NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 484 S 4.4834 8.3349 115.4153 58.4627 63.4717 173.7888 485 T 3.9674 8.3873 117.7958 65.9537 68.7906 172.3680 486 E 4.1090 9.0339 119.8372 56.8335 30.8485 176.6092 487 E 4.4462 8.7916 122.4894 56.7154 30.4891 176.1019 488 E 4.7639 9.1220 123.1940 54.4212 33.0461 174.6839 489 Y 4.2390 8.8742 126.2112 57.9734 39.1392 173.8975 490 V 4.1210 8.0350 124.9763 63.7476 33.5492 175.3068 491 S 4.4827 6.8734 110.9789 55.8391 66.1155 172.5545 492 P 4.2940 0.0000 0.0000 65.1606 31.1695 177.7276 493 R 4.0578 7.8206 117.0046 56.5984 30.7949 175.3190 494 F 5.2218 7.6426 116.5265 55.5401 42.3942 173.9453 495 L 5.0488 8.5912 124.0141 53.1464 45.9569 174.8783 496 V 4.9402 8.7002 124.2191 61.1617 34.0451 174.3134 497 A 4.8463 9.0303 128.4894 51.1835 23.0073 175.7836 498 D 4.4442 9.1677 121.3155 55.5624 39.2911 175.2980 499 G 3.9008 8.4381 105.1601 45.4761 0.0000 173.4218 500 F 5.1324 8.3435 118.7152 55.2774 41.9735 173.8231 501 L 4.8531 8.5249 125.8797 54.3160 43.7130 174.9521 502 I 4.8862 9.1458 127.7829 59.5885 39.8936 174.3815 503 D 4.1905 9.3234 127.9368 53.4343 41.0447 176.7069 504 L 4.0516 8.3185 127.3563 56.9805 41.6952 178.8123 505 A 4.1141 7.9682 121.1201 54.3400 18.8353 177.9727 506 E 4.2286 8.3344 112.8783 56.0344 30.5179 175.8621 507 E 3.9673 8.5090 118.1140 55.5446 27.7654 173.6136 508 K 4.9883 7.3725 115.0618 54.7189 36.6258 174.6377 509 P 5.0597 0.0000 0.0000 62.9472 32.2425 175.6179 510 I 4.5502 8.7582 122.3347 58.6874 41.0828 174.6961 511 N 3.1400 7.4537 126.4042 52.9149 38.7825 173.6415 512 P 4.0808 0.0000 0.0000 64.4098 31.5226 176.9604 513 K 4.3197 7.2853 115.9668 55.6399 32.7600 175.4769 514 D 4.2830 7.8244 121.3156 53.4539 41.5033 175.4817 515 P 4.2904 0.0000 0.0000 65.7312 31.1877 177.7574 516 R 4.3065 8.3166 113.9840 56.8446 29.6985 177.8771 517 L 4.0186 7.8382 120.5598 56.9740 41.4044 178.9300 518 L 3.9718 7.4150 118.7904 57.8322 41.5760 179.0581 519 T 4.0974 7.6683 114.4325 66.4034 68.7666 176.5620 520 L 4.2473 7.5965 119.2062 55.2996 42.2286 177.1944 521 L 4.8580 7.2109 117.6310 51.9846 44.7368 177.1974 522 K 4.1871 8.5791 121.9486 56.0079 33.9189 178.0305 523 D 4.3783 8.6815 121.1265 58.2839 40.5285 179.0224 524 H 4.1410 8.1630 116.2262 59.4488 29.9310 176.8152 525 Q 3.9885 7.8832 118.2995 59.0124 28.9813 178.3853 526 R 3.9794 8.0238 118.8456 58.7664 30.0814 179.0977 527 A 4.3961 7.9690 120.3375 52.3797 18.2615 179.4017 *529 I 4.0988 7.7590 123.6814 63.0824 39.1704 177.3950 530 D 4.3866 7.7909 118.6749 57.1095 41.2072 176.9872 531 Q 4.1563 7.2098 118.1187 55.3046 28.2542 177.0464 *533 N 4.4447 7.5659 115.6154 53.5616 39.8103 172.8795 534 L 4.4200 7.3252 119.9084 53.0988 43.9400 177.7308 535 V 3.4750 7.7216 121.4462 63.5200 32.0491 175.6080 536 K 4.2721 8.3990 127.1400 55.5540 32.7968 178.1137 537 W 3.8637 9.0314 125.6695 59.4936 29.1090 178.1353 538 N 4.3792 8.3059 116.2533 56.4340 37.7149 176.6063 539 D 4.4942 7.4361 119.1964 56.6642 41.1776 178.0464 540 F 4.5318 7.9067 118.1087 59.1016 38.7809 177.5536 541 K 4.0185 7.9439 118.4633 59.4578 32.1587 178.3517 542 K 4.1595 8.3111 116.3529 59.6073 32.9532 177.0490 543 Y 4.0336 8.0601 116.3984 58.7692 38.0358 176.5951 544 Q 4.3055 8.8113 123.6967 57.4169 29.6110 175.9012 545 D 5.0477 8.1021 115.8298 50.9289 42.7615 174.0904 546 P 4.7588 0.0000 0.0000 63.3822 32.5065 175.6255 547 I 4.3962 9.1383 122.9009 58.9598 38.6096 173.4374 548 P 3.6577 0.0000 0.0000 62.0489 32.3401 175.6912 549 L 4.6816 8.3247 123.1684 52.2598 44.8540 177.5156 550 K 4.5901 8.4332 125.4537 55.2976 30.7137 176.4555 551 A 4.6989 7.8584 122.4654 51.4953 20.2063 178.0084 552 K 4.5004 9.2859 120.5608 57.7761 33.4518 177.8642 553 T 4.7131 8.9384 105.4018 61.7926 73.2944 175.4938 554 L 3.9631 8.8113 124.5301 58.3653 41.7755 178.8098 555 F 4.3347 7.8917 113.7709 59.1334 39.0740 176.3880 556 K 3.9708 8.0324 121.8519 58.2199 32.0905 177.2527 557 F 4.8248 8.1813 115.8889 57.1904 40.3467 174.6313 558 C 4.9400 7.8468 118.3493 57.1959 29.9679 173.6550 559 K 4.0440 8.6307 124.4280 57.3982 32.0424 176.3873 560 Q 5.1446 8.8092 122.8881 54.1329 31.9069 174.5108 561 I 4.6391 8.6872 114.5351 59.1810 41.4571 174.0376 562 K 4.9848 8.4655 121.6212 54.6864 33.6186 175.9875 563 K 4.3764 8.7599 125.7143 54.1087 35.8812 174.5581 564 K 4.6455 7.9864 126.5107 55.8261 33.0765 