NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 306 L 4.2877 8.0385 120.6281 54.2434 43.3679 177.3677 307 A 3.8697 8.3562 122.3960 54.8803 18.3552 178.2893 308 L 4.1688 7.8219 114.6528 56.7611 42.6895 176.1246 309 S 4.5955 7.5264 111.6093 58.1104 64.0639 174.8062 310 L 4.2176 7.5307 121.9692 55.0648 42.0035 177.6076 311 T 4.3015 9.0609 113.5605 60.5176 71.4402 175.8893 312 A 3.9720 8.3087 122.0201 55.6972 18.3150 179.5996 313 D 4.3915 8.0232 116.6703 57.4835 40.8424 178.8833 314 Q 4.0366 7.9369 118.3903 58.7183 28.6404 178.2285 315 M 3.9492 8.1724 119.3868 58.6312 32.3714 177.9915 316 V 3.5288 7.7501 118.3324 66.3615 31.6299 177.5856 317 S 4.0589 8.1925 112.1396 61.6934 61.9609 176.2486 318 A 4.0315 8.0306 122.0057 54.9670 18.3022 179.4168 319 L 4.1131 8.3023 118.0279 57.9155 41.8454 179.5080 320 L 4.0280 8.4836 119.2336 58.1393 41.3764 179.4860 321 D 4.4520 8.1335 117.1765 56.9173 40.8131 178.0660 322 A 4.3175 7.6929 119.4081 52.2984 18.8410 177.4332 323 E 3.8470 7.4170 116.4499 56.3658 29.9745 175.7961 324 P 4.6123 0.0000 0.0000 61.4159 32.4596 174.0887 325 P 4.5193 0.0000 0.0000 62.2475 32.2237 175.7244 326 I 4.0666 8.0970 120.4467 60.5515 37.5606 176.0791 327 L 4.6687 8.2579 125.3326 53.7785 43.3223 175.2915 328 Y 4.5424 8.1674 117.2491 55.9219 40.1114 176.1687 329 S 4.3262 8.7614 118.0459 58.6521 63.2527 174.1214 330 E 4.1421 8.7656 126.2688 58.8518 29.8290 177.8065 *341 S 4.4274 7.8140 111.6339 58.3061 64.4896 175.5182 342 M 4.0468 7.9841 119.6423 58.7505 31.9746 178.1713 343 M 4.1473 8.0934 118.3822 58.2690 32.0304 178.9221 344 G 3.6073 8.0028 105.3648 47.9255 0.0000 175.6425 345 L 4.0302 7.5397 121.5761 57.2188 41.5032 179.7185 346 L 3.9416 8.2859 119.7043 57.9289 41.6378 179.5912 347 T 3.8955 8.4459 110.1449 64.7779 68.7287 175.9553 348 N 4.2619 8.3358 120.0830 56.2919 38.9938 176.5488 349 L 3.9678 8.0796 121.4290 58.0646 42.2154 178.7831 350 A 4.0593 8.3867 121.0632 55.3254 18.1612 179.0007 351 D 4.2273 8.3866 115.6265 57.6890 41.4821 178.4688 352 R 4.1498 8.0588 118.2810 58.9755 30.0604 178.7524 353 E 4.0855 8.2976 118.5079 59.1137 29.3786 179.2639 354 L 4.0166 7.9428 119.4330 57.5235 41.6745 179.5014 355 V 3.5625 7.3954 117.7673 66.5286 31.5040 177.9409 356 H 4.3629 8.1943 115.3191 58.7467 28.5086 177.3376 357 M 4.1735 8.3180 120.4513 58.8064 32.1024 178.2255 358 I 3.7593 7.8333 119.9318 64.6108 37.0322 178.2241 359 N 4.3828 7.7055 114.9615 55.9414 38.6811 176.8728 360 W 4.2905 8.4595 129.6131 60.4576 30.7908 177.7817 361 A 2.6105 8.3131 120.9458 54.6900 17.4929 179.7307 362 K 4.1393 7.4801 114.8558 58.8321 32.1609 178.9071 363 R 4.2946 7.4086 116.8409 55.7878 30.5684 176.6613 364 V 3.4198 6.7648 120.4386 61.4790 31.6664 173.4608 365 P 4.2955 0.0000 0.0000 64.5599 31.8577 175.9655 366 G 4.4013 8.9953 110.5805 46.6115 0.0000 175.4240 367 F 4.0205 8.4571 122.0444 61.3932 39.3649 177.3799 368 V 3.8343 7.7612 110.8575 63.1831 31.7990 176.9454 369 D 4.3959 7.9155 119.7445 56.3200 40.9284 176.7111 370 L 4.5767 7.1651 118.4720 53.8795 42.4736 177.2785 371 T 3.9904 8.3230 111.8202 61.5478 70.5208 175.3380 372 L 3.8660 8.2190 122.7611 58.5605 42.1203 178.4353 373 H 4.0642 8.1115 117.7259 59.3992 29.7352 176.8419 374 D 4.1775 7.9935 120.7095 57.0877 40.5904 178.6207 375 Q 3.7107 8.0017 118.6765 58.9273 28.6286 179.1172 376 V 3.6607 7.9352 119.1672 66.3012 31.6212 177.4615 377 H 4.1557 8.3711 118.0245 59.4006 29.7102 177.2337 