NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 503 A 4.2991 8.2493 123.5812 51.4578 20.6389 176.3583 504 I 4.2849 7.4784 109.0570 58.0760 39.7796 169.7701 505 V 4.3417 8.0566 120.4138 60.7496 35.0573 175.9171 506 N 4.5478 8.8598 125.7218 54.0501 39.3103 174.0029 507 A 4.7140 8.9441 125.5670 51.7111 19.7952 176.2175 508 Q 4.2503 8.7790 117.9232 55.8274 29.3277 175.9039 509 P 4.5358 0.0000 0.0000 65.3694 31.6018 176.6453 510 K 4.6171 7.3205 115.3388 55.5769 36.1687 175.6789 511 C 4.6118 8.1735 120.4204 55.4996 42.4408 172.4779 512 N 4.5915 8.4099 122.8733 51.9196 36.8636 174.2860 513 P 4.3918 0.0000 0.0000 64.5722 31.8742 176.7184 514 N 4.5127 7.5357 116.9229 52.8999 39.4607 175.5523 515 L 4.5063 8.6330 126.8334 53.6245 42.0328 173.0060 516 H 4.6067 8.5783 119.1295 55.5302 29.2532 173.8523 517 Y 4.9938 8.3682 122.4769 54.7277 40.9910 174.7560 518 W 5.5869 7.6263 116.3897 54.3356 31.8176 173.7254 519 T 4.5399 8.5501 113.9024 62.4719 70.4029 171.8433 520 T 5.0499 8.9501 115.6681 60.0755 68.7029 173.4873 521 Q 4.6429 9.1885 125.8312 53.9657 33.4409 175.9630 522 D 4.4206 8.3825 115.6904 54.1750 45.9560 175.1037 *525 A 4.2963 8.1955 119.2778 52.6024 19.5195 176.1535 526 A 4.6550 8.4504 123.1070 51.9197 19.6261 176.9077 527 I 4.6079 7.5706 112.9728 62.0874 41.3880 175.3034 528 G 3.7173 8.4124 109.6425 47.6511 0.0000 174.1031 529 L 4.3338 8.1070 122.3703 54.1200 42.3106 177.8584 530 A 4.0347 8.0291 125.0700 55.1383 18.3647 180.2141 531 W 4.3502 8.1201 111.5069 59.1970 28.8424 176.9093 532 I 3.3994 6.2763 121.2204 60.4624 36.7349 174.5320 533 P 4.2181 0.0000 0.0000 65.9927 31.4522 176.8340 534 Y 4.0024 8.2364 116.9284 60.4313 38.4882 176.3654 535 F 4.4039 7.8167 116.0133 56.8058 41.5891 177.2138 536 G 4.0164 8.4038 109.5005 45.6871 0.0000 173.3373 537 P 4.3570 0.0000 0.0000 62.1477 31.9079 174.9958 538 A 4.6160 7.9609 122.4067 50.2310 21.3640 177.4801 539 A 4.0152 8.5334 120.1976 54.5539 18.3920 178.3186 540 E 4.9624 8.1518 112.8623 56.1312 29.6184 176.6459 541 G 4.1684 7.8107 106.4993 45.5026 0.0000 175.3321 542 I 3.3195 7.4166 112.7223 63.2697 37.8346 175.9408 543 Y 4.8887 6.7896 118.1642 57.8322 38.8425 174.9131 544 T 4.7497 8.9198 115.3252 60.4433 70.8799 173.7814 545 E 4.4590 9.1306 128.0716 55.8776 31.2057 175.9959 546 G 3.6159 7.0324 110.1156 45.7023 0.0000 171.6456 547 L 4.9129 7.9887 123.4517 53.2208 44.6354 175.2368 548 M 4.6950 8.8023 126.5195 54.2146 34.0053 175.5773 549 H 4.8300 8.7348 120.3095 54.1433 30.6052 175.5755 550 N 4.5309 8.2302 119.9066 52.7868 37.1591 174.8669 551 Q 3.9439 7.7289 119.5296 56.3795 29.6132 176.1806 552 D 4.5056 8.6574 127.5584 53.8182 39.8387 174.9962 553 G 4.1571 8.3073 104.3736 45.5467 0.0000 175.1600 554 L 3.9333 8.0390 125.4365 58.0726 41.9978 179.1273 555 I 3.7875 8.2869 119.5047 64.4835 37.2214 177.6779 556 C 4.4215 8.5329 116.7866 59.6661 37.0151 176.5396 557 G 3.5361 8.2882 107.9454 47.7078 0.0000 175.7968 558 L 3.9453 7.7737 122.1196 57.4528 41.7533 179.5480 559 R 3.8983 7.9627 118.5318 59.4824 29.8318 178.3811 560 Q 3.9047 7.8547 119.3764 58.9838 29.0558 177.5865 561 L 3.8844 8.3353 121.5923 58.3752 42.1802 178.8739 562 A 3.9473 8.5648 120.7488 55.1256 17.9916 179.1631 563 N 4.3143 7.7398 114.5435 56.8097 39.1484 176.6884 564 E 4.1807 8.2489 119.1521 58.6617 29.9342 178.5991 565 T 4.1470 8.2353 110.2350 64.3059 69.0946 176.7369 566 T 3.7783 7.3758 117.8555 67.1170 68.5020 175.1290 567 Q 3.8897 8.2634 119.8556 59.7092 28.8469 178.5084 568 A 3.9801 7.9661 120.4553 55.4215 18.6173 178.8616 569 L 3.8703 7.8980 118.4000 58.7511 41.5993 179.2067 570 Q 4.0340 8.5148 119.5868 59.1135 28.9175 178.0563 571 L 4.0324 8.1239 120.1730 57.4786 41.6297 178.8698 572 F 4.1469 8.5935 121.0545 61.6757 39.0965 176.9652 573 L 3.7346 7.6952 116.6615 57.9257 41.4828 179.4706 574 R 3.9484 7.3521 116.8165 59.2838 30.1373 178.1626 575 A 4.0064 7.3753 118.8224 54.5157 18.8732 178.2419 576 T 3.5744 6.6683 112.3137 64.7192 68.9611 174.0271 577 T 4.2161 8.2260 118.8863 63.0370 68.3642 175.0121 578 E 4.2175 7.8201 118.1996 56.0965 30.4972 176.8495 579 L 4.1320 8.5233 120.8229 57.3905 42.2385 177.4223 580 R 4.4562 7.7021 115.8160 54.6770 31.8090 176.1169 581 T 4.5373 7.8526 117.2941 62.1247 71.1373 173.5297 582 F 4.7764 8.7190 124.9777 57.9457 41.4092 177.7068 583 S 4.4451 8.2414 114.8878 60.0544 62.6137 176.0755 584 I 3.5863 7.6103 124.2245 64.7739 36.8930 178.1268 585 L 4.0409 7.8331 119.1183 57.5869 41.5048 178.6719 586 N 4.5893 8.0946 114.9909 54.9775 38.5816 177.5982 587 R 3.9549 8.0041 120.4512 59.1739 30.2451 178.5644 588 K 3.8304 7.9047 118.0074 