NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 306 Y 4.7626 8.1444 121.6927 57.8964 38.8496 174.5694 307 N 4.4134 7.8656 125.9644 50.8192 39.6038 170.3651 308 P 4.2577 0.0000 0.0000 60.7126 33.2853 174.4310 309 P 4.2406 0.0000 0.0000 63.9248 31.9792 177.2953 310 Q 4.3529 8.8733 122.1115 56.8832 28.7100 174.1496 311 E 5.2175 7.8647 111.6208 53.8893 32.9115 179.5968 312 P 4.5957 0.0000 0.0000 61.2304 32.1279 176.5440 313 W 4.9781 8.6968 130.1169 59.4450 31.0304 176.1848 314 L 4.5311 7.6935 116.1762 53.0002 45.2803 176.0648 315 V 4.1910 8.2502 122.7005 61.6273 32.6074 174.0567 316 I 4.6396 8.2110 129.1934 60.4193 37.5015 175.9704 317 L 4.4957 9.0562 127.5265 56.6624 42.7128 176.5836 318 Y 4.6788 7.6490 115.8433 56.9695 41.4883 172.9053 319 Q 4.6022 6.9604 123.8635 55.3608 32.2995 173.4367 320 D 4.3972 8.0698 123.5250 52.9688 41.2706 174.7991 321 D 4.4751 8.7972 116.6032 57.0215 41.6237 176.6767 322 H 4.7594 9.5853 117.3950 56.5732 30.5994 173.9192 323 I 4.6403 7.2540 110.9934 58.3864 39.8187 172.9184 *325 V 3.9446 8.2146 119.0704 63.5564 32.5878 176.2542 326 V 4.6612 8.3052 120.8873 59.8678 34.9971 174.7721 327 N 5.0697 8.8177 122.8662 51.5588 38.4738 173.2021 328 K 4.1901 8.9644 126.8370 55.4142 33.4989 174.1056 329 P 4.8389 0.0000 0.0000 61.9523 33.2877 175.5378 330 S 4.3146 8.5133 116.2116 59.7785 62.8711 174.1039 331 G 4.0712 9.0813 115.2563 44.9915 0.0000 172.9783 332 L 4.7067 7.1264 121.5597 52.8591 43.6183 176.1956 333 L 4.2357 8.4750 125.9294 54.9943 42.3399 178.4916 334 S 4.1916 8.5974 117.6502 60.7798 63.2400 175.0996 335 V 4.5565 7.2409 110.5241 58.0589 35.0854 173.4728 336 P 4.2662 0.0000 0.0000 62.9794 31.4797 176.8804 337 G 3.8586 8.8713 111.9126 44.4262 0.0000 173.2738 338 R 3.9467 8.0416 119.1251 58.8857 30.6128 176.5435 339 L 4.0788 7.7685 120.1023 55.3172 42.3573 179.1141 340 E 4.0388 8.6977 117.6543 58.9478 29.7623 177.9302 341 E 4.3567 8.0842 114.7575 58.5120 29.8802 176.7727 342 H 5.1404 8.4055 117.3130 55.5053 29.5651 176.1461 343 K 3.9253 8.2850 121.4037 58.5621 32.4890 177.5002 344 D 4.3814 8.2238 118.8190 54.5054 41.5942 175.0667 345 S 4.6024 8.5496 119.5638 57.6144 66.1728 176.5396 346 V 3.3191 8.5330 116.5930 64.0481 31.0707 177.5002 *348 T 4.3635 7.9498 110.5416 61.2887 70.4391 176.2231 349 R 4.0301 7.8363 120.3899 58.8500 30.0768 178.7678 350 I 4.0847 7.8293 119.8189 64.5013 36.9929 178.4539 351 Q 4.3274 8.1411 117.0457 58.5414 28.5695 177.5791 352 R 4.0972 7.6479 118.6808 58.8640 30.1564 176.7375 353 D 4.6656 8.1399 113.8643 54.5332 42.7119 176.3239 354 Y 4.7759 7.8202 116.8530 55.2609 39.0680 173.6447 355 P 4.4030 0.0000 0.0000 66.0915 32.0303 178.1799 356 Q 4.3784 8.0516 113.5330 54.8648 28.3569 179.9147 357 A 4.6632 8.2192 120.6212 53.1170 19.4794 177.3685 358 E 4.8634 9.1006 119.4044 54.4515 34.3699 175.3557 359 S 4.5712 8.7108 117.2553 58.5891 63.6009 174.2570 360 V 4.2917 8.3186 113.3386 61.8879 33.8696 175.0101 361 H 4.5470 7.5277 112.4289 54.5464 30.8494 172.7159 362 R 4.5280 7.9344 117.6200 54.4691 33.7590 174.9686 363 L 4.8672 7.9710 121.4903 53.0292 44.7248 179.2968 364 D 4.8143 8.0402 121.6988 54.0670 40.0917 179.9464 *366 A 4.3548 8.5739 129.3059 52.8857 20.2658 176.6842 367 T 4.4666 7.6530 111.8214 63.3249 69.5980 174.3523 368 S 4.8472 8.6264 117.8072 57.0440 67.0096 172.1312 369 G 3.2461 8.6586 105.4985 43.5410 0.0000 172.6784 370 V 4.0137 7.8589 120.5334 63.2619 32.0169 176.3952 371 I 4.7462 8.5465 128.0613 59.3564 41.3585 173.9185 372 V 4.4688 8.8871 128.9521 60.4670 33.1569 175.4054 373 V 4.5255 8.0671 121.9622 61.0043 35.0300 174.2976 374 A 4.4088 8.5635 129.7948 51.7128 19.3874 178.0400 375 L 4.4935 8.8380 121.0215 55.0141 43.2493 177.2028 376 T 4.7859 7.3696 108.4063 58.9098 73.2678 174.5164 377 K 3.9954 8.5351 121.7302 59.3837 32.2615 178.9616 