NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 304 D 4.5485 8.2227 120.1860 54.4013 43.3507 177.3486 305 E 3.7048 8.0789 119.0587 58.5702 29.6426 176.9218 306 Q 4.0927 8.7730 120.1650 58.8163 29.3933 177.0319 307 Q 4.1437 7.8566 118.3900 58.1175 28.6649 178.0451 308 S 4.1526 7.9006 114.4116 61.4090 62.7369 175.8162 309 Q 4.0816 7.8054 119.2341 58.6658 28.1738 178.2677 310 A 3.9861 7.3501 119.7613 54.9394 18.3774 179.1141 311 V 4.0980 6.9299 106.4670 60.4147 32.1222 176.1703 312 A 4.2623 7.2897 122.7359 50.9970 18.9784 176.2703 313 P 4.5860 0.0000 0.0000 62.8495 32.3265 176.5553 314 V 4.4461 8.3294 121.6110 61.4648 34.4729 174.1629 315 Y 4.8838 9.0212 125.7685 56.9516 39.9585 174.9849 316 V 4.8106 8.9943 121.8527 60.0498 34.9457 174.6407 317 G 3.9155 9.7588 110.3456 43.8170 0.0000 171.6903 318 G 4.2259 6.0551 109.4272 45.5721 0.0000 171.6885 319 F 4.5915 8.0699 118.6681 56.8870 39.7249 177.0371 320 L 4.2717 8.9275 124.3459 56.1069 42.4510 176.9231 321 A 4.5863 7.5503 119.2360 51.0370 21.9790 175.0530 322 R 4.7219 8.2850 119.9687 54.2958 31.9017 176.8205 323 Y 4.4488 7.8368 122.0050 60.7337 37.9653 177.1756 324 D 4.6435 8.0906 116.8223 53.5702 40.1146 175.7348 325 Q 4.4304 8.0493 120.4085 54.4558 29.8793 174.9899 326 S 4.5841 8.5504 118.7949 55.8320 62.5197 171.7133 327 P 4.5957 0.0000 0.0000 62.2720 32.1604 176.4048 328 D 4.4293 8.6236 120.1608 57.0486 41.3503 176.8691 329 E 4.3272 8.0456 119.2354 54.9277 30.4702 176.9440 330 A 4.0592 8.8158 127.5838 55.1195 18.6762 179.0361 331 E 3.9506 8.2705 112.6089 59.0973 29.4309 177.6877 332 L 4.4948 7.6543 117.0887 54.3960 42.0673 176.7153 333 L 4.2185 7.8307 120.6470 54.9178 41.9315 177.7844 334 L 4.6419 8.0416 124.2962 52.5402 43.1559 173.5584 335 P 4.4741 0.0000 0.0000 61.2454 33.6105 176.3173 336 R 3.2144 7.9080 120.0927 59.5613 29.7956 178.5822 337 D 4.1783 7.7583 118.2689 56.2891 39.1842 178.6716 338 V 2.9468 7.3686 119.1004 65.4375 31.5539 177.9689 339 V 3.7871 7.6393 117.9185 66.1947 31.4656 177.7841 340 E 4.0549 8.3972 118.5527 59.6889 29.0538 178.4307 341 H 3.9800 7.7092 116.9885 59.5887 29.8946 176.9761 342 W 4.4294 7.2885 119.5661 59.9204 28.9712 176.8386 343 L 4.3236 8.7181 121.2449 57.2860 42.0919 181.4088 344 H 4.4657 7.7527 121.5615 55.5733 29.6817 174.3819 345 A 4.7097 8.1569 122.3522 51.3134 22.2072 176.6054 *355 V 3.9537 8.2281 117.5152 60.9364 33.2051 175.4670 356 A 4.5112 7.7852 122.9871 50.1572 19.1602 176.4284 357 L 4.3311 8.2559 123.1954 54.7590 43.1921 175.4994 358 P 4.8468 0.0000 0.0000 62.6843 33.2841 174.4392 359 L 5.2173 8.7205 124.0518 53.5166 44.6330 175.0216 360 N 5.2041 8.7293 122.3809 51.5948 41.9804 172.5809 361 I 4.3410 8.1559 119.3814 59.8879 38.5914 176.1333 362 N 3.8471 9.6755 127.6745 54.9136 37.8238 173.5762 363 H 4.3086 8.0572 107.8047 56.0688 26.9856 174.3172 364 D 4.7257 7.8126 119.8812 52.6361 41.5664 176.8364 365 D 4.3686 8.8480 127.4883 57.3668 41.0601 177.5486 366 T 4.1523 8.4830 107.4171 61.7842 69.7736 174.8585 367 A 4.4700 7.8203 126.7193 51.4829 19.1556 176.5461 368 V 4.1250 7.7396 121.3827 63.8712 