NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 306 L 4.2930 8.2787 121.8867 55.1435 44.2560 178.4577 307 A 3.8024 8.0205 120.9894 54.9411 18.3214 177.8074 308 L 4.1842 7.7911 113.4411 56.4034 43.1276 176.0399 309 S 4.6034 8.1039 113.2658 57.8680 63.8194 174.3939 310 L 4.4172 7.3169 121.8783 55.0081 42.0458 177.4618 311 T 4.3146 9.2459 113.0307 60.4408 71.5709 175.9115 312 A 3.8719 8.1976 121.6733 55.6625 18.3969 179.5788 313 D 4.3966 7.9455 116.4945 57.3629 40.8429 178.9414 314 Q 4.0306 7.7264 118.7793 58.6645 28.7344 177.8666 315 M 3.9266 7.9449 119.3834 58.7131 32.2051 178.3554 316 V 3.5748 7.7609 118.3077 66.2080 31.6921 178.2169 317 S 4.1475 8.0011 113.1692 61.0392 62.6485 176.0387 318 A 3.9675 8.1992 124.2639 55.0928 18.4624 179.3081 319 L 4.1027 7.9237 117.1824 58.1238 41.6439 179.8293 320 L 4.0506 8.2708 119.1912 57.8264 41.2513 179.1761 321 D 4.3550 8.2288 117.3695 56.9644 41.2996 177.3907 322 A 4.3363 7.7442 118.5973 51.8397 18.9488 177.4462 323 E 3.9465 7.4349 118.1624 55.9425 30.0416 175.6283 324 P 4.6246 0.0000 0.0000 61.3790 32.4045 174.2160 325 P 4.3814 0.0000 0.0000 62.5111 31.9096 176.3396 326 I 3.9525 8.0974 121.4145 60.6111 36.7878 176.1926 327 L 4.4678 8.2412 125.6574 54.5071 42.5310 175.8161 328 Y 4.6728 8.1872 116.7417 55.8957 40.6326 175.9528 329 S 4.2857 9.4717 118.1615 58.3930 62.8806 174.7206 330 E 4.3865 8.6915 129.5701 55.1359 27.8371 174.1708 331 Y 4.7045 7.7068 120.8531 55.4806 41.5944 175.4362 *340 A 4.2042 8.3793 119.8112 52.0589 19.9368 179.0066 341 S 4.1614 7.8607 115.0038 63.1759 63.4540 175.6644 342 M 3.8730 7.7749 122.1969 57.9845 32.2194 178.1588 343 M 4.1962 7.9991 118.4046 57.7704 32.0986 178.9513 344 G 3.4995 7.6961 105.8918 47.7167 0.0000 175.6704 345 L 3.9691 8.4001 122.4417 57.6379 41.7099 179.8682 346 L 3.9566 7.8538 118.4890 57.7609 41.3881 179.6970 347 T 4.0438 7.7497 115.9778 66.2802 68.3192 176.5284 348 N 4.2843 8.5844 119.5329 56.4486 39.0577 176.6310 349 L 3.9403 8.1778 121.7007 58.1845 42.2615 178.5614 350 A 4.0824 8.5035 120.9289 55.5074 18.1005 179.2524 351 D 4.2755 8.1727 116.1274 57.7633 40.6947 179.1180 352 R 4.1246 8.3776 118.7627 59.1546 29.9606 178.8359 353 E 4.0397 8.8231 118.9041 59.2215 29.4327 178.7842 354 L 3.9413 8.4404 120.7829 58.4726 41.9485 178.9773 355 V 3.5959 7.4013 116.7421 66.8731 31.3162 177.8203 356 H 4.3864 8.3198 114.8412 58.6203 28.5100 177.2605 357 M 4.1590 8.3184 120.6564 58.7588 32.0736 178.0408 358 I 3.7617 7.9380 119.9441 64.6298 37.1045 177.6738 359 N 4.2196 7.5522 114.7605 56.5707 38.9526 176.3633 360 W 4.2042 8.7847 129.8350 60.1378 30.8098 177.4944 361 A 2.6627 8.9383 122.0713 55.0169 17.4995 179.7780 362 K 4.2641 7.6383 114.2830 58.5023 32.1367 178.5510 363 R 4.5149 7.8601 117.3918 54.5441 30.7631 175.8400 364 V 3.5571 7.1539 121.5360 60.9682 31.7436 173.4137 365 P 4.3310 0.0000 0.0000 64.8963 31.5186 175.1198 366 G 4.1923 9.2396 111.5955 46.0280 0.0000 175.1532 367 F 3.9428 8.7837 122.5935 61.0321 39.3053 177.0073 368 V 3.8479 7.6441 116.5508 62.7099 31.8005 176.3280 369 D 4.4381 7.6411 120.0381 55.6211 40.8617 176.2810 370 L 4.4304 6.8984 119.3528 53.2548 43.1769 177.1820 371 T 4.0185 7.9139 111.2619 61.2873 70.7347 175.1579 372 L 3.7989 8.2422 123.4092 58.7844 42.1150 178.9193 373 H 4.2548 7.8600 115.4344 59.1902 28.6364 177.3542 374 D 4.4144 8.1952 120.5303 57.4019 40.6118 178.8767 375 Q 3.6255 8.0884 118.9147 58.8897 28.6537 179.0427 376 V 3.6803 8.1443 121.8664 66.6355 31.2247 178.5643 *377 H 4.3114 7.9904 118.2227 59.5523 27.9429 180.0372 