NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 566 Q 4.1998 8.3449 121.7008 55.6193 30.2337 174.7438 567 H 3.8119 8.4117 120.8437 55.1481 29.6183 174.9205 568 N 4.6887 8.6263 124.1662 52.8112 37.7072 174.5015 569 F 4.6104 7.8806 118.3163 58.0743 40.0236 176.2601 570 E 4.8377 9.8325 123.2752 53.9183 32.9960 175.5358 571 V 4.1613 8.5822 120.6811 63.5377 32.0271 174.6734 572 W 4.9167 9.4776 135.0000 55.7956 33.6804 174.0452 573 T 4.1175 8.0197 123.2814 61.5102 69.2673 174.1615 574 A 3.6065 7.1436 128.9887 52.0286 18.0084 177.5265 575 T 4.1609 8.8109 113.5934 64.6207 69.4380 174.7530 576 T 4.3424 7.4622 110.0953 58.1299 71.8874 170.9573 577 P 3.0815 0.0000 0.0000 63.4100 30.8757 175.4746 578 T 4.8437 8.1636 119.0976 61.8448 72.2314 173.2724 579 Y 4.8416 8.8720 122.8325 57.3047 40.0012 174.4547 580 C 4.6292 8.4774 122.4565 58.9330 32.3097 174.0619 581 Y 4.2715 9.2982 128.1865 59.7490 38.7618 176.5537 582 E 4.2161 8.2920 119.8695 58.7984 30.0955 176.5375 583 C 4.6659 7.9406 109.4444 56.8523 30.4503 173.3922 584 E 4.0028 8.5770 118.4558 58.1947 27.4037 175.3302 585 G 3.8875 7.5370 104.3166 43.7075 0.0000 172.6956 586 L 4.1806 7.4079 126.8266 55.4763 42.8937 176.8931 587 L 4.7874 9.4464 127.1947 55.2842 42.1759 175.7877 588 W 5.2663 8.0686 131.0262 55.3697 32.6615 172.9131 589 G 4.3103 8.3832 109.2793 45.0810 0.0000 173.8347 590 I 4.0866 7.2046 119.0036 61.2133 40.0041 176.9230 591 A 4.3433 7.3712 129.8864 49.9590 18.2032 177.0333 592 R 4.5237 7.8075 118.8968 58.5420 30.2628 176.7611 593 Q 3.9460 6.9794 119.4365 56.7747 30.1413 176.9414 594 G 4.2408 8.1084 107.4344 46.3925 0.0000 171.7858 595 M 5.7402 9.5629 119.6202 53.8015 36.0516 175.1280 596 R 5.0939 9.3454 121.8160 55.0826 34.2652 173.6755 597 C 4.3313 9.3141 126.8179 58.8732 32.9239 173.6049 598 T 4.4498 7.8059 114.9441 61.6610 69.0885 175.5739 599 E 4.4779 7.9962 120.1205 58.2783 33.4877 176.2164 600 C 4.4339 8.1248 113.2065 58.9327 30.0533 175.0040 601 G 3.7724 7.5801 106.1578 44.3884 0.0000 174.0921 602 V 3.2274 7.1203 119.4913 62.0675 32.4242 175.2970 603 K 5.1439 8.2633 121.0808 55.0211 36.1706 174.8556 604 C 4.9199 9.7274 118.5283 57.3443 33.8293 172.8328 605 H 4.9139 8.6004 116.2874 55.0377 29.3971 176.5391 606 E 4.0083 8.7973 119.7472 59.3061 29.3859 179.0836 607 K 4.2315 7.9042 117.9386 59.4567 33.3536 178.6118 608 C 4.2231 8.0531 117.2499 61.9887 27.7611 175.5648 609 Q 2.9916 7.3934 118.9525 59.0339 27.9286 177.5451 610 D 4.6061 7.7963 119.3339 56.2679 41.5117 177.8987 611 L 4.1165 7.7276 118.0499 57.1464 41.9625 177.4826 612 L 4.1246 8.2137 120.3076 54.8974 42.5535 175.9695 613 N 4.5877 8.6667 121.7897 53.2637 39.7323 174.1762 614 A 4.7911 8.0472 126.8901 51.1097 20.9935 175.8694 615 D 4.5496 7.4880 115.8315 54.1802 42.9622 175.7815 616 C 4.2136 8.2072 123.3816 59.1229 31.5941 172.7631 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 566 Q 8.34 4.20 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.92 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 567 H 8.41 3.81 0.00 2.50 2.16 0.00 5.75 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 0.00 568 N 8.63 4.69 0.00 2.94 2.65 0.00 0.00 6.85 7.59 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 0.00 569 F 7.88 4.61 0.00 3.06 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 570 E 9.83 4.84 0.00 2.05 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 2.23 2.54 0.00 571 V 8.58 4.16 2.14 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 0.74 0.00 0.00 0.99 0.00 0.00 572 W 9.48 4.92 0.00 3.43 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 0.00 573 T 8.02 4.12 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 1.03 0.00 0.00 574 A 7.14 3.61 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 0.00 575 T 8.81 4.16 4.33 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 