NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 333 N 4.7120 8.4249 119.2149 53.0807 40.4167 175.4921 334 I 4.1209 7.2319 116.5743 61.1590 37.9745 176.1325 335 Y 4.3396 8.4692 119.5645 61.3673 38.3192 177.4259 336 T 3.9812 8.0711 116.1395 66.9953 68.6504 176.2416 337 T 3.9636 8.1157 117.1439 66.9768 68.3660 175.9550 338 L 4.0685 7.7102 120.7539 58.2171 41.8334 179.2119 339 K 4.0656 7.8179 117.7881 59.3011 32.0923 178.8697 340 F 4.0748 8.3975 120.3548 61.2099 39.3818 176.8627 341 E 4.3560 8.3841 117.7264 58.5360 30.7565 178.5288 342 S 4.3782 7.5826 115.0452 57.4992 59.0925 173.8748 *345 Q 4.3064 7.7741 124.2330 55.6719 31.2635 177.8249 346 Q 4.2143 7.8716 117.9581 58.9917 28.9053 178.6860 347 R 3.9171 7.9136 118.9525 59.1430 30.2741 178.8288 348 V 3.6428 7.6891 117.5752 65.9681 31.5452 177.8925 349 I 3.7022 8.3110 120.0641 64.5010 37.0073 178.1862 350 Q 4.0208 8.0381 120.3166 59.0611 28.8025 178.4750 351 I 3.8471 7.9453 121.0306 64.4928 37.0430 178.6206 352 R 4.0819 8.0532 117.3708 58.8223 29.9265 178.4927 353 S 4.5416 7.7638 113.1789 58.3715 63.1920 174.3731 354 I 3.8313 7.1185 123.5789 60.2886 37.2198 174.2812 355 P 4.3309 0.0000 0.0000 62.4385 32.1270 176.7221 356 E 4.1111 9.2560 124.1594 59.6526 28.1902 178.0342 357 E 4.4667 8.2628 113.6600 56.8580 29.7467 177.5673 358 E 4.2989 8.4816 120.8141 58.0936 30.2046 177.0467 359 Y 4.8365 7.7125 114.5665 58.5110 37.8750 175.5919 360 H 4.9293 8.0211 115.3873 55.1217 31.5044 173.1319 361 E 4.7246 7.6630 118.3511 54.8118 31.7103 175.0282 362 L 5.1961 8.4320 122.1176 52.9410 44.2139 176.1815 363 V 4.4549 8.1461 122.2122 59.9524 34.5334 174.7761 364 S 4.8486 8.4619 118.6530 57.9135 63.6092 174.0474 365 V 4.5216 8.5828 123.1142 60.2426 34.6659 173.9219 366 Q 4.7775 8.5530 122.8953 53.6121 32.1828 172.2267 *424 P 4.4798 0.0000 0.0000 62.3823 32.7603 176.3721 425 I 4.1839 7.6643 122.7020 60.5361 39.8075 174.2470 426 Q 5.0053 8.4953 125.7929 54.4123 30.6596 175.4643 427 V 4.4355 7.7852 117.2538 59.1164 35.4874 175.8154 428 S 4.5946 8.8717 118.2294 58.2285 63.6325 176.2827 429 V 3.5418 8.5204 123.4504 65.7418 31.5890 178.3327 430 F 4.7842 7.9502 116.3228 58.6254 37.3586 177.4652 431 V 3.1661 6.7645 119.1420 66.0791 30.9580 177.8986 432 Q 4.0604 7.3575 115.4693 58.8638 28.7171 178.4086 433 S 4.2772 8.0330 115.6347 61.4716 63.0800 176.3766 434 A 4.0271 8.6310 123.7089 55.1723 18.2830 179.2611 435 A 4.1434 8.3004 119.3838 55.6308 18.2633 180.0464 436 K 3.9771 7.9462 116.8625 59.4143 32.2167 179.4246 437 V 3.9982 7.4572 119.6315 65.6078 31.4662 178.1628 438 F 4.5099 7.8467 116.2893 60.2641 38.8615 178.0374 439 T 4.0822 7.9809 115.3630 66.7703 68.3258 176.3504 440 E 3.9627 9.0372 121.6625 59.0129 29.4771 178.7808 441 F 4.1528 8.1230 120.5516 61.2601 39.4240 176.9369 442 E 3.7931 7.9979 116.9615 59.5549 29.2365 179.0805 443 Q 4.1809 8.2450 118.2349 59.3153 28.5871 179.6798 444 G 3.4306 8.0182 105.3051 47.4634 0.0000 175.3884 445 C 4.0565 7.6432 119.1831 62.6857 28.1696 175.6042 446 D 4.3644 8.2884 120.8936 57.5013 40.0523 178.3775 447 T 4.1446 7.0670 112.8630 63.6347 67.8788 174.6750 448 I 4.0186 7.8173 117.7034 61.4774 40.1809 174.6208 449 G 4.0660 7.3698 114.9271 44.2565 0.0000 174.5929 450 R 4.2303 8.8588 114.7301 53.8813 30.6007 174.7432 451 S 3.9780 8.6198 116.9703 60.3502 62.4143 173.4768 452 K 4.3057 7.8746 117.1498 56.4487 32.3546 177.5018 453 V 4.4968 7.4611 116.7109 61.7584 32.3538 176.4775 454 E 3.9907 8.5906 120.2870 59.9217 29.0240 178.7986 455 S 4.4000 8.1771 112.4149 60.3118 63.4861 175.1057 456 I 4.3872 7.2141 112.1820 60.4788 38.6221 176.6245 457 Y 4.2966 8.0856 122.6716 61.2067 38.4637 178.1064 458 L 3.9274 8.1234 120.3089 58.1033 42.2370 178.0177 459 Y 4.0553 7.9916 118.9683 60.8721 38.9077 178.1079 460 K 3.7611 8.1522 