NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 394 S 4.3798 8.3349 115.2985 58.1988 64.2538 174.7691 395 W 4.2820 7.9992 118.0752 57.3130 30.1336 172.8377 396 E 4.6474 9.2619 121.7157 56.7947 29.7729 176.0551 397 I 4.6143 8.9090 125.4295 59.3991 39.9837 175.2367 398 D 4.6163 8.7473 125.0874 53.0513 41.2917 175.2871 399 P 4.4324 0.0000 0.0000 65.4008 31.6459 178.8973 400 K 4.0731 8.6766 117.5010 59.2494 32.1332 177.2870 401 D 4.8494 8.6202 117.9942 54.0302 40.8301 175.2762 402 L 4.9763 7.7449 119.9428 53.2874 43.3522 175.9406 403 T 4.5599 8.3664 119.8958 61.5338 71.1373 173.4521 404 F 4.2082 9.0253 126.2755 57.5550 38.9136 175.1192 405 L 4.7052 8.6494 124.4010 55.7878 43.8956 177.3064 406 K 4.4807 7.6953 116.1993 56.3387 35.2703 175.4242 407 E 4.3062 9.0964 121.5767 57.2887 29.9882 174.4030 408 L 4.2980 9.3383 124.1049 55.7845 42.9193 177.7028 *411 G 3.9088 7.5613 107.6636 45.4379 0.0000 173.2794 412 Q 3.8246 8.6653 117.2689 58.3273 28.7477 176.9437 413 F 4.5708 8.0644 115.9996 56.8950 39.7460 177.4132 414 G 3.6737 8.0320 109.0771 44.9025 0.0000 174.3509 415 V 4.1597 8.1643 121.9613 61.9861 32.1715 176.3638 416 V 5.1149 8.2481 127.0766 59.7211 34.7291 174.6681 417 K 5.1085 8.9129 122.6357 54.5161 36.3908 174.7235 418 Y 4.5604 9.3418 125.4236 57.6970 40.1103 174.8208 419 G 3.8363 8.3026 112.5197 44.8337 0.0000 170.6909 420 K 5.0420 8.5973 118.5115 54.0769 35.5218 175.5068 421 W 5.1782 9.3329 134.9163 56.0848 33.1847 175.7960 422 R 3.6069 9.9665 126.8042 57.1677 27.7162 178.8639 423 G 3.9647 8.3392 104.7043 46.1305 0.0000 175.0087 424 Q 4.0610 7.4593 116.7866 56.9897 30.3802 175.3812 425 Y 4.8345 7.3384 116.2034 56.3072 39.6960 175.2256 426 D 5.0535 9.0497 124.8878 54.6894 41.7395 176.1256 427 V 4.8640 8.8060 114.9947 59.7151 36.8068 174.0009 428 A 5.1304 8.7797 124.0465 50.4251 21.8448 176.0322 429 I 4.7458 8.7923 122.1967 59.4430 40.3920 174.4276 430 K 5.2398 9.5001 129.7483 54.9999 34.1881 174.9629 431 M 5.4777 8.7071 123.2398 53.1662 34.6700 174.9134 432 I 3.1934 7.7999 121.8307 61.2977 38.9094 176.0214 433 K 4.1216 8.4278 127.8652 56.2895 32.8070 175.8120 *437 M 4.5027 7.6653 117.5182 54.9762 33.2248 175.5401 438 S 4.5943 9.5280 121.1773 57.4712 65.9477 175.2553 439 E 4.0232 8.6401 121.9244 59.7218 29.1943 179.3189 440 D 4.4030 8.1286 118.5449 57.5435 40.9417 178.6775 441 E 4.0604 8.2245 117.7168 58.9879 29.6914 178.8427 442 F 4.2498 8.4248 121.9164 61.3438 39.5177 177.1259 443 I 3.7184 8.0117 119.7266 64.3578 36.9371 178.3039 444 E 3.9724 8.3010 118.4593 59.1975 29.3775 179.0202 445 E 3.5867 8.2404 119.5279 59.0951 29.3841 178.9796 446 A 3.8185 7.7213 120.5835 55.2522 18.1622 179.8599 447 K 3.7831 7.7516 115.6668 59.3064 32.3397 179.4218 448 V 3.6611 7.6971 118.5600 66.3605 31.5484 177.9643 449 M 3.8632 7.7952 118.2375 58.6643 31.5266 178.6623 450 M 3.2160 7.7483 117.7334 57.1845 32.0190 177.4553 451 N 4.9197 7.6665 114.2068 51.8575 39.5873 174.3955 452 L 4.9901 7.2011 119.8086 53.0537 45.0963 176.3303 453 S 4.4397 9.1084 116.7965 57.6247 65.7655 172.9377 454 H 4.4248 8.2772 125.5197 54.5213 32.4207 173.7125 455 E 3.9308 8.3380 124.1081 