32.3969 176.2814 369 V 4.2392 8.7564 119.6221 60.3395 33.6992 176.0279 370 G 4.6306 7.2284 107.4528 46.1204 0.0000 170.9395 371 H 5.3250 7.5584 116.6601 54.0286 32.8511 172.7527 372 V 4.2837 8.6422 119.4596 62.3160 31.6498 175.4904 373 A 4.8694 9.0122 128.4704 52.0586 20.5646 176.3456 374 A 4.6945 7.5002 114.1287 51.3228 22.5639 175.1021 375 M 5.1391 9.2462 120.6913 53.9824 35.5673 174.3634 376 Q 4.5613 9.3179 127.0618 54.6814 33.0762 173.1634 377 S 4.9412 9.0400 121.7954 57.8936 63.4102 173.2787 378 V 4.6379 8.8960 120.4946 58.9394 35.0816 176.2673 379 R 3.9626 8.9130 120.1698 60.1161 29.7604 176.9038 380 D 4.6477 8.6875 114.6771 53.8248 41.7115 176.8954 381 G 2.8213 6.6778 106.1159 44.9799 0.0000 170.1232 382 L 4.8995 7.6203 123.1540 53.8786 43.3205 176.1628 383 F 4.4678 9.0866 129.7866 56.5459 41.5915 173.9709 384 C 5.0953 7.3883 124.8583 57.3246 35.5438 172.3635 385 L 4.9075 8.7328 125.4970 53.4072 44.8079 175.5385 386 G 4.3713 9.7781 113.9278 44.4041 0.0000 171.0065 387 C 4.7362 8.8723 119.7230 57.1902 34.7213 173.0002 388 V 4.2277 9.1894 129.0783 62.6360 31.4267 176.0000 389 T 4.4444 8.6337 118.2224 61.6587 71.2497 174.4606 390 S 4.0789 8.1689 117.3074 58.1751 62.7722 172.7764 391 P 4.2304 0.0000 0.0000 65.5960 31.1143 178.9266 392 R 3.8892 8.7601 117.3654 59.1281 29.9782 178.8020 393 F 3.5241 7.7276 120.2889 61.1867 39.2549 177.1292 394 L 3.6528 7.9604 118.6460 57.6077 41.3218 179.2350 395 E 3.7980 8.0843 119.2944 59.0654 29.5536 178.7963 396 I 3.4925 7.4942 119.8534 64.4579 37.2041 178.5356 397 V 2.9993 7.3409 119.0046 65.5655 30.9637 177.9612 398 R 3.6668 7.6400 117.9200 59.4600 30.0746 178.4028 399 R 3.9019 7.8400 117.5404 59.2217 29.9880 179.0127 400 A 3.7709 7.5764 120.7769 54.8637 18.0288 179.7970 401 S 3.9868 7.3428 111.8250 61.2855 63.0167 176.1093 402 E 4.1758 7.6119 120.7489 57.4567 29.2961 177.2738 403 K 4.5296 7.8055 118.5543 55.8545 33.0429 176.0565 404 S 4.7182 7.8380 113.3665 56.5025 64.6640 173.6492 405 E 3.9593 8.7553 129.1236 59.0034 29.1083 178.8264 406 L 3.8850 7.8439 119.4820 58.2862 42.4160 178.7334 407 V 3.7485 7.9257 117.9754 66.2471 31.2707 178.0634 408 S 4.1306 8.1474 113.8596 61.7045 62.6867 176.6949 409 R 4.0875 7.9290 119.8321 56.4137 29.9921 177.7349 410 G 4.0060 8.0084 107.2491 43.8559 0.0000 170.7704 411 P 4.7079 0.0000 0.0000 61.0672 33.1077 175.9717 412 V 3.5344 8.5340 111.6059 62.6625 31.3592 179.4365 413 S 3.1185 7.2675 114.6505 58.0159 65.5992 171.8315 414 P 4.3575 0.0000 0.0000 65.5152 31.7289 177.6254 415 L 4.1144 7.5726 118.7626 54.1228 42.0478 176.6962 416 Q 4.2524 8.3982 120.6095 54.9512 29.5681 174.2957 417 P 4.5747 0.0000 0.0000 63.2493 32.1413 176.6113 418 D 4.5139 9.1784 121.3990 51.3501 42.2874 175.4249 419 K 3.7792 8.6395 124.4483 59.2305 32.2937 178.2739 420 V 3.4581 7.5800 117.3769 66.0633 31.4356 178.0244 421 V 3.4421 7.5890 117.3966 65.9725 31.1411 177.8573 422 E 3.9307 8.4653 118.7696 59.2511 29.1981 179.1113 423 F 3.9115 8.4982 121.1589 61.1079 39.4605 177.2523 424 L 3.8084 7.8594 118.6521 57.7843 41.0871 179.5899 425 S 4.4057 7.7933 