119.3651 59.0907 32.2127 179.2572 461 F 3.6121 8.1318 121.0307 61.2785 39.3336 176.9483 462 N 4.0394 8.1753 116.3032 56.0094 38.2803 177.1285 463 L 3.7121 7.7065 121.9921 58.0145 42.0472 178.8619 464 L 3.9907 7.6327 120.2377 58.1844 41.8925 178.9218 465 Q 4.2018 7.7358 117.6575 59.2810 28.5026 178.9751 466 T 3.9213 7.9361 116.5554 66.4104 68.2687 176.6721 467 A 3.9951 8.3483 121.8937 55.1291 18.5400 178.9170 468 F 4.3009 8.3176 117.9738 61.5828 39.7736 176.7885 469 F 4.0883 8.8574 120.1091 61.1402 37.6467 177.2774 470 A 3.7846 8.2154 116.8808 53.4286 18.1059 179.0065 *472 V 3.4847 7.7564 121.0333 63.7106 33.2252 177.7883 473 S 3.8614 7.4252 115.1608 61.2965 62.6051 175.2238 474 E 4.1275 7.1687 116.2398 57.2639 29.6010 177.3401 475 K 3.7921 7.2496 117.2850 56.4872 32.7992 176.4934 476 V 4.0799 7.1671 118.0018 60.9525 31.6177 174.6555 477 N 4.1940 8.8539 125.3553 56.5700 38.7879 175.9572 478 D 4.6200 7.9636 122.7890 52.7025 41.8374 176.2019 479 W 4.5431 8.9944 126.8431 60.0924 27.6903 178.0098 480 T 3.4748 7.4206 110.3476 64.1821 68.2910 176.8630 481 Q 3.9431 7.8630 120.3930 58.6750 28.7979 178.4501 482 L 4.0733 7.8769 120.7794 58.3150 42.1431 178.1527 483 Y 4.5948 7.9730 120.4748 60.2756 38.6629 178.5288 484 K 3.8967 8.1750 119.1544 59.3548 31.9943 179.0654 485 D 4.2464 8.8499 120.3275 57.5788 40.7088 179.2104 486 V 3.7957 8.5251 118.7707 65.6710 31.6117 178.0915 487 R 2.5970 7.5354 118.8971 58.9787 29.7297 177.7315 488 Y 3.8726 8.1752 119.7599 60.4197 38.5524 178.2121 489 L 3.9028 7.5507 120.2932 57.5185 41.7293 178.1971 490 Y 5.2373 6.7713 116.3343 56.8656 38.1260 177.4771 491 T 3.8980 7.1593 118.2769 66.9030 68.8060 176.2053 492 E 4.1302 7.3715 119.5987 57.6649 30.7730 176.1969 493 N 4.8430 7.8266 117.1489 51.1858 39.4237 172.0990 494 P 4.9322 0.0000 0.0000 62.4830 31.3938 178.0962 495 K 4.2810 8.5982 118.5518 58.2043 32.5572 177.9498 496 L 4.3594 7.4452 120.9219 53.3197 40.0851 176.1708 497 L 3.9466 7.6700 120.9496 57.4735 42.7875 178.8273 498 Q 3.9381 8.0586 119.3494 59.2016 29.1169 179.2875 499 L 3.9912 8.0467 115.7330 55.4083 41.4070 179.0470 *501 E 4.1389 8.3714 119.3750 56.5453 31.4877 178.2369 502 L 3.6087 7.9426 118.8133 57.6486 41.3223 179.1415 503 N 4.5769 8.1021 117.3091 56.7833 38.9672 177.0600 504 S 4.3708 8.0719 115.1508 61.7694 63.3067 176.3563 505 R 4.0168 8.2554 122.2638 58.8424 29.8068 179.0760 506 R 3.9498 8.5239 119.0178 59.0550 30.1308 178.0700 507 L 3.9335 8.4217 120.7006 58.4769 42.0791 178.6640 508 D 4.2897 8.4752 118.9634 57.2082 40.6982 178.3960 509 L 3.7895 7.7479 120.6783 58.5892 42.0816 179.0510 510 N 3.9427 7.6339 115.7180 55.7072 38.0550 177.6349 511 L 3.9149 7.7742 120.6217 57.8713 41.7774 179.0895 512 N 4.1165 8.4890 116.6952 56.2037 38.4240 177.3978 513 L 3.8918 8.1304 120.6429 57.9189 41.6272 179.6030 514 I 3.8885 7.7272 119.5789 64.3879 37.0255 178.6803 515 K 4.0028 8.6858 119.6886 59.1970 31.8294 179.1621 516 K 3.8546 8.4980 120.1961 59.9487 32.1219 178.6454 517 T 3.7838 7.8842 115.8072 66.9877 68.3125 176.6140 518 I 3.9012 7.7548 121.2864 64.3097 37.0803 177.7287 519 Y 4.1496 8.8745 120.8793 60.7124 38.5614 178.3205 520 K 3.9698 8.3172 120.4328 59.3714 32.3257 178.7443 521 L 3.9621 7.7431 118.8281 57.8563 41.5896 179.7588 522 V 3.6473 7.9888 118.0612 66.2136 31.4749 177.7454 523 N 4.1894 8.1947 116.4586 56.2456 38.2404 177.2027 524 D 4.2046 8.3587 120.6016 57.4347 40.9239 178.2672 525 Q 3.8474 8.3214 120.3832 59.5041 28.8693 178.8253 526 L 3.8887 7.8798 119.7137 57.4585 41.5598 179.2621 527 Q 3.7043 8.1691 119.8084 58.9832 29.0192 177.5289 528 E 3.7638 8.3259 120.7811 59.4197 29.3167 178.8776 529 L 3.7187 7.6493 117.3158 57.6874 41.8163 178.9345 530 K 3.6056 7.8982 118.3471 59.5179 32.0390 177.8544 531 D 4.5086 7.8825 116.4322 