NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 279 G 3.8974 8.3549 108.0111 46.2391 0.0000 172.4082 280 Y 4.6502 8.7427 121.5457 55.5217 43.2470 169.3194 281 V 4.5030 8.6662 121.6151 61.2410 34.4019 174.5623 282 G 3.4318 8.8367 116.8781 45.1015 0.0000 172.4042 283 I 4.3232 8.4986 128.8147 60.0393 38.7216 175.7662 284 K 4.0812 8.7720 128.1575 55.7052 32.1707 176.6837 285 I 4.2926 8.6983 128.1621 59.5819 38.5587 175.5170 286 R 4.1771 8.5930 129.1418 55.8954 31.0677 175.1577 287 L 4.4632 8.3844 130.0533 55.3303 41.9513 175.9645 288 T 4.2956 8.5811 117.1896 63.2767 70.3249 175.0746 289 D 4.7140 7.5834 122.2775 51.8200 44.4633 175.6809 290 V 3.8924 8.2690 116.7954 60.1313 32.7724 176.1080 291 A 4.0865 8.1183 126.1414 51.3478 19.3077 176.8617 292 P 4.2154 0.0000 0.0000 66.0685 31.0666 178.5888 293 Q 4.1425 8.0031 114.7299 57.9334 29.2747 177.4461 294 A 4.3008 8.3136 121.3905 54.7531 18.3658 179.2409 295 Q 3.8966 7.6299 115.5297 59.3613 28.7998 179.1594 296 E 3.9330 8.1875 118.7315 59.3832 29.6471 179.1034 297 L 3.8103 7.8870 119.6203 58.2248 42.0594 178.8515 298 F 3.7281 8.3685 116.5038 60.1872 39.1667 177.2427 299 K 4.0478 8.3879 119.5892 59.4687 31.8444 178.7775 300 K 4.0442 8.3040 118.5435 58.1046 32.1776 177.3265 301 E 4.2500 7.3606 118.2256 55.2737 29.6809 177.1212 302 S 3.6376 7.5771 110.2766 58.8516 62.0176 172.9721 303 L 4.2131 7.5170 123.1691 53.6599 39.9006 175.3414 304 D 4.6411 7.8803 122.2044 53.5039 43.4263 176.1953 305 V 3.7170 8.1973 124.6540 65.8057 31.7874 178.3775 306 K 4.0911 8.8462 117.8604 58.6955 31.8987 178.2951 307 E 4.3969 8.0847 117.0385 56.1243 30.4467 175.6497 308 N 5.0986 7.0719 113.5101 50.9697 42.0976 174.6510 309 K 4.2340 8.2309 120.3228 56.0745 32.7266 175.8291 310 V 5.0696 8.0795 125.2168 61.1806 34.4218 173.8022 311 Y 5.4126 9.6146 124.5619 56.2820 42.1927 174.2662 312 L 4.7577 9.2049 123.4945 53.6989 43.6387 175.6919 313 V 4.5632 8.1371 124.4616 61.3204 32.7645 174.5754 314 A 5.1883 8.6671 129.9816 49.2591 21.3356 175.2198 315 A 4.7707 8.5467 124.4819 51.9284 19.8358 176.5366 316 T 4.8311 8.9233 115.0167 60.8302 71.2784 174.2442 317 L 4.5643 8.8214 123.9114 54.8156 43.3695 177.2349 318 R 5.0270 8.1718 117.6983 52.2749 30.0590 174.4562 319 P 4.3216 0.0000 0.0000 65.2856 31.6115 178.2771 320 E 4.2359 8.2948 117.2615 58.6486 29.5761 177.8113 321 T 4.5711 7.9274 109.6416 62.2719 69.0614 176.1939 322 M 3.9884 7.7824 122.7499 58.6905 31.9690 177.8706 323 Y 4.9453 7.5078 116.1393 60.2088 38.2404 177.6122 324 G 4.0817 8.2786 107.0037 45.2378 0.0000 173.5899 325 Q 4.9090 7.9686 118.8526 55.5885 28.9555 176.5048 326 T 4.5662 8.0864 111.2345 61.8398 71.1871 173.4221 327 C 4.5517 7.2551 114.8089 58.2573 32.9161 172.2229 328 C 4.5117 7.7932 116.1567 58.3984 35.1704 174.0470 329 F 5.7644 9.0364 124.6353 56.1361 41.2104 175.2211 330 V 4.9440 8.7476 115.2836 59.6862 36.6090 174.2174 331 S 4.9848 9.4141 117.9480 56.5751 63.2001 173.5975 332 P 4.4867 0.0000 0.0000 65.3981 31.2788 177.3362 333 K 4.2793 7.8059 114.8131 56.8784 32.6899 176.3463 334 I 4.1145 7.4304 121.2061 59.9606 38.9240 174.7421 335 D 4.7182 8.4994 127.3557 53.5824 40.6547 175.6730 336 Y 4.3087 9.0932 122.4708 57.5963 39.6751 175.3361 337 G 3.8885 8.9208 109.8023 44.7797 0.0000 172.6917 338 V 4.5214 7.4728 122.3481 60.8645 33.3078 174.6315 339 F 4.8494 9.0922 126.9203 55.5597 42.3951 174.6375 340 D 4.6906 8.6576 121.2944 53.0930 40.9401 175.8844 341 A 4.1059 8.3725 129.1443 51.7176 19.0995 178.1623 342 G 3.8895 7.5149 100.9897 46.2053 0.0000 173.3977 343 N 4.2826 9.1437 113.1966 54.1176 35.5389 175.3192 344 G 3.8852 7.9795 103.4309 46.3294 0.0000 172.8448 345 D 5.3736 7.3672 119.1470 52.5624 43.2569 175.1872 346 Y 5.0404 9.2257 120.1769 56.2111 41.8528 174.5355 347 F 5.9866 9.0985 121.5758 56.0251 42.7004 174.4103 348 I 5.4031 9.1210 123.4268 59.4154 39.4954 175.0032 349 T 5.0640 8.5184 116.1048 60.9431 72.4861 172.4913 350 T 4.4330 8.7532 112.2431 61.4806 69.7323 175.1715 351 E 4.2449 9.3952 125.3937 59.9961 29.3350 179.1824 352 R 3.8862 8.1287 116.0784 59.7298 29.9248 177.8788 353 A 4.1479 7.7311 118.8894 54.9587 18.3008 179.3706 354 F 3.6207 8.0760 119.2802 60.9613 39.0957 177.3371 355 K 3.8219 7.5595 118.6952 59.4124 31.9605 178.1260 356 N 4.4591 7.5113 115.0574 55.4468 38.4484 176.1929 357 M 4.2726 7.3174 119.2880 55.9290 33.6964 175.3568 *368 Y 4.4756 7.4776 118.9769 57.5799 