NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 334 R 4.2636 8.0976 119.7000 56.2965 31.3868 175.8091 335 T 3.9606 8.3260 109.5222 62.0220 68.8634 173.0849 336 D 4.5515 7.4921 121.3220 54.4776 42.6359 176.4828 337 S 4.9122 7.3460 112.9770 56.9343 66.0600 174.3345 338 L 3.9351 8.4536 118.7979 57.9902 40.9896 179.2640 339 K 3.9641 8.0484 117.9646 59.7056 32.2453 178.6237 340 G 3.7029 7.7148 103.9509 47.7223 0.0000 175.6643 341 R 4.0187 8.5308 120.3569 56.5867 30.4652 176.7893 342 R 3.8437 8.7853 116.6381 57.2001 28.0735 177.2196 343 G 3.9093 8.3609 104.1054 45.4275 0.0000 173.5935 344 R 4.5250 7.4160 118.2150 54.6827 32.0095 175.2991 345 L 4.8381 7.8349 117.4512 52.1731 45.2814 175.1328 346 P 4.6201 0.0000 0.0000 62.3851 33.5037 177.7305 347 S 3.9094 9.3695 119.6315 60.5872 61.1912 176.5316 *363 S 4.3968 8.9614 122.5419 58.9153 65.0378 174.4601 364 L 3.9849 7.6695 120.6804 58.2239 41.9473 179.1262 365 I 3.7737 7.6677 119.3734 64.2164 37.0081 178.4340 366 S 4.1085 8.0316 115.4658 61.4644 62.6835 176.3419 367 A 3.9763 8.0566 123.3667 55.3111 18.0224 179.6888 368 L 3.9450 8.0419 117.4105 57.8608 41.5188 180.0477 369 V 3.8191 7.9128 119.7621 65.1011 31.4277 178.0759 370 R 3.8930 8.3545 118.5348 59.4853 29.8656 178.0796 371 A 4.0794 8.3669 120.9400 55.7010 18.0464 179.2112 372 H 4.2764 7.9538 115.5254 59.5313 29.8344 177.3859 373 V 3.7790 8.2904 120.4850 66.2076 31.1417 177.7828 374 D 4.4539 8.5279 118.2888 56.7720 40.8247 177.1196 375 S 4.8196 7.7933 112.1545 57.8112 63.2477 173.4073 376 N 5.0395 7.5746 116.2639 50.8282 41.8537 172.6396 377 P 4.2706 0.0000 0.0000 62.1913 32.1370 176.1099 378 A 3.9904 8.6222 125.1588 52.7897 18.5650 178.0755 379 M 4.3684 8.7922 120.0982 56.6852 31.5918 176.8794 380 T 4.6116 7.7308 106.7654 61.5037 69.7427 174.2382 381 S 4.7845 8.6524 118.3267 58.3239 63.7744 174.3094 382 L 4.0016 7.9988 119.7736 54.8713 42.0824 176.7634 383 D 4.7526 8.6921 122.3655 53.3247 40.9863 175.5531 384 Y 4.4540 8.4832 123.1837 57.6087 38.2788 177.9154 385 S 4.2146 8.6438 117.7201 61.0698 62.8838 175.5974 386 R 4.4558 7.8863 116.5065 55.4833 30.1917 175.8624 387 F 4.4019 8.0972 121.4946 57.8571 38.1877 174.6508 388 Q 4.1897 8.3105 129.3409 54.2445 29.6029 174.8869 389 A 3.7743 7.8150 127.8032 52.0193 19.9443 176.2620 390 N 4.4047 7.7808 115.7271 52.4504 39.0812 173.4208 391 P 4.2464 0.0000 0.0000 65.8853 31.7547 177.7274 392 D 4.3677 8.3795 117.9193 57.2306 40.7767 176.6603 393 Y 4.9037 7.4104 115.1142 58.5337 37.9993 176.4882 394 Q 4.2895 8.0557 121.4994 55.2411 27.4707 174.8379 395 M 3.4214 7.8421 118.0055 52.8750 32.3844 175.6203 396 S 3.9444 9.1844 118.9630 58.6622 62.8156 175.6742 397 G 3.6537 9.2098 119.9313 46.4823 0.0000 172.5617 398 D 4.3316 8.5895 116.0717 54.5007 38.6110 173.7615 399 D 4.5152 8.0088 123.0764 56.2538 39.6766 178.3217 400 T 3.8296 7.8767 114.5221 65.2384 67.2523 175.1862 401 Q 3.9599 9.1754 121.6131 59.9691 29.0562 178.3365 402 H 4.1676 7.7975 113.5388 58.9685 28.7747 178.0008 403 I 3.6315 7.9073 121.5957 64.4265 36.8267 178.5278 404 Q 4.0854 8.2461 118.9916 58.8389 28.4075 178.5275 405 Q 3.9343 8.0489 120.7501 59.0091 28.9542 177.9641 406 F 4.1037 8.1126 121.6132 61.7369 39.3769 176.7365 407 Y 4.0530 7.4562 115.9890 61.1732 37.6291 178.4359 408 D 4.4771 8.3241 121.4577 56.8502 40.7068 178.7889 409 L 4.1372 8.0143 118.8634 57.6563 41.9683 179.4591 410 L 3.9282 7.5459 119.3205 57.9889 41.2195 179.5669 411 T 3.9139 8.0375 109.8204 64.7648 68.4888 176.2946 412 G 3.8869 