NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 438 H 4.7847 8.3033 116.3105 55.9486 30.1589 172.4033 439 M 4.9319 7.7800 117.9879 53.3096 35.3402 174.3447 440 C 4.3183 9.8252 124.1233 59.8126 33.0686 174.5492 441 L 4.1665 8.5180 126.4005 56.7033 41.7941 178.4497 442 V 3.9683 7.8651 117.7069 64.4998 32.1150 176.1255 443 C 5.3839 7.6268 110.5399 56.3335 30.7924 175.1759 444 S 4.0804 8.0179 114.8923 58.7602 61.0693 169.8512 445 D 4.7330 7.5757 120.7694 53.4374 42.5334 175.0518 446 E 4.4886 8.7108 122.0264 56.3122 30.0914 176.5204 447 A 4.3061 8.6582 126.6033 51.7549 19.1481 177.2168 448 S 4.5204 8.6428 115.9144 58.2337 63.6509 172.8425 449 G 3.5522 7.6879 107.0923 44.8183 0.0000 172.0357 450 C 4.8874 8.2106 119.3874 57.7890 32.7541 172.8819 451 H 4.6727 8.7499 124.1217 55.4837 31.8019 173.1455 452 Y 3.8868 9.0835 119.2361 59.0661 35.5186 172.5857 453 G 4.1055 9.4219 105.9541 44.9342 0.0000 174.1543 454 V 4.4296 7.7003 119.0545 60.4922 35.7370 173.8821 455 L 4.5364 8.5558 129.1728 55.9352 42.9840 175.6199 456 T 5.1242 8.7744 116.1037 60.2472 73.1924 173.2339 457 C 4.8984 8.6762 117.4216 57.4229 31.0584 174.8300 458 G 3.6507 8.0716 108.4297 47.3893 0.0000 176.3516 459 S 4.1972 8.0183 116.3027 61.8950 63.1009 176.3528 460 C 4.3275 8.1230 120.1884 61.8717 28.0322 175.6757 461 K 4.1976 7.9996 121.3308 59.8390 31.8340 179.2490 462 V 3.8943 7.9931 119.0467 64.2239 31.4241 177.9717 463 F 4.1014 8.6412 121.9485 61.2492 39.2344 176.8360 464 F 4.0938 8.8804 120.5388 61.0969 39.2674 176.7699 465 K 3.4215 7.9287 118.8591 59.5702 32.0125 178.8454 466 R 3.7821 7.9791 117.9377 59.1888 29.7413 179.0043 467 A 3.7099 7.4331 119.7644 54.8880 18.3566 179.7859 468 V 3.4699 7.4280 117.1805 64.5674 31.6050 177.9477 469 E 4.2190 7.9563 117.5932 58.5473 30.0921 178.0207 470 G 4.1026 7.8395 106.8872 43.7100 0.0000 172.4678 471 Q 4.4707 7.9363 122.8919 54.4307 31.5828 175.0532 472 H 3.5669 7.3763 114.6015 54.3215 28.8662 174.4186 473 N 4.3926 7.0904 118.1716 53.3321 37.8830 173.3130 474 Y 4.7232 6.9296 117.3397 57.0613 39.9357 175.2188 475 L 4.7859 8.2319 122.7747 53.1467 44.6834 175.7026 476 C 4.2641 8.7753 126.0186 59.4419 32.1086 172.6810 477 A 4.6857 8.6575 128.4122 52.0746 19.9676 177.0249 478 G 4.2561 7.4232 106.3444 46.3521 0.0000 174.6072 479 R 4.6400 8.2278 120.9984 56.0389 30.8916 174.7919 480 N 4.3680 8.6881 110.5748 54.1621 36.5134 174.4495 481 D 4.8787 7.5177 113.4264 52.6526 39.6149 175.5593 482 C 4.2988 8.0392 116.3796 60.5101 29.0918 174.2354 483 I 3.8289 8.2498 124.8118 61.5767 37.3363 176.4511 484 I 4.3136 8.2207 126.4963 59.0680 37.4654 174.2106 485 D 5.8500 7.6284 125.0139 50.3846 42.2427 176.8601 486 K 3.8600 8.7486 118.2161 60.0591 32.1184 179.2470 487 I 3.9799 7.6392 119.1916 64.2682 37.5969 178.3750 488 R 3.9923 8.6106 118.7445 58.2920 29.5927 178.8884 489 R 3.8612 7.7714 115.9479 59.2951 29.1174 177.9013 490 K 3.9864 7.5622 119.4540 58.8929 32.6252 177.7016 491 N 4.4024 8.5679 116.4914 55.7988 38.5548 174.8887 492 C 4.6220 7.4931 119.5352 55.7458 32.2668 171.8960 493 P 3.9658 0.0000 0.0000 64.6567 30.8948 177.8690 494 A 4.3327 7.8999 119.2850 55.7446 18.4912 179.4291 495 C 4.2340 8.0902 114.6386 62.6077 28.2334 176.2555 496 R 3.8234 8.1595 120.7599 59.5769 29.6103 177.8206 497 Y 4.6084 8.9934 119.7330 60.9278 38.7658 177.9510 498 R 3.8381 8.2616 119.5562 59.6665 30.1368 178.7148 499 K 4.0050 8.2680 117.9797 59.3338 31.9396 179.2600 500 C 4.0696 8.0975 117.2628 62.8705 28.1248 176.1484 501 L 3.8867 7.8927 120.7008 57.8006 40.9111 179.6498 502 Q 3.9764 7.9210 117.1365 58.6775 28.7731 178.0238 503 A 4.1810 7.9413 120.0510 53.0618 18.5143 178.1855 504 G 3.9286 7.7589 105.5120 45.0062 0.0000 174.0714 505 M 4.1645 7.2111 119.3389 55.5602 32.3176 175.5033 506 N 5.1496 8.4408 117.7534 51.9120 