378 A 3.9581 7.9656 120.6266 55.0638 18.3684 179.2449 379 A 3.9276 7.9719 119.3218 55.0983 18.3547 179.3193 380 E 3.8727 8.2510 117.7710 59.6858 29.8571 179.2892 381 R 3.9209 7.9186 117.9012 59.1995 30.1071 178.7798 382 E 3.9236 8.1629 118.9178 59.3594 29.7097 178.8535 383 L 4.0460 8.2268 119.3460 57.8644 41.6359 179.7529 384 K 4.1824 8.4514 118.5144 59.1858 31.8734 179.4907 385 R 3.9001 7.9055 119.0876 59.3903 29.9432 178.3753 386 Q 3.9489 8.1243 117.8806 59.2435 28.7784 179.1548 387 F 3.9663 8.3739 118.5959 60.5208 38.7076 177.7722 388 R 4.0544 8.2897 117.6170 58.8530 29.8779 177.3685 389 E 4.4158 8.0316 116.1308 54.8044 30.0611 176.0723 390 R 3.8035 7.7776 116.8074 57.3083 28.4870 177.5011 391 E 4.1329 8.3041 118.1214 58.4393 30.1881 176.4705 392 P 4.5250 0.0000 0.0000 62.4225 32.5645 176.2271 393 K 4.5537 8.7973 121.6236 54.7806 34.3525 175.2876 394 K 5.0296 8.7655 124.7262 54.6638 34.5122 175.6526 395 Q 4.8785 8.6370 124.8043 54.6807 32.4649 173.3429 396 Y 5.4374 9.7760 123.4337 56.1409 42.5094 174.7572 397 V 5.1563 8.9440 119.4510 60.3125 34.9943 174.4484 398 A 5.8135 9.1966 123.6170 50.4269 23.5264 174.7392 399 R 5.0884 8.4501 117.3170 54.5736 33.2742 175.7466 400 V 4.9522 9.0942 116.2478 58.9406 36.1858 174.5033 401 W 4.4370 9.0586 132.8045 58.3973 31.8016 177.4466 402 G 3.5706 8.2795 116.0815 42.8756 0.0000 172.0961 403 H 5.0037 8.2977 115.6875 53.1074 29.5843 172.4757 404 P 4.1757 0.0000 0.0000 62.5257 31.7917 176.6389 405 S 4.8531 8.3549 115.9736 55.9856 65.8445 172.3295 406 P 4.4529 0.0000 0.0000 62.7018 31.7338 176.8649 407 A 4.2243 8.6342 120.8749 54.2701 19.3539 176.7461 408 E 4.4016 7.5128 115.5226 54.4899 33.0020 175.4089 409 G 3.8554 6.7801 110.5586 46.3139 0.0000 171.1120 410 L 5.3844 8.7056 121.0089 53.3314 45.5271 176.9243 411 V 4.3998 9.3068 128.4249 61.3887 33.8189 176.2969 412 D 5.8500 8.3541 127.6241 51.8118 41.1469 172.1875 413 L 4.3128 7.8183 121.3215 54.3268 42.4483 175.7880 414 P 4.5937 0.0000 0.0000 63.0350 32.5907 175.2341 415 L 5.2665 8.9527 121.3863 53.3854 46.0139 175.2302 416 I 4.8003 8.3042 119.9543 59.7681 41.9503 173.6475 417 C 4.7731 8.5943 126.7600 58.8771 32.4180 173.8003 418 D 4.6829 8.9067 127.7593 51.8868 39.6455 176.3257 419 W 4.4892 8.5226 134.1292 59.6297 31.2213 176.3101 420 P 4.1986 0.0000 0.0000 64.8850 30.9855 176.7253 421 N 4.8159 8.4905 115.5976 52.2644 39.0371 174.6136 422 R 3.9794 7.2209 114.7841 56.1448 29.4914 174.5829 423 P 4.3951 0.0000 0.0000 63.0895 31.7809 176.4842 424 K 4.0445 7.6519 119.7169 57.2149 33.1614 175.9735 425 Q 5.1928 9.5069 122.0253 54.4286 32.8339 174.2014 426 K 4.6058 8.6384 117.6102 55.9826 36.1775 175.1322 427 V 4.2031 8.2539 121.5858 63.2098 32.6683 175.3144 428 C 4.4963 8.3496 127.2623 59.0537 34.0962 174.0752 429 Y 4.2608 8.9408 124.5755 59.8380 38.0781 176.6770 430 E 4.3471 8.2367 118.8497 58.1841 30.0581 177.0331 431 T 4.6065 7.7086 104.0904 60.4128 70.4230 174.1814 432 G 3.7835 8.0632 109.9415 46.5747 0.0000 173.3638 433 K 4.7368 9.2021 122.2899 53.8587 34.1600 174.6201 434 P 4.6638 0.0000 0.0000 63.5799 31.8277 175.3947 435 A 4.8122 8.5001 123.0652 50.4650 23.0742 174.6459 436 Q 5.0721 9.5047 120.0729 54.4857 33.0918 174.5173 437 T 5.0462 9.0725 120.1552 61.8804 72.4120 172.7499 438 E 5.1613 9.3918 126.8042 55.2790 31.7614 174.8672 439 Y 5.3712 8.8049 120.9873 55.5837 42.4273 173.9774 440 E 4.8935 9.1421 121.6174 54.8421 33.2176 174.3235 441 V 4.1409 9.1755 128.7324 63.2217 31.6518 176.0415 442 V 4.2886 8.5067 120.2821 61.4760 33.5947 175.6676 443 E 4.4826 7.5528 119.7867 55.3640 33.0830 173.2540 444 Y 4.7021 8.5799 124.9055 56.4704 39.1448 175.3518 445 A 4.4239 8.9959 128.2488 50.9776 19.9532 177.9872 446 A 4.2537 8.5162 122.8542 54.2951 18.6981 177.9770 447 D 4.7023 7.9764 114.6184 53.1302 40.1031 175.7133 448 