378 L 4.4624 7.9774 121.0971 57.9852 41.8825 179.5836 379 L 4.3739 8.2747 118.6458 57.4195 41.2761 178.9893 380 E 3.9571 8.2915 115.0182 57.6840 29.5785 177.2296 *382 A 4.3034 7.9213 120.6709 51.1316 20.8713 179.0191 383 W 4.4897 8.4045 114.6388 59.9911 27.7638 178.2957 384 L 3.1476 5.9533 120.6179 57.1691 41.3968 178.5381 385 E 3.8504 7.7746 118.1174 59.1748 29.4714 179.2709 386 I 3.6712 7.9424 120.4713 64.1895 37.1813 178.3386 387 L 3.9970 8.1645 120.2041 58.0709 41.3804 179.6193 388 M 3.9589 8.1720 118.7435 58.4274 31.9520 178.6265 389 I 3.7914 8.2833 119.3401 64.1302 38.0583 178.1765 390 G 3.7431 8.1744 106.5970 47.4366 0.0000 175.5904 391 L 3.7746 7.9502 122.6938 57.8348 41.8928 178.9883 392 V 3.4443 8.1574 117.4055 65.8588 31.5976 177.4189 393 W 4.3566 8.3656 128.0460 60.4490 30.3441 177.7944 394 R 3.7383 7.8801 113.3356 57.9851 29.3115 177.9139 395 S 4.2591 7.8915 115.9683 60.7843 62.8754 175.9072 396 M 3.6103 7.1171 119.8981 58.6998 31.8880 177.9592 397 E 4.3698 7.5263 117.4985 57.1099 30.7054 176.8649 398 H 4.8323 8.2444 112.1935 53.2328 29.9133 172.4621 399 P 4.2416 0.0000 0.0000 64.9191 30.2558 176.9296 400 G 4.0572 9.4996 110.5128 44.7601 0.0000 172.5843 401 K 5.0842 7.9169 117.5794 54.5692 36.3889 175.6890 402 L 4.1386 8.6488 122.7525 53.3955 43.1163 176.3100 403 L 4.8227 8.1516 128.8866 53.2940 39.5428 175.8148 404 F 3.9942 8.4876 121.1434 59.6404 39.7251 175.2332 405 A 4.6088 7.9258 120.6227 49.8470 22.3520 175.1130 406 P 4.1314 0.0000 0.0000 65.1474 31.3496 177.5344 407 N 5.0679 7.8171 113.2107 52.3573 38.1667 175.7541 408 L 4.5656 7.7797 120.2908 54.9100 43.6415 172.6017 409 L 4.6718 8.0165 121.5471 53.6908 42.8764 175.6142 410 L 5.1108 8.9595 127.1825 53.5614 44.6011 175.2849 411 D 5.1168 8.8097 119.8992 51.1832 42.6004 176.6912 412 R 3.2516 8.0170 115.6720 60.1696 30.1116 177.3421 413 N 4.3135 7.9832 115.0931 56.5330 38.5090 177.3883 414 Q 4.0572 8.6452 119.8547 58.7370 28.5326 178.9661 415 G 3.3255 7.4988 108.3310 47.6673 0.0000 176.2238 416 K 4.0961 7.6125 126.0444 59.6840 31.4028 183.1496 417 C 4.5226 7.5144 113.2464 60.0643 28.2789 173.5817 418 V 4.2959 7.6083 123.9850 61.1127 33.7104 175.0126 419 E 4.1894 8.8253 123.7796 57.6180 29.6337 173.7329 420 G 3.9568 8.9101 113.7596 44.8288 0.0000 174.7845 421 M 4.2426 7.7033 118.4506 58.2076 32.0912 178.2072 422 V 3.6611 7.9263 120.8555 66.6839 31.7278 178.2820 423 E 4.0310 7.6844 118.1477 61.2574 29.5038 180.9894 424 I 3.9539 7.7293 120.6287 64.0592 37.1909 177.9146 425 F 3.7675 9.1368 122.3037 61.6046 39.0475 177.0170 426 D 4.4668 8.9708 118.6330 57.5889 40.5501 178.6363 427 M 4.0149 8.0773 119.1905 58.3837 31.9792 178.8165 428 L 3.8465 8.5380 119.4973 57.6591 41.7178 179.5154 429 L 3.8755 8.1612 119.0098 57.8587 41.5085 179.5599 430 A 3.9413 8.1146 120.7606 55.2294 18.1916 179.7493 431 T 3.5024 8.1107 115.0304 66.7761 68.4219 176.9928 432 S 4.0595 7.9140 116.0139 61.0055 63.0272 176.3814 433 S 4.0045 8.0648 117.0164 61.4351 62.1066 176.1839 434 R 3.9753 8.1469 121.5315 59.4129 29.6914 178.4175 435 F 4.6382 8.3343 118.1657 60.5838 38.7961 177.4863 436 R 3.8593 8.4263 118.6438 59.6269 29.7480 178.1018 437 M 4.1152 8.2866 117.7887 58.9485 32.1655 178.1578 438 M 4.3794 8.0828 114.8795 54.1929 33.0225 176.0332 439 N 4.1616 8.9401 116.5648 53.6809 36.8041 174.8226 440 L 4.1629 8.0775 118.4614 55.7888 43.2655 176.5178 441 Q 4.9248 9.4456 124.9018 54.1836 32.0129 177.1268 442 G 3.4395 8.8457 109.6853 48.2064 0.0000 175.7974 443 E 3.9805 8.1450 120.2008 59.2387 29.4107 