114.3726 61.4888 62.8224 176.8841 426 G 3.5179 7.6633 107.3189 47.7780 0.0000 175.9183 427 S 3.7841 7.4991 118.1460 60.1666 63.9198 174.3618 428 Y 4.8926 6.9297 118.7297 56.7795 36.7177 175.7051 429 A 4.4729 7.9366 121.7655 52.8910 20.2650 177.8677 430 G 4.5368 8.6565 102.8551 44.1710 0.0000 172.1600 431 L 5.2535 8.7761 120.9145 52.8871 44.4909 176.4850 432 S 4.5285 8.8068 116.4858 56.8460 65.6425 172.1916 433 L 4.9087 8.5874 129.4926 54.1329 41.9330 175.4486 434 S 4.8330 8.2308 119.5616 58.1563 68.1245 173.9915 435 S 4.5754 8.0460 114.8772 57.2142 65.7906 172.8862 *453 T 3.8770 8.1494 112.9369 61.4754 67.8005 172.3954 454 P 3.7495 0.0000 0.0000 65.5187 31.1170 178.2170 455 F 4.7841 7.1929 122.4124 57.3297 37.4177 175.5748 456 K 4.0807 8.5103 126.2562 57.7578 31.1655 176.3191 457 E 4.7416 7.3606 112.1632 55.7933 33.6575 173.3488 458 V 4.6279 8.3002 119.0267 60.9422 34.4956 173.9504 459 A 5.2857 8.7249 128.7661 50.0917 22.2092 174.9124 460 L 5.0312 8.8620 121.6977 53.7949 43.6372 175.8360 461 C 5.3154 9.0754 118.0174 56.2818 33.3551 175.3349 462 S 4.6575 8.8593 112.5591 60.8853 62.8659 175.2956 463 V 4.4320 7.3578 111.3055 59.9184 35.3175 173.6070 464 G 4.0563 8.4505 112.6697 44.6332 0.0000 174.0012 465 R 4.1278 8.4913 119.7913 58.1912 30.6045 177.6375 466 R 4.4210 7.7307 116.1441 55.0717 31.2026 176.4135 467 R 4.2890 8.3915 121.1003 57.3688 30.8504 176.9758 468 G 3.9884 10.2717 110.6900 45.9561 0.0000 173.4101 469 T 5.4163 7.6097 108.4678 60.7334 70.1649 174.0865 470 L 4.3035 8.2975 123.5466 56.7495 42.5869 175.8232 471 A 4.5204 9.1062 128.4724 50.7335 20.3337 176.4740 472 V 4.3875 8.6008 122.8426 61.4303 33.8370 174.0809 473 Y 5.2121 8.7687 125.5998 57.0313 40.0100 175.0868 474 G 4.3524 8.7522 107.3997 46.3094 0.0000 174.7195 475 R 4.2883 8.8011 119.1698 57.3737 30.8755 177.0238 476 D 4.7287 7.8044 117.2653 51.2159 43.9973 174.1877 477 P 3.5827 0.0000 0.0000 65.3600 31.1329 178.1880 478 E 4.0168 7.9748 117.9288 59.0346 29.3404 178.5582 479 W 4.0622 8.4011 126.5032 60.4656 31.0648 177.3972 480 V 3.7389 8.1162 118.0612 66.6394 31.1031 178.0634 481 T 3.9772 7.9591 115.2084 66.7840 68.0807 176.1701 482 Q 4.1704 7.7260 117.9836 57.6970 28.7701 178.1282 483 R 3.9297 7.7446 118.8394 56.6654 30.4050 176.1464 484 F 4.6188 7.8190 117.8137 54.8995 39.0969 174.4385 485 P 4.2956 0.0000 0.0000 65.6042 31.3112 178.1521 486 D 4.4771 8.1370 116.6427 56.6445 41.0111 176.5548 487 L 4.2995 7.7246 120.2745 54.4125 42.1199 177.6280 488 T 4.3522 8.5437 114.6361 60.4966 71.5598 175.6395 489 A 3.9324 8.4853 122.4528 55.3522 18.2199 179.8101 490 A 4.0668 7.8965 118.7267 55.2585 18.5467 179.3030 491 D 4.2547 7.8245 116.9083 57.8071 40.9060 179.3132 492 R 3.9581 8.1384 118.4719 59.3354 30.0240 178.8623 493 D 4.3802 8.2518 118.8767 57.3463 40.3746 179.1050 494 G 3.5981 8.0425 106.1669 47.6970 0.0000 175.8131 495 L 4.1203 7.9225 121.3851 57.4465 41.6636 179.4341 496 R 2.0000 8.1450 118.7654 58.7953 29.7040 178.1369 497 A 3.7619 7.3998 118.8975 55.6315 18.3985 179.3429 498 Q 4.0470 7.5183 115.4413 58.7272 28.6867 178.7725 