NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 285 K 4.3516 8.3031 122.1409 54.3348 33.3688 174.7687 286 G 3.6802 8.3592 112.6730 43.5535 0.0000 171.7726 287 Y 2.8710 11.3700 120.1517 58.2838 37.4335 171.3428 288 Q 4.3231 7.6598 131.2500 53.9377 28.9862 176.1061 289 F 4.5141 8.5315 122.6573 57.0682 39.5104 174.8437 290 E 4.0128 9.5255 126.2536 56.5145 29.0337 176.3848 291 E 4.1704 8.6416 126.5044 57.0907 30.4905 176.0852 292 E 3.5196 8.6076 120.7694 56.6149 27.0403 171.9277 293 N 4.7730 7.6938 121.5592 51.7821 39.6934 173.4079 294 P 4.3475 0.0000 0.0000 64.7583 31.4526 177.0898 295 L 4.6553 8.1455 119.1819 54.4563 42.0651 178.3999 296 R 3.8305 7.7102 121.1351 59.8511 29.8780 177.2753 297 D 4.6849 7.9132 113.8381 54.3926 40.7996 175.8211 298 H 4.0966 7.6536 119.5056 55.6186 30.1600 172.9580 299 P 4.1960 0.0000 0.0000 65.2908 31.3832 176.4764 300 Q 4.4843 7.8181 124.9406 53.3032 30.0072 173.7698 301 P 4.2317 0.0000 0.0000 65.3830 31.7642 177.9491 302 F 4.4117 8.1841 119.9133 61.3215 39.5516 176.8105 303 E 3.5459 9.3653 119.0655 59.3385 29.2702 179.2507 304 E 3.9645 7.7529 118.2061 59.1386 29.4170 179.6666 305 G 2.7473 8.2622 106.4126 47.3096 0.0000 175.6948 306 L 3.8741 7.5088 121.4570 57.9509 41.6410 179.3445 307 R 3.8182 7.7898 117.5763 58.9219 29.8403 179.1221 308 R 3.8174 7.9423 117.2941 59.5217 30.1790 178.3241 309 L 3.9696 7.9573 119.6554 58.6519 41.8593 178.7855 310 Q 3.8261 8.3380 117.2648 59.1646 28.7983 178.4557 311 E 4.4047 8.0266 116.4078 56.1264 29.5421 177.2793 312 G 3.8352 8.8480 108.2800 45.8984 0.0000 174.4080 313 D 4.6941 8.0742 122.0046 52.5994 40.1933 177.0154 314 L 4.0669 8.2032 124.4505 56.8812 41.9320 176.4236 315 P 4.2804 0.0000 0.0000 66.0644 31.2867 178.3155 316 N 4.3612 8.2940 114.0977 55.7987 38.5583 177.2624 317 A 3.6444 7.8358 121.9647 54.8926 18.4269 179.5380 318 V 3.7985 8.3752 117.0684 66.6110 31.6308 178.3037 319 L 4.1547 7.6769 118.1914 57.6964 41.3503 179.7256 320 L 3.8737 7.6823 119.0724 57.6706 41.5937 179.4284 321 F 4.3830 7.8928 117.9388 60.4565 38.6934 177.4440 322 E 3.9139 8.7495 118.5416 59.5508 29.2771 179.3417 323 A 3.8482 7.9988 120.3279 55.0871 18.4507 179.5915 324 A 3.9441 7.9066 119.3184 55.1124 18.3424 179.7969 325 V 3.7818 7.5795 109.6596 63.0638 31.4127 178.2119 326 Q 3.9054 7.1974 117.4976 57.6634 28.8520 177.6542 327 Q 4.3643 7.5986 118.0199 57.5945 29.8291 175.5973 328 D 4.6794 7.8487 120.8634 50.9704 41.7908 173.6519 329 P 4.8827 0.0000 0.0000 64.3782 31.6476 177.8412 330 K 4.3211 7.8621 115.6366 57.2928 32.3110 177.6848 331 H 4.4508 8.1347 120.4928 55.9888 27.7637 174.9233 332 M 4.2179 8.5177 124.6618 58.3397 32.4039 176.9818 333 E 4.0008 8.2042 118.6373 58.9187 29.8612 178.4396 334 A 3.8557 7.3137 121.2545 54.5465 18.3129 179.6201 335 W 3.9936 7.9336 116.9728 59.9443 29.2890 177.9194 336 Q 3.9087 8.1144 119.5174 59.7777 28.2739 178.8328 337 Y 3.8801 7.6983 118.3172 60.3410 37.8838 177.6038 338 L 3.8780 7.6018 121.3678 58.5004 41.9243 179.1845 339 G 3.6373 8.7893 105.9146 48.1417 0.0000 175.7865 340 T 3.9520 8.0903 112.9916 64.2887 68.7108 176.7010 341 T 3.9846 8.8478 119.4361 66.7674 68.5645 176.7621 342 Q 4.1721 8.2919 119.7633 58.6975 28.7789 178.5542 343 A 4.0202 8.4878 122.3606 55.3868 18.2501 179.3490 344 E 4.2141 8.4353 116.6578 59.3852 29.8647 177.8272 345 N 4.6076 8.4909 114.0220 53.8023 38.9153 174.7384 346 E 3.8469 7.7796 116.7619 58.5481 28.1380 176.3413 347 Q 4.4216 8.1492 120.9932 54.8092 25.5684 175.8730 348 E 3.9717 7.8845 123.4387 58.9427 30.3191 177.8978 349 L 3.9694 7.7885 118.7016 57.9247 41.8297 179.2854 350 L 3.9098 7.8965 118.0784 57.3912 41.4089 179.3301 351 A 4.0810 8.2160 120.9609 55.2639 18.3988 179.5519 352 I 3.4646 7.5289 117.8139 64.6148 37.1131 178.3745 353 S 4.0908 8.1712 113.5466 61.5792 62.1027 176.2707 354 A 4.1362 8.6327 123.4884 55.3025 18.1564 179.6588 355 L 3.9709 8.7556 117.8236 57.6812 41.5696 180.1319 356 R 3.8931 8.3073 118.8872 59.2834 29.9788 179.1667 357 R 3.5409 7.3803 117.5933 58.8034 29.7345 178.6280 358 C 4.0136 7.9073 118.6715 62.6699 31.6021 175.8314 359 L 4.2190 7.6610 120.0309 57.3787 40.9012 179.2334 360 E 4.0148 7.7743 118.2961 59.4064 29.4205 178.9010 361 L 4.4409 7.1247 117.3796 55.8560 42.7132 176.9668 362 K 4.3456 8.0927 120.1321 53.7492 32.7815 174.4371 363 P 4.3611 0.0000 0.0000 63.6491 31.5934 177.2392 364 D 3.5506 7.2477 117.3137 52.6893 39.5887 176.8253 365 N 4.4082 7.5657 118.9587 54.1470 38.2811 175.1329 366 Q 4.1343 8.4314 128.0967 58.7648 29.0262 