179.2444 444 E 4.0047 7.9081 118.1321 59.0569 29.5885 178.5669 445 F 3.8687 8.2952 121.4095 61.4493 39.1854 177.7046 446 V 2.9453 7.4713 118.2848 64.5958 30.9890 178.1703 447 C 4.0388 7.3563 116.1931 62.7392 28.0223 176.0052 448 L 3.9815 7.8538 120.6862 57.4676 41.0905 179.8512 449 K 3.8074 7.8142 118.6338 59.5432 31.9291 179.4615 450 S 4.1966 7.8351 115.1567 61.7423 62.7649 176.7742 451 I 3.6722 7.7100 122.3654 64.4418 36.8335 178.4055 452 I 3.6567 7.7297 120.4686 64.3054 36.7603 178.0773 453 L 4.0124 7.7264 119.5100 58.4734 42.0292 178.8667 454 L 4.2125 8.0362 117.4645 57.0371 41.4598 177.9626 455 N 4.6680 8.6102 115.3820 53.9961 38.9405 176.6897 456 S 4.4019 8.1599 115.8512 61.4032 62.8634 174.9487 457 G 4.2511 7.4272 106.6097 44.9272 0.0000 173.7852 458 V 3.8579 7.9944 118.5364 63.1689 31.6088 176.4663 459 Y 4.4259 7.8660 121.8508 57.2815 36.2415 175.8047 *469 L 4.2722 8.0111 124.9103 54.1235 43.4270 178.3671 470 E 4.5254 8.2001 117.3847 60.4826 30.2430 184.1050 471 E 4.4174 8.0677 120.1753 62.5119 30.2078 184.6212 472 K 4.1406 8.1156 124.5418 60.1274 31.7981 180.4684 473 D 4.6493 7.8069 118.9022 57.3155 40.5885 178.5088 474 H 4.1438 8.2865 118.6638 59.3779 29.9418 177.0509 475 I 3.5937 7.8520 120.9825 65.0964 36.9979 177.9309 476 H 4.2409 8.1761 116.4434 58.9212 28.4372 178.1195 477 R 4.0093 7.8742 119.6467 58.8868 29.8148 179.1929 478 V 3.5225 7.8387 118.3734 65.8687 31.5596 177.9573 479 L 3.9465 8.2928 119.1564 58.0251 41.4017 179.2384 480 D 4.3749 8.1773 118.6324 57.3521 40.7728 178.8269 481 K 4.1833 8.1206 121.3790 59.0601 32.0613 178.9477 482 I 3.7857 7.9782 120.3892 64.3706 36.9705 178.4992 483 T 3.9329 8.0163 116.6521 66.7153 68.1473 175.9658 484 D 4.3900 8.3243 121.0979 57.9856 40.9277 179.3405 485 T 3.9482 8.4470 115.9315 66.6233 68.3593 176.4104 486 L 3.9801 8.6041 121.7687 58.1735 41.6474 179.8454 487 I 3.7116 8.2806 119.7626 64.4412 37.0212 177.5834 488 H 4.0447 8.4819 119.4498 59.7181 29.6403 176.9243 489 L 4.0156 8.0783 120.2539 58.1994 41.4371 179.7070 490 M 4.0389 7.8160 118.0542 58.1798 31.8381 178.6453 491 A 3.8920 8.2892 121.2573 55.0535 18.4016 179.2182 492 K 3.6974 8.1490 116.8693 59.9268 32.2814 178.3833 493 A 4.1927 7.8001 118.5031 53.2254 18.2305 177.9831 494 G 3.7992 8.7268 106.3476 45.7973 0.0000 173.9978 495 L 4.3713 7.4480 118.9280 53.7488 42.5457 177.5217 496 T 4.2886 9.1564 112.4263 60.9314 71.2921 175.6878 497 L 3.9213 8.2798 120.0293 57.9659 41.6517 179.5721 498 Q 3.6107 7.8841 118.8771 59.2544 29.0496 178.0433 499 Q 4.0053 7.8240 118.7601 58.9098 28.6333 178.6554 500 Q 3.9969 8.3268 119.6395 59.4684 28.8338 178.9317 501 H 4.3688 7.9616 115.2492 58.5684 28.4519 177.7377 502 Q 4.0191 7.9078 120.7992 58.9119 28.5917 178.4153 503 R 3.9117 8.2931 120.0854 59.2372 30.1359 178.0705 504 L 3.9373 8.3819 120.4050 58.2708 42.0605 178.9424 505 A 4.0092 8.2313 120.5653 55.1377 18.1035 179.4217 506 Q 3.9827 8.3563 115.8081 59.2890 29.0399 178.9894 507 L 4.2590 8.3304 120.0786 58.0101 41.7489 179.7148 508 L 4.1456 8.1632 118.3312 57.2659 41.5349 179.4117 509 L 4.0937 8.0973 119.3211 57.4844 41.4565 179.2893 510 I 3.9133 7.6387 119.9150 64.1996 36.9549 178.2742 511 L 4.0272 7.9254 120.0616 57.8700 41.3073 179.6681 512 S 4.1132 8.0495 115.1636 61.7351 62.6063 176.4363 513 H 4.2300 7.9709 118.4726 58.8052 28.5021 177.5438 514 I 3.6769 7.9366 121.7192 64.4753 36.9168 178.2334 515 R 3.8262 8.0268 119.3155 59.7501 29.8477 177.5791 516 H 4.1574 8.5390 118.1799 59.8530 29.7262 176.8139 517 M 3.9750 8.7563 120.6069 58.4196 