0.548 0.425 A 286 ALA 0.254 -0.332 0.205 0.394 A 287 LEU 0.555 0.113 0.419 0.408 A 288 ILE 0.447 -0.185 0.201 0.442 A 289 ALA 0.195 -0.465 0.226 0.290 A 290 GLU 0.206 -0.084 0.257 0.240 A 291 VAL 0.351 -0.389 0.446 0.254 A 292 ASN 0.511 -0.303 0.294 0.521 A 293 ILE -0.020 -0.430 -0.047 0.270 A 294 GLU 0.205 -0.482 -0.109 0.483 A 295 TYR 0.302 -0.233 0.280 0.314 A 296 ALA -0.335 -0.588 -0.079 0.084 A 297 ARG 0.237 -0.439 0.333 0.256 A 298 THR 0.347 -0.488 0.452 0.233 A 299 MET 0.435 -0.459 0.291 0.409 A 300 ASN 0.329 0.003 0.226 0.390 A 301 LYS 0.306 -0.500 0.463 0.248 A 302 VAL 0.464 0.097 0.430 0.344 A 303 VAL 0.469 0.325 0.457 0.331 A 304 PHE 0.481 0.194 0.348 0.427 A 305 ASP 0.170 -0.339 0.034 0.398 A 306 THR 0.011 -0.552 0.159 0.160 A 307 ALA 0.531 0.092 0.530 0.253 A 308 LEU 0.249 -0.034 0.162 0.338 A 309 THR 0.148 -0.392 0.214 0.237 A 310 ALA -0.275 -0.729 -0.145 0.258 A 311 ALA 0.394 -0.162 0.343 0.363 A 312 ARG 0.474 -0.016 0.427 0.369 A 313 ALA -0.184 -0.555 -0.030 0.199 A 314 GLU 0.405 -0.529 0.211 0.470 A 315 ARG 0.449 -0.055 0.433 0.352 A 316 GLU 0.401 0.083 0.299 0.407 A 317 ALA 0.668 0.438 0.544 0.403 A 318 ASP 0.330 0.028 0.219 0.426 A 319 ALA 0.275 -0.052 0.292 0.289 A 320 GLU 0.224 -0.713 0.254 0.260 A 321 ALA 0.620 0.185 0.588 0.277 A 322 ALA 0.585 0.093 0.463 0.421 A 323 ALA 0.160 -0.806 0.158 0.347 A 376 PRO 0.645 0.210 0.618 0.397 A 377 VAL 0.323 -0.313 0.284 0.333 A 378 GLU 0.607 0.401 0.548 0.447 A 379 GLY 0.630 0.553 0.492 N/A A 380 GLY 0.170 -0.117 0.229 N/A A 381 ALA -0.043 -0.255 0.102 0.177 A 382 ASP 0.617 0.320 0.577 0.451 A 383 PHE 0.168 -0.520 0.189 0.248 A 384 PRO 0.627 0.444 0.559 0.416 A 385 GLN 0.517 0.000 0.363 0.449 A 386 GLN 0.461 -0.009 0.388 0.389 A 387 PHE 0.583 0.438 0.500 0.442 A 388 SER 0.541 0.375 0.427 0.445 A 389 GLU 0.514 0.277 0.475 0.402 A 390 PHE 0.462 0.106 0.423 0.379 A 391 SER 0.466 0.278 0.435 0.345 A 392 PHE 0.518 -0.024 0.369 0.446 A 393 LYS 0.352 -0.232 0.465 0.273 A 394 THR 0.556 0.130 0.508 0.375 A 395 LEU 0.357 0.010 0.330 0.327 A 396 LEU 0.364 0.155 0.449 0.277 A 397 THR 0.239 -0.106 0.303 0.250 A 398 LYS 0.376 0.010 0.346 0.331 A 399 THR 0.551 0.274 0.550 0.338 A 400 GLU 0.633 0.244 0.544 0.475 A 401 VAL 0.534 0.160 0.387 0.418 A 402 ILE 0.511 0.174 0.476 0.355 A 403 MET 0.183 -0.290 0.243 0.252 A 404 ALA 0.601 0.322 0.483 0.411 A 405 ILE 0.533 -0.411 0.295 0.452 A 406 THR 0.484 -0.171 0.514 0.307 A 407 LYS 0.587 0.208 0.476 0.401 A 408 ILE 0.532 0.332 0.517 0.348 A 409 LYS 0.525 -0.344 0.346 0.415 A 410 VAL 0.442 -0.388 0.310 0.400 A 411 GLU 0.668 0.265 0.489 0.547 A 412 CYS 0.646 0.349 0.522 0.456 A 413 ALA 0.559 0.458 0.492 0.345 A 414 LYS 0.363 -0.479 0.469 0.278 A 415 VAL 0.713 0.520 0.574 0.431 A 416 THR 0.601 -0.176 0.592 0.351 A 417 LYS 0.657 0.380 0.550 0.413 A 418 MET 0.683 0.547 0.546 0.450 A 419 CYS 0.633 0.500 0.504 0.463 A 420 LEU 0.642 0.428 0.478 0.435 A 421 PHE 0.491 -0.022 0.415 0.405 A 422 ASN 0.625 0.414 0.511 0.472 A 423 THR 0.600 0.409 0.506 0.414 A 424 HIS 0.653 0.203 0.550 0.490 A 425 TYR 0.123 -0.627 0.363 0.137 A 426 THR 0.292 -0.173 0.215 0.363 A 427 LYS 0.332 -0.030 0.312 0.320 A 428 SER 0.587 0.304 0.544 0.359 A 429 ALA 0.698 0.508 0.570 0.401 A 430 ARG 0.484 0.039 0.454 0.366 A 431 LEU 0.539 0.099 0.435 0.391 A 432 GLU 0.500 0.108 0.533 0.350 A 433 GLU 0.129 -0.431 0.385 0.077 A 434 LEU 0.597 0.429 0.505 0.395 A 435 GLU 0.407 -0.188 0.451 0.311 A 436 GLN 0.458 0.179 0.525 0.312 A 437 THR 0.479 0.011 0.413 0.378 A 438 GLN 0.591 0.328 0.470 0.451 A 439 VAL 0.528 -0.163 0.381 0.417 A 440 ALA 0.372 0.263 0.364 0.303 A 441 ALA 0.636 0.430 0.516 0.405 A 442 LEU 0.591 0.340 0.451 0.416 A 443 ASP 0.658 0.371 0.563 0.519 A 444 SER 0.475 0.171 0.461 0.324 A 445 ALA 0.643 0.402 0.527 0.397 A 446 GLY 0.558 0.355 0.451 N/A A 447 ASN 0.297 -0.343 0.300 0.302 A 448 TYR 0.514 0.294 0.393 0.438 A 449 LEU 0.608 0.290 0.497 0.404 A 450 LYS 0.629 0.261 0.498 0.417 A 451 ASP 0.578 0.345 0.569 0.407 A 452 THR 0.493 0.352 0.437 0.373 A 453 TRP 0.517 0.110 0.387 0.444 A 454 CYS 0.378 0.104 0.373 0.313 A 455 VAL 0.348 -0.214 0.326 0.324 A 456 ALA 0.359 -0.219 0.295 0.391 A 457 LEU 0.497 0.074 0.414 0.375 A 458 ARG 0.496 0.147 0.469 0.369 A 459 ASN 0.535 0.307 0.487 0.400 A 460 ALA 0.578 0.286 0.503 0.353 A 461 ILE 0.368 0.086 0.306 0.345 A 462 ARG 0.554 0.347 0.431 0.417 A 463 ASN 0.441 0.170 0.466 0.322 A 464 SER 0.619 0.461 0.560 0.378 A 465 PHE 0.556 0.338 0.485 0.426 A 466 LYS 0.615 0.455 0.508 0.405 A 467 ASP 0.573 0.445 0.482 0.487 A 468 VAL -0.234 -0.592 -0.103 0.175 A 469 GLY 0.388 0.190 0.354 N/A A 470 LYS 0.209 -0.714 0.160 0.307 A 471 GLY 0.311 -0.175 0.309 N/A A 472 TRP 0.329 -0.711 0.406 0.291 A 473 PHE 0.590 0.113 0.444 0.471 A 474 ASN 0.367 -0.073 0.228 0.427 A 475 LEU 0.488 0.105 0.379 0.386 A 476 GLY 0.268 -0.085 0.285 N/A A 477 GLU 0.248 -0.080 0.296 0.256 A 478 ALA 0.519 0.163 0.508 0.271 A 479 SER 0.489 0.211 0.448 0.357 A 480 MET 0.361 0.070 0.396 0.298 A 481 GLU 0.327 -0.138 0.163 0.423 A 482 THR 0.355 -0.427 0.215 0.418 A 483 TYR 0.305 -0.185 0.332 0.296 A 484 GLU 0.521 0.237 0.444 0.431 A 485 PHE 0.485 0.311 0.363 0.423 A 486 SER 0.602 0.355 0.483 0.449 A 487 LYS 0.455 0.144 0.389 0.360 A 488 LEU 0.478 0.139 0.391 0.374 A 489 ARG 0.284 -0.494 0.197 0.330 A 490 LYS 0.135 -0.313 0.227 0.240 A 491 PHE 0.299 -0.194 0.311 0.300 A 492 LEU 0.422 -0.188 0.492 0.293 A 493 THR -0.028 -0.331 0.146 0.135 A 494 LEU 0.416 -0.132 0.419 0.323 A 495 THR 0.364 -0.290 0.275 0.382 A 496 ARG 0.194 -0.710 0.200 0.274 A 497 PHE 0.527 0.299 0.498 0.398 A 498 VAL 0.505 0.185 0.439 0.366 A 499 MET 0.567 0.128 0.423 0.433 A 500 GLU 0.334 -0.136 0.443 0.244 A 501 ASP 0.364 -0.176 0.545 0.145 A 502 THR 0.521 0.194 0.417 0.412 A 503 MET 0.613 0.462 0.491 0.430 A 504 ARG 0.635 0.454 0.524 0.435 A 505 ALA 0.556 0.302 0.515 0.306 A 506 LEU 0.652 0.406 0.493 0.434 A 507 VAL 0.598 0.344 0.484 0.404 A 508 GLU 0.541 0.288 0.486 0.422 A 509 ASP 0.064 -0.621 0.318 -0.028 A 510 SER 0.686 0.502 0.548 0.473 A 511 LEU 0.672 0.443 0.540 0.425 A 512 GLY 0.635 0.584 0.495 N/A A 513 LYS 0.466 0.097 0.368 0.374 A 514 PHE 0.542 0.050 0.472 0.421 A 515 THR 0.563 0.332 0.528 0.365 A 516 GLY 0.526 0.446 0.432 N/A A 517 PHE 0.502 0.185 0.509 0.374 A 518 ILE 0.642 0.236 0.497 0.426 A 519 GLN 0.549 0.260 0.456 0.424 A 520 SER 0.452 0.248 0.426 0.339 A 521 CYS 0.717 0.635 0.578 0.474 A 522 CYS 0.715 0.478 0.574 0.477 A 523 PRO 0.525 0.199 0.551 0.341 A 524 GLY 0.194 -0.064 0.243 N/A A 525 ARG 0.389 -0.158 0.342 0.346 A 526 VAL 0.105 -0.330 0.096 0.293 A 527 THR 0.170 -0.554 0.277 0.211 A 528 VAL 0.363 -0.594 0.139 0.447 A 529 HIS 0.356 -0.021 0.388 0.308 A 530 SER 0.392 -0.169 0.398 0.300 A 531 THR 0.615 0.250 0.594 0.362 A 532 SER 0.282 -0.283 0.456 0.099 A 533 SER 0.474 0.125 0.399 0.397 A 534 VAL 0.337 0.135 0.368 0.292 A 535 GLU 0.143 -0.527 0.208 0.209 A 536 ILE 0.518 0.300 0.441 0.375 A 537 LEU -0.015 -0.453 0.133 0.190 A 538 ASP -0.137 -0.654 -0.095 0.117 A 539 ALA 0.225 -0.609 0.269 0.263 A 540 SER 0.266 -0.048 0.346 0.212 A 541 SER 0.107 -0.282 0.135 0.274 A 542 PRO -0.001 -0.639 0.136 0.163 A 543 VAL 0.187 -0.364 0.138 0.324 A 544 PRO 0.126 -0.075 0.043 0.313 A 545 VAL 0.322 0.028 0.407 0.257 A 546 PRO 0.510 0.183 0.520 0.347 A 547 ALA 0.454 0.105 0.463 0.257 A 548 ILE 0.092 -0.302 0.080 0.279 A 549 GLY -0.170 -0.528 0.035 N/A A 550 PRO 0.489 0.191 0.443 0.373 A 551 GLY 0.357 -0.018 0.336 N/A A 552 ARG 0.439 -0.343 0.532 0.313 A 553 LYS 0.428 0.001 0.406 0.338 A 554 PRO 0.395 -0.380 0.242 0.412 A 555 PRO 0.576 0.209 0.532 0.391 A 556 LEU 0.539 0.218 0.553 0.336 A 557 LEU 0.529 0.156 0.446 0.380 A 558 VAL 0.572 0.419 0.509 0.372 A 559 MET 0.585 0.429 0.500 0.404 A 560 ASP 0.430 -0.006 0.418 0.360 A 561 LEU 0.599 0.359 0.464 0.414 A 562 ALA 0.396 -0.186 0.380 0.310 A 563 THR 0.392 0.146 0.354 0.346 A 564 ASN 0.409 -0.266 0.568 0.213 A 565 LYS 0.532 0.075 0.398 0.399 A 566 GLU 0.238 -0.336 0.140 0.349 A 567 ALA 0.536 0.276 0.503 0.299 A 568 THR 0.532 0.034 0.549 0.323 A 569 ARG 0.446 0.242 0.380 0.368 A 570 PHE 0.387 -0.058 0.274 0.384 A 571 VAL 0.419 0.032 0.332 0.371 A 572 TYR 0.758 0.470 0.572 0.562 A 573 SER 0.561 0.156 0.567 0.300 A 574 THR 0.190 -0.453 0.235 0.259 A 575 GLN 0.348 -0.206 0.510 0.230 A 576 PRO 0.627 0.394 0.515 0.441 A 577 GLU 0.311 -0.072 0.361 0.275 A 578 SER 0.596 0.130 0.580 0.326 A 579 ILE 0.593 0.259 0.476 0.405 A 580 VAL 0.580 0.237 0.489 0.389 A 581 THR 0.571 -0.034 0.451 0.430 A 582 LYS 0.581 -0.068 0.563 0.366 A 583 ILE 0.633 0.432 0.562 0.390 A 584 MET 0.595 0.321 0.511 0.406 A 585 ALA 0.574 0.184 0.507 0.341 A 586 LEU 0.583 0.322 0.458 0.407 A 587 PHE 0.665 0.382 0.532 0.492 A 588 ASP 0.628 0.521 0.521 0.522 A 589 ALA 0.460 0.177 0.449 0.285 A 590 ALA 0.533 0.229 0.448 0.378 A 591 ILE 0.660 0.445 0.526 0.424 A 592 GLY 0.546 0.414 0.444 N/A A 593 ARG 0.439 0.004 0.300 0.390 A 594 THR 0.618 0.332 0.489 0.443 A 595 GLN 0.689 0.532 0.576 0.473 A 596 GLY 0.435 0.043 0.380 N/A A 597 LEU 0.559 0.269 0.458 0.393 A 598 HIS 0.739 0.515 0.562 0.560 A 599 THR 0.070 -0.345 0.344 0.072 A 600 LEU 0.385 -0.526 0.228 0.392 A 601 GLU 0.148 -0.273 0.209 0.213 A 602 PRO 0.556 0.294 0.523 0.381 A 603 ALA 0.456 0.173 0.420 0.324 A 604 ILE 0.524 0.092 0.323 0.434 A 605 MET 0.456 0.200 0.439 0.343 A 606 GLU 0.550 0.245 0.470 0.442 A 607 ASN 0.328 -0.341 0.100 0.483 A 608 LEU 0.368 -0.273 0.388 0.307 A 609 PHE 0.346 -0.155 0.420 0.289 A 610 TRP 0.423 0.034 0.290 0.403 A 611 ALA 0.520 0.181 0.464 0.339 A 612 THR 0.500 0.269 0.456 0.364 A 613 ALA 0.447 0.009 0.361 0.402 A 614 PRO 0.234 0.017 0.286 0.262 A 615 VAL 0.575 0.272 0.525 0.364 A 616 LEU 0.502 0.185 0.558 0.311 A 617 SER 0.381 0.185 0.421 0.259 A 618 THR 0.182 -0.039 0.320 0.188 A 619 VAL 0.606 0.362 0.495 0.403 A 620 HIS 0.493 0.301 0.433 0.408 A 621 GLN 0.552 0.040 0.589 0.354 A 622 GLN 0.544 0.256 0.503 0.394 A 623 GLU 0.487 -0.003 0.573 0.310 A 624 GLU 0.460 -0.464 0.566 0.287 A 625 ILE 0.420 0.104 0.331 0.366 A 626 VAL 