NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 305 S 4.4611 8.1933 116.7922 58.4703 64.3774 174.9026 306 L 4.0987 7.8695 120.1650 55.2900 42.3346 177.5487 307 A 4.0137 8.6731 123.2059 54.6246 19.4711 178.3185 308 L 4.3404 7.6008 114.2143 55.2663 41.5241 177.5047 309 S 4.6598 7.4510 114.6389 58.4360 64.8820 174.9151 310 L 4.1890 7.2130 120.2271 54.6576 41.9400 177.7085 311 T 4.1334 9.5439 114.2585 61.1515 70.9594 175.5436 312 A 3.9038 8.2900 122.3405 55.4483 18.2575 179.5932 313 D 4.3224 7.8561 116.8827 57.4391 40.9233 178.7924 314 Q 3.9877 8.1159 118.7129 58.9512 28.6524 178.3236 315 M 3.9362 7.9410 119.2221 58.7163 32.2041 178.3722 316 V 3.5331 7.6025 117.9766 66.0653 31.6473 177.7373 317 S 4.0603 8.1301 112.5341 61.3966 62.2463 175.9869 318 A 3.9685 8.3053 123.6589 55.2934 17.9251 179.6909 319 L 3.9996 7.8592 116.2952 57.8283 41.7738 179.3976 320 L 4.1907 8.3092 119.3839 57.9329 41.3335 179.2603 321 D 4.4018 8.2069 117.8240 57.2076 40.8820 178.1096 322 A 4.3380 7.6837 118.3073 52.0165 18.8860 177.5168 323 E 3.9335 7.4135 117.2015 56.4162 30.0469 175.7807 324 P 4.5855 0.0000 0.0000 61.3031 32.2446 174.1734 325 P 4.5941 0.0000 0.0000 62.1543 32.3192 175.6779 326 I 4.0176 8.0494 119.8273 60.6943 37.6943 176.1001 327 L 4.6782 8.1905 124.8169 53.5857 43.5727 175.2055 328 Y 4.3516 8.3345 117.7282 56.5291 39.4930 176.1322 329 S 4.7198 8.7835 118.5781 57.5982 64.5510 173.2343 330 E 4.5711 8.5219 116.7296 56.1760 29.9805 175.4553 331 Y 4.0612 7.8670 120.2979 59.1980 39.0701 174.6995 332 D 4.6400 7.7474 125.5151 51.5238 43.2121 173.1746 333 P 4.1510 0.0000 0.0000 65.2689 31.9685 177.5249 334 T 4.0357 6.9886 110.0976 60.6185 65.3054 175.4129 335 R 4.7105 7.1912 120.0026 54.9080 31.7768 170.5579 336 P 3.9480 0.0000 0.0000 61.2932 32.4139 176.2443 337 F 4.4829 8.5257 120.3791 58.0543 38.6114 175.2701 338 S 4.7274 8.8928 122.1308 56.4687 65.3373 175.0374 339 E 3.9119 8.6785 119.4445 59.2680 29.2306 178.4024 340 A 3.9735 7.9247 120.6019 55.1693 18.6309 179.5631 341 S 4.1352 8.2921 113.0606 61.8670 62.9471 176.4462 342 M 4.0662 8.0808 121.5279 58.4390 32.0305 177.6820 343 M 4.0837 8.1235 118.5863 58.5760 32.2250 178.4261 344 G 3.6085 8.4834 106.0704 47.7790 0.0000 175.5511 345 L 4.0515 8.3719 122.3832 57.4763 41.7377 179.7091 346 L 3.9551 8.1609 119.3281 58.0694 41.5175 179.7929 347 T 4.0513 8.0221 109.7736 64.4981 68.9087 176.2245 348 N 4.2606 8.4278 120.1518 56.5006 39.0094 176.5451 349 L 3.9806 8.0595 121.3466 58.0610 42.1615 178.6747 350 A 4.1057 8.2025 120.6563 55.3388 18.1460 178.9102 351 D 4.3237 7.9945 116.1690 58.0993 40.8205 179.5497 352 R 4.1271 7.9877 117.8228 59.2934 29.9670 179.0632 353 E 3.8674 8.4690 118.4419 58.9863 29.3424 179.1227 354 L 4.0042 8.1293 119.5408 58.0116 41.5899 179.7150 355 V 3.6029 7.3700 117.5906 66.4148 31.4031 177.8383 356 H 4.2315 8.2418 115.5203 58.7388 28.5098 177.3374 357 M 4.1226 8.4149 120.5533 58.7599 31.8748 178.1691 358 I 3.7920 8.0110 120.0480 64.7937 37.0906 178.2310 359 N 4.4316 7.8545 116.1184 55.7932 38.5627 177.0401 360 W 4.2770 8.6078 129.8307 60.2794 30.7201 177.5829 361 A 2.6812 8.4220 121.0705 55.0160 17.5043 179.7015 362 K 3.6271 7.3487 114.6719 59.0743 32.2015 178.5055 363 R 4.4679 