8.5914 107.0164 45.9248 0.0000 174.3837 413 S 4.8432 8.0874 118.8645 57.5869 60.4602 174.2913 *415 E 4.2908 7.6933 124.3219 56.4075 32.1349 177.5501 416 I 3.8034 7.9315 118.9770 64.7065 37.3277 178.4188 417 I 4.0503 8.4779 120.8472 64.3290 36.6795 178.5982 418 R 3.7089 8.3260 118.9642 58.9395 30.2205 178.2758 419 G 3.7944 8.2500 105.6580 47.5947 0.0000 175.0472 420 W 4.3127 8.3349 131.5131 60.2895 30.5324 177.7437 421 A 2.7763 8.3661 120.1685 54.8589 17.4984 178.9736 422 E 4.2006 7.9093 114.9288 57.8821 29.7070 178.2242 423 K 4.5264 7.5171 117.8787 55.0757 32.6331 176.2445 424 I 3.8267 6.7805 122.6135 59.2880 36.8021 173.6473 425 P 4.2616 0.0000 0.0000 64.4331 31.3945 176.9027 426 G 4.0768 8.9684 110.7316 46.4869 0.0000 175.3785 427 F 3.9787 8.5001 122.0823 61.2354 39.5996 176.9841 428 A 3.9146 8.1487 121.7224 55.2791 17.8997 178.3114 429 D 4.4337 7.6394 115.0629 56.7364 41.1324 177.0425 430 L 4.0691 7.2247 118.8552 53.2701 42.3172 175.1609 431 P 4.1801 0.0000 0.0000 62.7586 32.0295 177.1289 432 K 3.6787 8.9786 123.6566 59.8869 31.9023 178.2633 433 A 3.9771 7.9526 120.0898 55.5066 18.3108 179.2574 434 D 4.3296 8.2831 117.4895 57.2740 40.8367 178.9670 435 Q 3.6875 7.7737 118.2426 59.0118 28.6491 178.5276 436 D 4.5176 8.2822 119.8607 57.2445 40.9053 178.5598 437 L 3.9838 8.0959 120.8162 58.2780 42.2460 179.0778 438 L 4.1190 8.5002 119.3660 57.6601 41.5426 179.3483 439 F 4.3737 8.6743 120.6159 61.6217 39.2600 177.1751 440 E 3.7776 8.4101 116.9634 59.4269 29.2782 179.3047 441 S 4.3759 8.1914 114.2719 60.5047 63.2273 175.4240 442 A 4.6880 7.6938 121.3697 51.9347 19.6606 178.2591 443 F 3.7007 7.9132 120.2561 61.3114 39.2412 177.1285 444 L 3.7101 7.8726 118.8553 58.2107 41.9618 178.4868 445 E 3.9572 8.0906 117.9419 59.5626 29.5133 179.2778 446 L 3.8542 8.3145 119.2608 57.5230 41.6617 179.4335 447 F 3.8348 7.9400 120.8893 61.1744 39.3229 177.4962 448 V 3.5878 8.2018 118.1164 65.6368 31.3539 177.6795 449 L 4.1335 8.2392 120.5624 58.5086 42.1154 179.3238 450 R 4.1119 7.8500 117.7854 59.0062 30.0075 178.9039 451 L 3.5950 7.5412 119.5625 57.9663 41.8314 178.8933 452 A 3.9641 8.2749 119.8985 55.1928 18.3586 178.7354 453 Y 4.0698 7.8980 117.6786 60.5092 38.9568 177.5324 454 R 3.9133 7.5071 114.5424 57.1799 30.2064 176.6458 455 S 4.2064 7.2995 115.4633 58.2551 63.8289 173.8479 456 N 4.7738 8.5353 119.8456 50.4035 38.8349 172.3942 457 P 4.1835 0.0000 0.0000 65.2881 31.6374 179.6852 458 V 3.5670 7.7897 117.2405 65.0917 31.4806 176.0464 459 E 4.3869 7.9637 115.5761 55.4781 29.8781 176.2260 460 G 3.7404 7.8322 107.1460 46.2863 0.0000 173.0449 461 K 4.7358 8.0047 120.1129 54.7599 33.7659 175.6795 462 L 4.4930 8.9670 126.7053 53.1546 43.4830 175.7327 463 I 4.7324 7.7380 125.4059 59.5064 38.9476 175.9232 464 F 4.3596 8.9818 126.3905 56.2259 40.0564 176.6646 465 C 3.9933 8.7464 120.4460 62.9698 27.9030 174.9649 466 N 4.6857 8.3082 113.7881 52.6015 37.4771 175.6693 467 G 3.9634 8.7662 109.6679 45.1789 0.0000 173.9041 468 V 3.8559 7.7661 120.5400 63.0359 32.7663 174.7975 469 V 4.6682 8.2536 128.1815 61.4286 32.5683 174.5217 470 L 5.1703 8.9463 128.1289 53.1975 45.1702 175.8944 471 H 5.1673 8.7184 120.9099 55.1978 31.4291 175.8694 472 R 3.7665 8.3635 125.4186 59.9998 29.5046 178.9575 473 L 4.1113 7.9272 116.5399 57.3741 42.0148 178.7937 474 Q 4.2534 8.3368 118.7205 58.7565 28.8423 178.0158 475 C 4.4276 8.0453 117.6278 62.4598 28.3616 176.0218 476 V 4.0090 7.7483 120.5723 65.0022 30.3938 178.7884 477 R 3.9759 7.5371 