NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 365 H 4.8472 8.2876 116.3370 55.1033 29.8362 173.7963 366 R 3.7257 8.5960 115.7270 57.9119 29.5918 176.5627 367 F 4.9070 8.2317 116.7485 57.3234 40.6406 178.7762 368 V 3.7118 7.5836 123.5271 65.2174 30.8966 178.4835 369 Q 3.9954 8.0501 118.1993 58.4073 28.6854 178.3530 370 K 3.9597 8.1420 120.2826 59.3885 32.2845 178.8221 371 V 3.7586 8.5712 118.9577 66.1839 31.5156 177.5805 372 E 3.9209 8.4151 119.0859 59.2390 29.4015 178.4727 373 E 3.9173 8.1920 119.3917 59.4690 29.7456 178.6899 374 M 3.9065 7.9339 118.7643 58.2693 31.9652 178.9419 375 V 3.6605 8.0548 118.6667 66.0403 31.7476 177.8968 376 Q 3.9529 8.2613 119.4080 59.0677 28.8308 177.4779 377 N 4.4717 8.6051 118.5562 57.2758 38.8754 176.5700 378 H 4.5162 8.1484 118.7459 58.7454 28.5876 177.8007 379 M 4.0789 8.0315 119.7665 58.3649 31.8102 178.4980 380 T 3.9653 7.9000 109.1945 63.9266 69.6714 175.6473 381 Y 4.5133 8.1489 118.5403 59.1685 39.2667 177.8438 382 S 4.4073 8.4019 115.0381 60.0856 63.3108 175.3813 383 L 4.4229 7.6405 118.3038 54.6716 42.1285 176.9074 384 Q 3.9717 7.2254 117.6622 55.5305 29.1263 175.7998 385 D 4.2026 8.4626 121.7005 54.5793 41.7933 176.3107 386 V 3.7686 7.7348 118.9956 61.3531 32.4987 178.2188 387 G 3.6544 7.9170 108.8287 48.0284 0.0000 174.7807 388 G 3.7586 8.3656 107.3406 45.9950 0.0000 173.2290 389 D 4.4709 7.7294 120.6924 53.7061 41.2020 176.6636 390 A 4.3024 8.6265 129.6671 54.2002 18.7834 177.7208 391 N 4.5278 8.8573 112.9691 54.4963 38.9811 175.3173 392 W 4.8693 7.8810 117.7313 54.9494 31.1604 174.9917 393 Q 4.7480 9.1415 123.0782 54.0120 31.2089 174.2000 394 L 4.0419 8.8275 128.6755 55.5858 41.7402 176.1666 395 V 4.1831 8.7242 121.1884 62.2694 33.3700 177.1445 396 V 4.4866 7.4501 118.9611 60.9350 35.1040 173.9757 397 E 5.0450 8.6452 127.0171 54.4769 32.8409 174.3783 398 E 4.5055 9.0308 127.3089 55.7510 33.7835 174.7893 399 G 3.7552 8.2825 116.0623 47.3114 0.0000 174.3761 400 E 4.3136 8.7861 125.4998 56.2578 30.0286 174.3786 401 M 4.5253 7.8433 121.0026 54.2857 33.9328 174.8788 402 K 4.9337 9.0147 124.9864 54.5195 36.1459 175.0854 403 V 4.7737 8.8887 125.2683 61.3609 33.8059 173.9218 404 Y 5.5673 9.7692 126.2912 56.3956 41.4683 174.9014 405 R 5.3488 9.3257 117.5342 54.7567 34.0657 173.6288 406 R 4.3719 7.7397 120.3160 54.1810 32.2989 174.5535 407 E 4.5863 8.5975 126.6969 56.2304 30.2549 176.5243 408 V 4.4182 9.2153 124.9584 61.0446 35.1417 173.8985 409 E 5.2176 8.8178 126.0196 54.5846 33.0486 175.0831 410 E 4.4948 8.7262 122.8396 55.5030 32.3126 175.9130 411 N 4.3984 9.8490 122.5996 54.5055 36.1197 175.3375 412 G 3.9768 8.5106 102.8136 45.6888 0.0000 173.5005 413 I 4.3477 7.2086 120.5544 58.8237 39.2111 175.1802 414 V 4.1241 8.2822 125.2141 63.0694 31.4275 175.2297 415 L 4.5478 8.1884 126.3009 55.6148 43.3694 178.0918 416 D 5.0138 7.1216 117.6887 53.1809 37.9000 173.8817 417 P 4.4695 0.0000 0.0000 62.8771 32.8333 174.8929 418 L 5.4391 8.9717 125.0788 53.2717 45.3744 175.0256 419 K 5.2090 9.7160 125.9774 54.8049 35.9053 174.5892 420 A 5.5547 9.5902 128.9368 50.3785 22.4347 174.8709 421 T 5.1633 8.8608 110.9153 60.6388 72.3396 172.4922 422 H 5.4058 9.0260 120.5572 56.0570 34.1152 172.1115 423 A 5.0794 8.6937 123.5413 50.2383 21.8541 175.5323 424 V 4.1804 8.6538 123.0752 60.8094 33.9915 175.1995 425 K 4.2157 8.6591 127.8311 57.1976 32.7176 177.7255 426 G 4.1758 8.9343 111.3369 44.9648 0.0000 173.6106 