59.7180 31.8892 179.0216 589 A 3.9997 7.6999 119.2349 55.5550 18.5689 179.3908 590 I 3.8245 7.9126 118.4577 64.5867 37.0867 178.7977 591 D 4.4152 8.5736 119.7154 57.2610 40.6264 179.5101 592 F 4.0749 8.4691 121.3829 61.2554 39.2339 177.2488 593 L 3.9228 7.9518 117.2538 57.8166 41.5462 178.8604 594 L 4.0831 7.9636 117.1139 58.6972 41.5808 178.7763 595 Q 3.9290 7.7351 118.4838 59.2778 29.5352 179.1924 596 R 4.3768 7.6208 126.4365 56.8060 28.1741 179.3923 *597 W 3.7585 7.5165 125.6053 57.5062 29.2685 176.4611 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 503 A 8.25 4.30 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 504 I 7.48 4.28 1.86 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 1.29 0.83 0.90 0.00 0.00 505 V 8.06 4.34 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 0.82 0.00 0.00 0.93 0.00 0.00 506 N 8.86 4.55 0.00 2.85 2.71 0.00 0.00 6.88 7.96 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 0.00 507 A 8.94 4.71 1.22 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 0.00 0.00 0.00 508 Q 8.78 4.25 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.72 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 509 P 0.00 4.54 0.00 2.04 2.12 0.00 3.67 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 2.03 2.11 0.00 510 K 7.32 4.62 0.00 1.88 1.66 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.38 7.81 511 C 8.17 4.61 0.00 2.87 2.95 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 0.00 512 N 8.41 4.59 0.00 2.80 2.79 0.00 0.00 6.77 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 0.00 513 P 0.00 4.39 0.00 2.19 2.19 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 514 N 7.54 4.51 0.00 2.78 2.78 0.00 0.00 6.78 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 0.00 515 L 8.63 4.51 0.00 1.79 1.74 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 516 H 8.58 4.61 0.00 3.09 3.26 0.00 5.71 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 517 Y 8.37 4.99 0.00 2.85 2.95 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 0.00 518 W 7.63 5.59 0.00 3.40 3.07 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 0.00 519 T 8.55 4.54 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 1.38 0.00 0.00 520 T 8.95 5.05 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 521 Q 9.19 4.64 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.16 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 522 D 8.38 4.42 0.00 2.83 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 *525 A 8.20 4.30 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 0.00 526 A 8.45 4.66 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 0.00 0.00 0.00 0.00 527 I 7.57 4.61 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.69 0.94 0.00 0.00 528 G 8.41 3.72 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 0.00 529 L 8.11 4.33 0.00 1.14 0.94 0.04 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 530 A 8.03 4.03 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 531 W 8.12 4.35 0.00 3.60 3.24 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 0.00 532 I 6.28 3.40 1.74 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.81 0.00 0.00 533 P 0.00 4.22 0.00 2.07 2.16 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 534 Y 8.24 4.00 0.00 2.74 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 0.00 535 F 7.82 4.40 0.00 3.12 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 G 8.40 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 0.00 0.00 0.00 537 P 0.00 4.36 0.00 2.02 1.96 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 538 A 7.96 4.62 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 0.00 0.00 0.00 0.00 539 A 8.53 4.02 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 0.00 540 E 8.15 4.96 0.00 2.10 2.05 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 2.18 2.21 0.00 541 G 7.81 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 0.00 0.00 0.00 542 I 7.42 3.32 1.61 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 -0.36 0.76 0.00 0.00 543 Y 6.79 4.89 0.00 2.78 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 0.00 544 T 8.92 4.75 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 1.46 0.00 0.00 545 E 9.13 4.46 0.00 1.88 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 2.34 2.43 0.00 546 G 7.03 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.99 4.91 0.00 1.27 1.36 0.70 0.76 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 0.00 548 M 8.80 4.69 0.00 2.07 2.10 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 2.70 2.59 0.00 549 H 8.73 4.83 0.00 3.05 3.22 0.00 