NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 510 S 4.4445 8.1927 115.2942 57.8928 63.9003 173.7128 511 F 4.1794 9.0414 130.1670 61.2309 39.2035 175.4032 512 I 3.4132 8.7165 120.1461 64.7996 37.4098 177.5041 513 D 4.3597 8.1385 118.7127 57.4320 40.0569 178.8770 514 R 3.9299 7.8358 119.1309 59.1190 29.9718 178.8069 515 V 3.7605 7.7555 118.2454 65.9068 31.5114 178.0098 516 K 3.8969 8.3831 118.4436 59.6713 31.6733 179.1084 517 A 4.0596 7.8926 119.8999 54.9260 18.3160 179.1056 518 L 4.1549 7.4464 117.4142 57.8622 42.5707 178.6944 519 L 4.2004 8.3406 119.0321 56.0551 41.8256 177.9028 520 G 3.8833 8.9732 107.9349 46.9099 0.0000 176.8295 521 E 4.1802 8.9056 124.3414 57.7305 29.4735 177.8182 522 R 4.0228 7.6632 117.5301 58.3144 30.3061 176.8052 523 V 4.5582 7.1260 114.5870 60.4972 34.7757 175.0825 524 K 4.1802 9.2183 126.4520 59.5369 32.6156 176.2269 525 D 4.5549 7.5648 116.2108 53.6156 44.6642 174.4758 526 V 5.0034 8.4570 121.6905 61.2883 34.0225 174.6754 527 R 4.7739 8.9130 125.1082 54.8633 35.1514 173.7229 528 L 5.2061 8.4120 120.1876 53.7115 43.6815 175.8416 529 T 4.7565 8.5761 111.6119 60.5519 71.9647 173.2031 530 H 4.8941 8.6116 114.7197 55.1319 30.7055 175.4614 531 R 3.8281 8.0871 115.6563 57.4902 29.7557 176.3769 532 L 4.6780 7.0730 118.3560 53.7385 42.9519 174.4944 533 T 4.5080 7.4328 113.2372 65.1607 71.5404 175.1289 534 D 4.5142 8.0436 126.6821 56.9192 41.8462 177.0750 535 T 4.3459 7.7474 116.4686 62.1717 69.4038 172.8806 536 P 4.4310 0.0000 0.0000 65.1135 32.7163 175.7814 537 A 5.1076 7.7567 119.0438 50.5490 22.4999 175.0065 538 I 4.8402 8.8317 118.6784 59.5247 42.2637 174.0892 539 V 5.1648 8.3066 124.8237 60.0611 34.2274 174.5090 540 S 4.9860 9.2911 117.3026 57.2511 67.2302 172.3421 541 T 4.9787 8.3452 115.1419 61.5972 71.5525 174.4564 542 D 4.4944 8.6776 124.2588 53.8457 41.8570 177.0710 543 A 3.9543 8.7765 125.8539 55.3943 18.1978 178.4914 544 D 4.7628 8.0238 111.0252 53.1973 39.2191 175.9473 545 E 4.2819 7.4311 116.9077 57.8212 32.1993 176.1637 *547 S 4.2464 7.4712 114.2441 58.1791 64.9950 174.1995 548 T 4.0358 8.5738 117.7191 67.2152 68.5218 177.7970 549 Q 4.0739 8.1007 118.6588 56.6218 28.6450 177.4833 *551 A 4.4258 8.1005 121.2768 51.6925 20.6112 180.0578 552 K 4.1678 7.9646 114.8780 59.4438 31.8992 179.4058 553 L 3.9540 7.9309 119.1123 57.9321 41.4898 179.4086 554 F 3.7929 8.0633 115.8978 60.5176 38.8659 177.5669 555 A 4.3957 8.4301 120.7368 54.7853 18.0751 179.3397 556 A 4.0843 8.0644 117.8794 55.0098 18.4353 178.7359 557 A 4.3480 7.9533 117.0659 51.8815 18.5579 178.0018 558 G 3.8472 8.1807 106.2511 46.6104 0.0000 173.9969 559 Q 4.6992 8.1111 118.7270 53.3436 30.9026 175.4951 560 K 4.1286 8.3516 119.6104 56.3272 32.6730 177.2892 561 V 3.7229 8.1937 123.1245 61.9137 31.9007 174.2968 562 P 4.2797 0.0000 0.0000 61.7189 31.8991 175.7553 563 E 3.9455 8.3528 121.1178 56.2767 30.1121 176.2669 564 V 4.0880 8.0360 124.3224 60.7227 33.9077 174.6947 565 K 4.3894 8.1631 126.0078 54.8293 33.7625 175.5274 566 Y 4.6632 8.3504 122.9599 57.6283 40.1313 174.6909 567 I 4.8009 9.1099 122.7012 59.8134 39.4444 174.8467 568 F 5.1782 9.2560 131.2179 57.6074 40.4093 174.0490 569 E 5.1445 9.2878 126.3174 54.5020 32.4288 175.2501 570 L 4.9523 8.6855 123.0496 52.8470 46.0603 175.3256 571 N 4.9517 8.9705 121.5073 51.7485 39.1867 173.8651 572 P 4.2212 0.0000 0.0000 65.6777 31.6160 177.1745 573 D 4.7081 8.1354 115.5940 54.5245 40.7987 175.7650 574 H 4.6988 7.8035 119.5257 54.3362 32.1777 175.2628 575 V 3.4757 8.1330 127.7987 66.5288 31.2771 178.2606 576 L 3.6370 8.0301 117.7147 57.5987 41.4473 179.6434 577 V 3.5216 7.6592 117.5828 65.8740 31.5549 177.9516 578 K 3.6533 8.0869 118.5192 59.5464 31.9055 179.2838 579 R 3.7023 8.1775 118.8948 59.1682 29.5871 178.4234 580 A 3.9734 7.3787 119.8000 54.7585 18.4817 179.1997 581 A 4.0488 7.5437 118.6838 55.3471 18.4387 179.3525 582 D 4.4345 8.1171 116.8380 56.3043 41.0591 177.3832 583 T 3.8521 7.2943 113.4819 62.9394 67.5231 173.3689 584 E 4.1227 8.7849 128.0476 58.3408 30.3720 176.7588 585 D 4.4564 7.6930 119.4287 54.0682 41.9591 176.3176 586 E 4.1550 9.0161 127.5546 59.5951 29.5340 179.2650 587 A 4.0501 8.1709 