NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 425 Y 4.5813 8.1449 121.6900 57.5163 39.3047 174.0523 426 V 4.1846 7.6900 120.1694 58.3577 34.7942 170.0903 427 V 4.1156 7.9425 121.9844 61.0478 34.8337 174.3586 428 C 4.9047 8.1845 121.0034 55.9289 32.2594 174.5341 429 R 3.8487 8.5757 117.7579 58.7970 29.6109 177.7746 430 Q 4.6572 8.2424 114.5076 55.5719 29.7088 175.2529 431 C 4.4909 7.8549 116.5982 58.8846 28.8920 172.4819 432 P 4.4387 0.0000 0.0000 62.3307 33.1114 177.2500 433 E 3.9430 8.6644 118.5378 59.9092 29.1532 179.2930 434 Y 4.3205 7.8318 116.1456 59.9226 38.3673 178.1541 435 R 4.0870 7.0394 120.0273 59.1292 30.2547 177.9753 436 R 3.9218 7.9050 118.5265 59.6966 29.8830 178.2787 437 Q 4.0817 8.4806 115.4785 57.7484 28.8561 176.7035 438 A 4.3218 7.6627 119.0147 52.1998 19.3992 177.3649 439 A 4.2281 7.4622 118.9802 51.6332 19.0871 177.4882 440 Q 4.1407 8.3005 118.8061 55.0023 29.4056 175.2100 441 P 4.3618 0.0000 0.0000 61.8578 31.9517 174.5936 442 P 4.5402 0.0000 0.0000 62.8679 32.4280 175.8877 *443 H 4.5131 8.4396 115.4110 54.1476 28.6050 172.9394 444 C 4.7545 8.3878 122.0288 56.3700 29.5620 172.4826 445 P 4.0789 0.0000 0.0000 65.6934 30.6752 176.4364 *473 D 4.5418 7.9308 116.6303 53.5400 42.6160 174.4662 474 Y 4.3204 8.0113 118.4196 58.2382 39.4790 174.7474 475 V 4.5793 7.1430 124.1197 60.7762 34.3559 174.8359 476 C 4.2353 8.7029 126.3473 59.6587 28.4684 172.2315 477 P 4.5246 0.0000 0.0000 61.8357 32.4292 176.8807 478 L 4.0100 8.8021 122.2150 58.5826 41.8687 177.9292 479 Q 4.3090 8.0616 113.9350 56.1537 29.0487 176.3402 480 G 3.7750 8.0808 108.4408 45.5048 0.0000 172.7593 481 S 4.8641 8.2553 114.3218 56.5317 66.8829 172.0603 482 H 5.4209 8.6784 115.4807 53.9394 32.3078 173.0903 483 A 4.7924 8.8417 121.5397 50.1188 22.6287 175.1157 484 L 4.7597 8.3626 120.1636 53.6311 43.2007 176.4886 485 C 4.0013 8.7331 124.5815 60.0010 31.8616 174.9491 486 T 3.7755 8.2514 123.6479 66.4382 68.2558 175.4882 487 C 4.0769 7.8674 120.9022 61.6441 32.2035 173.9382 488 C 3.9898 7.6720 112.2349 57.5360 30.0942 174.8367 489 F 4.1922 7.6686 117.9173 57.9890 37.1938 174.5296 490 Q 4.7414 7.4795 120.1380 53.9298 30.2779 173.7726 491 P 5.1310 0.0000 0.0000 63.3550 32.3041 175.2463 492 M 5.1263 9.0981 118.5773 52.5968 35.0695 172.5303 493 P 4.4567 0.0000 0.0000 63.2198 32.2610 175.8251 494 D 4.3249 8.7302 124.0800 52.9245 40.8986 175.5531 495 R 4.5023 8.3421 124.5230 55.8031 31.1654 179.0723 496 R 3.8252 7.9741 120.3271 59.3589 29.7250 179.0239 497 V 4.4209 7.5365 117.5815 65.6121 31.7626 177.0441 498 E 4.0295 8.1495 118.5441 59.3533 29.3172 178.6569 499 R 4.0514 8.0481 118.7910 59.3487 30.0432 178.0159 500 E 3.9053 7.9834 117.9286 59.4108 29.6048 178.5801 501 Q 4.3618 7.6645 114.5397 56.2263 29.4832 175.9966 502 D 4.5568 8.1904 118.9497 52.2377 41.9962 173.5289 503 P 4.4156 0.0000 0.0000 64.2868 31.7248 178.2375 504 R 4.0229 7.9580 117.1379 58.7001 30.1726 177.7015 505 V 3.6763 7.6631 117.7370 62.2183 31.9986 175.6219 506 A 4.2078 8.4377 129.8165 51.2137 18.9927 175.5069 507 P 4.3911 0.0000 0.0000 63.3692 32.0666 176.3015 508 Q 4.9479 8.5605 118.8925 55.2847 31.0531 174.3969 509 Q 5.1270 7.8728 115.6408 54.7921 31.9430 173.6254 510 C 4.3475 9.2011 121.5164 59.3174 32.0146 174.6736 511 A 4.0019 8.9334 129.7801 54.8850 18.3211 178.8852 512 V 3.8495 7.6833 114.9424 65.3286 32.1414 176.7318 513 C 4.2515 7.9008 112.8862 58.0727 30.3015 174.7656 514 L 3.7774 8.0548 118.8619 55.1725 39.6930 174.3759 515 Q 4.2122 7.4829 118.4000 55.1532 29.9894 173.8665 