427 V 4.5301 7.2661 110.9507 58.9018 35.6817 175.3886 428 T 4.6453 8.1987 112.3913 60.0193 71.9985 176.0924 429 G 3.7013 9.2144 109.1183 48.1776 0.0000 175.4180 430 H 2.6910 7.9362 120.0480 58.6265 29.7445 176.9551 431 E 3.8444 7.8845 120.1133 59.3724 29.3258 179.4895 432 V 3.6663 7.8065 118.0984 66.3806 31.6320 177.8712 433 C 4.4641 8.4830 116.7009 62.8563 27.8929 175.6115 434 N 4.4409 8.4687 118.4994 56.9871 37.9810 177.1280 435 Y 4.2927 8.0668 116.2939 60.9881 38.0003 177.9529 436 F 4.2937 8.7538 121.3204 60.6591 39.5412 176.6433 437 W 4.5442 8.5259 127.2148 58.6917 30.9408 175.6479 438 N 4.1443 8.5795 119.3840 53.5299 38.5065 175.7709 439 V 3.5839 7.8625 120.3872 64.1239 31.9663 178.4503 440 D 4.4692 8.0706 118.8083 56.6217 41.0245 177.5754 441 V 4.6455 7.6881 110.4482 60.9303 32.7608 177.2255 442 R 3.4745 8.0418 122.6344 59.4495 29.8251 178.6169 443 N 4.2541 8.0118 113.0551 56.0234 38.6768 176.0508 444 D 4.5661 7.8091 117.1947 55.7721 41.1049 177.0890 445 W 4.6927 7.1901 113.0616 56.2248 30.0671 175.5149 446 E 3.6604 7.1693 120.0446 55.9200 29.3384 175.9331 447 T 4.3888 8.3606 118.8918 62.3773 69.6525 174.2762 448 T 4.4205 8.3568 110.1754 61.5312 70.1266 174.0722 449 I 4.4567 7.3131 123.3589 60.1691 38.4425 174.9253 450 E 4.1691 9.0566 129.6891 58.3327 29.4023 175.9428 451 N 5.3404 8.4199 115.2976 51.7239 43.4755 172.7906 452 F 5.4846 8.2876 114.2708 56.4372 40.9108 172.8430 453 H 4.6456 9.2237 115.1026 54.1637 32.3680 172.7846 454 V 4.1461 8.2456 120.3963 62.5256 31.0218 175.8445 455 V 3.8172 8.6838 130.2512 65.8470 32.0492 175.9629 456 E 4.7210 7.8349 118.8120 55.3932 33.1720 174.1455 457 T 4.7018 8.4564 122.8354 62.1857 69.6615 174.5906 458 L 4.2129 8.7272 127.4031 56.9923 42.2505 176.4121 459 A 4.6130 7.4419 118.7453 51.2234 21.9463 176.1578 460 D 4.5094 8.8985 118.4442 57.0250 40.9487 177.6588 461 N 4.3279 8.2218 113.4892 51.9437 38.0420 173.2670 462 A 5.4271 8.1519 121.6651 50.8936 22.6920 175.7541 463 I 5.0977 9.0794 115.2101 59.3204 42.1319 174.0244 464 I 4.6604 8.5416 123.6074 59.5273 39.7339 174.7294 465 I 4.6424 8.1065 127.9901 59.4637 39.8737 173.8544 466 Y 5.0530 8.4208 128.1510 56.1531 40.7544 174.2607 467 Q 4.9307 8.1247 123.1169 54.9538 32.6800 173.2854 468 T 4.8321 8.7322 111.5057 60.3958 71.5515 172.8492 469 H 5.1894 8.5901 120.9947 53.8598 30.8520 175.1715 470 K 4.0241 8.7104 121.5144 56.4847 32.7098 177.0922 471 R 3.9442 8.6189 124.4985 56.6676 30.2952 176.1885 472 V 4.1675 8.2291 123.3503 62.7242 33.3951 174.9252 *476 S 4.2757 7.7202 112.3906 58.0614 64.1105 172.9713 477 Q 4.1891 8.3046 122.1044 56.3958 30.2149 174.7004 478 R 5.2114 8.5893 124.2983 54.7279 32.9095 174.8974 479 D 5.5171 9.0473 122.4163 51.6459 43.2886 174.9725 480 V 4.7683 8.3725 117.7847 60.1608 35.5258 173.7838 481 L 5.2850 8.6521 124.0757 53.6744 45.0069 174.4349 482 Y 5.1580 8.5017 124.1091 55.1163 42.0884 173.9426 483 L 4.3059 8.3854 124.3528 54.5992 43.7211 175.2437 484 S 5.5848 9.4980 121.3473 55.6310 65.0106 172.8696 485 V 5.2056 9.1167 126.7513 59.9206 34.5868 174.1720 486 I 4.9101 8.0189 124.0446 59.3610 39.6679 174.8612 487 R 4.5924 9.1283 127.4810 54.2863 34.7381 173.7826 488 K 3.6711 7.9670 123.4929 54.6507 33.6493 175.4586 489 I 4.1696 8.5950 129.9653 58.9942 38.3644 173.5938 490 P 4.5934 0.0000 0.0000 62.4947 31.8574 176.5809 491 A 4.1913 8.4012 125.9047 51.8630 19.1029 178.0859 492 L 4.1355 8.4290 121.5280 57.2275 42.3329 