NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 305 S 4.4140 8.3344 115.2856 58.2194 63.9022 172.7225 306 L 4.3381 8.0590 123.9571 55.4481 43.9927 176.6743 307 A 4.1700 8.8888 121.2144 54.0785 19.3473 177.2963 308 L 4.3943 7.6905 114.5045 55.9477 42.5192 178.0741 309 S 4.2666 7.7984 112.0261 59.9812 63.3826 174.6412 310 L 4.2179 7.7454 122.2722 54.4564 41.8690 177.5575 311 T 4.0363 8.3480 114.7590 61.2355 70.6350 175.1892 312 A 3.8985 8.3574 123.4055 55.6275 18.3566 179.5762 313 D 4.3320 8.0654 116.6789 57.7174 40.8848 179.1449 314 Q 3.9201 7.7408 117.7784 59.1587 28.7543 178.1655 315 M 3.9418 8.5489 119.5484 58.9995 32.1625 178.5248 316 V 3.5892 8.1913 118.4921 65.8742 31.8152 177.8649 317 S 4.0631 8.1549 112.8183 61.1810 62.1893 175.9880 318 A 3.9695 8.0920 123.3616 55.3672 17.9860 179.6920 319 L 3.9717 7.4709 115.5712 57.8246 41.7267 179.3172 320 L 4.1188 7.9489 119.5505 57.9017 42.1104 178.2453 321 D 4.5814 7.9976 118.2663 56.5251 40.8092 177.8294 322 A 4.3094 7.8379 118.4951 51.8687 18.6206 177.1968 323 E 4.0120 7.4145 119.4200 55.8019 30.1725 175.2525 324 P 4.5443 0.0000 0.0000 61.5286 32.1660 174.3902 325 P 4.4359 0.0000 0.0000 62.4007 32.0568 176.3470 326 I 3.9101 8.0801 121.6504 61.1924 37.7401 175.4648 327 L 4.7271 8.0814 123.8325 52.8986 44.4576 176.0564 328 Y 4.5630 8.2626 120.4740 57.7553 38.6326 175.7832 329 S 4.6434 9.2593 119.0454 57.8662 64.6286 173.3544 330 E 4.5567 8.4940 118.1054 55.9626 29.3414 174.8235 331 Y 4.1572 7.7859 118.3116 57.5832 39.1874 175.2577 332 D 4.2768 7.4738 125.1199 51.9551 44.0318 172.9651 333 P 4.2170 0.0000 0.0000 62.9817 32.0088 176.6525 334 T 3.9777 7.6124 109.1888 63.2876 69.3107 174.6107 335 R 4.4364 7.4642 121.5718 53.5248 31.7478 174.3938 336 P 4.2883 0.0000 0.0000 61.6768 32.1664 176.2854 337 F 4.4839 8.4873 118.9152 57.6308 38.3088 176.0262 338 S 4.8443 8.5375 121.4762 56.2783 66.6369 174.6164 339 E 3.8952 8.5753 121.8334 59.2280 29.3599 178.5861 340 A 3.9924 7.9399 120.5682 55.3231 18.7375 179.6829 341 S 4.1462 8.4127 113.1406 61.7315 63.1038 176.2852 342 M 4.2957 8.4694 121.9278 58.6020 31.9911 178.1620 343 M 4.1782 8.1080 118.7768 58.2051 32.1076 178.9429 344 G 3.6370 8.2607 106.0323 47.3865 0.0000 175.7121 345 L 4.0041 7.7570 122.1683 58.2443 42.2681 179.1272 346 L 3.9296 8.0842 119.0387 57.8156 41.5107 179.2731 347 T 4.0584 8.0997 113.0569 64.5507 67.3317 176.2604 348 N 4.3093 8.3433 119.3828 56.3043 38.9217 176.5043 349 L 3.9594 7.9769 121.5836 58.1977 42.1764 178.5387 350 A 4.0903 8.0979 120.5775 55.4142 18.0840 178.9264 351 D 4.2018 7.7792 114.6374 57.9683 41.5344 178.0446 352 R 3.9397 8.0092 117.8915 59.9155 30.0421 178.3826 353 E 4.0091 8.7695 117.7812 59.8929 29.8129 179.4458 354 L 4.0008 8.1265 118.7258 58.2893 41.3349 179.9904 355 V 3.6176 8.0409 117.9566 66.1003 31.3652 177.6677 356 H 4.9965 7.9963 116.6628 57.7070 28.7029 177.0785 357 M 4.1906 8.4281 120.8690 58.6787 31.8816 178.1121 358 I 3.7497 7.7222 119.6863 64.6057 37.5315 178.0163 359 N 4.4806 7.8268 116.7219 54.7243 37.4637 177.1986 360 W 4.0325 8.6939 131.7231 60.3753 30.7847 177.3620 361 A 2.5800 8.1136 120.9524 54.9541 17.4024 179.7311 362 K 3.9023 7.1859 115.1012 59.6424 32.1836 179.2351 363 R 4.1442 7.3892 116.1254 56.4803 30.3674 176.9326 364 V 3.4440 6.8901 120.7665 61.4243 31.7172 173.4738 365 P 4.2808 0.0000 0.0000 64.4090 31.7840 176.8284 366 G 4.5321 8.9892 111.0256 46.6889 0.0000 175.2425 367 F 3.8539 8.4013 122.6836 61.3010 39.3325 177.1384 368 V 3.8622 7.8860 115.8119 63.0463 31.3185 175.8884 369 D 4.6262 7.8162 120.3843 54.5577 41.2869 176.3510 370 L 