NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -7 K 4.2484 8.3149 121.7790 56.5979 32.3446 174.6221 -6 H 4.6223 8.4342 122.5923 53.5620 32.0587 172.7900 -5 H 4.4154 8.4208 119.6955 55.2220 28.6032 174.8101 -4 H 4.6123 7.8965 121.5439 54.1166 27.4309 174.3869 -3 H 4.7885 7.9110 124.9913 55.4937 30.5641 173.8567 -2 H 4.8737 8.3820 117.2111 54.9849 32.8539 172.8608 -1 H 3.9033 8.3920 114.4620 57.0158 26.0056 175.5616 *432 I 4.1663 7.4040 116.8143 61.5132 38.3118 176.7056 433 K 4.5680 8.1210 124.8902 53.5780 32.4994 174.9370 434 P 4.3711 0.0000 0.0000 64.5181 31.7568 178.5814 435 G 3.9241 8.1151 105.4733 47.0365 0.0000 174.0124 436 A 5.0822 8.2171 122.0205 52.2546 18.9033 176.6194 437 L 5.4801 7.8635 116.2842 53.6778 43.6843 175.5271 438 C 5.2561 9.1286 116.0652 57.0530 34.2975 172.3365 439 V 4.7768 8.5497 118.6993 61.3029 33.3661 174.2520 440 I 4.7969 8.5552 128.8117 60.1250 39.1153 174.1250 441 D 5.2727 9.4873 126.5960 52.6538 44.1342 174.6042 442 T 5.0505 8.9031 114.8370 59.1473 72.4169 173.0734 443 P 4.2639 0.0000 0.0000 65.7249 31.4311 178.0561 444 E 4.1422 7.8658 115.7778 56.6864 29.9809 176.9900 445 G 3.9350 6.2992 104.7377 45.6292 0.0000 170.8044 446 K 5.1128 8.2177 117.7087 54.8226 35.9440 175.7636 447 G 4.2509 8.8753 108.6918 45.4912 0.0000 170.9418 448 T 5.0777 9.0523 116.4673 62.1978 70.4942 174.9188 449 G 4.6015 9.1628 112.2595 44.3693 0.0000 171.4995 450 F 5.4158 8.1953 114.1430 54.9389 41.9158 173.7072 451 F 4.9651 9.0108 120.5786 57.2639 40.4248 175.0839 452 S 5.0015 9.2274 118.1382 57.9442 66.2164 173.4088 453 G 3.6973 8.4351 117.4034 47.4063 0.0000 173.4753 454 N 4.7314 8.8423 123.6910 53.2736 39.1139 173.2678 455 D 5.5339 8.2742 117.1047 53.2565 44.4130 175.0194 456 I 4.6367 9.0216 122.1895 59.5783 39.6466 174.9627 457 V 4.2220 7.8913 127.0744 61.4070 34.1226 174.3551 458 T 4.7981 7.6090 119.5700 60.9612 71.7747 172.1073 459 A 4.3956 8.4045 125.0466 51.4219 19.3238 178.1847 460 A 3.9089 8.4762 124.6150 55.7493 18.1789 180.1773 461 H 4.2671 8.0120 111.2901 58.0738 28.8022 177.5379 462 V 3.6251 7.1277 120.8113 65.9296 31.5091 177.7094 463 V 3.7242 7.7318 117.5937 63.8104 31.7636 176.7778 464 G 3.7606 8.5788 106.6062 47.3005 0.0000 174.5649 465 N 4.7011 8.7558 121.7063 52.8107 38.9281 174.8678 466 N 4.5198 7.6923 117.0632 53.8395 39.2313 174.9256 467 T 4.3539 8.5668 111.1598 62.7401 70.8423 174.3492 468 F 5.2663 8.2616 118.6739 55.6552 42.8788 174.7042 469 V 4.6769 8.9539 114.2816 59.6333 36.3266 174.4142 470 N 5.2013 8.9848 120.4389 52.8113 40.2699 174.4203 471 V 4.8495 9.2001 123.1751 61.2476 34.8115 173.4599 472 C 5.3401 9.3487 128.7364 57.9243 33.8953 171.8965 473 Y 5.0500 9.0962 127.0782 56.9880 42.2398 174.5299 474 E 3.3376 9.6679 126.1557 57.2617 27.3085 175.7425 475 G 3.9057 8.5939 105.0087 44.8920 0.0000 173.3842 476 L 4.6557 7.8568 122.4066 53.2889 44.5458 175.0401 477 M 5.0714 8.4972 125.7130 54.9115 33.2799 175.1099 478 Y 4.8942 9.4690 120.3050 56.2565 42.2833 174.2218 479 E 5.1913 8.9269 120.5584 55.2342 31.2796 175.5331 480 A 4.8580 9.1762 125.0947 50.0626 23.2586 174.5792 481 K 3.8674 8.4316 122.1288 54.7101 34.0308 175.8969 482 V 3.8370 8.0455 128.5370 63.4943 31.3994 175.3416 483 R 4.3242 9.1940 129.3233 58.4871 31.0249 175.9832 484 Y 4.9892 7.7409 118.7927 56.8177 42.4893 173.3365 485 M 4.5803 8.3917 126.1568 52.4574 32.9462 173.4925 486 P 4.2294 0.0000 0.0000 61.3425 33.0208 176.3954 487 E 4.0010 8.6309 118.2720 59.1007 29.6382 177.6280 488 K 4.0282 7.8502 116.3176 56.9915 33.1660 176.6077 489 D 4.7631 8.4060 121.2059 54.9182 39.4234 175.7555 490 I 