NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 474 G 3.8714 8.2127 109.7285 45.4814 0.0000 175.9543 475 S 3.8712 8.0142 116.0951 60.0069 62.5718 172.9318 476 R 3.8574 7.9609 121.2901 58.9859 30.4021 177.2241 477 E 3.5583 7.9463 118.9460 59.2321 29.6280 178.9666 478 R 3.6865 7.5150 115.6995 59.1889 29.5298 178.7908 479 L 3.9822 7.9120 119.7725 57.4862 41.6940 179.6472 480 V 3.6724 7.9499 118.2853 66.0732 31.5336 177.7563 481 Y 4.3957 8.0542 117.0959 60.7523 37.6625 177.7676 482 E 4.2163 8.3646 118.0895 58.2886 29.9874 178.9414 483 V 4.1778 7.8195 121.1998 65.6567 31.3688 177.9733 484 R 3.9219 7.7418 116.5272 59.2399 30.0187 177.5919 485 Q 4.2315 7.7526 114.6062 55.3418 28.9306 176.0723 486 K 3.9848 7.8325 118.4255 57.8067 29.9390 176.3638 487 C 4.4633 8.4142 116.7724 60.4286 29.0911 173.9704 488 R 4.6540 7.3781 119.1011 54.6747 33.0344 173.1193 489 N 4.9471 8.5621 121.3005 52.2354 39.8548 176.3934 490 I 3.7669 8.3407 122.5181 63.8460 38.3343 177.3538 491 E 4.2488 8.1549 118.1051 58.2939 29.4389 176.8789 492 D 4.7574 7.9346 117.5648 53.9053 41.8784 176.1518 493 I 4.4680 7.2245 112.9790 58.6316 40.4166 174.4616 494 C 4.4883 8.9852 123.7393 58.8275 30.8894 174.4193 495 I 4.0853 8.1664 121.8409 63.0298 37.6863 177.9357 496 S 4.4220 8.2477 117.5424 61.2435 62.8609 174.6787 497 C 4.6429 7.9689 110.3917 56.9608 30.9283 174.8388 498 G 3.8662 8.7518 108.7113 45.3187 0.0000 173.6583 499 S 4.1660 7.7501 114.2628 58.4935 62.7958 174.4700 500 L 4.3716 8.3502 124.8851 55.2682 42.4806 177.0605 501 N 4.6823 7.6512 119.1116 51.9631 37.3273 175.8854 502 V 3.7386 7.4173 117.9348 63.4758 32.5651 175.2617 503 T 4.5919 8.3278 122.7049 63.4226 70.2810 173.6308 504 L 4.4173 7.4426 121.3025 54.1789 45.6567 172.8094 505 E 4.6600 8.7498 123.0455 55.4964 29.1601 176.0707 506 H 4.0639 9.1866 125.5995 56.0426 30.3024 174.4947 507 P 4.4389 0.0000 0.0000 64.8027 31.9019 176.8530 508 L 4.3487 7.5447 116.9736 55.4857 43.3586 176.6456 509 F 5.3756 7.8770 114.6325 55.0847 43.1473 175.1859 510 V 3.6975 8.8056 122.5939 62.2591 31.7161 175.1027 511 G 4.5399 8.7120 115.6152 43.6525 0.0000 172.3161 512 G 4.3130 8.0305 109.5657 45.9558 0.0000 172.1310 513 M 5.2573 8.6421 118.7522 54.2120 36.1442 174.2778 514 C 4.8702 8.7169 120.7482 57.5508 31.8631 174.6449 515 Q 3.9888 8.6668 117.8009 59.0855 28.1874 178.6241 516 N 4.3145 8.1042 117.0499 56.6982 38.6020 177.1337 517 C 4.2170 8.0493 117.4581 62.2476 28.1741 175.8491 518 K 4.1477 8.0942 121.6058 59.6122 31.7517 178.6269 519 N 4.2777 8.3418 116.7054 56.4777 38.4398 176.8061 520 C 3.8360 8.1297 118.2587 63.0243 28.2870 175.9888 521 F 3.8209 8.5836 122.0060 61.4238 38.7410 177.0468 522 L 4.0032 8.1502 117.1750 58.0549 41.5170 179.2197 523 E 4.1465 8.4245 117.5682 59.3441 29.8812 178.5709 524 C 4.3249 8.4166 115.8864 59.6830 28.4406 173.7859 525 A 3.7357 7.3416 124.2599 53.5351 18.2089 176.7018 526 Y 3.7113 8.0686 118.7718 58.7426 35.7726 169.5176 527 Q 4.3059 7.8630 121.6710 56.0311 29.7315 174.5178 528 Y 4.9565 8.4529 122.0994 56.2226 40.7486 175.3198 529 D 4.7518 8.5780 123.4453 53.1861 41.9743 177.4545 530 D 4.4405 8.5662 120.0996 55.8648 39.2679 177.0156 531 D 4.5097 8.1252 118.0278 53.8231 39.8329 177.1282 532 G 3.8264 8.5659 108.7214 45.9065 0.0000 172.8308 533 Y 4.9127 8.1693 116.9532 55.4870 40.6776 175.4349 534 Q 3.7742 8.6049 121.2885 56.0919 29.3064 177.6495 535 S 4.0895 8.4934 118.1453 60.6395 63.0491 174.6415 536 Y 4.8266 7.1804 115.9154 55.4311 40.7206 174.8556 537 C 3.9245 8.7076 123.4973 60.2803 31.9410 175.1669 538 T 3.6087 8.0532 123.9694 66.0303 68.3378 175.4970 539 I 4.3050 7.6819 121.0079 62.8759 37.7828 176.2266 540 C 4.5569 7.8039 112.0896 57.2660 30.7137 174.4900 541 C 3.9246 8.3956 116.9077 60.3051 26.9508 173.2575 542 G 4.1389 7.4690 111.4810 46.5602 0.0000 175.1326 543 G 4.1338 9.2538 111.2341 45.8863 0.0000 170.7432 544 R 4.2560 7.6050 117.6958 