54.9415 41.7489 176.0889 532 N 5.0337 7.7981 116.8290 51.7987 39.4191 175.2123 533 E 3.9495 8.3679 120.6992 59.8421 30.1811 179.8141 534 R 4.0573 7.8936 116.6517 59.3772 30.8305 176.9773 535 T 4.7228 7.2279 109.9508 60.3295 68.0866 171.1117 536 P 4.2823 0.0000 0.0000 62.1879 32.7748 176.1362 537 D 4.6168 8.6012 120.4050 53.1542 41.7053 176.7703 538 W 4.7606 8.6656 125.7636 56.9433 29.2443 177.4665 539 D 4.4249 8.6510 120.8647 57.5672 40.6426 177.9778 540 I 3.7399 7.9524 119.7852 65.0655 37.0960 178.3045 541 T 4.1126 8.2205 115.5991 66.9477 68.2528 177.2148 542 I 3.9038 7.9774 120.3092 63.7533 37.2707 177.7789 543 S 4.6718 8.4900 114.3493 58.8368 63.9973 175.0826 544 S 4.6532 7.7967 115.0401 59.9346 64.6876 175.8441 545 L 4.0606 8.3679 123.0264 58.1806 41.9126 178.6742 546 L 4.0290 8.0448 118.7456 57.5776 41.6799 177.7862 547 P 4.2633 0.0000 0.0000 65.7364 31.2260 177.6573 548 Y 4.2252 7.9886 118.0176 60.9420 38.7270 178.4500 549 L 3.7930 8.1505 119.3612 57.8462 41.5960 179.8038 550 K 3.9713 8.2055 117.2262 58.9248 32.1401 178.8685 551 K 4.4016 8.5048 116.3662 57.1972 33.1317 176.0695 552 T 4.2911 7.4190 112.5701 64.5739 71.6955 175.7765 553 A 3.7294 7.7718 122.7093 55.2448 18.5244 179.6613 554 L 3.4854 7.4308 116.6077 57.4198 41.5121 178.2221 555 P 4.0138 0.0000 0.0000 65.4545 31.3862 178.4610 556 T 3.8919 7.6950 114.6664 66.8615 68.5744 176.6510 557 L 4.0087 8.1896 120.9006 57.7810 41.5296 179.1369 558 Y 4.3945 8.0324 117.4082 61.2379 37.5830 178.5968 559 K 3.8399 7.6463 118.0766 59.7538 32.2400 178.7125 560 L 4.1138 7.7008 116.9527 55.0555 41.8409 176.6265 561 E 3.8626 8.3193 117.6083 57.0266 27.7337 175.6071 562 D 4.7255 7.6152 116.5276 51.4201 42.1325 174.5700 563 N 4.3703 8.4960 121.4739 55.6075 38.7512 176.3372 564 T 3.9398 7.8353 117.8086 66.6160 68.5118 176.5871 565 I 3.7820 8.0898 121.9575 64.2306 37.1424 178.3144 566 L 4.0445 7.9652 119.4239 58.0340 41.4639 179.7069 567 V 3.7320 7.8687 117.6410 65.8513 31.3731 177.9885 568 A 4.0645 8.0533 120.8234 54.8174 18.1336 179.3794 569 L 3.9852 8.1141 118.8735 58.4942 42.2295 179.2065 570 I 3.8022 8.0149 119.7712 64.4527 37.0917 178.3773 571 R 3.9887 8.3706 119.5776 59.5540 29.8129 177.8211 572 Y 4.1193 8.3582 119.3868 60.8529 38.7415 178.2397 573 I 3.6261 8.1984 120.7361 64.3665 37.2909 178.6838 574 V 3.4975 7.9990 119.0234 65.9956 31.4609 177.2244 575 H 4.4111 8.1098 115.1596 58.3791 29.1074 177.4536 576 D 4.4297 7.6975 118.7720 56.6519 40.9642 175.8785 577 L 4.1964 7.5915 119.8898 56.1282 44.0727 178.1379 578 V 3.6583 7.9391 117.3652 66.3629 32.1413 178.4595 579 I 3.8445 7.9442 119.2868 64.4441 36.7992 178.0659 580 D 4.3522 7.8448 117.7191 57.1787 41.3281 177.4950 581 N 4.4624 8.2601 117.4916 57.0061 39.0538 176.8718 582 I 3.2906 8.0311 121.2294 64.3098 36.9592 178.4538 583 L 3.5563 7.8804 118.6042 57.0918 41.4378 178.1786 584 H 4.5943 7.8789 114.0349 54.6298 29.4027 175.5425 585 W 4.4528 7.4412 121.3537 56.9053 29.6644 176.3852 586 R 4.1085 8.6590 121.4913 59.1417 29.8443 176.8343 587 V 4.6275 7.4434 113.8173 60.4892 34.6646 174.6576 588 I 4.7970 8.5256 122.8294 59.2480 39.0481 175.7172 589 S 4.3025 8.6950 122.0461 58.1024 64.2613 175.2754 590 E 3.8409 9.0310 120.1484 59.6857 29.1111 179.6542 591 K 3.9477 8.0099 118.7356 59.7097 32.2618 178.7159 592 S 4.2444 8.3496 115.7241 61.5775 62.7250 176.7495 593 S 4.0135 8.6908 117.2351 61.5675 62.5106 176.5225 594 E 3.9439 8.1423 122.2049 59.0236 29.1924 178.8241 595 N 4.6421 8.4726 116.7199 56.7816 38.7055 177.4191 596 L 4.1557 8.6780 120.7158 57.7484 41.4033 179.6064 597 S 4.0569 8.0890 112.3608 61.4370 62.4568 175.6158 598 E 4.0020 8.2615 120.1833 59.3202 29.4291 178.6794 599 F 4.5935 8.8944 120.9628 61.5611 39.4720 178.7187 600 I 3.5798 7.7941 117.5072 61.6832 37.2694 177.9897 *602 L 4.1538 7.9164 121.7177 54.7705 43.7957 179.0507 603 L 3.7935 7.8783 120.0974 58.1282 41.8954 178.9348 604 L 3.9065 8.1892 119.2027 57.9285 41.3121 179.2220 605 S 4.1795 7.4218 111.2144 61.2361 62.3126 175.8092 606 G 3.9753 7.9335 105.1637 44.9460 0.0000 173.9737 607 L 4.5983 7.3463 119.9983 54.3176 41.9527 176.0248 608 E 4.4360 8.1252 120.6543 55.5728 29.1658 176.0867 609 I 4.5465 9.2346 128.7560 58.1312 37.8997 174.4063 610 P 4.5673 0.0000 0.0000 65.2212 31.5729 178.9345 611 R 3.8123 7.8991 113.3394 58.4283 29.3035 176.9791 612 L 4.3171 7.7819 118.0903 54.3591 41.7140 177.7793 613 N 4.5862 8.1323 117.9335 55.5826 38.5594 175.7848 614 L 4.4262 7.6822 116.2654 55.6969 42.8207 177.5281 615 I 3.9737 7.8423 121.2567 60.8177 38.4070 176.5461 616 E 3.9183 8.7968 125.4764 59.5741 29.6145 179.0861 617 T 3.9950 7.9191 109.1440 64.5543 68.7480 175.7958 618 Y 4.1593 8.0060 122.5052 60.5315 38.9167 177.2315 619 R 3.7290 7.9553 119.5763 59.6821 30.1530 178.2380 620 H 4.3630 8.4518 116.1194 58.7799 28.5410 177.9891 621 S 4.1044 7.8710 117.2860 61.7084 62.5757 176.9557 622 R 3.8744 7.5548 120.8553 58.8495 29.6942 178.8808 623 E 3.9407 8.3142 118.6775 59.2633 29.5062 179.1637 624 K 3.9142 8.1730 119.6542 59.5395 32.1372 178.4679 625 L 4.0024 7.6491 119.0462 58.0480 41.4664 179.9426 626 G 3.5752 8.3710 105.6434 47.8386 0.0000 175.7671 627 I 3.9058 8.2164 122.4714 63.8856 37.1169 178.1507 628 L 3.6291 8.6144 121.7532 57.9323 41.5938 178.9203 629 S 3.9733 7.9273 112.6717 61.1671 62.4369 176.1555 630 K 4.0813 7.7094 120.9933 59.4674 31.9672 179.0598 631 I 3.6197 7.6971 120.2514 64.7672 36.8429 178.2878 632 L 3.9796 7.6830 118.2433 56.9105 41.3658 178.1093 633 T 4.5339 7.4921 107.5144 61.0301 69.1412 173.3328 634 A 4.7728 7.6998 123.9516 51.2192 21.5057 177.8615 635 H 4.8789 8.2568 116.8210 55.0212 30.9364 176.2024 636 L 3.4290 8.6854 123.1783 58.3868 41.6312 179.3274 637 K 3.9835 8.0675 118.8225 59.6616 32.0683 178.4733 638 D 4.4647 8.1989 117.5155 57.1496 40.7790 178.3739 639 I 4.0499 7.3544 119.6465 64.1798 37.3522 177.8067 640 L 4.1109 7.7569 121.2379 57.9888 41.8357 179.6139 641 E 4.2497 8.1122 115.7898 57.2026 29.3286 178.7425 *643 F 4.0013 8.0399 121.0325 58.0820 41.2693 176.2154 644 Y 4.1914 7.9261 118.1818 61.4931 37.8034 177.9240 645 E 4.1245 8.2475 115.7836 56.4625 29.4673 177.7881 646 G 3.9097 8.3931 108.1658 45.6435 0.0000 175.7933 647 E 4.0893 7.7802 119.0038 58.8171 29.7698 177.4063 648 F 5.2399 7.7872 117.0064 57.4837 39.1549 177.0414 649 F 4.2363 8.3620 126.4555 61.3829 39.0153 175.8557 650 L 4.0839 8.2291 118.7663 54.5839 42.0430 175.3625 651 F 4.7647 8.3266 116.8683 55.5122 41.4551 175.5730 652 E 4.1644 8.6604 125.6756 56.2321 31.6794 177.4595 653 T 3.9191 8.5913 121.2442 67.1226 68.5178 176.3937 654 D 4.3501 8.1076 120.0471 57.4739 40.9033 178.4045 655 E 3.9778 8.1691 119.1912 59.1910 29.8025 178.8257 656 I 3.6832 7.7031 119.6155 64.2902 37.1419 178.5687 657 V 3.5596 7.6176 118.6658 65.9223 31.3451 178.0233 658 Q 3.8736 8.1645 117.9495 58.8278 28.5781 178.8973 659 W 4.3183 7.9553 119.7740 59.9232 28.9306 178.7044 660 I 4.0292 7.8183 119.3567 64.5309 36.3158 178.6096 661 I 3.8401 7.8029 119.8511 64.2842 37.1317 178.2069 662 L 4.1883 8.2451 120.0034 56.9543 41.2642 178.5829 663 L 4.4803 7.8475 116.2293 54.0002 42.8582 176.5843 664 F 4.8028 7.5314 116.1125 55.1794 42.7256 174.5817 665 A 4.2717 8.5579 126.6452 51.4585 19.0694 176.9820 666 D 4.4725 8.5384 120.7067 54.6036 41.9223 176.3715 667 T 4.7288 8.2605 115.4162 58.5968 73.1068 172.8059 668 P 4.2020 0.0000 0.0000 66.3815 31.3765 178.8002 669 T 3.8269 7.9133 113.6880 66.7046 68.3227 176.4977 670 R 3.8082 8.0580 120.5255 59.2386 30.0814 178.6638 671 R 3.8856 8.0860 117.8765 59.4706 30.0616 178.7074 672 D 4.3398 