0.674 0.523 0.552 0.417 A 627 VAL 0.613 0.366 0.501 0.405 A 628 ARG 0.491 -0.186 0.570 0.332 A 629 HIS 0.686 0.484 0.501 0.546 A 630 ARG 0.686 0.500 0.525 0.466 A 631 GLU 0.507 0.149 0.463 0.403 A 632 LEU 0.415 -0.204 0.510 0.280 A 633 LEU 0.610 0.422 0.471 0.418 A 634 ARG 0.608 0.238 0.509 0.424 A 635 ALA 0.538 0.105 0.533 0.257 A 636 ALA 0.540 0.374 0.490 0.324 A 637 LEU 0.514 0.097 0.396 0.394 A 638 SER 0.537 0.176 0.483 0.372 A 639 ALA 0.521 0.190 0.469 0.332 A 640 ALA 0.507 0.135 0.460 0.327 A 641 LEU 0.620 0.272 0.477 0.421 A 642 VAL 0.487 -0.248 0.352 0.406 A 643 PRO 0.556 0.400 0.548 0.367 A 644 LEU 0.601 0.486 0.520 0.390 A 645 GLU 0.580 -0.077 0.522 0.437 A 646 GLU 0.453 0.077 0.397 0.394 A 647 TYR 0.516 0.011 0.413 0.432 A 648 MET 0.607 0.363 0.465 0.439 A 649 ALA 0.127 -0.038 0.193 0.254 A 650 LYS 0.667 0.412 0.504 0.436 A 651 PHE 0.338 -0.190 0.325 0.324 A 652 GLU 0.176 -0.054 0.200 0.248 A 653 LYS 0.606 0.355 0.445 0.424 A 654 TYR 0.503 -0.005 0.535 0.373 A 655 VAL 0.216 -0.640 0.168 0.327 A 656 PRO 0.218 -0.285 0.356 0.211 A 657 LEU 0.492 0.236 0.444 0.358 A 658 LEU 0.522 0.096 0.545 0.330 A 659 GLN 0.483 -0.141 0.464 0.366 A 660 LEU 0.568 0.231 0.416 0.417 A 661 ASN 0.204 -0.137 0.198 0.286 A 662 VAL 0.369 -0.237 0.299 0.356 A 663 GLU 0.483 0.143 0.324 0.472 A 664 SER 0.500 0.229 0.464 0.351 A 665 TYR 0.642 0.227 0.449 0.518 A 666 VAL 0.221 -0.401 0.258 0.277 A 667 ALA 0.349 0.191 0.316 0.346 A 668 ALA 0.247 -0.321 0.362 0.150 A 669 LEU 0.514 0.191 0.438 0.374 A 670 GLU 0.151 -0.445 0.272 0.175 A 671 ALA 0.502 -0.051 0.425 0.375 A 672 LYS 0.162 -0.454 0.054 0.321 A 673 GLY 0.324 -0.189 0.317 N/A A 674 GLU 0.515 0.177 0.496 0.389 A 675 GLU 0.460 -0.057 0.405 0.395 A 676 LEU 0.381 -0.073 0.471 0.277 A 677 SER 0.241 -0.141 0.243 0.305 A 678 LEU 0.135 -0.544 0.133 0.282 A 679 THR 0.043 -0.555 0.220 0.141 A 680 GLU 0.163 -0.304 0.276 0.184 A 681 VAL 0.379 -0.121 0.471 0.260 A 682 ARG 0.416 0.007 0.295 0.378 A 683 ALA 0.321 -0.031 0.336 0.281 A 684 GLU 0.283 0.007 0.336 0.264 A 685 ILE 0.359 0.080 0.249 0.366 A 686 LYS 0.137 -0.341 0.038 0.312 A 687 ARG 0.387 0.071 0.294 0.361 A 688 ALA 0.382 -0.121 0.338 0.354 A 689 SER 0.323 -0.202 0.264 0.377 A 690 ALA 0.012 -0.355 0.171 0.142 A 691 ASP 0.478 0.339 0.406 0.436 A 692 LEU 0.366 -0.522 0.262 0.365 A 693 GLU 0.276 -0.145 0.194 0.352 A 694 SER 0.109 -0.360 0.212 0.184 A 695 LEU 0.443 -0.658 0.228 0.428 A 696 MET 0.565 0.160 0.475 0.403 A 697 GLU 0.332 -0.407 0.310 0.331 A 698 SER 0.635 0.396 0.509 0.458 A 699 VAL 0.468 -0.167 0.319 0.413 A 700 PRO 0.591 0.146 0.466 0.440 A 701 ILE 0.305 -0.337 0.179 0.365 A 702 GLY 0.682 0.514 0.521 N/A A 703 ILE 0.437 -0.209 0.306 0.388 A 704 SER 0.231 -0.073 0.261 0.272 A 705 LEU 0.559 0.120 0.395 0.422 A 706 GLY 0.537 0.256 0.439 N/A A 707 LEU 0.635 0.457 0.502 0.419 A 708 VAL 0.533 0.295 0.505 0.347 A 709 GLN 0.579 0.381 0.447 0.453 A 710 ILE 0.201 -0.334 0.397 0.200 A 711 ASN 0.598 0.009 0.441 0.498 A 712 LEU 0.433 -0.237 0.263 0.405 A 713 VAL 0.489 -0.062 0.353 0.407 A 714 LYS 0.603 0.292 0.567 0.376 A 715 THR 0.095 -0.682 0.267 0.152 A 716 ARG 0.186 -0.408 0.427 0.194 A 717 GLU 0.471 0.242 0.437 0.385 A 718 LEU 0.539 0.159 0.424 0.396 A 719 LEU 0.365 -0.401 0.211 0.387 A 720 VAL 0.309 -0.786 0.189 0.380 A 721 LYS 0.622 0.197 0.547 0.394 A 722 LYS 0.457 -0.028 0.344 0.377 A 723 GLN 0.324 -0.666 0.052 0.460 A 724 GLU 0.123 -0.545 0.283 0.140 A 725 LYS 0.558 0.308 0.523 0.367 A 726 LEU 0.177 -0.539 0.181 0.285 A 727 VAL 0.165 -0.255 0.192 0.277 A 728 ALA 0.530 0.160 0.430 0.401 A 729 LEU 0.539 0.281 0.447 0.385 A 730 LEU 0.494 0.120 0.371 0.393 A 731 LYS 0.009 -0.711 0.348 0.124 A 732 ALA 0.572 0.488 0.486 0.369 A 733 LEU 0.307 0.029 0.214 0.350 A 734 ALA 0.194 -0.045 0.263 0.232 A 735 ALA 0.251 -0.044 0.247 0.328 A 736 ARG 0.493 0.202 0.487 0.361 A 737 VAL 0.234 0.010 0.315 0.252 A 738 PRO 0.615 0.435 0.558 0.407 A 739 ARG 0.548 0.119 0.445 0.409 A 740 ARG 0.423 -0.312 0.333 0.370 A 741 ALA 0.309 0.028 0.297 0.325 A 742 MET 0.389 0.050 0.365 0.335 A 743 ALA 0.355 -0.015 0.306 0.369 A 744 SER 0.319 -0.045 0.305 0.324 A 745 VAL 0.403 -0.152 0.506 0.255 A 746 SER 0.224 -0.241 0.403 0.092 A 747 THR 0.208 -0.165 0.220 0.287 A 748 LYS 0.274 -0.252 0.437 0.240 A 749 PHE 0.487 -0.201 0.202 0.494 A 750 ALA 0.434 0.257 0.415 0.305 A 751 GLU 0.630 0.187 0.551 0.467 A 752 ILE 0.539 -0.015 0.509 0.357 A 753 ASP 0.440 0.199 0.392 0.399 A 754 ARG 0.511 0.186 0.357 0.415 A 755 ALA 0.024 -0.465 0.124 0.228 A 756 LEU 0.149 -0.418 0.247 0.238 A 757 LYS 0.188 -0.654 0.220 0.273 A 758 ALA 0.396 0.028 0.428 0.237 A 759 LYS 0.596 0.217 0.383 0.441 A 760 ALA 0.094 -0.266 0.119 0.323 A 761 ASN 0.353 -0.509 0.604 0.131 A 762 ASN 0.379 -0.300 0.231 0.436 A 763 LEU 0.279 -0.422 0.133 0.370 A 764 GLU 0.074 -0.461 0.095 0.215 A 765 ASP 0.424 0.171 0.266 0.504 A 766 VAL 0.210 -0.354 0.059 0.388 A 767 ASP 0.208 -0.044 0.105 0.377 A 768 GLU 0.006 -0.258 0.045 0.181 A 769 GLN 0.654 0.460 0.542 0.463 A 770 ARG 0.302 -0.139 0.307 0.304 A 771 HIS 0.222 0.041 0.231 0.271 A 772 TYR 0.449 0.109 0.344 0.406 A 773 ILE 0.441 0.075 0.526 0.289 A 774 GLU 0.540 0.210 0.447 0.447 A 775 SER 0.633 0.509 0.532 0.429 A 776 LEU 0.627 0.479 0.538 0.397 A 777 PRO 0.253 0.047 0.309 0.265 A 778 ASN 0.209 -0.409 0.431 0.117 A 779 LYS 0.516 -0.024 0.424 0.381 A 780 VAL 0.608 0.336 0.493 0.406 A 781 TYR 0.537 -0.164 0.306 0.491 A 782 GLU 0.378 -0.647 0.211 0.443 A 783 LEU 0.361 -0.200 0.422 0.287 A 784 MET 0.401 -0.261 0.239 0.413 A 785 ALA 0.396 0.107 0.349 0.356 A 786 ASP 0.357 0.223 0.395 0.286 A 787 VAL 0.342 -0.162 0.324 0.321 A 788 GLU 0.445 0.082 0.383 0.394 A 789 ALA 0.322 -0.044 0.311 0.321 A 790 GLN 0.348 -0.278 0.259 0.367 A 791 ARG 0.390 -0.002 0.351 0.343 A 792 GLY 0.088 -0.276 0.182 N/A A 793 TRP 0.413 0.118 0.410 0.355 A 794 TYR 0.606 -0.026 0.409 0.506 A 795 GLU 0.416 0.092 0.404 0.351 A 796 LEU 0.262 -0.190 0.239 0.311 A 797 LEU 0.557 0.018 0.485 0.379 A 798 GLU 0.596 0.273 0.583 0.412 A 799 GLY 0.526 0.299 0.432 N/A A 800 MET 0.549 0.212 0.484 0.386 A 801 ARG 0.457 0.125 0.474 0.343 A 802 TYR 0.214 -0.432 0.420 0.188 A 803 LEU 0.453 0.121 0.429 0.341 A 804 LEU 0.389 0.064 0.271 0.374 A 805 PRO 0.168 -0.195 0.141 0.292 A 806 GLU 0.457 0.135 0.510 0.322 A 807 GLU 0.100 -0.547 0.301 0.104 A 808 ASP 0.605 0.281 0.557 0.454 A 809 LEU 0.315 -0.006 0.404 0.267 A 810 LYS 0.172 -0.506 -0.004 0.348 A 811 GLU 0.459 0.164 0.453 0.362 A 812 LYS 0.392 -0.520 0.152 0.413 A 813 PHE 0.104 -0.478 -0.007 0.282 A 814 ALA 0.144 -0.462 0.142 0.351 A 815 GLY 0.164 -0.060 0.225 N/A A 816 GLU 0.374 0.128 0.373 0.330 A 817 SER 0.337 -0.181 0.297 0.355 A 818 TRP 0.467 -0.325 0.229 0.458 A 819 GLY 0.096 -0.477 0.187 N/A A 820 MET 0.177 -0.433 0.047 0.354 A 821 ARG 0.398 0.057 0.395 0.334 A 822 LEU 0.473 0.046 0.319 0.404 A 823 THR 0.369 -0.152 0.409 0.285 A 824 ARG 0.308 0.035 0.360 0.290 A 825 GLN 0.399 -0.151 0.389 0.338 A 826 ALA 0.470 0.046 0.487 0.242 A 827 GLU 0.480 0.131 0.382 0.430 A 828 LYS 0.373 0.112 0.311 0.343 A 829 GLN 0.350 -0.042 0.429 0.276 A 830 LEU 0.221 -0.259 0.300 0.257 A 831 GLU 0.089 -0.318 0.004 0.291 A 832 VAL 0.288 -0.628 0.433 0.218 A 833 LEU 0.035 -0.164 0.126 0.224 A 834 ALA -0.119 -0.503 -0.016 0.260 A 835 GLY -0.198 -0.517 0.019 N/A A 836 ASP 0.053 -0.441 0.175 0.101 A 837 GLU 0.280 -0.115 0.261 0.311 A 838 ALA 0.281 -0.124 0.273 0.326 A 839 ARG 0.376 -0.295 0.100 0.418 A 840 PHE 0.237 -0.670 0.578 0.136 A 841 LYS 0.246 -0.338 0.077 0.360 A 842 GLY 0.419 -0.081 0.371 N/A A 843 GLU 0.295 -0.061 0.174 0.384 A 844 MET 0.420 -0.098 0.429 0.323 A 845 ILE 0.494 0.189 0.442 0.360 A 846 THR 0.232 -0.194 0.082 0.411 A 847 GLU 0.439 -0.056 0.194 0.514 A 848 GLN 0.323 -0.184 0.180 0.389 A 849 ASP -0.086 -0.325 0.023 0.067 A 850 MET 0.012 -0.361 0.055 0.230 A 851 PHE 0.289 -0.503 0.479 0.219 A 852 ARG 0.335 -0.189 0.338 0.314 A 853 ASP 0.477 0.160 0.386 0.455 A 854 THR 0.530 0.212 0.425 0.414 A 855 ILE 0.414 -0.236 0.478 0.294 A 856 GLY 0.081 -0.354 0.178 N/A A 857 ASP 0.440 -0.450 0.195 0.596 A 858 LEU 0.405 0.135 0.303 0.369 A 859 GLN 0.460 -0.069 0.564 0.293 A 860 VAL 0.066 -0.494 0.074 0.279 A 861 LEU 0.378 -0.436 0.317 0.346 A 862 VAL 0.547 0.108 0.527 0.343 A 863 SER 0.133 -0.374 0.209 0.217 A 864 ASN 0.329 -0.631 0.063 0.512 A 865 PHE 0.519 0.245 0.469 0.404 A 866 GLY 0.012 -0.733 0.139 N/A A 867 LEU 0.174 -0.611 0.143 0.301 A 868 TYR 0.171 -0.410 0.294 0.204 A 869 THR 0.350 -0.146 0.233 0.401 A 870 ASP 0.343 -0.105 0.301 0.362 A 871 LEU 0.477 0.255 0.449 0.346 A 872 GLY 0.688 0.521 0.545 N/A B 1 MET 0.521 0.188 0.400 0.396 B 2 ALA 0.403 0.003 0.318 0.411 B 3 ASP 0.214 -0.344 0.125 0.365 B 4 GLU 0.627 0.349 0.548 0.466 B 5 GLY 0.276 -0.192 0.290 N/A B 6 GLU 0.290 -0.630 0.243 0.333 B 7 VAL 0.561 0.262 0.499 0.370 B 8 SER 0.506 -0.021 0.447 0.378 B 9 ALA 0.524 -0.069 0.470 0.334 B 10 LEU 0.633 0.339 0.517 0.411 B 11 VAL 0.703 0.556 0.590 0.415 B 12 CYS 0.649 0.285 0.490 0.498 B 13 ASP 0.584 0.345 0.486 0.498 B 14 ASN 0.445 0.022 0.360 0.406 B 15 GLY 0.733 0.570 0.550 N/A B 16 SER 0.684 0.278 0.610 0.397 B 17 GLY 0.655 0.424 0.506 N/A B 18 MET 0.661 0.390 0.581 0.415 B 19 VAL 0.452 -0.011 0.532 0.274 B 20 LYS 0.571 0.258 0.524 0.375 B 21 ALA 0.635 0.400 0.497 0.432 B 22 GLY 0.556 0.280 0.450 N/A B 23 PHE 0.744 0.501 0.634 0.511 B 24 ALA 0.452 -0.252 0.359 0.410 B 25 GLY 0.655 0.576 0.506 N/A B 26 ASP 0.468 -0.098 0.399 0.429 B 27 ASP 0.542 0.194 0.524 0.404 B 28 ALA 0.668 0.424 0.547 0.398 B 29 PRO 0.612 0.406 0.601 0.381 B 30 ARG 0.709 0.603 0.568 0.466 B 31 ALA 0.732 0.490 0.581 0.427 B 32 VAL 0.720 0.614 0.582 0.431 B 33 PHE 0.532 0.058 0.588 0.364 B 34 PRO 0.504 -0.076 0.356 0.433 B 35 SER 0.693 0.535 0.574 0.449 B 36 ILE 0.538 0.010 0.501 0.360 B 37 VAL 0.704 0.434 0.566 0.429 B 38 GLY 0.744 0.611 0.557 N/A B 39 ARG 0.361 -0.145 0.446 0.294 B 40 PRO 0.559 0.398 0.492 0.401 B 41 ARG -0.000 -0.790 0.056 0.203 B 42 HIS 0.535 0.419 0.482 0.419 B 43 THR 0.497 0.283 0.472 0.350 B 44 