378 L 4.1440 8.6175 121.1845 57.8135 41.4778 179.5896 379 L 4.1992 8.3004 119.0341 57.9136 41.4202 179.2353 380 E 4.2716 8.4427 117.8476 59.6044 29.4485 179.1158 381 S 4.2549 8.0519 111.9570 60.6549 62.8726 175.1949 382 A 4.6180 8.2847 121.9777 52.1934 19.2495 178.7674 383 W 4.3285 8.2392 116.2331 59.8468 27.9090 178.2637 384 L 3.5888 6.3778 120.5001 57.3472 41.4937 178.5182 385 E 3.8761 7.7889 118.2371 59.2492 29.4103 179.2414 386 I 3.7511 7.9123 119.9272 64.2667 37.1430 178.3071 387 L 4.0051 8.0244 119.8014 58.2721 41.4226 179.6495 388 M 4.0507 8.3135 118.7722 58.4276 31.8364 178.7384 389 I 3.9959 8.2303 119.1691 63.7097 38.1362 178.2124 390 G 3.7748 8.1999 106.9453 47.7311 0.0000 175.1120 391 L 3.8263 7.9863 122.4491 58.0035 42.1728 179.0688 392 V 3.6539 8.1640 118.2394 65.4834 31.2795 177.7904 393 W 4.1773 8.5640 128.6555 60.2855 30.3415 177.4416 394 R 3.8721 7.6959 112.2279 56.8575 29.2355 177.3418 395 S 4.5205 7.1799 114.6915 58.7703 63.8585 175.2738 396 M 4.1935 7.1889 124.3057 57.4214 31.5911 178.2350 397 E 4.0705 7.5639 115.4564 56.7253 30.5747 177.4093 398 H 4.8902 7.9535 112.7410 53.3495 30.3681 171.8109 399 P 4.2456 0.0000 0.0000 64.6392 31.6608 177.7591 400 G 4.0184 9.2214 109.9882 45.0903 0.0000 172.9608 401 K 4.9014 8.0091 117.9509 54.4628 36.2052 175.6527 402 L 4.2241 8.9193 123.6110 53.0188 43.6892 175.9667 403 L 4.5036 8.2435 128.6101 53.4054 39.7913 175.9200 404 F 4.0640 8.3884 121.5228 59.5907 39.6650 175.5311 405 A 4.5824 7.8906 120.6833 49.8773 22.0790 175.2085 406 P 4.0794 0.0000 0.0000 64.7037 31.4239 177.3515 407 N 4.9958 7.8132 113.5317 52.2461 37.9153 175.3399 408 L 4.6987 8.4350 121.3454 54.0676 42.6382 173.1870 409 L 4.9492 7.9511 121.3173 53.3782 43.5865 175.3858 410 L 5.3299 9.0812 126.9680 53.1515 45.0552 175.8401 411 D 5.2691 9.4834 121.9934 51.8749 41.7993 177.0775 412 R 4.2012 8.8742 117.4941 60.0501 29.7188 177.7491 413 N 4.2349 8.2907 115.4557 56.6634 38.3078 177.2155 414 Q 4.0728 9.4561 119.9967 58.4969 28.5303 178.8148 415 G 2.5634 7.7981 107.2162 46.9414 0.0000 175.9209 416 K 3.8517 7.3267 119.8158 58.8502 31.9659 178.6479 417 S 4.1250 7.2270 113.2271 60.4609 62.6373 174.5676 418 V 4.0470 6.5586 119.5829 61.1759 32.4212 175.1106 419 E 3.9109 8.6113 126.9896 57.3059 29.9300 176.6780 420 G 3.8322 8.7365 113.4403 47.1088 0.0000 174.1684 421 M 4.3029 7.6978 120.6266 56.7417 32.9716 177.7390 422 V 3.5075 7.6165 118.0959 65.9771 31.6295 177.6352 423 E 3.9841 8.1356 117.6151 59.6186 29.3703 179.3063 424 I 3.7462 7.7791 119.2194 64.2540 37.2360 178.0356 425 F 4.0090 8.8375 119.1794 61.0268 38.7976 177.5637 426 D 4.4786 8.7498 118.4977 57.6339 40.5141 178.8164 427 M 4.1125 8.1044 119.1561 58.4003 31.9096 178.7864 428 L 3.8831 8.2760 119.4456 57.7424 41.7835 179.5634 429 L 3.8717 8.3396 119.0323 57.7188 41.5790 179.4495 430 A 3.9586 8.3474 121.0247 55.4431 18.3384 179.7565 431 T 3.5936 8.0699 114.4550 66.7660 68.0680 176.7429 432 S 4.0464 8.1190 115.1013 61.5537 62.3076 176.3942 433 S 4.1735 8.1498 117.8386 61.3802 62.5168 176.6727 434 R 3.8656 7.9211 121.4452 59.5806 29.8829 178.5807 435 F 4.6985 8.1213 117.5498 60.6241 38.8365 177.7502 436 R 3.8655 8.1316 118.3749 59.7473 29.7609 178.3032 437 M 4.0857 8.2042 116.8931 58.6001 32.2930 177.2824 438 M 4.2339 8.1507 116.5814 54.5956 33.2120 175.2131 439 N 4.1207 8.0907 116.7417 53.9568 37.8013 174.3560 440 L 4.1430 7.9717 119.1755 55.6543 43.1657 176.6996 