5.70 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 N 8.23 4.53 0.00 2.95 2.78 0.00 0.00 6.98 7.08 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 0.00 551 Q 7.73 3.94 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.97 5.77 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 552 D 8.66 4.51 0.00 2.99 2.71 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 0.00 553 G 8.31 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 0.00 0.00 0.00 554 L 8.04 3.93 0.00 1.85 1.69 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 555 I 8.29 3.79 2.05 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 1.52 0.56 0.96 0.00 0.00 556 C 8.53 4.42 0.00 2.96 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 0.00 557 G 8.29 3.54 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 0.00 0.00 0.00 558 L 7.77 3.95 0.00 1.82 1.69 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 559 R 7.96 3.90 0.00 2.00 1.93 0.00 3.09 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 1.63 1.64 0.00 560 Q 7.85 3.90 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.54 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 561 L 8.34 3.88 0.00 1.78 1.82 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 562 A 8.56 3.95 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 0.00 563 N 7.74 4.31 0.00 2.82 3.09 0.00 0.00 7.27 7.75 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 0.00 564 E 8.25 4.18 0.00 2.16 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 2.34 2.42 0.00 565 T 8.24 4.15 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 1.22 0.00 0.00 566 T 7.38 3.78 4.36 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 1.22 0.00 0.00 567 Q 8.26 3.89 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 568 A 7.97 3.98 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 0.00 569 L 7.90 3.87 0.00 1.77 2.01 0.92 0.64 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 0.00 570 Q 8.51 4.03 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 571 L 8.12 4.03 0.00 1.97 1.74 0.98 0.76 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 0.00 572 F 8.59 4.15 0.00 3.08 3.35 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 0.00 573 L 7.70 3.73 0.00 1.87 1.71 0.94 1.04 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 0.00 574 R 7.35 3.95 0.00 1.79 2.18 0.00 3.26 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 1.61 1.62 0.00 575 A 7.38 4.01 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 0.00 576 T 6.67 3.57 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 1.15 0.00 0.00 577 T 8.23 4.22 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 0.00 578 E 7.82 4.22 0.00 2.14 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 2.25 2.32 0.00 579 L 8.52 4.13 0.00 1.65 1.76 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 580 R 7.70 4.46 0.00 1.92 1.65 0.00 3.33 0.00 0.00 3.35 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 581 T 7.85 4.54 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 1.52 0.00 0.00 582 F 8.72 4.78 0.00 3.15 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 0.00 583 S 8.24 4.45 0.00 4.13 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 0.00 584 I 7.61 3.59 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 0.74 0.00 0.00 585 L 7.83 4.04 0.00 1.69 1.69 0.90 0.67 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 0.00 586 N 8.09 4.59 0.00 2.84 2.87 0.00 0.00 7.18 7.66 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 0.00 587 R 8.00 3.95 0.00 1.99 1.95 0.00 3.35 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.85 0.00 588 K 7.90 3.83 0.00 1.94 1.87 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.57 7.81 589 A 7.70 4.00 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 0.00 590 I 7.91 3.82 2.05 0.00 0.00 0.89 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 0.91 0.94 0.00 0.00 591 D 8.57 4.42 0.00 2.99 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 0.00 592 F 8.47 4.07 0.00 3.20 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 593 L 7.95 3.92 0.00 1.85 1.75 0.99 1.11 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 0.00 594 L 7.96 4.08 0.00 1.75 1.74 0.93 0.90 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 0.00 595 Q 7.74 3.93 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 7.53 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 596 R 7.62 4.38 0.00 1.86 1.77 0.00 3.39 0.00 0.00 3.26 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.50 0.00 *597 W 7.52 3.76 0.00 2.56 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.