NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 368 R 4.4190 8.2544 119.0831 56.2986 31.5447 173.7755 369 V 4.0053 9.4964 121.5423 63.2088 33.1626 174.9151 370 F 4.1980 8.8837 118.2704 58.5142 39.9266 175.4629 371 G 4.3997 8.7828 114.1406 45.1721 0.0000 172.6140 372 C 4.3256 7.5415 120.2051 58.0705 32.5945 173.1599 373 D 4.3561 8.7044 124.8179 54.7395 42.2816 176.9881 374 L 4.0159 8.6202 128.1366 58.4005 42.1340 179.4446 375 G 3.6951 8.1826 104.9597 47.8368 0.0000 174.8609 376 E 3.9436 8.6806 122.0913 59.3056 29.6352 178.3992 377 H 4.2098 8.7875 118.5386 59.3625 29.9467 177.1651 378 L 4.0578 8.1998 120.5046 57.1214 41.2474 179.4254 379 L 3.9620 7.9778 118.8930 57.7063 41.6420 178.5728 380 N 4.4535 7.9653 115.4597 56.6503 38.6724 177.2061 381 S 4.3508 8.0753 113.6322 58.9818 63.5871 175.7155 382 G 3.8460 8.0496 109.2244 45.4336 0.0000 173.8268 383 F 4.4474 7.6207 117.8764 57.0295 39.6783 175.6144 384 E 4.1719 8.8730 122.3037 58.9878 29.5256 177.5869 385 V 4.5079 7.1520 108.6338 57.6314 35.9733 173.8213 386 P 4.1639 0.0000 0.0000 62.4979 32.6034 177.2400 387 Q 3.4354 8.3655 123.2170 59.3304 28.8317 179.3964 388 V 2.9166 7.2058 119.3371 64.2880 31.1103 177.9867 389 L 3.8249 7.0317 120.3474 57.9708 42.0354 178.8110 390 Q 4.0020 7.6061 117.9205 59.0267 28.6079 178.9843 391 S 4.1921 8.4271 116.4369 61.9083 62.9242 176.6602 392 C 4.2860 8.1304 119.6464 62.9309 27.8065 176.3208 393 T 3.8581 8.3325 111.4726 64.7346 68.2901 176.5638 394 A 4.0513 8.2220 123.8758 54.6931 18.4306 179.2994 395 F 4.2883 8.4039 119.1741 61.7111 39.4444 177.4575 396 I 3.6542 8.1417 119.3724 64.4795 36.6957 178.3740 397 E 3.9154 8.5046 118.7258 58.6430 29.2634 178.5916 398 R 3.9974 7.4725 117.4484 57.6308 30.8819 176.4519 399 Y 4.2665 7.8977 113.4060 57.5968 39.1806 176.3544 400 G 4.0101 7.6402 108.8622 45.2024 0.0000 174.5314 401 I 3.9118 7.3464 122.2998 59.5431 35.6322 175.4691 402 V 4.4546 7.2273 116.1576 58.4816 35.7632 174.6977 403 D 4.4683 8.7014 121.0756 56.4979 41.2801 176.9809 404 G 3.8949 9.2918 113.9247 45.6479 0.0000 172.7150 405 I 3.7439 7.2255 118.9734 62.7336 38.0566 176.3217 406 Y 3.9472 8.4816 122.5349 58.8694 36.6523 170.6035 407 R 4.2293 8.2411 119.7418 58.4376 30.6770 176.9123 408 L 4.1933 7.6598 116.1394 54.4680 42.2761 176.3555 409 S 4.7851 8.2391 115.5413 56.3072 65.2940 174.3257 410 G 4.0012 8.0540 110.8643 44.0094 0.0000 173.6640 411 V 3.8766 8.0954 117.9820 61.9233 33.1202 175.9801 412 A 4.0181 8.7584 128.2223 55.6985 18.1971 180.0202 413 S 4.1084 8.0229 111.9136 61.6341 63.1066 176.3279 414 N 4.4183 8.0998 119.6542 55.9063 38.3461 177.3030 415 I 3.6715 7.8756 121.2735 64.5600 37.1863 178.3420 416 Q 3.9977 8.2498 121.2414 59.6994 28.6098 179.9924 417 R 3.9520 8.0080 121.4978 61.3887 29.4567 180.8588 418 L 4.0926 7.9117 120.0005 57.4464 41.6031 179.3249 419 R 3.4253 8.1523 119.1009 59.6971 29.6580 177.6721 420 H 4.0195 8.0088 116.3470 59.5336 30.0280 176.6149 421 E 4.0066 8.0519 119.8144 59.5311 29.0751 179.4763 422 F 4.1744 8.0666 116.4163 60.3336 39.0309 177.1224 423 D 4.7223 8.3634 117.6418 56.0902 40.6436 177.1806 424 S 4.5238 7.4664 116.4590 58.7810 62.9926 175.1866 425 E 3.8706 8.5338 116.1536 57.1772 26.9371 177.5861 *426 H 4.8650 7.9350 116.9349 54.4391 30.1761 180.0413 427 V 4.0323 7.7265 118.5343 57.5977 32.4209 174.2044 428 P 4.1126 0.0000 0.0000 61.9625 31.7335 176.6005 429 D 4.5728 8.4212 120.6709 53.0067 40.5040 176.8467 430 L 4.0060 