175.7015 565 F 5.0366 9.1624 124.9884 55.3518 44.0530 173.8719 566 L 4.4144 9.0043 121.2826 54.8202 42.7232 176.4153 567 R 4.6127 8.6239 124.7102 55.1229 30.5954 176.2302 568 G 3.9107 8.8849 116.0850 44.2309 0.0000 173.7441 569 A 3.7222 8.2589 122.1624 54.0076 18.4101 178.1039 570 D 4.7124 8.0213 114.1257 53.0126 39.6100 176.6749 571 F 3.7159 8.1114 116.5797 58.3579 37.1882 174.3675 572 K 4.7505 8.0851 120.1915 54.4029 35.0683 174.6396 573 L 4.8621 8.0200 119.7448 54.3336 42.7033 176.6208 574 H 5.1507 9.0329 118.6883 54.0389 33.1720 173.1496 575 T 4.5045 8.8457 118.5159 63.6272 69.5860 174.0430 576 L 4.2969 8.5168 125.9127 53.8859 42.2931 175.8177 577 P 4.2309 0.0000 0.0000 65.6965 31.4940 176.4908 *590 T 4.4216 7.5173 107.1112 61.6944 69.9680 173.7637 591 V 4.5886 8.7329 115.0952 59.8962 36.6456 174.0512 592 L 5.0903 8.4589 122.1154 53.4092 43.3249 175.9390 593 A 4.7563 8.9884 124.9246 49.8067 22.3710 175.5033 594 S 4.7980 8.7539 118.8826 58.9184 63.5209 173.5984 595 C 5.0899 9.3619 118.7467 56.8637 33.6464 173.1385 596 V 4.5891 9.1072 121.6956 60.6880 32.8413 173.0794 597 P 4.8274 0.0000 0.0000 62.3444 32.0973 176.0283 598 I 4.5810 8.2735 117.5362 58.8663 40.6910 173.9990 599 L 4.8245 8.7413 127.2884 54.3882 43.2534 175.9861 600 L 4.8336 8.7176 126.4130 53.2047 44.1074 177.1601 601 D 4.4165 9.0978 119.6671 57.8768 40.5804 178.0399 602 D 4.6296 8.0859 114.3414 53.1868 39.7200 176.7153 603 Q 3.9112 8.1447 117.4245 56.6626 26.9020 173.5830 604 T 4.2421 8.0948 115.4852 63.4825 69.9029 173.5868 605 V 4.4883 8.2529 124.5513 61.6022 33.1399 174.9276 606 Q 4.5106 8.4993 126.5621 54.2753 32.7054 173.9383 607 Y 5.0595 8.3941 116.6519 56.8863 42.3329 174.6956 608 L 4.9955 8.9890 125.7411 53.8258 43.4519 175.5603 609 Y 5.0109 8.6549 121.1994 54.9751 42.0301 174.4182 610 D 4.7588 8.0297 120.6145 53.1658 41.4485 175.5235 611 D 4.5572 8.4766 125.5427 54.4843 40.8231 175.8412 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 484 S 8.33 4.48 0.00 4.02 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 0.00 485 T 8.39 3.97 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 1.34 0.00 0.00 486 E 9.03 4.11 0.00 1.98 1.96 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 2.36 2.34 0.00 487 E 8.79 4.45 0.00 1.93 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 2.46 2.46 0.00 488 E 9.12 4.76 0.00 1.87 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 0.00 2.24 2.39 0.00 489 Y 8.87 4.24 0.00 2.97 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 0.00 490 V 8.04 4.12 2.16 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 0.75 0.00 0.00 0.86 0.00 0.00 491 S 6.87 4.48 0.00 3.98 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 0.00 492 P 0.00 4.29 0.00 2.07 2.23 0.00 3.68 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 2.09 2.24 0.00 493 R 7.82 4.06 0.00 1.72 1.77 0.00 2.88 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 494 F 7.64 5.22 0.00 2.85 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 0.00 495 L 8.59 5.05 0.00 1.40 1.14 0.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 496 V 8.70 4.94 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 1.00 0.00 0.00 0.91 0.00 0.00 497 A 9.03 4.85 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 0.00 498 D 9.17 4.44 0.00 3.09 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 0.00 499 G 8.44 3.90 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 0.00 0.00 0.00 500 F 8.34 5.13 0.00 3.26 3.12 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 0.00 0.00 0.00 0.00 501 L 8.52 4.85 0.00 1.74 1.67 0.86 0.73 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 0.00 502 I 9.15 4.89 1.73 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.91 0.96 0.00 0.00 503 D 9.32 4.19 0.00 2.77 2.68 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 0.00 504 L 8.32 4.05 0.00 1.47 1.63 0.78 0.82 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 0.00 505 A 7.97 4.11 1.16 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 0.00 0.00 506 E 8.33 4.23 0.00 1.98 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 0.00 2.28 2.47 0.00 507 E 8.51 3.97 0.00 2.20 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 2.41 2.20 0.00 508 K 7.37 4.99 0.00 1.86 1.89 0.00 1.56 0.00 0.00 1.90 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.61 1.51 