NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 414 G 3.7381 8.3549 109.7189 45.3398 0.0000 174.9155 415 Y 3.5618 7.7070 116.5365 58.7992 38.0126 174.3837 416 W 5.1496 7.5735 119.0302 56.2862 30.6680 175.9511 417 I 4.0401 7.6723 111.2690 60.7882 37.9302 175.5977 418 T 4.3892 8.2845 118.6668 62.7931 67.8289 174.8437 419 C 4.3586 8.6778 122.3481 59.7928 30.7874 172.8849 420 C 4.6930 7.4002 113.5862 56.8836 31.2805 172.8230 421 P 4.3819 0.0000 0.0000 64.8419 30.9267 177.6055 422 T 4.4855 7.6894 106.4193 60.9889 69.0536 173.7236 423 C 4.0553 7.8208 122.3480 60.8000 31.6519 173.1770 424 D 4.8310 8.6496 124.8955 53.9838 41.4866 176.3490 425 V 4.1096 7.6891 120.2228 62.3140 32.3792 174.6271 426 D 4.8639 8.7490 125.4507 52.3268 44.0068 175.6937 427 I 2.5037 8.5799 126.4683 63.3207 37.9202 175.8817 428 N 4.6882 8.5758 116.0775 53.7659 38.7255 175.4567 429 T 4.6285 7.9568 105.6339 60.4203 70.7923 174.3283 430 W 4.2933 8.3187 132.1395 57.7406 31.3125 175.0352 431 V 3.8223 6.6542 116.3926 58.0818 35.1535 173.5822 432 P 4.0911 0.0000 0.0000 62.9341 31.8734 175.0011 433 F 4.4499 9.7254 121.2669 60.0687 41.1052 175.3726 434 Y 4.4704 8.0960 117.5518 57.3546 38.4117 176.8219 435 S 4.2425 9.4324 117.2324 60.7170 63.2534 175.2300 436 T 4.3329 7.9324 109.5913 61.8882 69.3102 174.3193 437 E 4.7095 7.9631 122.3859 55.6416 30.7092 174.4781 438 L 4.7153 8.3607 122.2103 55.9636 44.6736 176.6651 439 N 5.3333 8.2378 113.2844 52.8792 40.2387 174.7807 440 K 3.7621 7.5368 116.7816 53.0408 35.9904 174.2490 441 P 4.5277 0.0000 0.0000 62.2886 32.1129 176.0410 442 A 4.3241 9.9410 123.8797 52.5943 19.3837 176.3912 443 M 5.3933 8.5214 119.4856 53.7638 36.5778 174.5409 444 I 4.8216 8.9267 119.9995 59.6219 42.4552 173.1649 445 Y 4.0987 8.1782 129.4083 56.7023 40.2601 173.4971 446 C 4.2045 8.3121 128.0936 58.8656 32.7458 173.5761 447 S 4.3290 7.8601 121.7678 58.5945 63.3734 173.9465 448 H 4.2615 8.0339 121.9591 57.1035 30.9023 174.5703 449 G 3.6656 8.2358 115.2149 46.9770 0.0000 175.0806 450 D 4.3512 8.6588 122.4053 55.3135 41.1315 176.8621 451 G 3.4729 9.4557 104.1869 46.5338 0.0000 172.0502 452 H 4.7335 7.1647 112.1756 54.0155 32.0675 172.8963 453 W 4.9224 8.8008 120.2267 56.5617 29.9331 176.0977 454 V 4.6174 8.8357 116.7164 59.5613 35.6815 174.7378 455 H 4.8316 8.5998 119.5362 55.3854 29.6631 176.6278 456 A 4.0069 9.0349 126.8610 55.4334 18.1989 179.7035 457 Q 4.1472 8.2926 118.8908 59.0102 28.9799 177.9999 458 C 4.3317 7.8769 116.7201 62.1719 28.1666 174.8550 459 M 4.3818 8.0342 119.0192 54.5078 31.7416 176.0322 460 D 4.5462 7.9483 117.9375 55.1612 39.0293 173.7886 461 L 4.3050 7.3900 116.5770 54.1548 42.2549 178.0080 462 E 4.3629 8.7666 123.5159 55.9788 31.4419 177.3805 463 E 4.0382 9.1227 122.8314 59.7688 29.6192 179.6112 464 R 3.8200 7.9933 115.3905 59.5257 29.3535 178.7754 465 T 3.7620 7.7650 115.8825 66.1939 68.5630 176.0510 466 L 3.7734 7.8935 122.1595 58.2801 41.8330 179.1250 467 I 3.6758 7.7081 118.6474 64.6758 37.4199 177.7976 468 H 4.4100 8.3490 117.2935 58.8893 28.3900 177.7599 469 L 4.0416 8.2421 121.2877 57.9096 41.2645 179.8227 470 S 4.1616 7.9810 112.7751 60.7284 62.9822 175.3246 471 E 4.5768 7.7642 119.5004 56.9128 29.9816 175.3362 472 G 4.1940 7.8685 107.6488 44.4234 0.0000 172.8706 473 S 4.6803 8.4904 113.6584 57.8632 63.3811 173.9491 474 N 4.5531 7.8828 118.3201 53.5040 38.9410 174.7168 475 K 4.2958 8.4239 121.0888 56.2594 33.1696 175.5334 476 Y 4.7378 8.2160 123.9710 56.0557 41.5837 173.6688 477 Y 4.4236 7.1695 122.4078 55.6563 40.9729 175.4927 478 C 4.4296 8.2707 118.0889 57.1640 30.6318 174.3347 479 N 4.4093 8.6356 117.3289 56.3275 38.2510 176.8569 480 E 4.0544 