4.5258 7.1881 119.8760 53.1930 43.0133 176.7003 371 T 3.9076 8.0675 110.7819 61.4890 69.3904 174.8831 372 L 3.8813 8.7336 125.7660 58.9969 41.7906 178.8711 373 H 4.0800 7.7688 118.1601 59.2876 29.6569 176.8935 374 D 4.4655 8.6970 120.9170 56.9312 40.6297 178.7755 375 Q 3.6642 7.8284 118.2662 58.7060 28.6925 178.7188 376 V 3.6433 7.9585 119.2643 66.2753 31.3943 177.3814 377 H 4.0599 7.9231 116.3592 59.4111 29.7975 176.5361 378 L 4.2537 8.0478 119.4635 58.1180 41.9385 179.4421 379 L 4.4149 7.9658 118.6892 57.7192 41.3904 179.6375 380 E 4.0792 8.2553 114.9437 57.4392 30.0523 178.0215 *382 A 4.3798 8.0252 123.2575 51.4655 20.9404 179.5202 383 W 4.4375 8.3376 114.1423 59.9742 27.8724 178.3044 384 L 3.6534 6.4529 120.6944 57.2103 41.4253 178.3602 385 E 3.8733 7.8825 118.1042 59.5372 29.4622 178.9364 386 I 3.6144 7.9678 119.7894 64.5605 37.2578 178.0424 387 L 3.9951 8.3201 119.8971 58.4449 41.5102 179.8516 388 M 3.9914 8.3650 118.3793 58.5544 31.9319 178.4678 389 I 3.9719 8.2884 119.3203 64.3050 37.9753 178.0577 390 G 3.7410 8.2794 106.4659 47.7567 0.0000 175.4095 391 L 3.8875 7.8005 123.0911 57.8911 41.8541 179.3159 392 V 3.5580 8.0300 117.5476 65.3990 31.7049 177.5708 393 W 4.2983 8.5511 128.5732 60.5685 30.3436 177.8646 394 R 3.5781 8.0954 117.8153 58.8802 29.6604 177.5112 395 S 4.4758 7.4696 112.5042 58.7212 63.0686 175.6389 396 M 3.9741 7.4477 122.2488 57.9361 31.6420 176.6364 397 E 4.3833 7.4364 115.8695 56.5402 30.4005 176.5300 398 H 4.8577 7.9480 115.4980 52.4328 28.9826 170.8844 399 P 4.3180 0.0000 0.0000 64.5673 31.6256 176.4240 400 G 4.1186 9.4610 110.6411 45.0318 0.0000 173.0435 401 K 4.6793 7.7898 116.2710 54.8123 36.0212 175.2028 402 L 4.2641 8.7910 119.5662 52.9607 43.5537 177.4837 403 L 4.8312 8.4414 130.0843 52.9427 40.5341 175.7030 404 F 4.1533 7.6305 119.9512 60.7276 39.7165 176.0330 405 A 4.5591 8.2347 119.4399 50.4934 22.2241 175.0327 406 P 3.8400 0.0000 0.0000 65.2588 31.4529 177.2565 407 N 4.8578 8.3242 112.5431 52.1244 37.7389 174.5719 408 L 4.3873 8.9668 123.1280 53.9244 44.0867 173.7029 409 L 4.6090 8.3503 126.8745 53.1115 42.6041 175.0526 410 L 4.7655 8.8410 126.2746 53.7626 43.6523 175.5000 411 D 5.0623 8.2865 119.9079 51.5468 42.9013 176.1310 412 R 4.2044 8.8129 117.4306 59.6484 30.5026 178.4496 413 N 4.3622 8.1940 115.0472 55.6585 37.7080 176.9321 414 Q 3.8915 7.7826 116.3072 58.2082 28.9570 178.1667 415 G 2.8196 7.2324 106.6725 47.1999 0.0000 174.7311 416 K 3.9330 7.2924 120.3310 55.1770 31.2704 174.7571 *418 V 3.7718 7.6237 124.5178 62.8565 32.6598 174.4673 419 E 4.1953 8.6225 125.7266 57.6260 29.6917 176.0350 420 G 4.1548 8.9412 110.0287 46.4178 0.0000 175.4298 421 M 3.8391 7.9155 119.4585 58.3907 31.8358 178.8670 422 V 3.5057 7.6955 118.5883 65.1077 31.1092 177.8949 423 E 3.9612 8.1311 118.4418 59.3192 29.3308 179.3323 424 I 3.8872 7.3067 116.4824 64.1883 37.1453 178.3254 425 F 4.0736 8.5001 118.7366 60.9549 38.8360 177.3102 426 D 4.5061 8.5492 118.5164 57.9038 40.5008 179.0143 427 M 4.0883 7.7045 117.5786 58.0118 31.9306 178.8153 428 L 3.8653 7.9564 119.3000 57.5801 41.6934 179.2603 429 L 3.8024 8.1726 119.0665 57.7916 41.6387 179.2120 430 A 3.9356 7.9505 120.3344 55.6504 18.2922 179.6847 431 T 3.5521 7.9581 114.0276 66.9662 68.5511 176.1898 432 S 3.9036 8.0385 114.9387 61.8637 62.1972 175.9707 433 S 4.0405 8.3761 115.5069 61.6521 61.9561 176.3553 434 R 3.8890 7.8786 120.9127 59.5081 29.7566 178.3779 435 F 4.6126 8.0374 117.4202 60.8636 38.9801 177.5265 436 R 3.9062 8.1554 118.2406 59.7978 29.6250 178.1523 437 M 4.2466 8.4944 117.2660 57.4512 32.2017 176.4634 438 M 