NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 306 L 4.2805 8.0385 120.9911 55.2508 42.9665 178.4348 307 A 3.8658 7.8667 123.1446 54.6240 18.4968 177.5851 308 L 4.2670 7.7804 114.0119 56.2666 42.9059 175.8927 309 S 4.6620 7.5247 111.6869 57.6969 63.4817 174.4589 310 L 4.2362 7.2235 120.5017 54.8224 42.1747 177.4339 311 T 4.2518 8.1427 111.4895 60.7904 71.2287 175.3819 312 A 3.8969 8.4525 124.1878 55.8097 18.1824 179.5201 313 D 4.3594 8.0234 116.5789 57.6896 41.1175 178.8127 314 Q 4.2778 7.9489 115.5511 57.2003 28.9082 177.5302 315 M 3.9279 8.0706 121.6770 58.8705 32.3382 177.9031 316 V 3.5686 7.9428 118.6662 66.1124 31.3463 177.8322 317 S 4.0543 8.3058 112.6283 61.5126 62.0499 176.0909 318 A 4.0308 7.7203 121.7945 54.7521 18.3328 179.4794 319 L 4.1292 7.7121 117.7908 58.0256 41.7243 179.4468 320 L 4.0620 7.9678 117.3986 57.3138 41.6879 177.7056 321 D 4.6405 7.6092 115.3130 54.4116 41.7007 176.5880 322 A 4.4487 7.8517 120.2358 53.2578 19.5174 177.2863 323 E 3.9360 8.3227 114.2074 56.1702 29.9480 175.6608 324 P 4.5551 0.0000 0.0000 61.3272 32.2101 174.6143 325 P 4.3852 0.0000 0.0000 62.6928 31.8816 176.1905 326 I 4.0034 8.1176 121.2308 60.7019 37.0922 176.2103 327 L 4.4948 8.2941 125.6180 54.3378 42.6969 175.6483 328 Y 4.4924 8.3159 117.2032 56.4883 40.3052 175.3757 329 S 4.8037 8.3900 115.5824 57.1942 64.0183 173.0876 330 E 4.6040 8.4260 124.7817 56.3065 29.9431 175.6586 331 Y 4.1073 7.6948 117.6408 57.1200 39.6359 173.7716 332 D 4.6226 7.7712 126.5265 51.5954 41.1117 174.5917 333 P 4.2401 0.0000 0.0000 63.3241 31.0124 177.0451 334 T 4.2535 7.8070 110.5043 62.0140 69.8995 174.8915 335 R 4.4905 7.5080 118.4872 52.9492 30.9244 173.7555 336 P 4.6774 0.0000 0.0000 62.4701 31.8080 175.7481 337 F 4.3687 8.8949 117.3635 57.4097 39.7086 175.5455 338 S 4.8470 8.1566 117.1219 55.4594 67.5576 174.7212 339 E 3.9294 8.8131 120.2137 60.0391 29.0088 179.2838 340 A 4.0518 7.9075 121.2187 54.4869 18.5474 179.6302 341 S 4.0655 8.0194 113.8067 61.7523 63.0272 176.5037 342 M 3.9072 8.0485 121.0249 58.7687 31.9558 178.2715 343 M 4.1912 8.1302 119.0712 58.1855 32.1454 178.8941 344 G 3.6044 8.0421 105.9634 47.7339 0.0000 175.5239 345 L 4.0260 7.8044 122.5755 57.7474 42.0583 179.1141 346 L 3.9541 7.6784 118.9355 57.8122 41.7786 179.2937 347 T 4.1521 8.1640 109.4624 63.9540 68.8088 176.6099 348 N 4.2594 8.1736 120.4315 56.6931 39.0984 176.4868 349 L 3.9878 7.8190 121.0223 58.2069 42.1185 178.8495 350 A 4.1493 8.1928 120.7844 55.1898 18.5050 179.2753 351 D 4.3147 8.0796 117.0286 57.3781 40.5442 179.3938 352 R 4.0833 7.8311 118.6319 59.3438 30.3660 178.6406 353 E 4.0464 8.2835 118.2708 59.3347 29.3645 179.3994 354 L 3.9854 8.1183 120.5925 58.2545 42.2664 179.5223 355 V 3.7112 7.4347 117.6215 64.9188 31.0751 178.1445 356 H 4.2260 8.0315 116.9234 58.8948 28.6433 176.9308 357 M 4.0937 8.5793 120.4853 59.1980 31.8342 178.2735 358 I 3.8398 7.9068 119.4972 64.6689 37.0341 178.2309 359 N 4.4249 7.7099 115.7658 55.7846 38.5779 177.0559 360 W 4.2566 8.5834 129.9383 60.4582 30.9009 177.8093 361 A 2.6077 8.5859 121.0587 54.7211 17.4212 179.7210 362 K 4.0407 7.4166 115.7924 58.5116 32.1426 178.3270 363 R 4.4015 7.3436 116.6895 54.6859 31.0844 175.8232 364 V 3.4263 6.4591 118.8033 62.3425 31.9758 173.5565 365 P 4.4227 0.0000 0.0000 64.1447 31.7660 176.2096 366 G 4.0908 8.9694 110.8419 46.4810 0.0000 