GLY 0.351 -0.166 0.332 N/A B 45 VAL 0.468 0.173 0.300 0.424 B 46 MET 0.237 -0.485 0.457 0.175 B 47 VAL 0.288 -0.362 0.348 0.269 B 48 GLY 0.318 0.026 0.314 N/A B 49 MET 0.559 0.190 0.497 0.387 B 50 GLY 0.197 0.031 0.244 N/A B 51 GLN 0.132 -0.656 -0.032 0.349 B 52 LYS 0.035 -0.408 0.189 0.198 B 53 ASP 0.308 -0.159 0.208 0.407 B 54 SER 0.638 0.477 0.558 0.403 B 55 TYR 0.572 0.025 0.509 0.438 B 56 VAL 0.672 0.198 0.500 0.447 B 57 GLY 0.502 0.433 0.419 N/A B 58 ASP 0.651 0.147 0.558 0.515 B 59 GLU 0.270 -0.570 0.592 0.081 B 60 ALA 0.470 0.073 0.371 0.414 B 61 GLN 0.455 0.097 0.303 0.430 B 62 SER 0.619 0.404 0.562 0.375 B 63 LYS 0.501 0.143 0.478 0.352 B 64 ARG 0.711 0.535 0.576 0.464 B 65 GLY 0.368 -0.114 0.342 N/A B 66 ILE 0.586 0.418 0.472 0.403 B 67 LEU 0.430 -0.188 0.436 0.324 B 68 THR 0.555 0.096 0.542 0.348 B 69 LEU 0.236 -0.553 0.538 0.157 B 70 ARG 0.582 -0.039 0.563 0.390 B 71 TYR 0.669 0.415 0.601 0.479 B 72 PRO 0.613 0.484 0.570 0.399 B 73 ILE 0.665 0.309 0.518 0.430 B 74 GLU 0.670 0.332 0.601 0.474 B 75 HIS 0.741 0.632 0.629 0.526 B 76 GLY 0.537 0.261 0.439 N/A B 77 ILE 0.567 0.259 0.522 0.368 B 78 VAL 0.744 0.672 0.608 0.433 B 79 THR 0.648 0.302 0.577 0.404 B 80 ASN 0.628 0.206 0.435 0.532 B 81 TRP 0.714 0.546 0.603 0.525 B 82 ASP 0.295 -0.117 0.390 0.208 B 83 ASP 0.637 0.437 0.540 0.514 B 84 MET 0.540 -0.289 0.356 0.450 B 85 GLU 0.445 0.027 0.528 0.298 B 86 LYS 0.429 -0.167 0.472 0.314 B 87 ILE 0.600 0.399 0.464 0.415 B 88 TRP 0.630 0.437 0.533 0.483 B 89 HIS 0.535 -0.155 0.253 0.543 B 90 HIS 0.743 0.553 0.562 0.564 B 91 THR 0.520 -0.186 0.410 0.416 B 92 PHE 0.592 0.361 0.531 0.435 B 93 PHE 0.482 0.018 0.517 0.355 B 94 ASN 0.674 0.399 0.551 0.492 B 95 GLU 0.647 0.460 0.574 0.470 B 96 LEU 0.617 0.307 0.530 0.395 B 97 ARG 0.659 -0.116 0.580 0.431 B 98 VAL 0.552 0.178 0.488 0.370 B 99 ALA 0.413 0.104 0.343 0.386 B 100 PRO 0.640 0.348 0.525 0.445 B 101 GLU 0.682 0.528 0.613 0.478 B 102 GLU 0.569 -0.096 0.517 0.430 B 103 HIS 0.581 0.344 0.501 0.451 B 104 PRO 0.471 -0.090 0.394 0.387 B 105 VAL 0.667 0.377 0.516 0.434 B 106 LEU 0.662 0.504 0.553 0.412 B 107 LEU 0.593 0.325 0.509 0.390 B 108 THR 0.526 -0.023 0.473 0.374 B 109 GLU 0.527 0.045 0.455 0.429 B 110 ALA 0.654 0.406 0.509 0.439 B 111 PRO 0.476 0.190 0.367 0.405 B 112 LEU 0.594 0.306 0.547 0.373 B 113 ASN 0.729 0.606 0.567 0.534 B 114 PRO 0.580 -0.148 0.501 0.411 B 115 LYS 0.718 0.555 0.609 0.425 B 116 ALA 0.571 0.057 0.462 0.406 B 117 ASN 0.619 0.286 0.493 0.480 B 118 ARG 0.561 0.021 0.547 0.382 B 119 GLU 0.506 0.172 0.415 0.435 B 120 LYS 0.660 0.129 0.508 0.431 B 121 MET 0.453 -0.001 0.411 0.357 B 122 THR 0.643 0.428 0.530 0.434 B 123 GLN 0.375 -0.320 0.541 0.236 B 124 ILE 0.665 0.375 0.592 0.396 B 125 MET 0.604 0.323 0.512 0.412 B 126 PHE 0.693 0.480 0.537 0.511 B 127 GLU 0.440 0.101 0.391 0.384 B 128 THR 0.627 0.386 0.501 0.442 B 129 PHE 0.619 0.355 0.470 0.483 B 130 ASN 0.556 0.171 0.569 0.360 B 131 VAL 0.647 0.408 0.583 0.380 B 132 PRO 0.420 -0.312 0.390 0.349 B 133 ALA 0.528 0.353 0.483 0.319 B 134 MET 0.505 0.251 0.435 0.382 B 135 TYR 0.540 -0.074 0.555 0.394 B 136 VAL 0.619 0.288 0.490 0.416 B 137 ALA 0.623 0.360 0.561 0.321 B 138 ILE 0.487 -0.094 0.538 0.312 B 139 GLN 0.646 -0.243 0.421 0.522 B 140 ALA 0.584 0.286 0.512 0.347 B 141 VAL 0.404 -0.160 0.375 0.334 B 142 LEU 0.510 0.016 0.296 0.437 B 143 SER 0.534 0.351 0.456 0.401 B 144 LEU 0.541 0.321 0.499 0.362 B 145 TYR 0.361 -0.171 0.334 0.340 B 146 ALA 0.673 0.517 0.549 0.402 B 147 SER 0.645 0.453 0.541 0.432 B 148 GLY 0.751 0.714 0.561 N/A B 149 ARG 0.517 0.329 0.435 0.393 B 150 THR 0.202 -0.471 0.168 0.320 B 151 THR 0.245 -0.105 0.196 0.336 B 152 GLY 0.674 0.441 0.517 N/A B 153 ILE 0.579 0.414 0.514 0.379 B 154 VAL 0.533 0.171 0.515 0.341 B 155 LEU 0.590 0.444 0.486 0.399 B 156 ASP 0.610 0.225 0.558 0.460 B 157 SER 0.349 -0.351 0.540 0.077 B 158 GLY 0.756 0.528 0.564 N/A B 159 ASP 0.614 0.228 0.473 0.551 B 160 GLY 0.482 0.356 0.407 N/A B 161 VAL 0.502 0.082 0.423 0.374 B 162 THR 0.572 0.037 0.387 0.479 B 163 HIS 0.665 0.476 0.579 0.484 B 164 THR 0.476 -0.006 0.399 0.386 B 165 VAL 0.602 0.150 0.454 0.425 B 166 PRO 0.540 0.322 0.536 0.361 B 167 ILE 0.671 0.331 0.545 0.421 B 168 TYR 0.293 -0.200 0.400 0.259 B 169 GLU 0.434 0.016 0.419 0.360 B 170 GLY 0.736 0.639 0.553 N/A B 171 TYR 0.425 -0.332 0.518 0.317 B 172 ALA 0.573 0.284 0.515 0.329 B 173 LEU 0.530 0.289 0.451 0.378 B 174 PRO 0.575 0.334 0.565 0.373 B 175 HIS 0.522 0.193 0.363 0.473 B 176 ALA 0.655 0.497 0.566 0.355 B 177 ILE 0.572 0.189 0.518 0.373 B 178 LEU 0.665 0.539 0.581 0.401 B 179 ARG 0.609 -0.125 0.409 0.458 B 180 LEU 0.668 0.313 0.578 0.404 B 181 ASP 0.442 -0.036 0.423 0.371 B 182 LEU 0.557 0.293 0.414 0.412 B 183 ALA 0.411 0.161 0.388 0.316 B 184 GLY 0.690 0.597 0.526 N/A B 185 ARG 0.532 -0.395 0.289 0.451 B 186 ASP 0.485 0.091 0.447 0.404 B 187 LEU 0.645 0.372 0.491 0.431 B 188 THR 0.442 -0.028 0.323 0.414 B 189 ASP 0.322 -0.075 0.198 0.437 B 190 TYR 0.420 0.057 0.460 0.336 B 191 LEU 0.470 0.102 0.406 0.362 B 192 MET 0.383 -0.167 0.327 0.351 B 193 LYS 0.303 -0.162 0.254 0.325 B 194 ILE 0.521 -0.022 0.421 0.386 B 195 LEU 0.644 0.285 0.563 0.396 B 196 MET 0.221 -0.323 0.248 0.277 B 197 GLU 0.366 0.098 0.277 0.387 B 198 ARG 0.533 -0.162 0.473 0.390 B 199 GLY 0.651 0.517 0.504 N/A B 200 TYR 0.346 -0.105 0.228 0.370 B 201 SER 0.405 -0.071 0.300 0.433 B 202 PHE 0.376 -0.258 0.142 0.432 B 203 THR 0.436 -0.023 0.303 0.423 B 204 THR -0.307 -0.632 -0.206 0.155 B 205 THR 0.417 -0.303 0.362 0.363 B 206 ALA 0.488 0.322 0.455 0.311 B 207 GLU 0.537 -0.065 0.525 0.392 B 208 ARG 0.627 0.317 0.571 0.415 B 209 GLU 0.595 0.280 0.447 0.501 B 210 ILE 0.460 0.203 0.480 0.322 B 211 VAL 0.611 0.415 0.514 0.396 B 212 ARG 0.547 0.214 0.488 0.393 B 213 ASP 0.318 0.067 0.313 0.315 B 214 ILE 0.416 -0.142 0.218 0.415 B 215 LYS 0.476 -0.393 0.537 0.316 B 216 GLU 0.567 0.414 0.491 0.444 B 217 LYS 0.378 0.104 0.313 0.345 B 218 LEU 0.532 0.182 0.391 0.407 B 219 CYS 0.660 0.525 0.520 0.476 B 220 TYR 0.449 -0.048 0.553 0.323 B 221 VAL 0.137 -0.737 0.085 0.322 B 222 ALA 0.490 0.124 0.406 0.388 B 223 LEU 0.615 0.458 0.548 0.386 B 224 ASP 0.640 0.527 0.548 0.509 B 225 PHE 0.634 0.376 0.482 0.489 B 226 GLU 0.468 0.211 0.327 0.455 B 227 GLN 0.508 -0.172 0.482 0.376 B 228 GLU 0.553 0.265 0.433 0.469 B 229 MET 0.473 -0.149 0.342 0.408 B 230 ALA 0.422 0.245 0.402 0.308 B 231 THR 0.639 0.477 0.516 0.442 B 232 ALA 0.624 0.355 0.563 0.319 B 233 LEU 0.297 -0.138 0.287 0.310 B 234 SER 0.554 0.312 0.443 0.440 B 235 SER 0.357 0.086 0.337 0.332 B 236 SER 0.640 0.266 0.533 0.435 B 237 ALA 0.295 -0.006 0.309 0.289 B 238 LEU 0.542 0.353 0.415 0.402 B 239 GLU 0.383 -0.016 0.464 0.278 B 240 LYS 0.615 0.158 0.465 0.422 B 241 THR 0.685 0.539 0.568 0.442 B 242 TYR 0.391 0.008 0.346 0.359 B 243 GLU 0.514 0.128 0.451 0.419 B 244 LEU 0.532 0.193 0.489 0.362 B 245 PRO 0.619 0.508 0.518 0.433 B 246 ASP 0.671 0.238 0.580 0.520 B 247 GLY 0.418 0.230 0.370 N/A B 248 GLN 0.548 0.271 0.455 0.424 B 249 MET 0.521 0.215 0.564 0.323 B 250 ILE 0.493 -0.025 0.530 0.319 B 251 THR 0.649 0.493 0.516 0.449 B 252 ILE 0.261 -0.244 0.163 0.345 B 253 GLY 0.227 -0.342 0.262 N/A B 254 ASN 0.353 -0.418 0.285 0.369 B 255 GLU 0.547 0.080 0.362 0.511 B 256 ARG 0.478 0.257 0.408 0.378 B 257 PHE 0.540 0.332 0.486 0.413 B 258 ARG 0.535 -0.134 0.288 0.453 B 259 CYS 0.392 -0.308 0.297 0.421 B 260 PRO 0.735 0.618 0.682 0.432 B 261 GLU 0.227 -0.587 0.011 0.425 B 262 VAL 0.574 -0.073 0.415 0.429 B 263 LEU 0.408 -0.066 0.374 0.339 B 264 PHE 0.612 0.376 0.484 0.471 B 265 ASN 0.547 0.341 0.472 0.423 B 266 PRO 0.630 0.472 0.572 0.411 B 267 ASN 0.594 0.354 0.478 0.466 B 268 MET 0.484 0.172 0.539 0.309 B 269 ILE 0.390 0.185 0.360 0.334 B 270 GLY 0.639 0.601 0.497 N/A B 271 MET 0.388 -0.313 0.489 0.267 B 272 GLU 0.490 0.318 0.392 0.434 B 273 ALA 0.595 0.267 0.553 0.297 B 274 VAL 0.496 0.087 0.529 0.306 B 275 GLY 0.108 -0.491 0.193 N/A B 276 ILE 0.526 0.139 0.546 0.332 B 277 HIS 0.427 0.000 0.413 0.358 B 278 ASP 0.514 -0.193 0.397 0.493 B 279 THR 0.588 0.310 0.476 0.426 B 280 THR 0.683 0.521 0.556 0.449 B 281 PHE 0.463 0.164 0.419 0.382 B 282 ASN 0.555 0.349 0.417 0.473 B 283 SER 0.494 0.214 0.475 0.331 B 284 ILE 0.597 0.404 0.482 0.405 B 285 MET 0.432 0.158 0.356 0.371 B 286 LYS 0.568 -0.078 0.334 0.444 B 287 CYS 0.605 0.360 0.565 0.356 B 288 ASP 0.555 -0.200 0.390 0.554 B 289 VAL 0.423 0.021 0.319 0.381 B 290 ASP 0.655 0.422 0.506 0.572 B 291 ILE 0.315 -0.492 0.325 0.304 B 292 ARG 0.546 0.339 0.483 0.394 B 293 LYS 0.323 -0.149 0.522 0.235 B 294 ASP 0.595 0.251 0.504 0.494 B 295 LEU 0.391 -0.305 0.474 0.282 B 296 TYR 0.643 0.092 0.427 0.528 B 297 ASN 0.531 0.181 0.412 0.453 B 298 ASN 0.621 0.044 0.505 0.473 B 299 ILE 0.610 0.388 0.486 0.411 B 300 VAL 0.706 0.536 0.562 0.434 B 301 LEU 0.451 0.150 0.443 0.334 B 302 SER 0.535 0.253 0.514 0.332 B 303 GLY 0.725 0.617 0.546 N/A B 304 GLY 0.630 0.384 0.492 N/A B 305 THR 0.438 0.150 0.338 0.399 B 306 THR 0.331 0.005 0.254 0.368 B 307 MET 0.321 0.047 0.346 0.296 B 308 PHE 0.552 -0.002 0.375 0.471 B 309 PRO 0.549 0.394 0.478 0.400 B 310 GLY 0.452 0.281 0.390 N/A B 311 ILE 0.335 -0.082 0.480 0.244 B 312 ALA 0.607 0.096 0.483 0.418 B 313 ASP 0.322 0.103 0.274 0.360 B 314 ARG 0.570 0.338 0.480 0.411 B 315 MET 0.163 -0.596 0.224 0.248 B 316 SER 0.540 0.380 0.457 0.407 B 317 LYS 0.550 0.334 0.437 0.395 B 318 GLU 0.585 0.111 0.516 0.446 B 319 ILE 0.423 -0.165 0.365 0.352 B 320 THR 0.381 -0.375 0.265 0.404 B 321 ALA 0.535 0.385 0.484 0.327 B 322 LEU 0.690 0.414 0.589 0.413 B 323 ALA 0.342 0.063 0.346 0.293 B 324 PRO 0.572 -0.068 0.454 0.431 B 325 SER 0.337 -0.318 0.274 0.383 B 326 ALA 0.062 -0.354 0.134 0.260 B 327 MET 0.394 -0.036 0.247 0.403 B 328 LYS 0.682 0.530 0.541 0.430 B 329 ILE 0.567 -0.020 0.520 0.369 B 330 LYS 0.505 0.234 0.494 0.349 B 331 VAL 0.631 0.319 0.502 0.417 B 332 VAL 0.675 0.436 0.536 0.427 B 333 ALA 0.433 -0.015 0.388 0.343 B 334 PRO 0.672 0.521 0.587 0.435 B 335 PRO 0.646 0.564 0.627 0.393 B 336 