4.9426 7.4415 117.2269 59.3108 41.5367 176.3658 491 A 4.5300 8.4096 125.9569 50.0066 22.5273 174.9632 492 F 4.9800 8.8937 120.1630 55.6826 41.7567 174.5716 493 I 4.8282 8.6566 125.1412 59.3313 39.8726 175.3026 494 T 4.2916 8.4793 124.4706 63.5622 68.7834 173.9671 495 C 4.2744 8.7086 128.2697 58.5908 32.3963 171.7656 496 P 4.3752 0.0000 0.0000 62.6634 31.5761 177.6513 497 G 3.7011 8.7971 110.9920 48.2644 0.0000 173.9487 498 D 4.4735 8.0186 116.6205 53.1675 40.1584 175.8900 499 L 3.9688 7.3091 122.8741 54.3019 41.4425 175.7715 500 H 4.6933 8.1439 125.0602 52.9831 28.5421 172.5218 501 P 3.8667 0.0000 0.0000 62.2164 31.7214 177.4799 502 T 4.1276 8.5297 110.0432 63.4280 69.4336 174.4836 503 A 4.6990 7.3938 123.8144 51.1635 22.0388 174.8352 504 R 5.2211 8.2539 118.1632 54.5645 34.5200 174.5096 505 L 4.7325 9.2423 121.5622 53.5691 43.2439 176.6230 506 K 4.6405 8.5352 122.0647 54.9631 34.6924 176.1400 507 L 4.7838 8.3100 121.8616 54.0753 43.0851 176.6090 508 S 4.4564 8.2963 115.1969 57.7938 63.3448 175.2667 509 K 4.1353 8.7226 126.9865 58.8233 32.3448 177.4010 510 N 4.8372 7.5955 116.3290 50.5942 38.0289 170.5331 511 P 4.0376 0.0000 0.0000 61.3811 31.9931 175.6776 512 D 4.5680 8.2261 123.7486 52.8879 41.0682 175.3013 513 Y 4.4629 8.3169 124.0016 58.6414 38.5847 176.9852 514 S 4.5196 8.4988 116.8300 60.9966 64.1317 173.9305 515 C 5.2470 7.7898 112.6954 56.8814 32.6931 173.6312 516 V 4.7105 9.0230 112.7809 60.2015 36.6217 174.2221 517 T 5.0094 8.8228 118.6433 61.8217 71.7023 173.3080 518 V 4.6668 8.8993 126.5655 61.2746 33.9916 174.1269 519 M 5.2952 8.1805 126.7558 53.6104 34.9540 174.8716 520 A 4.6084 8.4443 122.6980 51.0099 23.4958 174.5052 521 Y 4.9457 8.3315 118.4210 56.8476 39.3702 175.6946 522 V 4.3230 9.1158 124.6166 61.6609 34.2737 176.1613 523 N 4.0482 8.5205 127.1457 54.9166 37.5765 177.0648 524 E 4.3003 9.1655 127.5928 57.9993 30.2180 175.4400 525 D 5.0749 8.0267 119.5142 52.0925 43.1359 175.1373 526 L 4.4370 8.3821 124.5798 54.9275 43.3913 176.1638 527 V 4.3817 8.9789 125.6562 61.1707 34.4881 174.0571 528 V 5.0497 8.4665 127.7315 61.1183 34.0449 174.6435 529 S 4.8204 8.8558 121.2413 57.1577 66.5801 173.3246 530 T 4.8860 8.3877 111.7078 61.2554 70.6438 173.4213 531 A 4.6611 8.3797 122.4229 50.7979 23.0966 175.7142 532 A 4.6420 8.5591 121.1112 51.8754 19.4527 176.8765 533 A 5.2012 8.6771 121.1193 50.3516 22.8119 175.4706 534 M 4.6736 9.0990 116.6739 53.3689 34.5942 174.5944 535 V 4.3334 7.9502 120.9394 61.8265 33.4566 175.1171 536 Y 4.5871 8.5619 125.0411 56.6693 40.7755 177.4410 537 G 3.8558 8.3825 117.9141 47.0584 0.0000 172.8409 538 N 4.6716 9.0036 123.5984 53.3112 39.0365 173.8470 539 T 5.1630 7.9007 115.8779 61.5943 72.0433 172.9141 540 L 5.2340 8.9563 125.9641 53.4713 45.3709 175.2742 541 S 5.3455 9.2966 121.5070 56.1756 66.4259 172.6057 542 Y 5.1201 7.3415 118.9841 55.8563 40.9058 173.3634 543 A 4.7606 8.8055 122.6758 52.2452 19.2886 177.1409 544 V 4.6803 8.8782 114.1632 59.8682 35.1582 176.1571 545 R 4.5736 8.7569 119.0203 56.5758 30.7690 176.3294 546 T 4.8479 7.5420 111.1282 60.8946 70.6713 173.1303 547 Q 4.1059 8.3209 123.6585 56.5700 29.6525 175.8504 548 D 4.9376 7.6797 117.9234 53.3215 41.5655 175.8169 549 G 3.7113 8.5164 109.3944 46.6343 0.0000 173.2838 550 M 4.6974 8.5571 122.3969 54.4542 33.9480 175.5469 551 S 4.4382 8.0725 116.2000 60.6308 63.3111 175.2847 552 G 4.4137 9.4922 113.2889 46.1063 0.0000 173.6279 553 A 4.1722 7.9174 121.8011 52.0486 19.3632 175.3174 554 P 4.2752 0.0000 0.0000 62.5040 33.1302 175.4161 555 V 4.2918 8.6680 123.9091 61.6810 33.0887 174.2787 556 C 5.1274 