8.2196 127.8895 56.9577 41.8786 179.1878 431 T 3.8250 8.3227 110.3768 63.1545 69.3076 175.0100 432 K 4.6763 7.5384 124.1575 52.2400 34.8274 181.0874 433 E 4.3324 8.3666 118.3578 56.6749 29.8544 175.3669 434 P 4.4939 0.0000 0.0000 63.3234 31.8034 176.5233 435 Y 4.4647 7.4688 119.1263 60.6256 38.3486 178.2347 436 V 3.9435 7.7718 117.3050 63.8107 31.3090 176.6512 437 Q 4.4535 8.0370 116.3688 55.8788 29.3046 175.5464 438 D 4.9349 8.0060 119.6742 52.2379 40.8836 176.2436 439 I 4.0058 7.8694 124.5701 64.5427 37.5927 177.3619 440 H 4.4135 8.0980 116.0667 58.4114 28.1389 177.8406 441 S 4.1480 7.8811 117.2449 61.4382 62.5765 176.7992 442 V 3.6960 7.8237 120.6062 65.8747 31.5447 177.9461 443 G 3.7523 7.9918 105.2044 48.2556 0.0000 175.7864 444 S 4.2305 8.4806 118.0557 61.0499 62.8218 176.5507 445 L 4.0260 8.2971 123.3482 58.1950 41.5323 178.5651 446 C 4.3264 8.4865 118.7319 62.6698 31.5475 175.7632 447 K 3.4292 8.0805 119.6269 59.1608 31.5024 179.0958 448 L 3.9731 8.2606 120.9052 58.1877 41.7904 178.0733 449 Y 3.5991 8.1001 118.5679 60.9496 38.7121 178.2332 450 F 3.9299 7.8028 117.9639 60.2584 38.8367 177.6272 451 R 3.9283 8.0658 117.8255 59.4147 30.1680 177.7782 452 E 4.2228 8.2492 116.6416 56.1262 29.7642 176.6196 453 L 4.0584 6.7423 120.1239 54.1827 42.0727 175.8823 454 P 4.3219 0.0000 0.0000 64.5499 31.6302 175.6940 455 N 4.4612 7.7863 116.9846 50.3392 40.6097 171.9020 456 P 4.4105 0.0000 0.0000 62.1894 32.2072 176.9507 457 L 4.0354 8.6789 120.6512 58.4645 41.8048 178.0978 458 L 4.2300 7.9202 115.4054 54.9330 41.9107 176.1191 459 T 3.9196 7.9551 110.5858 61.5015 69.9928 171.7283 460 Y 4.5152 8.9391 123.9321 62.1113 38.1998 179.5291 461 Q 4.1250 8.4093 116.9461 57.5110 28.3584 179.1662 462 L 4.6442 7.8521 115.9011 54.6389 42.6632 177.4722 463 Y 4.2097 8.2656 121.6696 61.1454 38.5889 178.2370 464 E 4.0614 8.4164 118.7262 59.3937 29.7201 179.2782 465 K 3.8839 8.0375 118.0542 59.4148 32.1153 179.1804 466 F 4.1246 8.3856 118.3691 60.6251 38.5901 177.9358 467 S 4.0362 7.6979 113.5199 61.7562 62.8249 176.1458 468 D 4.4437 8.2885 121.4376 57.1325 40.3691 178.7613 469 A 3.9183 8.0062 121.5166 55.1648 18.2664 180.0198 470 V 3.4597 7.3125 114.9797 64.0196 31.6957 177.7612 471 S 4.3257 7.3952 114.1669 58.1332 63.2456 174.2319 472 A 4.0590 6.9168 124.8380 52.0775 18.7184 177.8553 473 A 4.1468 8.5624 123.5075 54.2418 18.9706 178.7695 474 T 4.7480 7.4360 104.9857 59.5884 72.9503 174.7272 475 D 4.4382 8.6290 121.9893 57.5861 40.8928 178.9730 476 E 3.9621 8.1518 118.6967 59.5229 29.4749 178.9008 477 E 3.9516 7.9132 118.9756 59.1764 29.6487 178.9100 478 R 3.8268 8.2253 118.5703 58.9451 29.9823 178.7698 479 L 4.1243 8.1726 120.1917 58.3227 42.1763 178.9800 480 I 3.7024 7.7439 119.6515 64.4277 37.0765 178.6802 481 K 3.9234 8.2496 119.3971 59.4375 31.8204 179.5159 482 I 3.6429 7.7374 120.1318 64.5409 37.0459 177.6942 483 H 4.0650 8.3656 119.1255 59.7379 29.4208 176.9480 484 D 4.2405 7.9534 118.9216 57.1427 40.8493 178.8118 485 V 3.4522 7.5901 118.8157 65.9130 31.4661 178.0414 486 I 3.9230 7.8874 119.7418 64.7139 36.7444 178.1753 487 Q 4.2839 7.9985 117.0833 57.9828 28.6395 177.6135 488 Q 4.2525 7.7302 117.6546 55.6057 29.4743 176.1159 489 L 4.2817 7.3354 121.2021 53.6269 42.5122 175.8975 490 P 4.4347 0.0000 0.0000 61.9890 33.1647 175.6179 491 P 4.3425 0.0000 0.0000 65.6270 31.4229 177.1929 492 P 4.3144 0.0000 0.0000 66.2359 31.0139 178.1974 493 H 4.2589 8.3540 115.5845 