120.2592 54.9369 18.5951 179.4059 588 K 3.8786 8.1253 118.3229 59.6271 32.3602 178.3924 589 F 4.3926 8.8411 121.4901 61.7730 39.1750 177.0688 590 S 3.9651 8.2241 112.1117 61.4508 62.1904 175.7713 591 E 3.8634 8.0179 121.1555 59.4531 29.1424 179.5867 592 W 4.0663 8.1665 118.7337 59.5049 29.0249 178.9114 593 V 3.6532 7.7814 118.2545 66.1870 31.0372 177.8757 594 E 3.9515 8.4848 118.7569 59.2996 29.2363 179.3521 595 L 4.1063 7.9126 120.3132 58.2453 42.2466 178.9704 596 L 4.1878 8.3338 119.1619 57.6543 41.5394 179.2820 597 L 3.3926 8.4157 120.6985 58.1739 41.9238 178.7229 598 D 4.0655 7.8709 118.7225 57.3568 40.5312 178.8737 599 Q 3.9074 8.1570 118.2342 58.8185 28.6774 178.8191 600 A 3.9336 7.9444 121.7214 55.2279 18.5057 179.7382 601 L 3.5532 8.0293 117.9196 57.5531 41.4832 179.6085 602 L 3.8481 8.0658 120.6326 57.9543 41.8276 178.8474 603 A 3.9427 7.9636 119.9552 54.6317 18.2811 179.0343 604 E 4.0178 7.9183 117.3338 59.1507 30.3868 178.3395 605 R 4.4144 8.4999 116.5090 55.2498 30.3941 177.8334 606 G 3.8361 8.2528 106.4382 45.8984 0.0000 173.1146 607 T 4.5039 7.0969 110.6404 60.8987 70.5230 172.5649 608 L 4.8503 7.9423 124.1828 52.5792 45.4636 176.9250 609 E 4.1095 8.7605 120.5031 59.1241 29.8353 177.2167 610 D 4.7409 7.5278 117.5002 50.4007 41.6279 173.1730 611 P 4.3451 0.0000 0.0000 65.4479 31.6750 177.4338 612 N 4.3675 8.2161 114.5533 56.1285 38.3365 177.0791 613 L 3.9181 8.3065 121.7994 57.9989 42.0012 178.5802 614 F 4.3330 7.8016 119.0554 61.6333 39.3750 176.8594 615 I 3.5517 7.6305 117.7487 64.3812 37.0900 178.2420 616 R 4.0073 8.2015 119.6374 58.9879 29.3926 177.7876 617 R 4.1067 7.7931 116.8685 57.1434 29.7629 177.4243 *619 N 4.5970 8.1021 116.8314 52.9775 40.9451 176.8521 620 Q 3.9400 7.7425 117.3679 58.8856 28.5428 178.4746 621 L 4.0501 7.2163 117.5010 56.6183 41.6962 178.7017 622 L 4.2214 7.3135 118.3782 56.4261 41.7962 178.2851 623 V 4.0183 7.3234 116.8973 64.2391 32.0923 175.4629 624 S 4.3677 7.8361 117.1850 59.0179 63.2607 175.9783 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 510 S 8.19 4.44 0.00 3.90 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 0.00 511 F 9.04 4.18 0.00 3.15 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 0.00 512 I 8.72 3.41 1.87 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 1.57 0.61 0.89 0.00 0.00 513 D 8.14 4.36 0.00 2.68 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 0.00 514 R 7.84 3.93 0.00 2.03 2.11 0.00 2.82 0.00 0.00 2.53 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.41 0.00 515 V 7.76 3.76 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 1.10 0.00 0.00 0.37 0.00 0.00 516 K 8.38 3.90 0.00 2.00 1.87 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.59 7.81 517 A 7.89 4.06 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 518 L 7.45 4.15 0.00 1.86 1.98 1.01 1.02 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 0.00 519 L 8.34 4.20 0.00 1.76 1.68 0.98 0.73 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 0.00 520 G 8.97 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 0.00 0.00 0.00 521 E 8.91 4.18 0.00 1.97 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 2.31 2.33 0.00 522 R 7.66 4.02 0.00 1.87 1.97 0.00 3.08 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 523 V 7.13 4.56 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 1.00 0.00 0.00 0.87 0.00 0.00 524 K 9.22 4.18 0.00 1.75 1.96 0.00 1.99 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.39 7.81 525 D 7.56 4.55 0.00 2.80 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.46 5.00 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 0.81 0.00 0.00 1.02 0.00 0.00 527 R 8.91 4.77 0.00 1.73 1.73 0.00 3.17 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 528 L 8.41 5.21 0.00 1.50 1.52 0.98 0.91 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 0.00 529 T 8.58 4.76 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 1.27 0.00 0.00 530 H 8.61 4.89 0.00 3.16 3.28 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 531 R 8.09 3.83 0.00 1.93 2.07 0.00 3.03 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 532 L 7.07 4.68 0.00 1.50 1.76 