7.4278 116.0625 54.6288 30.8794 176.2550 364 V 3.4321 7.4999 121.8510 61.2509 31.6860 173.5093 365 P 4.3174 0.0000 0.0000 64.6045 31.4070 176.3978 366 G 4.1527 9.0030 111.4605 46.3132 0.0000 175.2638 367 F 4.1795 8.3925 122.1862 61.2797 39.4400 177.3657 368 V 3.7749 7.7258 111.5757 63.2610 31.7274 176.8463 369 D 4.4007 7.7263 118.5350 55.9995 40.8841 176.4509 370 L 4.3817 7.0482 119.2704 53.6514 42.8948 177.3058 371 T 4.0686 7.7573 111.1848 61.3354 70.7107 175.2202 372 L 3.8635 8.5115 123.7177 58.9785 41.9133 178.9485 373 H 4.0779 8.1528 117.4247 59.3016 29.8559 176.9096 374 D 4.4259 7.7833 119.9680 57.2521 40.8151 178.5498 375 Q 3.6001 7.9447 118.5852 58.8801 28.6812 179.1290 376 V 3.6486 7.9598 119.1871 66.4803 31.3419 177.4264 377 H 4.1956 7.9961 116.3306 59.3830 29.7361 176.8820 378 L 4.1932 8.0044 119.7888 57.8223 41.8226 179.1794 379 L 4.4091 8.1405 118.6301 57.6500 41.3130 179.5014 380 E 4.0200 8.1275 113.7750 57.6330 29.7474 177.8733 *382 A 4.3712 7.9836 123.2759 51.4286 20.9729 179.4433 383 W 4.4373 8.3586 114.4549 59.9945 27.8955 178.3070 384 L 3.5808 6.4676 120.6494 56.9878 41.3299 178.3546 385 E 3.8838 7.8987 118.3398 59.4004 29.4472 179.2190 386 I 3.6310 7.7891 119.4927 64.4011 37.1756 178.3322 387 L 4.0095 7.9685 119.7209 58.2934 41.3974 179.7102 388 M 3.9680 8.4211 118.8373 58.3880 31.8555 178.7240 389 I 3.8639 8.2838 119.3518 63.6924 38.1307 178.0683 390 G 3.8147 8.2905 106.8976 47.8739 0.0000 175.2812 391 L 3.7517 7.9716 123.5362 57.5566 41.8046 179.2459 392 V 3.3118 7.6749 117.2009 65.5281 31.7290 177.3981 393 W 4.4810 8.2974 128.1154 60.8557 30.2935 177.9947 394 R 3.5587 7.6872 116.5662 59.0637 29.7996 178.3187 395 S 4.3284 7.5007 112.4724 59.1144 62.8287 175.9162 396 M 3.9775 7.4787 122.6647 57.9941 31.7936 176.8747 397 E 4.1956 7.5846 113.1996 56.7513 30.7156 176.4781 398 H 4.7451 7.6255 117.7132 52.6070 28.5755 170.2690 399 P 4.2539 0.0000 0.0000 64.3968 31.8380 177.1275 400 G 3.9710 9.2339 110.6929 45.2511 0.0000 172.7678 401 K 4.8081 7.8358 117.3561 54.4049 36.5515 175.6365 402 L 4.2025 9.0072 123.1390 53.0107 43.7563 176.0386 403 L 4.4062 8.0560 128.3608 53.3299 39.7576 175.8497 404 F 3.9007 8.4691 121.4287 59.5488 39.5664 175.2419 405 A 4.5509 7.7880 121.1741 49.8187 22.2510 174.9363 406 P 4.0404 0.0000 0.0000 65.0192 31.3006 177.4845 407 N 4.9576 7.9196 112.6179 52.3360 37.6881 175.0489 408 L 4.4804 7.9505 122.2335 53.3923 42.6343 172.6525 409 L 4.7802 7.9941 121.8476 53.1402 43.3051 174.8693 410 L 4.8893 9.0732 127.4776 53.0981 44.8261 175.8397 411 D 5.1472 8.2511 121.3256 51.3411 42.1367 176.7900 412 R 4.2504 8.6827 114.1107 59.5574 29.2593 178.3237 413 N 4.4300 8.5529 117.9392 55.6771 38.6443 176.2571 414 Q 4.4904 8.0269 117.1213 56.7004 29.2587 177.8616 415 G 2.7019 7.7132 107.6165 47.4859 0.0000 175.8872 416 K 3.9744 7.3248 118.3650 59.2511 32.0308 178.6154 417 C 4.1767 7.4790 116.0498 60.6972 28.4240 174.0704 418 V 4.3234 7.1153 120.5708 60.0396 33.2978 174.4916 419 E 4.1344 8.7758 125.3871 57.9263 28.5404 177.6926 420 G 4.1579 8.9059 110.1937 45.2307 0.0000 174.9086 421 M 3.9665 7.8683 119.5619 58.0537 32.0154 178.3525 422 V 3.4119 7.4810 119.1841 64.8493 31.4075 178.0359 423 E 3.9691 8.1335 118.7132 