58.6141 28.7407 176.6388 494 Y 4.1376 8.5731 121.8304 61.1134 38.6617 178.7132 495 R 4.1021 8.5927 119.0155 59.6686 30.1122 179.3013 496 T 3.9724 7.9328 115.1680 66.3125 68.3543 176.7545 497 L 3.7399 8.2584 122.7640 57.8651 42.0443 178.4140 498 E 2.5400 7.7323 119.3022 58.8070 29.4320 178.5953 499 F 3.8123 7.9928 120.3499 61.1006 39.3900 176.7461 500 L 3.7871 8.0738 120.0119 58.4755 41.7796 178.8531 501 M 3.7954 7.9049 118.8086 58.3052 31.8274 179.0014 502 R 3.7333 7.9203 118.4742 59.2322 30.1744 178.3723 503 H 4.1056 7.8424 117.9764 59.5194 29.7569 177.3380 504 L 3.8472 7.8513 120.6792 57.5648 41.1059 179.4737 505 S 3.9729 7.9146 112.6703 61.0920 62.6165 175.6807 506 L 4.0008 7.8667 122.9650 58.1382 41.8287 178.4991 507 L 4.0710 7.9919 120.0422 58.4063 42.0737 178.7954 508 A 3.9895 8.3258 120.6515 55.2396 17.9914 179.2053 509 D 4.3038 7.7499 116.7361 57.1972 40.9112 177.4967 510 Y 4.6486 7.8855 116.3570 58.1029 38.0449 176.9995 511 C 4.0022 7.9457 119.2880 61.6183 29.0978 176.0093 512 S 4.1681 8.0642 115.0238 60.4815 62.7343 175.6973 513 I 4.1447 7.7684 123.3053 63.7601 37.8684 177.7345 514 T 4.1566 7.8949 109.2725 62.2083 68.6890 174.7842 515 N 4.3919 8.0430 117.3718 54.2802 36.7883 174.1715 516 M 4.5588 7.7551 118.3386 53.6392 32.6578 176.1558 517 H 4.5237 8.8301 121.3114 54.3893 31.1463 175.9971 518 A 3.9879 8.5659 123.1692 55.5313 17.9024 179.5039 519 K 3.8001 8.1540 117.3235 60.0296 32.1895 178.4246 520 N 4.3708 8.1854 115.9052 56.2887 38.5497 177.1811 521 L 4.1292 8.2015 120.1630 57.8233 41.6761 179.4402 522 A 4.0553 8.2956 120.7803 55.3233 18.1176 179.7355 523 I 3.6660 7.8379 117.3711 64.5723 37.2361 178.5957 524 V 3.7184 7.6937 118.1433 65.6843 31.6783 177.8391 525 W 3.9448 8.3927 118.5287 59.0959 28.8689 178.3120 526 A 4.0515 8.3296 121.1473 55.0142 17.6006 177.9609 527 P 4.2385 0.0000 0.0000 65.7437 31.4448 178.2850 528 N 4.5465 8.2754 114.5968 55.3141 38.6971 175.8595 529 L 4.4749 8.1995 119.6175 54.9518 43.3750 175.5931 530 L 4.9233 7.7320 118.8577 53.3514 43.4337 174.9972 531 R 4.8920 8.3542 121.4143 54.5915 32.5772 175.4979 532 S 3.6672 8.3350 117.1177 61.4735 62.2053 174.8960 *549 V 3.9778 7.4241 118.9528 60.7076 32.9077 178.2088 550 R 4.0950 8.6565 119.1950 64.2162 29.2818 175.4265 551 I 3.9712 7.7626 120.8717 64.8108 35.5501 179.9113 552 Q 4.1709 8.0818 119.0774 59.1163 28.6191 179.0519 553 S 4.2128 7.6309 114.0250 61.2733 63.0581 176.6864 554 V 3.6721 7.4815 121.7373 65.6058 31.2082 178.1610 555 V 3.5949 7.8932 118.1185 66.1391 31.3641 178.3039 556 V 3.5453 7.6351 117.5030 65.8157 31.3107 177.5189 557 E 3.9323 8.6725 119.6684 59.1523 29.5662 178.6589 558 F 3.9800 8.3796 120.6638 61.2843 39.2991 177.1846 559 I 3.8375 7.8638 118.2010 64.2727 37.0102 177.6390 560 L 4.0234 7.9425 120.2093 58.5580 41.9896 178.7695 561 N 4.4214 8.0820 114.1338 55.1450 38.6070 175.5499 562 H 4.8048 7.4265 117.2062 55.1653 29.7722 176.6439 563 V 3.8448 7.8759 122.8051 65.2354 30.8850 177.4210 564 D 4.4051 7.9849 118.4002 56.9891 40.9352 178.5996 565 V 3.8291 7.7048 119.2144 64.6711 31.5328 178.3371 566 L 3.9531 8.0524 118.7487 56.2799 41.3989 177.7167 567 F 4.9386 7.8010 117.0588 57.0586 39.5937 177.1036 568 S 4.3025 7.9785 118.8968 60.9461 63.2568 174.3465 569 G 4.0343 8.3139 113.4923 45.9729 0.0000 172.7393 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 368 R 8.25 4.42 0.00 1.85 1.79 0.00 3.19 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 