177.1575 493 T 4.7281 7.4990 106.9129 59.7437 71.8540 174.1816 494 E 4.2462 8.6293 119.5848 57.6714 29.5581 177.5425 495 N 4.6285 7.8066 115.9150 53.7421 39.1354 174.6149 496 D 5.0366 7.5751 118.0270 51.5043 43.5448 174.0917 497 P 4.6602 0.0000 0.0000 62.5827 32.4844 175.7812 498 E 4.3672 8.7022 120.5894 56.5333 30.8685 176.0030 499 T 4.8713 8.5120 118.2854 61.7103 71.9457 173.0559 500 W 5.0746 9.2257 126.3008 55.1412 31.5690 175.1163 501 I 5.2027 9.0003 123.9912 59.2791 41.4605 173.7532 502 V 4.9972 8.9622 128.7209 61.3862 34.0557 173.5115 503 C 5.3709 9.2877 128.5734 57.7699 33.9507 171.9516 504 N 5.7762 9.6811 124.6146 51.5623 40.7325 173.6540 505 F 5.3851 8.8071 118.9383 54.7390 41.6915 174.4858 506 S 4.8384 9.0013 118.4939 59.4739 63.1325 174.0608 507 V 4.7298 8.3487 116.4418 59.7838 35.7456 174.7212 508 D 4.9103 8.7823 121.2172 53.7593 42.4133 176.0300 509 H 4.8717 8.3699 120.5296 54.6152 32.9384 174.0960 510 D 4.4105 8.6861 126.4497 57.4727 40.7969 177.7055 511 S 4.3848 8.2123 112.5074 59.5707 63.4273 174.2679 512 A 4.4674 7.7237 123.1633 49.3668 18.3024 173.5870 513 P 4.6434 0.0000 0.0000 60.7840 33.1034 177.1581 514 L 4.0958 8.3543 118.8661 55.0077 41.8372 176.5498 515 N 5.0818 8.4696 119.1137 51.0101 40.0595 174.0630 516 N 4.6281 8.5432 114.9918 54.9172 39.1544 177.1083 517 R 4.1729 8.1075 113.8609 57.8398 30.2153 176.0728 518 C 5.1317 8.7514 114.9876 57.7177 31.5552 173.7531 519 V 4.1493 8.8683 121.9842 61.5936 32.7858 174.9821 520 R 5.3640 8.9358 128.7457 55.0581 29.9496 175.7088 521 A 4.4999 8.8352 129.1901 51.7550 19.7075 176.5238 522 K 4.7315 9.4826 120.0453 54.5177 35.1751 175.5585 523 I 5.0219 9.0848 118.7638 59.1400 41.2934 174.6071 524 N 5.3644 9.0915 122.0276 52.3889 41.7489 172.9317 525 V 4.8941 9.3335 126.5090 60.9432 35.1436 174.1222 526 A 5.2141 8.8051 128.0684 50.3895 23.0052 174.4283 527 M 4.9143 9.1072 121.5616 53.9538 34.7125 174.5304 528 I 5.0348 9.0533 128.0552 59.7829 40.2232 174.6398 529 C 5.4749 9.6170 124.7232 58.0715 32.0761 173.2783 530 Q 5.1490 9.0366 120.9558 54.4596 32.6172 174.2903 531 T 5.0477 8.6535 118.1832 61.8775 71.2279 173.4957 532 L 4.6972 9.0567 126.7261 53.0674 43.8957 175.4879 533 V 4.9764 8.5228 124.1254 61.2852 32.9869 175.0058 534 S 4.5098 8.8028 122.1435 58.9076 64.9355 174.3104 *542 I 3.8671 7.6441 119.9446 60.7166 38.6510 174.0745 543 S 4.9452 8.1241 121.7432 56.2539 66.2142 174.5374 544 R 3.9980 8.3655 117.4319 59.1982 29.8887 178.8241 545 D 4.4279 7.8214 116.7822 56.5498 41.0386 176.6109 546 N 5.0727 8.1524 115.0022 52.6320 40.0972 174.2043 547 I 5.1386 7.6026 112.9913 58.9787 41.1454 174.1472 548 L 5.0398 8.8040 125.6974 53.5893 45.7455 174.2637 549 C 5.0535 8.8924 126.7722 57.8826 33.4991 172.2838 550 K 4.7882 9.0432 127.1517 55.4748 33.3755 175.7329 551 I 5.0485 9.0101 126.5786 59.7340 40.3436 174.7720 552 T 5.0613 9.1805 123.1300 61.9053 71.5952 172.2211 553 Y 5.1900 9.2815 128.1958 55.8065 41.5668 174.6275 554 V 4.8991 8.3501 119.3315 59.3973 35.6833 174.5170 555 A 4.8210 8.8314 125.4602 50.3173 22.4740 174.5977 556 N 5.0757 9.3816 120.7048 51.5122 41.0384 173.3579 557 V 4.8536 8.3249 123.1211 60.7698 34.4566 174.1236 558 N 4.9971 9.1793 126.7991 50.9431 41.1022 171.9854 559 P 4.6864 0.0000 0.0000 62.6473 32.8204 175.6067 560 G 4.0708 8.6475 109.0927 45.1612 0.0000 173.6811 561 G 4.1480 9.0670 111.1984 45.1216 0.0000 173.8532 562 W 4.9193 8.5411 132.6011 55.4485 