56.7063 32.9754 175.9014 545 E 4.1256 8.1318 118.0213 56.9152 31.2949 176.3905 546 V 4.7850 8.0629 118.4238 59.8427 36.3902 174.2799 547 L 4.3076 8.7958 122.8596 54.0134 43.2752 175.6756 548 M 5.2266 8.2525 122.0280 53.4163 34.6072 175.0938 549 C 4.4951 9.3429 125.2890 59.3830 32.1474 173.5979 550 G 3.9212 9.3349 114.8129 45.9160 0.0000 172.9393 551 N 4.5998 7.9608 119.9775 52.5582 38.6270 175.2610 552 N 4.5269 8.7040 123.6766 55.3011 38.8375 175.8255 553 N 4.6072 8.6982 115.1461 54.1446 38.6307 174.1425 554 C 4.6593 8.0338 116.6536 59.3814 34.2150 174.6159 555 C 4.3990 8.2195 112.9354 60.6617 25.6160 173.3769 556 R 4.6778 7.5364 118.9219 56.5290 31.0699 175.4000 557 C 5.5251 8.4284 117.8029 58.0968 32.4331 172.9509 558 F 5.0667 9.1905 120.8723 55.4759 41.8621 175.1146 559 C 4.7778 8.7567 118.5654 57.9848 30.5039 175.1173 560 V 3.7014 8.1111 114.5792 64.3843 30.9852 178.9806 561 E 3.9736 8.0855 118.2212 59.4993 29.2913 178.9193 562 C 4.1257 7.9959 116.3577 62.6338 28.2269 176.1520 563 V 3.4593 7.6425 119.2849 66.2688 29.8218 177.9059 564 D 4.5495 8.2406 118.5697 57.0000 40.3114 178.7539 565 L 4.0079 7.6103 120.2771 58.0415 42.5904 178.2743 566 L 4.2476 8.0998 118.6253 56.2885 41.8328 179.2583 567 V 3.7286 8.1604 118.7879 64.4143 32.1180 175.8742 568 G 4.4758 6.7269 107.3122 43.3818 0.0000 169.9377 569 P 4.4228 0.0000 0.0000 63.9134 31.4147 177.3043 570 G 3.9680 9.1556 111.0751 45.3698 0.0000 175.0660 571 A 4.0559 8.0694 121.3089 54.5475 18.3061 179.6543 572 A 3.8165 8.6096 120.1732 55.5997 18.3409 179.8858 573 Q 3.9813 7.9387 113.8627 58.2693 28.9172 178.2226 574 A 4.0926 7.4971 121.1075 54.9719 18.5449 178.9589 575 A 4.1602 7.6660 118.2629 54.5258 19.0274 178.7073 576 I 3.7038 6.9386 117.9650 59.3004 36.3207 174.0341 *581 W 4.5399 7.7770 132.5897 56.9273 31.4821 173.7937 582 N 4.5933 8.0460 123.5952 51.8916 39.3597 175.8149 583 C 2.4500 7.4547 118.1669 57.0424 32.2316 173.8749 584 Y 3.6728 6.8244 117.0045 61.2148 37.2928 178.0648 585 M 4.0120 7.9634 118.4814 57.5668 32.2320 177.3761 586 C 4.5916 7.8101 115.0214 59.7719 29.4449 174.4365 587 G 3.9751 7.1827 108.2251 44.9903 0.0000 173.1375 588 H 4.3013 8.9002 120.3469 58.9365 30.1169 176.4995 589 K 4.1230 8.0288 116.9947 56.4299 32.5280 177.0595 590 G 4.0998 8.4785 108.7272 45.5690 0.0000 172.9265 591 T 4.8198 7.3909 116.6239 61.8531 70.2962 173.4478 592 Y 4.5046 8.9462 124.2132 56.6491 40.6749 176.2493 593 G 4.0914 8.0845 117.0862 46.3813 0.0000 174.0728 594 L 4.1640 8.9314 124.7130 55.1164 41.9885 176.0998 595 L 4.3201 7.9160 123.3890 54.1650 43.1084 175.5784 596 R 5.1641 8.5340 122.9981 54.1504 32.1856 174.7457 597 R 4.4231 9.5337 125.9179 56.2693 31.2142 176.0405 598 R 4.4466 8.8370 125.8312 55.4221 30.9257 177.6722 599 E 4.0766 9.1937 122.1941 58.9138 30.0086 177.7388 600 D 4.8520 7.9238 118.8499 52.6307 40.8823 178.3682 601 W 4.5069 7.9277 120.3914 60.4955 27.4307 175.4349 602 P 3.7821 0.0000 0.0000 65.0208 30.8177 178.6043 603 S 4.2985 7.7855 111.7352 60.7784 63.1079 176.4763 604 R 4.0515 8.0246 122.4951 59.1103 29.8251 178.6818 605 L 4.2569 8.2845 118.9090 57.9458 41.4473 179.3768 606 Q 4.1278 7.6839 115.8656 59.3114 28.7872 178.5867 607 M 4.2098 7.7795 116.9940 58.7737 32.4245 177.3109 608 F 4.0663 8.7724 119.6183 61.6531 39.5528 174.8850 609 F 4.2714 9.2216 120.5889 57.8013 38.7072 175.2694 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 474 G 8.21 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 475 S 8.01 3.87 0.00 3.95 3.82 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 0.00 476 R 7.96 3.86 0.00 2.00 1.83 0.00 3.21 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 477 E 7.95 3.56 0.00 1.85 1.69 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 1.50 2.05 0.00 478 R 7.52 3.69 0.00 2.04 2.24 0.00 2.81 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 479 L 7.91 3.98 0.00 1.68 1.74 