8.1986 118.4803 57.4940 40.8369 178.4477 673 C 4.0171 8.0029 119.0608 62.5518 31.5667 175.7164 674 I 3.5897 7.9777 121.6095 64.5879 36.8051 178.2439 675 D 4.3621 8.5639 120.0651 57.1149 40.5396 178.5329 676 E 3.9670 8.4650 120.2515 59.3861 29.5968 178.9607 677 I 3.1826 7.5220 119.8205 64.3401 36.9504 178.7496 678 R 3.9703 7.8995 118.7273 58.8235 29.7697 179.1585 679 R 3.9550 7.7581 118.4425 59.2832 30.1577 178.6712 680 V 3.7343 8.1387 118.1793 66.1278 31.3739 178.2320 681 R 4.0935 7.9219 116.7474 59.0586 29.9194 178.4803 682 E 4.1102 7.7709 118.2782 59.4036 29.8182 178.3922 683 E 4.1127 8.5757 116.9631 60.0869 29.6549 177.4764 684 A 4.3423 7.9597 123.9670 51.5582 18.3010 176.8181 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 333 N 8.42 4.71 0.00 2.71 2.88 0.00 0.00 6.91 7.06 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 0.00 334 I 7.23 4.12 1.65 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 1.57 1.03 0.85 0.00 0.00 335 Y 8.47 4.34 0.00 3.06 2.92 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 0.00 336 T 8.07 3.98 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 1.37 0.00 0.00 337 T 8.12 3.96 4.44 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 1.25 0.00 0.00 338 L 7.71 4.07 0.00 1.83 1.97 1.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 339 K 7.82 4.07 0.00 1.93 1.89 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.48 7.81 340 F 8.40 4.07 0.00 3.26 3.10 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 0.00 341 E 8.38 4.36 0.00 2.24 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 2.64 2.54 0.00 342 S 7.58 4.38 0.00 3.97 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 *345 Q 7.77 4.31 0.00 2.41 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 346 Q 7.87 4.21 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 347 R 7.91 3.92 0.00 1.90 1.93 0.00 3.45 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.82 0.00 348 V 7.69 3.64 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 1.17 0.00 0.00 0.96 0.00 0.00 349 I 8.31 3.70 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.55 0.93 0.00 0.00 350 Q 8.04 4.02 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 351 I 7.95 3.85 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.11 1.11 0.00 0.00 352 R 8.05 4.08 0.00 1.95 2.02 0.00 3.17 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 353 S 7.76 4.54 0.00 4.02 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 0.00 354 I 7.12 3.83 2.12 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.65 0.00 0.00 355 P 0.00 4.33 0.00 2.18 2.00 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.09 0.00 356 E 9.26 4.11 0.00 2.12 2.05 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 2.45 2.53 0.00 357 E 8.26 4.47 0.00 2.32 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 0.00 2.38 2.29 0.00 358 E 8.48 4.30 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 359 Y 7.71 4.84 0.00 2.84 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 0.00 360 H 8.02 4.93 0.00 3.11 3.33 0.00 5.88 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 361 E 7.66 4.72 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 362 L 8.43 5.20 0.00 1.46 1.50 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 363 V 8.15 4.45 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 0.75 0.00 0.00 0.88 0.00 0.00 364 S 8.46 4.85 0.00 3.74 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 365 V 8.58 4.52 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 0.25 0.00 0.00 0.89 0.00 0.00 366 Q 8.55 4.78 0.00 2.10 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 *424 P 0.00 4.48 0.00 2.09 2.00 0.00 3.76 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.03 0.00 425 I 7.66 4.18 1.87 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 