516 P 4.9332 0.0000 0.0000 62.5993 32.7464 175.3239 517 F 5.1977 8.8176 121.5148 55.4170 43.0509 175.0658 518 C 4.4124 8.9833 115.8427 59.0376 30.3065 175.3730 519 H 4.3265 8.2947 121.5022 59.7813 29.3068 176.8563 520 L 4.0510 7.9369 118.7144 57.5924 41.5478 178.4978 521 Y 4.2245 7.8625 118.8236 59.9069 38.9063 177.3941 522 W 4.8173 8.2392 111.3271 56.8973 30.1361 171.2641 523 G 3.8230 8.5697 114.0530 46.0465 0.0000 173.1675 524 C 4.6654 8.8005 125.0862 58.3046 32.9259 172.8633 525 T 4.5804 8.0003 121.1177 61.9916 71.0492 173.5408 526 R 4.3395 8.0027 123.2436 55.3350 32.8981 173.6794 527 T 4.0336 8.4758 122.1205 66.3763 68.3218 174.0535 528 G 3.7517 8.7743 114.9382 45.4216 0.0000 172.5980 529 C 4.0341 7.6983 120.9228 58.7159 31.6293 172.8121 530 Y 4.4768 7.8958 124.2355 57.8551 38.3749 175.8866 531 G 3.8787 7.9316 110.5022 46.2034 0.0000 173.8560 532 C 4.3030 8.3422 118.8038 58.3791 30.4965 173.3767 533 L 4.7494 7.1769 120.7980 54.1653 44.9880 174.4462 534 A 4.5639 8.6728 124.2887 50.2850 23.3575 173.8080 535 P 4.5508 0.0000 0.0000 63.0796 32.2968 177.1260 536 F 4.4811 9.4143 126.8816 61.7352 39.3573 177.3274 537 C 4.1191 8.2504 113.5915 60.2890 29.3267 173.9623 538 E 4.5167 8.1215 118.0101 55.5990 30.1842 175.9687 539 L 4.1169 7.7604 122.0876 55.1499 42.6191 175.7903 540 N 5.0379 8.8253 123.3899 52.6630 39.2712 174.9091 541 L 4.5411 8.5618 121.9830 54.0671 42.8302 177.5580 542 G 3.1662 7.4337 104.8554 45.0132 0.0000 174.4579 543 D 4.4277 8.1435 119.6510 56.5007 41.1929 177.8589 544 K 4.5430 7.6959 117.0316 56.0646 32.3931 177.6949 545 C 4.1736 7.3939 115.7448 60.5648 29.6973 174.8009 546 L 4.2426 7.7654 119.7729 56.3411 41.7506 176.1741 547 D 4.4853 8.1127 119.7647 55.2017 40.9200 176.0962 548 G 4.0551 9.0806 112.0053 46.2661 0.0000 175.4606 549 V 3.6072 7.7402 121.4128 63.9234 31.5543 176.4564 550 L 4.3452 8.1017 121.5797 54.2032 40.0368 175.9462 551 N 4.3239 9.2699 122.4762 54.1185 36.3130 174.3130 552 N 4.2229 8.1581 110.7816 54.4554 36.9459 174.6841 553 N 4.8144 8.0925 117.8495 52.0222 39.9204 174.6872 554 S 4.2000 8.5618 124.8495 61.4041 63.1440 175.6272 555 Y 3.9455 8.0872 122.6747 60.7099 38.6923 177.7610 556 E 4.0301 9.0220 119.8338 59.5323 29.4981 179.5647 557 S 4.1826 8.3023 115.2871 61.6335 62.8737 176.4616 558 D 4.3291 8.4740 122.0752 57.1656 40.4300 178.8226 559 I 3.5983 7.3567 120.3462 64.3034 37.0835 178.1142 560 L 4.0245 7.8581 121.0559 58.2100 41.9141 179.1184 561 K 4.0220 8.3532 118.5418 59.6428 31.8989 179.0939 562 N 4.3863 8.3110 116.7579 56.2577 38.4474 176.8461 563 Y 4.0611 8.2267 121.0422 60.6976 38.9125 178.0325 564 L 3.9220 8.3252 119.7249 57.8541 41.7974 179.4068 565 A 3.9859 8.0266 120.4865 55.6173 18.0985 179.8442 566 T 3.8285 7.9052 113.3145 66.6034 68.6102 176.4202 567 R 4.1130 7.7121 117.2743 55.8847 30.2242 176.9004 568 G 3.8423 7.7099 106.8214 46.4211 0.0000 173.6053 569 L 4.7971 8.0574 118.9580 52.9518 44.1076 176.9200 570 T 4.5086 8.4085 112.4748 59.7996 72.1650 175.8583 571 W 4.3745 8.5248 118.4133 59.7404 27.7726 178.4925 572 K 3.4435 6.8203 118.8906 59.0085 31.3901 178.7250 573 N 4.2141 7.8187 116.7789 56.4141 38.3351 177.0924 574 M 3.6845 7.8539 119.2632 58.3771 32.3099 177.9710 575 L 4.0349 8.1064 120.4282 58.4921 42.3245 178.7833 576 T 3.7772 8.0975 115.9507 67.0325 68.5983 176.3793 577 E 4.0207 8.3570 120.1479 59.5452 29.3622 179.7281 578 S 4.2578 8.4236 115.6022 61.4944 62.8429 176.6518 579 L 4.0104 8.3764 122.2517 57.3464 41.2831 179.5957 580 V 3.5051 7.8723 118.3066 65.9791 31.4593 