175.4303 367 F 3.9175 8.1221 121.4654 61.5526 39.3455 177.2052 368 V 4.5212 7.6791 109.1756 62.0676 31.7868 176.9792 369 D 4.4428 7.8725 121.3072 56.6667 40.9954 176.7281 370 L 4.2669 7.5004 118.7172 53.9219 42.5088 177.4523 371 T 3.9043 7.7113 118.6988 64.0234 70.4422 175.4065 372 L 3.9554 8.3799 124.5484 58.5494 42.0849 178.8625 373 H 4.1656 8.1906 117.8251 59.2965 29.7745 176.8685 374 D 4.2346 7.7392 120.2600 57.1838 40.8152 178.3825 375 Q 3.6636 8.2701 119.0234 58.8130 28.6977 179.1906 376 V 3.6587 7.9786 119.0986 66.4588 31.4307 177.4404 377 H 4.2529 7.8413 116.4514 59.3587 29.7072 176.8680 378 L 4.2411 8.0855 119.8133 57.9398 41.8384 179.2014 379 L 4.4417 8.2423 118.9704 57.6871 41.2902 179.5496 380 E 4.0409 8.5009 113.7991 57.6603 29.4108 177.7345 *382 A 4.3874 7.9926 124.5193 51.7017 20.9957 179.4885 383 W 4.4747 8.3877 114.3053 60.1659 27.7702 178.3535 384 L 3.3180 6.2117 120.5040 56.9370 41.4140 177.9052 385 E 3.7847 7.7886 118.8695 59.5655 29.4806 178.8382 386 I 3.6198 8.0697 119.8947 64.1491 37.1455 178.0120 387 L 3.9735 7.8743 121.1138 58.6537 41.8525 179.0911 388 M 4.0152 8.3415 118.8593 58.3548 31.8961 178.6467 389 I 3.8714 8.0659 119.0618 63.8164 38.2212 177.9427 390 G 3.9162 8.2622 106.7852 47.9856 0.0000 175.2151 391 L 3.8051 7.9772 123.0821 57.7322 41.8273 179.2968 392 V 3.3842 7.7019 117.0494 65.5228 31.8254 177.1954 393 W 4.8110 8.8468 128.7643 60.7737 30.2650 177.4470 394 R 3.6709 7.5044 112.1167 56.8211 29.6801 177.2979 395 S 4.3767 7.2337 115.8844 58.7759 62.9733 175.1774 396 M 3.9898 7.1222 123.2645 57.1042 32.1139 177.0526 397 E 4.6168 7.7575 116.5085 56.7057 31.1088 176.1897 398 H 4.7831 7.7808 113.4443 52.5196 28.8994 171.3464 399 P 4.2112 0.0000 0.0000 64.3858 31.9791 177.2776 400 G 3.9513 9.1997 109.8901 45.5205 0.0000 172.8154 401 K 4.7322 7.7199 116.9570 54.4461 36.4206 175.6718 402 L 4.2432 8.3024 120.2958 52.9071 42.8964 176.4448 403 L 4.7253 7.8646 127.7421 53.5867 40.3710 176.0907 404 F 4.1045 8.2169 121.5907 59.6067 39.6475 175.6352 405 A 4.5576 7.9718 120.6964 49.9434 22.1943 174.9245 406 P 3.7782 0.0000 0.0000 65.2995 31.3298 177.2169 407 N 4.9456 7.6110 112.2493 52.4453 37.8263 175.4619 408 L 4.6335 8.5384 122.7594 53.6642 42.7189 172.9041 409 L 4.9619 7.9644 119.7999 53.7847 42.4088 176.5477 410 L 4.7930 8.6422 125.2180 52.8865 43.5825 176.5971 411 D 4.8124 8.6497 123.3889 53.4793 42.2181 176.5010 412 R 4.1588 8.4771 122.7849 59.9685 29.7332 178.6505 413 N 4.3087 8.2978 115.6766 56.1627 38.4882 176.6499 414 Q 3.9786 7.8251 119.0437 57.8171 29.1300 177.8592 415 G 2.9205 7.3001 105.5727 46.6391 0.0000 173.9588 416 K 4.0770 7.6250 122.8431 55.4243 31.5969 177.6336 *418 V 3.7618 7.3323 118.2604 62.2305 32.8112 173.7729 419 E 4.1557 8.6963 128.5074 57.5765 29.8339 176.8092 420 G 4.0430 9.0077 114.9005 45.9283 0.0000 174.1816 421 M 4.0954 7.8655 118.9799 57.7235 32.1919 178.0982 422 V 3.4781 7.7105 119.2539 64.7583 31.1298 177.7965 423 E 3.9224 8.1002 119.2039 59.2855 29.6989 178.8175 424 I 3.7963 7.7804 119.2373 64.1392 37.0860 178.2746 425 F 4.0548 8.6983 119.0195 60.8437 38.8352 177.2555 426 D 4.4280 8.4124 118.4122 57.9121 40.7156 179.0293 427 M 4.1810 7.9766 118.9671 58.1200 31.9192 178.8658 428 L 3.8871 7.7790 119.4302 57.6283 41.8228 179.5257 429 L 3.8615 8.2192 119.9890 58.4086 40.4930 178.8737 430 A 3.8855 7.9291 121.7082 55.6182 