178.4255 367 T 4.0277 8.0490 110.4374 64.8248 69.1709 176.5406 368 A 4.2171 8.5871 123.7291 54.6166 18.1939 179.5137 369 L 4.0125 8.2461 117.9953 58.2457 41.8938 179.0197 370 M 3.8788 8.4838 117.8205 58.7861 32.1431 178.3741 371 A 3.9570 8.6004 121.2140 55.0447 18.7319 179.3852 372 L 3.7051 7.8789 118.4026 57.9059 42.0353 179.1980 373 A 4.1374 8.2562 121.2943 55.0581 18.3560 179.5122 374 V 3.5349 7.7379 116.7985 66.4913 31.3389 178.2214 375 S 4.2290 7.6252 112.9513 62.2071 62.8718 176.3002 376 F 4.5763 8.2069 119.8938 60.6171 38.6168 178.1426 377 T 4.0710 8.3831 114.9737 66.9555 68.2493 176.1232 378 N 4.5033 8.2487 117.0041 55.8162 38.7854 176.3099 379 E 4.4567 8.5035 119.0241 55.5314 29.3991 177.1460 380 S 4.0536 7.6721 112.2601 58.7708 61.7332 174.1441 381 L 4.3612 7.2823 121.4037 53.6131 37.5398 177.2807 382 Q 3.9788 7.7564 121.9739 59.1090 29.3289 177.7990 383 R 3.8296 8.0505 118.7425 60.2374 29.8190 178.0562 384 Q 3.9009 7.6515 116.2930 58.8885 28.6408 178.6807 385 A 4.2355 7.5270 121.7538 55.6095 18.3047 179.5625 386 C 4.1287 8.0765 115.1503 62.9061 28.1174 176.1036 387 E 4.0340 8.0931 119.7682 59.4592 29.1125 179.3929 388 I 3.9051 8.3073 120.2547 64.4791 37.0606 178.5173 389 L 4.3895 8.2806 119.1012 57.6233 41.6578 179.4298 390 R 4.2068 8.6398 119.3412 59.6240 30.2496 178.1333 391 D 4.3958 8.4781 118.9664 57.3140 39.9190 178.6327 392 W 4.2629 9.0130 129.1757 60.4729 30.4201 177.7705 393 L 4.2432 8.0185 120.2473 57.4649 41.7663 177.9066 394 R 4.0287 7.8322 113.6921 58.1059 29.9419 176.4325 395 Y 4.5344 7.5403 114.7268 57.9864 37.8524 175.6691 396 T 4.1656 6.7446 115.7447 60.9655 68.7465 173.1771 397 P 3.8820 0.0000 0.0000 65.4451 31.7422 177.9905 398 A 3.9216 7.6095 119.8321 54.4446 18.6540 177.4417 399 Y 4.6906 8.1251 111.7564 57.7015 38.9820 177.4616 400 A 4.0626 7.9828 124.6802 55.3733 18.6142 179.6768 401 H 4.3122 8.1277 109.9147 58.2327 28.7509 176.7359 402 L 3.9245 7.3709 119.1112 56.3977 41.6342 177.0045 403 V 4.0901 7.2861 118.7359 61.2884 32.4166 176.0183 *420 R 4.2456 8.3188 126.3609 55.6653 30.7346 176.2103 421 I 4.5895 7.0012 117.3595 62.3739 44.5110 175.5030 422 L 4.1444 7.7429 119.8744 54.8046 42.5206 178.8345 423 G 3.9921 8.6168 106.7938 46.7354 0.0000 173.0835 424 S 4.6676 8.0000 114.5344 56.2268 66.3887 173.2616 425 L 3.9545 7.7448 121.4070 57.2236 41.8616 177.3727 426 L 3.9442 7.6820 122.9766 55.9376 42.3752 178.2179 427 S 4.5611 7.8956 117.6578 57.3988 63.5606 175.6616 428 D 4.6144 7.4592 120.5723 55.4546 42.0493 178.4692 429 S 4.2134 8.6513 116.8471 61.4819 63.0842 176.5992 430 L 3.9130 7.8825 122.5394 58.1400 41.8713 178.5283 431 F 4.0663 8.2122 119.9484 61.3810 39.3705 176.7240 432 L 3.2347 7.6588 119.7946 57.7669 41.8405 177.9908 433 E 3.7688 8.4196 119.7619 59.3290 29.4443 178.7448 434 V 3.5778 7.7771 117.7151 65.9971 31.5298 177.6640 435 K 3.3836 7.4429 118.9963 59.9115 32.0025 178.4655 436 E 3.9337 8.0126 117.8585 58.6752 29.3039 179.4763 437 L 3.9574 7.8264 119.7262 57.8977 41.7268 179.4257 438 F 3.8756 8.6414 117.8798 60.3373 38.5571 177.8090 439 L 4.1004 8.1179 117.9441 57.2010 41.6114 179.2356 440 A 4.0700 7.8191 120.5643 54.9977 18.4240 179.0915 441 A 3.8501 7.8327 119.3598 55.5953 18.1831 179.7314 442 V 3.4831 7.3903 116.0275 66.6257 31.3963 178.3575 443 R 4.0005 7.7502 114.8839 57.7687 29.9857 178.3796 444 L 4.4441 7.5021 119.2389 56.4978 42.4885 177.5678 445 D 4.5584 7.7614 122.6279 52.1401 41.9522 173.0814 446 P 4.6179 0.0000 0.0000 62.8746 32.0426 177.7285 447 T 4.0071 7.7788 110.3727 64.4175 68.9684 175.1465 448 S 4.6961 7.7570 114.7405 56.2343 65.1436 172.8897 449 I 4.3513 8.0339 121.1401 59.3763 39.0660 175.4805 450 D 4.7409 8.6375 125.4425 52.7821 42.0830 174.9931 451 P 4.3817 0.0000 0.0000 65.6161 31.8102 178.0531 452 D 4.1788 8.3471 118.8145 56.7091 40.6029 178.8558 453 V 3.5092 7.8071 118.5714 66.2367 31.8860 178.0162 454 Q 3.9550 7.9740 117.6696 58.9979 28.4599 178.0766 455 C 3.9874 8.3458 120.2695 62.2623 31.5206 175.4747 456 G 3.4831 7.7613 106.4728 47.9638 0.0000 174.8200 457 L 3.6660 8.4540 123.7609 57.4532 42.1029 179.3696 458 G 2.9309 7.9325 105.7670 47.5248 0.0000 175.4578 459 V 3.7410 7.8484 121.5587 65.7865 31.4306 178.0453 460 L 3.9431 7.7774 118.2795 58.0349 41.3758 179.6064 461 F 4.3630 7.9495 118.7751 59.7746 38.7817 177.4258 462 N 4.4855 8.2727 116.6828 56.6692 38.6346 176.8381 463 L 3.9912 7.5888 118.8767 57.8514 41.7784 179.3656 464 S 4.0301 8.0396 112.6291 59.2220 62.8342 175.7890 465 G 3.3223 7.5720 111.0196 45.7323 