177.9943 581 A 3.7652 7.6189 120.0459 54.6831 17.9670 179.3256 582 L 4.2347 8.0045 120.4364 57.9957 42.0271 178.9881 583 Q 4.0125 8.0487 118.1463 59.1600 29.0609 177.7470 584 R 4.2568 7.8461 116.2231 56.0772 30.3810 177.5183 585 G 3.9872 8.0424 107.3034 45.6286 0.0000 175.0893 586 V 3.7813 7.9856 120.2324 64.9887 32.0579 176.2774 587 F 5.4088 7.8827 117.0611 55.9038 41.0699 174.4418 588 L 5.1404 8.9508 121.9665 53.0617 44.9045 176.2511 589 L 5.0416 8.1414 120.0125 52.7332 44.4974 178.0927 590 S 4.0987 9.4455 116.0811 60.3385 63.3678 173.7311 591 D 4.6368 7.4272 118.5263 52.2791 40.6995 176.0965 592 Y 4.4485 8.1624 125.2262 58.8223 38.3220 177.2937 593 R 4.0970 7.6209 119.4889 58.1118 30.5388 177.0461 594 V 3.8712 7.3583 118.1095 62.4647 32.2602 174.8770 595 T 4.8841 9.1860 116.4191 59.4361 71.9846 174.7529 596 G 3.7814 8.6721 108.8715 48.0187 0.0000 174.8112 597 D 4.6401 8.1085 118.5182 55.4669 41.7319 177.1141 598 T 4.0051 7.7451 117.4280 63.7104 69.7070 173.6560 599 V 4.3360 8.4586 126.2890 62.6540 32.8433 174.6488 600 L 5.1409 8.9093 127.7604 52.8522 46.1206 176.4282 601 C 4.6770 8.2239 115.6519 56.4508 31.3001 173.9173 602 Y 4.0242 8.3863 119.8385 61.2707 37.9990 177.9261 603 C 3.9067 8.0669 116.7047 63.0348 28.1936 175.8574 604 C 4.1578 7.9422 117.8986 62.6920 27.7046 176.2793 605 G 3.1774 8.1233 107.6697 47.3917 0.0000 175.4904 606 L 3.8796 7.8587 123.0540 57.7956 41.7804 179.0567 607 R 3.8421 7.6214 118.2922 59.7360 29.9776 178.7973 608 S 4.2216 7.8094 114.9824 61.2409 62.7000 176.3040 609 F 4.4673 8.8638 124.0058 61.6159 39.1709 177.3188 610 R 3.7466 8.3471 117.6504 59.3019 29.3308 178.8878 611 E 3.9555 7.9437 118.0909 59.4925 29.4110 179.4718 612 L 4.0870 8.3250 119.2745 58.1260 41.5938 179.7480 613 T 3.7819 8.0162 115.9984 66.5425 67.8589 176.0325 614 Y 3.8897 7.8939 121.4275 60.9312 38.7701 178.3872 615 Q 4.0214 7.6585 119.3647 58.1745 28.3627 177.9297 616 Y 4.1423 7.9214 120.2772 60.6837 39.1420 177.8743 617 R 3.8929 8.2428 119.7556 59.6927 29.8165 178.1732 618 Q 3.8052 7.7771 117.8492 58.9635 28.4311 178.1594 619 N 4.7818 7.3548 113.9087 52.0817 38.9086 175.0976 620 I 3.6474 6.9185 123.1153 59.9709 37.7734 174.3886 621 P 4.2313 0.0000 0.0000 62.3215 32.0485 177.1322 622 A 3.9599 8.8026 125.7200 55.3799 18.3548 179.6091 623 S 4.2637 8.0345 108.5202 60.4686 63.1877 174.5800 624 E 4.5726 8.0850 119.5873 56.0001 29.6154 175.3774 625 L 4.9104 7.4611 118.5602 51.7026 45.2278 174.6821 626 P 4.3550 0.0000 0.0000 62.7090 32.0937 177.8552 627 V 3.5809 8.6180 121.2514 66.2664 31.1959 178.2709 628 A 3.9630 7.9760 118.8471 54.9814 18.4433 179.4485 629 V 3.7658 7.6239 116.7550 66.4273 31.5198 178.2066 630 T 4.1895 7.7640 106.7521 63.9082 69.1085 176.1654 631 S 4.2714 8.1277 117.3354 59.5674 63.3785 174.8550 632 R 3.9838 6.9276 120.0163 55.1498 30.5345 174.7748 633 P 4.5304 0.0000 0.0000 62.7278 32.8477 175.1660 634 D 4.8958 8.5368 121.4001 54.3575 41.8424 175.7282 635 C 3.8382 8.8216 124.3467 59.0871 32.3253 174.1121 636 Y 4.1720 7.4518 123.3679 58.7849 38.3048 177.3522 637 W 4.7044 7.7134 120.3468 57.1500 30.6383 177.4202 638 G 3.8240 8.1019 108.8162 46.0158 0.0000 175.7695 639 R 4.1177 8.8111 117.4944 58.7714 29.3232 177.5026 640 N 4.6284 7.7656 113.8853 53.0813 39.0622 174.9056 641 C 4.1476 8.0910 119.8694 60.0158 31.9211 173.6613 642 R 4.2575 8.3320 124.4553 57.5171 30.5188 177.2538 643 T 4.2835 7.6805 113.8179 64.0651 68.9596 176.0421 644 Q 4.1680 7.8759 118.8344 57.8000 28.8350 177.3923 645 V 3.9353 7.6810 111.2943 62.7943 32.1872 