38.7731 172.8843 369 Y 4.8324 7.8081 123.2937 54.2138 37.4496 173.9456 370 K 4.3241 7.7062 125.9270 54.5721 35.1338 174.0464 371 P 4.0837 0.0000 0.0000 61.5989 32.5510 176.3246 372 L 4.0942 8.1151 120.9212 57.6762 41.7346 177.1912 373 F 4.9514 6.9779 111.2191 56.1380 41.2113 172.7980 374 T 4.8751 8.4388 109.0718 60.1038 71.4254 173.6626 375 I 4.7236 9.0826 123.0947 59.3937 41.8153 174.1567 376 N 5.0288 9.0887 127.8944 53.1747 40.0659 175.4616 377 G 4.4602 8.9287 113.1456 47.6120 0.0000 175.9958 378 K 4.0071 8.0498 120.2522 59.7739 31.8719 179.4273 379 T 4.0506 7.8077 114.0515 65.7901 68.7383 175.7814 380 L 4.4282 7.8957 119.8687 54.1750 42.0131 176.5224 381 I 4.0574 7.0650 120.8023 62.7350 37.2241 176.3872 382 G 2.8787 8.5312 114.4267 44.3425 0.0000 173.7801 383 S 4.2181 7.4344 115.9908 58.5841 64.1513 174.0459 384 R 4.7110 8.7991 122.8945 55.8424 31.4380 175.6037 385 I 5.0595 8.0504 113.9240 59.3914 41.5495 174.0712 386 D 4.8666 9.2079 123.3897 52.6353 43.1085 174.5409 387 A 4.8122 8.4779 127.9716 49.9686 20.2846 174.9657 388 P 4.2903 0.0000 0.0000 63.8344 32.2023 177.2391 389 Y 3.7031 9.1288 118.0520 58.1719 35.7594 169.2215 390 A 4.7830 7.5785 123.0181 52.3405 18.9420 178.2997 391 V 4.1092 8.1322 114.6455 62.3302 32.5742 176.7290 392 N 4.5678 8.0279 117.7234 52.7599 38.9986 174.9600 393 K 4.2364 8.5297 122.3611 56.7096 33.6493 176.3170 394 N 4.0870 8.4540 116.4823 54.5089 35.8087 173.8196 395 L 4.5074 7.2288 119.0062 54.0696 44.2400 176.7961 396 R 5.0045 8.1236 118.6866 54.2968 35.0692 174.1564 397 V 4.2597 7.9288 120.2574 62.0456 32.9551 174.8315 398 L 5.3783 9.3463 127.4880 52.3074 45.8374 173.9797 399 P 5.2416 0.0000 0.0000 62.7377 33.3486 175.7677 400 M 4.2910 8.8656 120.8849 53.5810 33.4681 174.6634 401 E 3.9789 9.0202 126.9747 59.0627 29.8635 177.6315 402 T 4.4856 7.5280 106.6059 61.4834 69.5377 174.6345 403 V 3.7181 7.5445 122.8942 63.3400 32.0083 175.5346 404 L 4.1299 8.4407 128.8675 55.1090 42.5989 176.1639 405 A 4.5003 8.4371 125.9424 52.7301 20.1002 178.1161 406 T 4.2051 7.8160 104.7940 62.5975 69.9697 175.1497 407 K 4.1531 7.9753 123.3032 55.9089 33.5149 177.3867 408 G 3.6593 8.5002 115.3711 46.4272 0.0000 173.4763 409 T 4.2418 8.4630 109.1896 61.3180 69.6917 176.5102 410 G 4.1625 8.4907 110.7199 45.0793 0.0000 173.2274 411 V 4.6704 7.5168 120.3680 61.0222 34.0484 174.4771 412 V 4.6498 8.7975 127.4677 61.1616 34.3609 174.7849 413 T 4.3241 8.6398 121.7101 62.2743 68.6620 173.5116 414 C 4.8572 8.5404 125.7676 57.8823 34.2402 172.3851 415 V 4.8268 9.5077 127.2904 59.9335 31.2677 174.2096 416 P 4.5571 0.0000 0.0000 64.6897 31.9990 178.3589 417 S 4.3531 8.3006 113.1523 60.5726 63.1687 174.9575 418 D 4.8323 8.0867 116.2402 53.2451 42.6044 174.9727 419 S 4.7122 8.4767 115.6681 55.5537 63.9875 172.5183 420 P 4.3352 0.0000 0.0000 65.8248 31.1011 178.2265 421 D 4.4293 8.1876 117.1106 57.6100 40.7095 178.5547 422 D 4.5163 7.9683 118.9087 57.3709 40.8654 178.4966 423 F 4.1407 8.5740 121.3401 61.4488 39.4524 177.4112 424 V 3.5636 8.0997 117.7804 66.1656 31.3298 178.2360 425 T 3.7325 7.8974 115.5352 66.7625 68.2414 176.5173 426 T 3.9268 8.1259 118.0619 66.9837 68.6830 176.3271 427 R 3.7194 7.6497 120.0847 59.4105 29.9787 178.2548 428 D 4.3755 7.9172 118.3777 57.4483 40.6436 178.7403 429 L 3.9649 7.7057 117.8376 57.8111 41.6818 179.2021 430 A 4.1564 7.9998 119.7614 55.0948 18.3176 179.1821 431 N 4.5206 7.8668 114.0288 55.1466 40.2106 176.1316 432 K 4.7905 8.2919 117.9929 54.5486 32.8102 175.4826 433 P 4.4206 0.0000 0.0000 65.9550 32.3852 179.1480 434 E 3.9143 8.3943 118.2678 59.3715 29.6430 178.4793 435 Y 3.9409 8.0742 118.0115 60.5522 38.8421 176.0704 436 Y 4.2771 7.8219 114.0012 57.4276 38.4452 175.1924 437 G 3.7993 7.7867 107.6125 46.9056 0.0000 172.8173 438 I 4.5379 8.0050 112.4231 58.7159 41.2571 173.7963 439 E 4.2189 6.5935 118.1658 53.9258 31.5702 177.3177 440 K 3.9224 8.3822 123.4965 59.6278 32.5664 178.6802 441 D 4.5481 7.9270 117.6267 57.0048 41.0065 177.5495 442 W 4.4316 7.9302 118.2930 59.2690 29.1341 176.4973 443 V 3.9716 7.3391 117.2337 60.1762 30.4486 175.6065 444 Q 4.1157 8.6690 127.5090 56.2259 29.0860 175.6122 445 T 4.3782 8.4413 114.6076 61.6353 70.2695 174.0627 446 D 4.5565 8.0640 122.5921 53.7591 40.6317 175.5607 447 I 4.4188 8.2691 125.8555 59.4778 38.6084 175.8033 448 V 4.1768 8.2175 119.2970 59.2753 32.6941 174.4744 449 P 4.4370 0.0000 0.0000 