8.8962 126.5647 57.8291 31.3490 174.0808 557 D 4.6487 8.7363 121.7762 52.3648 40.4059 177.1179 558 K 3.5571 8.2095 116.8018 58.9284 32.4821 177.4987 559 Y 4.6318 8.2257 118.6329 58.5577 38.2443 176.6711 *560 C 3.8595 8.2858 116.1574 57.6460 26.7375 178.0802 561 R 4.5195 7.8704 119.3156 56.2553 30.6912 175.9216 562 V 4.0762 8.3841 122.9283 61.9599 31.6152 175.8823 563 L 4.6649 9.2091 124.6343 56.0360 43.9370 175.9476 564 A 4.9847 7.6012 117.9573 51.1683 23.1458 175.1220 565 V 4.7817 8.4266 119.1714 61.0436 34.1126 174.5011 566 H 4.4958 9.5560 129.2235 57.2973 30.3229 174.2607 567 Q 4.4619 9.1507 124.2066 57.3340 30.2124 175.5284 568 T 4.8159 7.2780 111.0492 60.8019 71.5043 171.0755 569 N 5.4947 8.5728 120.5714 51.0953 40.9722 174.2450 570 T 4.3650 8.6467 111.1863 60.3822 70.8173 174.5623 571 G 3.8430 8.0589 118.4043 47.1949 0.0000 172.4943 572 Y 4.4797 8.6036 122.3895 57.8266 37.9510 173.8856 573 T 4.8231 7.9028 118.6872 62.0799 70.3530 174.4987 574 G 4.0406 9.2593 114.8470 44.9208 0.0000 172.6296 575 G 4.4153 8.6310 107.2853 44.2029 0.0000 171.6098 576 A 5.3230 9.1529 125.0279 50.0797 23.5807 174.5899 577 V 4.6719 8.2020 119.2036 60.9622 33.5928 175.4332 578 I 4.3959 8.6273 129.6617 61.7376 37.5339 175.1920 579 I 4.9473 8.6130 127.1835 59.3333 40.0482 174.2763 580 D 5.1151 9.7736 127.1852 50.6839 42.7408 174.4512 581 P 4.2822 0.0000 0.0000 66.1092 31.3466 178.7399 582 T 4.1502 8.2647 106.7209 63.7082 68.9293 175.4227 583 D 4.6884 8.4955 122.2907 56.9912 41.1273 177.7506 584 F 2.7785 8.0801 117.8094 59.5124 39.0205 175.3125 585 H 4.4123 7.6317 115.2375 52.8459 32.5267 171.3576 586 P 4.4253 0.0000 0.0000 63.1000 31.3236 176.1453 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 -7 K 8.31 4.25 0.00 1.69 1.75 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.43 7.81 -6 H 8.43 4.62 0.00 3.19 3.15 0.00 5.94 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 -5 H 8.42 4.42 0.00 3.01 2.87 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -4 H 7.90 4.61 0.00 3.17 3.30 0.00 5.71 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -3 H 7.91 4.79 0.00 3.04 3.15 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 H 8.38 4.87 0.00 3.11 3.04 0.00 5.81 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 -1 H 8.39 3.90 0.00 3.70 3.37 0.00 5.84 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 *432 I 7.40 4.17 1.87 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 1.41 1.36 0.89 0.00 0.00 433 K 8.12 4.57 0.00 1.82 1.77 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.67 7.81 434 P 0.00 4.37 0.00 2.19 2.04 0.00 3.62 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 435 G 8.12 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 0.00 0.00 0.00 436 A 8.22 5.08 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 437 L 7.86 5.48 0.00 1.84 1.81 0.63 1.22 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 0.00 438 C 9.13 5.26 0.00 3.31 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 0.00 439 V 8.55 4.78 2.02 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 0.91 0.00 0.00 0.70 0.00 0.00 440 I 8.56 4.80 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.66 0.88 0.00 0.00 441 D 9.49 5.27 0.00 2.71 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 442 T 8.90 5.05 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 0.00 443 P 0.00 4.26 0.00 2.07 2.17 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 444 E 7.87 4.14 0.00 2.04 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 2.35 2.30 0.00 445 G 6.30 3.93 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 