499 W 4.4913 8.1206 117.7750 59.7592 28.2168 177.6048 500 Q 4.5339 7.8174 116.5406 56.1923 28.5484 176.4752 501 R 4.2627 7.8480 120.6020 54.7396 29.9852 176.8622 *504 S 4.2721 8.0923 123.5340 58.2725 64.0782 174.0528 505 T 4.4769 7.3521 109.1539 59.9017 71.0672 175.2656 506 A 4.1110 8.4239 125.8853 55.1719 18.8751 179.2720 507 V 3.6430 7.9481 114.5887 65.3326 31.6505 175.5648 508 D 4.8300 7.5036 118.5529 52.4346 43.3240 175.5356 *511 G 3.9166 8.6374 113.0756 45.2648 0.0000 174.5868 512 D 4.5830 9.2392 124.1713 52.6763 41.4618 173.2359 513 P 4.4770 0.0000 0.0000 63.5377 31.9867 176.0204 514 F 4.6006 8.7805 122.9785 57.8047 39.6042 175.2229 515 R 4.5845 8.0981 129.1825 56.0641 31.1272 174.6996 516 S 4.4968 6.4301 113.3090 57.2217 65.4513 170.6026 517 D 4.9215 8.2034 117.3926 51.4642 42.1734 175.5552 518 S 4.1168 8.7629 113.2986 62.0924 62.4713 175.8434 519 Y 4.2446 7.6453 119.8495 60.6884 37.7434 178.8333 520 G 3.6758 8.8740 106.9496 47.9415 0.0000 175.7972 521 L 4.2409 8.1590 121.9969 57.3319 41.2479 179.3561 522 L 4.1438 8.7841 120.8337 58.1495 41.8028 179.2500 523 G 3.5585 8.2434 104.8731 47.9492 0.0000 174.9098 524 N 4.5894 8.3198 119.2137 56.2525 39.1207 177.1041 525 S 4.2014 8.2532 116.2764 61.4097 62.7739 176.9634 526 V 3.8461 7.5617 122.4068 64.5935 31.1529 178.1615 527 D 4.4744 8.0991 119.5564 57.2305 40.7195 178.5254 528 A 4.0657 7.7654 120.1341 55.0913 18.1403 179.5769 529 L 3.8538 7.4371 116.6070 57.0740 41.5306 177.7887 530 Y 4.5279 7.2286 114.2191 57.4911 38.2011 175.3184 531 I 4.0644 7.4866 122.0649 60.6675 37.5728 176.0471 532 R 4.0636 8.5163 125.6474 57.1464 30.9461 176.0230 533 E 4.0587 8.8520 121.1914 57.4967 27.3118 176.1167 534 R 3.8470 7.3663 119.4369 60.2900 29.8135 178.4441 535 L 4.0288 7.8027 117.6367 57.3348 41.6729 177.7647 536 P 4.3131 0.0000 0.0000 65.2781 31.2310 178.8164 537 K 4.0159 8.6750 117.8028 59.5320 31.9996 179.4176 538 L 4.0560 8.1108 119.2360 57.9508 41.6122 179.8732 539 R 3.9814 8.4910 118.4849 59.1728 29.9777 178.5131 540 Y 3.9954 8.3999 119.7791 60.6628 38.8358 177.6312 541 D 4.3762 8.5708 120.1698 57.3181 40.8413 178.5779 542 K 3.8514 8.1476 120.0608 59.7267 32.0029 178.5734 543 Q 3.8617 7.8591 119.2179 58.8287 28.7193 177.6823 544 L 3.7470 7.4801 120.6072 57.7339 42.1934 178.5047 545 V 4.1438 7.5867 109.0402 60.3891 32.0403 176.6231 546 G 3.8574 7.6050 107.2571 46.2596 0.0000 176.0549 547 V 3.6612 7.3059 120.7436 64.6165 31.6140 178.2062 548 T 4.0613 7.6245 108.6440 64.4243 69.0196 175.5877 549 E 4.0793 8.0059 121.9077 57.9725 29.7011 176.9242 550 R 4.6750 7.0766 111.8721 53.5994 32.3151 175.1639 551 E 4.1089 8.4507 118.7688 56.7204 30.0748 176.4384 552 S 4.7137 7.9546 115.1870 58.4675 65.3784 173.6571 553 Y 4.5327 8.6936 116.3033 57.8774 37.9291 176.3077 554 V 3.7451 7.4715 120.9279 63.5509 31.8446 176.0225 555 K 4.2338 8.6319 125.2693 57.6018 32.9167 176.5366 556 A 4.1699 7.9364 125.6860 52.3205 18.3625 176.9856 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 304 D 8.22 4.55 0.00 2.67 2.70 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 