62.9587 32.1020 175.7501 450 I 4.3600 8.5237 122.2814 62.0573 39.9910 175.7429 451 V 4.8308 7.6114 120.0674 61.2100 34.1619 174.3387 452 H 4.7698 9.3904 128.8296 55.5111 31.2279 173.9039 453 T 4.9955 8.3431 115.0288 59.9772 71.6821 174.8209 454 E 3.8559 8.9193 123.4096 59.6632 29.8130 178.7082 455 K 3.7588 7.6330 118.1283 58.6163 32.2722 176.7930 456 Y 3.8375 7.0136 112.8736 56.4364 40.0271 177.5621 457 G 3.6982 7.5617 108.4931 45.6873 0.0000 174.5704 458 D 4.5882 8.5620 118.0172 55.6074 41.9503 176.7782 459 K 4.5919 7.5432 118.5440 53.6554 32.4575 176.0543 460 C 4.2396 8.1888 118.2684 60.8525 29.8928 175.9051 461 A 3.8490 8.0619 123.5352 54.9104 17.9081 179.0877 462 E 2.6851 7.7275 117.3207 58.9822 29.6676 178.7042 463 F 3.9686 8.0045 120.4397 61.3428 39.5270 177.2044 464 L 3.8820 8.0692 118.7227 57.5821 41.3370 179.6362 465 V 3.5855 7.7677 118.4003 65.9656 31.2310 177.7487 466 N 4.3891 7.6242 114.9185 55.5486 38.5512 176.4023 467 D 4.2815 7.7503 118.3598 55.5384 41.4613 177.1743 468 L 4.4307 7.5649 116.8439 52.8369 43.6780 176.2304 469 K 3.6597 7.5317 117.1193 57.1938 28.9417 174.1203 470 I 4.3148 8.0498 117.9200 59.9589 38.1357 176.2148 471 Q 4.4670 8.5721 124.1803 56.1275 30.0415 175.8433 472 S 4.6769 7.5194 111.4996 55.8296 65.4480 172.6551 473 P 4.3898 0.0000 0.0000 64.4752 31.1721 176.9420 474 K 4.3505 7.5802 118.4564 56.2241 32.7119 176.6997 475 D 4.6999 7.7881 119.9507 52.6791 39.8533 176.9873 476 S 4.1619 7.8839 118.4435 62.1167 63.2537 175.8838 477 V 3.4979 8.0049 120.4494 66.9998 30.8335 177.7402 478 Q 4.0994 8.3013 117.0158 58.5276 28.7993 178.6864 479 L 4.0183 7.8342 119.7280 57.6992 41.5149 179.3184 480 A 3.9590 8.1197 120.6785 55.1186 18.3331 179.1498 481 N 4.2337 7.9863 114.8663 56.8516 39.0522 177.0258 482 A 3.9585 8.9525 123.3066 54.9187 18.6186 179.2987 483 K 3.8632 8.6427 118.6378 59.6847 32.1528 178.5998 484 E 3.9463 8.0169 119.3221 59.4780 29.7006 178.7712 485 L 4.1566 7.9868 118.7728 57.8047 41.6404 179.5362 486 A 4.0985 8.1916 120.8526 55.2494 18.3410 179.0668 487 Y 3.9441 8.0781 117.6970 60.6632 38.8765 178.3810 488 K 4.2566 8.4035 119.4453 59.7683 32.2357 179.2430 489 E 4.1785 8.5328 118.9134 59.2678 29.5405 179.4482 490 G 3.7510 8.1676 105.8551 47.9792 0.0000 175.4483 491 F 3.9127 7.7387 122.0471 60.9438 39.5083 176.3949 492 Y 4.2899 7.9000 114.5477 59.5039 38.0032 176.2405 493 N 4.9282 8.2463 114.6411 52.7190 39.5753 174.2659 494 G 4.4386 7.6146 106.1065 44.9598 0.0000 173.2566 495 T 5.1521 8.6606 119.8726 61.3189 72.0297 173.5581 496 M 4.5460 8.9396 126.3862 55.7872 32.7985 176.8073 497 L 4.5948 8.9051 122.5955 54.6635 42.7602 176.2361 498 I 4.1886 7.3558 117.7060 60.4160 41.2548 174.7413 499 G 3.4815 8.3020 111.7066 43.9365 0.0000 173.4772 500 K 3.5356 8.3322 118.3724 59.1097 32.0043 177.3465 501 Y 4.6888 7.4804 114.4256 57.1286 38.3490 174.8087 502 K 3.8870 7.4373 120.9801 58.6376 32.2807 176.7877 503 G 4.0175 9.0000 115.4702 45.3157 0.0000 173.3717 504 D 4.6368 8.1360 120.0973 53.1429 41.9757 176.1739 505 K 4.3273 8.3515 121.5959 56.4529 32.9192 178.3218 506 V 3.4847 8.8318 123.3557 66.0089 31.7025 177.6416 507 E 3.0109 7.7897 118.6068 59.2764 29.1413 178.0339 508 D 4.4348 7.7035 116.5980 56.6716 41.5351 178.2041 509 A 3.8343 7.9431 121.3060 54.3211 18.4288 179.4555 510 K 3.8258 8.2683 119.2009 59.3715 32.2992 177.2789 511 P 4.2865 0.0000 0.0000 65.6405 31.1785 178.5345 512 K 3.8458 7.7064 117.9500 59.2499 32.0090 179.2984 513 V 3.8784 7.9301 118.8697 65.6923 31.5193 177.8347 514 K 3.7888 7.9534 119.2768 59.6549 32.0965 178.3996 515 Q 3.9731 8.0236 119.6235 59.2692 28.8803 177.9153 516 D 4.4496 8.1829 119.7861 57.6123 40.8932 178.8214 517 L 3.7367 7.7782 119.1534 57.7921 41.5625 179.8136 518 I 4.0947 7.5568 120.6702 64.0993 36.8751 178.0205 519 D 4.4548 8.3831 118.6717 57.4470 40.8002 178.1281 520 E 4.4205 8.3356 115.8557 55.7954 29.7117 177.0783 521 G 3.9409 7.7462 106.9652 46.4795 0.0000 174.7147 522 L 4.4609 8.1221 120.8615 55.4792 43.2103 175.9608 523 A 5.1145 7.5934 119.3756 51.1808 23.1833 174.3455 524 F 4.8891 8.0383 111.9774 56.0801 41.4710 173.8116 525 V 4.4608 8.5094 119.9314 63.0077 32.8120 174.8344 526 Y 4.8750 8.8872 126.7770 57.0136 42.4735 173.5052 527 N 5.1856 8.8069 123.9110 51.6720 41.7544 173.0247 528 E 4.6255 8.1423 119.1299 54.6623 32.7591 174.7044 529 P 4.4112 0.0000 0.0000 62.7046 30.8492 171.9051 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 279 G 8.35 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 280 Y 8.74 4.65 0.00 2.83 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 0.00 281 V 8.67 4.50 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 0.83 0.00 0.00 0.89 0.00 0.00 282 G 8.84 3.