GLU 0.663 0.460 0.498 0.536 B 337 ARG 0.456 0.195 0.416 0.362 B 338 LYS 0.657 0.265 0.505 0.430 B 339 TYR 0.688 0.292 0.488 0.540 B 340 SER 0.614 0.571 0.513 0.428 B 341 VAL 0.366 -0.072 0.307 0.349 B 342 TRP 0.595 0.275 0.458 0.481 B 343 ILE 0.611 0.284 0.457 0.425 B 344 GLY 0.533 0.321 0.436 N/A B 345 GLY 0.513 0.408 0.425 N/A B 346 SER 0.585 0.401 0.496 0.414 B 347 ILE 0.361 -0.092 0.387 0.304 B 348 LEU 0.460 0.243 0.381 0.367 B 349 ALA 0.601 0.398 0.485 0.407 B 350 SER 0.643 0.413 0.565 0.401 B 351 LEU 0.367 -0.509 0.530 0.241 B 352 SER -0.041 -0.546 0.069 0.175 B 353 THR 0.160 -0.588 0.444 0.076 B 354 PHE 0.519 0.108 0.516 0.384 B 355 GLN 0.363 -0.201 0.276 0.370 B 356 GLN 0.628 0.344 0.473 0.480 B 357 MET 0.435 -0.115 0.547 0.269 B 358 TRP 0.234 -0.263 0.337 0.241 B 359 ILE 0.410 0.112 0.429 0.315 B 360 ALA 0.511 -0.069 0.392 0.434 B 361 LYS 0.538 0.059 0.513 0.360 B 362 SER 0.595 0.312 0.580 0.325 B 363 GLU 0.687 0.315 0.493 0.564 B 364 TYR 0.688 0.376 0.518 0.528 B 365 ASP 0.506 0.173 0.429 0.450 B 366 GLU 0.535 -0.120 0.456 0.436 B 367 SER 0.747 0.460 0.584 0.503 B 368 GLY 0.641 0.343 0.498 N/A B 369 PRO 0.689 0.307 0.558 0.465 B 370 SER 0.574 0.157 0.462 0.442 B 371 ILE 0.602 0.410 0.497 0.401 B 372 VAL 0.542 0.278 0.465 0.378 [deleted to fit within ticket limits] Ld 208 ARG 0.617 0.308 0.732 0.663 Ld 209 GLU 0.572 0.129 0.579 0.674 Ld 210 ILE 0.461 0.171 0.605 0.625 Ld 211 VAL 0.584 0.330 0.625 0.694 Ld 212 ARG 0.715 0.466 0.680 0.740 Ld 213 ASP 0.158 -0.294 0.375 0.324 Ld 214 ILE 0.473 0.045 0.415 0.720 Ld 215 LYS 0.580 0.116 0.667 0.672 Ld 216 GLU 0.604 0.444 0.660 0.652 Ld 217 LYS 0.202 -0.173 0.312 0.592 Ld 218 LEU 0.578 0.357 0.613 0.693 Ld 219 CYS 0.644 0.532 0.654 0.721 Ld 220 TYR 0.497 0.003 0.703 0.556 Ld 221 VAL 0.185 -0.597 0.271 0.626 Ld 222 ALA 0.500 0.082 0.532 0.743 Ld 223 LEU 0.533 0.277 0.680 0.635 Ld 224 ASP 0.571 0.097 0.699 0.551 Ld 225 PHE 0.651 0.373 0.608 0.722 Ld 226 GLU 0.455 0.120 0.479 0.624 Ld 227 GLN 0.447 0.129 0.605 0.569 Ld 228 GLU 0.487 0.234 0.562 0.601 Ld 229 MET 0.477 -0.145 0.457 0.698 Ld 230 ALA 0.481 0.301 0.589 0.634 Ld 231 THR 0.551 0.341 0.673 0.619 Ld 232 ALA 0.611 0.397 0.688 0.649 Ld 233 LEU 0.332 -0.261 0.428 0.627 Ld 234 SER 0.612 0.423 0.632 0.708 Ld 235 SER 0.484 0.269 0.522 0.688 Ld 236 SER 0.662 0.434 0.689 0.700 Ld 237 ALA 0.460 0.058 0.542 0.678 Ld 238 LEU 0.526 0.311 0.538 0.695 Ld 239 GLU 0.618 0.366 0.621 0.692 Ld 240 LYS 0.635 0.407 0.630 0.717 Ld 241 THR 0.633 0.452 0.681 0.684 Ld 242 TYR 0.406 0.038 0.547 0.546 Ld 243 GLU 0.605 0.423 0.684 0.638 Ld 244 LEU 0.541 0.306 0.644 0.656 Ld 245 PRO 0.518 0.181 0.644 0.615 Ld 246 ASP 0.594 0.233 0.607 0.674 Ld 247 GLY 0.473 0.404 0.584 N/A Ld 248 GLN 0.359 -0.123 0.565 0.518 Ld 249 MET 0.587 0.420 0.621 0.688 Ld 250 ILE 0.497 0.187 0.608 0.645 Ld 251 THR 0.667 0.551 0.681 0.714 Ld 252 ILE 0.286 -0.403 0.239 0.686 Ld 253 GLY 0.404 -0.057 0.545 N/A Ld 254 ASN 0.422 -0.388 0.440 0.642 Ld 255 GLU 0.520 0.041 0.477 0.691 Ld 256 ARG 0.473 0.292 0.535 0.640 Ld 257 PHE 0.571 0.271 0.687 0.625 Ld 258 ARG 0.459 -0.382 0.353 0.692 Ld 259 CYS 0.467 -0.114 0.523 0.666 Ld 260 PRO 0.665 0.426 0.732 0.681 Ld 261 GLU 0.206 -0.441 0.174 0.579 Ld 262 VAL 0.617 0.242 0.611 0.725 Ld 263 LEU 0.421 -0.056 0.529 0.636 Ld 264 PHE 0.599 0.378 0.600 0.685 Ld 265 ASN 0.574 0.400 0.587 0.683 Ld 266 PRO 0.660 0.499 0.689 0.701 Ld 267 ASN 0.604 0.287 0.593 0.709 Ld 268 MET 0.524 0.230 0.695 0.602 Ld 269 ILE 0.424 0.079 0.436 0.680 Ld 270 GLY 0.682 0.654 0.704 N/A Ld 271 MET 0.370 -0.286 0.603 0.540 Ld 272 GLU 0.376 -0.108 0.607 0.460 Ld 273 ALA 0.579 0.233 0.688 0.608 Ld 274 VAL 0.509 0.155 0.687 0.604 Ld 275 GLY 0.053 -0.576 0.344 N/A Ld 276 ILE 0.539 0.275 0.674 0.641 Ld 277 HIS 0.416 0.006 0.500 0.572 Ld 278 ASP 0.523 -0.230 0.536 0.650 Ld 279 THR 0.600 0.424 0.637 0.689 Ld 280 THR 0.684 0.607 0.705 0.711 Ld 281 PHE 0.429 0.190 0.552 0.572 Ld 282 ASN 0.561 0.366 0.590 0.668 Ld 283 SER 0.514 0.280 0.616 0.611 Ld 284 ILE 0.646 0.454 0.689 0.700 Ld 285 MET 0.458 0.152 0.498 0.661 Ld 286 LYS 0.560 0.250 0.557 0.702 Ld 287 CYS 0.654 0.397 0.739 0.632 Ld 288 ASP 0.554 -0.225 0.547 0.680 Ld 289 VAL 0.488 0.125 0.469 0.720 Ld 290 ASP 0.574 0.362 0.644 0.609 Ld 291 ILE 0.512 -0.112 0.491 0.709 Ld 292 ARG 0.560 0.273 0.602 0.671 Ld 293 LYS 0.539 -0.021 0.676 0.645 Ld 294 ASP 0.671 0.512 0.686 0.697 Ld 295 LEU 0.377 -0.329 0.604 0.574 Ld 296 TYR 0.659 0.246 0.585 0.733 Ld 297 ASN 0.344 0.074 0.464 0.546 Ld 298 ASN 0.558 -0.032 0.573 0.678 Ld 299 ILE 0.669 0.479 0.689 0.714 Ld 300 VAL 0.721 0.598 0.737 0.722 Ld 301 LEU 0.544 0.093 0.689 0.637 Ld 302 SER 0.616 0.352 0.667 0.672 Ld 303 GLY 0.780 0.666 0.760 N/A Ld 304 GLY 0.662 0.473 0.693 N/A Ld 305 THR 0.388 0.051 0.448 0.645 Ld 306 THR 0.451 -0.027 0.481 0.675 Ld 307 MET 0.245 -0.216 0.479 0.517 Ld 308 PHE 0.549 0.070 0.475 0.699 Ld 309 PRO 0.570 0.488 0.596 0.682 Ld 310 GLY 0.504 0.365 0.602 N/A Ld 311 ILE 0.356 -0.058 0.617 0.555 Ld 312 ALA 0.572 0.101 0.603 0.727 Ld 313 ASP 0.321 0.039 0.406 0.511 Ld 314 ARG 0.572 0.360 0.641 0.665 Ld 315 MET 0.160 -0.617 0.421 0.487 Ld 316 SER 0.478 0.078 0.477 0.734 Ld 317 LYS 0.533 0.140 0.503 0.707 Ld 318 GLU 0.604 0.248 0.647 0.661 Ld 319 ILE 0.581 0.281 0.598 0.702 Ld 320 THR 0.347 -0.302 0.394 0.650 Ld 321 ALA 0.557 0.384 0.645 0.646 Ld 322 LEU 0.691 0.409 0.753 0.698 Ld 323 ALA 0.223 -0.234 0.385 0.617 Ld 324 PRO 0.557 -0.111 0.510 0.720 Ld 325 SER 0.330 -0.380 0.411 0.636 Ld 326 ALA 0.071 -0.236 0.259 0.617 Ld 327 MET 0.469 0.155 0.448 0.696 Ld 328 LYS 0.655 0.435 0.704 0.700 Ld 329 ILE 0.555 0.071 0.624 0.674 Ld 330 LYS 0.510 0.264 0.671 0.631 Ld 331 VAL 0.661 0.326 0.666 0.722 Ld 332 VAL 0.673 0.477 0.697 0.713 Ld 333 ALA 0.487 0.079 0.554 0.694 Ld 334 PRO 0.652 0.403 0.643 0.720 Ld 335 PRO 0.629 0.497 0.701 0.670 Ld 336 GLU 0.666 0.447 0.633 0.733 Ld 337 ARG 0.479 0.172 0.566 0.633 Ld 338 LYS 0.647 0.313 0.642 0.719 Ld 339 TYR 0.703 0.326 0.643 0.746 Ld 340 SER 0.590 0.543 0.641 0.672 Ld 341 VAL 0.401 -0.085 0.459 0.665 Ld 342 TRP 0.589 0.321 0.587 0.670 Ld 343 ILE 0.532 0.055 0.530 0.703 Ld 344 GLY 0.524 0.322 0.614 N/A Ld 345 GLY 0.422 0.187 0.555 N/A Ld 346 SER 0.606 0.353 0.659 0.670 Ld 347 ILE 0.359 -0.059 0.549 0.588 Ld 348 LEU 0.370 0.014 0.483 0.625 Ld 349 ALA 0.648 0.428 0.650 0.752 Ld 350 SER 0.686 0.487 0.735 0.675 Ld 351 LEU 0.675 0.488 0.744 0.692 Ld 352 SER 0.682 0.525 0.743 0.659 Ld 353 THR 0.339 -0.376 0.684 0.425 Ld 354 PHE 0.612 0.247 0.645 0.676 Ld 355 GLN 0.484 -0.130 0.457 0.680 Ld 356 GLN 0.514 0.214 0.653 0.598 Ld 357 MET 0.538 0.310 0.654 0.635 Ld 358 TRP 0.305 0.070 0.383 0.517 Ld 359 ILE 0.482 0.302 0.561 0.658 Ld 360 ALA 0.468 -0.149 0.512 0.735 Ld 361 LYS 0.576 0.076 0.636 0.681 Ld 362 SER 0.599 0.158 0.738 0.566 Ld 363 GLU 0.717 0.461 0.662 0.764 Ld 364 TYR 0.691 0.239 0.624 0.743 Ld 365 ASP 0.555 -0.010 0.533 0.696 Ld 366 GLU 0.683 0.291 0.635 0.748 Ld 367 SER 0.730 0.370 0.710 0.757 Ld 368 GLY 0.714 0.471 0.722 N/A Ld 369 PRO 0.703 0.493 0.710 0.722 Ld 370 SER 0.586 0.477 0.631 0.679 Ld 371 ILE 0.694 0.490 0.704 0.722 Ld 372 VAL 0.560 0.227 0.639 0.669 Ld 373 HIS 0.678 0.454 0.651 0.728 Ld 374 ARG 0.595 0.396 0.695 0.661 Ld 375 LYS 0.224 -0.315 0.282 0.616 Ld 376 CYS 0.612 0.356 0.635 0.705 Ld 377 PHE 0.378 -0.147 0.495 0.548 Le 1 MET 0.313 -0.309 0.496 0.600 Le 2 ALA -0.399 -0.735 -0.013 0.437 Le 3 THR 0.182 -0.608 0.189 0.659 Le 4 LEU 0.063 -0.599 0.400 0.474 Le 5 THR 0.617 0.573 0.655 0.691 Le 6 TYR 0.083 -0.515 0.558 0.283 Le 7 THR 0.109 -0.240 0.362 0.465 Le 8 VAL 0.399 0.007 0.628 0.562 Le 9 PHE -0.031 -0.370 0.092 0.407 Le 10 SER 0.053 -0.342 0.149 0.619 Le 11 LEU 0.259 -0.271 0.436 0.579 Le 12 GLY 0.411 -0.114 0.549 N/A Le 13 GLU 0.297 -0.411 0.335 0.563 Le 14 ALA 0.186 -0.298 0.374 0.588 Le 15 GLN 0.422 -0.111 0.415 0.652 Le 16 LEU 0.146 -0.272 0.410 0.521 Le 17 HIS 0.013 -0.415 0.277 0.327 Le 18 GLN 0.403 0.194 0.472 0.606 Le 19 LEU 0.228 -0.762 0.233 0.653 Le 20 HIS 0.255 -0.342 0.383 0.489 Le 21 THR 0.013 -0.834 0.514 0.267 Le 22 SER 0.554 0.202 0.614 0.662 Le 23 ASN 0.289 -0.335 0.483 0.476 Le 24 GLY 0.570 0.462 0.640 N/A Le 25 LYS 0.314 -0.553 0.561 0.562 Le 26 LEU -0.152 -0.653 0.316 0.381 Le 27 PHE 0.438 -0.022 0.684 0.522 Le 28 VAL 0.106 -0.749 0.583 0.384 Le 29 MET 0.210 -0.545 0.272 0.604 Le 30 GLY -0.043 -0.432 0.290 N/A Le 31 GLU -0.161 -0.745 -0.110 0.401 Le 32 VAL 0.232 -0.429 0.466 0.542 Le 33 ALA 0.166 -0.280 0.365 0.577 Le 34 VAL 0.381 -0.007 0.564 0.588 Le 35 GLU -0.005 -0.486 0.043 0.455 Le 36 LEU 0.266 -0.501 0.263 0.663 Le 37 PHE 0.460 -0.016 0.553 0.596 Le 38 GLN 0.277 -0.028 0.338 0.576 Le 39 GLU 0.466 0.059 0.417 0.676 Le 40 SER 0.085 -0.198 0.233 0.556 Le 41 PRO 0.266 -0.338 0.133 0.703 Le 42 THR 0.153 -0.517 0.219 0.611 Le 43 ALA -0.189 -0.828 0.075 0.567 Le 44 PHE 0.361 -0.500 0.292 0.629 Le 45 LEU -0.110 -0.711 0.291 0.419 Le 46 GLN -0.045 -0.818 -0.020 0.508 Le 47 GLU -0.003 -0.498 0.333 0.264 Le 48 LEU 0.088 -0.679 0.078 0.639 Le 49 ARG 0.216 -0.530 0.461 0.508 Le 50 LYS 0.097 -0.686 -0.018 0.657 Le 51 ASN -0.000 -0.432 0.333 0.300 Le 52 LYS 0.349 0.063 0.440 0.627 Le 53 LEU 0.409 0.110 0.507 0.638 Le 54 PRO 0.559 0.304 0.592 0.676 Le 55 LYS 0.188 -0.100 0.369 0.563 Le 56 LEU 0.148 -0.488 0.391 0.531 Le 57 GLN 0.046 -0.508 0.167 0.480 Le 58 SER -0.019 -0.629 0.191 0.481 Le 59 ALA -0.140 -0.403 0.195 0.449 Le 60 ASN 0.350 -0.179 0.531 0.501 Le 61 ARG 0.318 -0.690 0.485 0.563 Le 62 ASP 0.310 -0.112 0.530 0.372 Le 63 VAL 0.133 -0.315 0.320 0.561 Le 64 LEU 0.183 -0.566 0.683 0.418 Le 65 HIS 0.026 -0.578 0.196 0.384 Le 66 THR 0.334 -0.066 0.559 0.514 Le 67 VAL 0.030 -0.650 0.151 0.591 Le 68 ALA -0.205 -0.636 -0.040 0.721 Le 69 GLU 0.377 -0.379 0.315 0.655 Le 70 LEU 0.286 -0.263 0.272 0.671 Le 71 HIS 0.055 -0.682 0.258 0.376 Le 72 LEU 0.035 -0.769 0.272 0.517 Le 73 PRO -0.068 -0.557 0.193 0.410 Le 74 VAL 0.011 -0.461 0.114 0.599 Le 75 GLU 0.403 -0.246 0.486 0.568 Le 76 SER 0.071 -0.562 0.286 0.476 Le 