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 533 T 7.43 4.51 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 1.22 0.00 0.00 534 D 8.04 4.51 0.00 2.70 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 0.00 535 T 7.75 4.35 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 1.30 0.00 0.00 536 P 0.00 4.43 0.00 2.00 1.68 0.00 3.67 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.92 0.00 537 A 7.76 5.11 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 538 I 8.83 4.84 1.89 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 1.31 1.62 0.92 0.00 0.00 539 V 8.31 5.16 1.93 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 0.18 0.00 0.00 0.92 0.00 0.00 540 S 9.29 4.99 0.00 3.92 4.03 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 0.00 541 T 8.35 4.98 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 542 D 8.68 4.49 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 543 A 8.78 3.95 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 0.00 544 D 8.02 4.76 0.00 2.79 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 0.00 545 E 7.43 4.28 0.00 1.92 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 2.22 2.18 0.00 *547 S 7.47 4.25 0.00 4.02 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 0.00 548 T 8.57 4.04 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 1.35 0.00 0.00 549 Q 8.10 4.07 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.49 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 *551 A 8.10 4.43 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 552 K 7.96 4.17 0.00 2.07 1.90 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.52 7.81 553 L 7.93 3.95 0.00 1.72 1.57 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 554 F 8.06 3.79 0.00 3.37 3.17 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 0.00 555 A 8.43 4.40 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 0.00 556 A 8.06 4.08 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 0.00 557 A 7.95 4.35 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 0.00 558 G 8.18 3.85 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 0.00 0.00 0.00 559 Q 8.11 4.70 0.00 2.41 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.93 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 560 K 8.35 4.13 0.00 1.74 1.73 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.44 7.81 561 V 8.19 3.72 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 1.01 0.00 0.00 562 P 0.00 4.28 0.00 1.67 1.61 0.00 3.31 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.34 0.00 563 E 8.35 3.95 0.00 1.84 1.76 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 2.20 2.23 0.00 564 V 8.04 4.09 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 0.02 0.00 0.00 0.82 0.00 0.00 565 K 8.16 4.39 0.00 1.55 1.67 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.24 1.32 7.81 566 Y 8.35 4.66 0.00 2.97 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 0.00 567 I 9.11 4.80 1.96 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 1.16 0.72 0.97 0.00 0.00 568 F 9.26 5.18 0.00 2.99 2.95 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 0.00 569 E 9.29 5.14 0.00 1.90 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 570 L 8.69 4.95 0.00 1.47 1.48 0.69 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 571 N 8.97 4.95 0.00 2.71 2.80 0.00 0.00 7.34 7.42 0.00 0.00 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 P 0.00 4.22 0.00 2.08 2.10 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.10 0.00 573 D 8.14 4.71 0.00 2.71 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 0.00 574 H 7.80 4.70 0.00 3.18 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 V 8.13 3.48 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 0.87 0.00 0.00 0.83 0.00 0.00 576 L 8.03 3.64 0.00 1.72 1.65 1.10 0.70 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 0.00 577 V 7.66 3.52 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 1.01 0.00 0.00 0.96 0.00 0.00 578 K 8.09 3.65 0.00 1.85 1.71 0.00 1.64 0.00 0.00 1.49 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.60 7.81 579 R 8.18 3.70 0.00 1.58 1.43 0.00 2.22 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.40 