59.0183 29.2087 179.4171 424 I 3.7568 7.1442 117.2307 64.3737 37.2803 178.1909 425 F 4.2956 8.4987 118.7895 60.9312 38.6750 177.3898 426 D 4.4320 8.4305 118.3271 57.7320 40.6509 178.9081 427 M 4.1270 7.9100 118.7745 58.4146 31.9702 178.7286 428 L 3.8935 8.0552 119.1010 57.8779 41.8010 179.6845 429 L 3.8594 8.4426 118.9216 57.6549 41.5666 179.4277 430 A 3.9878 8.3109 121.0878 55.5040 18.2477 179.8922 431 T 3.7780 7.9970 114.2892 66.5704 68.4837 176.9216 432 S 3.7800 7.9820 115.2014 61.4877 62.2832 176.5085 433 S 4.1366 8.0727 117.8291 61.2952 62.4272 176.6336 434 R 3.9327 7.8627 121.3651 59.5222 29.9447 178.2272 435 F 4.3147 8.5250 117.7696 60.8964 38.9864 177.7993 436 R 3.9002 8.2303 117.7280 59.7480 29.7265 178.0355 437 M 4.0223 8.4446 117.4912 59.0526 32.2135 178.4100 438 M 4.1974 8.2263 115.1820 55.0401 33.2178 175.5080 439 N 4.1053 8.1486 117.2462 53.6208 37.9180 174.3363 440 L 4.0386 7.9327 118.5643 56.1525 43.0758 176.7232 441 Q 4.8556 9.0455 124.8265 54.3635 31.8776 177.0657 442 G 3.4319 8.7288 108.9710 48.2123 0.0000 175.9059 443 E 3.9899 8.0838 120.2667 59.1016 29.4995 179.1981 444 E 3.8830 7.9630 118.1901 59.2136 29.6628 178.7698 445 F 3.8657 8.0030 120.8914 61.4857 39.3799 177.6957 446 V 3.1152 7.5218 111.6787 64.1511 31.2211 178.4320 447 C 4.0866 7.6374 116.7893 62.7064 27.9235 176.0797 448 L 3.9297 7.8475 120.6188 57.5919 41.3019 179.4321 449 K 3.8275 7.7225 119.5404 59.6570 32.0368 179.0857 450 S 4.2234 8.0698 115.2307 61.4650 62.6776 176.7090 451 I 3.6940 7.9081 122.6518 64.3653 36.8375 178.3239 452 I 3.6973 7.9028 120.7041 64.3365 36.7295 178.1496 453 L 4.0106 7.6218 119.1859 58.3706 42.1019 178.7298 454 L 4.2718 7.7450 116.9374 56.8431 41.9795 178.5290 455 N 4.4959 8.7487 117.6866 56.4588 38.8892 176.7440 456 S 4.5891 7.8554 112.3800 59.5173 62.6555 175.6898 457 G 4.2310 7.6559 108.6128 46.5613 0.0000 174.2297 458 V 3.7141 7.4173 121.4349 61.0319 31.0081 177.8257 459 Y 4.6622 11.3700 117.3285 57.6268 40.9843 175.8269 *470 E 4.4076 8.3150 127.8490 55.4658 30.5445 177.3676 471 E 4.0425 9.4022 116.4136 59.1691 29.3372 178.1212 472 K 4.3847 7.9007 115.2555 56.5825 33.0291 177.6647 473 D 4.4215 7.8078 119.3665 56.9396 41.3529 177.2472 474 H 4.0778 9.3113 119.5781 59.5872 29.7360 177.2716 475 I 3.5688 7.3952 120.1614 64.6562 36.8647 178.1646 476 H 4.2578 7.8087 116.4697 58.4862 28.5264 178.0597 477 R 3.9016 8.3807 120.5635 59.1926 29.8956 179.2243 478 V 3.5330 7.8913 118.1788 65.8897 31.5328 177.9488 479 L 3.9576 8.0912 118.9593 58.0164 41.3851 179.2786 480 D 4.3703 8.1430 118.6851 57.3621 40.8246 178.9317 481 K 3.9008 8.1164 118.9193 59.5970 31.9868 179.4124 482 I 3.8158 7.6852 120.0303 64.2089 37.0387 178.5094 483 T 3.8306 7.9357 116.7079 66.7827 68.2565 175.9610 484 D 4.4271 8.2172 120.9078 58.0955 40.8610 179.4448 485 T 3.8597 7.7311 115.5502 66.6423 68.4276 176.7387 486 L 3.9832 8.0883 120.8963 57.7808 41.6391 179.6470 487 I 3.7033 7.9160 119.8169 64.4976 36.9608 177.7890 488 H 4.0728 8.5375 119.4356 59.4410 29.6907 177.1597 489 L 3.9344 8.1120 120.6396 58.1804 41.4537 179.5390 490 M 4.0605 8.0786 118.3460 58.0948 31.9582 178.5714 491 A 3.9614 8.4616 121.4334 55.0379 18.2962 179.5842 492 K 3.8288 8.0233 117.1635 59.4507 