8.1313 116.6944 58.6012 30.0341 177.0307 481 H 4.8527 7.9235 113.9765 55.2546 30.2233 176.4458 482 V 3.6052 7.7586 118.9365 64.3209 31.3139 177.0219 483 Q 4.2116 7.8067 116.8234 56.1979 29.1831 175.9370 484 I 3.7589 7.3167 119.8139 60.5887 37.5866 175.9577 485 A 4.1204 8.3488 128.3687 52.6654 18.7217 177.4353 486 R 4.3830 8.0494 113.1408 56.4745 33.3835 175.0039 *487 A 4.0943 7.9612 126.3570 52.4934 18.8699 176.0937 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 414 G 8.35 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 415 Y 7.71 3.56 0.00 1.99 1.55 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 0.00 416 W 7.57 5.15 0.00 3.28 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 0.00 417 I 7.67 4.04 1.92 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 1.49 0.52 0.98 0.00 0.00 418 T 8.28 4.39 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 1.30 0.00 0.00 419 C 8.68 4.36 0.00 3.07 2.97 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 0.00 420 C 7.40 4.69 0.00 3.22 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 0.00 421 P 0.00 4.38 0.00 2.07 2.16 0.00 3.64 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 422 T 7.69 4.49 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 1.22 0.00 0.00 423 C 7.82 4.06 0.00 3.25 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 0.00 424 D 8.65 4.83 0.00 2.71 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 0.00 425 V 7.69 4.11 1.90 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 0.73 0.00 0.00 0.94 0.00 0.00 426 D 8.75 4.86 0.00 2.74 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 0.00 427 I 8.58 2.50 1.26 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.70 0.00 0.00 428 N 8.58 4.69 0.00 2.81 2.80 0.00 0.00 6.84 7.06 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 0.00 429 T 7.96 4.63 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 1.22 0.00 0.00 430 W 8.32 4.29 0.00 3.65 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 0.00 431 V 6.65 3.82 1.76 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 0.81 0.00 0.00 0.66 0.00 0.00 432 P 0.00 4.09 0.00 2.11 2.19 0.00 3.34 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.02 0.00 433 F 9.73 4.45 0.00 2.67 2.97 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 0.00 434 Y 8.10 4.47 0.00 3.25 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 0.00 435 S 9.43 4.24 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 436 T 7.93 4.33 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 1.23 0.00 0.00 437 E 7.96 4.71 0.00 2.40 2.37 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 2.78 2.57 0.00 438 L 8.36 4.72 0.00 1.58 1.62 0.96 0.96 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 0.00 439 N 8.24 5.33 0.00 2.75 2.89 0.00 0.00 6.69 7.66 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 0.00 440 K 7.54 3.76 0.00 1.10 0.74 0.00 1.32 0.00 0.00 0.61 0.00 0.00 2.78 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.59 1.02 7.81 441 P 0.00 4.53 0.00 2.01 1.46 0.00 2.39 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.86 0.00 442 A 9.94 4.32 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 0.00 443 M 8.52 5.39 0.00 2.07 1.76 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.51 0.00 444 I 8.93 4.82 1.73 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.63 0.63 0.00 0.00 445 Y 8.18 4.10 0.00 1.76 2.31 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 0.00 446 C 8.31 4.20 0.00 2.77 2.34 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 0.00 447 S 7.86 4.33 0.00 2.87 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 0.00 448 H 8.03 4.26 0.00 3.27 