NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 520 Q 4.3655 8.3293 119.0916 54.4037 30.7965 175.3806 521 P 4.4170 0.0000 0.0000 61.1109 32.5630 175.3527 522 L 3.6396 8.7694 121.5208 58.1331 42.6331 180.5936 523 S 4.0295 7.9579 111.4842 61.2439 62.1050 175.1296 524 G 3.7045 8.1596 106.5539 45.8926 0.0000 173.4844 525 Y 3.5273 7.8341 119.9035 56.5721 38.3189 175.3136 526 P 4.0911 0.0000 0.0000 64.6876 31.6684 177.5472 527 W 4.2679 6.5582 114.5200 56.1728 28.9302 175.1531 528 F 5.1191 7.4892 122.8000 58.0435 39.3068 174.6801 529 H 4.5663 8.7073 124.7423 54.8250 29.8283 176.6057 530 G 3.4563 5.5433 108.4305 46.3061 0.0000 174.4554 531 M 4.6126 8.2480 114.4442 53.6603 30.7698 176.0680 532 L 4.3144 7.3221 122.5643 53.8677 43.9167 176.9387 533 S 4.4745 8.3353 120.0220 57.9502 65.1885 175.0799 534 R 3.8093 8.6108 123.7917 59.7717 29.7174 178.5579 535 L 3.9262 7.8196 119.2259 58.1126 42.1147 178.9178 536 K 3.9375 8.0397 118.1388 59.3387 32.0207 178.9349 537 A 3.9505 8.2294 121.0198 55.2931 18.1624 179.4074 538 A 3.9265 8.1887 119.0804 55.4967 18.2303 179.7120 539 Q 3.9697 7.8731 115.0864 59.2350 28.6945 179.0199 540 L 4.1548 8.1660 119.9947 57.8922 41.5398 179.6045 541 V 3.9027 7.6137 109.4461 62.7088 31.9381 177.4832 542 L 4.6450 7.7888 121.0843 54.8072 41.7137 176.3366 543 E 4.1213 7.3792 115.0098 59.1145 29.6870 181.9283 544 G 4.1288 9.5327 112.0446 44.0288 0.0000 174.5771 545 G 3.9898 8.5602 109.7709 45.4985 0.0000 174.5809 546 T 4.1166 8.4631 107.9600 64.2243 68.8864 176.4952 547 G 3.6504 7.5206 109.9247 48.0854 0.0000 174.3341 548 S 4.5482 8.3852 116.0573 58.3289 62.8804 172.9906 549 H 4.4428 7.7737 121.2042 58.6408 29.6848 175.2307 550 G 4.0685 9.3515 115.7367 44.9789 0.0000 173.1033 551 V 5.0356 8.7006 121.5224 62.6333 32.9714 175.1306 552 F 5.9505 8.3201 120.8287 56.1510 41.8641 172.3496 553 L 4.7032 8.3608 115.8006 55.5697 43.1787 173.2424 554 V 5.2958 8.8194 120.1702 61.2653 34.4432 174.5506 555 R 4.8874 9.1429 123.0875 54.4983 33.5083 174.0209 556 Q 4.7843 8.8919 119.6957 54.8605 30.4498 175.5977 557 S 4.3800 8.6731 118.2671 58.8833 62.5873 174.2248 558 E 4.3268 8.9190 124.6042 57.9909 29.8256 177.3899 559 T 4.6072 7.8043 105.1351 60.4083 70.7546 173.7345 560 R 4.6174 8.0528 122.3613 53.8102 32.3412 175.3750 561 R 3.9893 8.5684 123.1479 57.5013 30.8554 176.1099 562 G 3.9691 8.9680 111.5699 46.1962 0.0000 171.8294 563 E 5.2115 7.8358 119.1514 54.2826 32.8226 174.5422 564 C 5.4753 9.2994 123.0938 58.0047 33.1520 172.8374 565 V 4.8277 9.2156 119.2446 61.2654 34.9955 174.0861 566 L 5.0131 9.3730 130.1697 54.2193 43.2761 174.8070 567 T 5.1609 8.8746 124.6505 62.2722 70.3466 174.3355 568 F 5.5060 8.7395 120.4637 55.3829 42.4247 172.8874 569 N 5.1252 9.6692 119.6163 52.8349 40.1881 173.4367 570 F 5.0569 9.6445 132.2424 57.3982 41.8937 175.6428 571 Q 3.2011 10.0707 124.5984 55.7066 25.2904 171.1033 572 G 4.0716 8.7096 105.5860 45.8111 0.0000 174.2943 573 K 4.5821 8.4730 118.5948 54.0626 35.4011 174.7925 574 A 4.6479 8.3904 123.3366 51.2380 19.4648 176.9568 575 K 4.3781 8.5535 122.3260 54.6775 35.6926 175.1278 576 H 5.1964 8.4461 118.8439 53.9859 32.2059 172.4665 577 L 4.7783 8.9074 125.7396 53.0185 44.2453 175.8269 578 R 4.5691 8.8240 125.7437 56.3135 31.1754 175.9996 579 L 4.7741 9.3740 122.9994 53.0651 44.9051 175.2410 580 S 5.0567 9.2228 120.0034 56.9070 63.8607 173.1277 581 L 5.8795 9.4083 127.1946 52.3444 44.6362 174.9002 582 N 5.0752 8.3503 116.2339 50.4537 40.5113 175.0202 583 A 3.8592 8.7068 120.4509 55.2013 18.2861 178.2583 584 A 4.2695 8.1717 116.1712 52.0668 18.9221 178.0827 585 G 3.9528 8.5459 105.5151 46.1454 0.0000 173.9958 586 Q 4.6637 8.3811 119.2280 55.1821 30.3528 174.6557 587 C 5.1935 8.8035 122.4167 57.7454 34.3213 172.3479 588 R 4.7921 9.3594 127.3860 54.7589 32.1696 175.1162 589 V 4.1019 8.5121 