32.4065 178.3853 493 A 4.2307 7.6047 118.4548 52.8537 18.2312 178.0214 494 G 3.8374 7.7149 105.5090 45.4037 0.0000 173.8167 495 L 4.3452 7.5409 119.4173 53.7816 42.4340 177.9512 496 T 3.9951 8.5760 113.6808 61.5031 70.5465 174.8622 497 L 3.7597 8.4962 124.0755 58.7341 41.9679 178.9128 498 Q 3.9510 8.1422 118.4816 59.7864 28.8164 178.8710 499 Q 4.0611 8.0572 118.4740 58.7384 28.6588 178.7446 500 Q 3.9520 8.3058 119.8192 59.2959 28.7765 178.5156 501 H 4.3200 8.0409 117.1930 58.8730 28.6521 177.9348 502 Q 4.0017 8.0922 119.8889 59.0709 28.5857 178.8913 503 R 4.1351 8.1319 121.1346 58.6578 30.0746 178.2152 504 L 3.9145 8.1074 120.0139 58.1942 42.0888 178.9003 505 A 4.0182 8.1170 120.6389 55.1991 17.7902 179.5869 506 Q 3.9653 8.3704 116.7979 59.0453 28.6563 179.1015 507 L 4.0235 8.0597 119.9175 57.9784 41.5220 179.7035 508 L 4.0715 8.1154 118.6094 57.4380 41.4108 179.4099 509 L 4.1036 8.2212 119.0184 57.3238 41.5139 179.3426 510 I 3.8506 7.5353 120.4611 64.2966 37.0140 178.2357 511 L 4.1091 7.7076 119.6674 57.5756 41.3391 179.6040 512 S 4.1193 7.8573 113.3599 61.5636 62.3616 175.5289 513 H 4.2137 8.2562 120.5108 59.4055 29.5446 177.1422 514 I 3.6975 8.0179 121.6898 64.1455 36.8573 178.2896 515 R 3.9356 8.1761 119.7131 59.6642 29.8217 177.9914 516 H 4.1029 8.1593 117.9055 59.5966 29.8849 177.1653 517 M 3.9240 8.0520 120.3917 58.2815 31.6957 178.4392 518 S 3.9078 8.1303 113.4762 61.5574 62.5328 176.0398 519 N 4.2661 8.1731 118.8179 56.2960 38.3418 177.3901 520 K 3.9611 8.2351 120.2457 59.6217 32.0785 179.6574 521 G 3.6092 8.5397 106.1621 48.0145 0.0000 175.7307 522 M 3.9492 8.3397 121.6179 58.0266 31.9086 178.5611 523 E 4.1404 8.2507 117.7135 59.1345 29.8675 178.7139 524 H 4.0759 8.3570 119.4051 59.0693 29.9016 176.6419 525 L 3.9970 8.6296 122.9380 58.6958 41.7790 178.4303 526 Y 3.9972 8.2523 119.1222 60.6198 38.7078 177.8022 527 S 4.1073 8.3445 114.1868 61.8304 62.5235 176.1648 528 M 4.0486 8.3349 121.5619 58.0830 31.6829 178.6518 529 K 3.9494 7.7681 119.8497 59.4020 32.1420 178.6425 530 C 4.1554 7.5161 115.7641 61.8155 28.1502 175.1446 531 K 4.2083 7.8315 117.9374 55.5953 32.0965 176.2099 532 N 4.1914 7.7552 115.2044 54.0050 36.7738 175.9970 533 V 3.7546 7.7360 119.7795 65.7105 31.9361 176.4330 534 V 4.4426 7.1065 115.7671 59.6178 33.6499 171.4091 535 P 4.3628 0.0000 0.0000 62.6057 31.8282 175.8023 536 L 4.7212 8.0882 122.0885 52.5244 44.1825 176.8421 537 S 4.2172 8.4636 115.4145 58.9599 64.2980 175.3682 538 D 4.3077 8.5299 125.1490 57.1063 40.6140 178.7361 539 L 3.8561 7.7967 120.5089 58.1522 42.1666 178.7389 540 L 3.6671 7.6973 119.6844 57.9706 42.1168 178.6348 541 L 4.0498 8.1708 119.2639 57.7307 41.4808 179.4738 542 E 3.9811 8.0598 118.1725 59.7353 29.2554 179.1555 543 M 4.1123 7.6425 117.4014 58.3842 32.0798 178.3243 544 L 4.3535 8.1246 120.4598 58.2633 42.1415 178.3020 545 D 4.6473 8.4529 117.2241 55.9110 40.6810 178.0639 546 A 4.3252 7.7701 120.7403 54.4094 18.6053 177.6461 547 H 4.7221 7.8511 113.0777 56.1036 29.0938 176.1244 548 R 4.6669 7.4246 117.4092 53.5756 31.0975 174.9279 549 L 4.2597 7.9236 123.9831 56.0807 42.4929 172.7143 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 305 S 8.19 4.46 0.00 3.90 