176.3416 646 K 4.4456 8.0863 121.2775 54.6336 33.4961 176.7863 647 A 4.0425 8.7116 126.7204 55.7643 18.2234 178.8807 648 H 4.0749 8.2076 116.0261 59.6848 29.9035 176.8537 649 H 4.2920 8.2784 119.4360 59.1426 29.5904 176.9700 650 A 4.0329 7.8845 121.9875 55.1832 18.2369 178.9940 651 M 2.5500 7.5655 116.1105 58.0937 32.3020 178.3247 652 K 3.7837 7.3966 117.7272 57.1763 32.6258 177.3299 653 F 4.8465 7.0533 116.1371 54.9439 42.2465 174.3879 654 N 4.6428 8.9574 123.5104 54.2424 39.2016 174.9734 655 H 5.0644 9.0758 120.8544 55.8161 29.9372 175.3913 656 I 4.2312 8.2111 122.8356 58.0478 35.3864 174.1227 657 C 4.7268 7.5061 117.5187 57.3077 32.2054 174.1262 658 E 4.5010 8.5300 119.7541 55.4620 29.9377 176.6837 659 Q 4.2242 8.5631 122.9317 56.5181 29.4645 175.9710 660 T 4.5734 8.7521 114.4149 61.1794 70.4459 174.2006 661 R 4.5950 7.4348 120.0357 54.5445 33.2594 174.9706 662 F 4.9354 8.6846 119.2896 57.3003 40.8284 176.1122 663 K 4.3029 8.3649 127.6390 55.0465 31.3249 180.9588 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 425 Y 8.14 4.58 0.00 2.95 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 0.00 426 V 7.69 4.18 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 0.70 0.00 0.00 0.73 0.00 0.00 427 V 7.94 4.12 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 0.82 0.00 0.00 0.87 0.00 0.00 428 C 8.18 4.90 0.00 3.67 3.15 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 0.00 429 R 8.58 3.85 0.00 1.27 1.69 0.00 2.71 0.00 0.00 2.58 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.50 0.00 430 Q 8.24 4.66 0.00 2.58 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 7.06 0.00 0.00 0.00 0.00 0.00 2.73 2.78 0.00 431 C 7.85 4.49 0.00 3.10 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 0.00 432 P 0.00 4.44 0.00 1.80 2.04 0.00 3.45 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.77 0.00 433 E 8.66 3.94 0.00 2.03 2.09 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 2.41 2.34 0.00 434 Y 7.83 4.32 0.00 3.08 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 0.00 435 R 7.04 4.09 0.00 1.36 1.77 0.00 3.15 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 436 R 7.90 3.92 0.00 1.89 2.04 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 437 Q 8.48 4.08 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.60 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 438 A 7.66 4.32 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 0.00 439 A 7.46 4.23 1.44 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 0.00 440 Q 8.30 4.14 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 441 P 0.00 4.36 0.00 2.04 1.98 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 442 P 0.00 4.54 0.00 2.18 2.08 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 *443 H 8.44 4.51 0.00 2.95 2.89 0.00 7.18 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 0.00 444 C 8.39 4.75 0.00 2.94 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 0.00 445 P 0.00 4.08 0.00 2.17 2.22 0.00 3.79 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 2.00 1.99 0.00 *473 D 7.93 4.54 0.00 2.70 2.81 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 0.00 474 Y 8.01 4.32 0.00 3.00 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 0.00 475 V 7.14 4.58 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 0.85 0.00 0.00 0.90 0.00 0.00 476 C 8.70 4.24 0.00 2.89 2.89 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 0.00 477 P 0.00 4.52 0.00 2.14 2.16 0.00 3.76 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.01 0.00 