33.6690 173.8292 563 A 4.2310 6.9908 125.5023 48.8181 21.6702 174.7630 564 P 3.7539 0.0000 0.0000 61.8881 32.9173 177.3979 565 A 3.8340 8.4006 124.9560 55.4056 18.3112 179.7605 566 S 4.0168 8.0819 112.0600 61.9269 62.6423 176.9550 567 V 3.5187 7.5814 121.2552 65.5633 31.4351 177.7982 568 L 3.9447 7.9249 118.7738 57.8940 41.3798 179.8060 569 R 3.9792 8.2588 117.9630 58.9222 29.6792 178.9037 570 A 3.9960 8.0299 120.8195 55.0206 18.3071 179.9029 571 V 3.5373 8.0549 116.6792 66.0279 31.7088 178.0072 572 A 4.2827 8.0059 120.5135 55.4588 18.0574 179.7332 573 K 4.0023 7.9320 115.5857 59.3366 32.1663 179.3155 574 R 4.1334 7.6657 118.6451 59.4171 30.1699 178.3819 575 E 4.0089 8.5745 118.7450 59.3733 29.4408 178.9787 576 Y 4.1821 7.9908 116.2908 60.8637 37.9980 176.9210 577 P 4.2755 0.0000 0.0000 65.2093 31.4479 178.5559 578 K 3.8919 7.9250 118.5731 59.4622 32.1588 178.2947 579 F 4.3364 8.4572 121.0540 61.6669 39.2996 177.1175 580 L 3.0076 7.5702 118.2011 57.1212 41.3763 179.4579 581 K 3.8687 8.0896 119.6985 59.4950 32.1823 178.8675 582 R 3.8915 7.9673 118.9174 59.3606 30.0627 178.2382 583 F 4.0806 8.5876 121.1174 61.5126 39.4376 177.2473 584 T 3.4778 7.8067 109.4047 64.6805 68.4114 176.7026 585 S 4.1485 7.8884 117.9040 61.3868 62.7683 175.8872 586 Y 3.9621 7.9603 122.2387 60.6813 38.6094 178.3550 587 V 2.5782 7.1031 118.9595 65.6693 31.5835 177.9211 588 Q 3.7874 7.5535 117.5201 59.0137 28.3346 178.7808 589 E 3.8314 7.7523 118.2333 59.2490 29.5828 179.1021 590 K 3.8651 7.5564 118.4433 58.3384 32.4385 177.9519 591 T 4.2750 7.3422 108.1404 60.9621 69.6113 174.5340 592 A 4.0310 6.9738 124.8852 53.8271 18.6124 177.8883 593 G 3.9414 8.9201 111.2437 45.1594 0.0000 173.5707 594 K 4.4201 7.5124 118.6060 54.0922 33.5039 174.9069 595 P 4.2715 0.0000 0.0000 62.9380 31.7880 176.2952 596 I 3.6286 8.0565 122.9201 60.7096 37.4099 175.9318 597 L 4.2221 8.1684 128.6703 53.5445 40.8421 176.3768 598 F 4.3937 8.4718 123.1349 57.5961 38.9190 175.8069 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 365 H 8.29 4.85 0.00 3.49 3.62 0.00 5.62 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 366 R 8.60 3.73 0.00 1.80 2.01 0.00 2.78 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.83 0.00 367 F 8.23 4.91 0.00 3.35 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 0.00 368 V 7.58 3.71 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 0.83 0.00 0.00 0.92 0.00 0.00 369 Q 8.05 4.00 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 370 K 8.14 3.96 0.00 2.07 2.34 0.00 1.50 0.00 0.00 1.80 0.00 0.00 3.10 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.91 1.60 7.81 371 V 8.57 3.76 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 1.18 0.00 0.00 1.36 0.00 0.00 372 E 8.42 3.92 0.00 2.29 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 0.00 2.31 2.37 0.00 373 E 8.19 3.92 0.00 2.08 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 2.22 2.32 0.00 374 M 7.93 3.91 0.00 1.77 1.70 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 1.03 2.31 0.00 375 V 8.05 3.66 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 1.01 0.00 0.00 1.03 0.00 0.00 376 Q 8.26 3.95 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 377 N 8.61 4.47 0.00 2.85 2.93 0.00 0.00 7.25 7.72 0.00 0.00 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 H 8.15 4.52 0.00 3.42 3.33 0.00 5.68 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 0.00 379 M 8.03 4.08 