369 V 9.50 4.01 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 1.06 0.00 0.00 370 F 8.88 4.20 0.00 3.21 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 371 G 8.78 4.40 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 0.00 372 C 7.54 4.33 0.00 3.08 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 0.00 373 D 8.70 4.36 0.00 2.84 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 374 L 8.62 4.02 0.00 1.71 1.55 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 375 G 8.18 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 0.00 0.00 0.00 376 E 8.68 3.94 0.00 2.08 2.16 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 2.34 2.35 0.00 377 H 8.79 4.21 0.00 3.31 3.52 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 378 L 8.20 4.06 0.00 1.77 1.71 1.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 379 L 7.98 3.96 0.00 1.77 1.73 0.94 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 380 N 7.97 4.45 0.00 2.91 2.91 0.00 0.00 7.12 7.08 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 0.00 381 S 8.08 4.35 0.00 4.30 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 0.00 382 G 8.05 3.85 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 0.00 0.00 0.00 383 F 7.62 4.45 0.00 3.02 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 0.00 384 E 8.87 4.17 0.00 1.98 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 2.37 2.33 0.00 385 V 7.15 4.51 1.83 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 0.69 0.00 0.00 0.01 0.00 0.00 386 P 0.00 4.16 0.00 1.49 1.52 0.00 3.45 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 1.91 2.10 0.00 387 Q 8.37 3.44 0.00 1.36 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.90 0.00 0.00 0.00 0.00 0.00 2.28 1.89 0.00 388 V 7.21 2.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 -0.06 0.00 0.00 389 L 7.03 3.82 0.00 1.56 1.59 1.15 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 390 Q 7.61 4.00 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 1.75 2.15 0.00 391 S 8.43 4.19 0.00 3.87 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 0.00 392 C 8.13 4.29 0.00 3.03 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 0.00 393 T 8.33 3.86 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 1.13 0.00 0.00 394 A 8.22 4.05 1.52 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 0.00 0.00 395 F 8.40 4.29 0.00 3.27 3.35 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 0.00 396 I 8.14 3.65 2.02 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 0.78 0.88 0.00 0.00 397 E 8.50 3.92 0.00 2.00 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 2.41 2.56 0.00 398 R 7.47 4.00 0.00 1.60 1.55 0.00 3.10 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.25 0.00 399 Y 7.90 4.27 0.00 1.71 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 400 G 7.64 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 0.00 0.00 0.00 401 I 7.35 3.91 1.45 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.10 0.25 0.00 0.00 402 V 7.23 4.45 2.07 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 0.96 0.00 0.00 0.89 0.00 0.00 403 D 8.70 4.47 0.00 2.62 2.63 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 0.00 0.00 0.00 0.00 404 G 9.29 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 0.00 0.00 0.00 405 I 7.23 3.74 1.93 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.21 0.96 0.00 0.00 406 Y 8.48 3.95 0.00 3.33 