58.8963 29.5856 178.3083 456 K 4.5289 8.2686 115.7004 55.8814 32.8032 174.6363 457 L 5.0912 7.4026 119.1987 52.7890 43.1594 176.8282 458 V 3.6278 8.2184 123.4352 63.7573 32.1824 175.1344 459 Q 4.2503 9.0792 129.7624 55.0772 29.9814 174.6897 460 L 4.1890 8.5413 129.4997 55.8953 42.0666 175.8977 461 Y 4.8929 9.4561 124.3744 58.1733 39.7484 175.7905 462 G 4.2221 7.0505 103.5365 46.7752 0.0000 171.6643 463 V 5.1162 7.9962 111.5310 59.8986 36.8513 174.9844 464 C 5.3325 9.3181 120.0154 58.5625 30.5975 174.7552 465 T 4.6037 9.1370 114.3612 61.5389 69.7519 175.2529 466 K 4.3494 8.2233 124.9347 55.5980 32.0735 181.4045 467 Q 4.6275 7.4677 115.5490 55.0107 31.9547 178.3494 468 R 4.6349 8.1696 112.8685 55.2807 32.8992 174.2741 469 P 4.3847 0.0000 0.0000 61.9677 32.4632 175.8357 470 I 4.0598 7.8747 120.9085 61.4613 37.7476 175.3994 471 F 5.7467 9.0385 124.9675 55.9216 42.6992 174.1430 472 I 4.7418 8.9378 122.6622 59.5986 39.9038 174.5530 473 I 4.8705 8.7284 127.8536 59.6751 39.8581 174.8899 474 T 4.6876 8.3844 116.3792 58.7325 72.6417 172.8602 475 E 3.7249 7.5515 119.8984 56.9378 29.9656 176.1761 476 Y 4.4100 8.5973 123.2942 57.7384 40.1250 174.7214 477 M 4.1127 8.1022 126.4530 53.5171 32.1783 176.6767 478 A 3.2384 8.0851 127.7007 54.3183 18.7975 177.8146 479 N 4.5465 7.8091 111.3861 52.5196 39.4617 177.3680 480 G 3.7268 7.4782 107.9183 45.5765 0.0000 173.0281 481 C 4.8115 8.3326 114.9497 58.0560 31.7816 174.2799 482 L 4.0786 9.0499 125.3230 58.2123 41.6236 179.2212 483 L 4.0425 8.0301 119.8414 58.5161 42.0989 178.6998 484 N 4.4477 8.2513 115.7999 56.2753 38.5378 176.7298 485 Y 4.1623 8.0302 120.8733 60.5840 38.6838 177.7791 486 L 4.2801 8.2740 119.3898 58.0582 41.6756 179.5147 487 R 4.0708 7.8634 118.0715 59.1893 29.8058 178.6837 488 E 3.9247 8.4277 118.5035 58.7727 29.7948 177.8459 489 M 4.0786 7.4707 116.4482 54.5583 31.9766 177.6855 490 R 4.0348 7.2408 117.9359 59.8029 29.3840 177.7936 491 H 4.4144 7.8365 113.3465 57.2483 29.0716 175.9581 492 R 4.3310 7.6168 117.6416 56.8991 31.5383 177.1241 493 F 4.5504 7.6175 115.1114 57.9808 39.6173 174.4113 494 Q 4.7933 9.0349 122.7325 54.1633 31.2789 177.1900 495 T 3.8664 8.3620 110.7183 64.9101 68.7087 176.3142 496 Q 4.0010 8.1596 122.0256 59.2966 29.0138 178.2677 497 Q 4.1926 7.9602 118.5046 59.0149 28.8858 178.8310 498 L 3.5468 7.6624 119.3850 57.5944 41.4911 179.1913 499 L 4.1433 7.9548 120.1603 58.2695 42.0482 178.8909 500 E 4.0108 8.3921 118.5918 59.6069 29.3956 179.1754 501 M 4.1353 8.0540 118.8120 58.6026 31.9660 178.6295 502 C 4.3128 8.0599 116.3997 62.6678 28.3649 175.9958 503 K 4.0263 8.3953 121.4665 59.6047 31.7462 178.2814 504 D 4.4198 8.6368 119.4937 57.7734 40.8289 179.3142 505 V 3.7125 7.8338 117.9594 66.0124 31.4796 177.6028 506 C 3.7266 8.5453 118.7554 62.2288 31.4578 175.4198 507 E 3.9190 8.3767 120.0778 59.2112 28.9785 179.0848 508 A 3.8211 7.7110 120.3777 55.5655 18.4770 179.7015 509 M 3.5792 7.8451 117.1504 58.0252 31.8028 178.5483 510 E 3.9694 8.0204 119.7333 59.3356 29.6338 178.2981 511 Y 4.0339 7.8013 119.1149 60.8201 38.9444 178.0329 512 L 3.9612 8.1117 120.0642 57.6413 41.8019 178.9543 513 E 