0.0000 175.2290 466 E 4.1894 7.3447 120.7403 55.8300 27.0987 176.6454 467 Y 4.3587 7.7009 121.3255 60.8878 38.7278 176.9479 468 D 4.3799 8.1588 119.4579 56.2551 39.4274 178.5993 469 K 3.6979 7.8294 119.5249 58.9734 32.0101 178.9329 470 A 3.9708 7.5811 120.4078 54.7300 18.1904 179.5820 471 V 3.6172 8.1118 117.1885 66.5670 31.7537 177.6685 472 D 4.3460 7.9039 117.8403 57.8885 40.6787 179.2374 473 C 4.6533 7.5975 117.6338 62.5343 28.3454 176.1298 474 F 4.2316 8.3821 119.5246 60.9261 38.5081 178.0056 475 T 3.7893 8.3314 115.6114 66.1893 67.8570 176.8802 476 A 3.9203 7.8983 122.2010 55.0410 18.3651 179.3172 477 A 3.8603 7.9988 119.3319 55.5968 18.0488 179.9586 478 L 3.9967 7.7616 117.2980 57.5816 41.4006 179.3759 479 S 4.3765 7.7694 112.3484 60.0695 62.9266 175.4333 480 V 4.2657 7.0611 120.9146 63.0571 33.9666 175.6849 481 R 4.6425 7.9824 118.5254 53.5926 29.6545 174.3152 482 P 4.8535 0.0000 0.0000 63.7556 31.9912 177.6465 483 N 4.9288 8.1280 115.4380 53.4529 39.0627 175.4529 484 D 4.5608 8.1492 120.6987 53.1499 40.4321 175.9639 485 Y 4.4690 8.2919 125.6703 59.3892 38.1141 177.7104 486 L 3.9382 7.0658 121.9346 58.4219 42.0298 178.9408 487 L 4.0342 7.8256 117.8226 56.9537 41.5757 179.3149 488 W 3.8874 8.2595 119.2693 59.7032 29.0070 177.6081 489 N 4.5985 8.4364 116.7896 57.0584 38.2837 176.8067 490 K 3.6619 7.7987 119.0251 59.3669 32.0468 178.9731 491 L 3.7672 7.8480 120.9281 57.9404 41.7829 179.3509 492 G 2.8823 8.2546 105.8623 47.2999 0.0000 175.5387 493 A 4.2530 8.1302 125.0134 54.8369 18.3701 179.7706 494 T 3.8123 8.0042 114.4104 66.8811 68.4795 176.8660 495 L 3.9564 8.0813 120.6312 57.7005 41.6392 179.4025 496 A 4.0453 8.1860 121.0719 55.1408 18.0633 179.3705 497 N 4.2071 8.1855 114.4468 55.1989 38.3840 176.6970 498 G 3.9965 7.2011 105.9964 43.4495 0.0000 173.1013 499 N 4.1664 7.5693 115.2962 54.4184 37.3876 176.0910 500 Q 4.5299 7.9985 115.2536 54.9751 25.9194 175.9742 501 S 4.1509 7.7047 119.2043 61.4327 63.3851 176.0953 502 E 3.9434 8.0630 121.7038 59.2716 29.4021 178.5218 503 E 3.9857 8.1267 117.9463 58.9647 29.4237 179.1455 504 A 3.5993 7.9768 121.0520 55.0304 18.5448 179.3759 505 V 3.5970 7.7322 116.5681 66.5115 31.5014 177.7455 506 A 3.9448 7.7861 119.6672 55.3515 18.1635 179.4709 507 A 4.1279 7.5892 118.8803 55.6260 18.3521 179.5145 508 Y 4.3560 7.8565 115.5472 61.3674 37.8662 178.8596 509 R 3.9241 8.5383 119.4275 59.4069 30.2858 179.0975 510 R 3.5549 7.7769 118.1234 58.9937 29.8360 178.5329 511 A 4.0845 7.9067 120.6947 55.2323 18.3103 179.5769 512 L 4.0165 8.2683 117.8114 57.8103 41.4128 179.2857 513 E 3.9637 8.1596 118.0779 59.8826 29.5962 179.5236 514 L 4.3701 7.4373 116.3362 56.5040 42.5751 177.4679 515 Q 4.2150 8.3679 120.1699 54.0868 29.8722 172.3989 516 P 4.4364 0.0000 0.0000 64.2858 31.6373 177.6174 517 G 3.9757 7.9858 105.0984 45.8462 0.0000 174.4086 518 Y 4.6941 7.9871 123.8829 56.0084 37.2897 175.7999 519 I 3.5834 7.6861 126.2751 64.2292 37.7910 176.8848 520 R 3.7929 7.8749 118.7829 60.0507 29.6749 178.4196 521 S 4.1645 7.8636 114.4069 61.3976 62.9117 176.6597 522 R 3.9075 8.1412 121.8182 59.1308 29.6640 177.9610 523 Y 4.3700 7.7440 119.1156 60.7669 38.9480 176.6750 524 N 3.6802 8.2182 117.6430 56.4202 38.7011 176.6713 525 L 4.0218 7.5731 121.5685 58.5236 41.8047 179.5275 526 G 3.0114 7.3983 103.7708 47.3940 0.0000 175.4187 527 I 3.9361 7.8256 122.5040 64.6172 37.0462 178.5942 528 S 4.1585 8.3360 115.9383 61.8919 62.5291 176.8140 529 C 4.0764 7.8519 119.1038 62.8495 27.8617 176.0858 530 I 3.7402 7.8203 121.4087 64.4605 36.5266 177.9713 531 N 4.5912 7.6917 114.9477 54.8072 38.4196 176.1371 532 L 4.6289 7.8533 119.0497 53.7781 42.7159 177.2432 533 G 3.7069 7.8609 106.9268 45.8513 0.0000 175.2375 534 A 4.3151 7.2627 123.4641 51.2279 15.3785 177.5388 535 H 4.1923 7.7054 123.2158 58.1080 29.4335 177.2853 536 R 3.8685 8.0057 120.0099 59.6441 29.9928 177.7759 537 E 3.8829 8.2407 118.1681 59.2456 29.4099 178.7720 538 A 3.4748 7.7645 120.6485 54.8876 18.4639 179.3625 539 V 3.4538 7.8394 117.2426 66.3609 31.3480 177.9046 540 E 3.7544 8.0766 118.0831 59.9175 29.3539 179.1930 541 H 4.1289 7.5642 115.9216 58.9207 28.5766 177.9761 542 F 4.5347 7.8771 119.6592 60.4262 38.6584 177.8284 543 L 3.8214 7.9084 118.8150 57.7239 41.4197 179.3199 544 E 3.9122 8.3672 118.4589 59.1820 29.3609 179.2759 545 A 3.9255 8.0088 120.6854 55.1596 18.4692 179.3125 546 L 3.6591 7.8722 117.7740 58.0689 41.6038 179.4519 547 N 4.2458 8.1623 116.4733 57.1216 38.9660 176.6812 548 M 3.8990 8.0789 119.9639 