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 283 I 8.50 4.32 1.87 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.90 0.82 0.00 0.00 284 K 8.77 4.08 0.00 1.67 1.38 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.26 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.99 1.34 7.81 285 I 8.70 4.29 2.00 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 1.10 0.55 0.89 0.00 0.00 286 R 8.59 4.18 0.00 2.00 1.94 0.00 2.44 0.00 0.00 2.71 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.44 0.00 287 L 8.38 4.46 0.00 1.72 1.46 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 288 T 8.58 4.30 4.18 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 0.00 0.00 0.00 1.18 0.00 0.00 289 D 7.58 4.71 0.00 2.45 2.47 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 0.00 290 V 8.27 3.89 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 0.05 0.00 0.00 0.60 0.00 0.00 291 A 8.12 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 292 P 0.00 4.22 0.00 2.24 2.37 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 293 Q 8.00 4.14 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.15 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 294 A 8.31 4.30 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 0.00 295 Q 7.63 3.90 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.60 0.00 296 E 8.19 3.93 0.00 2.06 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 2.40 2.42 0.00 297 L 7.89 3.81 0.00 1.79 1.94 0.85 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 298 F 8.37 3.73 0.00 2.92 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 0.00 299 K 8.39 4.05 0.00 2.11 1.86 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.44 7.81 300 K 8.30 4.04 0.00 1.80 1.79 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.36 7.81 301 E 7.36 4.25 0.00 1.40 1.15 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 1.58 2.14 0.00 302 S 7.58 3.64 0.00 4.01 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 0.00 303 L 7.52 4.21 0.00 1.40 1.47 -0.24 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 304 D 7.88 4.64 0.00 2.76 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.20 3.72 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 0.79 0.00 0.00 0.46 0.00 0.00 306 K 8.85 4.09 0.00 1.76 1.84 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.50 7.81 307 E 8.08 4.40 0.00 1.94 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 2.25 2.38 0.00 308 N 7.07 5.10 0.00 2.85 2.86 0.00 0.00 7.04 7.49 0.00 0.00 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 K 8.23 4.23 0.00 2.00 1.91 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.47 7.81 310 V 8.08 5.07 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 1.30 0.00 0.00 1.08 0.00 0.00 311 Y 9.61 5.41 0.00 3.14 2.83 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 0.00 0.00 0.00 0.00 312 L 9.20 4.76 0.00 1.55 1.55 0.84 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 313 V 8.14 4.56 1.96 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 0.51 0.00 0.00 0.34 0.00 0.00 314 A 8.67 5.19 1.22 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 0.00 0.00 0.00 315 A 8.55 4.77 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 0.00 316 T 8.92 4.83 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 1.20 0.00 0.00 317 L 8.82 4.56 0.00 1.72 1.68 0.72 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 318 R 8.17 5.03 0.00 1.88 1.85 0.00 3.29 0.00 0.00 3.40 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 319 P 0.00 4.32 0.00 2.22 2.25 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 2.07 2.00 0.00 320 E 8.29 4.24 0.00 2.30 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 0.00 2.42 2.35 0.00 321 T 7.93 4.57 4.32 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 1.27 0.00 0.00 322 M 7.78 3.99 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.78 0.00 323 Y 7.51 4.95 0.00 3.07 3.03 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 0.00 324 G 8.28 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 0.00 0.00 0.00 325 Q 7.97 4.91 