4.0067 8.5828 119.9773 59.4537 29.3766 178.9579 514 S 4.3330 7.7755 111.9641 59.9911 63.1754 174.8329 515 K 4.3366 7.0268 119.0260 55.4373 32.3389 175.7937 516 Q 3.4550 7.5966 116.3241 57.0803 26.6357 173.4209 517 F 4.9074 8.0610 114.9692 55.6972 41.2931 175.5535 518 L 4.9454 8.8799 124.6111 53.3273 43.7760 177.3649 519 H 3.9371 9.8599 126.3459 59.5285 29.9442 178.9239 520 R 4.2514 8.4770 113.5494 56.9741 29.2212 177.2695 521 D 4.8113 7.9921 113.8187 53.5340 41.0751 175.7821 522 L 3.9353 7.9408 121.1582 55.1218 42.8874 175.2070 523 A 4.5489 7.9680 126.4639 51.2135 21.9888 176.5243 524 A 4.1324 9.4863 123.9366 55.2111 18.5951 180.6686 525 R 4.0220 8.0350 111.1562 58.7235 29.3789 176.9987 526 N 4.6131 8.0144 113.7337 53.0393 39.2676 174.0601 527 C 5.0419 7.9856 116.6471 58.3645 30.9399 172.7572 528 L 5.1332 8.6956 120.7222 52.9574 45.3685 175.6086 529 V 4.7509 8.2358 120.4513 61.1695 34.8971 175.2154 530 N 4.9027 8.5464 125.6982 51.3342 39.5169 175.4658 531 D 4.3990 8.6177 117.3692 55.6162 39.4226 176.9143 532 Q 4.1758 8.1620 117.5288 55.8711 29.1405 176.5115 533 G 3.8711 8.1623 106.5630 45.2744 0.0000 173.8698 534 V 3.8995 8.1433 120.9225 62.3415 32.1477 174.8078 535 V 4.7388 8.6382 127.5558 61.8254 32.6720 175.0628 536 K 4.9143 8.9193 125.3812 54.8346 37.0230 175.2071 537 V 4.6833 8.4135 121.3896 61.2219 34.3612 174.6353 538 S 4.7694 8.7742 120.8176 57.6187 63.1756 173.2965 539 D 4.7255 8.5637 124.7460 52.9095 39.5840 175.5371 540 F 4.2003 8.0518 122.5455 58.9253 39.9383 175.5703 541 G 3.6590 8.4749 116.2083 46.3594 0.0000 173.7245 542 L 4.2892 7.5868 118.6232 53.9969 42.8157 176.3222 543 S 4.8297 8.8328 115.8737 57.1127 65.1931 174.9985 544 R 4.2066 8.4111 125.2296 56.7103 30.3834 176.2452 *559 F 4.4300 7.9710 114.5933 54.8341 38.3803 175.0856 560 P 4.4372 0.0000 0.0000 62.1847 30.9926 177.6131 561 V 3.5767 8.7442 124.6042 66.0593 31.4897 178.0748 562 R 4.0292 8.2762 116.0731 57.5786 30.1646 176.9489 563 W 4.8430 8.5500 116.3012 56.2963 29.7129 175.3188 564 S 4.7330 7.6075 115.4164 55.8743 64.4047 173.0959 565 P 2.9700 0.0000 0.0000 60.9782 33.1477 175.6889 566 P 3.8783 0.0000 0.0000 65.5444 31.1208 178.7763 567 E 3.9756 7.7566 115.7878 58.8998 29.6398 179.3064 568 V 2.9887 7.2410 119.0307 65.7382 31.5128 177.4358 569 L 3.7466 7.1939 117.3936 58.0893 41.5657 178.9500 570 M 3.9708 7.5270 116.3334 56.1228 32.5232 176.4740 571 Y 4.7933 6.9953 112.2464 56.4282 40.1295 175.1454 572 S 3.4393 7.8364 114.8083 59.2545 61.1239 173.6770 573 K 4.2808 7.6735 121.4687 55.3089 30.5947 174.5968 574 F 4.5184 8.2609 121.7292 56.4740 40.4043 175.2640 575 S 4.6648 8.9746 117.9913 56.5226 66.0811 175.0839 576 S 4.3122 8.9628 115.4231 62.2897 62.3164 177.1021 577 K 4.1554 8.3525 120.7793 58.9044 31.7469 179.3837 578 S 4.4216 8.1195 114.8056 61.2202 63.1343 176.2550 579 D 4.7263 8.3631 122.1519 57.2092 40.7790 178.4597 580 I 3.4891 8.1765 120.6024 64.0169 37.1774 178.1815 581 W 4.6901 8.6079 129.8745 60.1278 30.5130 177.9134 582 A 4.6396 8.5298 120.3909 55.3255 17.8248 179.2787 583 F 4.3819 9.1480 119.7070 61.3605 39.4123 177.4336 584 G 3.4579 8.2780 105.1577 47.9211 0.0000 