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 0.00 306 L 7.87 4.10 0.00 1.75 1.69 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 307 A 8.67 4.01 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 0.00 308 L 7.60 4.34 0.00 1.74 1.70 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 309 S 7.45 4.66 0.00 3.88 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 0.00 310 L 7.21 4.19 0.00 1.74 1.58 0.89 0.82 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 0.00 311 T 9.54 4.13 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 1.24 0.00 0.00 312 A 8.29 3.90 0.97 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 0.00 0.00 313 D 7.86 4.32 0.00 2.68 2.72 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 0.00 0.00 0.00 0.00 314 Q 8.12 3.99 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 315 M 7.94 3.94 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.56 0.00 316 V 7.60 3.53 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 0.95 0.00 0.00 317 S 8.13 4.06 0.00 4.20 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 0.00 318 A 8.31 3.97 1.36 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 0.00 0.00 0.00 319 L 7.86 4.00 0.00 1.62 1.76 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 320 L 8.31 4.19 0.00 1.89 1.75 0.94 1.13 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 0.00 321 D 8.21 4.40 0.00 2.91 2.76 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 0.00 322 A 7.68 4.34 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 0.00 323 E 7.41 3.93 0.00 2.17 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 2.62 2.57 0.00 324 P 0.00 4.59 0.00 2.00 2.01 0.00 3.59 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.93 0.00 325 P 0.00 4.59 0.00 2.19 2.09 0.00 3.68 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 1.83 1.96 0.00 326 I 8.05 4.02 1.81 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 1.39 0.55 0.76 0.00 0.00 327 L 8.19 4.68 0.00 1.64 1.65 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 328 Y 8.33 4.35 0.00 3.00 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 0.00 329 S 8.78 4.72 0.00 4.09 3.95 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 0.00 330 E 8.52 4.57 0.00 2.13 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 0.00 2.28 2.32 0.00 331 Y 7.87 4.06 0.00 3.10 3.05 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 340 A 7.92 3.97 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 0.00 341 S 8.29 4.14 0.00 4.13 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 0.00 342 M 8.08 4.07 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 343 M 8.12 4.08 0.00 2.19 2.24 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 344 G 8.48 3.61 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 0.00 0.00 0.00 345 L 8.37 4.05 0.00 1.85 1.80 1.36 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 346 L 8.16 3.96 0.00 1.64 1.70 0.76 -0.07 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 0.00 347 T 8.02 4.05 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 348 N 8.43 4.26 0.00 2.88 3.16 0.00 0.00 6.79 7.03 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 0.00 349 L 8.06 3.98 0.00 1.98 1.92 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 