NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 501 H 4.3274 8.4401 117.6586 55.4176 30.0059 173.4028 502 A 4.1893 8.1219 122.9199 50.9034 17.3908 174.5793 503 G 3.9544 9.4862 109.4333 45.9830 0.0000 168.3914 504 I 4.9749 7.9035 124.5093 59.4281 40.5597 174.3470 505 F 5.2170 8.5210 125.9078 55.9207 41.7535 174.8050 506 T 4.7979 8.8162 116.6208 60.5481 71.2627 172.9037 507 F 4.6934 8.7436 124.2125 57.2876 39.4798 175.9145 508 E 4.2335 8.5221 120.1074 59.1622 29.5286 177.6121 509 E 4.6717 7.9835 118.9299 53.6391 32.9474 173.6245 510 P 5.1044 0.0000 0.0000 64.2980 32.6199 175.7735 511 V 4.6875 7.2096 120.7203 61.5230 34.5738 174.2260 512 T 4.5039 8.9590 122.5221 60.3339 70.7230 171.7469 513 H 5.1126 8.3045 124.0567 53.9259 30.1063 173.9705 514 V 4.4793 8.1059 116.0968 58.9574 35.3569 175.9417 515 S 4.6825 8.6011 117.9173 58.6032 63.4421 174.8106 516 E 4.2118 8.8330 122.3040 59.1232 29.5135 178.0230 517 S 4.6717 7.9649 111.3632 58.2096 63.2729 174.8137 518 I 3.7533 7.7431 123.2778 62.3721 37.8221 175.8999 519 G 4.1456 8.2435 114.2662 45.3392 0.0000 172.0497 520 I 5.1344 7.1623 119.4494 58.7158 40.7991 174.2741 521 M 4.7438 8.7966 123.7993 53.6405 34.2965 174.5662 522 E 5.2402 8.6624 119.1331 54.5654 32.7346 175.5878 523 V 4.6587 8.4370 123.5002 59.8063 34.8285 174.7795 524 K 4.9832 9.7953 124.2138 55.4000 34.0403 175.6895 525 V 4.2165 8.4729 124.8269 61.8059 32.3943 175.4084 526 L 4.7368 9.2786 128.7909 53.5896 44.0884 176.1721 527 R 4.4754 8.1509 117.2962 54.8309 30.5522 175.5316 528 T 3.9601 8.5083 121.7314 66.9931 68.0783 176.7556 529 S 4.1055 7.8868 114.3388 61.6283 63.7700 174.4215 530 G 3.9808 6.5789 106.1903 43.5715 0.0000 171.6217 531 A 4.6698 7.8499 122.4129 51.3018 22.2479 177.3127 532 R 4.9365 7.7355 118.7419 53.4689 32.5847 176.1984 533 G 5.1138 7.2994 117.8135 45.4964 0.0000 172.1483 534 N 4.9226 8.3241 129.2767 51.6792 41.6163 171.5675 535 V 4.4917 8.7418 127.4161 60.9601 34.1718 174.2860 536 I 4.6068 8.7056 130.0829 60.2319 38.7010 175.1566 537 V 4.4567 8.9490 129.3420 60.2594 32.7233 173.2113 538 P 5.0560 0.0000 0.0000 62.7981 32.9276 174.6613 539 Y 5.5419 8.4347 118.5931 55.7599 42.2840 173.8906 540 K 4.9242 9.3258 118.9800 55.8640 36.4468 174.9563 541 T 4.9256 8.4234 114.0384 61.3968 70.1052 173.9825 542 I 4.3957 9.3688 128.5338 59.8300 39.0394 174.9111 543 E 4.4047 9.1074 127.7372 57.6643 29.2163 176.2195 544 G 3.6372 9.3121 115.6907 47.6568 0.0000 172.6080 545 T 4.6668 5.9579 115.2613 61.5748 70.9425 176.7138 546 A 4.6956 8.1095 123.7572 51.2700 20.6767 176.2719 547 R 4.4816 9.5676 120.9639 54.7375 32.2549 176.4210 548 G 3.0869 9.0717 118.7003 45.8990 0.0000 175.2705 549 G 3.7269 9.3983 114.8867 46.0187 0.0000 174.4054 550 G 3.4422 7.8946 105.9436 44.9622 0.0000 174.8180 551 E 3.8566 6.6301 119.3074 57.1024 30.4085 177.5030 552 D 4.9073 8.5409 118.4894 56.1287 42.7607 176.3172 553 F 5.6261 7.7975 111.2437 55.0548 42.1654 173.2183 554 E 4.8817 9.2806 121.7853 54.5829 30.1089 175.4572 555 D 4.7543 8.3220 127.3732 53.8313 40.1602 175.6672 556 T 4.9118 9.1133 115.5598 60.6750 71.1906 172.2368 557 C 4.9812 8.1017 122.5640 56.0028 32.5226 173.2299 558 G 3.9244 6.6639 109.4806 45.3186 0.0000 170.7305 559 E 5.0677 8.3903 117.2092 54.3643 31.9290 175.6616 560 L 4.3975 9.2395 124.3811 53.8668 43.8084 175.6380 561 E 4.6746 8.5369 123.8824 54.9526 30.5879 175.3710 562 F 4.0431 9.2141 128.2000 56.5130 39.5570 176.2610 563 Q 4.5835 8.7858 124.1217 55.0268 28.7798 175.6800 564 N 5.2147 7.8579 116.4353 51.6632 42.0680 175.6741 565 D 4.4797 8.6138 121.1635 57.0108 41.6474 178.0736 566 E 3.9276 8.4547 119.4166 58.6441 29.6789 176.8218 567 I 4.4297 7.3083 110.0285 59.3198 39.4196 174.9882 568 V 4.7386 7.9091 119.6151 59.8694 34.5836 174.7300 569 K 4.5697 8.2538 119.2362 54.6672 35.5715 175.0098 570 I 5.1924 8.0522 121.8814 59.7200 40.9580 174.8167 