1.19 1.19 0.95 0.00 0.00 426 Q 8.50 5.01 0.00 1.90 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.59 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 427 V 7.79 4.44 1.71 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 0.52 0.00 0.00 0.44 0.00 0.00 428 S 8.87 4.59 0.00 3.79 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 0.00 429 V 8.52 3.54 2.17 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 0.93 0.00 0.00 0.93 0.00 0.00 430 F 7.95 4.78 0.00 2.88 2.78 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 0.00 431 V 6.76 3.17 1.75 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 1.13 0.00 0.00 0.27 0.00 0.00 432 Q 7.36 4.06 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 433 S 8.03 4.28 0.00 4.07 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 434 A 8.63 4.03 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 435 A 8.30 4.14 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 436 K 7.95 3.98 0.00 1.90 1.89 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.73 7.81 437 V 7.46 4.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.87 0.00 0.00 438 F 7.85 4.51 0.00 3.27 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 T 7.98 4.08 4.44 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 1.25 0.00 0.00 440 E 9.04 3.96 0.00 2.22 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 0.00 2.31 2.37 0.00 441 F 8.12 4.15 0.00 3.30 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 0.00 442 E 8.00 3.79 0.00 2.22 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 2.70 2.56 0.00 443 Q 8.25 4.18 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 444 G 8.02 3.43 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 0.00 0.00 0.00 0.00 445 C 7.64 4.06 0.00 2.98 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 0.00 446 D 8.29 4.36 0.00 2.83 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 0.00 447 T 7.07 4.14 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 1.17 0.00 0.00 448 I 7.82 4.02 1.88 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 1.29 0.40 0.95 0.00 0.00 449 G 7.37 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 0.00 450 R 8.86 4.23 0.00 1.83 2.12 0.00 3.27 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.25 0.00 451 S 8.62 3.98 0.00 4.14 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 0.00 452 K 7.87 4.31 0.00 2.04 1.96 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.39 7.81 453 V 7.46 4.50 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 1.53 0.00 0.00 1.28 0.00 0.00 454 E 8.59 3.99 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 455 S 8.18 4.40 0.00 4.07 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.21 4.39 1.75 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.24 0.84 0.00 0.00 457 Y 8.09 4.30 0.00 3.34 3.30 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 0.00 458 L 8.12 3.93 0.00 1.92 1.77 1.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 459 Y 7.99 4.06 0.00 3.10 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 0.00 460 K 8.15 3.76 0.00 1.96 2.16 0.00 1.92 0.00 0.00 1.64 0.00 0.00 3.16 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.57 1.25 7.81 461 F 8.13 3.61 0.00 2.69 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 462 N 8.18 4.04 0.00 2.81 2.70 0.00 0.00 6.73 7.49 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 0.00 463 L 7.71 3.71 0.00 1.11 1.52 0.78 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 464 L 7.63 3.99 0.00 1.75 1.53 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 465 Q 7.74 4.20 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 466 T 7.94 3.92 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 1.22 0.00 0.00 467 A 8.35 4.