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.88 0.00 380 T 7.90 3.97 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 1.18 0.00 0.00 381 Y 8.15 4.51 0.00 3.12 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 0.00 382 S 8.40 4.41 0.00 4.10 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 0.00 383 L 7.64 4.42 0.00 1.58 1.66 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 384 Q 7.23 3.97 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 385 D 8.46 4.20 0.00 2.52 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 386 V 7.73 3.77 0.99 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 -0.39 0.00 0.00 -0.41 0.00 0.00 387 G 7.92 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 388 G 8.37 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 389 D 7.73 4.47 0.00 2.71 2.75 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 0.00 390 A 8.63 4.30 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.86 4.53 0.00 2.92 2.78 0.00 0.00 6.89 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 0.00 392 W 7.88 4.87 0.00 3.36 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 0.00 393 Q 9.14 4.75 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 394 L 8.83 4.04 0.00 1.50 1.53 0.29 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 395 V 8.72 4.18 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 0.75 0.00 0.00 1.02 0.00 0.00 396 V 7.45 4.49 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 0.77 0.00 0.00 0.94 0.00 0.00 397 E 8.65 5.05 0.00 1.85 1.69 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 2.13 2.38 0.00 398 E 9.03 4.51 0.00 1.97 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 2.17 2.23 0.00 399 G 8.28 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 400 E 8.79 4.31 0.00 2.23 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 0.00 2.36 2.35 0.00 401 M 7.84 4.53 0.00 2.05 1.35 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 402 K 9.01 4.93 0.00 1.76 1.32 0.00 1.74 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.23 1.31 7.81 403 V 8.89 4.77 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 1.10 0.00 0.00 0.95 0.00 0.00 404 Y 9.77 5.57 0.00 3.00 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 0.00 405 R 9.33 5.35 0.00 1.95 2.03 0.00 2.83 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 406 R 7.74 4.37 0.00 0.67 0.86 0.00 2.46 0.00 0.00 2.80 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.12 0.00 407 E 8.60 4.59 0.00 1.81 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 0.00 2.42 2.24 0.00 408 V 9.22 4.42 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 0.76 0.00 0.00 0.81 0.00 0.00 409 E 8.82 5.22 0.00 1.81 1.77 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 2.15 2.25 0.00 410 E 8.73 4.49 0.00 1.97 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 2.19 2.20 0.00 411 N 9.85 4.40 0.00 2.86 2.90 0.00 0.00 7.21 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 412 G 8.51 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 413 I 7.21 4.35 1.99 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 1.38 1.31 0.90 0.00 0.00 414 V 8.28 4.12 1.99 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 0.75 0.00 0.00 0.83 0.00 0.00 415 L 8.19 4.55 0.00 1.42 1.59 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 416 D 7.12 5.01 0.00 2.51 2.61 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 0.00 0.00 0.00 0.00 