175.7220 585 V 3.8365 8.1515 120.6908 65.5348 31.4327 177.7411 586 L 4.4149 8.6132 120.4299 58.6168 41.8699 178.6436 587 M 4.0199 8.1359 118.9928 58.3633 31.9166 178.5899 588 W 4.1945 8.5771 128.3370 60.5536 30.9034 177.8443 589 E 4.1254 9.0149 119.0208 59.4867 29.0072 179.4236 590 I 3.5671 8.1548 120.0742 64.7246 37.0380 178.1971 591 Y 3.8223 8.1932 115.7415 59.9581 37.5155 177.4316 592 S 4.2631 7.6001 115.0935 56.7730 63.0545 173.9615 593 L 3.2185 8.5604 120.4975 55.8251 39.4682 175.3949 594 G 3.9772 8.5781 103.5404 45.6153 0.0000 174.6946 595 K 4.2745 7.2450 117.8232 55.8422 32.6423 176.3984 596 M 4.4697 8.5289 121.1253 54.2333 32.8345 174.3974 597 P 3.1353 0.0000 0.0000 63.6393 32.0813 175.3877 598 Y 3.4801 7.2151 116.6491 58.5186 35.3854 171.8365 599 E 3.8679 8.5431 121.7676 59.5151 29.7594 177.8514 600 R 3.7374 7.8146 117.1270 58.1651 30.1008 175.9463 601 F 5.3380 7.7863 115.5599 55.1901 41.7794 175.9315 602 T 4.1559 8.5563 113.9617 61.4265 70.5837 175.1891 603 N 4.2336 8.7963 120.0708 56.9040 38.5935 177.2922 604 S 3.9986 8.0310 113.3862 61.6764 62.4544 176.0181 605 E 3.8841 8.3294 121.0802 59.2997 29.0989 179.4148 606 T 3.3242 8.5693 116.4556 66.3929 67.9994 176.1118 607 A 3.7478 8.1160 122.8316 55.3619 18.1917 179.2291 608 E 3.7500 7.9951 116.6333 60.2313 29.5150 179.5975 609 H 3.9398 8.2050 116.1164 58.5792 28.5563 178.1402 610 I 3.5591 7.5762 121.7248 64.1988 36.6639 178.2586 611 A 3.8907 7.2414 119.7191 55.0386 18.2805 179.0277 612 Q 4.1764 7.4048 114.2929 56.7742 28.8076 177.0160 613 G 3.9871 7.8919 108.9480 45.1168 0.0000 173.4967 614 L 4.0740 7.8862 121.7770 54.8622 42.4651 176.6464 615 R 4.5096 8.2079 123.7204 53.6418 33.4832 175.3854 616 L 3.4699 7.4739 120.7632 55.1464 41.8527 177.1462 617 Y 4.8797 8.2367 121.0480 57.2239 38.7545 175.3766 618 R 3.5769 8.0889 122.4442 55.8034 30.5122 174.8778 619 P 4.2973 0.0000 0.0000 62.6479 32.1543 176.5751 620 H 3.9766 8.9248 121.9640 59.6086 29.6069 176.1042 621 L 4.1508 7.8088 114.8893 55.3480 42.0196 176.4631 622 A 4.1569 7.7242 123.3974 50.7629 19.2417 178.2077 623 S 4.3464 8.3765 118.4174 58.1396 65.1133 175.1703 624 E 3.9775 8.6165 121.5350 59.4661 29.0013 179.6808 625 K 3.8719 8.0003 117.9572 59.6060 32.3252 179.3195 626 V 3.5503 7.6334 118.2681 66.0588 31.4000 177.3509 627 Y 4.0735 8.0653 119.2972 61.0217 38.6361 177.9741 628 T 3.7716 8.1063 116.7668 66.7234 68.2640 176.5728 629 I 3.5745 6.9135 119.4163 64.4943 37.6651 177.9817 630 M 3.6651 7.4497 117.4459 58.3969 30.8703 177.8454 631 Y 2.9431 7.5476 121.0633 59.8297 38.7743 178.1611 632 S 4.0517 7.6948 115.0201 61.4074 62.7911 176.0689 633 C 4.2724 7.3833 119.2265 60.9402 27.4187 174.7119 634 W 4.1439 6.7152 119.5389 56.0307 28.9998 175.5378 635 H 4.1946 8.1366 115.9045 55.9717 28.7040 174.7111 636 E 4.1748 9.3142 125.6906 59.3134 29.6005 177.3746 637 K 4.2395 8.0936 119.2900 55.4404 32.7233 177.4358 638 A 4.1018 8.9342 128.2013 55.3376 18.4034 178.7648 639 D 4.5124 8.0362 113.0138 55.3948 39.6727 176.6801 640 E 4.2788 7.9845 118.4314 56.6462 29.9962 176.6863 641 R 4.5151 7.9038 118.2945 54.0378 30.8839 174.6399 642 P 4.4178 0.0000 0.0000 