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 326 T 8.09 4.57 4.25 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 1.31 0.00 0.00 327 C 7.26 4.55 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 0.00 328 C 7.79 4.51 0.00 2.89 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.04 5.76 0.00 3.17 2.83 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 0.00 0.00 0.00 0.00 330 V 8.75 4.94 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 0.60 0.00 0.00 1.00 0.00 0.00 331 S 9.41 4.98 0.00 3.93 3.82 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 0.00 332 P 0.00 4.49 0.00 2.13 2.17 0.00 3.79 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 0.00 333 K 7.81 4.28 0.00 1.75 1.85 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.43 7.81 334 I 7.43 4.11 1.37 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 1.20 0.52 0.04 0.00 0.00 335 D 8.50 4.72 0.00 2.51 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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 0.00 344 G 7.98 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 0.00 345 D 7.37 5.37 0.00 2.67 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 0.00 346 Y 9.23 5.04 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 0.00 347 F 9.10 5.99 0.00 3.14 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 0.00 348 I 9.12 5.40 1.92 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 2.20 0.88 0.00 0.00 349 T 8.52 5.06 4.38 0.00 0.00 0.00 0.00 0.00 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 0.00 350 T 8.75 4.43 4.25 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 1.18 0.00 0.00 351 E 9.40 4.24 0.00 2.19 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 2.63 2.76 0.00 352 R 8.13 3.89 0.00 1.85 1.98 0.00 3.29 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 353 A 7.73 4.15 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 354 F 8.08 3.62 0.00 2.45 2.44 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 0.00 0.00 0.00 0.00 355 K 7.56 3.82 0.00 1.45 1.59 0.00 0.61 0.00 0.00 1.19 0.00 0.00 2.75 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.16 0.97 7.81 356 N 7.51 4.46 0.00 2.97 3.03 0.00 0.00 6.97 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 0.00 357 M 7.32 4.27 0.00 1.72 1.55 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 *368 Y 7.48 4.48 0.00 2.99 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 0.00 369 Y 7.81 4.83 0.00 3.19 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 0.00 370 K 7.71 4.32 0.00 0.95 1.19 0.00 1.52 0.00 0.00 1.57 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.16 1.20 7.81 371 P 0.00 4.08 0.00 1.78 0.73 0.00 3.72 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 1.76 1.93 0.00 372 L 8.12 4.09 0.00 1.57 1.84 1.04 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 373 F 6.98 4.95 0.00 2.99 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 0.00 374 T 8.44 4.88 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 1.12 0.00 0.00 375 I 9.08 4.72 2.06 0.00 0.00 1.21 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 1.79 0.97 0.00 0.00 376 N 9.09 5.03 0.00 2.92 2.74 0.00 0.00 7.07 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 377 G 8.93 4.46 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 0.00 378 K 8.05 4.01 0.00 2.03 1.95 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.56 7.81 379 T 7.81 4.05 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 1.31 0.00 0.00 380 L 7.90 4.43 0.00 1.83 1.63 0.81 0.43 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 0.00 381 I 7.06 4.06 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.84 1.11 0.00 0.00 382 G 8.53 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 0.00 0.00 0.00 383 S 7.43 4.22 0.00 3.66 3.73 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 0.00 384 R 8.80 4.71 0.00 1.61 1.73 0.00 3.01 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.39 0.00 385 I 8.05 5.06 1.81 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.61 0.82 0.00 0.00 386 D 9.21 4.87 0.00 2.74 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 0.00 387 A 8.48 4.81 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 0.00 388 P 0.00 4.29 0.00 1.97 1.90 0.00 3.65 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 2.01 2.21 0.00 389 Y 9.13 3.70 0.00 2.87 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 0.00 390 