18.2659 179.7293 431 T 3.6371 7.6194 113.5424 66.7665 67.9347 176.8824 432 S 3.8322 7.7553 115.0335 61.3136 62.2746 176.3527 433 S 4.1783 8.5171 117.9692 60.7831 62.3569 176.6039 434 R 3.9933 7.6381 121.4750 59.2469 30.0203 177.9250 435 F 4.3821 8.3800 117.8182 61.1245 39.0272 177.9870 436 R 3.9612 8.0635 117.4252 59.4107 29.6294 178.0851 437 M 4.0252 7.5206 117.2471 59.0557 32.4591 177.7257 438 M 4.2093 8.3348 115.6157 54.9411 33.5269 175.5231 439 N 4.1120 7.9605 117.2765 54.0438 37.7493 173.6647 440 L 4.0637 8.4114 120.3194 55.5761 43.4960 176.4228 441 Q 4.9889 8.6246 123.0518 53.8854 32.5765 177.4577 442 G 3.3816 8.7317 109.2389 47.9252 0.0000 175.9846 443 E 3.9984 8.0600 120.3211 59.2713 29.4748 179.0297 444 E 3.9815 7.9732 118.2677 59.0913 29.6259 178.7171 445 F 3.7824 8.1587 121.1249 61.5169 39.3418 177.7649 446 V 3.2448 7.5499 111.3441 63.8335 31.2186 178.5924 447 C 4.0326 7.3961 115.6345 62.7701 27.9852 175.4141 448 L 3.8118 7.7750 120.6640 57.9250 41.3365 179.2801 449 K 3.6527 7.5585 118.9161 60.0757 31.9300 178.8423 450 S 4.3325 7.9410 114.4498 61.5720 62.7068 176.7950 451 I 3.7121 8.1847 122.9711 64.3951 36.8489 178.3350 452 I 3.6891 8.0911 121.0410 64.4807 36.7447 178.1041 453 L 4.1014 7.7979 119.5093 58.0681 41.9705 178.3858 454 L 4.4253 7.5411 117.0083 56.5651 42.3838 178.2051 455 N 4.4811 8.7084 117.4361 56.4706 38.8434 177.1574 456 S 4.1031 8.0238 115.5063 60.8397 62.7348 175.3706 457 G 4.1009 7.9055 106.2588 44.9439 0.0000 174.9917 458 V 3.0871 7.6442 120.3837 63.8581 31.5798 176.9125 459 Y 4.4181 8.2968 116.5296 57.9532 38.5558 175.3861 460 T 4.3626 6.9308 114.7658 61.8755 68.9604 174.9462 461 F 5.1178 7.4725 129.0803 56.9781 37.4160 179.1388 *470 E 4.1123 8.7306 126.7073 57.4448 30.1112 175.6008 471 E 4.4315 8.2750 118.4583 56.6451 29.8960 178.4309 472 K 4.0487 8.0105 119.8785 59.5434 32.0226 178.2605 473 D 4.3429 8.0849 117.6481 57.6485 41.3570 177.2094 474 H 4.0890 8.3571 118.2129 59.6501 29.6537 176.7921 475 I 3.6670 8.1515 121.5128 64.8492 36.8798 178.1929 476 H 4.2551 8.3467 117.1640 58.8146 28.3453 177.9828 477 R 3.9350 8.8061 121.1301 59.3700 30.0887 179.4078 478 V 3.7162 7.8878 118.3661 64.2501 31.6719 178.4439 479 L 4.0446 8.0251 120.2336 57.7252 41.3684 178.9960 480 D 4.3922 8.4948 119.3574 57.1133 40.6239 178.8290 481 K 3.9293 7.7353 119.1225 59.7397 32.0550 179.4938 482 I 3.7226 7.6632 119.3939 64.3296 36.9180 178.7464 483 T 3.8197 7.6985 116.3097 66.7924 68.2656 176.0547 484 D 4.4247 8.4022 121.1640 58.0100 40.8248 179.4638 485 T 3.8528 8.1274 116.0660 66.5313 68.3385 176.5260 486 L 3.9563 8.2118 121.2603 58.0759 41.7145 179.8469 487 I 3.7001 7.8724 119.4305 64.4585 36.9556 177.6173 488 H 4.0146 8.4186 119.4892 59.7301 29.3788 177.1090 489 L 3.8959 8.1737 120.2253 57.8219 41.4487 179.3662 490 M 4.1526 7.7297 118.5701 57.6685 32.0338 178.5141 491 A 3.9651 8.5190 121.5456 55.0747 18.4334 179.8877 492 K 3.7556 8.0045 115.1645 59.6414 32.6240 177.7738 493 A 4.1040 7.3154 119.2202 52.7618 18.6349 177.8714 494 G 4.0207 8.2706 104.6694 45.1054 0.0000 173.6341 495 L 4.3182 7.3741 118.9587 53.4654 42.6926 177.6437 496 T 4.0828 8.2084 113.2217 61.3939 70.6976 175.3331 497 L 4.0972 8.4014 121.2129 58.2271 41.6517 179.9108 498 Q 3.3556 7.9198 116.5634 58.8344 28.7088 178.1629 499 Q 3.9949 7.7369 119.8101 58.5705 28.5744 178.4393 500 Q 3.9486 7.9686 