571 I 4.2858 8.7846 127.8845 60.0367 38.9033 174.6776 572 T 5.4020 8.4292 117.4676 59.5264 70.3280 173.5274 573 I 4.5182 8.1861 127.3703 59.2037 40.3135 174.8844 574 R 4.4509 8.5374 127.1617 55.9943 30.7811 174.7175 575 I 4.8047 8.7695 128.4225 59.7900 39.0684 175.3175 576 F 4.3127 8.7539 126.0077 56.5560 39.9860 176.6689 577 D 4.5853 8.6940 122.3029 53.3755 39.0770 173.7168 578 R 4.4852 7.9537 120.0341 54.2830 31.5059 175.6966 579 E 4.5301 8.4473 127.6412 54.2633 29.8818 174.3713 580 E 3.6038 8.3377 124.4163 56.3264 28.9349 176.2777 581 Y 4.8412 8.2255 109.6166 56.3736 42.8405 174.4299 582 E 4.0780 8.9346 122.4116 56.8113 29.7262 176.5944 583 K 4.8120 8.5756 122.0846 54.9687 36.1331 175.7475 584 E 4.7183 8.3684 117.6235 56.0540 29.9266 176.7599 585 C 4.3542 8.0318 114.6908 58.6880 31.0069 173.0698 586 S 4.8794 9.4588 119.6722 56.7312 67.6119 173.0139 587 F 5.2896 8.5032 116.5148 55.3043 41.3791 173.7961 588 S 5.0804 8.9164 115.7837 56.7593 66.3647 172.8197 589 L 5.3380 8.6623 123.8791 53.5508 44.9983 175.7560 590 V 5.1602 8.9169 118.1606 59.7310 36.0323 174.4291 591 L 5.0670 8.7630 121.7804 53.8238 43.2664 176.1320 592 E 4.6609 9.0343 122.1582 54.2735 32.1305 175.6788 593 E 3.9538 8.7781 120.6062 56.5047 29.5835 175.6210 594 P 4.8204 0.0000 0.0000 62.3047 32.7527 175.6851 595 K 4.7717 9.1529 120.8907 54.9310 35.6806 174.5195 596 W 5.0557 8.9511 133.0366 56.1420 31.7246 175.1839 597 I 4.6383 9.0909 129.6124 59.7602 38.6803 176.2709 598 R 4.3635 8.4932 121.4616 56.8380 30.2398 178.1620 599 R 3.9332 8.8095 114.9939 57.3123 29.1844 177.7358 600 G 3.9800 8.3067 105.1519 46.4007 0.0000 173.3162 601 M 4.9274 8.0324 119.7366 53.6866 34.5463 174.6648 602 K 4.3359 7.9515 117.3942 57.0796 34.8450 174.3937 603 G 3.7965 8.3198 118.0905 44.0032 0.0000 172.6988 604 G 3.8348 7.1541 107.3760 43.1279 0.0000 172.8631 605 F 4.7418 8.4076 122.3242 55.8214 42.1842 175.0930 606 T 4.2223 8.5677 122.1479 62.7597 67.5186 175.0297 607 I 4.1216 8.0128 128.7512 60.2017 35.8419 175.9418 608 T 4.2475 8.1557 121.2944 63.1835 66.4719 173.9384 609 E 4.4773 8.4590 122.2461 55.6287 31.4648 176.6090 610 E 4.5089 8.0839 119.1413 55.0991 29.2181 174.2135 611 Y 4.7535 8.1377 123.2487 55.7087 42.3528 173.4789 612 D 4.9321 8.0689 124.7687 52.0202 43.4417 176.6192 613 D 4.6262 8.8694 125.6478 57.0782 41.6730 177.7048 614 K 4.1033 8.5815 118.3864 58.6737 32.2125 176.2994 615 Q 4.3338 7.3353 123.4757 56.0634 34.4867 172.3833 616 P 4.5341 0.0000 0.0000 61.6833 33.0755 176.6954 617 L 3.8802 8.2191 117.6399 57.5474 41.9191 178.5316 618 T 4.2190 7.5863 119.0190 62.9668 66.9795 173.7460 619 S 4.6535 8.3119 120.4423 57.9748 63.8310 174.8402 620 K 4.8884 7.5360 121.7753 55.9386 34.5841 174.3420 621 E 4.4295 8.3789 121.8956 57.2259 31.4272 176.7733 622 E 4.3070 8.4465 116.0609 56.4164 28.4946 177.1942 623 E 4.2644 7.7698 123.6714 55.7809 29.1348 177.0981 624 E 3.8457 8.0187 114.6371 57.6728 28.0042 177.7785 625 R 3.8899 8.1061 117.5414 59.6108 29.2466 177.5521 626 R 3.8880 7.9057 118.7992 59.2683 29.9452 178.4385 627 I 3.7257 7.6788 118.1924 64.0454 37.4719 177.7295 628 A 4.1364 8.2629 121.9747 55.3597 18.4002 179.6275 629 E 4.0611 8.5943 117.1871 59.3530 29.3219 178.7946 630 M 4.4983 8.1426 117.1933 56.4209 32.1376 177.5022 631 G 4.0209 7.6377 105.1974 43.5573 0.0000 173.3469 632 R 4.7924 6.8935 119.0378 53.0404 32.5675 174.3061 633 P 5.0036 0.0000 0.0000 63.3671 32.3507 175.2449 634 I 4.8222 9.1256 115.0577 59.7680 41.7240 173.5735 635 L 5.1183 8.3869 122.0501 53.0258 44.0543 176.4130 636 G 3.6839 8.7729 108.4930 46.0360 0.0000 173.7246 637 E 3.9294 9.0014 120.1128 58.9611 29.4502 177.0696 638 H 4.7399 7.8428 121.0967 54.0799 30.5082 173.0126 639 T 4.6481 8.4544 118.6879 60.0363 69.2604 172.7476 640 K 4.8315 8.4555 128.8724 54.8873 36.5547 174.5453 641 L 4.4180 8.5415 127.2951 53.0724 44.3296 