417 P 0.00 4.47 0.00 1.75 2.16 0.00 3.49 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.14 0.00 418 L 8.97 5.44 0.00 1.48 1.24 0.48 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 419 K 9.72 5.21 0.00 1.54 1.09 0.00 1.31 0.00 0.00 0.92 0.00 0.00 2.48 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.11 1.26 7.81 420 A 9.59 5.55 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 0.00 421 T 8.86 5.16 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 0.00 422 H 9.03 5.41 0.00 3.20 3.07 0.00 5.59 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 0.00 423 A 8.69 5.08 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 0.00 424 V 8.65 4.18 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 0.81 0.00 0.00 0.63 0.00 0.00 425 K 8.66 4.22 0.00 1.63 1.69 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.42 7.81 426 G 8.93 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 0.00 0.00 0.00 0.00 427 V 7.27 4.53 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 0.62 0.00 0.00 0.87 0.00 0.00 428 T 8.20 4.65 4.22 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 0.87 0.00 0.00 429 G 9.21 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 0.00 430 H 7.94 2.69 0.00 2.53 3.07 0.00 5.70 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 0.00 431 E 7.88 3.84 0.00 2.16 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 2.26 2.30 0.00 432 V 7.81 3.67 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 1.21 0.00 0.00 0.91 0.00 0.00 433 C 8.48 4.46 0.00 3.17 3.21 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 0.00 0.00 0.00 434 N 8.47 4.44 0.00 2.79 2.68 0.00 0.00 7.06 7.28 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 0.00 435 Y 8.07 4.29 0.00 3.14 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 436 F 8.75 4.29 0.00 3.01 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.98 0.84 0.00 0.00 490 P 0.00 4.59 0.00 1.87 1.93 0.00 3.58 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 1.95 2.00 0.00 491 A 8.40 4.19 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 0.00 492 L 8.43 4.14 0.00 1.63 1.72 0.89 0.76 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 0.00 493 T 7.50 4.73 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 0.00 494 E 8.63 4.25 0.00 1.97 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 0.00 2.29 2.31 0.00 495 N 7.81 4.63 0.00 2.65 2.85 0.00 0.00 6.78 8.68 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 0.00 496 D 7.58 5.04 0.00 2.80 2.54 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 0.00 0.00 0.00 0.00 497 P 0.00 4.66 0.00 2.10 2.07 0.00 3.75 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 1.99 2.00 0.00 498 E 8.70 4.37 0.00 1.94 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 499 T 8.51 4.87 4.20 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 1.29 0.00 0.00 500 W 9.23 5.07 0.00 3.33 3.19 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 0.00 501 I 9.00 5.20 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.98 0.96 0.00 0.00 502 V 8.96 5.