31.7596 178.7166 518 S 4.1378 8.3599 113.3906 61.4482 62.6115 175.6768 519 N 4.2633 8.7415 119.6391 56.5417 38.3460 177.5009 520 K 4.0604 8.4703 120.0086 59.4181 32.1510 179.6110 521 G 3.6795 8.9333 107.1522 48.1559 0.0000 175.6214 522 M 4.2715 8.5094 121.4654 57.9722 31.9466 178.1377 523 E 3.9997 8.1049 119.1316 59.9040 29.7853 178.4913 524 H 4.2778 8.3024 117.8928 59.1924 29.9277 177.1644 525 L 3.7979 8.4095 120.9943 58.2141 41.3087 179.2930 526 Y 4.1146 8.3446 115.5436 60.5458 37.7678 178.3102 527 S 4.3630 8.4190 115.3919 62.3009 63.1410 175.7865 528 M 3.9069 7.8930 121.3780 53.9428 31.5384 177.1892 529 K 4.0845 6.5996 128.7141 54.9608 33.5174 178.1855 *536 L 4.3151 8.5319 126.4573 53.9551 44.1588 177.8671 537 Y 4.0118 8.3058 119.0598 61.3939 38.5173 177.9475 538 D 4.4893 8.3051 118.9293 56.8145 41.0721 178.0595 539 L 3.9013 7.9759 120.6917 58.5368 41.5666 179.1277 540 L 3.9474 8.0910 118.7709 57.3859 41.4586 179.0506 541 L 3.9535 7.6760 120.4064 58.2951 41.5372 179.0111 542 E 3.9453 8.7581 118.5200 59.7253 29.4491 179.1327 543 M 4.1966 7.9010 118.5855 58.6454 31.8225 178.9423 544 L 4.0994 8.8790 118.5228 57.6055 42.1312 178.9757 545 D 4.4194 8.4882 119.3603 57.3742 40.8716 178.4592 546 A 3.9601 9.2375 121.8069 55.5715 18.1088 178.9274 547 H 4.1897 7.9325 117.9237 59.9211 29.8866 177.3756 548 R 4.3954 7.8546 122.0193 59.4060 29.4765 180.9009 549 L 4.9974 8.0093 116.9182 55.0289 42.3390 181.3086 550 H 4.9633 8.0344 115.3659 55.3456 30.5228 175.1205 551 A 4.2863 8.3713 123.5508 52.4423 18.9239 177.3058 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 L 8.28 4.29 0.00 1.73 1.70 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 307 A 8.02 3.80 1.37 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 0.00 0.00 0.00 308 L 7.79 4.18 0.00 1.67 1.74 0.98 0.79 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 0.00 309 S 8.10 4.60 0.00 3.97 4.08 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 0.00 0.00 0.00 0.00 310 L 7.32 4.42 0.00 1.62 1.62 0.90 0.81 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 0.00 311 T 9.25 4.31 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 1.22 0.00 0.00 312 A 8.20 3.87 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.95 4.40 0.00 2.69 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 7.73 4.03 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 315 M 7.94 3.93 0.00 2.41 2.13 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 316 V 7.76 3.57 2.09 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 1.08 0.00 0.00 1.01 0.00 0.00 317 S 8.00 4.15 0.00 4.10 4.11 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.92 4.10 0.00 1.97 1.73 0.88 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 320 L 8.27 4.05 0.00 1.68 1.74 0.94 0.87 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 0.00 321 D 8.23 4.35 0.00 2.87 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 0.00 322 A 7.74 4.34 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.43 3.95 0.00 2.14 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 0.00 2.38 2.46 0.00 324 P 0.00 4.62 0.00 2.15 2.09 0.00 3.66 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.71 0.00 325 P 0.00 4.38 0.00 2.19 2.11 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.94 0.00 326 I 8.10 3.95 1.85 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 1.41 0.56 0.78 0.00 0.00 327 L 8.24 4.47 0.00 1.66 1.69 0.98 0.80 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 0.00 328 Y 8.19 4.67 0.00 2.92 2.94 