0.00 0.00 0.00 446 K 8.22 5.11 0.00 1.62 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.41 7.81 447 G 8.88 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 0.00 0.00 0.00 0.00 448 T 9.05 5.08 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 449 G 9.16 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 450 F 8.20 5.42 0.00 3.12 3.04 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 0.00 451 F 9.01 4.97 0.00 3.07 3.01 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 0.00 0.00 0.00 452 S 9.23 5.00 0.00 4.21 4.02 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 0.00 453 G 8.44 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 0.00 454 N 8.84 4.73 0.00 2.83 2.82 0.00 0.00 6.79 8.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 455 D 8.27 5.53 0.00 3.07 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 0.00 456 I 9.02 4.64 1.70 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 0.72 0.61 0.53 0.00 0.00 457 V 7.89 4.22 0.67 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 0.23 0.00 0.00 0.62 0.00 0.00 458 T 7.61 4.80 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 1.03 0.00 0.00 459 A 8.40 4.40 1.21 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 0.00 0.00 460 A 8.48 3.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 461 H 8.01 4.27 0.00 3.30 3.42 0.00 5.54 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 462 V 7.13 3.63 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.78 0.00 0.00 463 V 7.73 3.72 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.84 0.00 0.00 464 G 8.58 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 0.00 0.00 0.00 465 N 8.76 4.70 0.00 2.72 2.86 0.00 0.00 6.78 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 466 N 7.69 4.52 0.00 2.78 2.99 0.00 0.00 6.88 8.56 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 0.00 467 T 8.57 4.35 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 1.25 0.00 0.00 468 F 8.26 5.27 0.00 2.87 2.98 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 0.00 469 V 8.95 4.68 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.92 0.00 0.00 470 N 8.98 5.20 0.00 2.82 2.77 0.00 0.00 6.67 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 471 V 9.20 4.85 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 0.00 1.02 0.00 0.00 0.95 0.00 0.00 472 C 9.35 5.34 0.00 3.01 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 Y 9.10 5.05 0.00 3.32 3.01 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 0.00 0.00 0.00 474 E 9.67 3.34 0.00 1.96 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.89 0.00 475 G 8.59 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 0.00 476 L 7.86 4.66 0.00 1.72 1.51 0.72 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 477 M 8.50 5.07 0.00 1.96 1.94 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 2.55 2.57 0.00 478 Y 9.47 4.89 0.00 2.82 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 0.00 479 E 8.93 5.19 0.00 1.94 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 2.44 2.35 0.00 480 A 9.18 4.86 1.27 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 0.00 0.00 0.00 481 K 8.43 3.87 0.00 1.51 1.48 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.69 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.07 0.26 7.81 482 V 8.05 3.84 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 0.76 0.00 0.00 0.92 0.00 0.00 483 R 9.19 4.32 0.00 1.83 2.15 0.00 3.33 0.00 0.00 3.18 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 484 Y 7.74 4.99 0.00 2.96 2.76 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 