117.3868 58.7319 30.4191 178.5686 478 G 3.7843 7.9031 104.6798 47.4092 0.0000 175.9603 479 F 2.9798 8.8039 120.8155 58.4607 39.5432 176.3488 480 G 4.0838 7.7097 103.3704 43.8222 0.0000 172.9722 481 E 4.0043 8.6534 117.3413 58.8061 29.3128 179.0862 482 W 4.5034 8.3873 128.1019 60.7244 30.6488 177.3367 483 I 3.4141 8.0156 118.5313 63.9808 37.2883 177.6159 484 D 4.3718 8.1451 119.9666 57.2194 40.5187 178.8433 485 S 4.2379 7.9479 115.4218 61.4732 62.8655 176.5320 486 I 3.6234 7.5191 122.6021 64.3154 36.8057 178.5993 487 V 3.4458 7.6878 119.0771 65.8639 31.2565 177.6160 488 E 3.9213 8.1766 119.0529 59.2259 29.4940 178.5911 489 F 4.0896 8.5754 120.9536 61.2619 39.4151 176.7601 490 S 3.9829 8.7445 113.3066 61.5475 62.1080 176.0185 491 S 4.0006 8.3948 115.8832 61.6824 61.8988 175.9945 492 N 4.3105 7.9972 117.7785 55.9743 38.2719 176.9584 493 L 3.9101 7.7568 121.4261 58.2897 42.3049 178.9335 494 Q 4.1233 8.0095 116.4766 58.0764 29.2715 178.0372 495 N 4.5795 7.6139 119.0916 52.5371 38.1451 175.2668 *497 N 4.5393 7.8530 113.2117 53.2076 40.1750 176.0262 498 I 4.1773 7.6598 118.8482 60.8560 38.4660 177.2736 499 D 4.7365 8.6874 125.6330 52.7565 41.7398 176.7798 500 I 3.7802 8.5221 119.9961 64.7762 37.3684 178.1094 501 S 4.1068 8.1381 114.9470 61.4422 62.8219 176.3749 502 A 3.8762 8.5990 123.5260 55.2940 18.1548 179.3805 503 F 3.7724 8.2470 119.1188 61.5794 38.9364 177.5108 504 S 4.1161 8.1073 114.5207 61.4389 62.4812 176.4839 505 C 4.1455 7.5652 119.3791 62.6611 28.1177 176.0541 506 I 3.5502 7.4476 120.9979 64.1606 36.4064 178.2726 507 A 3.6331 7.4099 120.5657 55.0822 18.2117 179.2458 508 A 4.3619 7.6236 118.1722 55.3614 18.5438 179.5556 509 L 4.1687 7.9361 115.9865 56.9114 41.7424 178.9100 510 A 4.1596 7.3146 117.3603 52.6972 19.2358 178.1608 *512 V 3.9719 7.3321 118.5078 63.5426 31.7519 174.0976 513 T 4.7127 7.4841 115.2892 59.1881 71.0690 172.8223 514 E 4.0984 8.6859 126.3375 56.5704 30.1834 176.5128 515 R 4.7432 8.1386 123.2478 54.5094 34.2130 174.6343 516 H 4.1960 8.8794 119.6572 57.2578 29.1481 175.7526 517 G 4.0408 9.0334 112.9689 45.6225 0.0000 172.8230 518 L 4.5702 7.6266 118.8116 53.1511 42.8623 177.1501 519 K 4.1150 9.8162 124.4587 59.3285 32.6603 177.9005 520 E 4.6909 8.5389 118.7545 53.2155 29.5485 174.9993 521 P 4.3489 0.0000 0.0000 65.1502 31.6845 178.5661 522 K 3.9720 7.9309 119.6876 59.4895 32.1291 178.7773 523 R 3.9730 7.8859 117.9236 58.8352 29.8098 179.3533 524 V 3.5911 7.5425 117.8516 66.0919 31.7673 177.5433 525 E 3.9862 8.2843 118.9339 59.3356 29.3634 178.5666 526 E 4.0444 8.2217 118.6528 58.6940 29.4443 178.9105 527 L 3.9426 7.6166 120.8467 57.9172 42.1490 178.3578 528 Q 3.9681 8.3765 119.9662 59.6192 28.9347 178.4190 529 N 4.3133 8.2892 117.2087 56.0732 38.6666 177.2699 530 K 3.9122 7.9417 120.9931 59.7271 32.2827 178.9761 531 I 3.7754 8.0591 120.2507 64.3513 36.9250 178.9196 532 V 3.6358 8.1132 113.6551 64.5172 31.4268 178.4416 533 N 4.4288 8.6573 116.4943 56.0617 38.4083 177.1086 534 C 4.1494 7.9052 120.3353 62.0896 31.5648 175.3725 535 L 3.9706 7.8519 122.0239 58.0102 41.6846 178.9017 536 K 3.9506 8.3522 118.8049 59.8600 31.9922 179.0508 537 D 4.4413 8.2497 118.9272 57.5818 40.6681 178.5015 538 H 4.2329 8.2259 118.4055 59.2580 29.4310 177.6057 539 V 3.6701 8.1639 120.2633 66.1984 31.1955 178.1613 540 T 4.0465 8.3439 115.8689 66.6618 68.4585 176.2654 541 F 4.1438 8.4600 122.6965 61.5166 39.2612 176.5188 542 N 4.4547 8.0777 112.8958 54.3730 38.1541 175.5435 543 N 4.8773 7.5516 118.4435 