119.5599 59.3128 28.9076 178.5511 501 H 4.2397 8.1326 115.9213 58.4631 28.4046 177.7592 502 Q 3.9446 7.9644 121.0942 58.8278 28.5985 178.2574 503 R 4.0534 7.9891 121.0109 58.7882 30.1248 177.8260 504 L 3.8749 8.0684 120.0711 58.4515 41.9605 178.9533 505 A 3.9807 7.8361 119.6998 55.3728 18.4513 179.5365 506 Q 4.0013 8.4116 116.8672 59.1246 28.7976 179.3331 507 L 4.1449 8.1480 120.0683 57.7952 41.6019 179.4958 508 L 4.1001 7.9854 118.7600 57.4253 40.9816 179.2888 509 L 4.1100 8.0330 118.7885 57.1138 41.6160 179.0492 510 I 3.9805 7.6304 119.2215 63.6459 37.0125 178.1259 511 L 4.0907 7.6445 120.3547 57.4774 41.3054 179.2859 512 S 4.0687 7.8005 112.6612 61.5624 62.2794 175.6772 513 H 4.1664 8.1792 120.5617 59.2579 29.6943 177.1677 514 I 3.7205 8.0050 121.8029 64.1663 36.7985 178.3848 515 R 3.9086 8.1035 119.7812 59.5010 29.9346 177.9204 516 H 4.0558 8.2308 118.0540 59.7265 29.8527 176.9375 517 M 3.9040 8.2050 120.7218 58.4936 31.7507 178.7629 518 S 3.8928 8.0847 113.0688 61.4390 62.4766 175.9171 519 N 4.2985 8.2762 119.3042 56.2401 38.3487 177.6004 520 K 4.1576 8.0057 120.0018 59.3013 32.2589 179.6849 521 G 3.6602 8.6791 106.3633 47.9354 0.0000 175.4267 522 M 4.1376 8.0479 120.4764 58.5091 32.1671 178.2230 523 E 4.0508 7.8989 117.5430 59.5606 29.6056 178.8006 524 H 4.3178 8.2204 119.3811 58.4938 29.8155 177.0631 525 L 4.0719 8.2489 122.3415 58.3953 41.7101 178.3904 526 Y 4.0695 8.0606 118.8981 60.3036 38.8064 177.4745 527 S 4.2654 7.9643 115.2595 61.2964 62.9421 176.1330 528 M 4.1472 8.0434 121.6437 57.7442 31.9551 177.2085 529 K 4.1346 7.3358 118.6094 56.9533 32.0532 178.1031 *531 K 4.2073 7.9254 116.3114 54.5407 33.8040 175.3628 532 N 4.2147 7.7034 114.4616 54.2558 36.5382 175.9254 533 V 3.8595 7.4319 111.8207 63.4230 32.0805 177.2364 534 V 4.4204 7.1295 116.9426 59.8129 33.6964 171.3980 535 P 4.4702 0.0000 0.0000 62.1230 32.0195 175.6922 536 L 4.6932 8.1572 122.9734 52.7239 43.8068 176.6525 537 S 4.3204 8.2606 117.0048 57.9138 63.8467 175.0138 538 D 4.3931 8.6276 121.0973 56.9632 40.7942 178.5306 539 L 3.8778 7.6477 121.0779 58.1763 42.1464 178.5311 540 L 3.6895 7.8455 120.2566 57.7741 41.9239 178.8855 541 L 4.1284 7.7206 118.6858 57.2924 41.5383 178.6165 542 E 3.9227 7.8463 117.8072 59.8493 29.5362 178.8608 543 M 3.9926 7.6704 118.2649 58.5648 31.9192 178.2397 544 L 4.2994 8.2975 120.2726 58.7676 42.1298 178.5585 545 D 4.6444 8.5472 117.0143 55.9653 40.8704 177.8359 546 A 4.2655 7.7496 120.9021 54.1289 18.6823 177.8025 547 H 4.5522 8.5573 113.9364 56.6690 29.5829 175.6633 548 R 4.1800 7.7609 120.4661 56.4867 28.9682 174.6591 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 306 L 8.04 4.28 0.00 1.84 1.99 0.92 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 307 A 7.87 3.87 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 0.00 308 L 7.78 4.27 0.00 1.64 1.73 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 309 S 7.52 4.66 0.00 3.97 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 0.00 310 L 7.22 4.24 0.00 1.88 1.62 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 311 T 8.14 4.25 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 1.19 0.00 0.00 312 A 8.45 3.90 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 D 8.02 4.36 0.00 2.69 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 0.00 314 Q 7.95 4.28 0.00 2.29 