126.2972 62.7471 31.8584 178.0196 590 Q 3.6020 8.8079 128.2325 56.7790 26.9324 174.7574 591 H 4.5476 9.4227 123.8206 57.1415 30.3457 176.1815 592 L 3.9112 7.3899 121.6489 54.2359 42.1712 175.3741 593 H 4.8917 7.8602 119.1866 53.8538 31.7895 173.1732 594 F 5.0206 8.6243 121.2643 55.6985 42.8156 175.9697 595 Q 4.1664 8.7077 120.6915 58.4708 29.2500 176.0014 596 S 5.2982 7.3533 112.3719 57.3722 66.5949 175.8334 597 I 3.6382 8.1400 122.5209 64.3177 36.7705 178.4982 598 F 3.9134 8.0805 121.1675 61.2498 39.2321 176.7178 599 D 4.1439 7.8635 118.4182 57.3833 40.5604 178.4298 600 M 2.0000 7.2283 118.3845 57.8301 31.8489 178.2978 601 L 3.4376 7.0336 117.9895 57.6003 42.0722 179.0045 602 E 3.7124 7.7354 118.7174 59.3385 29.2625 178.8646 603 H 3.9580 7.8128 118.3180 59.2610 29.9961 176.7479 604 F 5.5779 7.3619 118.2363 58.0265 38.4327 176.9428 605 R 4.3409 7.4753 119.0984 57.4967 30.1286 176.8387 606 V 3.9792 7.4053 116.4069 64.0263 33.0259 175.1818 607 H 4.8648 8.4375 117.5156 53.0494 30.1410 172.9256 608 P 4.7589 0.0000 0.0000 62.3470 31.8493 176.1838 609 I 3.0940 7.8117 122.5243 60.7109 37.2373 176.0499 610 P 4.6159 0.0000 0.0000 62.1875 29.1460 176.1253 611 L 4.0748 7.3156 121.6917 55.4442 42.6900 177.3958 612 E 4.1953 8.5733 122.1849 57.6765 30.0924 176.5840 613 S 4.3809 7.4538 114.1505 55.8285 63.1889 171.3047 *617 S 4.1442 8.0866 115.4685 57.6633 63.6338 174.4959 618 D 4.9982 8.5710 125.4408 54.2561 42.3263 175.9824 619 V 4.6559 8.0946 117.6786 61.0242 34.4242 173.8443 620 V 4.8040 8.2429 116.9686 58.9898 35.6263 175.3442 621 L 4.0838 8.7028 124.0715 55.1159 41.7355 176.3380 622 V 4.3786 8.6646 123.7467 64.0288 32.5242 175.6267 623 S 4.9569 8.0293 113.1938 56.8159 66.8502 171.3735 624 Y 4.6340 7.4925 117.8310 54.7547 40.7833 175.1460 625 V 4.0924 8.2711 121.5514 61.6739 32.0455 174.1776 626 P 4.9784 0.0000 0.0000 62.8822 32.2463 176.6012 627 S 4.1334 8.1871 115.7152 58.5501 63.1561 173.8998 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 520 Q 8.33 4.37 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 521 P 0.00 4.42 0.00 2.24 2.16 0.00 3.62 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 1.99 2.00 0.00 522 L 8.77 3.64 0.00 1.34 0.70 0.72 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 523 S 7.96 4.03 0.00 3.82 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 0.00 524 G 8.16 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 Y 7.83 3.53 0.00 2.03 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 0.00 526 P 0.00 4.09 0.00 1.99 2.22 0.00 3.26 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.93 0.00 527 W 6.56 4.27 0.00 3.54 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 0.00 528 F 7.49 5.12 0.00 2.61 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 529 H 8.71 4.57 0.00 2.94 3.16 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 G 5.54 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 531 M 8.25 4.61 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 532 L 7.32 4.31 0.00 1.74 1.50 0.92 1.00 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 0.00 533 S 8.34 4.47 0.00 4.08 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 0.00 534 R 8.61 3.81 0.00 1.83 1.94 0.00 3.08 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.36 0.00 535 L 7.82 3.93 0.00 1.79 1.64 0.92 0.57 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 0.00 536 K 8.04 3.94 0.00 1.95 1.84 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.60 7.81 537 A 8.23 3.95 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 0.00 0.00 538 A 8.19 3.93 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 0.00 539 Q 7.87 3.97 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.63 0.00 540 L 8.17 4.15 0.00 1.82 1.72 0.93 1.26 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 0.00 541 V 7.61 3.90 