N 3.8925 7.7843 114.1751 55.4284 37.6595 172.9855 449 T 4.9802 7.5097 104.7523 60.0962 73.2252 172.7144 450 A 5.1006 9.0393 122.8647 50.3334 23.3331 174.7868 451 R 4.9161 8.6739 120.5979 54.7351 32.2424 175.2897 452 V 4.9072 9.1874 126.0524 61.1034 35.2998 174.0463 453 V 4.6963 8.9398 127.8137 61.7318 33.1312 174.4608 454 L 5.3282 9.3402 127.7608 53.0330 45.3404 175.9567 455 K 5.1009 9.3869 122.1264 53.8297 34.9652 173.1397 456 P 4.6431 0.0000 0.0000 62.9019 31.5492 176.3751 457 I 4.1218 8.9133 126.9257 64.1466 37.7525 176.8689 458 T 4.4238 7.8120 109.7825 60.7291 70.5895 173.7871 459 G 4.2765 8.0524 107.8287 45.0625 0.0000 173.2236 460 R 4.1018 8.2743 118.0315 55.1095 31.1087 176.9340 461 S 4.2416 8.5348 115.1481 60.5011 62.7685 173.4600 462 H 4.1612 9.2312 121.9030 56.7854 26.6985 176.0611 463 Q 3.7391 7.9970 121.9285 59.7028 28.4130 179.1104 464 L 3.8903 7.5871 117.5138 57.7604 41.7376 179.3043 465 R 4.0095 7.6848 116.8946 58.9963 30.4166 178.6856 466 V 3.4035 7.7094 118.2372 65.6844 31.3768 178.5658 467 H 4.4035 8.0581 113.8518 56.1513 28.3974 177.0691 *469 L 4.1793 7.9396 124.3240 55.0731 43.6040 178.4135 470 A 4.0776 8.3285 120.4427 55.3060 18.2299 178.2983 471 L 4.1389 7.5493 113.3330 55.6591 41.8887 177.9368 472 G 3.9588 9.0495 107.6867 45.5128 0.0000 173.9551 473 H 5.5076 7.7813 114.8509 51.6762 28.3088 171.4183 474 P 4.4986 0.0000 0.0000 62.5955 33.1667 177.1731 475 I 4.3232 8.3522 122.5057 61.1032 38.5211 175.7322 476 L 4.2089 8.5636 126.8723 56.3575 41.9526 178.4965 477 G 3.8916 8.7503 109.8886 45.5569 0.0000 173.0792 478 D 4.3282 7.7280 119.8421 53.8858 40.7220 177.0684 479 R 3.8596 8.3116 127.0056 58.6475 30.3700 178.0927 480 F 4.6365 7.8727 114.9898 58.6362 39.6317 175.9678 481 Y 4.7185 7.9995 114.2705 57.3169 39.4974 175.6392 482 A 4.2847 7.9535 124.0304 51.2163 19.5718 178.2831 483 S 4.2962 8.3006 117.4287 56.9220 65.2951 173.6462 484 P 4.0588 0.0000 0.0000 66.6168 30.4659 178.3312 485 E 3.7834 7.6105 116.5605 58.4309 29.6168 178.7500 486 A 4.1332 6.7334 121.3143 54.8978 18.4715 179.6821 487 R 3.7497 8.3636 117.4772 59.0557 30.8546 178.3009 488 A 4.1996 7.7114 120.4645 50.8198 16.1278 177.1873 *490 A 4.0648 7.2755 126.0768 51.4835 20.1674 176.4347 491 P 4.3572 0.0000 0.0000 64.1225 32.0718 176.1302 492 R 4.5827 7.3435 115.3145 54.1543 32.5222 174.0431 493 L 4.0302 8.3123 120.9435 55.7262 43.0527 177.8512 494 L 3.8769 8.1956 128.1740 52.9203 39.5878 174.5597 495 L 5.4346 7.5937 121.8051 53.5405 46.4049 174.6487 496 H 5.3562 9.7360 125.0725 54.6440 33.8131 172.1232 497 A 3.3953 8.8581 128.7125 50.9140 18.3234 176.7511 498 E 4.8280 8.3520 118.0766 56.9562 31.2982 175.7820 *500 L 4.5495 7.7203 122.3469 55.6312 43.9026 175.2726 501 T 5.0229 8.7126 122.1674 61.8878 71.8258 173.2110 502 I 5.1482 8.2284 118.9484 59.5213 41.8620 173.3003 503 T 4.7641 8.4289 111.6200 59.8010 70.9712 173.7526 504 H 3.9827 9.3855 125.4307 56.1805 30.1926 174.3702 505 P 4.2333 0.0000 0.0000 64.7484 31.6032 176.7305 506 A 4.4986 7.9614 118.6931 53.6149 20.9406 176.9601 507 Y 4.4617 7.5418 112.0530 58.4920 38.4034 177.3879 508 G 3.9509 8.2186 107.1350 45.5503 0.0000 173.2595 509 N 4.7074 7.5221 116.8005 51.2647 38.7205 175.1893 510 S 4.8780 8.0552 114.5224 57.6026 63.5071 173.1295 *512 T 4.0761 8.0656 117.5560 63.2449 69.0144 173.4565 513 F 4.9250 9.0000 125.5045 55.5982 41.1154 175.3746 514 K 5.0017 8.7087 120.9920 54.8188 36.0436 176.2740 515 A 4.5366 8.9974 125.7347 49.9775 21.5969 174.1368 516 P 4.1315 0.0000 0.0000 63.3960 31.9030 176.5935 517 A 3.3741 7.9458 123.2957 52.1782 18.7075 177.3355 518 D 4.6007 8.0404 119.6262 54.6197 41.3585 176.8609 519 F 4.5430 6.8402 119.9647 56.9350 38.0829 174.5603 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 306 Y 8.14 4.76 0.00 2.88 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 