A 7.58 4.78 1.30 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 0.00 0.00 0.00 391 V 8.13 4.11 2.12 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 0.81 0.00 0.00 0.99 0.00 0.00 392 N 8.03 4.57 0.00 2.89 2.77 0.00 0.00 6.95 7.61 0.00 0.00 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 K 8.53 4.24 0.00 1.75 1.74 0.00 1.91 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 394 N 8.45 4.09 0.00 2.81 2.81 0.00 0.00 6.96 7.85 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 0.00 395 L 7.23 4.51 0.00 1.50 1.49 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 396 R 8.12 5.00 0.00 1.42 1.24 0.00 2.57 0.00 0.00 2.89 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.01 0.00 397 V 7.93 4.26 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 0.97 0.00 0.00 0.81 0.00 0.00 398 L 9.35 5.38 0.00 1.77 1.70 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 399 P 0.00 5.24 0.00 2.15 2.14 0.00 3.86 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 2.09 0.00 400 M 8.87 4.29 0.00 1.86 1.14 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.25 0.00 401 E 9.02 3.98 0.00 2.05 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 2.34 2.39 0.00 402 T 7.53 4.49 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 1.22 0.00 0.00 403 V 7.54 3.72 2.21 0.00 0.00 0.00 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 1.00 0.00 0.00 404 L 8.44 4.13 0.00 1.63 1.55 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 405 A 8.44 4.50 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00 406 T 7.82 4.21 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 1.20 0.00 0.00 407 K 7.98 4.15 0.00 1.73 1.75 0.00 1.92 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.34 1.44 7.81 408 G 8.50 3.66 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 0.00 0.00 0.00 409 T 8.46 4.24 4.24 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 0.00 0.00 0.00 0.98 0.00 0.00 410 G 8.49 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 0.00 0.00 0.00 411 V 7.52 4.67 2.22 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 0.94 0.00 0.00 0.88 0.00 0.00 412 V 8.80 4.65 2.30 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 1.16 0.00 0.00 1.02 0.00 0.00 413 T 8.64 4.32 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 1.28 0.00 0.00 414 C 8.54 4.86 0.00 2.29 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.51 4.83 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 1.11 0.00 0.00 1.04 0.00 0.00 416 P 0.00 4.56 0.00 2.27 2.31 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 417 S 8.30 4.35 0.00 4.05 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 0.00 418 D 8.09 4.83 0.00 2.70 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 0.00 419 S 8.48 4.71 0.00 3.89 4.09 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 0.00 420 P 0.00 4.34 0.00 2.24 2.11 0.00 3.72 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 421 D 8.19 4.43 0.00 2.74 2.74 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 0.00 422 D 7.97 4.52 0.00 3.01 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 0.00 423 F 8.57 4.14 0.00 3.35 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 0.00 424 V 8.10 3.56 2.12 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 0.98 0.00 0.00 1.10 0.00 0.00 425 T 7.90 3.73 4.07 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 0.80 0.00 0.00 426 T 8.13 3.93 4.35 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 1.18 0.00 0.00 427 R 7.65 3.72 0.00 1.54 1.90 0.00 3.06 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 428 D 7.92 4.38 0.00 2.91 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 0.00 429 L 7.71 3.96 0.00 1.79 1.77 1.05 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 430 A 8.00 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 431 N 7.87 4.52 0.00 3.03 2.92 0.00 0.00 6.81 6.89 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 0.00 432 K 8.29 4.79 0.00 2.00 1.74 0.00 1.39 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.27 1.34 7.81 433 P 0.00 4.42 0.00 2.17 2.31 0.00 3.83 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 434 E 8.39 3.91 0.00 2.12 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 2.39 2.34 0.00 435 Y 8.07 3.94 0.00 2.72 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 0.00 436 Y 7.82 4.28 0.00 3.09 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 