NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 503 S 4.5092 8.2816 116.1785 58.3104 64.3557 171.8400 504 C 3.6351 8.6620 122.5329 60.3046 31.3686 170.1618 505 V 3.7399 7.5228 126.3479 63.1875 31.6461 175.2636 506 N 5.0263 8.4279 115.7737 54.2826 42.0622 174.2683 507 C 4.8771 8.0105 110.7990 59.0880 32.2400 176.5582 508 G 3.9424 8.2328 109.8378 45.8342 0.0000 177.3243 509 R 4.2207 8.7855 129.4855 55.2129 31.1262 176.6971 510 E 3.8278 9.0279 115.5181 57.7843 29.4417 177.0446 511 A 5.0891 6.9931 123.7277 51.6494 20.6193 174.9930 512 M 4.2216 7.5861 119.0977 56.4792 33.1571 176.6051 513 S 4.7614 7.5351 110.5292 56.3396 66.2480 172.3804 514 E 4.7183 8.0510 119.3459 54.1738 31.3383 175.1551 515 C 3.8426 9.1753 121.1561 59.3829 31.1230 175.1799 516 T 4.4892 8.2947 119.8150 62.0369 68.0570 175.2532 517 G 4.2719 7.8982 108.5469 46.1371 0.0000 172.2670 518 C 4.7749 8.5435 113.6627 58.0899 35.8131 173.8988 519 H 4.0984 8.9147 116.0513 56.9200 25.7593 175.5176 520 K 4.4348 8.2690 117.3417 56.9124 33.1613 176.7847 521 V 4.7458 7.2873 111.5382 59.8087 36.5567 173.6627 522 N 5.2637 7.9876 117.7664 51.9709 40.8673 172.8513 523 Y 4.8721 8.2298 117.5843 56.3986 41.3206 176.3359 524 C 4.0102 8.8927 116.0823 60.7150 28.7464 173.1604 525 S 4.8481 7.1887 112.9180 55.6879 65.6698 174.2782 526 T 3.9704 8.2469 117.3346 66.3591 68.4964 177.1131 527 F 4.1972 8.0018 116.7717 60.1871 37.5506 177.0490 528 C 4.0042 6.2674 115.1482 62.6122 27.5512 175.9606 529 Q 2.8354 7.2811 120.4758 58.7454 28.3643 178.2077 530 R 3.5351 7.4627 118.3621 59.0549 30.2419 178.2317 531 K 4.1513 8.0001 117.9285 59.5709 32.2941 178.7345 532 D 4.6868 8.3810 118.7502 55.5872 40.9841 178.0449 533 W 4.6115 7.9030 116.2797 57.2137 27.8715 177.7298 534 K 4.1730 7.6436 121.7540 59.0987 31.4926 177.2256 535 D 4.4551 7.9972 117.6793 56.6368 41.9679 177.5551 536 H 4.3166 8.0223 118.3922 58.6709 29.9407 176.7034 537 Q 2.5200 7.8877 120.3857 59.0432 27.5402 178.5670 538 H 4.2115 7.2926 116.8192 57.1194 28.9707 175.7298 539 I 4.3601 7.9636 112.8160 60.1921 39.0513 175.2147 540 C 4.2059 7.6603 121.8963 60.7448 31.8858 173.0175 541 G 4.1049 9.0285 113.6738 45.3049 0.0000 173.3301 542 Q 4.5366 7.4803 119.0859 54.2431 30.4010 176.7726 543 S 4.4491 8.4901 120.2921 56.8767 60.9695 173.5679 544 A 4.2906 7.6021 126.6112 51.9849 19.0876 176.2376 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 S 8.28 4.51 0.00 3.84 4.14 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 0.00 504 C 8.66 3.64 0.00 3.08 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 505 V 7.52 3.74 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 0.76 0.00 0.00 0.68 0.00 0.00 506 N 8.43 5.03 0.00 2.99 2.94 0.00 0.00 6.93 7.84 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 0.00 507 C 8.01 4.88 0.00 3.01 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 0.00 508 G 8.23 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 509 R 8.79 4.22 0.00 1.88 1.90 0.00 3.14 0.00 0.00 3.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 510 E 9.03 3.83 0.00 2.11 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 0.00 2.35 2.29 0.00 511 A 6.99 5.09 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 0.00 512 M 7.59 4.22 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 513 S 7.54 4.76 0.00 3.90 3.89 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 0.00 514 E 8.05 4.72 0.00 1.85 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 0.00 2.20 2.24 0.00 515 C 9.18 3.84 0.00 3.09 2.93 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 0.00 516 T 8.29 4.49 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 1.18 0.00 0.00 517 G 7.90 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 0.00 0.00 0.00 0.00 518 C 8.54 4.77 0.00 3.13 3.11 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 0.00 519 H 8.91 4.10 0.00 3.27 3.65 0.00 5.66 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 520 K 8.27 4.43 0.00 1.87 1.92 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.51 7.81 521 V 7.29 4.75 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 0.79 0.00 0.00 1.01 0.00 0.00 522 N 7.99 5.26 0.00 2.61 2.77 0.00 0.00 5.76 7.43 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 0.00 523 Y 8.23 4.87 0.00 2.81 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 0.00 524 C 8.89 4.01 0.00 3.08 3.31 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 0.00 525 S 7.19 4.85 0.00 3.67 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 0.00 526 T 8.25 3.97 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 1.12 0.00 0.00 527 F 8.00 4.20 0.00 3.23 3.27 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 0.00 528 C 6.27 4.00 0.00 2.57 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 0.00 529 Q 7.28 2.84 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.13 0.00 0.00 0.00 0.00 0.00 2.20 2.07 0.00 530 R 7.46 3.54 0.00 1.64 1.81 0.00 3.27 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 531 K 8.00 4.15 0.00 1.90 1.88 0.00 1.88 0.00 0.00 2.06 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.69 7.81 532 D 8.38 4.69 0.00 2.71 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 0.00 533 W 7.90 4.61 0.00 3.70 3.52 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 0.00 534 K 7.64 4.17 0.00 1.76 1.95 0.00 1.73 0.00 0.00 1.61 0.00 0.00 3.15 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.87 1.53 7.81 535 D 8.00 4.46 0.00 2.75 2.68 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 0.00 536 H 8.02 4.32 0.00 3.43 3.56 0.00 5.94 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 Q 7.89 2.52 0.00 1.13 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.48 0.00 0.00 0.00 0.00 0.00 1.88 1.72 0.00 538 H 7.29 4.21 0.00 2.99 3.31 0.00 5.59 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 539 I 7.96 4.36 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.01 0.85 0.00 0.00 540 C 7.66 4.21 0.00 3.12 3.06 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 0.00 0.00 0.00 541 G 9.03 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 0.00 0.00 0.00 542 Q 7.48 4.54 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.35 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 543 S 8.49 4.45 0.00 3.84 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 0.00 544 A 7.60 4.29 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