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 1.32 0.00 0.00 503 C 9.29 5.37 0.00 3.19 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 0.00 504 N 9.68 5.78 0.00 2.60 2.49 0.00 0.00 6.06 8.11 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 0.00 505 F 8.81 5.39 0.00 3.12 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 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0.00 0.00 0.00 0.00 2.48 2.34 0.00 531 T 8.65 5.05 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 1.37 0.00 0.00 532 L 9.06 4.70 0.00 1.74 1.60 0.95 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 533 V 8.52 4.98 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 0.91 0.00 0.00 1.11 0.00 0.00 534 S 8.80 4.51 0.00 3.92 3.96 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 *542 I 7.64 3.87 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.83 1.05 0.00 0.00 543 S 8.12 4.95 0.00 3.99 3.96 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 0.00 544 R 8.37 4.00 0.00 1.82 1.96 0.00 3.19 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 545 D 7.82 4.43 0.00 2.62 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 571 V 8.05 3.54 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 1.07 0.00 0.00 1.01 0.00 0.00 572 A 8.01 4.28 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 0.00 573 K 7.93 4.00 0.00 2.06 1.93 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.48 7.81 574 R 7.67 4.13 0.00 1.90 2.10 0.00 3.10 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 575 E 8.57 4.01 0.00 1.88 1.81 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 2.44 2.42 0.00 576 Y 7.99 4.18 0.00 3.34 3.17 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 0.00 0.00 0.00 0.00 577 P 0.00 4.28 0.00 2.19 2.11 0.00 3.87 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.21 0.00 578 K 7.93 3.89 0.00 1.89 2.07 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.49 7.81 579 F 8.46 4.34 0.00 3.11 3.30 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 0.00 580 L 7.57 3.01 0.00 1.64 1.43 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 581 K 8.09 3.87 0.00 1.90 1.91 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.43 7.81 582 R 7.97 3.89 0.00 2.06 2.25 0.00 3.23 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.73 0.00 583 F 8.59 4.08 0.00 2.94 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 T 7.81 3.48 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 1.08 0.00 0.00 585 S 7.89 4.15 0.00 4.05 3.91 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 0.00 0.00 0.00 586 Y 7.96 3.96 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 587 V 7.10 2.58 1.71 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 0.66 0.00 0.00 0.08 0.00 0.00 588 Q 7.55 3.79 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 589 E 7.75 3.83 0.00 1.90 1.88 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 2.26 2.42 0.00 590 K 7.56 3.87 0.00 0.90 0.94 0.00 1.44 0.00 0.00 1.24 0.00 0.00 3.30 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.16 1.35 7.81 591 T 7.34 4.28 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 1.19 0.00 0.00 592 A 6.97 4.03 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 0.00 593 G 8.92 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 0.00 594 K 7.51 4.42 0.00 1.90 1.70 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.36 7.81 595 P 0.00 4.27 0.00 2.01 1.99 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 596 I 8.06 3.63 1.47 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.33 -0.28 0.00 0.00 597 L 8.17 4.22 0.00 1.46 1.41 0.84 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 598 F 8.47 4.39 0.00 3.16 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 * Residues marked with a * may have inaccurate shift predictions.