58.5411 31.7550 178.8932 549 Q 3.9695 7.7983 117.3425 58.8482 29.0657 178.3573 550 R 4.3185 8.0527 121.1293 59.0044 29.9703 178.7724 551 K 4.2478 8.6224 117.3672 58.1571 32.1841 177.0387 552 S 4.3190 7.6064 112.9777 57.8939 61.4164 173.9445 553 R 4.4972 7.8837 126.3582 58.9439 30.3267 176.6713 554 G 3.7851 8.0541 100.3068 43.8292 0.0000 171.4280 555 P 4.4790 0.0000 0.0000 63.2138 32.0248 176.3888 556 R 4.2234 7.8278 118.7285 56.2928 33.0381 176.9208 557 G 3.2523 9.6815 110.8854 48.8609 0.0000 177.4142 558 E 3.2235 8.9540 120.1650 58.4889 31.6970 174.4445 559 G 3.8776 8.7543 105.5773 43.9374 0.0000 171.7992 560 G 4.3136 8.7648 105.9666 42.6184 0.0000 171.6719 561 A 4.3416 8.7275 128.1338 52.3022 18.5261 176.5250 562 M 4.7057 8.4568 122.5125 54.6014 34.2319 176.6371 563 S 4.6122 8.3784 117.9273 57.7465 65.1305 175.9459 564 E 4.2140 8.7519 125.5073 59.1364 29.2660 178.7703 565 N 4.1660 8.1805 117.0025 57.1841 38.8568 176.7982 566 I 3.1802 7.2648 120.1133 63.5313 37.1734 178.3979 567 W 4.0143 7.7943 119.8106 59.6147 28.6708 178.6055 568 S 4.1441 8.4391 114.5700 61.9766 62.3570 176.6089 569 T 3.7377 7.5644 119.2669 65.9433 67.9727 176.3369 570 L 3.9264 7.4858 122.1907 58.2268 42.1302 179.1151 571 R 3.8521 8.0627 118.0127 59.1871 29.9523 178.8896 572 L 3.8522 7.6666 119.6505 57.9788 42.2155 178.6717 573 A 4.0704 8.1722 120.8401 55.3914 18.3111 179.5730 574 L 4.1089 8.3037 117.6694 57.9567 41.3918 180.0527 575 S 4.6198 7.4649 115.6600 61.5458 62.9675 176.4611 576 M 4.1802 7.8165 118.9656 57.2513 31.6891 178.1592 577 L 4.2629 7.5484 120.2719 56.2823 42.4270 177.7051 578 G 4.0014 8.2336 104.8807 45.6862 0.0000 174.4435 579 Q 4.3245 8.0148 121.6787 54.4984 27.5470 176.1775 580 S 2.7900 7.8440 119.2751 61.1804 63.3773 176.8469 581 D 4.4094 7.8433 116.0716 54.7267 39.3238 176.8692 582 A 4.6115 8.3317 122.1076 52.9676 19.3828 178.4930 583 Y 4.3504 8.3147 116.7896 60.7926 38.1420 178.0771 584 G 3.7058 8.3031 106.0543 47.7938 0.0000 175.3664 585 A 4.0375 8.1094 122.5098 54.8990 18.3958 179.2493 586 A 4.2192 7.9010 119.2994 55.7536 18.2178 179.6288 587 D 4.2666 7.9807 115.8395 56.7907 41.0386 177.9332 588 A 4.1490 7.5529 118.3161 51.5235 18.8596 177.2835 589 R 2.5100 6.9311 115.1174 57.0785 28.0523 177.4666 590 D 4.7425 7.7634 119.2209 52.6509 39.9249 175.2761 591 L 4.2213 8.3491 126.4912 57.8055 42.4404 178.0698 592 S 4.2849 8.2123 114.6299 62.0597 62.8377 176.7531 593 T 3.9137 7.9849 118.3214 66.5543 68.2272 176.4993 594 L 4.1758 7.8790 120.4086 58.0353 41.6691 179.2250 595 L 4.0627 8.5484 118.9351 58.7054 41.7445 180.0025 596 T 3.8983 7.8283 114.8504 66.9596 68.1294 176.5912 597 M 4.0117 7.9581 119.7644 57.8469 32.0253 177.8246 598 F 4.4688 8.1501 114.8798 56.1838 39.9195 175.6512 599 G 3.8322 7.9867 106.0457 47.0529 0.0000 173.9505 600 L 4.8338 7.8476 117.9435 51.4159 44.5720 175.4391 601 P 4.3789 0.0000 0.0000 62.4669 31.9849 176.4438 602 Q 4.1801 8.8776 119.5397 56.6882 28.6125 176.9034 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 285 K 8.30 4.35 0.00 1.79 1.69 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.02 7.81 286 G 8.36 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 0.00 0.00 0.00 287 Y 11.37 2.87 0.00 3.12 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 0.00 288 Q 7.66 4.32 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 289 F 8.53 4.51 0.00 3.19 3.06 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 0.00 290 E 9.53 4.01 0.00 2.00 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 2.38 2.40 0.00 291 E 8.64 4.17 0.00 2.05 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 0.00 2.37 2.39 0.00 292 E 8.61 3.52 0.00 2.23 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 0.00 2.18 2.36 0.00 293 N 7.69 4.77 0.00 2.94 2.74 0.00 0.00 6.81 7.71 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 0.00 294 P 0.00 4.35 0.00 2.21 2.17 0.00 3.79 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 295 L 8.15 4.66 0.00 1.78 1.61 0.90 0.56 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 0.00 296 R 7.71 3.83 0.00 1.82 1.94 0.00 3.19 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 297 D 7.91 4.68 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 H 7.65 4.10 0.00 3.27 3.18 0.00 5.79 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 299 P 0.00 4.20 0.00 2.05 2.08 0.00 3.40 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 300 Q 7.82 4.48 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 301 P 0.00 4.23 0.00 2.49 2.23 0.00 