77 SER 0.516 0.207 0.676 0.540 Le 78 ALA 0.476 0.134 0.549 0.689 Le 79 ASN 0.408 0.209 0.567 0.533 Le 80 SER 0.283 -0.100 0.341 0.664 Le 81 GLN 0.425 -0.099 0.381 0.673 Le 82 GLY 0.288 0.065 0.479 N/A Le 83 VAL 0.384 -0.636 0.442 0.663 Le 84 CYS 0.193 -0.627 0.509 0.354 Le 85 LEU 0.095 -0.559 0.619 0.393 Le 86 LEU -0.044 -0.747 0.123 0.537 Le 87 PRO 0.388 -0.104 0.562 0.559 Le 88 ALA 0.114 -0.427 0.411 0.443 Le 89 ALA -0.070 -0.388 0.175 0.566 Le 90 THR 0.357 -0.160 0.561 0.533 Le 91 VAL 0.122 -0.399 0.486 0.454 Le 92 GLU 0.426 0.136 0.578 0.529 Le 93 THR 0.181 -0.594 0.293 0.580 Le 94 LEU 0.161 -0.446 0.415 0.528 Le 95 LEU 0.222 -0.614 0.435 0.556 Le 96 VAL 0.131 -0.598 0.246 0.604 Le 97 ASP 0.243 -0.544 0.650 0.163 Le 98 LYS 0.251 -0.281 0.447 0.569 Le 99 ARG 0.217 -0.258 0.373 0.538 Le 100 ARG 0.145 -0.789 0.191 0.554 Le 101 MET -0.089 -0.452 0.096 0.483 Le 102 GLU -0.010 -0.620 -0.002 0.480 Le 103 LEU 0.085 -0.467 0.338 0.517 Le 104 VAL 0.109 -0.599 0.533 0.416 Le 105 GLN -0.295 -0.770 0.017 0.282 Le 106 PRO -0.155 -0.535 0.086 0.402 Le 107 PHE 0.019 -0.443 0.264 0.373 Le 108 LYS 0.213 -0.531 0.421 0.558 Le 109 LEU 0.056 -0.454 0.134 0.593 Le 110 ALA 0.213 -0.289 0.337 0.677 Le 111 LEU 0.233 -0.271 0.333 0.611 Le 112 LEU 0.164 -0.504 0.442 0.517 Le 113 LYS 0.133 -0.313 0.470 0.494 Le 114 LEU 0.411 -0.353 0.707 0.547 Le 115 ALA 0.074 -0.284 0.266 0.610 Le 116 SER -0.016 -0.571 0.246 0.418 Le 117 GLN 0.285 -0.462 0.351 0.575 Le 118 GLU 0.159 -0.564 0.372 0.399 Le 119 ALA -0.046 -0.452 0.281 0.438 Le 120 ALA 0.015 -0.599 0.223 0.601 Le 121 ARG -0.018 -0.388 0.284 0.424 Le 122 LEU 0.060 -0.406 0.200 0.565 Le 123 MET 0.052 -0.818 0.085 0.591 Le 124 ALA 0.325 -0.530 0.426 0.684 Le 125 ALA -0.067 -0.508 0.235 0.481 Le 126 GLY 0.204 -0.339 0.431 N/A Le 127 GLU 0.051 -0.572 0.387 0.282 Le 128 TYR 0.177 -0.319 0.338 0.447 Le 129 GLU 0.323 -0.300 0.453 0.510 Le 130 LEU 0.130 -0.475 0.396 0.518 Le 131 ALA 0.393 0.084 0.558 0.571 Le 132 LEU 0.184 -0.378 0.221 0.632 Le 133 PRO 0.267 0.113 0.340 0.589 Le 134 VAL 0.399 -0.315 0.371 0.717 Le 135 ALA 0.070 -0.300 0.342 0.491 Le 136 LEU 0.496 -0.109 0.497 0.696 Le 137 ASP 0.163 -0.548 0.332 0.373 Le 138 ALA 0.047 -0.136 0.233 0.626 Le 139 VAL 0.082 -0.314 0.300 0.537 Le 140 GLN 0.165 -0.374 0.140 0.592 Le 141 GLN 0.228 -0.418 0.349 0.530 Le 142 GLY 0.025 -0.246 0.329 N/A Le 143 GLN 0.174 -0.539 0.424 0.444 Le 144 ALA 0.425 0.078 0.558 0.612 Le 145 LEU 0.218 -0.438 0.159 0.681 Le 146 PHE 0.218 -0.573 0.510 0.424 Le 147 LYS 0.630 0.413 0.665 0.701 Le 148 PRO 0.252 -0.037 0.337 0.580 Le 149 ALA 0.084 -0.211 0.315 0.549 Le 150 PRO 0.385 -0.165 0.245 0.734 Le 151 ALA -0.240 -0.707 0.121 0.435 Le 152 LEU 0.230 -0.269 0.326 0.611 Le 153 GLN 0.193 -0.310 0.135 0.617 Le 154 LEU -0.072 -0.496 0.187 0.490 Le 155 PHE 0.039 -0.243 0.334 0.359 Le 156 PRO 0.261 -0.097 0.263 0.627 Le 157 LEU 0.143 -0.790 0.249 0.593 Le 158 TYR 0.109 -0.505 0.285 0.413 Le 159 LEU -0.165 -0.640 0.125 0.461 Le 160 LEU 0.000 -0.492 0.124 0.563 Le 161 ALA 0.050 -0.435 0.243 0.615 Le 162 ALA 0.523 0.008 0.581 0.698 Le 163 GLN 0.180 -0.808 0.238 0.551 Le 164 ALA 0.391 -0.443 0.440 0.746 Le 165 ASN 0.248 -0.311 0.162 0.677 Le 166 LEU 0.103 -0.542 0.599 0.407 Le 167 GLY 0.510 0.133 0.606 N/A Le 168 LEU -0.161 -0.702 -0.017 0.529 Le 169 ARG 0.195 -0.596 0.378 0.523 Le 170 ARG 0.189 -0.427 0.533 0.468 Le 171 ALA 0.125 -0.479 0.429 0.430 Le 172 LYS 0.270 -0.393 0.630 0.512 Le 173 GLN 0.441 -0.052 0.446 0.651 Le 174 CYS 0.247 -0.146 0.487 0.446 Le 175 GLU 0.131 -0.331 0.351 0.386 Le 176 ASP -0.026 -0.237 0.235 0.219 Le 177 PHE -0.112 -0.746 0.159 0.315 Le 178 LEU 0.426 -0.107 0.566 0.621 Le 179 ALA 0.472 0.315 0.539 0.697 Le 180 LEU 0.333 -0.133 0.442 0.621 Le 181 ALA 0.252 -0.316 0.507 0.471 Le 182 SER 0.134 -0.675 0.491 0.305 Le 183 TRP 0.094 -0.450 0.116 0.442 Le 184 LEU 0.223 -0.108 0.436 0.556 Le 185 ALA 0.175 -0.340 0.364 0.589 Le 186 MET -0.178 -0.779 0.091 0.421 Le 187 LYS 0.360 -0.175 0.355 0.665 Le 188 GLU 0.026 -0.819 0.001 0.514 Le 189 PRO 0.037 -0.576 0.244 0.463 Le 190 GLY 0.275 -0.243 0.472 N/A Le 191 LEU 0.071 -0.493 0.436 0.463 Le 192 THR 0.080 -0.580 0.182 0.575 Le 193 THR -0.096 -0.612 0.003 0.555 Le 194 SER -0.000 -0.776 0.448 0.195 Le 195 ILE 0.322 0.051 0.507 0.584 Le 196 MET 0.193 -0.529 0.451 0.494 Le 197 LYS 0.439 0.072 0.410 0.689 Le 198 SER 0.228 -0.213 0.378 0.554 Le 199 GLN 0.119 -0.339 0.314 0.459 Le 200 LEU -0.045 -0.649 -0.014 0.599 Le 201 SER 0.212 -0.388 0.567 0.307 Le 202 ARG 0.004 -0.692 0.089 0.502 Le 203 LEU 0.186 -0.704 0.343 0.577 Le 204 TYR 0.054 -0.654 0.679 0.211 Le 205 GLY -0.215 -0.737 0.191 N/A Le 206 GLN 0.230 -0.482 0.226 0.598 Le 207 LEU 0.263 -0.114 0.422 0.587 Le 208 TYR -0.027 -0.483 0.086 0.384 Le 209 ALA 0.360 -0.216 0.580 0.496 Le 210 PHE 0.088 -0.389 0.253 0.432 Le 211 GLN 0.439 -0.032 0.583 0.574 Le 212 SER 0.165 -0.352 0.336 0.527 Le 213 LYS -0.117 -0.661 -0.096 0.566 Le 214 HIS -0.335 -0.786 0.019 0.152 Le 215 ALA 0.422 -0.127 0.617 0.518 Le 216 GLU 0.103 -0.528 0.313 0.383 Le 217 ALA 0.633 0.582 0.668 0.706 Le 218 LEU 0.135 -0.509 0.616 0.419 Le 219 HIS 0.049 -0.476 0.143 0.433 Le 220 ALA 0.311 -0.046 0.475 0.593 Le 221 PHE 0.174 -0.539 0.326 0.468 Le 222 ALA -0.407 -0.760 -0.058 0.494 Le 223 GLU -0.067 -0.430 0.337 0.197 Le 224 ASP 0.187 -0.490 0.509 0.229 Le 225 VAL -0.034 -0.509 0.315 0.447 Le 226 TYR -0.010 -0.727 0.098 0.393 Le 227 TYR 0.318 -0.392 0.549 0.475 Le 228 CYS 0.245 -0.523 0.593 0.315 Le 229 SER 0.137 -0.178 0.349 0.479 Le 230 LEU 0.023 -0.447 0.193 0.545 Le 231 GLU 0.318 -0.146 0.255 0.637 Le 232 TYR -0.084 -0.830 0.137 0.318 Le 233 GLY 0.497 0.082 0.598 N/A Le 234 PRO 0.442 -0.134 0.569 0.597 Le 235 GLU 0.307 -0.608 0.573 0.414 Le 236 ASP 0.194 -0.776 0.116 0.631 Le 237 VAL -0.215 -0.764 0.077 0.463 Le 238 ARG 0.176 -0.709 0.138 0.591 Le 239 THR -0.108 -0.745 -0.032 0.571 Le 240 SER 0.588 0.181 0.622 0.693 Le 241 LEU 0.336 -0.297 0.655 0.525 Le 242 GLY 0.149 -0.178 0.399 N/A Le 243 TYR 0.401 -0.059 0.553 0.539 Le 244 TYR -0.051 -0.746 0.102 0.358 Le 245 ASN 0.291 -0.432 0.398 0.543 Le 246 MET 0.167 -0.461 0.438 0.483 Le 247 GLY 0.310 0.091 0.491 N/A Le 248 LYS 0.062 -0.650 0.185 0.561 Le 249 VAL 0.133 -0.338 0.181 0.645 Le 250 PHE -0.015 -0.525 0.258 0.349 Le 251 GLN 0.156 -0.588 0.221 0.540 Le 252 SER 0.072 -0.350 0.294 0.467 Le 253 SER 0.252 -0.512 0.291 0.687 Le 254 ALA 0.336 -0.187 0.481 0.615 Le 255 GLU 0.216 -0.486 0.343 0.476 Le 256 LEU 0.210 -0.185 0.279 0.621 Le 257 ASP 0.091 -0.542 0.083 0.528 Le 258 LYS 0.556 0.195 0.573 0.694 Le 259 ALA 0.159 -0.317 0.302 0.662 Le 260 ALA 0.494 -0.041 0.662 0.540 Le 261 SER 0.386 -0.038 0.580 0.500 Le 262 CYS 0.411 -0.037 0.537 0.582 Le 263 ASN 0.208 -0.532 0.350 0.496 Le 264 ASP 0.221 0.007 0.352 0.431 Le 265 GLN 0.163 -0.406 0.511 0.388 Le 266 VAL 0.406 -0.039 0.675 0.539 Le 267 VAL 0.440 -0.041 0.548 0.639 Le 268 ALA 0.268 -0.502 0.409 0.638 Le 269 ILE 0.527 0.232 0.675 0.633 Le 270 TRP 0.256 -0.378 0.550 0.423 Le 271 ALA 0.251 -0.435 0.356 0.697 Le 272 ALA 0.342 -0.019 0.434 0.692 Le 273 ALA 0.489 0.340 0.586 0.650 Le 274 LEU -0.049 -0.718 0.114 0.538 Le 275 ASN -0.022 -0.820 -0.085 0.592 Le 276 ALA 0.222 -0.187 0.435 0.542 Le 277 VAL 0.032 -0.531 0.229 0.545 Le 278 VAL 0.012 -0.400 0.075 0.623 Le 279 LEU 0.018 -0.582 0.168 0.554 Le 280 GLY 0.018 -0.446 0.324 N/A Le 281 LEU -0.165 -0.531 0.184 0.434 Le 282 ALA -0.036 -0.411 0.158 0.634 Le 283 ASP 0.480 -0.031 0.479 0.650 Le 284 GLY 0.035 -0.569 0.334 N/A Le 285 GLY 0.254 0.059 0.459 N/A Le 286 GLY -0.016 -0.546 0.305 N/A Le 287 ALA 0.183 -0.149 0.397 0.549 Le 288 ALA -0.059 -0.299 0.236 0.489 Le 289 GLN 0.216 -0.513 0.216 0.593 Le 290 PRO 0.477 0.063 0.510 0.658 Le 291 ALA 0.054 -0.430 0.361 0.442 Le 292 ALA 0.418 -0.343 0.516 0.665 Le 293 LEU 0.250 -0.050 0.355 0.610 Le 294 PRO 0.324 -0.357 0.269 0.673 Le 295 VAL 0.396 -0.346 0.634 0.557 Le 296 GLY -0.155 -0.273 0.226 N/A Le 297 ARG 0.212 -0.264 0.158 0.606 Le 298 LEU 0.068 -0.548 0.160 0.589 Le 299 GLN -0.085 -0.793 0.163 0.375 Le 300 LEU -0.039 -0.807 0.124 0.540 Le 301 MET 0.333 -0.035 0.644 0.491 Le 302 GLU 0.410 -0.469 0.664 0.456 Le 303 VAL 0.018 -0.355 0.251 0.522 Le 304 VAL 0.136 -0.339 0.210 0.629 Le 305 ASP 0.455 0.045 0.506 0.590 Le 306 MET 0.486 0.217 0.517 0.671 Le 307 LEU 0.093 -0.327 0.270 0.553 Le 308 THR 0.361 0.137 0.438 0.628 Le 309 ASP 0.235 -0.502 0.175 0.627 Le 310 ILE 0.285 -0.073 0.245 0.683 Le 311 ALA 0.233 -0.212 0.474 0.497 Le 312 ARG 0.483 0.160 0.651 0.608 Le 313 SER 0.263 -0.123 0.494 0.456 Le 314 ARG -0.001 -0.421 0.172 0.472 Le 315 ALA -0.379 -0.810 0.045 0.375 Le 316 ALA 0.025 -0.335 0.321 0.466 Le 317 ALA 0.598 0.494 0.660 0.673 Le 318 LEU 0.450 -0.099 0.492 0.671 Le 319 GLY 0.325 0.179 0.500 N/A Le 320 SER 0.161 -0.449 0.191 0.698 Le 321 GLY 0.440 0.326 0.565 N/A Le 322 HIS 0.307 -0.181 0.574 0.432 Le 323 VAL 0.084 -0.629 0.236 0.577 Le 324 THR 0.256 -0.274 0.421 0.550 Le 325 VAL -0.173 -0.619 0.062 0.502 Le 326 GLY 0.200 -0.263 0.429 N/A Le 327 GLU 0.234 -0.360 0.385 0.466 Le 328 ALA 0.113 -0.042 0.328 0.566 Le 329 HIS 0.070 -0.539 0.564 0.222 Le 330 LEU 0.034 -0.470 0.151 0.572 Le 331 VAL 0.219 -0.275 0.310 0.627 Le 332 THR -0.153 -0.723 0.383 0.220 Le 333 ALA 0.061 -0.497 0.378 0.426 Le 334 LEU 0.280 -0.351 0.587 0.522 Le 335 ALA 0.452 0.088 0.511 0.714 Le 336 CYS 0.033 -0.378 0.239 0.486 Le 337 ILE 0.189 -0.521 0.432 0.537 Le 338 GLN 0.453 0.030 0.612 0.570 Le 339 LEU 0.126 -0.570 0.133 0.636 Le 340 GLU -0.132 -0.721 -0.184 0.480 Le 341 GLU 0.323 -0.328 0.303 0.610 Le 342 ARG 0.044 -0.876 -0.058 0.576 Le 343 GLY -0.423 -0.786 0.072 N/A Le 344 ARG 0.268 -0.689 0.285 0.598 Le 345 ALA -0.290 -0.765 0.130 0.359 Le 346 GLY 0.076 -0.370 0.357 N/A Le 347 GLU 0.428 -0.227 0.579 0.531 Le 348 GLU 0.506 0.086 0.484 0.673 Le 349 LEU -0.263 -0.705 0.155 0.387 Le 350 GLU 0.169 -0.273 0.276 0.474 Le 351 ALA 0.386 -0.388 0.485 0.671 Le 352 ALA 0.336 -0.022 0.461 0.645 Le 353 ALA 0.226 -0.309 0.429 