7.81 509 P 0.00 5.06 0.00 2.47 2.41 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.98 0.00 510 I 8.76 4.55 1.95 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 0.93 0.74 1.02 0.00 0.00 511 N 7.45 3.14 0.00 1.74 2.17 0.00 0.00 7.21 7.71 0.00 0.00 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 P 0.00 4.08 0.00 1.88 1.92 0.00 3.14 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.92 0.00 513 K 7.29 4.32 0.00 1.57 1.69 0.00 1.69 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.20 1.23 7.81 514 D 7.82 4.28 0.00 2.57 2.38 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 0.00 515 P 0.00 4.29 0.00 2.26 2.27 0.00 3.68 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 516 R 8.32 4.31 0.00 2.05 2.18 0.00 2.78 0.00 0.00 3.17 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 517 L 7.84 4.02 0.00 1.63 1.51 0.79 0.15 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 0.00 518 L 7.42 3.97 0.00 1.54 1.69 0.93 1.27 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 0.00 519 T 7.67 4.10 4.36 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 1.21 0.00 0.00 520 L 7.60 4.25 0.00 1.65 1.85 1.05 0.83 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 0.00 521 L 7.21 4.86 0.00 1.55 1.39 0.44 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 522 K 8.58 4.19 0.00 1.83 1.74 0.00 1.71 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.49 7.81 523 D 8.68 4.38 0.00 2.68 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 0.00 524 H 8.16 4.14 0.00 3.11 3.34 0.00 5.73 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 0.00 525 Q 7.88 3.99 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.86 0.00 0.00 0.00 0.00 0.00 2.52 2.45 0.00 526 R 8.02 3.98 0.00 1.90 1.89 0.00 3.03 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 527 A 7.97 4.40 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 *529 I 7.76 4.10 1.91 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.48 0.79 0.00 0.00 530 D 7.79 4.39 0.00 2.76 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 0.00 531 Q 7.21 4.16 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.04 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 *533 N 7.57 4.44 0.00 2.68 2.77 0.00 0.00 7.28 7.78 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 0.00 534 L 7.33 4.42 0.00 1.46 1.64 0.84 0.95 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 0.00 535 V 7.72 3.47 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.68 0.00 0.00 536 K 8.40 4.27 0.00 1.64 1.65 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.51 7.81 537 W 9.03 3.86 0.00 3.47 3.37 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 0.00 538 N 8.31 4.38 0.00 2.76 2.88 0.00 0.00 7.18 8.08 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 0.00 539 D 7.44 4.49 0.00 2.32 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 0.00 540 F 7.91 4.53 0.00 3.16 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 0.00 541 K 7.94 4.02 0.00 1.96 1.99 0.00 1.76 0.00 0.00 2.01 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.63 7.81 542 K 8.31 4.16 0.00 1.89 2.00 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.65 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.57 1.57 7.81 543 Y 8.06 4.03 0.00 3.21 3.26 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 0.00 544 Q 8.81 4.31 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 545 D 8.10 5.05 0.00 2.77 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 0.00 546 P 0.00 4.76 0.00 1.90 1.77 0.00 3.67 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 1.53 0.56 0.00 547 I 9.14 4.40 1.47 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.37 0.67 0.00 0.00 548 P 0.00 3.66 0.00 1.84 1.58 0.00 3.70 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 1.94 1.99 0.00 549 L 8.32 4.68 0.00 1.71 1.65 0.61 0.89 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 0.00 550 K 8.43 4.59 0.00 1.78 1.81 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.39 7.81 551 A 7.86 4.70 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 0.00 552 K 9.29 4.50 0.00 1.94 1.93 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.54 7.81 553 T 8.94 4.71 4.56 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 0.00 0.00 0.00 1.37 0.00 0.00 554 L 8.81 3.96 0.00 1.73 1.28 0.78 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 