0.00 485 M 8.39 4.58 0.00 1.86 1.86 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 486 P 0.00 4.23 0.00 2.11 1.84 0.00 3.70 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 487 E 8.63 4.00 0.00 1.95 2.02 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 2.28 2.33 0.00 488 K 7.85 4.03 0.00 1.79 1.73 0.00 2.08 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.50 7.81 489 D 8.41 4.76 0.00 2.58 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 0.00 490 I 7.44 4.94 1.66 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 1.17 0.53 0.23 0.00 0.00 491 A 8.41 4.53 0.99 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 0.00 0.00 492 F 8.89 4.98 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 0.00 493 I 8.66 4.83 1.88 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 1.14 0.95 0.93 0.00 0.00 494 T 8.48 4.29 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 495 C 8.71 4.27 0.00 3.10 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 0.00 496 P 0.00 4.38 0.00 2.02 2.05 0.00 3.54 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.14 0.00 497 G 8.80 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 0.00 498 D 8.02 4.47 0.00 2.89 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 499 L 7.31 3.97 0.00 0.27 1.35 0.56 0.64 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 0.00 500 H 8.14 4.69 0.00 3.13 3.15 0.00 5.77 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 501 P 0.00 3.87 0.00 1.57 0.49 0.00 3.48 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.06 0.00 502 T 8.53 4.13 4.31 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 1.31 0.00 0.00 503 A 7.39 4.70 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 0.00 504 R 8.25 5.22 0.00 1.71 1.91 0.00 3.22 0.00 0.00 3.40 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 505 L 9.24 4.73 0.00 1.69 1.65 0.63 0.87 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 0.00 506 K 8.54 4.64 0.00 1.72 1.71 0.00 1.64 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.47 7.81 507 L 8.31 4.78 0.00 1.65 1.66 1.18 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 508 S 8.30 4.46 0.00 3.91 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 0.00 509 K 8.72 4.14 0.00 1.77 1.83 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 510 N 7.60 4.84 0.00 2.66 2.73 0.00 0.00 6.93 8.02 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 0.00 511 P 0.00 4.04 0.00 1.42 1.57 0.00 3.68 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 512 D 8.23 4.57 0.00 2.55 2.50 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 0.00 513 Y 8.32 4.46 0.00 3.02 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 0.00 514 S 8.50 4.52 0.00 3.93 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 0.00 515 C 7.79 5.25 0.00 2.95 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 0.00 516 V 9.02 4.71 1.91 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 0.75 0.00 0.00 0.79 0.00 0.00 517 T 8.82 5.01 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 1.16 0.00 0.00 518 V 8.90 4.67 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 0.90 0.00 0.00 0.57 0.00 0.00 519 M 8.18 5.30 0.00 1.75 1.81 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 2.42 2.38 0.00 520 A 8.44 4.61 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 0.00 521 Y 8.33 4.95 0.00 2.99 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 0.00 522 V 9.12 4.32 2.13 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 1.04 0.00 0.00 0.96 0.00 0.00 523 N 8.52 4.05 0.00 2.92 1.90 0.00 0.00 7.17 