437 G 7.79 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 0.00 0.00 0.00 438 I 8.01 4.54 2.09 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.79 1.19 0.00 0.00 439 E 6.59 4.22 0.00 1.16 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 440 K 8.38 3.92 0.00 1.72 1.76 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.46 7.81 441 D 7.93 4.55 0.00 2.76 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 0.00 442 W 7.93 4.43 0.00 3.51 3.13 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 0.00 0.00 0.00 0.00 443 V 7.34 3.97 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 0.77 0.00 0.00 1.00 0.00 0.00 444 Q 8.67 4.12 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.87 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 445 T 8.44 4.38 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 1.22 0.00 0.00 446 D 8.06 4.56 0.00 2.70 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 0.00 447 I 8.27 4.42 1.96 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.81 1.00 0.00 0.00 448 V 8.22 4.18 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 0.74 0.00 0.00 0.97 0.00 0.00 449 P 0.00 4.44 0.00 2.05 2.13 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 450 I 8.52 4.36 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.08 1.03 0.00 0.00 451 V 7.61 4.83 2.27 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 0.85 0.00 0.00 0.97 0.00 0.00 452 H 9.39 4.77 0.00 3.26 3.12 0.00 5.77 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 453 T 8.34 5.00 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 1.23 0.00 0.00 454 E 8.92 3.86 0.00 1.85 1.96 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 2.27 2.18 0.00 455 K 7.63 3.76 0.00 1.33 0.74 0.00 1.47 0.00 0.00 1.12 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.66 1.14 7.81 456 Y 7.01 3.84 0.00 2.77 2.55 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 0.00 457 G 7.56 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 0.00 458 D 8.56 4.59 0.00 2.66 2.74 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 0.00 459 K 7.54 4.59 0.00 1.77 1.68 0.00 1.82 0.00 0.00 1.92 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.40 7.81 460 C 8.19 4.24 0.00 3.21 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 0.00 461 A 8.06 3.85 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 0.00 462 E 7.73 2.69 0.00 1.69 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 2.14 0.00 463 F 8.00 3.97 0.00 3.22 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 0.00 464 L 8.07 3.88 0.00 1.64 1.56 0.61 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 465 V 7.77 3.59 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 1.23 0.00 0.00 1.05 0.00 0.00 466 N 7.62 4.39 0.00 2.49 2.73 0.00 0.00 6.98 9.28 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 0.00 467 D 7.75 4.28 0.00 1.86 2.38 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.56 4.43 0.00 1.75 1.65 0.90 0.97 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 0.00 469 K 7.53 3.66 0.00 1.85 1.80 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.40 7.81 470 I 8.05 4.31 1.90 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 1.30 0.55 0.94 0.00 0.00 471 Q 8.57 4.47 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 472 S 7.52 4.68 0.00 3.79 3.63 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 0.00 473 P 0.00 4.39 0.00 2.08 2.07 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.05 0.00 474 K 7.58 4.35 0.00 1.71 1.79 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.37 7.81 475 D 7.79 4.70 0.00 2.81 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 476 S 7.88 4.16 0.00 4.09 4.13 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 0.00 0.00 0.00 0.00 477 V 8.00 3.50 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 1.06 0.00 0.00 0.99 0.00 0.00 478 Q 8.30 4.10 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.54 0.00 479 L 7.83 4.02 0.00 1.78 1.73 0.94 1.16 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 0.00 480 A 8.12 3.96 1.41 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 0.00 0.00 481 N 7.99 4.23 0.00 3.00 2.99 0.00 0.00 7.14 9.06 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 0.00 482 A 8.95 3.96 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 0.00 483 K 8.64 3.86 0.00 1.83 2.01 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.49 