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 468 F 8.32 4.30 0.00 3.14 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.86 4.09 0.00 3.32 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 0.00 470 A 8.22 3.78 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.76 3.48 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 0.51 0.00 0.00 0.19 0.00 0.00 473 S 7.43 3.86 0.00 3.84 3.71 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 0.00 474 E 7.17 4.13 0.00 1.76 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 0.00 2.37 2.31 0.00 475 K 7.25 3.79 0.00 0.83 0.74 0.00 0.65 0.00 0.00 0.70 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.97 0.74 7.81 476 V 7.17 4.08 2.05 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 0.95 0.00 0.00 0.98 0.00 0.00 477 N 8.85 4.19 0.00 2.78 2.94 0.00 0.00 7.08 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 0.00 478 D 7.96 4.62 0.00 2.69 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.99 4.54 0.00 3.62 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 0.00 480 T 7.42 3.47 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 -0.45 0.00 0.00 481 Q 7.86 3.94 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 482 L 7.88 4.07 0.00 1.88 1.96 1.03 0.47 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 0.00 483 Y 7.97 4.59 0.00 3.44 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 0.00 484 K 8.17 3.90 0.00 2.02 1.82 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.70 7.81 485 D 8.85 4.25 0.00 2.91 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 486 V 8.53 3.80 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 1.31 0.00 0.00 487 R 7.54 2.60 0.00 1.35 1.71 0.00 3.14 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.26 0.00 488 Y 8.18 3.87 0.00 2.98 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 0.00 489 L 7.55 3.90 0.00 1.83 1.65 1.13 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 490 Y 6.77 5.24 0.00 3.05 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 0.00 491 T 7.16 3.90 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 1.09 0.00 0.00 492 E 7.37 4.13 0.00 1.42 1.68 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 2.22 2.20 0.00 493 N 7.83 4.84 0.00 2.67 2.74 0.00 0.00 6.83 9.05 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 2.25 2.41 0.00 528 E 8.33 3.76 0.00 1.93 2.05 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 2.28 2.14 0.00 529 L 7.65 3.72 0.00 1.87 1.77 0.83 0.18 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 0.00 530 K 7.90 3.61 0.00 0.79 1.43 0.00 1.24 0.00 0.00 0.97 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 0.21 7.81 531 D 7.88 4.51 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 0.00 532 N 7.80 5.03 0.00 2.77 2.63 0.00 0.00 6.79 7.76 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 0.00 533 E 8.37 3.95 0.00 1.95 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 2.38 2.34 0.00 534 R 7.89 4.06 0.00 1.77 1.95 0.00 3.24 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 535 T 7.23 4.72 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 1.20 0.00 0.00 536 P 0.00 4.28 0.00 1.54 1.88 0.00 3.86 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 537 D 8.60 4.62 0.00 2.56 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 0.00 538 W 8.67 4.76 0.00 3.51 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 0.00 539 D 8.65 4.42 0.00 2.98 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 0.00 540 I 7.95 3.74 2.08 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.43 0.97 0.00 0.00 541 T 8.22 4.11 4.81 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 1.42 0.00 0.00 542 I 7.98 3.90 1.99 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 1.56 0.59 0.96 0.00 0.00 543 S 8.49 4.67 0.00 4.07 