441 Q 4.8056 9.1445 125.2017 54.6785 31.6937 177.3351 442 G 3.3066 8.6891 108.7225 47.7982 0.0000 176.0205 443 E 3.9780 8.0757 120.4391 59.4254 29.5334 179.0647 444 E 4.0390 8.0104 118.1994 59.0755 29.5972 178.9436 445 F 3.8259 7.8304 120.8205 61.2917 39.4453 177.7072 446 V 3.1871 7.3945 111.3952 64.0098 31.1585 178.5088 447 C 4.0893 7.4979 115.4406 62.7831 27.9620 176.0040 448 L 3.9350 7.6553 120.5719 57.6552 41.1414 179.5256 449 K 3.7789 7.7005 119.5164 59.5696 32.0985 179.1148 450 S 4.3447 8.0950 115.2178 61.4273 62.6304 176.6382 451 I 3.7027 8.1329 123.0537 64.3924 36.8614 178.3084 452 I 3.7009 7.9242 120.6900 64.3994 36.7426 178.1653 453 L 4.0601 7.6327 119.2317 58.3154 42.0671 178.6765 454 L 4.2392 7.7341 117.0503 56.8418 41.8369 178.2294 455 N 4.3241 8.3738 117.2777 55.8325 38.9367 177.0522 456 S 4.1574 7.9821 115.7465 61.2530 63.1790 175.5487 457 G 3.9849 7.7988 106.5671 45.2174 0.0000 175.5765 458 V 2.2854 7.0327 120.7373 64.4691 31.2316 178.1279 459 Y 4.2947 7.2471 116.2443 59.8803 37.8987 175.7675 460 T 4.7828 7.5105 114.7345 61.2867 68.7990 175.3842 461 F 4.3468 7.9397 118.2822 59.3272 38.0920 176.2762 *464 S 4.2643 8.6724 116.9582 58.6758 64.2840 173.3539 465 T 4.5114 7.6320 110.4967 59.6043 71.9422 174.4537 466 L 3.9809 8.1487 119.6208 57.8516 41.5585 179.5170 467 K 3.9283 7.9479 119.4212 59.4141 32.2496 178.7207 468 S 4.0878 8.1183 114.5996 61.4503 62.7000 176.5473 469 L 4.0133 7.6881 122.5068 57.7499 41.4241 179.3760 470 E 4.0011 7.9307 118.5620 59.2963 29.2650 179.3556 471 E 3.9806 8.3522 118.6508 59.5473 29.5408 179.6345 472 K 3.9681 8.2593 118.4957 59.2916 32.0802 178.9333 473 D 4.3427 8.1951 118.4952 57.5278 41.1133 177.7389 474 H 4.1419 8.3310 118.5832 59.4775 29.8300 177.0732 475 I 3.5684 7.9719 121.7534 64.9504 36.9415 178.2408 476 H 4.2478 8.3796 116.9989 58.7736 28.4898 178.1699 477 R 3.9511 8.1517 120.1617 59.1033 29.8319 179.2343 478 V 3.5588 7.9291 118.2571 65.7932 31.4195 178.0484 479 L 3.9606 8.1841 119.1127 58.0365 41.4752 179.2027 480 D 4.3628 8.2557 118.7360 57.1732 40.7032 178.8953 481 K 4.0512 7.9262 120.1163 59.6953 32.1685 179.0708 482 I 3.7895 7.9756 120.1218 64.3666 36.8607 178.6577 483 T 3.8547 8.2514 117.1774 66.8243 68.2468 176.3371 484 D 4.3773 8.2400 120.7708 57.6643 40.7360 179.1909 485 T 3.8867 7.9138 116.1279 66.6240 68.4910 176.6694 486 L 3.9799 8.1363 121.0625 57.9361 41.6619 179.7200 487 I 3.7159 8.0045 119.8130 64.4720 36.9764 177.6848 488 H 4.1025 8.5008 119.3615 59.4647 29.6654 176.8295 489 L 3.8594 8.0094 120.5218 58.4143 41.4022 179.7003 490 M 4.0399 8.0816 117.9592 58.1582 31.8772 178.5897 491 A 3.9786 8.3732 121.3151 55.2885 18.3700 179.8513 492 K 3.8925 7.9523 115.3645 59.5223 32.2008 179.1929 493 A 4.1438 7.7857 120.0315 53.6473 18.2318 178.3901 494 G 3.9989 7.7532 104.7575 45.1678 0.0000 173.9946 495 L 4.3430 7.3028 119.3686 54.3357 42.3082 177.7711 496 T 4.2092 8.3755 112.1629 61.1354 70.9505 175.6651 497 L 3.8173 8.4483 121.8050 58.2428 41.6034 179.6941 498 Q 3.9189 7.9431 118.5658 59.4398 29.0486 178.2786 499 Q 4.0411 7.9375 118.8192 58.7864 28.6074 178.8385 500 Q 3.9628 8.3334 119.6244 59.2601 28.8094 178.4133 501 H 4.2809 8.0054 117.1533 59.0515 28.6971 177.9245 502 Q 4.0310 8.2134 119.8196 59.0031 28.5079 178.9514 503 R 3.8898 8.2509 119.8614 59.1841 30.1162 178.1508 504 L 3.9362 8.4071 120.4496 58.1464 41.9912 178.8806 505 A 4.0025 8.1391 120.5173 55.3268 18.2349 