4.5425 7.4316 114.6434 54.2132 31.8253 175.4087 439 N 4.1527 8.0230 114.3542 54.1343 36.6861 174.8602 440 L 3.9772 7.8691 118.7392 55.7591 43.0769 176.5514 441 Q 4.8500 8.9879 124.9331 54.3351 31.8483 176.9429 442 G 3.6527 9.0102 109.8314 48.4834 0.0000 175.8221 443 E 3.9939 8.1262 119.9609 59.1611 29.4323 179.1718 444 E 3.7413 8.0017 118.2793 59.1063 29.5534 178.7850 445 F 3.8127 7.9498 120.7633 61.3902 39.2723 177.6715 446 V 2.9539 7.2321 111.3036 64.0849 31.1287 178.2767 447 C 3.9591 7.3708 116.2163 62.8414 28.0323 175.7267 448 L 3.8760 7.8198 120.4349 58.2021 41.1785 179.5169 449 K 3.7151 7.5578 117.6725 60.0146 32.0070 178.9993 450 S 4.2483 8.1428 114.7130 61.8599 62.8803 176.9874 451 I 3.6922 8.0064 122.5057 64.4542 36.9699 178.2631 452 I 3.6967 8.1890 120.9443 64.4299 36.7642 177.9962 453 L 4.1939 8.0955 119.6721 58.5338 42.0920 178.9454 454 L 4.2474 8.4582 117.3279 56.9832 41.6725 178.0157 455 N 4.7038 8.5462 115.5645 52.8325 39.5598 175.2302 456 S 4.2504 7.1001 114.1530 60.1157 65.1318 171.2271 457 G 4.1523 9.8476 111.7763 43.8961 0.0000 175.9031 458 V 4.1267 8.4266 120.3946 61.7316 33.6841 170.7095 459 Y 4.6320 8.3178 121.6135 56.0367 40.6091 174.9311 460 T 3.6086 6.3894 114.6890 64.9900 67.2291 176.4852 *472 K 4.2002 7.6562 118.0367 56.2958 33.7791 176.9343 473 D 4.4947 8.0965 118.7519 56.2020 41.3711 176.0270 474 H 4.1581 8.2488 118.7072 59.6443 29.7949 176.4567 475 I 3.6862 7.8696 120.7059 65.2861 36.9595 177.9390 476 H 4.3952 7.9104 115.2486 58.4564 28.3664 178.2051 477 R 3.9189 8.0141 120.5802 59.2182 30.1022 179.2590 478 V 3.6613 7.8981 118.1233 64.4408 31.0079 178.1840 479 L 4.0019 7.7930 119.8813 57.9653 41.6389 178.9091 480 D 4.3751 7.9593 118.0906 56.7770 40.5437 178.8547 481 K 3.9475 8.3920 120.0977 59.4798 32.0532 178.9738 482 I 3.6439 7.6508 119.4811 65.0358 37.0226 178.6208 483 T 3.8506 8.2031 116.4666 66.7518 68.3337 176.3774 484 D 4.3761 7.8346 120.2702 57.6127 40.7769 178.7269 485 T 3.8144 8.0882 116.2939 66.9317 68.3747 175.9303 486 L 3.9067 8.1258 120.5838 58.5447 41.7575 179.7508 487 I 3.6984 8.2937 119.4710 64.7905 37.0359 178.0092 488 H 4.0568 8.7320 119.2837 59.1040 29.4577 177.0434 489 L 3.9737 7.8507 119.7130 58.2465 41.7394 179.2271 490 M 4.1501 7.8249 117.8797 58.4752 31.9805 178.2042 491 A 3.9210 7.8536 120.6854 55.6380 18.2896 179.6237 492 K 3.8571 8.3044 116.5284 58.7812 32.2653 177.7314 493 A 4.5196 7.9132 119.1062 51.1994 19.7134 176.5343 494 G 3.6466 8.2706 105.0290 46.6968 0.0000 173.8498 495 L 4.8326 7.4944 117.0306 52.8234 44.4299 177.6897 496 T 4.2775 8.1047 112.0024 60.9467 71.1402 175.7478 497 L 3.9267 8.4629 121.7523 58.4781 41.7460 179.8093 498 Q 3.7658 7.9547 118.5562 59.0829 29.1049 177.8824 499 Q 4.0278 7.8556 119.1362 58.5372 28.5912 178.5254 500 Q 3.9244 8.2017 120.1830 59.1448 28.7832 178.1128 501 H 4.1810 8.1932 116.0531 58.9008 28.4335 177.4278 502 Q 4.0089 7.7159 120.3676 58.9176 28.5953 179.0083 503 R 3.9511 8.0016 119.5922 58.9044 30.1243 178.0911 504 L 3.9085 8.1600 120.2788 58.2899 42.0997 178.8888 505 A 4.0388 8.3610 120.8779 55.3133 18.0373 179.6378 506 Q 3.9797 7.8132 115.7738 59.0218 28.9276 178.7252 507 L 4.2571 8.0447 120.0221 57.9225 41.2313 179.5827 508 L 4.0646 7.9308 118.7670 57.6614 41.5932 179.5925 509 L 4.0459 8.1544 119.2209 57.7842 41.5042 179.4309 510 I 3.5365 7.5326 119.8073 64.3580 37.0394 178.2310 511 L 4.0596 7.6935 118.7171 57.8227 41.3844 179.5000 512 S 4.1149 7.9740 112.7154 61.9191 62.2872 175.9958 513 H 4.2568 8.1049 118.7257 58.9616 28.2923 177.9600 514 I 3.7420 7.7083 121.2403 64.0683 36.9873 177.8438 515 