175.3885 642 E 4.4626 9.0475 128.2848 55.3800 30.4288 175.8613 643 V 4.2372 8.0360 126.5746 61.2724 33.0708 174.5891 644 I 4.7239 8.4417 129.3913 59.4166 39.8131 174.8141 645 I 5.0136 8.5961 118.9921 59.1018 41.0062 173.3319 646 E 5.7373 8.9770 121.3088 53.7088 30.7182 176.1569 647 E 3.9507 8.1402 123.7870 57.6767 29.5855 175.6351 648 S 3.5599 8.7156 123.5584 58.4478 59.1092 169.7095 649 Y 4.7975 7.4698 121.4454 54.8366 40.6711 175.3490 650 E 4.4685 8.6365 119.4422 54.5274 31.1620 175.8030 651 F 4.4865 8.7371 126.4014 56.9153 39.1431 175.2628 652 K 4.3397 7.7640 127.8436 54.8338 33.2676 178.2587 653 S 4.2192 8.1186 115.3275 58.8155 60.7913 172.8794 654 T 4.1164 7.5158 123.7658 63.0252 67.5073 174.4065 655 V 4.5452 7.9039 125.0196 60.7015 35.0035 175.0650 656 D 4.5456 8.5632 122.7551 53.5010 39.3723 175.6987 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 501 H 8.44 4.33 0.00 2.84 3.22 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 0.00 502 A 8.12 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 0.00 503 G 9.49 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 0.00 504 I 7.90 4.97 1.68 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 1.17 0.94 0.89 0.00 0.00 505 F 8.52 5.22 0.00 2.73 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 0.00 506 T 8.82 4.80 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 1.18 0.00 0.00 507 F 8.74 4.69 0.00 2.99 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 0.00 508 E 8.52 4.23 0.00 2.01 2.05 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 2.39 2.61 0.00 509 E 7.98 4.67 0.00 1.95 1.66 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 2.24 2.33 0.00 510 P 0.00 5.10 0.00 2.11 2.29 0.00 3.84 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 2.04 1.80 0.00 511 V 7.21 4.69 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 0.79 0.00 0.00 0.84 0.00 0.00 512 T 8.96 4.50 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 0.99 0.00 0.00 513 H 8.30 5.11 0.00 2.66 3.06 0.00 5.52 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 514 V 8.11 4.48 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 0.71 0.00 0.00 0.84 0.00 0.00 515 S 8.60 4.68 0.00 3.95 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 0.00 516 E 8.83 4.21 0.00 2.01 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 0.00 2.40 2.47 0.00 517 S 7.96 4.67 0.00 4.00 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 0.00 518 I 7.74 3.75 1.90 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 1.50 0.83 1.01 0.00 0.00 519 G 8.24 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 520 I 7.16 5.13 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.95 0.90 0.00 0.00 521 M 8.80 4.74 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 522 E 8.66 5.24 0.00 1.82 1.87 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 2.19 2.26 0.00 523 V 8.44 4.66 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 0.99 0.00 0.00 1.07 0.00 0.00 524 K 9.80 4.98 0.00 1.96 1.83 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.40 7.81 525 V 8.47 4.22 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 0.56 0.00 0.00 0.83 0.00 0.00 526 L 9.28 4.74 0.00 1.66 1.53 0.94 0.85 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 0.00 527 R 8.15 4.48 0.00 1.37 1.39 0.00 3.29 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 528 T 8.51 3.96 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 1.16 0.00 0.00 529 S 7.89 4.11 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 0.00 530 G 6.58 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 0.00 531 A 7.85 4.67 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 0.00 532 R 7.74 4.94 0.00 1.83 2.05 0.00 3.50 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.82 0.00 533 G 7.30 5.11 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 0.00 534 N 8.32 