350 A 8.20 4.11 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 351 D 7.99 4.32 0.00 2.97 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 0.00 352 R 7.99 4.13 0.00 1.94 2.04 0.00 3.18 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 353 E 8.47 3.87 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 354 L 8.13 4.00 0.00 1.89 1.67 0.51 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 355 V 7.37 3.60 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 1.02 0.00 0.00 0.99 0.00 0.00 356 H 8.24 4.23 0.00 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0.00 0.00 0.00 0.00 0.00 1.12 1.78 0.00 407 N 7.92 4.96 0.00 2.97 3.11 0.00 0.00 5.70 7.79 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 0.00 408 L 7.95 4.48 0.00 1.72 1.53 0.86 0.63 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 0.00 409 L 7.99 4.78 0.00 1.55 1.50 0.79 0.94 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 0.00 410 L 9.07 4.89 0.00 1.58 1.57 0.56 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 411 D 8.25 5.15 0.00 2.80 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 0.00 412 R 8.68 4.25 0.00 2.14 2.32 0.00 2.99 0.00 0.00 3.35 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 413 N 8.55 4.43 0.00 3.00 2.93 0.00 0.00 6.55 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 414 Q 8.03 4.49 0.00 1.93 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.52 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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 0.97 0.00 0.00 432 S 7.98 3.78 0.00 3.79 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 0.00 433 S 8.07 4.14 0.00 4.03 3.88 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 0.00 434 R 7.86 3.93 0.00 2.07 2.19 0.00 3.23 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.88 0.00 435 F 8.53 4.31 0.00 3.25 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 0.00 436 R 8.23 3.90 0.00 2.09 2.07 0.00 3.07 0.00 0.00 3.46 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 437 M 8.44 4.02 0.00 2.01 2.30 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.62 0.00 438 M 8.23 4.20 0.00 1.99 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.56 0.00 439 N 8.15 4.11 0.00 2.81 2.83 0.00 0.00 7.05 7.38 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 1.72 0.00 0.00 0.00 0.00 0.00 0.00 508 L 8.12 4.07 0.00 1.71 1.73 0.93 0.53 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 0.00 509 L 8.22 4.10 0.00 1.89 1.74 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 510 I 7.54 3.85 2.18 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 1.76 1.39 1.20 0.00 0.00 511 L 7.71 4.11 0.00 1.87 1.76 0.94 0.76 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 0.00 512 S 7.86 4.12 0.00 3.88 4.06 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 0.00 513 H 8.26 4.21 0.00 3.29 3.44 0.00 5.92 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 0.00 514 I 8.02 3.70 1.91 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.52 0.91 0.00 0.00 515 R 8.18 3.94 0.00 2.04 2.13 0.00 3.17 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 516 H 8.16 4.10 0.00 3.28 3.43 0.00 5.84 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 