3.55 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 302 F 8.18 4.41 0.00 3.10 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 0.00 303 E 9.37 3.55 0.00 2.11 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 2.27 2.21 0.00 304 E 7.75 3.96 0.00 2.25 1.79 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 2.28 2.31 0.00 305 G 8.26 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 0.00 0.00 0.00 306 L 7.51 3.87 0.00 1.56 1.67 0.19 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 307 R 7.79 3.82 0.00 1.92 1.85 0.00 3.11 0.00 0.00 3.11 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 308 R 7.94 3.82 0.00 1.86 2.07 0.00 3.21 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 309 L 7.96 3.97 0.00 1.95 2.08 1.08 0.95 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 0.00 310 Q 8.34 3.83 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 311 E 8.03 4.40 0.00 1.93 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 0.00 2.31 2.47 0.00 312 G 8.85 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 0.00 0.00 0.00 313 D 8.07 4.69 0.00 2.73 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 0.00 314 L 8.20 4.07 0.00 1.79 1.79 1.03 1.16 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 0.00 315 P 0.00 4.28 0.00 2.16 2.14 0.00 3.79 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 316 N 8.29 4.36 0.00 2.90 2.78 0.00 0.00 6.97 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 317 A 7.84 3.64 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.38 3.80 2.43 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 1.22 0.00 0.00 1.21 0.00 0.00 319 L 7.68 4.15 0.00 1.86 1.88 0.96 0.66 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 0.00 320 L 7.68 3.87 0.00 1.50 1.44 0.77 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 321 F 7.89 4.38 0.00 3.13 3.14 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 0.00 0.00 0.00 322 E 8.75 3.91 0.00 2.28 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 2.68 2.72 0.00 323 A 8.00 3.85 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 0.00 324 A 7.91 3.94 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 0.00 325 V 7.58 3.78 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.37 0.00 0.00 326 Q 7.20 3.91 0.00 1.84 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.99 0.00 0.00 0.00 0.00 0.00 1.47 1.16 0.00 327 Q 7.60 4.36 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.96 0.00 0.00 0.00 0.00 0.00 2.59 2.35 0.00 328 D 7.85 4.68 0.00 2.74 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 0.00 329 P 0.00 4.88 0.00 2.23 2.36 0.00 3.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 330 K 7.86 4.32 0.00 1.91 1.89 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.43 7.81 331 H 8.13 4.45 0.00 3.36 3.14 0.00 5.61 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 332 M 8.52 4.22 0.00 2.12 2.09 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 2.67 2.57 0.00 333 E 8.20 4.00 0.00 2.04 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 2.69 2.53 0.00 334 A 7.31 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 335 W 7.93 3.99 0.00 3.57 3.14 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 0.00 0.00 0.00 336 Q 8.11 3.91 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.83 0.00 0.00 0.00 0.00 0.00 2.03 2.31 0.00 337 Y 7.70 3.88 0.00 2.57 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 338 L 7.60 3.88 0.00 1.84 1.84 1.21 0.28 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 0.00 339 G 8.79 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 340 T 8.09 3.95 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 1.13 0.00 0.00 341 T 8.85 3.98 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 342 Q 8.29 4.17 0.00 2.40 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.65 2.82 0.00 343 A 8.49 4.02 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 0.00 344 E 8.44 4.21 0.00 2.21 2.33 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 2.58 2.77 0.00 345 N 8.49 4.61 0.00 2.91 3.03 0.00 0.00 7.32 7.51 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 0.00 346 E 7.78 3.85 0.00 2.22 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 2.21 2.44 0.00 347 Q 8.15 4.42 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.64 0.00 348 E 7.88 3.97 0.00 2.09 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 2.52 2.47 0.00 349 L 7.79 3.97 0.00 1.71 1.67 0.92 0.70 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 0.00 350 L 7.90 3.91 