555 F 7.89 4.33 0.00 3.10 3.11 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 0.00 556 K 8.03 3.97 0.00 1.52 1.08 0.00 1.02 0.00 0.00 1.41 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.01 1.18 7.81 557 F 8.18 4.82 0.00 3.19 2.97 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 0.00 0.00 0.00 558 C 7.85 4.94 0.00 2.91 2.84 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 0.00 559 K 8.63 4.04 0.00 1.68 1.81 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.48 7.81 560 Q 8.81 5.14 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 561 I 8.69 4.64 1.89 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 1.35 0.99 0.96 0.00 0.00 562 K 8.47 4.98 0.00 1.61 1.72 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.39 7.81 563 K 8.76 4.38 0.00 1.44 0.98 0.00 1.14 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.80 7.81 564 K 7.99 4.65 0.00 1.62 1.44 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.49 7.81 565 F 9.16 5.04 0.00 2.83 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 0.00 566 L 9.00 4.41 0.00 1.86 1.63 1.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 567 R 8.62 4.61 0.00 1.79 1.80 0.00 3.24 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 568 G 8.88 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 0.00 569 A 8.26 3.72 1.20 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 0.00 0.00 0.00 570 D 8.02 4.71 0.00 2.89 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 0.00 571 F 8.11 3.72 0.00 3.21 3.21 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 0.00 572 K 8.09 4.75 0.00 2.05 1.78 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.69 1.60 7.81 573 L 8.02 4.86 0.00 0.68 0.81 -0.56 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 574 H 9.03 5.15 0.00 3.02 3.25 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 T 8.85 4.50 4.33 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 1.34 0.00 0.00 576 L 8.52 4.30 0.00 1.58 1.57 0.84 1.02 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 0.00 577 P 0.00 4.23 0.00 2.17 2.19 0.00 3.79 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 1.98 1.96 0.00 *590 T 7.52 4.42 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 1.18 0.00 0.00 591 V 8.73 4.59 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 0.67 0.00 0.00 0.99 0.00 0.00 592 L 8.46 5.09 0.00 1.48 1.53 0.88 0.61 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 0.00 593 A 8.99 4.76 1.20 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 0.00 0.00 0.00 594 S 8.75 4.80 0.00 3.72 3.97 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 0.00 0.00 0.00 595 C 9.36 5.09 0.00 3.20 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 0.00 596 V 9.11 4.59 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 0.97 0.00 0.00 1.07 0.00 0.00 597 P 0.00 4.83 0.00 1.98 2.01 0.00 3.73 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.26 0.00 598 I 8.27 4.58 1.27 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.83 0.68 0.00 0.00 599 L 8.74 4.82 0.00 1.73 1.74 1.00 1.07 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 0.00 600 L 8.72 4.83 0.00 1.73 1.74 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 601 D 9.10 4.42 0.00 2.71 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 602 D 8.09 4.63 0.00 2.82 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 0.00 603 Q 8.14 3.91 0.00 2.31 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.93 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 604 T 8.09 4.24 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 1.24 0.00 0.00 605 V 8.25 4.49 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 0.34 0.00 0.00 0.91 0.00 0.00 606 Q 8.50 4.51 0.00 1.62 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.52 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 607 Y 8.39 5.06 0.00 3.02 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 0.00 608 L 8.99 5.00 0.00 1.48 1.40 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 609 Y 8.65 5.01 0.00 2.90 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 0.00 610 D 8.03 4.76 0.00 1.58 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 0.00 0.00 0.00 611 D 8.48 4.56 0.00 2.55 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 * Residues marked with a * may have inaccurate shift predictions.