179.5132 506 Q 3.9748 8.3177 116.7249 59.2277 28.5744 179.3196 507 L 4.1542 7.9529 118.8144 57.9220 41.8596 179.3483 508 L 4.1991 8.2035 118.9267 57.6383 41.4659 179.5337 509 L 4.0554 8.2929 119.2666 57.6238 41.4841 179.4792 510 I 3.8124 7.6773 120.1412 64.1773 36.9839 178.2568 511 L 4.0713 7.7303 120.0009 57.8456 41.3348 179.7255 512 S 4.1956 7.9012 115.0261 61.6169 62.7240 176.0437 513 H 4.2668 8.1819 120.6228 59.2491 29.6820 177.2841 514 I 3.6237 7.9057 121.8754 64.1663 36.9024 178.2684 515 R 4.0495 8.0946 121.0298 58.9925 29.8500 178.1087 516 H 4.1353 8.1263 118.0095 59.6068 29.9022 177.1547 517 M 3.9084 8.0484 120.5948 58.2977 31.6452 178.6416 518 S 3.9262 8.0190 113.1960 61.4362 62.5607 176.0270 519 N 4.2641 7.9825 119.0092 56.3509 38.3188 177.6182 520 K 4.1013 8.0156 120.0027 59.3369 32.0998 179.7052 521 G 3.6604 8.4386 106.5661 47.9633 0.0000 175.7827 522 M 4.1735 8.3035 121.3917 58.1666 32.0485 178.5888 523 E 4.0551 8.3001 118.8030 59.6623 29.4310 178.6833 524 H 4.2287 8.0940 116.8786 59.4127 30.2034 176.6052 525 L 4.1429 8.0479 120.5390 58.3706 41.3811 179.1083 526 Y 4.2798 8.1093 117.8353 60.6064 38.7963 177.6243 527 S 4.2969 7.8997 112.0298 59.6598 63.2933 174.0836 528 M 4.3003 7.9337 127.8696 55.7174 32.5611 175.0501 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 4.29 0.00 1.69 1.69 0.93 0.52 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 0.00 307 A 8.36 3.87 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 0.00 308 L 7.82 4.17 0.00 1.65 1.75 0.95 0.82 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 0.00 309 S 7.53 4.60 0.00 3.93 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 0.00 310 L 7.53 4.22 0.00 1.71 1.64 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 311 T 9.06 4.30 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 8.31 3.97 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 0.00 313 D 8.02 4.39 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 0.00 314 Q 7.94 4.04 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 315 M 8.17 3.95 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 316 V 7.75 3.53 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 0.94 0.00 0.00 1.02 0.00 0.00 317 S 8.19 4.06 0.00 3.96 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 0.00 318 A 8.03 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 8.30 4.11 0.00 1.80 1.74 0.95 0.45 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 0.00 320 L 8.48 4.03 0.00 1.65 1.75 0.93 1.07 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 0.00 321 D 8.13 4.45 0.00 2.74 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 7.69 4.32 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 7.42 3.85 0.00 2.22 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 2.42 2.49 0.00 324 P 0.00 4.61 0.00 2.16 2.09 0.00 3.65 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.66 0.00 325 P 0.00 4.52 0.00 2.20 2.10 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.91 0.00 326 I 8.10 4.07 1.86 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 0.58 0.79 0.00 0.00 327 L 8.26 4.67 0.00 1.66 1.66 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 328 Y 8.17 4.54 0.00 2.90 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 0.00 329 S 8.76 4.33 0.00 3.87 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 0.00 330 E 8.77 4.14 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 *341 