7.81 484 E 8.02 3.95 0.00 2.28 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 0.00 2.33 2.45 0.00 485 L 7.99 4.16 0.00 1.78 1.86 1.01 1.12 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 0.00 486 A 8.19 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 487 Y 8.08 3.94 0.00 3.29 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 0.00 488 K 8.40 4.26 0.00 2.16 2.07 0.00 1.97 0.00 0.00 2.00 0.00 0.00 3.28 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.87 1.78 7.81 489 E 8.53 4.18 0.00 2.39 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 0.00 2.42 2.27 0.00 490 G 8.17 3.75 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 0.00 0.00 0.00 491 F 7.74 3.91 0.00 2.51 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 0.00 492 Y 7.90 4.29 0.00 3.21 2.95 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 0.00 0.00 0.00 493 N 8.25 4.93 0.00 2.90 2.75 0.00 0.00 6.97 8.41 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 0.00 494 G 7.61 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 495 T 8.66 5.15 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 1.26 0.00 0.00 496 M 8.94 4.55 0.00 1.90 2.16 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 497 L 8.91 4.59 0.00 1.56 1.65 0.95 0.68 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 0.00 498 I 7.36 4.19 1.72 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 1.05 0.47 0.45 0.00 0.00 499 G 8.30 3.48 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 0.00 500 K 8.33 3.54 0.00 1.37 0.95 0.00 1.54 0.00 0.00 1.41 0.00 0.00 2.68 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.47 1.10 7.81 501 Y 7.48 4.69 0.00 3.08 2.90 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 0.00 0.00 0.00 502 K 7.44 3.89 0.00 1.73 1.72 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.38 7.81 503 G 9.00 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 504 D 8.14 4.64 0.00 3.04 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.35 4.33 0.00 1.84 1.60 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.74 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.32 7.81 506 V 8.83 3.48 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 0.92 0.00 0.00 0.90 0.00 0.00 507 E 7.79 3.01 0.00 1.53 1.68 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 2.04 1.50 0.00 508 D 7.70 4.43 0.00 2.72 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.94 3.83 1.34 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 0.00 0.00 510 K 8.27 3.83 0.00 2.00 1.88 0.00 1.90 0.00 0.00 1.92 0.00 0.00 2.95 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.66 7.81 511 P 0.00 4.29 0.00 2.26 2.28 0.00 3.80 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 512 K 7.71 3.85 0.00 1.18 1.18 0.00 1.03 0.00 0.00 1.49 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.26 7.81 513 V 7.93 3.88 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 1.18 0.00 0.00 1.35 0.00 0.00 514 K 7.95 3.79 0.00 1.99 1.99 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.42 7.81 515 Q 8.02 3.97 0.00 2.37 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 516 D 8.18 4.45 0.00 3.18 3.15 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 0.00 517 L 7.78 3.74 0.00 1.70 1.48 0.62 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 518 I 7.56 4.09 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.95 0.00 0.00 519 D 8.38 4.45 0.00 2.84 2.79 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 0.00 520 E 8.34 4.42 0.00 1.97 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 2.41 2.49 0.00 521 G 7.75 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 0.00 522 L 8.12 4.46 0.00 1.54 1.60 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 523 A 7.59 5.11 1.06 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 0.00 0.00 524 F 8.04 4.89 0.00 3.18 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 0.00 525 V 8.51 4.46 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 0.79 0.00 0.00 0.95 0.00 0.00 526 Y 8.89 4.88 0.00 3.24 2.74 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 0.00 527 N 8.81 5.19 0.00 2.55 2.64 0.00 0.00 6.90 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 0.00 528 E 8.14 4.63 0.00 1.95 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 0.00 1.92 2.23 0.00 529 P 0.00 4.41 0.00 2.11 1.86 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.