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 480 V 7.95 3.67 2.23 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 1.13 0.00 0.00 0.97 0.00 0.00 481 Y 8.05 4.40 0.00 3.24 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 0.00 482 E 8.36 4.22 0.00 2.26 2.25 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 2.50 2.33 0.00 483 V 7.82 4.18 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 1.37 0.00 0.00 1.02 0.00 0.00 484 R 7.74 3.92 0.00 1.91 2.13 0.00 3.23 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 485 Q 7.75 4.23 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.43 0.00 0.00 0.00 0.00 0.00 2.68 2.55 0.00 486 K 7.83 3.98 0.00 1.92 1.93 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.40 7.81 487 C 8.41 4.46 0.00 2.94 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 0.00 488 R 7.38 4.65 0.00 1.79 1.71 0.00 3.17 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 489 N 8.56 4.95 0.00 2.88 2.72 0.00 0.00 6.68 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 490 I 8.34 3.77 1.88 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 1.43 1.35 0.93 0.00 0.00 491 E 8.15 4.25 0.00 2.02 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 2.34 2.35 0.00 492 D 7.93 4.76 0.00 2.89 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 0.00 493 I 7.22 4.47 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 1.46 0.75 0.91 0.00 0.00 494 C 8.99 4.49 0.00 2.95 3.03 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 0.00 0.00 0.00 495 I 8.17 4.09 1.83 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 1.51 0.74 0.91 0.00 0.00 496 S 8.25 4.42 0.00 3.93 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 0.00 497 C 7.97 4.64 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 498 G 8.75 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 499 S 7.75 4.17 0.00 3.86 3.75 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 0.00 500 L 8.35 4.37 0.00 1.67 1.68 0.92 1.06 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 0.00 501 N 7.65 4.68 0.00 2.73 2.78 0.00 0.00 6.87 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 0.00 502 V 7.42 3.74 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 0.96 0.00 0.00 1.00 0.00 0.00 503 T 8.33 4.59 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 504 L 7.44 4.42 0.00 1.72 1.58 0.90 1.09 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 0.00 505 E 8.75 4.66 0.00 1.93 1.90 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 2.32 2.33 0.00 506 H 9.19 4.06 0.00 3.29 3.50 0.00 5.58 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 507 P 0.00 4.44 0.00 2.02 1.90 0.00 2.73 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.44 0.00 508 L 7.54 4.35 0.00 1.22 0.78 0.98 0.86 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 0.00 509 F 7.88 5.38 0.00 2.76 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 0.00 510 V 8.81 3.70 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.04 0.00 0.00 511 G 8.71 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.03 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 0.00 0.00 0.00 0.00 513 M 8.64 5.26 0.00 2.10 1.86 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 514 C 8.72 4.87 0.00 3.12 3.06 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 0.00 0.00 0.00 515 Q 8.67 3.99 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 516 N 8.10 4.31 0.00 2.73 2.86 0.00 0.00 7.15 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 0.00 517 C 8.05 4.22 0.00 3.15 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 0.00 518 K 8.09 4.15 0.00 1.95 1.97 0.00 1.44 0.00 0.00 1.46 0.00 0.00 2.49 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.13 1.09 7.81 519 N 8.34 4.28 0.00 3.00 2.98 0.00 0.00 7.05 7.19 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 0.00 520 C 8.13 3.84 0.00 3.14 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 