4.92 0.00 2.77 2.71 0.00 0.00 6.35 8.03 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 0.00 535 V 8.74 4.49 1.88 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 0.54 0.00 0.00 -0.48 0.00 0.00 536 I 8.71 4.61 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.65 0.86 0.00 0.00 537 V 8.95 4.46 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 0.80 0.00 0.00 -0.10 0.00 0.00 538 P 0.00 5.06 0.00 2.19 2.07 0.00 3.58 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 2.05 2.04 0.00 539 Y 8.43 5.54 0.00 3.25 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 0.00 540 K 9.33 4.92 0.00 1.88 1.95 0.00 1.36 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.50 7.81 541 T 8.42 4.93 4.50 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 1.48 0.00 0.00 542 I 9.37 4.40 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.97 0.98 0.00 0.00 543 E 9.11 4.40 0.00 1.97 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 2.58 2.49 0.00 544 G 9.31 3.64 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 0.00 0.00 0.00 545 T 5.96 4.67 4.29 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 1.24 0.00 0.00 546 A 8.11 4.70 1.59 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 0.00 0.00 0.00 0.00 0.00 0.00 547 R 9.57 4.48 0.00 1.92 1.76 0.00 3.28 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 548 G 9.07 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 0.00 0.00 0.00 549 G 9.40 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 0.00 0.00 0.00 550 G 7.89 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 6.63 3.86 0.00 2.01 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 0.00 2.44 2.33 0.00 552 D 8.54 4.91 0.00 2.92 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 0.00 553 F 7.80 5.63 0.00 2.79 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 0.00 554 E 9.28 4.88 0.00 2.09 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 0.00 2.31 2.41 0.00 555 D 8.32 4.75 0.00 2.76 2.43 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 0.00 556 T 9.11 4.91 4.37 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 1.41 0.00 0.00 557 C 8.10 4.98 0.00 2.87 2.87 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 0.00 558 G 6.66 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 0.00 559 E 8.39 5.07 0.00 1.85 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 2.09 2.18 0.00 560 L 9.24 4.40 0.00 1.77 1.51 1.06 0.94 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 0.00 561 E 8.54 4.67 0.00 1.89 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 0.00 2.13 2.25 0.00 562 F 9.21 4.04 0.00 2.85 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 Q 8.79 4.58 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.16 0.00 564 N 7.86 5.21 0.00 2.83 2.69 0.00 0.00 6.59 8.53 0.00 0.00 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 D 8.61 4.48 0.00 3.05 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 0.00 566 E 8.45 3.93 0.00 1.97 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 2.31 2.39 0.00 567 I 7.31 4.43 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.71 0.90 0.00 0.00 568 V 7.91 4.74 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 0.89 0.00 0.00 1.11 0.00 0.00 569 K 8.25 4.57 0.00 1.18 1.48 0.00 1.42 0.00 0.00 1.58 0.00 0.00 2.65 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.34 0.22 7.81 570 I 8.05 5.19 1.85 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 1.35 0.59 0.97 0.00 0.00 571 I 8.78 4.29 1.74 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.00 0.34 0.00 0.00 572 T 8.43 5.40 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 0.00 573 I 8.19 4.52 1.99 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 1.06 0.00 0.00 574 R 8.54 4.45 0.00 1.72 1.43 0.00 2.21 0.00 0.00 3.05 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.27 0.00 575 I 8.77 