3.09 0.00 6.00 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 449 G 8.24 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 450 D 8.66 4.35 0.00 2.69 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 0.00 451 G 9.46 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 452 H 7.16 4.73 0.00 3.24 3.29 0.00 5.46 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 0.00 453 W 8.80 4.92 0.00 3.17 3.08 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 0.00 454 V 8.84 4.62 2.14 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 0.88 0.00 0.00 1.08 0.00 0.00 455 H 8.60 4.83 0.00 3.33 3.29 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 456 A 9.03 4.01 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 0.00 457 Q 8.29 4.15 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.40 0.00 0.00 0.00 0.00 0.00 2.10 1.51 0.00 458 C 7.88 4.33 0.00 3.21 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 0.00 459 M 8.03 4.38 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 3.01 0.00 460 D 7.95 4.55 0.00 2.90 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 0.00 461 L 7.39 4.30 0.00 1.91 1.63 0.48 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 462 E 8.77 4.36 0.00 2.08 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 2.49 2.46 0.00 463 E 9.12 4.04 0.00 2.28 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 2.41 2.45 0.00 464 R 7.99 3.82 0.00 1.96 2.15 0.00 3.06 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 465 T 7.76 3.76 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 1.24 0.00 0.00 466 L 7.89 3.77 0.00 1.52 1.59 0.72 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 467 I 7.71 3.68 1.82 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 1.65 0.90 0.94 0.00 0.00 468 H 8.35 4.41 0.00 3.29 3.36 0.00 5.64 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 0.00 469 L 8.24 4.04 0.00 1.76 1.68 0.84 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 470 S 7.98 4.16 0.00 4.03 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 0.00 471 E 7.76 4.58 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 2.30 2.49 0.00 472 G 7.87 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 473 S 8.49 4.68 0.00 3.97 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 0.00 474 N 7.88 4.55 0.00 2.78 2.84 0.00 0.00 7.10 7.63 0.00 0.00 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 K 8.42 4.30 0.00 1.68 1.41 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.45 7.81 476 Y 8.22 4.74 0.00 2.93 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 Y 7.17 4.42 0.00 2.62 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 0.00 478 C 8.27 4.43 0.00 3.17 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 0.00 479 N 8.64 4.41 0.00 2.77 2.95 0.00 0.00 7.00 7.90 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 0.00 480 E 8.13 4.05 0.00 1.72 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 2.26 2.28 0.00 481 H 7.92 4.85 0.00 3.21 3.19 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 482 V 7.76 3.61 2.32 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 0.82 0.00 0.00 0.89 0.00 0.00 483 Q 7.81 4.21 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 484 I 7.32 3.76 1.95 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.43 0.90 0.00 0.00 485 A 8.35 4.12 1.19 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 0.00 0.00 0.00 0.00 0.00 486 R 8.05 4.38 0.00 1.77 1.89 0.00 2.81 0.00 0.00 2.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.36 0.00 *487 A 7.96 4.09 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 * Residues marked with a * may have inaccurate shift predictions.