307 N 7.87 4.41 0.00 2.67 2.57 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 308 P 0.00 4.26 0.00 1.89 1.84 0.00 3.23 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 309 P 0.00 4.24 0.00 2.03 2.01 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 310 Q 8.87 4.35 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.86 0.00 0.00 0.00 0.00 0.00 2.36 1.92 0.00 311 E 7.86 5.22 0.00 1.92 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.85 0.00 312 P 0.00 4.60 0.00 2.08 2.07 0.00 3.67 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 313 W 8.70 4.98 0.00 3.24 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 314 L 7.69 4.53 0.00 1.68 1.46 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 315 V 8.25 4.19 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.95 0.00 0.00 316 I 8.21 4.64 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.72 0.90 0.00 0.00 317 L 9.06 4.50 0.00 1.64 1.86 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 318 Y 7.65 4.68 0.00 3.16 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 319 Q 6.96 4.60 0.00 1.82 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.44 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 320 D 8.07 4.40 0.00 2.85 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 321 D 8.80 4.48 0.00 2.52 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 322 H 9.59 4.76 0.00 3.04 3.26 0.00 5.56 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 323 I 7.25 4.64 1.82 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.88 0.84 0.00 0.00 *325 V 8.21 3.94 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 -0.31 0.00 0.00 326 V 8.31 4.66 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.86 0.00 0.00 327 N 8.82 5.07 0.00 2.67 2.73 0.00 0.00 7.09 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 328 K 8.96 4.19 0.00 1.82 1.64 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.35 7.81 329 P 0.00 4.84 0.00 2.16 2.15 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 330 S 8.51 4.31 0.00 3.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 331 G 9.08 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 332 L 7.13 4.71 0.00 1.53 1.68 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 333 L 8.48 4.24 0.00 1.83 1.71 0.64 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 334 S 8.60 4.19 0.00 3.82 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 335 V 7.24 4.56 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.91 0.00 0.00 336 P 0.00 4.27 0.00 2.19 2.08 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 337 G 8.87 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 338 R 8.04 3.95 0.00 1.78 1.90 0.00 3.26 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 339 L 7.77 4.08 0.00 1.57 1.81 0.86 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 340 E 8.70 4.04 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 341 E 8.08 4.36 0.00 1.82 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 342 H 8.41 5.14 0.00 3.20 3.01 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 343 K 8.28 3.93 0.00 1.81 1.91 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.24 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.64 1.40 7.81 344 D 8.22 4.38 0.00 2.66 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 345 S 8.55 4.60 0.00 3.99 3.94 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 422 R 7.22 3.98 0.00 1.50 1.43 0.00 2.21 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.10 0.00 423 P 0.00 4.40 0.00 2.17 2.11 0.00 3.36 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.99 0.00 424 K 7.65 4.04 0.00 1.64 1.67 0.00 1.16 0.00 0.00 1.34 0.00 0.00 2.66 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.47 0.65 7.81 425 Q 9.51 5.19 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.61 0.00 0.00 0.00 0.00 0.00 2.19 2.49 0.00 426 K 8.64 4.61 0.00 1.79 1.89 0.00 1.33 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.36 7.81 427 V 8.25 4.