0.556 Le 354 ALA 0.599 0.308 0.692 0.627 Le 355 THR 0.184 -0.536 0.596 0.356 Le 356 PHE -0.039 -0.680 0.424 0.259 Le 357 GLY 0.408 0.171 0.547 N/A Le 358 GLU 0.243 -0.460 0.315 0.521 Le 359 ASP 0.183 -0.766 0.082 0.651 Le 360 ASP 0.294 -0.172 0.235 0.646 Le 361 VAL 0.025 -0.714 0.211 0.551 Le 362 GLU 0.308 -0.546 0.349 0.564 Le 363 ARG 0.274 -0.586 0.254 0.612 Le 364 LEU 0.254 -0.160 0.431 0.578 Le 365 ARG 0.123 -0.639 0.089 0.575 Le 366 LEU 0.147 -0.140 0.443 0.507 Le 367 VAL 0.337 -0.046 0.502 0.594 Le 368 GLU 0.418 -0.137 0.554 0.537 Le 369 MET 0.315 0.054 0.348 0.639 Le 370 ALA 0.124 -0.164 0.343 0.556 Le 371 ARG 0.322 -0.172 0.437 0.581 Le 372 VAL 0.326 -0.429 0.612 0.521 Le 373 MET -0.142 -0.687 0.045 0.472 Le 374 LEU 0.311 -0.400 0.604 0.533 Le 375 ASN 0.345 0.014 0.430 0.573 Le 376 ALA 0.335 -0.230 0.469 0.631 Le 377 LEU 0.382 -0.569 0.576 0.589 Le 378 THR 0.439 -0.220 0.633 0.551 Le 379 GLY 0.596 0.507 0.655 N/A Le 380 GLY 0.318 -0.373 0.474 N/A Lf 1 MET 0.219 -0.191 0.494 0.533 Lf 2 ALA 0.506 0.226 0.608 0.637 Lf 3 THR -0.280 -0.721 0.185 0.258 Lf 4 LEU 0.291 -0.510 0.349 0.639 Lf 5 VAL 0.403 -0.105 0.630 0.564 Lf 6 GLN 0.271 -0.250 0.606 0.425 Lf 7 ALA 0.409 0.081 0.524 0.642 Lf 8 PRO 0.324 -0.204 0.430 0.583 Lf 9 MET 0.373 -0.026 0.489 0.604 Lf 10 ASP 0.429 0.049 0.456 0.604 Lf 11 SER -0.124 -0.597 0.194 0.351 Lf 12 ALA 0.262 0.024 0.456 0.561 Lf 13 ARG 0.264 -0.296 0.412 0.554 Lf 14 GLY 0.459 0.204 0.576 N/A Lf 15 GLN 0.075 -0.654 0.525 0.308 Lf 16 LEU 0.513 0.234 0.573 0.672 Lf 17 SER 0.303 -0.183 0.302 0.735 Lf 18 SER 0.337 -0.170 0.397 0.661 Lf 19 ARG 0.311 -0.524 0.334 0.608 Lf 20 GLU 0.419 -0.181 0.329 0.689 Lf 48 GLN 0.201 -0.308 0.157 0.613 Lf 49 ALA 0.249 -0.123 0.452 0.549 Lf 50 TYR 0.240 -0.240 0.376 0.482 Lf 51 ARG 0.153 -0.379 0.294 0.525 Lf 52 GLU 0.072 -0.801 0.195 0.430 Lf 53 THR -0.006 -0.421 0.200 0.486 Lf 54 GLN 0.306 -0.129 0.493 0.515 Lf 55 LEU 0.055 -0.314 0.152 0.584 Lf 56 ALA 0.301 -0.174 0.524 0.506 Lf 57 ASP 0.066 -0.467 0.062 0.515 Lf 58 LYS 0.427 0.073 0.469 0.660 Lf 59 LYS 0.518 0.020 0.575 0.672 Lf 60 SER 0.352 -0.178 0.437 0.632 Lf 61 LEU 0.008 -0.672 0.219 0.524 Lf 62 CYS 0.304 -0.108 0.419 0.595 Lf 63 ILE 0.248 -0.222 0.456 0.563 Lf 64 GLN -0.023 -0.556 0.019 0.504 Lf 65 LEU 0.577 0.364 0.610 0.694 Lf 66 LEU 0.214 -0.268 0.535 0.505 Lf 67 VAL 0.283 -0.273 0.553 0.526 Lf 68 GLU 0.228 -0.645 0.192 0.589 Lf 69 GLY 0.212 -0.613 0.435 N/A Lf 70 ARG 0.123 -0.596 0.285 0.510 Lf 71 PRO -0.291 -0.565 -0.122 0.412 Lf 72 GLN 0.316 0.104 0.423 0.561 Lf 73 ALA -0.037 -0.464 0.152 0.642 Lf 74 PHE 0.008 -0.665 0.243 0.374 Lf 75 VAL 0.319 -0.018 0.444 0.617 Lf 76 ASP 0.111 -0.404 0.265 0.372 Lf 77 PHE 0.146 -0.550 0.532 0.358 Lf 78 PHE -0.028 -0.512 0.325 0.310 Lf 79 SER 0.262 -0.372 0.297 0.691 Lf 80 LEU -0.135 -0.389 0.171 0.458 Lf 81 THR -0.046 -0.467 0.355 0.335 Lf 82 HIS 0.410 -0.094 0.586 0.519 Lf 83 ASN 0.299 -0.389 0.467 0.499 Lf 84 ARG 0.184 -0.251 0.360 0.522 Lf 85 MET 0.111 -0.361 0.348 0.491 Lf 86 ALA 0.590 0.355 0.633 0.704 Lf 87 GLY 0.370 -0.095 0.526 N/A Lf 88 GLY 0.555 0.395 0.632 N/A Lf 89 GLU 0.385 -0.054 0.407 0.603 Lf 90 VAL 0.302 -0.241 0.453 0.600 Lf 91 GLY 0.411 0.217 0.549 N/A Lf 92 PRO 0.356 -0.063 0.347 0.655 Lf 93 ASP 0.364 -0.011 0.476 0.499 Lf 94 GLY 0.282 -0.076 0.475 N/A Lf 95 GLN 0.055 -0.766 0.395 0.362 Lf 96 PRO 0.141 -0.040 0.289 0.519 Lf 97 ALA 0.433 -0.172 0.634 0.507 Lf 98 ALA 0.116 -0.078 0.330 0.566 Lf 99 ALA 0.351 0.046 0.479 0.636 Lf 100 ALA 0.363 -0.236 0.491 0.633 Lf 101 ALA 0.232 -0.033 0.431 0.560 Lf 102 ALA 0.502 0.215 0.541 0.732 Lf 103 ALA 0.250 -0.397 0.405 0.622 Lf 104 GLY 0.682 0.528 0.704 N/A Lf 105 ASP 0.145 -0.454 0.556 0.126 Lf 106 ASP -0.041 -0.706 0.467 -0.033 Lf 107 VAL 0.457 0.026 0.681 0.571 Lf 108 PRO -0.245 -0.801 0.162 0.290 Lf 109 GLN 0.321 -0.061 0.374 0.592 Lf 110 GLU 0.291 -0.319 0.249 0.614 Lf 111 ALA -0.171 -0.473 0.173 0.444 Lf 112 LEU 0.280 -0.268 0.420 0.599 Lf 113 GLY -0.143 -0.344 0.232 N/A Lf 114 LEU 0.129 -0.732 0.135 0.637 Lf 115 LEU 0.361 -0.254 0.526 0.599 Lf 116 ARG 0.224 -0.259 0.562 0.479 Lf 117 SER 0.270 -0.172 0.484 0.476 Lf 118 GLU 0.289 -0.245 0.548 0.412 Lf 119 LEU 0.318 -0.164 0.328 0.665 Lf 120 LEU 0.227 -0.223 0.275 0.633 Lf 121 LYS 0.040 -0.805 0.037 0.604 Lf 122 ALA 0.116 -0.420 0.272 0.653 Lf 123 ASP 0.356 -0.614 0.347 0.616 Lf 124 ASN -0.021 -0.607 0.299 0.305 Lf 125 ALA -0.033 -0.381 0.280 0.455 Lf 126 LEU 0.273 -0.299 0.421 0.594 Lf 127 ARG 0.194 -0.580 0.460 0.495 Lf 128 THR 0.331 -0.588 0.378 0.648 Lf 129 GLY 0.414 0.063 0.551 N/A Lf 130 ASP 0.179 -0.403 0.403 0.324 Lf 131 THR 0.211 -0.260 0.393 0.532 Lf 132 GLN 0.450 0.010 0.383 0.693 Lf 133 ALA 0.029 -0.322 0.263 0.557 Lf 134 VAL 0.325 -0.055 0.301 0.706 Lf 135 TYR 0.303 -0.822 0.132 0.629 Lf 136 ALA -0.147 -0.472 0.052 0.655 Lf 137 SER -0.156 -0.718 0.080 0.450 Lf 138 TYR 0.194 -0.515 0.274 0.486 Lf 139 LYS 0.243 -0.206 0.292 0.623 Lf 140 ASN 0.139 -0.626 0.136 0.587 Lf 141 LEU -0.039 -0.735 -0.039 0.614 Lf 142 ALA 0.187 -0.307 0.370 0.595 Lf 143 LYS 0.321 -0.242 0.544 0.572 Lf 144 TYR -0.002 -0.785 0.031 0.426 Lf 145 PHE -0.120 -0.559 0.092 0.338 Lf 146 ALA 0.238 -0.500 0.526 0.425 Lf 147 GLN 0.399 -0.182 0.581 0.543 Lf 148 ILE 0.431 0.016 0.521 0.645 Lf 149 GLY 0.195 -0.226 0.426 N/A Lf 150 ARG 0.129 -0.330 0.239 0.529 Lf 151 LEU 0.049 -0.559 0.115 0.598 Lf 152 HIS 0.269 -0.753 0.174 0.616 Lf 153 LYS -0.009 -0.794 0.186 0.521 Lf 154 ALA 0.335 -0.204 0.480 0.614 Lf 155 GLU 0.279 0.005 0.379 0.515 Lf 156 PHE 0.268 -0.467 0.180 0.605 Lf 157 PHE 0.289 -0.202 0.395 0.529 Lf 158 PHE 0.215 -0.597 0.365 0.484 Lf 159 ARG 0.127 -0.246 0.255 0.522 Lf 160 ARG 0.113 -0.535 0.110 0.562 Lf 161 CYS -0.115 -0.295 0.139 0.428 Lf 162 LEU 0.326 -0.209 0.520 0.581 Lf 163 ARG 0.324 -0.141 0.495 0.562 Lf 164 LEU 0.268 -0.331 0.437 0.583 Lf 165 SER 0.211 -0.028 0.323 0.599 Lf 166 GLN 0.112 -0.357 0.075 0.584 Lf 167 ASP 0.363 -0.127 0.563 0.410 Lf 168 THR 0.179 -0.365 0.532 0.400 Lf 169 GLN 0.239 -0.269 0.158 0.642 Lf 170 TRP 0.323 -0.154 0.627 0.449 Lf 171 LEU 0.305 -0.454 0.277 0.680 Lf 172 ALA 0.521 0.377 0.615 0.644 Lf 173 GLY 0.529 0.411 0.617 N/A Lf 174 GLU 0.384 -0.111 0.526 0.522 Lf 175 LEU 0.159 -0.297 0.293 0.583 Lf 176 GLU 0.290 -0.554 0.164 0.670 Lf 177 ALA 0.544 0.278 0.632 0.649 Lf 178 ASN 0.191 -0.480 0.295 0.519 Lf 179 LEU 0.305 -0.219 0.489 0.582 Lf 180 ALA 0.142 -0.221 0.311 0.627 Lf 181 LEU 0.128 -0.401 0.362 0.532 Lf 182 GLY 0.093 -0.571 0.367 N/A Lf 183 VAL 0.091 -0.509 0.243 0.578 Lf 184 VAL 0.184 -0.571 0.586 0.437 Lf 185 TYR -0.041 -0.751 0.012 0.403 Lf 186 GLU 0.114 -0.568 0.440 0.310 Lf 187 GLU 0.327 -0.508 0.405 0.546 Lf 188 LEU 0.374 -0.107 0.605 0.571 Lf 189 GLN 0.156 -0.042 0.401 0.442 Lf 190 GLU 0.188 -0.512 0.575 0.293 Lf 191 THR 0.195 -0.584 0.502 0.435 Lf 192 GLU 0.180 -0.541 0.121 0.588 Lf 193 ALA 0.351 0.166 0.497 0.609 Lf 194 ALA 0.385 0.122 0.492 0.660 Lf 195 ILE 0.313 0.086 0.523 0.572 Lf 196 ALA 0.237 -0.259 0.335 0.710 Lf 197 CYS -0.058 -0.522 0.250 0.363 Lf 198 TYR 0.367 -0.540 0.489 0.538 Lf 199 GLU 0.339 -0.209 0.515 0.484 Lf 200 ARG 0.065 -0.488 0.257 0.483 Lf 201 ARG 0.170 -0.411 0.167 0.577 Lf 202 LEU 0.512 0.240 0.555 0.679 Lf 203 SER 0.473 -0.027 0.542 0.650 Lf 204 LEU 0.164 -0.455 0.183 0.636 Lf 205 ALA 0.036 -0.223 0.312 0.494 Lf 206 SER 0.316 -0.102 0.543 0.461 Lf 207 ASP 0.330 -0.438 0.385 0.543 Lf 208 ASN -0.256 -0.798 -0.128 0.390 Lf 209 GLN 0.259 -0.102 0.384 0.535 Lf 210 LEU 0.046 -0.754 0.116 0.595 Lf 211 ALA 0.240 -0.385 0.422 0.583 Lf 212 LEU 0.348 0.144 0.442 0.631 Lf 213 GLU 0.356 -0.087 0.621 0.430 Lf 214 SER 0.433 0.147 0.516 0.634 Lf 215 ASP 0.408 0.085 0.445 0.588 Lf 216 THR 0.405 0.187 0.533 0.596 Lf 217 ALA 0.050 -0.390 0.258 0.591 Lf 218 TYR -0.074 -0.484 0.231 0.289 Lf 219 GLN 0.350 -0.170 0.587 0.499 Lf 220 ASN 0.318 -0.456 0.307 0.637 Lf 221 LEU 0.300 -0.164 0.589 0.533 Lf 222 THR -0.090 -0.830 0.028 0.542 Lf 223 THR 0.369 0.032 0.444 0.631 Lf 224 VAL -0.020 -0.815 0.538 0.323 Lf 225 TYR 0.104 -0.358 0.476 0.332 Lf 226 LEU 0.199 -0.254 0.451 0.535 Lf 227 ARG 0.233 -0.821 0.458 0.519 Lf 228 GLN 0.226 -0.137 0.428 0.485 Lf 229 ALA 0.139 -0.164 0.308 0.628 Lf 230 GLU -0.058 -0.765 0.043 0.402 Lf 231 VAL -0.111 -0.533 0.299 0.403 Lf 232 GLN 0.114 -0.407 0.331 0.446 Lf 233 GLU 0.385 0.002 0.491 0.547 Lf 234 SER 0.151 -0.352 0.359 0.483 Lf 235 THR 0.238 -0.198 0.369 0.573 Lf 236 GLY 0.619 0.350 0.668 N/A Lf 237 GLN 0.129 -0.377 0.186 0.537 Lf 238 VAL 0.210 -0.279 0.482 0.518 Lf 239 ASP 0.537 0.184 0.560 0.644 Lf 240 ASP 0.317 0.027 0.548 0.363 Lf 241 ALA -0.066 -0.242 0.229 0.489 Lf 242 ILE -0.110 -0.620 0.359 0.387 Lf 243 ALA 0.563 0.383 0.650 0.646 Lf 244 SER 0.454 0.209 0.548 0.620 Lf 245 TYR 0.140 -0.263 0.399 0.393 Lf 246 ASN 0.000 -0.317 0.146 0.441 Lf 247 LYS 0.112 -0.552 0.158 0.599 Lf 248 CYS 0.085 -0.145 0.363 0.400 Lf 249 LEU 0.155 -0.289 0.280 0.586 Lf 250 SER 0.384 0.135 0.476 0.623 Lf 251 ALA -0.202 -0.383 0.046 0.594 Lf 252 ALA 0.191 -0.107 0.351 0.628 Lf 253 GLU 0.121 -0.409 0.296 0.412 Lf 254 ARG 0.218 -0.266 0.532 0.485 Lf 255 SER 0.098 -0.389 0.355 0.424 Lf 256 GLY 0.168 -0.407 0.410 N/A Lf 257 ASP 0.344 -0.279 0.393 0.555 Lf 258 ASN 0.014 -0.638 0.274 0.359 Lf 259 ALA 0.118 -0.337 0.309 0.601 Lf 260 THR 0.386 -0.163 0.463 0.632 Lf 261 ALA -0.025 -0.423 0.294 0.444 Lf 262 ALA 0.230 -0.180 0.365 0.657 Lf 263 LYS 0.237 -0.302 0.416 0.573 Lf 264 ALA 0.369 -0.011 0.494 0.637 Lf 265 ASN 0.270 -0.480 0.236 0.643 Lf 266 TYR 0.129 -0.400 0.282 0.430 Lf 267 ARG 0.305 -0.343 0.251 0.632 Lf 268 ILE 0.597 0.416 0.644 0.691 Lf 269 GLY -0.059 -0.621 0.281 N/A Lf 270 MET 0.179 -0.534 0.260 0.588 Lf 271 LEU 0.057 -0.607 0.081 0.618 Lf 272 TYR 0.408 0.092 0.435 0.592 Lf 273 ALA 0.453 0.244 0.581 0.611 Lf 274 GLY 0.468 0.245 0.581 N/A Lf 275 GLY 0.608 0.420 0.662 N/A Lf 276 ARG 0.417 -0.288 0.645 0.569 Lf 277 ARG 0.264 -0.208 0.535 0.513 Lf 278 HIS 0.441 0.312 0.550 0.568 Lf 279 PRO 0.488 0.131 0.548 0.645 Lf 