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 0.00 0.00 0.00 329 S 9.47 4.29 0.00 3.82 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 0.00 330 E 8.69 4.39 0.00 2.12 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 2.32 2.34 0.00 331 Y 7.71 4.70 0.00 3.05 2.88 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 0.00 0.00 0.00 *340 A 8.38 4.20 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 0.00 341 S 7.86 4.16 0.00 4.04 4.08 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 0.00 0.00 0.00 0.00 342 M 7.77 3.87 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 343 M 8.00 4.20 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.51 0.00 344 G 7.70 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.40 3.97 0.00 1.70 1.60 0.41 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 421 M 7.70 4.24 0.00 2.41 2.23 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.90 0.00 422 V 7.93 3.66 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 0.91 0.00 0.00 0.88 0.00 0.00 423 E 7.68 4.03 0.00 2.10 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 2.24 2.22 0.00 424 I 7.73 3.95 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.66 0.90 0.00 0.00 425 F 9.14 3.77 0.00 3.31 3.18 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 0.00 426 D 8.97 4.47 0.00 2.99 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 0.00 427 M 8.08 4.01 0.00 2.05 2.28 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.59 0.00 428 L 8.54 3.85 0.00 1.47 1.44 0.75 0.69 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 0.00 429 L 8.16 3.88 0.00 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0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.63 0.00 438 M 8.08 4.38 0.00 2.04 2.18 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 3.07 2.64 0.00 439 N 8.94 4.16 0.00 2.80 2.88 0.00 0.00 6.82 5.12 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 0.00 440 L 8.08 4.16 0.00 1.53 1.64 0.84 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 441 Q 9.45 4.92 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 442 G 8.85 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 3.98 0.00 2.06 2.00 0.00 0.00 0.00 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 2.46 0.00 444 E 7.91 4.00 0.00 2.13 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 445 F 8.30 3.87 0.00 2.03 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 7.47 2.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.75 0.00 0.00 447 C 7.36 4.04 0.00 3.17 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 0.00 448 L 7.85 3.98 0.00 1.70 1.66 0.94 0.93 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 0.00 449 K 7.81 3.81 0.00 1.48 1.80 0.00 0.61 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.18 0.00 0.00 0.00 0.00 1.09 0.48 7.81 450 S 7.84 4.20 0.00 3.95 3.87 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 0.00 451 I 7.71 3.67 2.00 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 1.51 0.59 0.90 0.00 0.00 452 I 7.73 3.66 2.06 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 1.41 0.70 0.97 0.00 0.00 453 L 7.73 4.01 0.00 1.82 1.93 0.80 0.29 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 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0.00 0.00 0.00 1.58 0.98 0.92 0.00 0.00 488 H 8.48 4.04 0.00 3.23 3.54 0.00 5.60 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 0.00 489 L 8.08 4.02 0.00 1.87 1.71 0.88 0.85 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 0.00 490 M 7.82 4.04 0.00 2.01 2.20 