478 L 8.80 4.01 0.00 1.72 1.82 1.08 0.78 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 0.00 479 Q 8.06 4.31 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 480 G 8.08 3.78 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 0.00 0.00 0.00 481 S 8.26 4.86 0.00 3.83 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 0.00 482 H 8.68 5.42 0.00 2.94 3.24 0.00 5.84 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 483 A 8.84 4.79 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 0.00 484 L 8.36 4.76 0.00 1.56 1.68 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 485 C 8.73 4.00 0.00 3.09 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 0.00 486 T 8.25 3.78 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 0.00 0.00 0.00 1.09 0.00 0.00 487 C 7.87 4.08 0.00 3.17 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 0.00 488 C 7.67 3.99 0.00 3.09 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0.00 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 Y 8.23 4.06 0.00 3.00 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 0.00 564 L 8.33 3.92 0.00 1.78 1.90 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 565 A 8.03 3.99 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 0.00 566 T 7.91 3.83 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 1.16 0.00 0.00 567 R 7.71 4.11 0.00 1.72 1.81 0.00 2.91 0.00 0.00 2.64 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.05 0.00 568 G 7.71 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 0.00 569 L 8.06 4.80 0.00 1.57 1.54 0.97 0.67 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 0.00 570 T 8.41 4.51 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 1.10 0.00 0.00 571 W 8.52 4.37 0.00 3.78 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 0.00 572 K 6.82 3.44 0.00 1.15 1.41 0.00 1.10 0.00 0.00 1.39 0.00 0.00 2.55 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.30 0.21 7.81 573 N 7.82 4.21 0.00 2.85 2.82 0.00 0.00 6.65 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 0.00 574 M 7.85 3.68 0.00 2.23 1.75 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.16 0.00 575 L 8.11 4.03 0.00 2.21 1.88 0.76 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 576 T 8.10 3.78 4.35 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 1.17 0.00 0.00 577 E 8.36 4.02 0.00 2.12 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 0.00 2.54 2.59 0.00 578 S 8.42 4.26 0.00 4.13 4.28 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 0.00 579 L 8.38 4.01 0.00 1.73 1.66 0.59 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 580 V 7.87 3.51 2.19 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 0.95 0.00 0.00 0.92 0.00 0.00 581 A 7.62 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 582 L 8.00 4.23 0.00 1.99 1.93 1.09 1.00 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 0.00 583 Q 8.05 4.01 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 584 R 7.85 4.26 0.00 1.88 1.93 0.00 3.22 0.00 0.00 3.19 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 585 G 8.04 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 0.00 586 V 7.99 3.78 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 0.87 0.00 0.00 0.91 0.00 0.00 587 F 7.88 5.41 0.00 3.13 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 0.00 588 L 8.95 5.14 0.00 1.63 1.60 0.97 1.26 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 0.00 589 L 8.14 5.04 0.00 1.86 1.60 1.12 1.01 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 0.00 590 S 