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 0.00 407 R 8.24 4.23 0.00 1.80 2.14 0.00 3.28 0.00 0.00 3.25 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0.00 0.00 0.00 0.00 1.40 1.56 7.81 482 I 7.74 3.64 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.34 1.12 0.00 0.00 483 H 8.37 4.06 0.00 3.24 3.60 0.00 5.79 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 0.00 484 D 7.95 4.24 0.00 2.77 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 0.00 485 V 7.59 3.45 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 -0.28 0.00 0.00 0.71 0.00 0.00 486 I 7.89 3.92 1.98 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 1.76 0.85 0.81 0.00 0.00 487 Q 8.00 4.28 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 488 Q 7.73 4.25 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 489 L 7.34 4.28 0.00 2.03 1.81 1.17 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 490 P 0.00 4.43 0.00 2.27 2.03 0.00 3.65 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00 491 P 0.00 4.34 0.00 2.19 2.15 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 492 P 0.00 4.31 0.00 2.31 2.36 0.00 3.69 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 2.21 2.13 0.00 493 H 8.35 4.26 0.00 3.46 3.61 0.00 5.64 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 0.00 494 Y 8.57 4.14 0.00 3.22 3.23 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 0.00 495 R 8.59 4.10 0.00 1.98 2.06 0.00 3.33 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 496 T 7.93 3.97 4.36 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 1.45 0.00 0.00 497 L 8.26 3.74 0.00 1.78 1.78 0.77 0.97 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 0.00 498 E 7.73 2.54 0.00 1.16 1.80 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 2.02 1.61 0.00 499 F 7.99 3.81 0.00 3.26 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 0.00 500 L 8.07 3.79 0.00 1.54 1.34 0.08 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 501 M 7.90 3.80 0.00 1.91 1.84 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 2.54 2.60 0.00 502 R 7.92 3.73 0.00 1.66 1.77 0.00 2.97 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 503 H 7.84 4.11 0.00 3.03 3.41 0.00 5.78 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 0.00 504 L 7.85 3.85 0.00 1.48 1.52 0.07 0.52 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 0.00 505 S 7.91 3.97 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 0.00 506 L 7.87 4.00 0.00 1.74 1.85 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 507 L 7.99 4.07 0.00 1.91 1.82 0.94 1.09 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 0.00 508 A 8.33 3.99 1.37 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 0.00 0.00 0.00 509 D 7.75 4.30 0.00 2.56 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.89 4.65 0.00 3.13 2.82 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 0.00 511 C 7.95 4.00 0.00 2.77 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 0.00 512 S 8.06 4.17 0.00 4.06 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 0.00 513 I 7.77 4.14 2.