62.6977 32.2045 176.3762 643 T 4.2758 7.9244 109.7369 60.7251 71.5248 175.6775 644 F 3.9166 8.9501 120.0542 60.1581 38.7605 178.0770 645 K 4.0744 7.6726 119.5303 59.6129 31.9816 178.9556 646 I 3.6933 7.7039 120.0049 64.2579 36.9901 178.1554 647 L 3.9430 8.0282 120.1170 57.9145 41.5295 179.3791 648 L 3.9734 8.0522 119.9202 58.2004 41.9287 178.6961 649 S 4.0929 7.9868 112.9095 61.7858 62.3003 176.0770 650 N 4.3489 8.4036 119.0439 56.2626 38.2367 177.5944 651 I 3.7758 8.2557 121.6730 64.4429 37.0335 178.4608 652 L 4.0358 8.2579 118.9082 57.7871 41.5715 178.8309 653 D 4.4567 8.4236 118.2917 57.4369 41.0103 178.5558 654 V 3.6757 7.7654 117.3842 65.9831 31.5492 177.6299 655 M 4.3012 7.9209 118.1198 57.2537 31.7911 175.9394 656 D 4.4631 7.8116 122.8080 53.3607 39.7681 175.2241 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 394 S 8.33 4.38 0.00 3.85 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 395 W 8.00 4.28 0.00 3.43 3.19 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 0.00 396 E 9.26 4.65 0.00 1.92 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 2.41 2.36 0.00 397 I 8.91 4.61 1.92 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.51 0.85 0.00 0.00 398 D 8.75 4.62 0.00 2.78 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 0.00 399 P 0.00 4.43 0.00 2.40 2.44 0.00 3.76 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 400 K 8.68 4.07 0.00 1.92 1.95 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.54 1.54 7.81 401 D 8.62 4.85 0.00 3.09 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 0.00 402 L 7.74 4.98 0.00 1.42 1.06 0.73 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 403 T 8.37 4.56 4.14 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 0.00 0.00 0.00 1.19 0.00 0.00 404 F 9.03 4.21 0.00 2.86 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 0.00 405 L 8.65 4.71 0.00 1.21 1.77 0.72 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 406 K 7.70 4.48 0.00 1.84 1.93 0.00 1.53 0.00 0.00 1.86 0.00 0.00 2.53 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.59 1.53 7.81 407 E 9.10 4.31 0.00 1.78 1.78 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 2.23 1.91 0.00 408 L 9.34 4.30 0.00 1.66 1.79 1.14 0.98 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 *411 G 7.56 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 0.00 412 Q 8.67 3.82 0.00 1.84 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.04 0.00 0.00 0.00 0.00 0.00 1.16 1.98 0.00 413 F 8.06 4.57 0.00 3.07 3.05 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 0.00 414 G 8.03 3.67 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 0.00 0.00 0.00 415 V 8.16 4.16 2.29 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 1.01 0.00 0.00 0.92 0.00 0.00 416 V 8.25 5.11 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 0.83 0.00 0.00 0.95 0.00 0.00 417 K 8.91 5.11 0.00 1.85 1.95 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 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0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.69 0.00 438 S 9.53 4.59 0.00 4.06 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 