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 491 A 8.29 3.89 1.35 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 0.00 492 K 8.15 3.70 0.00 1.62 2.03 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.44 7.81 493 A 7.80 4.19 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 494 G 8.73 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 0.00 0.00 0.00 495 L 7.45 4.37 0.00 1.66 1.73 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 496 T 9.16 4.29 4.22 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 0.00 0.00 0.00 0.00 1.24 0.00 0.00 497 L 8.28 3.92 0.00 1.69 1.74 0.92 0.62 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 0.00 498 Q 7.88 3.61 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 499 Q 7.82 4.01 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 500 Q 8.33 4.00 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 501 H 7.96 4.37 0.00 3.38 3.57 0.00 5.28 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 502 Q 7.91 4.02 0.00 2.31 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.66 0.00 503 R 8.29 3.91 0.00 1.93 1.94 0.00 3.12 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 504 L 8.38 3.94 0.00 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3.01 0.00 0.00 0.00 0.00 1.39 1.44 7.81 521 G 8.93 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.51 4.27 0.00 2.42 2.24 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 2.82 2.63 0.00 523 E 8.10 4.00 0.00 2.27 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 2.36 2.38 0.00 524 H 8.30 4.28 0.00 3.27 3.48 0.00 5.66 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 0.00 525 L 8.41 3.80 0.00 1.90 1.29 0.85 0.94 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 0.00 526 Y 8.34 4.11 0.00 2.98 3.08 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 0.00 0.00 0.00 0.00 527 S 8.42 4.36 0.00 4.04 4.26 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 3.91 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.59 0.00 529 K 6.60 4.08 0.00 1.97 2.00 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.21 1.10 7.81 *536 L 8.53 4.32 0.00 1.72 1.79 0.67 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 537 Y 8.31 4.01 0.00 3.12 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 0.00 538 D 8.31 4.49 0.00 2.79 2.80 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 0.00 539 L 7.98 3.90 0.00 1.72 1.80 0.89 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 540 L 8.09 3.95 0.00 1.69 1.64 0.89 0.71 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 0.00 541 L 7.68 3.95 0.00 1.76 1.78 0.92 1.16 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 0.00 542 E 8.76 3.95 0.00 2.18 1.98 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 2.45 2.51 0.00 543 M 7.90 4.20 0.00 2.07 2.15 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 2.71 2.53 0.00 544 L 8.88 4.10 0.00 1.68 1.72 0.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 545 D 8.49 4.42 0.00 2.88 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 0.00 546 A 9.24 3.96 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 0.00 547 H 7.93 4.19 0.00 3.29 3.50 0.00 5.75 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 R 7.85 4.40 0.00 1.99 1.81 0.00 3.26 0.00 0.00 3.26 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 549 L 8.01 5.00 0.00 1.55 1.50 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 550 H 8.03 4.96 0.00 3.24 3.21 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 551 A 8.37 4.29 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.