4.80 1.90 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.31 1.14 0.00 0.00 576 F 8.75 4.31 0.00 3.08 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 0.00 577 D 8.69 4.59 0.00 2.66 2.66 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 0.00 578 R 7.95 4.49 0.00 1.85 1.89 0.00 3.50 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 579 E 8.45 4.53 0.00 1.92 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 2.12 2.38 0.00 580 E 8.34 3.60 0.00 1.89 1.65 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 2.28 2.29 0.00 581 Y 8.23 4.84 0.00 3.00 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 0.00 582 E 8.93 4.08 0.00 2.02 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 2.37 2.41 0.00 583 K 8.58 4.81 0.00 1.90 1.76 0.00 1.74 0.00 0.00 1.91 0.00 0.00 3.06 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.43 1.69 7.81 584 E 8.37 4.72 0.00 1.94 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 2.23 2.34 0.00 585 C 8.03 4.35 0.00 3.12 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 0.00 586 S 9.46 4.88 0.00 3.65 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 0.00 587 F 8.50 5.29 0.00 2.81 2.51 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 0.00 588 S 8.92 5.08 0.00 3.78 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 0.00 589 L 8.66 5.34 0.00 1.74 1.22 1.22 0.94 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 0.00 590 V 8.92 5.16 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 0.76 0.00 0.00 1.09 0.00 0.00 591 L 8.76 5.07 0.00 1.53 1.55 0.44 0.69 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 0.00 592 E 9.03 4.66 0.00 1.85 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 0.00 2.33 2.43 0.00 593 E 8.78 3.95 0.00 1.99 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 2.36 2.30 0.00 594 P 0.00 4.82 0.00 1.98 1.78 0.00 3.89 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 2.20 2.27 0.00 595 K 9.15 4.77 0.00 1.85 1.99 0.00 1.32 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.35 7.81 596 W 8.95 5.06 0.00 3.57 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 9.09 4.64 2.20 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 1.29 0.61 0.96 0.00 0.00 598 R 8.49 4.36 0.00 2.10 2.42 0.00 3.06 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 599 R 8.81 3.93 0.00 2.01 2.13 0.00 2.79 0.00 0.00 2.96 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.47 0.00 600 G 8.31 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 0.00 601 M 8.03 4.93 0.00 1.83 1.98 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.85 0.00 602 K 7.95 4.34 0.00 1.79 1.76 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.28 1.38 7.81 603 G 8.32 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 0.00 604 G 7.15 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 0.00 605 F 8.41 4.74 0.00 3.00 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 0.00 606 T 8.57 4.22 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 1.25 0.00 0.00 607 I 8.01 4.12 1.91 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 1.64 0.79 0.92 0.00 0.00 608 T 8.16 4.25 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 1.33 0.00 0.00 609 E 8.46 4.48 0.00 2.04 2.05 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 2.18 2.56 0.00 610 E 8.08 4.51 0.00 2.01 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 2.26 2.30 0.00 611 Y 8.14 4.75 0.00 2.86 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 0.00 612 D 8.07 4.93 0.00 2.57 2.38 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 0.00 613 D 8.87 4.63 0.00 2.74 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 0.00 614 K 8.58 4.10 0.00 1.90 1.82 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.51 7.81 615 Q 7.34 4.33 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.87 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 