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.85 0.00 0.00 428 C 8.35 4.50 0.00 3.02 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 429 Y 8.94 4.26 0.00 2.98 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 430 E 8.24 4.35 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.86 0.00 431 T 7.71 4.61 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 432 G 8.06 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 433 K 9.20 4.74 0.00 1.75 1.71 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.40 1.25 7.81 434 P 0.00 4.66 0.00 2.08 2.08 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 435 A 8.50 4.81 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 436 Q 9.50 5.07 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 437 T 9.07 5.05 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 438 E 9.39 5.16 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 439 Y 8.80 5.37 0.00 3.03 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 440 E 9.14 4.89 0.00 1.96 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.35 0.00 441 V 9.18 4.14 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 1.06 0.00 0.00 442 V 8.51 4.29 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.96 0.00 0.00 443 E 7.55 4.48 0.00 1.96 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 444 Y 8.58 4.70 0.00 2.82 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 445 A 9.00 4.42 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 446 A 8.52 4.25 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 447 D 7.98 4.70 0.00 2.80 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 448 N 7.78 3.89 0.00 2.76 2.39 0.00 0.00 6.73 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 449 T 7.51 4.98 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 450 A 9.04 5.10 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 451 R 8.67 4.92 0.00 1.92 1.78 0.00 3.08 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 452 V 9.19 4.91 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.93 0.00 0.00 453 V 8.94 4.70 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.96 0.00 0.00 454 L 9.34 5.33 0.00 1.66 1.55 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 455 K 9.39 5.10 0.00 1.65 1.76 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.41 7.81 456 P 0.00 4.64 0.00 2.23 1.96 0.00 4.09 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.88 0.00 457 I 8.91 4.12 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.85 0.93 0.00 0.00 458 T 7.81 4.42 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 459 G 8.05 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 460 R 8.27 4.10 0.00 1.81 1.82 0.00 3.28 0.00 0.00 3.08 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 461 S 8.53 4.24 0.00 3.79 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 462 H 9.23 4.16 0.00 3.36 3.32 0.00 5.72 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 463 Q 8.00 3.74 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.03 6.81 0.00 0.00 0.00 0.00 0.00 2.18 2.11 0.00 464 L 7.59 3.89 0.00 1.47 1.59 0.16 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 465 R 7.68 4.01 0.00 1.79 2.14 0.00 3.30 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 466 V 7.71 3.40 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.32 0.00 0.00 467 H 8.06 4.40 0.00 3.26 3.21 0.00 5.72 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *469 L 7.94 4.18 0.00 1.76 1.85 1.03 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 470 A 8.33 4.08 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 471 L 7.55 4.14 0.00 1.60 