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 0.86 0.00 0.00 1.03 0.00 0.00 542 L 7.79 4.64 0.00 1.84 1.69 0.92 0.91 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 0.00 543 E 7.38 4.12 0.00 2.00 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 2.26 2.14 0.00 544 G 9.53 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 0.00 545 G 8.56 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 0.00 546 T 8.46 4.12 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 1.22 0.00 0.00 547 G 7.52 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 S 8.39 4.55 0.00 4.03 3.90 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 0.00 549 H 7.77 4.44 0.00 3.18 3.25 0.00 5.91 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 G 9.35 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 0.00 551 V 8.70 5.04 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 0.80 0.00 0.00 0.99 0.00 0.00 552 F 8.32 5.95 0.00 3.42 3.24 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 0.00 553 L 8.36 4.70 0.00 1.66 1.69 0.93 0.19 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 0.00 554 V 8.82 5.30 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 1.34 0.00 0.00 1.16 0.00 0.00 555 R 9.14 4.89 0.00 1.93 1.91 0.00 3.02 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 556 Q 8.89 4.78 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 557 S 8.67 4.38 0.00 3.94 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 0.00 558 E 8.92 4.33 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 559 T 7.80 4.61 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 1.22 0.00 0.00 560 R 8.05 4.62 0.00 1.88 1.87 0.00 3.34 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 561 R 8.57 3.99 0.00 1.77 1.85 0.00 3.41 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 562 G 8.97 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 0.00 563 E 7.84 5.21 0.00 2.17 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 2.24 2.43 0.00 564 C 9.30 5.48 0.00 2.98 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 0.00 565 V 9.22 4.83 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 1.16 0.00 0.00 0.98 0.00 0.00 566 L 9.37 5.01 0.00 1.83 1.81 0.98 0.54 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 0.00 567 T 8.87 5.16 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 568 F 8.74 5.51 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 0.00 569 N 9.67 5.13 0.00 3.02 2.96 0.00 0.00 6.96 7.59 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 0.00 570 F 9.64 5.06 0.00 3.18 2.85 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 0.00 0.00 0.00 571 Q 10.07 3.20 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.20 1.90 0.00 572 G 8.71 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 0.00 573 K 8.47 4.58 0.00 1.92 1.68 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.36 7.81 574 A 8.39 4.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 K 8.55 4.38 0.00 0.79 1.01 0.00 1.37 0.00 0.00 1.46 0.00 0.00 2.80 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.02 1.06 7.81 576 H 8.45 5.20 0.00 2.97 3.18 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 577 L 8.91 4.78 0.00 1.95 1.63 0.88 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 578 R 8.82 4.57 0.00 1.78 1.89 0.00 3.22 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 579 L 9.37 4.77 0.00 1.66 1.61 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 580 S 9.22 5.06 0.00 3.90 3.90 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 0.00 581 L 9.41 5.88 0.00 1.53 1.59 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 582 N 8.35 5.08 0.00 2.90 2.91 0.00 0.00 5.79 7.54 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 0.00 583 A 8.71 3.86 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 A 8.17 4.27 