439 E 8.64 4.02 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 440 D 8.13 4.40 0.00 2.73 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 441 E 8.22 4.06 0.00 2.22 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 2.60 2.37 0.00 442 F 8.42 4.25 0.00 3.29 3.32 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 0.00 443 I 8.01 3.72 2.06 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 1.63 0.94 0.92 0.00 0.00 444 E 8.30 3.97 0.00 2.16 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 0.00 2.34 2.27 0.00 445 E 8.24 3.59 0.00 1.81 1.22 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 0.00 0.00 0.00 1.31 0.89 1.20 0.00 0.00 471 F 9.04 5.75 0.00 3.03 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 0.00 472 I 8.94 4.74 1.81 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.75 0.79 0.00 0.00 473 I 8.73 4.87 1.62 0.00 0.00 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 1.20 1.05 0.65 0.00 0.00 474 T 8.38 4.69 4.09 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 1.06 0.00 0.00 475 E 7.55 3.72 0.00 1.95 1.74 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 2.18 2.13 0.00 476 Y 8.60 4.41 0.00 3.01 3.05 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 0.00 477 M 8.10 4.11 0.00 1.84 1.66 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 2.40 2.27 0.00 478 A 8.09 3.24 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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8.36 3.87 4.34 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 1.31 0.00 0.00 496 Q 8.16 4.00 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 497 Q 7.96 4.19 0.00 2.43 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 498 L 7.66 3.55 0.00 1.13 0.51 0.44 -0.26 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 0.00 499 L 7.95 4.14 0.00 2.03 1.89 1.07 0.87 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 0.00 500 E 8.39 4.01 0.00 2.22 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 2.36 2.51 0.00 501 M 8.05 4.14 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.60 0.00 502 C 8.06 4.31 0.00 3.34 3.20 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 0.00 503 K 8.40 4.03 0.00 1.89 2.05 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 *559 F 7.97 4.43 0.00 2.37 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 0.00 0.00 0.00 0.00 560 P 0.00 4.44 0.00 2.45 2.27 0.00 3.82 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 561 V 8.74 3.58 2.11 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 0.95 0.00 0.00 0.92 0.00 0.00 562 R 8.28 4.03 0.00 1.45 1.53 0.00 3.38 0.00 0.00 3.43 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 563 W 8.55 4.84 0.00 3.50 3.27 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 0.00 564 S 7.61 4.73 0.00 3.69 3.57 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 0.00 565 P 0.00 2.97 0.00 2.11 1.66 0.00 3.47 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.99 0.00 566 P 0.00 3.88 0.00 1.98 1.92 0.00 2.98 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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8.97 4.66 0.00 4.02 