NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 503 E 4.7820 8.4293 120.1785 56.3633 31.0884 174.5873 504 E 4.4462 9.2204 122.7329 53.8779 32.3541 169.9560 505 V 4.3126 9.0673 123.7504 62.2913 31.8905 176.6724 506 L 4.4361 9.0585 129.3688 56.5891 42.5324 176.9843 507 F 4.7020 7.9344 118.8297 57.5768 42.8920 172.5409 508 C 5.3711 6.9119 123.1857 59.3843 34.2271 172.6337 509 E 4.7133 8.5998 126.4409 55.3265 33.9926 175.2053 510 K 4.6526 8.5887 125.5598 55.6493 32.4682 177.1464 511 A 4.8892 9.3629 125.6342 49.5981 23.4870 174.5114 512 K 4.8430 9.3880 121.1852 54.5912 34.9864 174.6826 513 L 5.0398 8.2905 129.1034 53.4694 44.0146 174.7775 514 L 5.3498 9.1100 126.5368 53.0390 44.8831 175.5991 515 I 5.0857 8.4236 123.0465 59.0482 41.2013 174.7074 516 F 3.9852 9.0444 128.3662 58.2327 39.8266 173.5582 517 D 4.6707 7.7361 126.1743 52.2722 43.2307 176.6740 518 S 4.0480 8.4479 121.8911 57.2145 61.7568 174.2822 *522 G 3.8023 7.7521 116.4828 46.4662 0.0000 167.5746 523 Y 5.0134 8.5478 117.5172 56.7310 39.6136 175.6077 524 T 4.7586 8.6057 113.5677 59.5731 72.4490 173.3732 525 S 4.7283 8.7639 118.4277 58.6733 63.0269 173.9022 526 R 4.4845 9.9754 122.9844 55.3153 31.5571 175.3951 527 G 4.3921 6.1166 106.8571 43.9051 0.0000 171.7645 528 V 4.6586 7.5803 119.9589 61.2011 34.8291 174.5883 529 G 4.1331 8.9250 115.2752 46.3456 0.0000 171.8193 530 E 4.9662 8.7071 118.2892 55.3413 31.3106 171.9451 531 L 5.0370 9.2272 128.0718 52.4763 44.1559 175.2718 532 K 5.2938 9.2679 125.5938 54.5392 36.1349 174.6734 533 L 4.9981 8.7152 126.0169 53.6498 43.9120 175.0274 534 L 5.3714 9.1006 126.3048 52.8987 45.4474 175.4050 535 R 5.0562 8.7238 125.6861 54.5784 33.4279 175.4464 536 K 4.3361 8.6561 129.8113 55.3880 32.1163 176.2875 537 K 4.0052 8.9462 124.8517 58.1789 32.2307 177.5130 538 D 4.6458 7.9111 115.5637 53.0195 39.9423 176.3305 539 D 4.3508 7.8353 122.3086 54.2904 42.1170 176.3566 540 K 4.1069 8.6091 128.7002 56.7967 31.9295 176.2199 541 G 3.7743 8.2763 106.6374 47.3385 0.0000 174.5747 542 K 4.5061 8.0901 124.9167 53.2904 33.2985 179.8704 543 V 5.0708 8.1245 125.9459 60.3056 34.8591 174.2967 544 R 5.3138 9.1923 123.3628 54.5661 33.7213 173.8996 545 V 4.8064 8.8256 120.0195 59.9766 34.1197 174.4293 546 L 5.2218 8.7844 125.3608 53.4143 45.3340 174.3974 547 C 5.6951 8.9954 126.0604 56.5249 34.7671 172.4377 548 R 5.0046 8.4177 126.0336 54.6118 32.7050 175.2035 549 S 4.8117 8.3618 123.5947 56.5657 64.9080 173.8993 *551 G 3.6236 8.1324 104.1574 46.0796 0.0000 173.2053 *553 G 3.7703 7.6083 100.1946 45.2467 0.0000 171.2718 554 H 4.1569 7.8889 120.6276 55.6037 30.1255 174.2850 555 V 4.1373 8.2573 127.2836 63.0147 30.8967 175.3778 556 L 4.1660 8.8248 130.2041 57.0762 42.5375 177.8207 557 L 4.5991 7.5812 119.6750 53.8086 45.7583 174.7440 558 N 5.4622 8.7606 124.5092 52.7748 40.1705 172.6413 559 T 4.8161 8.8904 118.6620 60.2406 71.7191 172.5057 560 S 4.8755 8.6448 122.0745 58.1581 64.0036 174.1613 561 V 3.8553 8.4821 124.6929 62.8194 31.8567 175.5103 562 V 4.0828 8.9641 130.7461 61.7200 32.5785 177.6502 563 K 4.0263 8.4601 128.1146 57.5383 31.7595 176.0165 564 S 4.4418 7.7157 111.5616 59.4735 63.2824 173.8623 565 F 4.9367 7.3957 119.5471 55.6086 40.4779 175.1436 566 K 4.3081 7.9979 122.8262 54.9605 33.5151 175.6597 567 Y 4.6335 8.2618 120.6938 56.4225 40.0719 174.6479 568 Q 4.7570 8.3555 120.7920 53.8568 32.6712 172.3921 569 P 4.8221 0.0000 0.0000 62.7430 31.9160 176.4021 570 I 3.7895 8.2353 123.0842 64.0202 37.3089 175.6355 571 D 4.4807 7.5896 115.8195 52.3977 41.5012 175.3358 572 A 3.9834 8.6890 121.2839 55.4843 18.1703 178.4500 573 D 4.5931 7.9209 113.5894 55.8146 42.1728 176.2986 574 N 5.0427 8.2550 118.7287 52.6401 39.0826 175.8463 575 E 4.2280 8.0001 114.5503 57.6492 30.9309 179.2100 576 N 4.8612 8.0807 114.2335 53.4217 39.1088 174.2499 577 L 5.0411 8.0237 119.9952 53.5313 44.7397 175.2379 578 I 4.7672 8.5895 125.8426 59.5181 39.7587 175.4998 579 K 4.5448 9.3134 127.3507 56.1419 33.2082 175.9875 