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.83 0.00 0.00 0.00 0.00 0.00 2.49 2.34 0.00 315 M 8.07 3.93 0.00 2.31 2.11 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 2.57 2.56 0.00 316 V 7.94 3.57 2.25 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 1.03 0.00 0.00 0.94 0.00 0.00 317 S 8.31 4.05 0.00 4.12 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 318 A 7.72 4.03 1.38 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 0.00 0.00 319 L 7.71 4.13 0.00 1.81 1.76 0.90 0.61 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 0.00 320 L 7.97 4.06 0.00 1.81 1.80 0.95 1.34 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 0.00 321 D 7.61 4.64 0.00 2.64 2.98 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 0.00 322 A 7.85 4.45 1.42 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 0.00 0.00 0.00 323 E 8.32 3.94 0.00 2.19 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 2.59 2.44 0.00 324 P 0.00 4.56 0.00 2.00 2.00 0.00 3.59 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.99 0.00 325 P 0.00 4.39 0.00 2.15 2.06 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 326 I 8.12 4.00 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.57 0.83 0.00 0.00 327 L 8.29 4.49 0.00 1.66 1.68 0.89 0.96 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 0.00 328 Y 8.32 4.49 0.00 2.92 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 329 S 8.39 4.80 0.00 3.87 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 330 E 8.43 4.60 0.00 2.01 1.94 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 2.24 2.30 0.00 331 Y 7.69 4.11 0.00 3.08 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 0.00 332 D 7.77 4.62 0.00 2.55 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 0.00 0.00 0.00 0.00 333 P 0.00 4.24 0.00 2.23 2.25 0.00 3.19 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.92 0.00 334 T 7.81 4.25 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 1.20 0.00 0.00 335 R 7.51 4.49 0.00 1.85 1.90 0.00 3.03 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.52 0.00 336 P 0.00 4.68 0.00 2.30 2.23 0.00 3.78 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 2.03 2.04 0.00 337 F 8.89 4.37 0.00 2.96 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 0.00 338 S 8.16 4.85 0.00 4.00 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 0.00 339 E 8.81 3.93 0.00 2.22 2.28 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 2.37 2.40 0.00 340 A 7.91 4.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 341 S 8.02 4.07 0.00 3.81 3.79 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 0.00 342 M 8.05 3.91 0.00 2.17 2.32 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 2.95 2.61 0.00 343 M 8.13 4.19 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.87 0.00 344 G 8.04 3.60 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 0.00 0.00 0.00 345 L 7.80 4.03 0.00 1.97 1.71 0.95 0.70 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 0.00 346 L 7.68 3.95 0.00 1.85 1.63 0.72 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 347 T 8.16 4.15 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 348 N 8.17 4.26 0.00 2.91 2.95 0.00 0.00 6.66 6.56 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 0.00 349 L 7.82 3.99 0.00 2.05 1.73 1.05 1.15 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 0.00 350 A 8.19 4.15 1.50 