NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 480 A 4.2870 8.1185 123.5830 51.5987 19.9561 177.5503 481 A 4.0007 8.3670 122.3929 53.2847 18.3821 177.0415 482 G 3.8256 8.0812 103.1390 45.8302 0.0000 171.8111 483 L 4.5451 7.7701 121.9625 52.2108 42.6403 173.6158 484 P 4.8137 0.0000 0.0000 61.0350 33.3856 174.8053 485 Q 4.4752 8.5088 120.5826 54.3417 30.0981 174.4972 486 F 5.0365 8.1538 119.9448 54.4209 40.9303 173.6153 487 G 4.1440 9.3485 107.3727 45.4861 0.0000 173.9976 488 S 4.6265 7.6009 111.7708 55.8328 65.2392 172.9022 489 A 4.1925 8.5361 129.6836 52.0077 18.6359 177.6673 490 S 4.5935 8.4000 119.1348 56.9808 64.6358 173.8118 491 A 4.1418 8.2508 124.7141 51.9536 18.8095 177.4180 492 L 4.4720 8.2286 121.9882 53.0131 42.2299 176.6923 493 S 4.4475 8.3696 118.6848 57.5845 63.3820 173.2999 494 T 4.5065 8.0204 113.3338 60.6419 70.4989 174.1419 495 S 4.7833 8.0012 116.8347 55.9772 66.7510 173.6909 496 P 4.3143 0.0000 0.0000 65.1015 31.3349 177.4424 497 L 3.7644 8.1629 119.1582 56.2428 41.8101 177.4741 498 A 3.5199 8.2056 121.5068 51.6479 18.2380 175.7085 499 S 3.5862 8.4405 113.9043 58.4148 59.6381 169.8278 500 V 4.3130 7.7329 122.1308 59.9452 33.8012 174.9548 501 A 4.1228 8.5797 130.2128 51.8301 18.7748 176.1713 502 L 4.6075 8.3791 125.3200 53.3932 43.6456 175.4950 503 S 4.6464 8.3152 118.8637 56.2333 65.6087 172.6731 504 A 4.4151 8.4963 128.5040 51.1191 19.6263 176.7011 505 A 4.6791 8.4099 124.1343 50.2361 21.8080 176.2468 506 A 4.5188 8.2860 124.4374 49.8299 18.6029 176.5918 507 A 4.0831 8.3194 123.2672 52.8958 19.1256 177.8818 508 A 4.5243 8.3455 123.6637 50.0103 18.7774 174.7009 509 A 4.6100 8.1789 122.4507 50.3322 21.3708 176.3047 510 A 4.6707 8.4340 125.5645 50.8087 20.1582 178.3889 511 G 4.5150 8.6644 112.9892 48.4712 0.0000 172.8499 512 K 4.4045 7.5667 116.5467 55.0033 35.8607 175.1767 513 Q 3.9504 8.6766 120.2261 56.4871 29.4501 177.3931 514 I 4.2813 7.9519 121.6349 60.7941 37.7695 175.9290 515 E 4.2451 8.4608 121.0416 56.8904 29.8949 177.1126 516 G 4.0687 8.7980 109.0550 43.7096 0.0000 169.9193 517 P 4.2381 0.0000 0.0000 62.8215 31.2559 176.1538 518 E 4.9528 7.9271 122.5407 55.4983 30.3247 175.6949 519 G 3.6655 8.1677 107.6817 45.8085 0.0000 174.4063 520 C 5.1048 7.7373 118.5309 59.5861 29.2723 173.9073 521 N 4.4668 7.9653 115.2428 51.8806 40.9176 174.1388 522 L 4.9528 7.9278 121.5971 53.2522 46.3041 174.7830 523 F 5.1936 9.0826 127.7832 56.4091 41.9926 173.7172 524 I 5.7307 8.5926 119.4435 58.7726 40.9038 174.7562 525 Y 4.7852 8.4320 122.1180 56.5018 38.5626 173.1095 526 H 4.3839 8.7916 123.7823 56.6722 32.3869 172.9549 527 L 4.9703 7.8123 116.6516 51.5629 45.3657 174.7819 528 P 4.2665 0.0000 0.0000 62.4622 31.3016 176.7494 529 Q 4.3107 8.8614 115.5688 59.3816 28.0181 178.1497 530 E 4.1071 8.2459 116.4261 58.0002 29.7339 176.4682 531 F 4.4264 8.6375 122.6239 58.3239 39.4300 174.4120 532 T 4.3760 7.8512 124.9684 61.7097 70.5929 175.6713 533 D 3.9616 8.1225 124.1882 56.5349 39.5378 178.7205 534 T 3.8322 7.6981 114.2740 64.7579 67.4305 175.5295 535 D 4.1843 7.5110 120.1336 56.9481 41.3087 178.1304 536 L 3.6656 7.7047 119.5935 58.6869 40.3358 178.6463 537 A 3.7481 7.3269 120.7289 54.7286 18.5130 179.0677 538 S 4.1195 7.7443 111.3031 61.8574 62.1647 176.4255 539 T 3.8384 7.1051 116.8419 66.5625 68.5468 176.1269 540 F 4.5853 7.1363 114.2479 57.9085 37.8746 177.0759 541 L 3.5811 7.4460 120.4664 57.8740 41.4623 176.5714 542 P 4.2469 0.0000 0.0000 65.5467 32.0176 175.8692 543 F 4.5185 9.3626 115.8845 61.8002 37.6993 175.5483 544 G 4.4092 6.3096 107.7540 43.7892 0.0000 175.4749 545 N 4.0095 9.0000 128.3923 53.3809 39.2009 172.8380 546 V 4.2863 8.0799 117.9490 59.7961 33.2288 176.0665 547 I 5.1155 9.2225 127.8168 58.8489 39.4028 174.8085 548 S 5.2928 8.7505 121.6466 56.4395 66.1580 172.9512 549 A 5.7512 9.0703 122.5881 49.1004 22.9812 174.7780 550 K 4.7069 8.5959 117.1384 55.0522 36.2300 176.6916 551 V 3.7842 7.4994 120.8931 59.5309 33.1246 173.9400 552 F 4.8849 6.9651 121.5806 56.2244 39.6089 175.1904 553 I 4.7916 8.0707 121.9151 59.6924 40.6431 174.5926 554 D 4.8312 8.7123 125.1089 53.3692 44.2381 174.5470 555 K 3.6934 8.4381 126.1765 58.7327 31.9243 176.4557 556 Q 4.4035 7.1904 119.5069 56.6722 31.2539 176.2283 557 T 4.4961 7.5057 112.7081 62.0029 70.0578 174.7208 558 S 4.5352 8.1764 113.1020 57.7849 62.6636 172.7905 559 L 4.6170 