580 W 4.8697 9.5097 135.0000 54.5357 31.0063 172.1514 581 P 4.6734 0.0000 0.0000 62.4038 31.6328 175.7172 582 I 4.8597 8.9656 122.3423 59.5666 42.0722 173.3734 583 I 4.8503 8.4916 128.2014 60.3001 38.5789 175.2962 584 T 4.4783 8.6106 125.9725 63.5051 71.1742 174.6474 585 D 4.4154 9.7768 125.8770 54.2975 37.1241 171.5323 586 G 3.9751 8.3757 108.4671 47.0676 0.0000 174.9150 587 K 4.3978 7.9174 122.0288 53.0336 33.0165 180.7619 588 L 4.8135 8.3460 125.0615 54.3065 42.6495 175.6652 589 E 4.8343 9.2378 124.1949 54.7933 33.4717 174.8268 590 T 4.9383 8.4464 116.7234 62.0174 70.4588 174.4839 591 F 5.1927 9.2547 125.8948 57.2116 41.2948 174.6767 592 I 4.9852 8.8801 121.5743 59.7475 40.0334 174.8212 593 I 4.7551 9.1246 131.1155 60.4261 38.9006 175.5288 594 K 4.8457 9.2321 132.5225 54.0943 32.9880 173.3082 595 V 4.4544 8.3286 121.6735 59.2821 33.6516 177.6604 596 K 4.0776 8.8771 122.8724 57.4976 31.8620 177.6058 597 Q 4.8176 7.7985 119.8455 54.6150 32.1017 177.7060 598 K 4.0418 8.4420 125.8853 59.3522 31.9674 180.3241 599 A 4.3317 7.9971 119.3523 55.2852 18.4977 179.1373 600 D 4.5863 8.2688 117.4697 57.5860 40.8984 179.1061 601 G 4.1792 7.8925 109.6014 48.0033 0.0000 176.6448 602 R 4.0008 7.8470 123.2090 61.1365 29.2641 180.8836 603 R 4.1628 8.2560 119.2932 59.1402 30.0944 178.2323 604 L 3.2493 7.9411 120.2073 57.9280 41.8851 179.1487 605 V 3.6651 7.9490 118.1842 66.0515 31.4457 178.2539 606 G 3.5820 8.2639 105.2433 47.7720 0.0000 175.5550 607 A 4.0423 8.9547 124.4074 54.7726 18.2876 180.0184 608 V 3.4758 8.0607 116.7865 65.9956 31.6159 178.1266 609 A 4.2282 8.3702 123.2383 55.9613 18.2463 179.9581 610 D 4.3208 8.3800 119.5103 58.5669 39.6582 180.4199 611 A 4.2386 8.0498 121.5389 55.1172 18.4078 179.5383 612 Q 4.1588 8.3343 118.6238 59.7840 28.8838 179.1795 613 Q 4.1508 8.1179 120.6171 59.9507 28.2551 178.5461 614 A 4.4959 7.9665 126.1040 52.3466 18.5727 177.0488 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 503 E 8.43 4.78 0.00 1.88 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 2.33 2.33 0.00 504 E 9.22 4.45 0.00 2.04 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 2.40 2.34 0.00 505 V 9.07 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 0.85 0.00 0.00 0.93 0.00 0.00 506 L 9.06 4.44 0.00 1.63 1.78 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 507 F 7.93 4.70 0.00 3.12 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 0.00 508 C 6.91 5.37 0.00 2.86 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 0.00 509 E 8.60 4.71 0.00 2.04 1.81 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 1.83 2.38 0.00 510 K 8.59 4.65 0.00 1.54 1.61 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.66 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.02 7.81 511 A 9.36 4.89 1.20 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 0.00 512 K 9.39 4.84 0.00 1.79 1.65 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.34 7.81 513 L 8.29 5.04 0.00 1.70 1.44 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 514 L 9.11 5.35 0.00 1.53 1.63 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 515 I 8.42 5.09 1.72 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.25 0.88 0.00 0.00 516 F 9.04 3.99 0.00 2.28 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 0.00 517 D 7.74 4.67 0.00 2.48 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 0.00 0.00 0.00 0.00 518 S 8.45 4.05 0.00 3.94 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 *522 G 7.75 3.80 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 0.00 0.00 0.00 523 Y 8.55 5.01 0.00 2.95 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 0.00 524 T 8.61 4.76 4.21 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 1.16 0.00 0.00 525 S 8.76 4.73 0.00 3.91 3.80 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 R 9.98 4.48 0.00 1.72 1.83 0.00 3.39 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 527 G 6.12 4.39 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 