280 GLU 0.223 -0.688 0.240 0.552 Lf 281 ALA 0.215 -0.252 0.369 0.633 Lf 282 VAL -0.108 -0.825 0.213 0.456 Lf 283 HIS 0.232 -0.545 0.086 0.630 Lf 284 TYR 0.469 0.079 0.531 0.603 Lf 285 LEU 0.219 -0.288 0.529 0.511 Lf 286 ARG 0.309 -0.328 0.430 0.575 Lf 287 ALA 0.455 -0.002 0.624 0.549 Lf 288 PHE 0.265 -0.127 0.384 0.515 Lf 289 ILE -0.271 -0.666 0.041 0.434 Lf 290 ASP 0.455 0.028 0.585 0.511 Lf 291 LEU 0.345 -0.062 0.380 0.657 Lf 292 ALA -0.155 -0.514 0.016 0.699 Lf 293 PRO 0.194 -0.384 0.069 0.682 Lf 294 HIS 0.211 -0.574 0.327 0.480 Lf 295 MET 0.471 -0.019 0.660 0.582 Lf 296 GLU 0.362 -0.162 0.651 0.417 Lf 297 ASP 0.539 0.154 0.641 0.567 Lf 298 LYS 0.363 -0.088 0.477 0.621 Lf 299 ALA 0.202 -0.209 0.361 0.628 Lf 300 ALA 0.158 -0.291 0.425 0.477 Lf 301 VAL 0.285 -0.278 0.483 0.569 Lf 302 GLY 0.260 0.055 0.463 N/A Lf 303 SER 0.270 -0.097 0.472 0.491 Lf 304 ALA 0.375 0.115 0.537 0.579 Lf 305 TYR 0.326 -0.207 0.391 0.545 Lf 306 THR 0.349 -0.368 0.610 0.489 Lf 307 ALA 0.543 0.179 0.583 0.721 Lf 308 PHE 0.460 0.036 0.589 0.580 Lf 309 SER 0.506 0.320 0.635 0.579 Lf 310 GLY 0.249 -0.069 0.456 N/A Lf 311 CYS 0.275 -0.193 0.459 0.512 Lf 312 LEU 0.241 -0.575 0.219 0.668 Lf 313 ARG 0.626 0.418 0.623 0.705 Lf 314 ASP 0.519 0.178 0.465 0.716 Lf 315 MET 0.522 0.099 0.570 0.669 Lf 316 GLY 0.367 0.303 0.524 N/A Lf 317 ASP 0.201 -0.151 0.300 0.456 Lf 318 THR 0.112 -0.410 0.188 0.598 Lf 319 GLU 0.283 -0.301 0.437 0.480 Lf 320 ALA 0.179 -0.270 0.352 0.612 Lf 321 ALA 0.404 0.234 0.494 0.680 Lf 322 VAL 0.272 -0.090 0.385 0.620 Lf 323 ARG 0.199 -0.433 0.437 0.506 Lf 324 CYS -0.186 -0.718 0.020 0.486 Lf 325 LEU 0.373 -0.321 0.450 0.642 Lf 326 GLU 0.557 0.351 0.635 0.623 Lf 327 GLU 0.407 0.073 0.432 0.607 Lf 328 TYR 0.206 -0.495 0.301 0.485 Lf 329 LEU 0.581 0.207 0.640 0.682 Lf 330 GLN 0.520 0.013 0.700 0.577 Lf 331 ALA 0.593 0.492 0.656 0.673 Lf 332 ALA 0.126 -0.122 0.285 0.647 Lf 333 ARG 0.461 0.218 0.563 0.623 Lf 334 GLY 0.466 0.361 0.580 N/A Lf 335 GLY 0.420 -0.068 0.554 N/A Lf 336 ASP 0.155 -0.579 0.521 0.174 Lf 337 PRO 0.174 -0.666 0.563 0.393 Lf 338 ASN 0.481 0.057 0.502 0.654 Lf 339 GLY 0.382 0.028 0.533 N/A Lf 340 THR 0.356 0.046 0.443 0.621 Lf 341 ALA 0.265 -0.212 0.493 0.508 Lf 342 LEU 0.478 -0.008 0.589 0.643 Lf 343 ALA 0.253 -0.189 0.487 0.503 Lf 344 SER 0.093 -0.380 0.238 0.560 Lf 345 CYS 0.490 0.108 0.622 0.575 Lf 346 SER 0.377 -0.342 0.606 0.458 Lf 347 LEU 0.186 -0.461 0.539 0.486 Lf 348 GLY 0.402 0.035 0.544 N/A Lf 349 ILE 0.379 0.019 0.449 0.647 Lf 350 MET 0.503 -0.398 0.686 0.592 Lf 351 LEU 0.424 0.039 0.422 0.687 Lf 352 TYR 0.496 0.220 0.515 0.631 Lf 353 GLU 0.557 0.104 0.635 0.622 Lf 354 GLN 0.433 -0.170 0.522 0.603 Lf 355 GLY 0.203 -0.237 0.430 N/A Lf 356 ASP 0.541 0.038 0.565 0.646 Lf 357 LEU 0.546 0.301 0.578 0.689 Lf 358 ASP 0.325 -0.259 0.494 0.429 Lf 359 SER 0.489 0.310 0.529 0.685 Lf 360 ALA -0.092 -0.346 0.225 0.463 Lf 361 VAL 0.242 -0.637 0.278 0.663 Lf 362 SER 0.568 0.346 0.660 0.623 Lf 363 TYR 0.466 -0.297 0.551 0.592 Lf 364 PHE 0.391 -0.013 0.594 0.525 Lf 365 GLU 0.214 -0.280 0.199 0.570 Lf 366 LYS 0.292 -0.148 0.457 0.589 Lf 367 PHE 0.242 -0.217 0.539 0.430 Lf 368 PHE 0.347 -0.182 0.525 0.519 Lf 369 GLU 0.377 -0.126 0.520 0.520 Lf 370 THR 0.500 0.185 0.670 0.577 Lf 371 ALA 0.424 0.091 0.531 0.650 Lf 372 ARG 0.502 0.044 0.616 0.631 Lf 373 THR 0.302 -0.044 0.587 0.465 Lf 374 LEU 0.304 -0.438 0.356 0.643 Lf 375 ASN 0.496 0.314 0.555 0.630 Lf 376 ASP 0.245 -0.378 0.228 0.587 Lf 377 ARG 0.476 -0.177 0.558 0.634 Lf 378 LYS 0.284 -0.408 0.204 0.679 Lf 379 MET 0.398 -0.209 0.374 0.685 Lf 380 LEU -0.024 -0.403 0.131 0.545 Lf 381 ASP 0.385 0.084 0.432 0.570 Lf 382 THR 0.410 0.064 0.411 0.692 Lf 383 ALA 0.050 -0.761 0.171 0.723 Lf 384 ARG 0.232 -0.464 0.312 0.567 Lf 385 VAL 0.209 -0.357 0.341 0.602 Lf 386 ASN 0.620 0.228 0.627 0.700 Lf 387 LEU 0.693 0.449 0.721 0.714 Lf 388 GLY 0.199 0.082 0.428 N/A Lf 389 VAL 0.169 -0.161 0.310 0.592 Lf 390 ALA 0.338 -0.005 0.527 0.549 Lf 391 ARG 0.136 -0.196 0.337 0.500 Lf 392 GLY 0.090 -0.606 0.366 N/A Lf 393 ALA 0.127 -0.250 0.303 0.621 Lf 394 LEU 0.278 -0.013 0.389 0.612 Lf 395 ARG 0.409 -0.203 0.547 0.597 Lf 396 MET 0.061 -0.183 0.290 0.486 Lf 397 GLY 0.246 -0.008 0.455 N/A Lf 398 ALA -0.002 -0.404 0.218 0.587 Lf 399 TRP 0.295 -0.694 -0.007 0.639 Lf 400 MET 0.198 -0.551 0.403 0.524 Lf 401 GLY 0.041 -0.447 0.338 N/A Lf 402 VAL 0.310 -0.236 0.245 0.730 Lf 403 VAL 0.418 -0.026 0.406 0.709 Lf 404 ALA 0.439 0.147 0.586 0.587 Lf 405 ASN 0.590 0.421 0.666 0.640 Lf 406 ASN 0.215 -0.454 0.529 0.368 Lf 407 LEU 0.338 -0.489 0.259 0.709 Lf 408 PRO 0.007 -0.356 0.171 0.481 Lf 409 LYS 0.267 -0.029 0.461 0.573 Lf 410 LEU 0.323 -0.250 0.379 0.644 Lf 411 ILE 0.333 -0.181 0.363 0.658 Lf 412 ALA 0.296 0.154 0.466 0.588 Lf 413 TRP 0.360 -0.186 0.559 0.501 Lf 414 LYS 0.333 0.024 0.474 0.605 Lf 415 GLY -0.118 -0.226 0.247 N/A Lf 416 SER -0.027 -0.400 0.285 0.359 Lf 417 ARG 0.005 -0.718 -0.047 0.548 Lf 418 VAL -0.047 -0.488 0.154 0.534 Lf 419 PRO 0.472 0.223 0.592 0.609 Lf 420 PHE 0.371 -0.033 0.467 0.562 Lf 421 THR 0.593 0.306 0.703 0.633 Lf 422 ASP 0.161 -0.447 0.369 0.335 Lf 423 HIS 0.479 0.012 0.583 0.575 Overall mean Q-Score: 0.38 > color #6 #33d17aff > hide #!4 models > hide #!5 models > hide #!7 models > hide #!8 models > hide #!2 models > hide #!1 models > hide #!3 models > show #!3 models > open "/home/em301/Documents/dynein d/dynein-d_ATPVi_all/afold3-IDA- > d_Actin.pdb" Summary of feedback from opening /home/em301/Documents/dynein d/dynein- d_ATPVi_all/afold3-IDA-d_Actin.pdb --- warnings | Start residue of secondary structure not found: HELIX 1 1 GLN A 53 VAL A 56 1 4 Start residue of secondary structure not found: HELIX 2 2 ASP A 58 VAL A 60 1 3 Start residue of secondary structure not found: HELIX 3 3 GLU A 61 THR A 66 1 6 Start residue of secondary structure not found: HELIX 4 4 SER A 68 LEU A 70 1 3 Start residue of secondary structure not found: HELIX 5 5 ARG A 87 ALA A 99 1 13 136 messages similar to the above omitted Chain information for afold3-IDA-d_Actin.pdb #9 --- Chain | Description B | No description available > color #9 #ffbe6fff > ui tool show Matchmaker [Repeated 1 time(s)] > matchmaker #9 to #6 Computing secondary structure [Repeated 1 time(s)] Parameters --- Chain pairing | bb Alignment algorithm | Needleman-Wunsch Similarity matrix | BLOSUM-62 SS fraction | 0.3 Gap open (HH/SS/other) | 18/18/6 Gap extend | 1 SS matrix | | | H | S | O ---|---|---|--- H | 6 | -9 | -6 S | | 6 | -6 O | | | 4 Iteration cutoff | 2 Matchmaker 020_RSR022_018_apo.pdb, chain Ld (#6) with afold3-IDA-d_Actin.pdb, chain B (#9), sequence alignment score = 1713.6 RMSD between 350 pruned atom pairs is 0.965 angstroms; (across all 377 pairs: 1.457) > open "/home/em301/Documents/dynein d/dynein-d_ATPVi_all/8GLV_MD&tail.pdb" > "/home/em301/Documents/dynein d/dynein-d_ATPVi_all/8GLV_Lc.pdb" Summary of feedback from opening /home/em301/Documents/dynein d/dynein- d_ATPVi_all/8GLV_MD&tail.pdb --- warnings | Start residue of secondary structure not found: HELIX 1 1 GLY0A 10 GLY0A 29 1 20 Start residue of secondary structure not found: HELIX 2 2 SER0A 40 LEU0A 44 1 5 Start residue of secondary structure not found: HELIX 3 3 PRO0A 70 GLY0A 79 1 10 Start residue of secondary structure not found: HELIX 4 4 ARG0A 86 PHE0A 90 1 5 Start residue of secondary structure not found: HELIX 5 5 ASN0A 100 HIS0A 105 1 6 32456 messages similar to the above omitted Cannot find LINK/SSBOND residue CYS5 (359 ) Cannot find LINK/SSBOND residue CYS5 (359 ) Cannot find LINK/SSBOND residue CYS5 (359 ) Cannot find LINK/SSBOND residue CYSA (359 ) Cannot find LINK/SSBOND residue CYSA (359 ) 1766 messages similar to the above omitted Summary of feedback from opening /home/em301/Documents/dynein d/dynein- d_ATPVi_all/8GLV_Lc.pdb --- warnings | Start residue of secondary structure not found: HELIX 1 1 GLY0A 10 GLY0A 29 1 20 Start residue of secondary structure not found: HELIX 2 2 SER0A 40 LEU0A 44 1 5 Start residue of secondary structure not found: HELIX 3 3 PRO0A 70 GLY0A 79 1 10 Start residue of secondary structure not found: HELIX 4 4 ARG0A 86 PHE0A 90 1 5 Start residue of secondary structure not found: HELIX 5 5 ASN0A 100 HIS0A 105 1 6 32549 messages similar to the above omitted Cannot find LINK/SSBOND residue CYS5 (359 ) Cannot find LINK/SSBOND residue CYS5 (359 ) Cannot find LINK/SSBOND residue CYS5 (359 ) Cannot find LINK/SSBOND residue CYSA (359 ) Cannot find LINK/SSBOND residue CYSA (359 ) 1766 messages similar to the above omitted Chain information for 8GLV_MD&tail.pdb #10 --- Chain | Description La Lb | No description available Lc | No description available Ld | No description available Le | No description available Lf | No description available Chain information for 8GLV_Lc.pdb #11 --- Chain | Description Lc | No description available > ui tool show Matchmaker > matchmaker #!10-11 to #3 Computing secondary structure [Repeated 2 time(s)] Parameters --- Chain pairing | bb Alignment algorithm | Needleman-Wunsch Similarity matrix | BLOSUM-62 SS fraction | 0.3 Gap open (HH/SS/other) | 18/18/6 Gap extend | 1 SS matrix | | | H | S | O ---|---|---|--- H | 6 | -9 | -6 S | | 6 | -6 O | | | 4 Iteration cutoff | 2 Matchmaker 018_RSR020_016_apo.pdb, chain Lc (#3) with 8GLV_MD&tail.pdb, chain Lc (#10), sequence alignment score = 3823.1 RMSD between 346 pruned atom pairs is 1.315 angstroms; (across all 809 pairs: 3.042) Matchmaker 018_RSR020_016_apo.pdb, chain Lc (#3) with 8GLV_Lc.pdb, chain Lc (#11), sequence alignment score = 3823.1 RMSD between 346 pruned atom pairs is 1.315 angstroms; (across all 809 pairs: 3.042) > nucleotides #9#!3,6,10-11 slab > style nucleic & #9#!3,6,10-11 stick Changed 0 atom styles > matchmaker #!10-11 to #3 Computing secondary structure [Repeated 2 time(s)] Parameters --- Chain pairing | bb Alignment algorithm | Needleman-Wunsch Similarity matrix | BLOSUM-62 SS fraction | 0.3 Gap open (HH/SS/other) | 18/18/6 Gap extend | 1 SS matrix | | | H | S | O ---|---|---|--- H | 6 | -9 | -6 S | | 6 | -6 O | | | 4 Iteration cutoff | 2 Matchmaker 018_RSR020_016_apo.pdb, chain Lc (#3) with 8GLV_MD&tail.pdb, chain Lc (#10), sequence alignment score = 3823.1 RMSD between 346 pruned atom pairs is 1.315 angstroms; (across all 809 pairs: 3.042) Matchmaker 018_RSR020_016_apo.pdb, chain Lc (#3) with 8GLV_Lc.pdb, chain Lc (#11), sequence alignment score = 3823.1 RMSD between 346 pruned atom pairs is 1.315 angstroms; (across all 809 pairs: 3.042) > show #9#!3,6,10-11 cartoons [Repeated 1 time(s)] > hide #9#!3,6,10-11 atoms > show #9#!3,6,10-11 cartoons > hide #!6 models > hide #!1.2 models > hide #!1.1.1 models > hide #9 models > hide #!3 models > hide #!1.1 models > hide #!10 models > close #11 > show #!10 models > show #!6 models > close #2-5 > close #8 Traceback (most recent call last): File "/usr/lib/ucsf-chimerax/lib/python3.11/site- packages/chimerax/core/triggerset.py", line 149, in invoke return self._func(self._name, data) ^^^^^^^^^^^^^^^^^^^^^^^^^^^^ File "/home/em301/.local/share/ChimeraX/1.9/lib/python3.11/site- packages/chimerax/qscore/ui.py", line 307, in _toggle_save_button_enabled for atom in model.atoms: ^^^^^^^^^^^ AttributeError: 'NoneType' object has no attribute 'atoms' Error processing trigger "selected model changed": AttributeError: 'NoneType' object has no attribute 'atoms' File "/home/em301/.local/share/ChimeraX/1.9/lib/python3.11/site- packages/chimerax/qscore/ui.py", line 307, in _toggle_save_button_enabled for atom in model.atoms: ^^^^^^^^^^^ See log for complete Python traceback. OpenGL version: 3.3.0 NVIDIA 535.230.02 OpenGL renderer: NVIDIA GeForce RTX 3090/PCIe/SSE2 OpenGL vendor: NVIDIA Corporation Python: 3.11.4 Locale: en_US.UTF-8 Qt version: PyQt6 6.7.1, Qt 6.7.1 Qt runtime version: 6.7.3 Qt platform: xcb XDG_SESSION_TYPE=x11 DESKTOP_SESSION=ubuntu XDG_SESSION_DESKTOP=ubuntu XDG_CURRENT_DESKTOP=ubuntu:GNOME DISPLAY=:1 Manufacturer: Micro-Star International Co., Ltd. Model: MS-7D54 OS: Ubuntu 22.04 Architecture: 64bit ELF Virtual Machine: none CPU: 16 AMD Ryzen 7 5700X 8-Core Processor Cache Size: 512 KB Memory: total used free shared buff/cache available Mem: 125Gi 101Gi 17Gi 736Mi 6.6Gi 22Gi Swap: 2.0Gi 2.0Gi 4.0Mi Graphics: 2d:00.0 VGA compatible controller [0300]: NVIDIA Corporation GA102 [GeForce RTX 3090] [10de:2204] (rev a1) Subsystem: Palit Microsystems Inc. GA102 [GeForce RTX 3090] [1569:2204] Kernel driver in use: nvidia Installed Packages: alabaster: 1.0.0 anyio: 4.7.0 appdirs: 1.4.4 asttokens: 3.0.0 auditwheel: 6.1.0 autocommand: 2.2.2 babel: 2.16.0 backports.tarfile: 1.2.0 beautifulsoup4: 4.12.3 blockdiag: 3.0.0 blosc2: 3.0.0 build: 1.2.1 certifi: 2024.8.30 cftime: 1.6.4.post1 charset-normalizer: 3.4.0 ChimeraX-AddCharge: 1.5.18 ChimeraX-AddH: 2.2.6 ChimeraX-AlignmentAlgorithms: 2.0.2 ChimeraX-AlignmentHdrs: 3.5 ChimeraX-AlignmentMatrices: 2.1 ChimeraX-Alignments: 2.16.1 ChimeraX-AlphaFold: 1.0.1 ChimeraX-AltlocExplorer: 1.1.2 ChimeraX-AmberInfo: 1.0 ChimeraX-Arrays: 1.1 ChimeraX-Atomic: 1.58.8 ChimeraX-AtomicLibrary: 14.1.11 ChimeraX-AtomSearch: 2.0.1 ChimeraX-AxesPlanes: 2.4 ChimeraX-BasicActions: 1.1.2 ChimeraX-BILD: 1.0 ChimeraX-BlastProtein: 3.0.0 ChimeraX-BondRot: 2.0.4 ChimeraX-BugReporter: 1.0.1 ChimeraX-BuildStructure: 2.13.1 ChimeraX-Bumps: 1.0 ChimeraX-BundleBuilder: 1.4.0 ChimeraX-ButtonPanel: 1.0.1 ChimeraX-CageBuilder: 1.0.1 ChimeraX-CellPack: 1.0 ChimeraX-Centroids: 1.4 ChimeraX-ChangeChains: 1.1 ChimeraX-CheckWaters: 1.4 ChimeraX-ChemGroup: 2.0.1 ChimeraX-Clashes: 2.3 ChimeraX-Clipper: 0.24.0 ChimeraX-ColorActions: 1.0.5 ChimeraX-ColorGlobe: 1.0 ChimeraX-ColorKey: 1.5.6 ChimeraX-CommandLine: 1.2.5 ChimeraX-ConnectStructure: 2.0.1 ChimeraX-Contacts: 1.0.1 ChimeraX-Core: 1.9 ChimeraX-CoreFormats: 1.2 ChimeraX-coulombic: 1.4.4 ChimeraX-Crosslinks: 1.0 ChimeraX-Crystal: 1.0 ChimeraX-CrystalContacts: 1.0.1 ChimeraX-DataFormats: 1.2.3 ChimeraX-Dicom: 1.2.6 ChimeraX-DistMonitor: 1.4.2 ChimeraX-DockPrep: 1.1.3 ChimeraX-Dssp: 2.0 ChimeraX-EMDB-SFF: 1.0 ChimeraX-ESMFold: 1.0 ChimeraX-FileHistory: 1.0.1 ChimeraX-FunctionKey: 1.0.1 ChimeraX-Geometry: 1.3 ChimeraX-gltf: 1.0 ChimeraX-Graphics: 1.4.1 ChimeraX-Hbonds: 2.5 ChimeraX-Help: 1.3 ChimeraX-HKCage: 1.3 ChimeraX-IHM: 1.1 ChimeraX-ImageFormats: 1.2 ChimeraX-IMOD: 1.0 ChimeraX-IO: 1.0.3 ChimeraX-ISOLDE: 1.9 ChimeraX-ItemsInspection: 1.0.1 ChimeraX-IUPAC: 1.0 ChimeraX-KVFinder: 1.2.1 ChimeraX-Label: 1.1.14 ChimeraX-LigandRecognizer: 0.2 ChimeraX-LinuxSupport: 1.0.1 ChimeraX-ListInfo: 1.2.2 ChimeraX-Log: 1.2 ChimeraX-LookingGlass: 1.1 ChimeraX-Maestro: 1.9.1 ChimeraX-Map: 1.3 ChimeraX-MapData: 2.0 ChimeraX-MapEraser: 1.0.1 ChimeraX-MapFilter: 2.0.1 ChimeraX-MapFit: 2.0 ChimeraX-MapSeries: 2.1.1 ChimeraX-Markers: 1.0.1 ChimeraX-Mask: 1.0.2 ChimeraX-MatchMaker: 2.1.6 ChimeraX-MCopy: 1.0 ChimeraX-MDcrds: 2.7.2 ChimeraX-MedicalToolbar: 1.1 ChimeraX-Meeting: 1.0.1 ChimeraX-MLP: 1.1.1 ChimeraX-mmCIF: 2.14.2 ChimeraX-MMTF: 2.2 ChimeraX-ModelArchive: 1.0 ChimeraX-Modeller: 1.5.18 ChimeraX-ModelPanel: 1.5 ChimeraX-ModelSeries: 1.0.1 ChimeraX-Mol2: 2.0.3 ChimeraX-Mole: 1.0 ChimeraX-Morph: 1.0.2 ChimeraX-MouseModes: 1.2 ChimeraX-Movie: 1.0 ChimeraX-MutationScores: 1.0 ChimeraX-Neuron: 1.0 ChimeraX-Nifti: 1.2 ChimeraX-NMRSTAR: 1.0.2 ChimeraX-NRRD: 1.2 ChimeraX-Nucleotides: 2.0.3 ChimeraX-OpenCommand: 1.14 ChimeraX-OrthoPick: 1.0.1 ChimeraX-PDB: 2.7.6 ChimeraX-PDBBio: 1.0.1 ChimeraX-PDBLibrary: 1.0.4 ChimeraX-PDBMatrices: 1.0 ChimeraX-PickBlobs: 1.0.1 ChimeraX-Positions: 1.0 ChimeraX-PresetMgr: 1.1.2 ChimeraX-PubChem: 2.2 ChimeraX-QScore: 1.2 ChimeraX-ReadPbonds: 1.0.1 ChimeraX-Registration: 1.1.2 ChimeraX-RemoteControl: 1.0 ChimeraX-RenderByAttr: 1.6.2 ChimeraX-RenumberResidues: 1.1 ChimeraX-ResidueFit: 1.0.1 ChimeraX-RestServer: 1.3.1 ChimeraX-RNALayout: 1.0 ChimeraX-RotamerLibMgr: 4.0 ChimeraX-RotamerLibsDunbrack: 2.0 ChimeraX-RotamerLibsDynameomics: 2.0 ChimeraX-RotamerLibsRichardson: 2.0 ChimeraX-SaveCommand: 1.5.1 ChimeraX-SchemeMgr: 1.0 ChimeraX-SDF: 2.0.2 ChimeraX-Segger: 1.0 ChimeraX-Segment: 1.0.1 ChimeraX-Segmentations: 3.5.6 ChimeraX-SelInspector: 1.0 ChimeraX-SeqView: 2.14 ChimeraX-Shape: 1.0.1 ChimeraX-Shell: 1.0.1 ChimeraX-Shortcuts: 1.2.0 ChimeraX-ShowSequences: 1.0.3 ChimeraX-SideView: 1.0.1 ChimeraX-SimilarStructures: 1.0.1 ChimeraX-Smiles: 2.1.2 ChimeraX-SmoothLines: 1.0 ChimeraX-SpaceNavigator: 1.0 ChimeraX-StdCommands: 1.18.1 ChimeraX-STL: 1.0.1 ChimeraX-Storm: 1.0 ChimeraX-StructMeasure: 1.2.1 ChimeraX-Struts: 1.0.1 ChimeraX-Surface: 1.0.1 ChimeraX-SwapAA: 2.0.1 ChimeraX-SwapRes: 2.5 ChimeraX-TapeMeasure: 1.0 ChimeraX-TaskManager: 1.0 ChimeraX-Test: 1.0 ChimeraX-Toolbar: 1.2.3 ChimeraX-ToolshedUtils: 1.2.4 ChimeraX-Topography: 1.0 ChimeraX-ToQuest: 1.0 ChimeraX-Tug: 1.0.1 ChimeraX-UI: 1.41 ChimeraX-Umap: 1.0 ChimeraX-uniprot: 2.3.1 ChimeraX-UnitCell: 1.0.1 ChimeraX-ViewDockX: 1.4.4 ChimeraX-VIPERdb: 1.0 ChimeraX-Vive: 1.1 ChimeraX-VolumeMenu: 1.0.1 ChimeraX-vrml: 1.0 ChimeraX-VTK: 1.0 ChimeraX-WavefrontOBJ: 1.0 ChimeraX-WebCam: 1.0.2 ChimeraX-WebServices: 1.1.4 ChimeraX-Zone: 1.0.1 colorama: 0.4.6 comm: 0.2.2 contourpy: 1.3.1 cxservices: 1.2.3 cycler: 0.12.1 Cython: 3.0.10 debugpy: 1.8.9 decorator: 5.1.1 distro: 1.9.0 docutils: 0.21.2 executing: 2.1.0 filelock: 3.15.4 fonttools: 4.55.3 funcparserlib: 2.0.0a0 glfw: 2.8.0 grako: 3.16.5 h11: 0.14.0 h5py: 3.12.1 html2text: 2024.2.26 httpcore: 1.0.7 httpx: 0.28.1 idna: 3.10 ihm: 1.3 imagecodecs: 2024.6.1 imagesize: 1.4.1 importlib_metadata: 8.0.0 importlib_resources: 6.4.0 inflect: 7.3.1 ipykernel: 6.29.5 ipython: 8.26.0 ipywidgets: 8.1.5 jaraco.context: 5.3.0 jaraco.functools: 4.0.1 jaraco.text: 3.12.1 jedi: 0.19.1 Jinja2: 3.1.4 jupyter_client: 8.6.2 jupyter_core: 5.7.2 jupyterlab_widgets: 3.0.13 kiwisolver: 1.4.7 line_profiler: 4.1.3 lxml: 5.2.2 lz4: 4.3.3 MarkupSafe: 3.0.2 matplotlib: 3.9.2 matplotlib-inline: 0.1.7 more-itertools: 10.3.0 msgpack: 1.0.8 ndindex: 1.9.2 nest-asyncio: 1.6.0 netCDF4: 1.6.5 networkx: 3.3 nibabel: 5.2.0 nptyping: 2.5.0 numexpr: 2.10.2 numpy: 1.26.4 openvr: 1.26.701 ordered-set: 4.1.0 packaging: 23.2 packaging: 24.1 ParmEd: 4.2.2 parso: 0.8.4 pep517: 0.13.1 pexpect: 4.9.0 pillow: 10.4.0 pip: 24.2 pkginfo: 1.11.1 platformdirs: 4.3.6 platformdirs: 4.2.2 prompt_toolkit: 3.0.48 psutil: 6.0.0 ptyprocess: 0.7.0 pure_eval: 0.2.3 py-cpuinfo: 9.0.0 pycollada: 0.8 pydicom: 2.4.4 pyelftools: 0.31 Pygments: 2.18.0 pynmrstar: 3.3.4 pynrrd: 1.0.0 PyOpenGL: 3.1.7 PyOpenGL-accelerate: 3.1.7 pyopenxr: 1.0.3401 pyparsing: 3.2.0 pyproject_hooks: 1.2.0 PyQt6-commercial: 6.7.1 PyQt6-Qt6: 6.7.3 PyQt6-WebEngine-commercial: 6.7.0 PyQt6-WebEngine-Qt6: 6.7.3 PyQt6-WebEngineSubwheel-Qt6: 6.7.3 PyQt6_sip: 13.8.0 python-dateutil: 2.9.0.post0 pytz: 2024.2 pyzmq: 26.2.0 qtconsole: 5.5.2 QtPy: 2.4.2 qtshim: 1.0 RandomWords: 0.4.0 requests: 2.32.3 scipy: 1.14.0 setuptools: 72.1.0 sfftk-rw: 0.8.1 six: 1.16.0 sniffio: 1.3.1 snowballstemmer: 2.2.0 sortedcontainers: 2.4.0 soupsieve: 2.6 Sphinx: 8.0.2 sphinx-autodoc-typehints: 2.2.3 sphinxcontrib-applehelp: 2.0.0 sphinxcontrib-blockdiag: 3.0.0 sphinxcontrib-devhelp: 2.0.0 sphinxcontrib-htmlhelp: 2.1.0 sphinxcontrib-jsmath: 1.0.1 sphinxcontrib-qthelp: 2.0.0 sphinxcontrib-serializinghtml: 2.0.0 stack-data: 0.6.3 superqt: 0.6.3 tables: 3.10.1 tcia_utils: 1.5.1 tifffile: 2024.7.24 tinyarray: 1.2.4 tomli: 2.0.1 tornado: 6.4.2 traitlets: 5.14.3 typeguard: 4.3.0 typing_extensions: 4.12.2 typing_extensions: 4.12.2 tzdata: 2024.2 urllib3: 2.2.3 wcwidth: 0.2.13 webcolors: 24.6.0 wheel: 0.43.0 wheel: 0.43.0 wheel-filename: 1.4.1 widgetsnbextension: 4.0.13 zipp: 3.19.2
Change History (1)
comment:1 by , 5 months ago
Component: | Unassigned → Third Party |
---|---|
Description: | modified (diff) |
Owner: | set to |
Platform: | → all |
Project: | → ChimeraX |
Status: | new → assigned |
Summary: | ChimeraX bug report submission → QScore: model is None |
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