52.9533 39.7653 174.9573 544 G 3.5176 7.9684 105.1612 45.7736 0.0000 176.3410 545 G 4.0652 8.2219 108.3974 45.8359 0.0000 174.2404 546 L 4.3467 7.1031 120.1163 53.3088 42.1014 176.6526 547 N 4.7385 8.4694 120.7510 52.4500 38.5862 175.3271 548 R 4.6880 8.0730 116.8000 52.7272 30.8561 174.0687 549 P 4.2784 0.0000 0.0000 66.0668 31.4537 178.5038 550 N 4.4981 8.0673 116.9216 55.6190 38.5397 176.5681 551 Y 4.2720 8.0160 120.4593 60.8282 39.1070 177.7031 552 L 3.8018 8.2035 121.5317 58.0695 41.9562 179.0639 553 S 4.1808 8.1914 114.3536 61.0100 62.8174 176.4488 554 K 3.9674 7.8006 122.7248 59.0441 32.2881 178.6041 555 L 3.9941 7.9951 119.6636 57.9579 41.6380 179.6632 556 L 4.1438 7.8564 118.5900 57.4419 41.1536 179.6983 557 G 3.7352 8.1191 105.5314 47.1675 0.0000 175.8103 558 K 4.2217 7.9476 120.6624 59.0549 31.8708 179.3932 559 L 4.0336 7.9237 119.7592 57.3810 41.6109 177.6113 560 P 4.2770 0.0000 0.0000 65.5930 31.2309 178.5093 561 E 4.0615 8.0444 117.1605 59.2551 29.3822 179.2088 562 L 3.4392 8.0488 120.4778 57.8613 41.9324 178.9144 563 R 3.8662 8.0448 117.9552 59.8537 30.0378 178.3468 564 T 4.0180 8.0276 115.4898 66.4172 68.2786 176.4391 565 L 4.0758 8.0381 122.4687 58.5442 42.1556 178.9104 566 C 4.4382 8.3309 116.5522 62.5199 28.0021 175.9398 567 T 3.9245 7.5888 111.6587 64.8489 68.2064 176.1676 568 Q 3.9043 7.8595 122.3030 58.5095 28.9516 178.4150 569 G 2.0000 7.2938 107.4098 46.8811 0.0000 175.7928 570 L 4.1160 7.3629 120.9114 57.7153 41.6769 179.4686 571 Q 4.1810 8.0803 118.0542 58.7549 28.4703 178.9377 572 R 3.8918 7.6884 119.5999 59.5716 30.3162 178.6314 573 I 3.9419 7.9643 119.7074 64.3784 37.0932 178.2429 574 F 4.2435 8.7545 121.8623 61.2798 39.2427 176.5489 575 Y 3.7642 8.2260 119.1370 60.8280 38.5472 177.9757 576 L 4.2742 8.5416 120.4208 57.7541 41.4871 179.6655 577 K 3.9945 7.7165 117.4181 59.5389 32.8453 179.0394 578 L 3.8560 7.3069 119.5079 57.4804 41.4354 178.8091 579 E 3.7468 8.4190 119.4316 56.8126 29.3979 176.1852 580 D 4.7013 7.2770 116.8951 54.9512 40.5502 174.2747 581 L 4.3092 7.4572 119.3199 56.4423 42.9610 176.8858 582 V 4.4666 7.2489 116.1040 59.3272 31.2843 172.2812 583 P 4.2926 0.0000 0.0000 61.7876 32.2790 174.5353 584 P 3.6390 0.0000 0.0000 61.2021 31.9404 175.4725 585 P 4.3498 0.0000 0.0000 62.1487 33.3614 176.9651 586 A 3.9181 8.4585 119.4830 55.7240 18.0217 179.9943 587 I 3.6519 7.5294 117.5148 64.4886 37.2589 178.5406 588 I 3.7418 7.4457 120.1362 63.9757 36.9909 178.0104 589 D 4.3187 7.9822 120.1793 57.1606 40.6104 178.6660 590 K 3.9436 8.0616 120.2256 59.1752 32.1814 178.3967 591 L 3.8570 7.7694 120.7766 58.1957 41.8020 178.6624 592 F 4.0170 8.2818 120.2050 61.5940 39.1699 177.2325 593 L 3.9046 7.8115 116.7035 57.5630 41.4229 178.9151 594 D 4.4320 8.3051 118.8426 57.0924 40.8816 178.1793 595 T 4.1636 7.5568 114.6404 63.5936 68.8316 175.2114 596 L 3.3587 6.7693 122.4748 54.1384 41.6790 176.1759 597 P 4.2165 0.0000 0.0000 63.7637 31.8063 176.2963 598 F 4.4658 6.4797 119.3441 57.0551 37.8552 174.5800 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 334 R 8.10 4.26 0.00 1.82 1.87 0.00 3.17 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 335 T 8.33 3.96 4.20 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 0.00 0.00 1.13 0.00 0.00 336 D 7.49 4.55 0.00 2.58 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 337 S 7.35 4.91 0.00 3.99 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 0.00 338 L 8.45 3.94 0.00 1.70 1.75 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 