0.00 521 F 8.58 3.82 0.00 3.33 3.28 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 0.00 522 L 8.15 4.00 0.00 1.80 1.71 0.68 0.73 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 0.00 523 E 8.42 4.15 0.00 1.96 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 2.34 2.40 0.00 524 C 8.42 4.32 0.00 2.71 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 0.00 525 A 7.34 3.74 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 0.00 526 Y 8.07 3.71 0.00 3.28 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 0.00 527 Q 7.86 4.31 0.00 2.50 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 528 Y 8.45 4.96 0.00 2.97 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 0.00 529 D 8.58 4.75 0.00 3.09 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 D 8.57 4.44 0.00 2.78 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 0.00 531 D 8.13 4.51 0.00 2.98 2.91 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 0.00 532 G 8.57 3.83 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 0.00 0.00 0.00 533 Y 8.17 4.91 0.00 3.17 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 0.00 534 Q 8.60 3.77 0.00 1.85 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 1.31 2.12 0.00 535 S 8.49 4.09 0.00 3.08 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 0.00 536 Y 7.18 4.83 0.00 2.77 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 0.00 537 C 8.71 3.92 0.00 2.98 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 0.00 538 T 8.05 3.61 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 539 I 7.68 4.31 1.89 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 1.40 0.67 0.88 0.00 0.00 540 C 7.80 4.56 0.00 3.18 3.14 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 0.00 541 C 8.40 3.92 0.00 3.06 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 0.00 542 G 7.47 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 0.00 0.00 0.00 543 G 9.25 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 544 R 7.61 4.26 0.00 1.76 1.74 0.00 3.37 0.00 0.00 3.14 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 545 E 8.13 4.13 0.00 2.02 1.79 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 2.31 2.29 0.00 546 V 8.06 4.79 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 0.81 0.00 0.00 0.87 0.00 0.00 547 L 8.80 4.31 0.00 1.22 0.40 0.41 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 548 M 8.25 5.23 0.00 1.20 1.59 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 2.33 2.34 0.00 549 C 9.34 4.50 0.00 3.11 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 0.00 550 G 9.33 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 0.00 551 N 7.96 4.60 0.00 2.74 2.76 0.00 0.00 7.16 6.71 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 0.00 552 N 8.70 4.53 0.00 2.76 2.83 0.00 0.00 7.20 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 0.00 553 N 8.70 4.61 0.00 2.93 2.91 0.00 0.00 6.66 7.47 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 0.00 554 C 8.03 4.66 0.00 2.98 3.06 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 0.00 0.00 0.00 555 C 8.22 4.40 0.00 3.51 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 0.00 556 R 7.54 4.68 0.00 1.88 1.80 0.00 3.10 0.00 0.00 3.14 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.70 0.00 557 C 8.43 5.53 0.00 2.76 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 0.00 558 F 9.19 5.07 0.00 3.23 3.14 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 0.00 559 C 8.76 4.78 0.00 3.21 3.06 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 0.00 0.00 0.00 560 V 8.11 3.70 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 0.70 0.00 0.00 0.91 0.00 0.00 561 E 8.09 3.97 0.00 2.05 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 2.45 0.00 562 C 8.00 4.13 0.00 3.15 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 563 V 7.64 3.46 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 