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 0.00 0.00 351 D 8.08 4.31 0.00 3.02 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 0.00 352 R 7.83 4.08 0.00 2.00 2.04 0.00 3.20 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 353 E 8.28 4.05 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.71 0.00 354 L 8.12 3.99 0.00 2.06 1.69 0.53 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 355 V 7.43 3.71 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 0.90 0.00 0.00 0.86 0.00 0.00 356 H 8.03 4.23 0.00 3.40 3.43 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 357 M 8.58 4.09 0.00 2.31 2.21 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.87 0.00 358 I 7.91 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0.00 1.38 1.44 7.81 *418 V 7.33 3.76 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 1.01 0.00 0.00 0.97 0.00 0.00 419 E 8.70 4.16 0.00 1.97 1.86 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 2.30 2.31 0.00 420 G 9.01 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 421 M 7.87 4.10 0.00 2.25 1.94 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.36 0.00 422 V 7.71 3.48 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 0.74 0.00 0.00 0.97 0.00 0.00 423 E 8.10 3.92 0.00 2.07 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 2.43 0.00 424 I 7.78 3.80 2.07 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.87 0.96 0.00 0.00 425 F 8.70 4.05 0.00 3.29 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 0.00 426 D 8.41 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0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 435 F 8.38 4.38 0.00 3.19 3.18 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 0.00 436 R 8.06 3.96 0.00 2.10 1.93 0.00 3.05 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 437 M 7.52 4.03 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.61 0.00 438 M 8.33 4.21 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.57 0.00 439 N 7.96 4.11 0.00 2.81 2.81 0.00 0.00 7.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 440 L 8.41 4.06 0.00 1.45 1.66 0.63 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 441 Q 8.62 4.99 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 442 G 8.73 3.38 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 1.21 0.00 0.00 484 D 8.40 4.42 0.00 2.88 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 0.00 485 T 8.13 3.85 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 1.20 0.00 0.00 486 L 8.21 3.96 0.00 1.92 1.71 0.89 0.64 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 0.00 487 I 7.87 3.70 1.88 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 1.41 0.49 0.92 0.00 0.00 488 H 8.42 4.01 0.00 3.16 3.52 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 0.00 489 L 8.17 3.90 0.00 1.90 1.69 0.91 0.85 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 0.00 490 M 7.73 4.15 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.52 0.00 491 A 8.52 3.97 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 509 L 8.03 4.11 0.00 1.72 1.72 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 510 I 7.63 3.98 2.19 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.03 1.10 0.00 0.00 511 L 7.64 4.09 0.00 1.83 1.72 0.92 0.73 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 0.00 512 S 7.80 4.07 0.00 3.91 