7.7485 120.3038 53.5744 42.7686 175.2695 560 S 5.0713 8.5325 119.8204 56.2680 63.6842 172.5462 561 K 4.6549 8.3760 124.7729 56.2724 36.3378 175.0523 562 C 5.1520 8.3401 122.4569 59.0085 36.2221 171.6737 563 F 5.5197 8.6298 114.9874 55.0689 41.5648 173.8758 564 G 3.9646 9.2869 105.8136 44.2709 0.0000 171.7015 565 F 5.5948 8.3756 119.0273 55.4813 42.4837 175.1090 566 V 4.9264 8.7465 120.7621 60.2393 35.6189 174.3514 567 S 4.7217 9.2479 116.6863 56.9692 65.2592 172.3178 568 F 5.7893 8.7650 127.2102 56.5497 40.9413 175.1066 569 D 5.7747 9.0330 123.7055 51.4469 42.1532 174.2482 570 N 5.0402 8.0835 120.9192 52.1170 43.2104 170.8601 571 P 4.6961 0.0000 0.0000 62.0077 32.1583 176.6223 572 D 4.4690 8.7887 117.1414 57.7366 40.3445 178.2166 573 S 4.1805 8.2621 114.3691 61.9533 63.2179 176.0256 574 A 4.3725 8.2625 123.0753 55.2482 18.1621 179.5935 575 Q 3.9954 8.1653 116.4022 59.2381 28.9264 179.3619 576 V 3.6889 8.4296 120.2257 64.8309 30.7695 178.2561 577 A 4.1443 8.0278 121.1666 54.9793 17.9809 179.7834 578 I 3.6558 7.5462 116.9817 64.4586 37.4463 178.3793 579 K 4.1225 7.7921 117.6876 59.4110 32.0751 179.1376 580 A 4.2787 7.8815 119.1031 52.8783 18.5736 177.0375 581 M 4.7042 7.2264 115.5193 53.3889 34.8369 174.9640 582 N 4.6658 8.9432 123.3213 53.5294 39.3869 174.7347 583 G 4.1987 8.5756 106.5910 45.3005 0.0000 173.0333 584 F 5.0935 7.8925 121.4944 56.3912 41.2402 172.8885 585 Q 4.8752 9.0855 126.6341 54.4500 29.9773 175.1275 586 V 4.2869 7.5780 121.3253 60.1075 34.5758 175.3478 587 G 4.0887 8.5961 113.2579 48.9346 0.0000 174.2213 588 T 4.5750 7.0872 108.4680 58.9540 69.4098 172.3934 589 K 4.2628 7.4207 125.6505 56.4676 36.1602 174.4739 590 R 4.7229 7.9406 121.3483 54.3365 32.9072 174.3472 591 L 4.0381 8.1475 127.7826 54.5991 43.2831 176.1860 592 K 4.2347 8.4059 127.1906 55.7122 33.2029 175.9555 593 V 4.4584 8.3942 128.8911 60.7354 32.4339 175.4322 594 Q 4.5341 8.7224 126.2541 54.2259 30.1493 175.0806 595 L 4.6404 8.4905 126.9829 54.2890 43.7766 176.4178 596 K 4.2472 8.6350 127.2242 56.3283 35.5662 176.9969 *597 K 4.8718 8.5057 125.2268 54.9048 32.3784 172.0826 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 480 A 8.12 4.29 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 0.00 481 A 8.37 4.00 1.33 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 0.00 0.00 482 G 8.08 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 0.00 483 L 7.77 4.55 0.00 1.57 1.59 0.95 1.00 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 0.00 484 P 0.00 4.81 0.00 2.30 2.06 0.00 3.89 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 485 Q 8.51 4.48 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.68 0.00 0.00 0.00 0.00 0.00 2.13 2.27 0.00 486 F 8.15 5.04 0.00 3.17 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 0.00 487 G 9.35 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 0.00 488 S 7.60 4.63 0.00 3.77 3.69 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 0.00 489 A 8.54 4.19 1.26 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 0.00 0.00 490 S 8.40 4.59 0.00 3.88 3.81 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 0.00 491 A 8.25 4.14 1.24 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 0.00 0.00 0.00 492 L 8.23 4.47 0.00 1.63 1.63 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 493 S 8.37 4.45 0.00 3.83 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 0.00 494 T 8.02 4.51 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 1.21 0.00 0.00 495 S 8.00 4.78 0.00 3.84 3.73 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 0.00 496 P 0.00 4.31 0.00 2.04 2.13 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 497 L 8.16 3.76 0.00 1.58 1.73 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 498 A 8.21 3.52 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 0.00 499 S 8.44 3.59 0.00 3.99 3.88 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 0.00 500 V 7.73 4.31 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 0.97 0.00 0.00 0.93 0.00 0.00 501 A 8.58 4.12 1.25 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 0.00 502 L 8.38 4.61 0.00 1.59 1.57 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 503 S 8.32 4.65 0.00 3.81 3.66 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 0.00 0.00 0.00 0.00 504 A 8.50 4.42 1.25 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 