339 K 8.05 3.96 0.00 1.73 1.83 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.51 7.81 340 G 7.71 3.70 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 0.00 0.00 0.00 341 R 8.53 4.02 0.00 1.84 2.18 0.00 3.26 0.00 0.00 3.14 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 342 R 8.79 3.84 0.00 1.89 1.96 0.00 3.35 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 343 G 8.36 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 0.00 0.00 0.00 344 R 7.42 4.53 0.00 1.89 1.88 0.00 3.16 0.00 0.00 3.55 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 345 L 7.83 4.84 0.00 1.56 1.50 0.91 1.00 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 0.00 346 P 0.00 4.62 0.00 2.00 1.94 0.00 3.65 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 1.99 2.07 0.00 347 S 9.37 3.91 0.00 3.83 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *363 S 8.96 4.40 0.00 3.86 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 0.00 364 L 7.67 3.98 0.00 1.78 1.63 0.90 1.02 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 0.00 365 I 7.67 3.77 1.84 0.00 0.00 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 1.60 0.41 0.84 0.00 0.00 366 S 8.03 4.11 0.00 4.01 3.92 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 0.00 0.00 0.00 0.00 367 A 8.06 3.98 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 0.00 368 L 8.04 3.95 0.00 2.01 1.78 0.91 0.67 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 0.00 369 V 7.91 3.82 2.27 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 1.94 2.12 0.00 378 A 8.62 3.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 379 M 8.79 4.37 0.00 1.98 2.08 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 2.53 2.42 0.00 380 T 7.73 4.61 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 1.21 0.00 0.00 381 S 8.65 4.78 0.00 3.90 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 0.00 382 L 8.00 4.00 0.00 1.85 1.35 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 383 D 8.69 4.75 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 384 Y 8.48 4.45 0.00 3.09 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 385 S 8.64 4.21 0.00 4.02 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 386 R 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.46 0.00 0.00 0.00 0.00 0.00 2.54 2.42 0.00 395 M 7.84 3.42 0.00 2.16 2.07 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 2.68 2.80 0.00 396 S 9.18 3.94 0.00 3.87 3.94 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 0.00 397 G 9.21 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 0.00 398 D 8.59 4.33 0.00 2.89 2.75 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 0.00 399 D 8.01 4.52 0.00 3.00 2.93 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 0.00 0.00 0.00 400 T 7.88 3.83 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 401 Q 9.18 3.96 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 402 H 7.80 4.17 0.00 3.42 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.93 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0.00 0.00 0.00 0.00 0.00 445 E 8.09 3.96 0.00 2.15 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 2.38 2.39 0.00 446 L 8.31 3.85 0.00 1.62 1.47 1.17 0.81 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 0.00 447 F 7.94 3.83 0.00 2.39 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 0.00 448 V 8.20 3.59 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 0.63 0.00 0.00 1.29 0.00 0.00 449 L 8.24 4.13 0.00 1.87 1.65 