0.00 1.79 1.61 0.78 0.11 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 0.00 351 A 8.22 4.08 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 352 I 7.53 3.46 1.97 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 0.85 0.42 0.79 0.00 0.00 353 S 8.17 4.09 0.00 3.99 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 354 A 8.63 4.14 1.70 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 0.00 355 L 8.76 3.97 0.00 1.82 1.67 0.85 1.09 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 0.00 356 R 8.31 3.89 0.00 2.00 1.91 0.00 3.21 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 357 R 7.38 3.54 0.00 0.67 0.66 0.00 3.07 0.00 0.00 2.82 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.69 0.00 358 C 7.91 4.01 0.00 3.14 3.06 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 0.00 359 L 7.66 4.22 0.00 1.65 1.67 0.97 1.34 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 0.00 360 E 7.77 4.01 0.00 2.00 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 2.29 2.47 0.00 361 L 7.12 4.44 0.00 1.88 1.71 0.99 0.78 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 0.00 362 K 8.09 4.35 0.00 1.68 1.57 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.26 7.81 363 P 0.00 4.36 0.00 2.07 2.13 0.00 3.28 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.88 0.00 364 D 7.25 3.55 0.00 2.49 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 0.00 0.00 0.00 365 N 7.57 4.41 0.00 2.72 2.78 0.00 0.00 7.23 7.68 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 0.00 366 Q 8.43 4.13 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.70 0.00 0.00 0.00 0.00 0.00 2.18 2.45 0.00 367 T 8.05 4.03 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 1.27 0.00 0.00 368 A 8.59 4.22 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 0.00 369 L 8.25 4.01 0.00 2.23 2.01 1.07 0.79 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 0.00 370 M 8.48 3.88 0.00 2.14 1.85 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 371 A 8.60 3.96 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 0.00 372 L 7.88 3.71 0.00 1.85 1.88 0.46 1.27 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 0.00 373 A 8.26 4.14 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 0.00 374 V 7.74 3.53 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 1.06 0.00 0.00 0.99 0.00 0.00 375 S 7.63 4.23 0.00 3.84 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 0.00 376 F 8.21 4.58 0.00 3.34 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 0.00 377 T 8.38 4.07 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 378 N 8.25 4.50 0.00 2.97 2.95 0.00 0.00 7.12 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 0.00 379 E 8.50 4.46 0.00 2.20 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 2.44 2.55 0.00 380 S 7.67 4.05 0.00 4.05 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 0.00 381 L 7.28 4.36 0.00 1.79 1.64 1.08 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 382 Q 7.76 3.98 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.29 0.00 383 R 8.05 3.83 0.00 1.80 1.81 0.00 3.12 0.00 0.00 3.28 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 384 Q 7.65 3.90 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.63 0.00 0.00 0.00 0.00 0.00 1.90 2.16 0.00 385 A 7.53 4.24 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 0.00 386 C 8.08 4.13 0.00 3.14 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 0.00 387 E 8.09 4.03 0.00 2.20 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 2.39 2.49 0.00 388 I 8.31 3.91 2.09 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 479 S 7.77 4.38 0.00 4.08 3.99 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 0.00 480 V 7.06 4.27 2.24 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 0.92 0.00 0.00 0.95 0.00 0.00 481 R 7.98 4.64 0.00 1.85 1.83 0.00 3.19 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 482 P 0.00 4.85 0.00 2.36 2.34 0.00 3.45 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 483 N 8.13 4.93 0.00 2.82 2.98 0.00 0.00 6.91 8.06 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 0.00 484 D 8.15 4.56 0.00 2.72 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 0.00 485 Y 8.29 4.47 0.00 3.23 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 0.00 486 L 7.07 3.94 0.00 1.25 1.70 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 504 A 7.98 3.60 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 0.00 505 V 7.73 3.60 2.23 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 