40.3885 174.9207 507 L 4.2706 8.7903 120.4853 58.1995 42.2075 178.4971 508 E 4.4318 8.1951 116.4120 56.6744 29.3615 177.7151 509 A 4.2818 7.6711 120.1103 54.5712 18.5805 179.9438 510 R 4.1125 8.0659 118.0009 58.1739 30.0764 177.6183 511 K 4.3027 7.7345 121.0124 58.8708 33.3968 178.5838 512 T 4.0737 7.9098 117.3989 64.0984 68.6669 174.5698 513 K 4.1564 7.7310 123.8828 57.2692 34.7018 174.3155 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 438 H 8.30 4.78 0.00 3.36 3.61 0.00 5.56 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 439 M 7.78 4.93 0.00 2.07 1.97 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 2.47 2.63 0.00 440 C 9.83 4.32 0.00 3.02 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 0.00 441 L 8.52 4.17 0.00 1.78 1.68 0.95 0.74 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 0.00 442 V 7.87 3.97 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 0.83 0.00 0.00 0.93 0.00 0.00 443 C 7.63 5.38 0.00 3.06 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 0.00 444 S 8.02 4.08 0.00 4.07 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 0.00 445 D 7.58 4.73 0.00 2.80 2.53 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 0.00 0.00 0.00 0.00 446 E 8.71 4.49 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 2.28 2.33 0.00 447 A 8.66 4.31 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 0.00 448 S 8.64 4.52 0.00 4.02 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 0.00 449 G 7.69 3.55 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 0.00 0.00 0.00 450 C 8.21 4.89 0.00 2.84 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 0.00 451 H 8.75 4.67 0.00 3.10 2.74 0.00 5.82 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 452 Y 9.08 3.89 0.00 3.13 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 0.00 453 G 9.42 4.11 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 0.00 454 V 7.70 4.43 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 0.95 0.00 0.00 0.94 0.00 0.00 455 L 8.56 4.54 0.00 1.79 1.54 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 456 T 8.77 5.12 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 1.27 0.00 0.00 457 C 8.68 4.90 0.00 3.15 3.28 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 0.00 458 G 8.07 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 0.00 0.00 0.00 459 S 8.02 4.20 0.00 4.09 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 460 C 8.12 4.33 0.00 3.08 3.14 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 0.00 461 K 8.00 4.20 0.00 1.82 1.91 0.00 1.31 0.00 0.00 1.51 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.58 1.58 7.81 462 V 7.99 3.89 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 0.91 0.00 0.00 0.99 0.00 0.00 463 F 8.64 4.10 0.00 3.21 3.42 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 0.00 0.00 0.00 0.00 464 F 8.88 4.09 0.00 3.40 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 0.00 465 K 7.93 3.42 0.00 1.83 2.04 0.00 1.62 0.00 0.00 1.47 0.00 0.00 3.42 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.49 7.81 466 R 7.98 3.78 0.00 1.84 1.85 0.00 3.21 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.94 0.00 467 A 7.43 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 468 V 7.43 3.47 1.27 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 0.28 0.00 0.00 0.76 0.00 0.00 469 E 7.96 4.22 0.00 2.01 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 2.17 0.00 470 G 7.84 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 0.00 471 Q 7.94 4.47 0.00 1.84 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.44 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 472 H 7.38 3.57 0.00 2.35 2.55 0.00 5.52 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 N 7.09 4.39 0.00 2.48 2.60 0.00 0.00 7.28 7.54 