1.19 0.61 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 0.00 450 R 7.85 4.11 0.00 1.81 1.86 0.00 2.59 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 451 L 7.54 3.59 0.00 1.20 1.54 -0.08 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 452 A 8.27 3.96 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 453 Y 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0.00 0.00 1.66 1.41 0.00 478 G 7.90 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 0.00 479 F 8.80 2.98 0.00 2.96 3.22 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 0.00 480 G 7.71 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 0.00 0.00 0.00 481 E 8.65 4.00 0.00 2.04 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 2.43 2.40 0.00 482 W 8.39 4.50 0.00 3.36 3.47 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 0.00 483 I 8.02 3.41 1.76 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.83 0.93 0.00 0.00 484 D 8.15 4.37 0.00 2.90 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 0.00 485 S 7.95 4.24 0.00 4.20 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 0.00 486 I 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 538 H 8.23 4.23 0.00 3.43 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 539 V 8.16 3.67 2.18 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 1.18 0.00 0.00 1.13 0.00 0.00 540 T 8.34 4.05 4.35 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 1.24 0.00 0.00 541 F 8.46 4.14 0.00 3.21 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 542 N 8.08 4.45 0.00 2.84 2.81 0.00 0.00 6.91 8.06 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 0.00 543 N 7.55 4.88 0.00 2.85 2.99 0.00 0.00 7.03 8.06 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 0.00 544 G 7.97 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 545 G 8.22 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 0.00 546 L 7.10 4.35 0.00 1.94 1.62 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 547 N 8.47 4.74 0.00 2.86 2.85 0.00 0.00 6.17 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 R 8.07 4.69 0.00 2.00 1.94 0.00 3.22 0.00 0.00 3.46 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 549 P 0.00 4.28 0.00 2.28 2.35 0.00 3.80 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 2.10 2.09 0.00 550 N 8.07 4.50 0.00 2.85 2.95 0.00 0.00 7.25 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 551 Y 8.02 4.27 0.00 2.93 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 0.00 552 L 8.20 3.80 0.00 1.89 1.83 0.91 0.60 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 0.00 553 S 8.19 4.18 0.00 4.11 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 554 K 7.80 3.97 0.00 2.00 2.02 0.00 1.90 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.50 7.81 555 L 8.00 3.99 0.00 1.60 1.52 0.37 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 556 L 7.86 4.14 0.00 1.82 1.70 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 557 G 8.12 3.74 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 0.00 0.00 0.00 558 K 7.95 4.22 0.00 2.08 2.01 0.00 1.43 0.00 0.00 1.86 0.00 0.00 2.76 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.60 1.58 7.81 559 L 7.92 4.03 0.00 1.85 1.72 0.91 0.99 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 0.00 560 P 0.00 4.28 0.00 2.19 2.12 0.00 3.80 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 561 E 8.04 4.06 0.00 2.48 2.26 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 2.43 2.59 0.00 562 L 8.05 3.44 0.00 1.79 