0.00 528 V 7.58 4.66 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 1.05 0.00 0.00 0.93 0.00 0.00 529 G 8.92 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 0.00 530 E 8.71 4.97 0.00 1.69 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 2.20 2.12 0.00 531 L 9.23 5.04 0.00 1.70 1.78 0.75 0.24 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 0.00 532 K 9.27 5.29 0.00 1.66 1.66 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.34 7.81 533 L 8.72 5.00 0.00 1.87 1.67 1.04 0.61 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 0.00 534 L 9.10 5.37 0.00 1.58 1.51 0.92 0.49 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 0.00 535 R 8.72 5.06 0.00 1.88 1.74 0.00 3.11 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 536 K 8.66 4.34 0.00 1.51 1.69 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.30 7.81 537 K 8.95 4.01 0.00 1.74 1.91 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.52 7.81 538 D 7.91 4.65 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 0.00 539 D 7.84 4.35 0.00 2.65 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 0.00 540 K 8.61 4.11 0.00 1.81 1.72 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.01 7.81 541 G 8.28 3.77 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 0.00 0.00 0.00 542 K 8.09 4.51 0.00 1.45 1.72 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.27 1.22 7.81 543 V 8.12 5.07 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 1.04 0.00 0.00 0.98 0.00 0.00 544 R 9.19 5.31 0.00 2.03 1.97 0.00 3.00 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 545 V 8.83 4.81 1.77 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 0.41 0.00 0.00 0.54 0.00 0.00 546 L 8.78 5.22 0.00 1.72 1.49 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 547 C 9.00 5.70 0.00 2.89 2.64 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 0.00 548 R 8.42 5.00 0.00 1.85 1.71 0.00 3.22 0.00 0.00 3.38 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 549 S 8.36 4.81 0.00 3.93 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 *551 G 8.13 3.62 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 0.00 0.00 0.00 *553 G 7.61 3.77 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 0.00 0.00 0.00 554 H 7.89 4.16 0.00 3.18 3.21 0.00 5.78 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 555 V 8.26 4.14 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 0.84 0.00 0.00 0.92 0.00 0.00 556 L 8.82 4.17 0.00 1.56 1.63 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 557 L 7.58 4.60 0.00 1.69 1.35 1.19 0.09 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 0.00 558 N 8.76 5.46 0.00 2.70 2.68 0.00 0.00 6.82 7.70 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 0.00 559 T 8.89 4.82 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 1.44 0.00 0.00 560 S 8.64 4.88 0.00 3.83 3.80 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 0.00 561 V 8.48 3.86 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 0.66 0.00 0.00 0.97 0.00 0.00 562 V 8.96 4.08 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 0.09 0.00 0.00 0.71 0.00 0.00 563 K 8.46 4.03 0.00 1.82 1.72 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.03 7.81 564 S 7.72 4.44 0.00 3.60 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 0.00 565 F 7.40 4.94 0.00 2.37 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 0.00 0.00 0.00 566 K 8.00 4.31 0.00 1.55 1.59 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.36 7.81 567 Y 8.26 4.63 0.00 2.53 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 0.00 0.00 0.00 0.00 568 Q 8.36 4.76 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.93 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 569 P 0.00 4.82 0.00 2.28 2.11 0.00 3.80 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 1.99 2.01 0.00 570 I 8.24 3.79 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.63 0.90 0.00 0.00 571 D 7.59 4.48 0.00 2.85 2.75 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 