0.00 305 E 8.08 3.70 0.00 2.14 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 0.00 2.36 2.41 0.00 306 Q 8.77 4.09 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 307 Q 7.86 4.14 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 308 S 7.90 4.15 0.00 3.95 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 0.00 309 Q 7.81 4.08 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 310 A 7.35 3.99 1.25 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 0.00 0.00 0.00 311 V 6.93 4.10 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 0.68 0.00 0.00 1.00 0.00 0.00 312 A 7.29 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 313 P 0.00 4.59 0.00 1.86 1.82 0.00 3.64 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 2.04 2.06 0.00 314 V 8.33 4.45 2.13 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 1.19 0.00 0.00 0.92 0.00 0.00 315 Y 9.02 4.88 0.00 3.18 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 0.00 316 V 8.99 4.81 1.82 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 0.67 0.00 0.00 0.08 0.00 0.00 317 G 9.76 3.92 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 0.00 0.00 0.00 318 G 6.06 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 0.00 0.00 0.00 0.00 319 F 8.07 4.59 0.00 3.38 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 0.00 320 L 8.93 4.27 0.00 1.55 1.70 0.72 0.82 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 0.00 321 A 7.55 4.59 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 0.00 322 R 8.28 4.72 0.00 1.78 1.75 0.00 3.09 0.00 0.00 3.43 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.42 0.00 323 Y 7.84 4.45 0.00 3.06 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 0.00 324 D 8.09 4.64 0.00 2.80 2.80 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 0.00 325 Q 8.05 4.43 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.63 0.00 326 S 8.55 4.58 0.00 3.85 3.81 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 0.00 327 P 0.00 4.60 0.00 2.25 2.06 0.00 3.86 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 2.02 2.03 0.00 328 D 8.62 4.43 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 0.00 329 E 8.05 4.33 0.00 2.05 1.89 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 2.38 2.31 0.00 330 A 8.82 4.06 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 0.00 331 E 8.27 3.95 0.00 2.12 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 0.00 2.31 2.38 0.00 332 L 7.65 4.49 0.00 1.73 1.79 1.00 1.04 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 0.00 333 L 7.83 4.22 0.00 1.75 1.65 0.94 1.02 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 0.00 334 L 8.04 4.64 0.00 1.69 1.70 1.21 1.26 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 0.00 335 P 0.00 4.47 0.00 2.26 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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 0.00 0.00 0.00 0.00 0.00 0.00 411 P 0.00 4.71 0.00 2.16 2.38 0.00 3.83 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.34 0.00 412 V 8.53 3.53 2.06 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 