NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 529 H 4.5742 8.4449 120.3951 55.6648 29.7900 171.7037 530 M 3.5736 8.4739 125.8783 53.5101 31.8701 175.9447 531 T 4.0064 8.4800 115.7575 61.1210 71.7151 172.3027 532 P 4.4983 0.0000 0.0000 65.3128 31.3047 178.3492 533 Q 3.9666 7.9502 119.0317 59.1389 29.3775 176.8764 534 D 4.4368 7.7748 117.8932 57.6764 41.4051 177.9725 535 H 4.2427 7.9346 115.2160 58.2112 28.6098 176.3498 536 E 4.4067 7.8184 119.2479 56.6172 29.1919 178.0710 537 K 4.0918 8.1379 118.5452 59.5700 32.0501 178.9464 538 A 3.9994 7.7283 120.0706 54.8000 18.3125 179.2742 539 A 4.0080 7.7534 119.2075 55.4184 18.1514 179.6112 540 L 4.0325 7.4782 117.6817 57.6332 42.5004 178.2962 541 I 4.2416 7.3868 117.2951 61.6938 37.7623 177.1520 542 M 4.1108 8.3440 120.7535 58.5554 32.0762 178.0697 543 Q 3.9602 7.6987 116.9150 59.0899 28.7312 178.9563 544 V 3.6673 7.6697 117.3883 65.1734 31.7963 176.8134 545 L 3.8852 8.5086 116.5629 56.4605 41.0550 177.3531 546 Q 4.3747 8.8483 123.7500 55.9676 31.0070 176.6255 547 L 4.2823 9.8534 117.0219 56.7350 38.7980 174.6492 548 T 4.2186 7.5467 106.8447 60.9073 70.7348 173.8965 549 A 4.0212 8.6001 129.3251 54.5182 18.2163 178.4948 550 D 4.1258 8.0109 115.9937 57.6142 41.3785 177.9915 551 Q 4.1362 7.8529 118.6718 59.0793 28.7509 178.6965 552 I 3.7977 7.7468 119.9786 63.9002 37.0198 178.0497 553 A 4.1766 8.4679 122.0665 55.1769 18.2514 178.8771 554 M 4.1933 7.5114 114.9993 55.9372 32.5087 176.5667 555 L 4.4644 7.3899 120.1455 52.6699 43.3140 174.7404 556 P 4.6123 0.0000 0.0000 61.4313 32.3887 175.5442 557 P 4.2675 0.0000 0.0000 65.6235 31.4098 177.6109 558 E 4.3437 8.1145 116.6817 57.1156 29.9682 176.9845 559 Q 4.5206 7.6585 115.3122 57.7123 30.8224 177.2784 560 R 3.9004 8.2864 119.3821 59.9256 30.1392 178.6680 561 Q 3.9701 8.2382 118.1953 59.1102 28.9409 177.9242 562 S 3.9063 8.1805 114.5022 61.8040 62.2029 176.3977 563 I 3.7353 7.8467 122.2576 64.1642 36.7912 178.1413 564 L 4.0165 8.6197 121.9242 58.0170 41.6804 179.1113 565 I 3.6997 7.5032 118.3730 64.5063 37.4405 178.0073 566 L 4.1447 8.3168 120.1823 57.6301 41.1752 179.6967 567 K 4.0095 8.4180 118.9928 59.4779 31.8063 179.1619 568 E 3.9827 8.2559 118.9113 59.4462 29.3400 179.3876 569 Q 4.0100 7.8493 117.7791 59.0633 28.5441 178.8531 570 I 3.7410 7.2070 119.7144 64.5161 37.1552 178.1897 571 Q 4.2552 7.6835 118.0638 55.9254 28.7922 174.1567 572 K 3.6952 7.7580 122.7840 57.0459 29.8557 173.5394 573 S 4.4337 8.7840 118.3653 59.1989 69.6668 174.0624 574 T 3.1957 8.0526 123.1675 64.8733 66.3346 172.6034 575 G 4.6937 7.5530 120.4012 45.8419 0.0000 170.7036 576 A 4.8074 7.5078 121.3247 49.4056 22.4634 175.0975 577 P 4.4248 0.0000 0.0000 63.0630 31.5581 176.4141 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 529 H 8.44 4.57 0.00 3.12 3.36 0.00 5.74 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 M 8.47 3.57 0.00 2.03 2.02 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 2.58 2.88 0.00 531 T 8.48 4.01 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 1.22 0.00 0.00 532 P 0.00 4.50 0.00 2.30 2.36 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 533 Q 7.95 3.97 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 7.10 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 534 D 7.77 4.44 0.00 2.87 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 4.24 0.00 3.40 3.32 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 E 7.82 4.41 0.00 2.16 2.06 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 2.30 2.35 0.00 537 K 8.14 4.09 0.00 1.93 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.77 7.81 538 A 7.73 4.00 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 0.00 539 A 7.75 4.01 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 0.00 540 L 7.48 4.03 0.00 1.62 1.91 0.92 0.98 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 0.00 541 I 7.39 4.24 1.87 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 0.48 0.91 0.00 0.00 542 M 8.34 4.11 0.00 2.15 2.11 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 2.60 2.72 0.00 543 Q 7.70 3.96 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 544 V 7.67 3.67 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 0.00 545 L 8.51 3.89 0.00 1.79 1.50 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 546 Q 8.85 4.37 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.22 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 547 L 9.85 4.28 0.00 1.90 2.18 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 548 T 7.55 4.22 4.24 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 1.21 0.00 0.00 549 A 8.60 4.02 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 0.00 550 D 8.01 4.13 0.00 2.66 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 0.00 551 Q 7.85 4.14 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 552 I 7.75 3.80 1.87 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 1.72 0.84 0.91 0.00 0.00 553 A 8.47 4.18 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 0.00 554 M 7.51 4.19 0.00 1.99 2.33 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 2.63 2.72 0.00 555 L 7.39 4.46 0.00 1.80 1.59 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 556 P 0.00 4.61 0.00 2.21 2.19 0.00 3.69 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 2.07 1.95 0.00 557 P 0.00 4.27 0.00 2.02 2.22 0.00 3.67 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 2.01 1.90 0.00 558 E 8.11 4.34 0.00 1.93 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 2.29 2.40 0.00 559 Q 7.66 4.52 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.47 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 560 R 8.29 3.90 0.00 1.98 2.14 0.00 3.14 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 561 Q 8.24 3.97 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 562 S 8.18 3.91 0.00 3.90 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 0.00 563 I 7.85 3.74 1.94 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 1.55 0.63 0.91 0.00 0.00 564 L 8.62 4.02 0.00 1.66 1.88 0.90 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 0.00 565 I 7.50 3.70 2.01 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 1.62 0.76 0.90 0.00 0.00 566 L 8.32 4.14 0.00 1.88 1.71 0.92 0.56 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 0.00 567 K 8.42 4.01 0.00 1.99 1.86 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.63 7.81 568 E 8.26 3.98 0.00 2.19 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 2.32 2.49 0.00 569 Q 7.85 4.01 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 570 I 7.21 3.74 2.05 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 0.59 0.91 0.00 0.00 571 Q 7.68 4.26 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.25 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 572 K 7.76 3.70 0.00 1.93 1.86 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.54 7.81 573 S 8.78 4.43 0.00 3.77 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 0.00 574 T 8.05 3.20 4.24 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 1.21 0.00 0.00 575 G 7.55 4.69 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 0.00 0.00 0.00 576 A 7.51 4.81 1.21 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 0.00 0.00 577 P 0.00 4.42 0.00 2.19 2.04 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00