1.76 0.50 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 472 G 9.05 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 H 7.78 5.51 0.00 2.97 3.36 0.00 5.96 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 474 P 0.00 4.50 0.00 2.15 2.22 0.00 3.98 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.96 0.00 475 I 8.35 4.32 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.25 0.96 0.00 0.00 476 L 8.56 4.21 0.00 1.65 1.60 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 477 G 8.75 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 478 D 7.73 4.33 0.00 2.87 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 479 R 8.31 3.86 0.00 1.25 1.72 0.00 3.09 0.00 0.00 2.92 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.46 0.00 480 F 7.87 4.64 0.00 2.18 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 481 Y 8.00 4.72 0.00 2.98 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 482 A 7.95 4.28 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 483 S 8.30 4.30 0.00 3.84 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 484 P 0.00 4.06 0.00 2.16 2.31 0.00 3.56 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.01 0.00 485 E 7.61 3.78 0.00 1.16 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 486 A 6.73 4.13 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 487 R 8.36 3.75 0.00 1.80 2.08 0.00 3.07 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 488 A 7.71 4.20 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *490 A 7.28 4.06 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 491 P 0.00 4.36 0.00 2.18 2.18 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 492 R 7.34 4.58 0.00 1.96 2.00 0.00 2.83 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 493 L 8.31 4.03 0.00 1.53 1.75 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 494 L 8.20 3.88 0.00 1.20 0.16 0.69 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 495 L 7.59 5.43 0.00 1.78 1.56 1.12 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 496 H 9.74 5.36 0.00 3.42 3.07 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 497 A 8.86 3.40 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 498 E 8.35 4.83 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.07 0.00 *500 L 7.72 4.55 0.00 1.88 1.75 1.06 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 501 T 8.71 5.02 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 502 I 8.23 5.15 1.98 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.32 0.84 0.00 0.00 503 T 8.43 4.76 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 504 H 9.39 3.98 0.00 3.27 3.33 0.00 5.60 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 505 P 0.00 4.23 0.00 1.98 2.07 0.00 3.21 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.03 0.00 506 A 7.96 4.50 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 507 Y 7.54 4.46 0.00 3.11 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 508 G 8.22 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 509 N 7.52 4.71 0.00 3.00 2.98 0.00 0.00 6.59 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 510 S 8.06 4.88 0.00 3.81 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *512 T 8.07 4.08 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 513 F 9.00 4.92 0.00 2.82 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 514 K 8.71 5.00 0.00 1.59 1.65 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.38 7.81 515 A 9.00 4.54 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 516 P 0.00 4.13 0.00 2.11 2.03 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 517 A 7.95 3.37 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 518 D 8.04 4.60 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 519 F 6.84 4.54 0.00 3.05 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.