1.17 0.00 0.00 1.15 0.00 0.00 564 D 8.24 4.55 0.00 2.80 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 0.00 565 L 7.61 4.01 0.00 1.77 1.79 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 566 L 8.10 4.25 0.00 1.66 1.51 0.78 0.82 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 0.00 567 V 8.16 3.73 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 0.99 0.00 0.00 0.56 0.00 0.00 568 G 6.73 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 569 P 0.00 4.42 0.00 2.04 2.01 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 570 G 9.16 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 0.00 0.00 0.00 571 A 8.07 4.06 1.41 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 0.00 572 A 8.61 3.82 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 0.00 573 Q 7.94 3.98 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 574 A 7.50 4.09 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 0.00 575 A 7.67 4.16 0.92 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 0.00 576 I 6.94 3.70 1.89 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.49 0.81 0.00 0.00 *581 W 7.78 4.54 0.00 3.30 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 582 N 8.05 4.59 0.00 2.45 2.45 0.00 0.00 7.19 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 0.00 583 C 7.45 2.45 0.00 2.75 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 0.00 584 Y 6.82 3.67 0.00 2.64 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 0.00 585 M 7.96 4.01 0.00 1.41 1.98 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.66 0.00 586 C 7.81 4.59 0.00 2.77 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 0.00 587 G 7.18 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 0.00 0.00 0.00 588 H 8.90 4.30 0.00 3.14 3.38 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 0.00 589 K 8.03 4.12 0.00 1.59 1.34 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.41 7.81 590 G 8.48 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 0.00 0.00 0.00 591 T 7.39 4.82 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 1.17 0.00 0.00 592 Y 8.95 4.50 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 0.00 593 G 8.08 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 0.00 0.00 0.00 0.00 594 L 8.93 4.16 0.00 1.79 1.71 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 595 L 7.92 4.32 0.00 1.51 1.55 -0.05 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 596 R 8.53 5.16 0.00 1.95 2.05 0.00 3.05 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.65 0.00 597 R 9.53 4.42 0.00 2.06 2.06 0.00 3.18 0.00 0.00 3.48 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.29 0.00 598 R 8.84 4.45 0.00 1.89 2.08 0.00 3.24 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.53 0.00 599 E 9.19 4.08 0.00 2.08 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 0.00 2.30 2.40 0.00 600 D 7.92 4.85 0.00 2.87 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 0.00 601 W 7.93 4.51 0.00 3.58 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 0.00 602 P 0.00 3.78 0.00 1.76 1.52 0.00 2.99 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.44 0.00 603 S 7.79 4.30 0.00 4.03 4.06 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 0.00 0.00 0.00 604 R 8.02 4.05 0.00 2.24 2.09 0.00 3.40 0.00 0.00 3.46 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.95 0.00 605 L 8.28 4.26 0.00 2.14 2.12 1.48 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 606 Q 7.68 4.13 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.95 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 607 M 7.78 4.21 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 608 F 8.77 4.07 0.00 3.07 3.33 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 0.00 609 F 9.22 4.27 0.00 3.26 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 * Residues marked with a * may have inaccurate shift predictions.