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 0.00 474 Y 6.93 4.72 0.00 3.12 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 0.00 475 L 8.23 4.79 0.00 1.59 1.56 0.96 0.94 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 0.00 476 C 8.78 4.26 0.00 3.03 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 0.00 477 A 8.66 4.69 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 0.00 478 G 7.42 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 0.00 0.00 0.00 0.00 479 R 8.23 4.64 0.00 1.97 1.88 0.00 3.29 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 480 N 8.69 4.37 0.00 2.87 2.92 0.00 0.00 6.91 8.06 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 0.00 481 D 7.52 4.88 0.00 2.82 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 0.00 482 C 8.04 4.30 0.00 2.98 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 0.00 483 I 8.25 3.83 1.86 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 1.41 0.46 0.90 0.00 0.00 484 I 8.22 4.31 1.84 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 1.61 1.05 0.83 0.00 0.00 485 D 7.63 5.85 0.00 2.85 2.78 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 0.00 486 K 8.75 3.86 0.00 1.76 1.87 0.00 2.06 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.53 7.81 487 I 7.64 3.98 1.85 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 1.63 0.40 0.89 0.00 0.00 488 R 8.61 3.99 0.00 1.94 1.94 0.00 3.26 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 489 R 7.77 3.86 0.00 1.80 2.17 0.00 2.99 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.55 0.00 490 K 7.56 3.99 0.00 1.66 1.83 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.37 7.81 491 N 8.57 4.40 0.00 2.79 2.84 0.00 0.00 6.68 7.76 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 0.00 492 C 7.49 4.62 0.00 2.86 2.71 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 0.00 0.00 0.00 493 P 0.00 3.97 0.00 0.68 1.55 0.00 3.53 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 1.78 1.93 0.00 494 A 7.90 4.33 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 495 C 8.09 4.23 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 496 R 8.16 3.82 0.00 1.73 1.72 0.00 2.50 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.39 0.00 497 Y 8.99 4.61 0.00 3.50 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 0.00 498 R 8.26 3.84 0.00 2.03 2.18 0.00 3.17 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 499 K 8.27 4.01 0.00 2.03 1.83 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.67 7.81 500 C 8.10 4.07 0.00 3.31 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 0.00 501 L 7.89 3.89 0.00 1.65 1.61 0.70 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 502 Q 7.92 3.98 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 503 A 7.94 4.18 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 0.00 504 G 7.76 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 0.00 0.00 0.00 505 M 7.21 4.16 0.00 0.91 0.62 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.26 0.00 506 N 8.44 5.15 0.00 2.87 2.79 0.00 0.00 6.98 8.44 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 0.00 507 L 8.79 4.27 0.00 1.81 1.80 0.46 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 508 E 8.20 4.43 0.00 2.04 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 0.00 2.41 2.28 0.00 509 A 7.67 4.28 1.46 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 0.00 0.00 510 R 8.07 4.11 0.00 1.92 1.89 0.00 3.18 0.00 0.00 3.43 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.77 0.00 511 K 7.73 4.30 0.00 1.92 1.95 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.55 7.81 512 T 7.91 4.07 4.42 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 0.00 0.00 0.00 1.23 0.00 0.00 513 K 7.73 4.16 0.00 1.99 1.80 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.37 7.81