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.96 0.88 0.00 0.00 514 T 7.89 4.16 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 1.30 0.00 0.00 515 N 8.04 4.39 0.00 2.89 2.95 0.00 0.00 6.78 7.18 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 0.00 516 M 7.76 4.56 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.87 0.00 517 H 8.83 4.52 0.00 3.42 3.27 0.00 5.83 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 0.00 518 A 8.57 3.99 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 0.00 519 K 8.15 3.80 0.00 1.94 1.86 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.76 7.81 520 N 8.19 4.37 0.00 3.03 2.91 0.00 0.00 7.06 6.74 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 0.00 521 L 8.20 4.13 0.00 1.91 1.80 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 522 A 8.30 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 523 I 7.84 3.67 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.70 0.93 0.00 0.00 524 V 7.69 3.72 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 0.63 0.00 0.00 0.95 0.00 0.00 525 W 8.39 3.94 0.00 3.53 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 0.00 526 A 8.33 4.05 1.37 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 0.00 0.00 0.00 527 P 0.00 4.24 0.00 2.03 2.15 0.00 3.81 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.20 0.00 528 N 8.28 4.55 0.00 2.92 2.98 0.00 0.00 6.91 7.35 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 0.00 529 L 8.20 4.47 0.00 1.68 1.62 0.75 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 530 L 7.73 4.92 0.00 1.44 1.54 0.86 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 531 R 8.35 4.89 0.00 1.97 1.91 0.00 3.18 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 532 S 8.33 3.67 0.00 3.64 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 *549 V 7.42 3.98 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 0.73 0.00 0.00 0.93 0.00 0.00 550 R 8.66 4.09 0.00 1.81 1.96 0.00 3.22 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.00 551 I 7.76 3.97 1.87 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 1.64 0.54 0.91 0.00 0.00 552 Q 8.08 4.17 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.45 1.99 0.00 553 S 7.63 4.21 0.00 4.09 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 0.00 554 V 7.48 3.67 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 1.03 0.00 0.00 1.05 0.00 0.00 555 V 7.89 3.59 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 0.79 0.00 0.00 0.99 0.00 0.00 556 V 7.64 3.55 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 0.96 0.00 0.00 0.88 0.00 0.00 557 E 8.67 3.93 0.00 2.15 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 0.00 2.32 2.33 0.00 558 F 8.38 3.98 0.00 3.39 3.23 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 0.00 559 I 7.86 3.84 1.90 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 1.59 0.99 1.06 0.00 0.00 560 L 7.94 4.02 0.00 1.59 1.89 0.79 0.91 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 0.00 561 N 8.08 4.42 0.00 2.49 2.49 0.00 0.00 6.95 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 0.00 562 H 7.43 4.80 0.00 3.10 3.13 0.00 5.82 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 563 V 7.88 3.84 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 0.80 0.00 0.00 0.92 0.00 0.00 564 D 7.98 4.41 0.00 2.66 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 0.00 565 V 7.70 3.83 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 1.03 0.00 0.00 0.92 0.00 0.00 566 L 8.05 3.95 0.00 1.52 1.24 1.03 0.73 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 0.00 567 F 7.80 4.94 0.00 3.19 3.35 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 0.00 568 S 7.98 4.30 0.00 3.95 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 0.00 569 G 8.31 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.