S 7.81 4.43 0.00 3.87 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 0.00 342 M 7.98 4.05 0.00 2.00 2.04 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 2.64 2.53 0.00 343 M 8.09 4.15 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 344 G 8.00 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 7.54 4.03 0.00 1.81 1.71 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 346 L 8.29 3.94 0.00 1.71 1.62 0.64 -0.32 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 8.45 3.90 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 1.25 0.00 0.00 348 N 8.34 4.26 0.00 2.84 3.04 0.00 0.00 6.86 6.18 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 0.00 349 L 8.08 3.97 0.00 1.93 1.94 0.96 1.02 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 8.39 4.06 1.51 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 0.00 0.00 351 D 8.39 4.23 0.00 2.69 2.87 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 0.00 0.00 0.00 352 R 8.06 4.15 0.00 2.10 2.02 0.00 3.23 0.00 0.00 3.20 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 427 M 8.10 4.11 0.00 2.10 2.26 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 2.89 2.66 0.00 428 L 8.28 3.88 0.00 1.64 1.52 0.84 0.40 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 0.00 429 L 8.34 3.87 0.00 1.81 1.70 1.03 0.69 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 0.00 430 A 8.35 3.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 431 T 8.07 3.59 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 0.75 0.00 0.00 432 S 8.12 4.05 0.00 3.88 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 0.00 433 S 8.15 4.17 0.00 4.03 3.87 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 0.00 0.00 0.00 434 R 7.92 3.87 0.00 1.94 1.91 0.00 3.15 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 435 F 8.12 4.70 0.00 3.27 3.05 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 0.00 0.00 0.00 436 R 8.13 3.87 0.00 1.99 2.08 0.00 3.07 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 437 M 8.20 4.09 0.00 2.18 2.09 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 2.62 2.60 0.00 438 M 8.15 4.23 0.00 2.13 2.25 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 2.85 2.60 0.00 439 N 8.09 4.12 0.00 2.88 2.87 0.00 0.00 7.08 7.87 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 0.00 440 L 7.97 4.14 0.00 1.59 1.64 0.82 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 441 Q 9.14 4.81 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 442 G 8.69 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 0.00 0.00 0.00 443 E 8.08 3.98 0.00 2.04 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 0.00 2.39 2.45 0.00 444 E 8.01 4.04 0.00 2.11 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 445 F 7.83 3.83 0.00 2.13 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 0.00 446 V 7.39 3.19 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 0.88 0.00 0.00 0.92 0.00 0.00 447 C 7.50 4.09 0.00 3.14 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 0.00 448 L 7.66 3.93 0.00 1.68 1.68 0.90 0.96 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 0.00 449 K 7.70 3.78 0.00 1.14 1.49 0.00 0.61 0.00 0.00 0.65 0.00 0.00 2.37 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.09 1.04 7.81 450 S 8.10 4.34 0.00 4.10 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 0.00 451 I 8.13 3.70 2.04 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 1.52 