9.45 4.10 0.00 3.93 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 0.00 591 D 7.43 4.64 0.00 2.68 2.54 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 0.00 592 Y 8.16 4.45 0.00 3.11 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 0.00 593 R 7.62 4.10 0.00 1.76 1.94 0.00 3.02 0.00 0.00 2.89 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.69 0.00 594 V 7.36 3.87 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 0.82 0.00 0.00 0.85 0.00 0.00 595 T 9.19 4.88 4.32 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 1.28 0.00 0.00 596 G 8.67 3.78 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 0.00 0.00 0.00 597 D 8.11 4.64 0.00 2.73 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 0.00 598 T 7.75 4.01 4.28 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 1.19 0.00 0.00 599 V 8.46 4.34 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 1.08 0.00 0.00 0.96 0.00 0.00 600 L 8.91 5.14 0.00 1.43 1.28 0.15 0.78 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 0.00 601 C 8.22 4.68 0.00 2.33 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.39 4.02 0.00 3.00 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 0.00 603 C 8.07 3.91 0.00 3.04 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 0.00 604 C 7.94 4.16 0.00 2.83 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 0.00 0.00 0.00 0.00 605 G 8.12 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 0.00 0.00 0.00 606 L 7.86 3.88 0.00 1.17 1.49 0.85 0.66 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 0.00 607 R 7.62 3.84 0.00 1.83 2.00 0.00 3.11 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 608 S 7.81 4.22 0.00 3.64 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 0.00 609 F 8.86 4.47 0.00 3.33 3.36 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 0.00 610 R 8.35 3.75 0.00 2.05 1.96 0.00 3.20 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 611 E 7.94 3.96 0.00 2.21 2.02 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 2.31 2.50 0.00 612 L 8.33 4.09 0.00 1.90 1.89 1.06 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 613 T 8.02 3.78 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 1.05 0.00 0.00 614 Y 7.89 3.89 0.00 2.99 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 0.00 615 Q 7.66 4.02 0.00 1.31 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.21 0.00 616 Y 7.92 4.14 0.00 3.13 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 0.00 617 R 8.24 3.89 0.00 1.86 1.82 0.00 3.03 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.43 0.00 618 Q 7.78 3.81 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.67 0.00 0.00 0.00 0.00 0.00 2.20 2.06 0.00 619 N 7.35 4.78 0.00 2.64 2.78 0.00 0.00 7.09 8.62 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 0.00 620 I 6.92 3.65 1.58 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.25 0.25 0.00 0.00 621 P 0.00 4.23 0.00 2.17 1.96 0.00 3.56 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.06 0.00 622 A 8.80 3.96 1.28 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 0.00 0.00 623 S 8.03 4.26 0.00 4.00 4.01 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 0.00 624 E 8.09 4.57 0.00 2.20 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 0.00 2.34 2.31 0.00 625 L 7.46 4.91 0.00 1.69 1.51 0.80 0.70 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 0.00 626 P 0.00 4.36 0.00 2.18 1.98 0.00 3.61 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 627 V 8.62 3.58 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 