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 0.00 524 E 9.17 4.30 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 M 8.56 4.70 0.00 1.80 1.90 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 551 S 8.07 4.44 0.00 3.91 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 0.00 552 G 9.49 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 553 A 7.92 4.17 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 0.00 554 P 0.00 4.28 0.00 1.52 0.49 0.00 3.86 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.66 0.00 555 V 8.67 4.29 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 0.40 0.00 0.00 0.73 0.00 0.00 556 C 8.90 5.13 0.00 2.84 2.71 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 0.00 0.00 0.00 0.00 557 D 8.74 4.65 0.00 2.74 2.71 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 0.00 0.00 0.00 0.00 558 K 8.21 3.56 0.00 1.52 1.62 0.00 1.09 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.11 0.44 7.81 559 Y 8.23 4.63 0.00 3.12 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 *560 C 8.29 3.86 0.00 2.90 3.07 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 0.00 561 R 7.87 4.52 0.00 1.95 1.93 0.00 3.27 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.58 0.00 562 V 8.38 4.08 1.87 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 0.89 0.00 0.00 0.77 0.00 0.00 563 L 9.21 4.66 0.00 1.73 1.94 0.89 0.03 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 0.00 564 A 7.60 4.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 565 V 8.43 4.78 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.08 0.00 0.00 566 H 9.56 4.50 0.00 3.42 3.31 0.00 5.80 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 567 Q 9.15 4.46 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.44 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 568 T 7.28 4.82 4.18 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 1.13 0.00 0.00 569 N 8.57 5.49 0.00 2.86 2.74 0.00 0.00 5.80 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 0.00 570 T 8.65 4.37 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 1.15 0.00 0.00 571 G 8.06 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 0.00 0.00 0.00 572 Y 8.60 4.48 0.00 3.04 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 T 7.90 4.82 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 1.14 0.00 0.00 574 G 9.26 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 0.00 0.00 0.00 0.00 575 G 8.63 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 0.00 0.00 0.00 0.00 576 A 9.15 5.32 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 0.00 0.00 0.00 0.00 0.00 0.00 577 V 8.20 4.67 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.94 0.00 0.00 578 I 8.63 4.40 1.97 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.59 1.02 0.00 0.00 579 I 8.61 4.95 2.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.04 1.12 0.00 0.00 580 D 9.77 5.12 0.00 2.94 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 0.00 581 P 0.00 4.28 0.00 2.22 2.13 0.00 3.67 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 582 T 8.26 4.15 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 1.29 0.00 0.00 583 D 8.50 4.69 0.00 3.05 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 0.00 584 F 8.08 2.78 0.00 2.85 2.62 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 0.00 585 H 7.63 4.41 0.00 2.98 2.93 0.00 5.70 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 586 P 0.00 4.43 0.00 2.12 2.00 0.00 3.35 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.59 0.00 * Residues marked with a * may have inaccurate shift predictions.