0.00 572 A 8.69 3.98 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 D 7.92 4.59 0.00 2.87 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 0.00 574 N 8.26 5.04 0.00 2.69 2.69 0.00 0.00 6.97 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 0.00 575 E 8.00 4.23 0.00 1.89 1.95 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 2.31 1.87 0.00 576 N 8.08 4.86 0.00 2.93 3.08 0.00 0.00 6.02 6.67 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 0.00 577 L 8.02 5.04 0.00 1.61 1.57 0.94 0.52 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 0.00 578 I 8.59 4.77 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.05 1.10 0.00 0.00 579 K 9.31 4.54 0.00 1.78 1.70 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.69 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.37 7.81 580 W 9.51 4.87 0.00 3.63 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 0.00 581 P 0.00 4.67 0.00 0.86 1.42 0.00 2.80 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.55 0.00 582 I 8.97 4.86 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.77 -0.01 0.00 0.00 583 I 8.49 4.85 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.01 0.95 0.00 0.00 584 T 8.61 4.48 4.30 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 1.29 0.00 0.00 585 D 9.78 4.42 0.00 2.81 2.57 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 0.00 586 G 8.38 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 0.00 587 K 7.92 4.40 0.00 1.68 1.68 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.32 1.23 7.81 588 L 8.35 4.81 0.00 1.57 1.52 0.49 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 589 E 9.24 4.83 0.00 2.15 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 2.14 2.05 0.00 590 T 8.45 4.94 4.39 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 1.25 0.00 0.00 591 F 9.25 5.19 0.00 3.12 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 0.00 592 I 8.88 4.99 1.68 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.11 0.83 0.00 0.00 593 I 9.12 4.76 1.94 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.82 0.87 0.00 0.00 594 K 9.23 4.85 0.00 1.39 1.70 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.28 7.81 595 V 8.33 4.45 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 0.91 0.00 0.00 1.05 0.00 0.00 596 K 8.88 4.08 0.00 1.77 1.72 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.36 1.03 7.81 597 Q 7.80 4.82 0.00 2.39 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 598 K 8.44 4.04 0.00 1.76 1.81 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.07 7.81 599 A 8.00 4.33 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 0.00 600 D 8.27 4.59 0.00 3.01 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 G 7.89 4.18 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 0.00 0.00 0.00 602 R 7.85 4.00 0.00 1.78 1.96 0.00 3.27 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 603 R 8.26 4.16 0.00 2.16 2.35 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.74 0.00 604 L 7.94 3.25 0.00 1.02 1.60 0.26 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 605 V 7.95 3.67 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 1.10 0.00 0.00 1.04 0.00 0.00 606 G 8.26 3.58 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 0.00 0.00 0.00 607 A 8.95 4.04 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 0.00 608 V 8.06 3.48 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 0.79 0.00 0.00 1.01 0.00 0.00 609 A 8.37 4.23 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 0.00 610 D 8.38 4.32 0.00 2.69 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 0.00 611 A 8.05 4.24 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 0.00 612 Q 8.33 4.16 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 613 Q 8.12 4.15 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 614 A 7.97 4.50 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 * Residues marked with a * may have inaccurate shift predictions.