0.95 0.00 0.00 1.01 0.00 0.00 506 A 7.79 3.94 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 0.00 507 A 7.59 4.13 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 0.00 508 Y 7.86 4.36 0.00 3.15 3.04 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 0.00 509 R 8.54 3.92 0.00 1.91 1.93 0.00 3.10 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 510 R 7.78 3.55 0.00 1.30 1.39 0.00 2.68 0.00 0.00 2.63 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 511 A 7.91 4.08 1.72 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 0.00 0.00 512 L 8.27 4.02 0.00 1.83 1.73 0.90 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 513 E 8.16 3.96 0.00 2.03 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 0.00 2.29 2.41 0.00 514 L 7.44 4.37 0.00 1.83 1.80 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 515 Q 8.37 4.21 0.00 0.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.74 0.00 0.00 0.00 0.00 0.00 1.76 1.43 0.00 516 P 0.00 4.44 0.00 2.05 2.09 0.00 3.69 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 517 G 7.99 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 0.00 518 Y 7.99 4.69 0.00 3.05 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 0.00 519 I 7.69 3.58 1.99 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 1.53 0.72 0.83 0.00 0.00 520 R 7.87 3.79 0.00 1.68 1.56 0.00 2.59 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.53 0.00 521 S 7.86 4.16 0.00 4.19 4.01 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 0.00 522 R 8.14 3.91 0.00 1.85 2.01 0.00 3.14 0.00 0.00 3.08 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.58 0.00 523 Y 7.74 4.37 0.00 2.97 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 0.00 524 N 8.22 3.68 0.00 1.62 1.42 0.00 0.00 6.74 6.76 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 0.00 525 L 7.57 4.02 0.00 1.71 1.68 0.99 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 526 G 7.40 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 0.00 0.00 0.00 527 I 7.83 3.94 1.77 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.23 0.82 0.00 0.00 528 S 8.34 4.16 0.00 4.09 3.99 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 0.00 529 C 7.85 4.08 0.00 3.13 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 I 7.82 3.74 1.99 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.52 1.01 0.00 0.00 531 N 7.69 4.59 0.00 2.97 2.87 0.00 0.00 6.92 7.73 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 0.00 532 L 7.85 4.63 0.00 1.68 1.64 0.93 1.10 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 G 7.86 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 534 A 7.26 4.32 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 0.00 535 H 7.71 4.19 0.00 3.25 3.39 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 R 8.01 3.87 0.00 1.95 1.95 0.00 3.26 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.85 0.00 537 E 8.24 3.88 0.00 2.00 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 2.27 2.25 0.00 538 A 7.76 3.47 1.29 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 0.00 0.00 0.00 539 V 7.84 3.45 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 -0.04 0.00 0.00 0.95 0.00 0.00 540 E 8.08 3.75 0.00 1.98 1.84 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 2.30 2.27 0.00 541 H 7.56 4.13 0.00 2.85 3.30 0.00 5.62 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 0.00 542 F 7.88 4.53 0.00 3.11 2.81 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 0.00 0.00 0.00 543 L 7.91 3.82 0.00 1.77 1.64 0.67 0.89 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 0.00 544 E 8.37 3.91 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 2.31 2.39 0.00 545 A 8.01 3.93 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 0.00 546 L 7.87 3.66 0.00 1.60 1.42 -0.21 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 547 N 8.16 4.25 0.00 2.93 2.88 0.00 0.00 7.29 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 M 8.08 3.90 0.00 2.10 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 2.70 2.58 0.00 549 Q 7.80 3.97 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.95 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 550 R 8.05 4.32 0.00 1.91 2.14 0.00 3.19 0.00 0.00 3.33 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 551 K 8.62 4.25 0.00 1.94 1.87 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.45 7.81 552 S 7.61 4.32 0.00 3.84 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 0.00 553 R 7.88 4.50 0.00 1.84 1.96 0.00 3.45 0.00 0.00 2.62 