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 0.00 576 S 8.96 4.31 0.00 3.96 4.10 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 0.00 0.00 0.00 0.00 577 K 8.35 4.16 0.00 1.85 1.94 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.63 7.81 578 S 8.12 4.42 0.00 4.15 4.12 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 0.00 579 D 8.36 4.73 0.00 3.25 3.23 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 0.00 580 I 8.18 3.49 2.09 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.30 0.80 0.00 0.00 581 W 8.61 4.69 0.00 3.64 3.36 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 0.00 582 A 8.53 4.64 1.81 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 0.00 0.00 583 F 9.15 4.38 0.00 3.71 3.53 0.00 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0.00 0.00 2.28 2.35 0.00 600 R 7.81 3.74 0.00 1.37 0.75 0.00 2.85 0.00 0.00 2.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.34 0.00 601 F 7.79 5.34 0.00 3.12 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 0.00 602 T 8.56 4.16 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 1.27 0.00 0.00 603 N 8.80 4.23 0.00 2.83 2.94 0.00 0.00 6.49 7.57 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 0.00 604 S 8.03 4.00 0.00 3.85 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 0.00 605 E 8.33 3.88 0.00 2.17 1.81 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 2.34 2.35 0.00 606 T 8.57 3.32 4.21 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 0.45 0.00 0.00 607 A 8.12 3.75 1.19 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 0.00 0.00 0.00 608 E 8.00 3.75 0.00 1.99 1.81 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 2.43 2.39 0.00 609 H 8.21 3.94 0.00 2.60 3.02 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 610 I 7.58 3.56 1.68 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.19 0.71 0.00 0.00 611 A 7.24 3.89 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 0.00 612 Q 7.40 4.18 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.91 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 613 G 7.89 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 L 7.89 4.07 0.00 1.56 1.52 0.91 1.01 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 0.00 615 R 8.21 4.51 0.00 2.07 1.83 0.00 3.09 0.00 0.00 3.06 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.33 0.00 616 L 7.47 3.47 0.00 0.83 0.68 -0.43 -1.40 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 0.00 617 Y 8.24 4.88 0.00 3.05 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 0.00 618 R 8.09 3.58 0.00 0.67 1.40 0.00 3.45 0.00 0.00 2.91 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.39 0.00 619 P 0.00 4.30 0.00 2.14 1.64 0.00 3.77 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.19 0.00 620 H 8.92 3.98 0.00 3.04 3.35 0.00 5.74 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 621 L 7.81 4.15 0.00 1.91 1.75 0.91 0.71 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 0.00 622 A 7.72 4.16 1.02 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 0.00 0.00 623 S 8.38 4.35 0.00 4.04 4.01 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 