0.87 0.93 0.00 0.00 452 I 7.92 3.70 2.10 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 1.43 0.89 0.94 0.00 0.00 453 L 7.63 4.06 0.00 1.89 1.94 1.02 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 454 L 7.73 4.24 0.00 1.67 1.67 0.89 1.10 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 0.00 455 N 8.37 4.32 0.00 2.74 2.88 0.00 0.00 7.05 8.82 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 0.00 456 S 7.98 4.16 0.00 4.01 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 0.00 457 G 7.80 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 0.00 458 V 7.03 2.29 1.75 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 -0.27 0.00 0.00 0.39 0.00 0.00 459 Y 7.25 4.29 0.00 3.01 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 460 T 7.51 4.78 4.34 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 1.40 0.00 0.00 461 F 7.94 4.35 0.00 3.02 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 *464 S 8.67 4.26 0.00 3.87 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 0.00 465 T 7.63 4.51 4.21 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 1.18 0.00 0.00 466 L 8.15 3.98 0.00 1.69 1.74 0.91 0.56 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 0.00 467 K 7.95 3.93 0.00 1.80 1.72 0.00 1.56 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.45 7.81 468 S 8.12 4.09 0.00 4.16 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 0.00 469 L 7.69 4.01 0.00 1.94 1.77 0.93 0.91 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 0.00 470 E 7.93 4.00 0.00 2.06 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 2.50 2.47 0.00 471 E 8.35 3.98 0.00 2.19 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 2.45 2.39 0.00 472 K 8.26 3.97 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.46 1.78 7.81 473 D 8.20 4.34 0.00 2.93 2.86 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 0.00 474 H 8.33 4.14 0.00 3.35 3.51 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 0.00 475 I 7.97 3.57 1.84 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.69 0.75 0.00 0.00 476 H 8.38 4.25 0.00 3.22 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 477 R 8.15 3.95 0.00 2.01 1.97 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 478 V 7.93 3.56 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.78 0.00 0.00 479 L 8.18 3.96 0.00 1.90 1.71 0.88 1.18 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 0.00 480 D 8.26 4.36 0.00 2.86 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 0.00 481 K 7.93 4.05 0.00 2.04 1.91 0.00 1.51 0.00 0.00 1.64 0.00 0.00 3.25 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.51 7.81 482 I 7.98 3.79 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.69 0.89 0.00 0.00 483 T 8.25 3.85 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 1.22 0.00 0.00 484 D 8.24 4.38 0.00 2.83 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 0.00 485 T 7.91 3.89 4.41 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 1.28 0.00 0.00 486 L 8.14 3.98 0.00 1.86 1.72 0.91 1.14 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 0.00 487 I 8.00 3.72 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.83 0.96 0.00 0.00 488 H 8.50 4.10 0.00 3.28 3.56 0.00 5.63 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 8.01 3.86 0.00 1.90 1.70 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 490 M 8.08 4.04 0.00 2.07 2.25 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 