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 0.00 513 H 8.18 4.17 0.00 3.29 3.45 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 8.01 3.72 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.87 0.89 0.00 0.00 515 R 8.10 3.91 0.00 2.07 2.18 0.00 3.16 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 516 H 8.23 4.06 0.00 3.23 3.40 0.00 5.85 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 8.20 3.90 0.00 1.98 2.01 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 2.52 2.47 0.00 518 S 8.08 3.89 0.00 3.79 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 0.00 519 N 8.28 4.30 0.00 2.87 2.82 0.00 0.00 7.08 8.03 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 0.00 520 K 8.01 4.16 0.00 1.81 1.79 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.46 7.81 521 G 8.68 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 0.00 522 M 8.05 4.14 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.55 0.00 523 E 7.90 4.05 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 2.30 2.44 0.00 524 H 8.22 4.32 0.00 3.27 3.46 0.00 5.64 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 L 8.25 4.07 0.00 2.05 1.97 1.06 0.96 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 0.00 526 Y 8.06 4.07 0.00 3.14 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 527 S 7.96 4.27 0.00 4.07 4.17 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 0.00 528 M 8.04 4.15 0.00 2.22 2.04 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 2.58 2.53 0.00 529 K 7.34 4.13 0.00 1.81 1.74 0.00 1.45 0.00 0.00 1.38 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.56 7.81 *531 K 7.93 4.21 0.00 1.77 1.86 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.60 1.39 7.81 532 N 7.70 4.21 0.00 2.85 2.86 0.00 0.00 6.99 7.02 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 0.00 533 V 7.43 3.86 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 0.66 0.00 0.00 0.95 0.00 0.00 534 V 7.13 4.42 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 0.64 0.00 0.00 0.95 0.00 0.00 535 P 0.00 4.47 0.00 2.05 2.01 0.00 3.64 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 536 L 8.16 4.69 0.00 1.61 1.57 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 537 S 8.26 4.32 0.00 3.93 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 0.00 538 D 8.63 4.39 0.00 2.75 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 539 L 7.65 3.88 0.00 1.66 1.72 0.86 0.78 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 0.00 540 L 7.85 3.69 0.00 2.17 1.74 0.65 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 541 L 7.72 4.13 0.00 1.71 1.69 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 542 E 7.85 3.92 0.00 2.13 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 2.35 2.41 0.00 543 M 7.67 3.99 0.00 0.83 1.67 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 1.17 1.72 0.00 544 L 8.30 4.30 0.00 1.87 1.95 1.15 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 545 D 8.55 4.64 0.00 2.88 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 546 A 7.75 4.27 1.50 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 0.00 0.00 547 H 8.56 4.55 0.00 3.42 3.43 0.00 5.86 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 R 7.76 4.18 0.00 1.80 1.77 0.00 3.01 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.64 0.00 * Residues marked with a * may have inaccurate shift predictions.