1.84 0.70 0.75 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 0.00 563 R 8.04 3.87 0.00 1.79 2.12 0.00 3.33 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 564 T 8.03 4.02 4.42 0.00 0.00 0.00 0.00 0.00 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 0.00 565 L 8.04 4.08 0.00 1.79 1.73 0.51 1.35 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 0.00 566 C 8.33 4.44 0.00 3.04 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 0.00 567 T 7.59 3.92 4.20 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 0.00 0.00 1.21 0.00 0.00 568 Q 7.86 3.90 0.00 2.20 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 569 G 7.29 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 0.00 0.00 0.00 0.00 0.00 0.00 570 L 7.36 4.12 0.00 1.79 1.64 0.62 0.89 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 0.00 571 Q 8.08 4.18 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.59 0.00 572 R 7.69 3.89 0.00 1.87 2.04 0.00 3.05 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.68 0.00 573 I 7.96 3.94 2.28 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.22 0.95 0.00 0.00 574 F 8.75 4.24 0.00 3.31 3.35 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 0.00 575 Y 8.23 3.76 0.00 3.16 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 576 L 8.54 4.27 0.00 2.07 1.94 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 577 K 7.72 3.99 0.00 1.84 1.83 0.00 1.39 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.31 7.81 578 L 7.31 3.86 0.00 1.42 1.36 0.06 -0.04 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 0.00 579 E 8.42 3.75 0.00 1.44 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 2.23 2.18 0.00 580 D 7.28 4.70 0.00 2.76 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 L 7.46 4.31 0.00 1.49 1.78 1.03 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 582 V 7.25 4.47 2.19 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 1.12 0.00 0.00 0.98 0.00 0.00 583 P 0.00 4.29 0.00 2.06 1.98 0.00 3.76 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 2.03 2.32 0.00 584 P 0.00 3.64 0.00 2.01 1.70 0.00 3.59 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 1.93 2.12 0.00 585 P 0.00 4.35 0.00 2.12 2.06 0.00 2.47 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 586 A 8.46 3.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 587 I 7.53 3.65 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.48 0.80 0.00 0.00 588 I 7.45 3.74 1.58 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.33 0.81 0.00 0.00 589 D 7.98 4.32 0.00 2.81 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 0.00 590 K 8.06 3.94 0.00 1.81 1.91 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.63 1.43 7.81 591 L 7.77 3.86 0.00 1.88 1.85 0.91 1.01 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 0.00 592 F 8.28 4.02 0.00 3.23 3.24 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 0.00 593 L 7.81 3.90 0.00 1.69 1.69 0.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 594 D 8.31 4.43 0.00 2.73 2.82 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 0.00 0.00 0.00 0.00 595 T 7.56 4.16 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 596 L 6.77 3.36 0.00 1.31 0.90 -0.13 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 597 P 0.00 4.22 0.00 2.16 2.08 0.00 3.10 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 598 F 6.48 4.47 0.00 3.14 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 * Residues marked with a * may have inaccurate shift predictions.