0.00 505 A 8.41 4.68 1.22 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 0.00 0.00 0.00 506 A 8.29 4.52 1.33 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 0.00 0.00 507 A 8.32 4.08 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 0.00 508 A 8.35 4.52 1.23 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 0.00 0.00 509 A 8.18 4.61 1.24 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 0.00 0.00 0.00 510 A 8.43 4.67 1.36 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 0.00 0.00 511 G 8.66 4.51 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 0.00 512 K 7.57 4.40 0.00 1.96 1.72 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.66 7.81 513 Q 8.68 3.95 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 514 I 7.95 4.28 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 1.41 0.92 0.92 0.00 0.00 515 E 8.46 4.25 0.00 1.97 1.92 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 2.33 2.26 0.00 516 G 8.80 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 0.00 517 P 0.00 4.24 0.00 2.26 2.25 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 518 E 7.93 4.95 0.00 2.00 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 2.34 2.45 0.00 519 G 8.17 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 0.00 520 C 7.74 5.10 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 0.00 521 N 7.97 4.47 0.00 2.56 2.78 0.00 0.00 6.44 7.51 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 0.00 522 L 7.93 4.95 0.00 1.07 0.59 0.72 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 523 F 9.08 5.19 0.00 3.18 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 0.00 524 I 8.59 5.73 1.99 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 1.47 1.76 1.04 0.00 0.00 525 Y 8.43 4.79 0.00 3.03 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 0.00 526 H 8.79 4.38 0.00 2.97 3.08 0.00 5.68 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 0.00 527 L 7.81 4.97 0.00 1.86 1.52 -0.59 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 528 P 0.00 4.27 0.00 2.30 2.22 0.00 3.72 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.02 0.00 529 Q 8.86 4.31 0.00 2.25 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.06 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 530 E 8.25 4.11 0.00 2.12 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 2.39 2.36 0.00 531 F 8.64 4.43 0.00 3.23 3.18 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 0.00 532 T 7.85 4.38 4.08 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 0.00 0.00 1.13 0.00 0.00 533 D 8.12 3.96 0.00 2.89 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 0.00 534 T 7.70 3.83 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 0.00 535 D 7.51 4.18 0.00 2.80 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 0.00 536 L 7.70 3.67 0.00 2.31 2.15 1.18 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 537 A 7.33 3.75 1.57 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 0.00 0.00 538 S 7.74 4.12 0.00 4.05 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 0.00 539 T 7.11 3.84 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 1.20 0.00 0.00 540 F 7.14 4.59 0.00 3.08 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 0.00 541 L 7.45 3.58 0.00 1.75 1.77 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 542 P 0.00 4.25 0.00 2.12 2.20 0.00 3.84 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 543 F 9.36 4.52 0.00 2.68 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 0.00 544 G 6.31 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 0.00 545 N 9.00 4.01 0.00 2.98 2.86 0.00 0.00 6.73 7.67 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 0.00 546 V 8.08 4.29 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 -0.57 0.00 0.00 0.82 0.00 0.00 547 I 9.22 5.12 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 2.31 1.10 0.00 0.00 548 S 8.75 5.29 0.00 4.03 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 0.00 549 A 9.07 5.75 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 K 8.60 4.71 0.00 1.49 1.53 0.00 1.52 0.00 0.00 1.76 0.00 0.00 3.24 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.29 1.42 7.81 551 V 7.50 3.78 1.36 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 -2.96 0.00 0.00 0.41 0.00 0.00 552 F 6.97 4.88 0.00 3.01 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 