R 3.8918 8.0067 119.6938 59.9373 29.8776 177.7312 516 H 4.0105 8.3000 117.5510 59.7248 29.7553 177.0470 517 M 4.0287 8.3616 120.6750 58.3861 31.7917 178.4995 518 S 3.9590 8.6049 113.7317 61.6140 62.3638 176.1558 519 N 4.2930 8.2187 119.1484 56.1257 38.2895 177.6861 520 K 4.0436 7.9908 120.0403 59.3686 32.1092 179.3294 521 G 3.6528 8.3965 106.3598 48.1316 0.0000 174.9788 522 M 3.8560 8.0678 121.1756 58.3342 32.1232 178.2532 523 E 3.9885 8.0882 118.8478 59.3247 29.8167 177.9299 524 H 4.1069 8.2879 118.3288 59.3212 29.9502 176.5388 525 L 3.9274 8.6456 122.2838 58.6351 41.8700 178.3689 526 Y 4.0857 8.3225 119.3996 60.8518 38.7920 178.3465 527 S 4.1182 8.6171 115.4923 61.6560 62.5310 176.4082 528 M 4.0247 8.1682 122.4767 57.7230 31.0909 178.5524 529 K 3.8877 7.9201 119.9849 60.2694 32.3293 178.0509 530 C 4.0997 7.8418 116.8907 61.8180 27.7182 176.4709 531 K 4.0267 8.0246 122.9044 57.3780 32.0666 175.9977 532 N 4.2354 8.0524 115.7468 53.1665 37.0983 175.4777 533 V 3.4660 6.6942 114.8062 63.8487 32.1658 175.3838 534 V 4.4579 7.3280 115.0103 58.7543 34.4205 173.9779 535 P 4.6227 0.0000 0.0000 62.0367 32.4775 175.3671 536 L 4.7988 7.9924 119.6551 52.7746 44.5040 176.8192 537 S 4.3420 8.3397 117.6587 58.2157 63.8003 174.9664 538 D 4.3599 8.8555 123.2298 57.7863 40.4444 179.6283 539 L 3.8069 7.6896 119.8561 57.9464 42.3293 178.1804 540 L 3.4603 7.8953 119.7642 58.1388 41.9265 178.2589 541 L 3.9126 8.0590 120.2901 58.5343 41.9025 178.9773 542 E 3.9715 7.8398 117.7361 59.7457 29.2115 179.2934 543 M 4.0069 7.5877 117.4911 57.8690 31.9524 178.4203 544 L 4.4619 8.0835 120.9185 58.3950 42.6451 178.5672 545 D 4.5991 8.3972 118.5143 57.1489 40.5774 178.3809 546 A 4.2748 8.0893 119.8790 54.2762 18.3765 177.9520 547 H 4.6728 8.5352 113.6555 55.6599 30.2881 174.8693 548 R 4.2037 7.5279 122.5001 56.1555 30.2841 175.5429 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 305 S 8.33 4.41 0.00 3.79 3.80 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 0.00 0.00 0.00 0.00 306 L 8.06 4.34 0.00 1.71 1.57 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 307 A 8.89 4.17 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 0.00 308 L 7.69 4.39 0.00 1.61 1.72 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 309 S 7.80 4.27 0.00 4.01 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 310 L 7.75 4.22 0.00 1.64 1.64 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 311 T 8.35 4.04 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 312 A 8.36 3.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 D 8.07 4.33 0.00 2.71 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.74 3.92 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 315 M 8.55 3.94 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 316 V 8.19 3.59 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 0.93 0.00 0.00 0.95 0.00 0.00 317 S 8.15 4.06 0.00 3.94 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 0.00 318 A 8.09 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.47 3.97 0.00 1.60 1.74 0.88 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 320 L 7.95 4.12 0.00 1.95 1.71 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 321 D 8.00 4.58 0.00 2.96 2.70 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 0.00 0.00 0.00 322 A 7.84 4.31 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 0.00 323 E 7.41 4.01 0.00 2.13 1.95 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 2.41 2.39 0.00 324 P 0.00 4.54 0.00 2.04 1.98 0.00 3.65 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 1.76 1.85 0.00 325 P 0.00 