0.70 0.00 0.00 0.87 0.00 0.00 413 S 7.27 3.12 0.00 3.87 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 0.00 414 P 0.00 4.36 0.00 2.22 2.19 0.00 3.86 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 415 L 7.57 4.11 0.00 1.62 1.32 0.38 0.85 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 0.00 416 Q 8.40 4.25 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 417 P 0.00 4.57 0.00 2.07 2.05 0.00 3.68 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 2.04 2.11 0.00 418 D 9.18 4.51 0.00 2.38 1.89 0.00 0.00 0.00 0.00 0.00 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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 0.00 531 I 7.49 4.06 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.78 0.94 0.00 0.00 532 R 8.52 4.06 0.00 1.92 1.80 0.00 3.39 0.00 0.00 3.37 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 533 E 8.85 4.06 0.00 2.20 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 0.00 2.29 2.21 0.00 534 R 7.37 3.85 0.00 2.06 1.93 0.00 3.07 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 535 L 7.80 4.03 0.00 1.72 1.70 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 536 P 0.00 4.31 0.00 2.16 2.11 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 537 K 8.68 4.02 0.00 2.04 1.90 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.55 7.81 538 L 8.11 4.06 0.00 1.96 1.75 0.98 0.89 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 0.00 539 R 8.49 3.98 0.00 2.01 2.00 0.00 3.15 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 540 Y 8.40 4.00 0.00 3.17 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 0.00 541 D 8.57 4.38 0.00 2.95 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 0.00 542 K 8.15 3.85 0.00 1.98 1.92 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.42 7.81 543 Q 7.86 3.86 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.57 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 544 L 7.48 3.75 0.00 1.23 1.66 0.84 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 545 V 7.59 4.14 2.46 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 0.88 0.00 0.00 1.10 0.00 0.00 546 G 7.60 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 547 V 7.31 3.66 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 0.75 0.00 0.00 0.38 0.00 0.00 548 T 7.62 4.06 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 1.21 0.00 0.00 549 E 8.01 4.08 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 550 R 7.08 4.68 0.00 1.76 1.75 0.00 2.97 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.31 0.00 551 E 8.45 4.11 0.00 1.97 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 0.00 2.29 2.33 0.00 552 S 7.95 4.71 0.00 4.00 3.69 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 0.00 553 Y 8.69 4.53 0.00 3.21 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 0.00 554 V 7.47 3.75 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 0.99 0.00 0.00 555 K 8.63 4.23 0.00 1.76 1.83 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.33 7.81 556 A 7.94 4.17 1.25 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.