0.00 624 E 8.62 3.98 0.00 1.98 2.04 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 2.36 2.32 0.00 625 K 8.00 3.87 0.00 1.78 1.84 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.49 7.81 626 V 7.63 3.55 1.77 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 0.24 0.00 0.00 0.86 0.00 0.00 627 Y 8.07 4.07 0.00 3.07 3.05 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 0.00 628 T 8.11 3.77 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 1.15 0.00 0.00 629 I 6.91 3.57 1.92 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 1.54 0.55 0.90 0.00 0.00 630 M 7.45 3.67 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.38 0.00 631 Y 7.55 2.94 0.00 2.20 2.52 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 0.00 632 S 7.69 4.05 0.00 4.07 4.14 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 0.00 0.00 0.00 0.00 633 C 7.38 4.27 0.00 2.29 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 0.00 634 W 6.72 4.14 0.00 2.58 1.74 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 0.00 635 H 8.14 4.19 0.00 3.17 3.40 0.00 5.93 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 0.00 636 E 9.31 4.17 0.00 2.00 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 0.00 2.35 2.48 0.00 637 K 8.09 4.24 0.00 1.90 1.93 0.00 1.76 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.47 7.81 638 A 8.93 4.10 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 0.00 639 D 8.04 4.51 0.00 2.78 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 0.00 640 E 7.98 4.28 0.00 2.02 1.74 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 2.24 2.24 0.00 641 R 7.90 4.52 0.00 1.92 1.85 0.00 3.37 0.00 0.00 3.59 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.70 0.00 642 P 0.00 4.42 0.00 2.08 2.01 0.00 3.79 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 1.85 1.86 0.00 643 T 7.92 4.28 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 644 F 8.95 3.92 0.00 3.25 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 0.00 645 K 7.67 4.07 0.00 1.79 1.83 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.65 7.81 646 I 7.70 3.69 1.96 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 1.52 0.44 0.89 0.00 0.00 647 L 8.03 3.94 0.00 1.75 1.73 0.62 0.81 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 0.00 648 L 8.05 3.97 0.00 1.86 1.86 0.97 0.81 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 0.00 649 S 7.99 4.09 0.00 3.97 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 0.00 650 N 8.40 4.35 0.00 2.93 2.84 0.00 0.00 7.10 7.68 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 0.00 651 I 8.26 3.78 2.08 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.88 1.01 0.00 0.00 652 L 8.26 4.04 0.00 1.77 1.76 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 653 D 8.42 4.46 0.00 2.86 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 0.00 654 V 7.77 3.68 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 0.91 0.00 0.00 0.98 0.00 0.00 655 M 7.92 4.30 0.00 2.08 2.35 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 2.93 2.60 0.00 656 D 7.81 4.46 0.00 2.67 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.