1.27 0.00 0.00 576 T 7.46 4.34 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 1.22 0.00 0.00 577 P 0.00 3.08 0.00 1.95 1.61 0.00 3.30 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 578 T 8.16 4.84 4.68 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 1.45 0.00 0.00 579 Y 8.87 4.84 0.00 2.78 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 0.00 580 C 8.48 4.63 0.00 3.09 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 Y 9.30 4.27 0.00 3.09 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 0.00 582 E 8.29 4.22 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 583 C 7.94 4.67 0.00 3.09 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 E 8.58 4.00 0.00 2.08 2.18 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 2.25 2.38 0.00 585 G 7.54 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 586 L 7.41 4.18 0.00 1.17 1.48 1.09 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 587 L 9.45 4.79 0.00 1.88 1.77 1.11 -0.38 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 0.00 588 W 8.07 5.27 0.00 3.22 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 0.00 589 G 8.38 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 0.00 590 I 7.20 4.09 1.79 0.00 0.00 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 1.27 0.65 0.82 0.00 0.00 591 A 7.37 4.34 1.18 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 0.00 0.00 592 R 7.81 4.52 0.00 2.04 0.86 0.00 3.02 0.00 0.00 3.33 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.22 0.00 593 Q 6.98 3.95 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.68 0.00 0.00 0.00 0.00 0.00 2.58 2.27 0.00 594 G 8.11 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 0.00 0.00 0.00 0.00 595 M 9.56 5.74 0.00 1.87 2.10 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.65 0.00 596 R 9.35 5.09 0.00 1.19 1.63 0.00 2.49 0.00 0.00 2.85 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.30 0.00 597 C 9.31 4.33 0.00 1.91 2.37 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 0.00 598 T 7.81 4.45 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 1.24 0.00 0.00 599 E 8.00 4.48 0.00 1.81 1.88 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 2.12 2.19 0.00 600 C 8.12 4.43 0.00 2.73 2.82 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 0.00 0.00 0.00 0.00 601 G 7.58 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 602 V 7.12 3.23 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 0.48 0.00 0.00 0.79 0.00 0.00 603 K 8.26 5.14 0.00 1.45 1.01 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.32 0.00 0.00 2.18 0.00 0.00 0.00 0.00 1.04 0.86 7.81 604 C 9.73 4.92 0.00 2.68 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 0.00 605 H 8.60 4.91 0.00 3.28 3.29 0.00 5.82 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 606 E 8.80 4.01 0.00 1.93 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 2.33 2.45 0.00 607 K 7.90 4.23 0.00 1.96 2.04 0.00 1.49 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.50 7.81 608 C 8.05 4.22 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 609 Q 7.39 2.99 0.00 1.85 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.96 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 610 D 7.80 4.61 0.00 2.85 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 611 L 7.73 4.12 0.00 1.83 1.75 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 612 L 8.21 4.12 0.00 1.69 1.70 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 613 N 8.67 4.59 0.00 2.80 2.79 0.00 0.00 6.94 7.99 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 0.00 614 A 8.05 4.79 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 0.00 615 D 7.49 4.55 0.00 2.59 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 616 C 8.21 4.21 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