1.12 0.00 0.00 0.93 0.00 0.00 628 A 7.98 3.96 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 0.00 629 V 7.62 3.77 2.28 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 1.06 0.00 0.00 0.95 0.00 0.00 630 T 7.76 4.19 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 1.19 0.00 0.00 631 S 8.13 4.27 0.00 3.85 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 0.00 632 R 6.93 3.98 0.00 1.82 1.75 0.00 3.22 0.00 0.00 3.59 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 633 P 0.00 4.53 0.00 2.18 2.15 0.00 3.58 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 634 D 8.54 4.90 0.00 2.60 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 0.00 635 C 8.82 3.84 0.00 2.51 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 0.00 636 Y 7.45 4.17 0.00 2.77 2.98 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 0.00 637 W 7.71 4.70 0.00 3.35 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 0.00 638 G 8.10 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 639 R 8.81 4.12 0.00 1.70 2.20 0.00 3.01 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.47 0.00 640 N 7.77 4.63 0.00 3.02 2.86 0.00 0.00 6.90 8.15 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 0.00 641 C 8.09 4.15 0.00 3.27 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 0.00 642 R 8.33 4.26 0.00 1.72 1.89 0.00 3.36 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.46 0.00 643 T 7.68 4.28 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 1.11 0.00 0.00 644 Q 7.88 4.17 0.00 1.94 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.06 0.00 0.00 0.00 0.00 0.00 2.49 2.36 0.00 645 V 7.68 3.94 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 0.73 0.00 0.00 1.01 0.00 0.00 646 K 8.09 4.45 0.00 1.93 1.78 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.60 7.81 647 A 8.71 4.04 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 0.00 648 H 8.21 4.07 0.00 3.28 3.36 0.00 5.87 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 649 H 8.28 4.29 0.00 3.36 3.61 0.00 5.92 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 650 A 7.88 4.03 1.49 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 0.00 0.00 651 M 7.57 2.55 0.00 1.88 1.75 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.26 0.00 652 K 7.40 3.78 0.00 1.40 1.22 0.00 1.45 0.00 0.00 1.45 0.00 0.00 2.81 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.43 1.34 7.81 653 F 7.05 4.85 0.00 2.64 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 0.00 654 N 8.96 4.64 0.00 2.80 2.82 0.00 0.00 6.92 8.33 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 0.00 655 H 9.08 5.06 0.00 3.23 3.43 0.00 5.89 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 656 I 8.21 4.23 1.88 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.33 0.53 0.00 0.00 657 C 7.51 4.73 0.00 3.08 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 0.00 658 E 8.53 4.50 0.00 2.03 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 2.36 2.28 0.00 659 Q 8.56 4.22 0.00 2.10 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 1.69 2.50 0.00 660 T 8.75 4.57 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 1.23 0.00 0.00 661 R 7.43 4.60 0.00 0.97 1.23 0.00 3.09 0.00 0.00 2.91 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.63 0.00 662 F 8.68 4.94 0.00 3.07 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 0.00 663 K 8.36 4.30 0.00 1.77 1.62 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.37 1.06 7.81 * Residues marked with a * may have inaccurate shift predictions.