4.44 0.00 2.08 1.98 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 326 I 8.08 3.91 1.74 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.50 0.83 0.00 0.00 327 L 8.08 4.73 0.00 1.61 1.58 1.01 0.94 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 0.00 328 Y 8.26 4.56 0.00 3.06 2.83 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 0.00 0.00 0.00 0.00 329 S 9.26 4.64 0.00 4.06 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 0.00 330 E 8.49 4.56 0.00 2.15 1.99 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 2.24 2.35 0.00 331 Y 7.79 4.16 0.00 3.03 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.47 4.28 0.00 2.40 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 434 R 7.88 3.89 0.00 1.98 1.90 0.00 3.16 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 435 F 8.04 4.61 0.00 3.29 3.03 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 0.00 0.00 0.00 436 R 8.16 3.91 0.00 1.99 2.10 0.00 3.07 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 437 M 8.49 4.25 0.00 2.05 2.30 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 438 M 7.43 4.54 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.90 0.00 439 N 8.02 4.15 0.00 2.91 2.94 0.00 0.00 6.80 7.94 0.00 0.00 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 L 7.87 3.98 0.00 1.48 1.71 0.73 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 441 Q 8.99 4.85 0.00 2.30 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 442 G 9.01 3.65 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 0.00 0.00 0.00 443 E 8.13 3.99 0.00 2.02 1.99 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 2.40 2.40 0.00 444 E 8.00 3.74 0.00 2.10 1.89 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 2.36 2.32 0.00 445 F 7.95 3.81 0.00 2.03 2.21 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 0.00 446 V 7.23 2.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.91 0.00 0.00 447 C 7.37 3.96 0.00 3.06 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.82 3.88 0.00 1.62 1.67 0.90 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 449 K 7.56 3.72 0.00 1.56 1.85 0.00 1.17 0.00 0.00 1.23 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.96 0.73 7.81 450 S 8.14 4.25 0.00 4.02 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.01 3.69 2.02 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.63 0.92 0.00 0.00 452 I 8.19 3.70 2.14 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.36 0.95 0.00 0.00 453 L 8.10 4.19 0.00 1.90 2.05 1.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 454 L 8.46 4.25 0.00 1.66 1.78 0.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 455 N 8.55 4.70 0.00 2.73 2.90 0.00 0.00 7.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 456 S 7.10 4.25 0.00 4.14 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 0.00 457 G 9.85 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 458 V 8.43 4.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 503 R 8.00 3.95 0.00 1.90 2.10 0.00 3.11 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 504 L 8.16 3.91 0.00 1.80 1.87 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 505 A 8.36 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 506 Q 7.81 3.98 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.67 0.00 507 L 8.04 4.26 0.00 1.85 1.74 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 508 L 7.93 4.06 0.00 1.73 1.73 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 509 L 8.15 4.05 0.00 2.00 1.67 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 510 I 7.53 3.54 2.23 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.50 