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 544 S 7.80 4.65 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 1.22 0.00 0.00 553 A 7.77 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 554 L 7.43 3.49 0.00 1.49 1.07 0.99 0.93 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 0.00 555 P 0.00 4.01 0.00 1.92 2.09 0.00 3.53 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 556 T 7.69 3.89 4.44 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 1.27 0.00 0.00 557 L 8.19 4.01 0.00 1.52 1.72 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 558 Y 8.03 4.39 0.00 3.02 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 0.00 559 K 7.65 3.84 0.00 1.80 1.77 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.49 7.81 560 L 7.70 4.11 0.00 1.75 1.73 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 561 E 8.32 3.86 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 562 D 7.62 4.73 0.00 2.82 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 0.00 563 N 8.50 4.37 0.00 2.80 2.84 0.00 0.00 7.01 7.05 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 0.00 564 T 7.84 3.94 4.57 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 1.25 0.00 0.00 565 I 8.09 3.78 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.95 0.94 0.00 0.00 566 L 7.97 4.04 0.00 1.91 1.77 1.17 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 567 V 7.87 3.73 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 1.19 0.00 0.00 1.05 0.00 0.00 568 A 8.05 4.06 1.43 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 0.00 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0.00 0.00 0.00 1.53 0.61 0.91 0.00 0.00 662 L 8.25 4.19 0.00 1.98 1.79 0.68 0.44 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 0.00 663 L 7.85 4.48 0.00 1.65 1.23 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 664 F 7.53 4.80 0.00 3.07 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 0.00 665 A 8.56 4.27 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 0.00 666 D 8.54 4.47 0.00 2.65 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 0.00 667 T 8.26 4.73 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 668 P 0.00 4.20 0.00 2.17 2.18 0.00 3.61 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 2.13 2.23 0.00 669 T 7.91 3.83 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 670 R 8.06 3.81 0.00 1.90 2.02 0.00 3.36 0.00 0.00 3.53 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 671 R 8.09 3.89 0.00 2.08 1.95 0.00 3.18 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 672 D 8.20 4.34 0.00 2.67 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 673 C 8.00 4.02 0.00 3.00 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 0.00 674 I 7.98 3.59 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.66 0.87 0.00 0.00 675 D 8.56 4.36 0.00 2.62 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 0.00 676 E 8.47 3.97 0.00 2.22 2.06 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 0.00 2.48 2.49 0.00 677 I 7.52 3.18 1.54 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.08 0.68 0.33 0.00 0.00 678 R 7.90 3.97 0.00 1.87 1.97 0.00 3.09 0.00 0.00 3.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 679 R 7.76 3.95 0.00 2.10 2.10 0.00 3.13 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.66 0.00 680 V 8.14 3.73 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 1.10 0.00 0.00 1.24 0.00 0.00 681 R 7.92 4.09 0.00 2.01 2.09 0.00 3.54 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.97 0.00 682 E 7.77 4.11 0.00 2.09 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 2.35 2.42 0.00 683 E 8.58 4.11 0.00 2.04 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 2.38 2.46 0.00 684 A 7.96 4.34 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.