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.53 0.00 554 G 8.05 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 0.00 0.00 0.00 555 P 0.00 4.48 0.00 2.18 2.32 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 556 R 7.83 4.22 0.00 1.83 1.83 0.00 3.13 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 557 G 9.68 3.25 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 0.00 558 E 8.95 3.22 0.00 2.20 2.26 0.00 0.00 0.00 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 2.29 0.00 559 G 8.75 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 0.00 0.00 0.00 560 G 8.76 4.31 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 0.00 561 A 8.73 4.34 1.28 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 0.00 0.00 562 M 8.46 4.71 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.70 0.00 563 S 8.38 4.61 0.00 3.70 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 0.00 564 E 8.75 4.21 0.00 1.99 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 2.43 2.30 0.00 565 N 8.18 4.17 0.00 2.71 2.54 0.00 0.00 7.25 7.40 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 0.00 566 I 7.26 3.18 1.52 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 -0.17 0.49 0.00 0.00 567 W 7.79 4.01 0.00 3.49 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 0.00 568 S 8.44 4.14 0.00 4.01 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 0.00 569 T 7.56 3.74 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 0.88 0.00 0.00 570 L 7.49 3.93 0.00 1.67 1.87 0.94 0.83 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 0.00 571 R 8.06 3.85 0.00 2.01 1.89 0.00 3.43 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 572 L 7.67 3.85 0.00 1.88 1.69 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 573 A 8.17 4.07 1.61 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 0.00 574 L 8.30 4.11 0.00 1.77 1.83 1.02 1.16 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 0.00 575 S 7.46 4.62 0.00 3.97 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 0.00 576 M 7.82 4.18 0.00 1.58 1.86 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 2.75 2.49 0.00 577 L 7.55 4.26 0.00 1.88 2.03 1.06 1.50 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 0.00 578 G 8.23 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 0.00 579 Q 8.01 4.32 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.72 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 580 S 7.84 2.79 0.00 3.65 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 D 7.84 4.41 0.00 2.74 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 0.00 582 A 8.33 4.61 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 583 Y 8.31 4.35 0.00 3.08 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 0.00 584 G 8.30 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 585 A 8.11 4.04 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 586 A 7.90 4.22 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 0.00 587 D 7.98 4.27 0.00 2.86 2.70 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 0.00 588 A 7.55 4.15 1.29 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 0.00 0.00 0.00 589 R 6.93 2.51 0.00 1.45 1.56 0.00 2.40 0.00 0.00 2.60 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.50 0.00 590 D 7.76 4.74 0.00 2.79 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 0.00 591 L 8.35 4.22 0.00 2.12 1.82 0.89 0.96 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 0.00 592 S 8.21 4.28 0.00 4.10 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 0.00 593 T 7.98 3.91 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 594 L 7.88 4.18 0.00 2.07 1.93 1.24 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 595 L 8.55 4.06 0.00 1.86 1.80 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 596 T 7.83 3.90 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 0.00 597 M 7.96 4.01 0.00 1.70 2.33 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.54 0.00 598 F 8.15 4.47 0.00 3.09 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 G 7.99 3.83 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 0.00 0.00 0.00 600 L 7.85 4.83 0.00 1.82 1.59 0.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 601 P 0.00 4.38 0.00 2.18 2.06 0.00 3.81 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 1.99 1.99 0.00 602 Q 8.88 4.18 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.68 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 * Residues marked with a * may have inaccurate shift predictions.