0.00 517 M 8.05 3.92 0.00 2.03 2.12 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 2.56 2.43 0.00 518 S 8.13 3.91 0.00 3.79 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 0.00 519 N 8.17 4.27 0.00 2.84 2.82 0.00 0.00 7.09 6.46 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 0.00 520 K 8.24 3.96 0.00 1.81 1.82 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.47 7.81 521 G 8.54 3.61 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 0.00 0.00 0.00 522 M 8.34 3.95 0.00 1.97 2.20 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 523 E 8.25 4.14 0.00 2.26 2.20 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 2.60 2.49 0.00 524 H 8.36 4.08 0.00 3.36 3.50 0.00 5.61 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 L 8.63 4.00 0.00 1.98 1.96 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 526 Y 8.25 4.00 0.00 3.21 3.10 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 0.00 527 S 8.34 4.11 0.00 3.98 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 0.00 528 M 8.33 4.05 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 529 K 7.77 3.95 0.00 1.65 1.67 0.00 1.40 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.55 7.81 530 C 7.52 4.16 0.00 3.01 2.91 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 0.00 531 K 7.83 4.21 0.00 1.70 1.82 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.23 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.44 7.81 532 N 7.76 4.19 0.00 2.84 2.86 0.00 0.00 6.87 7.46 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 0.00 533 V 7.74 3.75 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 0.83 0.00 0.00 0.98 0.00 0.00 534 V 7.11 4.44 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 0.70 0.00 0.00 0.94 0.00 0.00 535 P 0.00 4.36 0.00 2.06 2.02 0.00 3.64 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 2.02 2.10 0.00 536 L 8.09 4.72 0.00 1.60 1.56 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 537 S 8.46 4.22 0.00 4.18 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 538 D 8.53 4.31 0.00 2.71 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 539 L 7.80 3.86 0.00 1.68 1.56 0.84 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 540 L 7.70 3.67 0.00 1.70 1.59 0.50 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 541 L 8.17 4.05 0.00 1.99 1.71 0.92 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 542 E 8.06 3.98 0.00 2.15 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 0.00 2.27 2.59 0.00 543 M 7.64 4.11 0.00 1.49 1.60 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.58 0.00 544 L 8.12 4.35 0.00 2.13 1.97 1.16 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 545 D 8.45 4.65 0.00 2.84 2.76 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 0.00 546 A 7.77 4.33 1.56 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 0.00 0.00 547 H 7.85 4.72 0.00 3.33 3.38 0.00 5.64 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 R 7.42 4.67 0.00 1.79 1.79 0.00 2.84 0.00 0.00 2.47 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.44 0.00 549 L 7.92 4.26 0.00 1.68 1.60 0.94 0.95 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 * Residues marked with a * may have inaccurate shift predictions.