0.00 580 A 7.38 3.97 1.47 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 0.00 0.00 581 A 7.54 4.05 0.57 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 0.00 582 D 8.12 4.43 0.00 2.54 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 0.00 583 T 7.29 3.85 4.36 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 1.47 0.00 0.00 584 E 8.78 4.12 0.00 2.02 1.99 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 2.29 2.30 0.00 585 D 7.69 4.46 0.00 3.00 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 0.00 586 E 9.02 4.15 0.00 2.07 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 2.42 2.35 0.00 587 A 8.17 4.05 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 0.00 588 K 8.13 3.88 0.00 2.15 2.17 0.00 1.58 0.00 0.00 1.67 0.00 0.00 3.25 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.71 1.85 7.81 589 F 8.84 4.39 0.00 3.30 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 590 S 8.22 3.97 0.00 4.06 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 0.00 591 E 8.02 3.86 0.00 2.06 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 2.41 2.41 0.00 592 W 8.17 4.07 0.00 3.52 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 0.00 593 V 7.78 3.65 1.99 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 1.13 0.00 0.00 0.39 0.00 0.00 594 E 8.48 3.95 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 595 L 7.91 4.11 0.00 1.78 1.87 0.82 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 596 L 8.33 4.19 0.00 2.14 1.97 1.07 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 597 L 8.42 3.39 0.00 1.18 1.54 -0.13 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 598 D 7.87 4.07 0.00 2.75 1.54 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 0.00 599 Q 8.16 3.91 0.00 2.32 2.23 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 2.72 2.90 0.00 600 A 7.94 3.93 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 0.00 601 L 8.03 3.55 0.00 1.51 1.50 0.73 -0.06 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 0.00 602 L 8.07 3.85 0.00 1.49 1.68 0.85 0.90 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 0.00 603 A 7.96 3.94 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 604 E 7.92 4.02 0.00 1.85 1.91 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 2.06 2.39 0.00 605 R 8.50 4.41 0.00 1.97 1.95 0.00 3.43 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 606 G 8.25 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 0.00 0.00 0.00 607 T 7.10 4.50 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 1.25 0.00 0.00 608 L 7.94 4.85 0.00 1.54 1.38 0.40 0.67 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 0.00 609 E 8.76 4.11 0.00 1.90 1.99 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 2.30 2.34 0.00 610 D 7.53 4.74 0.00 2.60 2.47 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 0.00 611 P 0.00 4.35 0.00 2.23 2.15 0.00 3.67 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 612 N 8.22 4.37 0.00 2.74 2.87 0.00 0.00 6.73 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 613 L 8.31 3.92 0.00 2.00 1.88 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 614 F 7.80 4.33 0.00 2.84 3.34 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 0.00 615 I 7.63 3.55 1.97 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 1.33 0.79 0.84 0.00 0.00 616 R 8.20 4.01 0.00 2.07 1.88 0.00 3.06 0.00 0.00 3.07 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 617 R 7.79 4.11 0.00 2.02 1.98 0.00 3.22 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.71 0.00 *619 N 8.10 4.60 0.00 2.80 2.82 0.00 0.00 7.04 7.39 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 0.00 620 Q 7.74 3.94 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 621 L 7.22 4.05 0.00 1.28 1.29 -0.44 0.49 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 0.00 622 L 7.31 4.22 0.00 1.70 1.70 0.86 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 623 V 7.32 4.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.93 0.00 0.00 624 S 7.84 4.37 0.00 4.00 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 * Residues marked with a * may have inaccurate shift predictions.