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 0.00 585 G 8.55 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 0.00 0.00 0.00 586 Q 8.38 4.66 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.25 0.00 587 C 8.80 5.19 0.00 3.05 2.85 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 0.00 0.00 0.00 588 R 9.36 4.79 0.00 1.85 1.74 0.00 3.02 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.29 0.00 589 V 8.51 4.10 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 1.09 0.00 0.00 1.14 0.00 0.00 590 Q 8.81 3.60 0.00 2.30 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 591 H 9.42 4.55 0.00 3.23 3.38 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 592 L 7.39 3.91 0.00 1.69 0.89 1.13 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 593 H 7.86 4.89 0.00 2.88 3.01 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 594 F 8.62 5.02 0.00 3.08 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 0.00 595 Q 8.71 4.17 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.67 0.00 0.00 0.00 0.00 0.00 2.48 2.31 0.00 596 S 7.35 5.30 0.00 4.03 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 0.00 597 I 8.14 3.64 1.95 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.69 0.85 0.00 0.00 598 F 8.08 3.91 0.00 3.07 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 D 7.86 4.14 0.00 2.80 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 600 M 7.23 2.00 0.00 1.77 1.30 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 1.79 0.00 601 L 7.03 3.44 0.00 1.05 1.08 -0.68 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 602 E 7.74 3.71 0.00 1.70 1.73 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 1.61 1.47 0.00 603 H 7.81 3.96 0.00 2.97 2.68 0.00 5.58 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 604 F 7.36 5.58 0.00 2.82 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 605 R 7.48 4.34 0.00 1.79 2.04 0.00 3.25 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.74 0.00 606 V 7.41 3.98 1.89 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 0.64 0.00 0.00 0.84 0.00 0.00 607 H 8.44 4.86 0.00 3.17 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 608 P 0.00 4.76 0.00 2.18 2.06 0.00 3.83 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 2.02 2.01 0.00 609 I 7.81 3.09 1.45 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.19 -0.10 0.36 0.00 0.00 610 P 0.00 4.62 0.00 2.21 2.14 0.00 3.59 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 611 L 7.32 4.07 0.00 1.48 1.47 0.37 0.96 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 0.00 612 E 8.57 4.20 0.00 1.90 1.94 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 2.24 2.31 0.00 613 S 7.45 4.38 0.00 3.77 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 *617 S 8.09 4.14 0.00 3.91 3.90 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 0.00 618 D 8.57 5.00 0.00 2.63 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 0.00 619 V 8.09 4.66 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.97 0.00 0.00 620 V 8.24 4.80 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 0.73 0.00 0.00 0.92 0.00 0.00 621 L 8.70 4.08 0.00 1.21 0.84 0.15 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 622 V 8.66 4.38 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 0.81 0.00 0.00 0.96 0.00 0.00 623 S 8.03 4.96 0.00 3.70 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 0.00 624 Y 7.49 4.63 0.00 2.53 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 0.00 0.00 0.00 625 V 8.27 4.09 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 0.86 0.00 0.00 0.96 0.00 0.00 626 P 0.00 4.98 0.00 2.22 2.26 0.00 3.88 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.02 0.00 627 S 8.19 4.13 0.00 3.77 3.50 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 * Residues marked with a * may have inaccurate shift predictions.