553 I 8.07 4.79 2.24 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 1.30 1.15 1.00 0.00 0.00 554 D 8.71 4.83 0.00 2.64 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 0.00 555 K 8.44 3.69 0.00 1.74 1.79 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.75 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.42 7.81 556 Q 7.19 4.40 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.66 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 557 T 7.51 4.50 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 1.21 0.00 0.00 558 S 8.18 4.54 0.00 3.87 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 0.00 559 L 7.75 4.62 0.00 1.85 1.59 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 560 S 8.53 5.07 0.00 3.86 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 0.00 561 K 8.38 4.65 0.00 1.93 1.94 0.00 1.39 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.45 7.81 562 C 8.34 5.15 0.00 3.21 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 0.00 563 F 8.63 5.52 0.00 3.24 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 0.00 564 G 9.29 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 565 F 8.38 5.59 0.00 2.93 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 0.00 566 V 8.75 4.93 2.36 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 0.53 0.00 0.00 1.46 0.00 0.00 567 S 9.25 4.72 0.00 4.07 3.89 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 0.00 568 F 8.77 5.79 0.00 3.02 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 0.00 569 D 9.03 5.77 0.00 2.65 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 0.00 570 N 8.08 5.04 0.00 2.92 2.73 0.00 0.00 7.18 7.69 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 0.00 571 P 0.00 4.70 0.00 2.25 2.02 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 572 D 8.79 4.47 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 0.00 573 S 8.26 4.18 0.00 3.94 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 0.00 574 A 8.26 4.37 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 0.00 0.00 0.00 0.00 0.00 575 Q 8.17 4.00 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 576 V 8.43 3.69 2.14 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 0.85 0.00 0.00 0.97 0.00 0.00 577 A 8.03 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 578 I 7.55 3.66 1.89 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.66 0.73 0.00 0.00 579 K 7.79 4.12 0.00 1.75 1.87 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.63 7.81 580 A 7.88 4.28 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 M 7.23 4.70 0.00 2.33 2.02 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 2.64 2.66 0.00 582 N 8.94 4.67 0.00 2.77 2.90 0.00 0.00 6.86 7.65 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 0.00 583 G 8.58 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 F 7.89 5.09 0.00 1.96 2.24 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 0.00 585 Q 9.09 4.88 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.60 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 586 V 7.58 4.29 1.61 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 0.72 0.00 0.00 0.30 0.00 0.00 587 G 8.60 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 0.00 588 T 7.09 4.57 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 1.18 0.00 0.00 589 K 7.42 4.26 0.00 1.53 1.38 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.26 1.26 7.81 590 R 7.94 4.72 0.00 1.56 1.53 0.00 3.12 0.00 0.00 3.09 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.51 0.00 591 L 8.15 4.04 0.00 1.72 1.47 0.46 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 592 K 8.41 4.23 0.00 1.40 1.57 0.00 1.77 0.00 0.00 1.87 0.00 0.00 2.78 0.00 0.00 2.16 0.00 0.00 0.00 0.00 1.50 1.37 7.81 593 V 8.39 4.46 2.14 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 0.85 0.00 0.00 1.05 0.00 0.00 594 Q 8.72 4.53 0.00 2.39 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.02 0.00 0.00 0.00 0.00 0.00 2.43 2.67 0.00 595 L 8.49 4.64 0.00 1.58 1.52 0.89 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 596 K 8.64 4.25 0.00 1.80 1.82 0.00 1.42 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.36 7.81 *597 K 8.51 4.87 0.00 1.76 1.62 0.00 1.50 0.00 0.00 2.39 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.46 7.81 * Residues marked with a * may have inaccurate shift predictions.