0.98 0.00 0.00 511 L 7.69 4.06 0.00 1.89 1.77 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 512 S 7.97 4.11 0.00 3.94 4.05 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 0.00 0.00 0.00 0.00 513 H 8.10 4.26 0.00 3.35 3.28 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 514 I 7.71 3.74 2.07 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.84 0.92 0.00 0.00 515 R 8.01 3.89 0.00 1.95 2.13 0.00 3.11 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 516 H 8.30 4.01 0.00 3.31 3.52 0.00 5.84 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 0.00 517 M 8.36 4.03 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.55 0.00 518 S 8.60 3.96 0.00 3.84 3.99 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 0.00 519 N 8.22 4.29 0.00 2.80 2.78 0.00 0.00 7.06 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 520 K 7.99 4.04 0.00 1.88 1.83 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.48 7.81 521 G 8.40 3.65 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 0.00 0.00 0.00 522 M 8.07 3.86 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.43 0.00 523 E 8.09 3.99 0.00 2.02 2.06 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 2.31 2.47 0.00 524 H 8.29 4.11 0.00 3.26 3.55 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 L 8.65 3.93 0.00 1.87 1.96 1.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 526 Y 8.32 4.09 0.00 3.15 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 527 S 8.62 4.12 0.00 4.08 4.30 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 0.00 528 M 8.17 4.02 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 529 K 7.92 3.89 0.00 1.77 1.74 0.00 1.63 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.41 7.81 530 C 7.84 4.10 0.00 2.85 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 531 K 8.02 4.03 0.00 1.71 1.84 0.00 1.84 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.65 7.81 532 N 8.05 4.24 0.00 2.99 2.83 0.00 0.00 7.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 533 V 6.69 3.47 2.06 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 0.88 0.00 0.00 0.95 0.00 0.00 534 V 7.33 4.46 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.93 0.00 0.00 535 P 0.00 4.62 0.00 2.14 2.03 0.00 3.44 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 2.08 0.00 536 L 7.99 4.80 0.00 1.61 1.58 0.93 0.90 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 0.00 537 S 8.34 4.34 0.00 4.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 538 D 8.86 4.36 0.00 2.73 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 0.00 539 L 7.69 3.81 0.00 1.69 1.73 0.85 0.47 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 0.00 540 L 7.90 3.46 0.00 1.63 1.57 0.95 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 541 L 8.06 3.91 0.00 1.96 1.78 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 542 E 7.84 3.97 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.56 0.00 543 M 7.59 4.01 0.00 0.51 0.84 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.55 0.00 544 L 8.08 4.46 0.00 1.95 1.94 1.22 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 545 D 8.40 4.60 0.00 2.83 2.78 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 0.00 546 A 8.09 4.27 1.55 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 0.00 0.00 547 H 8.54 4.67 0.00 3.42 3.38 0.00 5.61 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 R 7.53 4.20 0.00 1.74 1.71 0.00 2.75 0.00 0.00 2.55 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.39 0.00 * Residues marked with a * may have inaccurate shift predictions.