616 P 0.00 4.53 0.00 2.33 2.10 0.00 3.57 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 1.93 1.90 0.00 617 L 8.22 3.88 0.00 1.66 1.79 1.13 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 618 T 7.59 4.22 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 1.20 0.00 0.00 619 S 8.31 4.65 0.00 3.94 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 0.00 620 K 7.54 4.89 0.00 1.70 1.77 0.00 1.62 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.47 7.81 621 E 8.38 4.43 0.00 1.93 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 0.00 2.29 2.38 0.00 622 E 8.45 4.31 0.00 1.95 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 2.29 2.29 0.00 623 E 7.77 4.26 0.00 2.07 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 2.41 2.32 0.00 624 E 8.02 3.85 0.00 2.19 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 0.00 2.30 2.27 0.00 625 R 8.11 3.89 0.00 2.03 2.20 0.00 2.96 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 626 R 7.91 3.89 0.00 1.90 1.96 0.00 3.18 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 627 I 7.68 3.73 2.00 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 1.57 0.65 0.90 0.00 0.00 628 A 8.26 4.14 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 0.00 629 E 8.59 4.06 0.00 2.14 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 0.00 2.35 2.58 0.00 630 M 8.14 4.50 0.00 1.98 2.22 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 2.88 2.56 0.00 631 G 7.64 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 R 6.89 4.79 0.00 2.06 1.94 0.00 3.21 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 633 P 0.00 5.00 0.00 2.42 2.70 0.00 3.94 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 634 I 9.13 4.82 1.92 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 1.34 0.89 1.08 0.00 0.00 635 L 8.39 5.12 0.00 1.58 1.80 1.06 0.99 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 0.00 636 G 8.77 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 637 E 9.00 3.93 0.00 1.83 1.86 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 2.11 1.90 0.00 638 H 7.84 4.74 0.00 3.16 3.21 0.00 5.69 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 639 T 8.45 4.65 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 1.34 0.00 0.00 640 K 8.46 4.83 0.00 1.86 1.54 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.42 7.81 641 L 8.54 4.42 0.00 0.27 0.61 0.68 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 642 E 9.05 4.46 0.00 1.74 1.71 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 2.17 2.11 0.00 643 V 8.04 4.24 0.67 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 0.63 0.00 0.00 0.51 0.00 0.00 644 I 8.44 4.72 1.71 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.58 0.85 0.00 0.00 645 I 8.60 5.01 1.95 0.00 0.00 1.00 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 1.06 1.00 0.00 0.00 646 E 8.98 5.74 0.00 2.11 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 0.00 2.48 2.20 0.00 647 E 8.14 3.95 0.00 2.06 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 2.51 2.32 0.00 648 S 8.72 3.56 0.00 4.04 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 0.00 649 Y 7.47 4.80 0.00 3.01 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 0.00 650 E 8.64 4.47 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 2.22 2.28 0.00 651 F 8.74 4.49 0.00 3.09 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 0.00 652 K 7.76 4.34 0.00 1.65 1.64 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.35 1.43 7.81 653 S 8.12 4.22 0.00 3.98 3.93 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 0.00 654 T 7.52 4.12 4.05 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 1.09 0.00 0.00 655 V 7.90 4.55 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 0.95 0.00 0.00 0.96 0.00 0.00 656 D 8.56 4.55 0.00 2.76 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