2.85 2.56 0.00 491 A 8.37 3.98 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 0.00 492 K 7.95 3.89 0.00 1.82 1.84 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.41 7.81 493 A 7.79 4.14 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 0.00 494 G 7.75 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 0.00 0.00 0.00 0.00 495 L 7.30 4.34 0.00 1.59 1.60 0.92 1.18 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 0.00 496 T 8.38 4.21 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 1.20 0.00 0.00 497 L 8.45 3.82 0.00 1.66 1.69 0.93 0.66 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 0.00 498 Q 7.94 3.92 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 499 Q 7.94 4.04 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 500 Q 8.33 3.96 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 501 H 8.01 4.28 0.00 3.34 3.33 0.00 5.64 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 0.00 502 Q 8.21 4.03 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 503 R 8.25 3.89 0.00 1.99 2.09 0.00 3.12 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 504 L 8.41 3.94 0.00 1.85 1.92 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 505 A 8.14 4.00 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 0.00 506 Q 8.32 3.97 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.76 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 507 L 7.95 4.15 0.00 1.80 1.79 0.93 0.95 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 0.00 508 L 8.20 4.20 0.00 1.72 1.75 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 509 L 8.29 4.06 0.00 1.85 1.73 0.93 0.72 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 7.68 3.81 2.21 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 0.84 0.00 0.00 511 L 7.73 4.07 0.00 1.89 1.77 0.96 0.91 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 0.00 512 S 7.90 4.20 0.00 4.04 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 0.00 513 H 8.18 4.27 0.00 3.18 3.42 0.00 5.69 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 7.91 3.62 2.02 0.00 0.00 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 1.37 0.88 0.89 0.00 0.00 515 R 8.09 4.05 0.00 2.03 2.11 0.00 3.16 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 516 H 8.13 4.14 0.00 3.37 3.47 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 3.91 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 518 S 8.02 3.93 0.00 3.74 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 7.98 4.26 0.00 2.90 2.82 0.00 0.00 7.08 7.39 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 0.00 520 K 8.02 4.10 0.00 1.84 1.82 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.41 7.81 521 G 8.44 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 8.30 4.17 0.00 2.02 2.23 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.72 0.00 523 E 8.30 4.06 0.00 2.24 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 2.37 2.50 0.00 524 H 8.09 4.23 0.00 3.29 3.57 0.00 5.80 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 L 8.05 4.14 0.00 2.06 1.87 1.24 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 526 Y 8.11 4.28 0.00 3.08 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 7.90 4.30 0.00 4.10 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 0.00 528 M 7.93 4.30 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.43 0.00 * Residues marked with a * may have inaccurate shift predictions.