NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 541 D 4.9372 8.2648 119.7118 53.2385 39.7034 174.2234 542 L 4.6357 7.5741 124.2049 52.5616 45.0840 174.6953 543 P 4.5002 0.0000 0.0000 62.3505 36.0576 176.6011 544 V 2.4116 7.8888 117.6626 63.3779 34.0357 177.1652 545 E 4.2153 9.0068 113.1585 55.8830 31.4455 170.5320 546 E 3.8479 8.7267 129.8104 55.5326 29.8217 174.8287 547 Q 4.1418 8.5128 122.3693 55.0583 29.6829 177.1139 548 L 5.3304 8.3810 133.3338 56.1824 41.7377 175.5147 549 R 3.8874 7.1521 115.8236 59.7469 29.9945 178.9575 550 R 3.9640 7.9140 117.1970 58.8765 29.9963 178.5802 551 L 3.9257 7.8996 118.7449 58.3514 42.4593 178.5507 552 Q 4.1230 8.1195 117.9638 59.0129 28.4253 178.5034 553 E 3.9172 7.9495 119.2728 59.0209 29.6941 178.1194 554 E 4.0996 8.2565 118.6355 58.1380 30.1343 177.7623 555 R 4.3991 8.0673 116.9676 55.5383 30.9829 176.0803 556 T 4.4854 7.1568 108.8232 60.1141 70.4950 174.0337 557 C 3.8770 8.7679 123.7625 60.2391 31.9037 174.5109 558 K 4.3265 8.3770 125.2835 57.2077 32.4360 177.1268 559 V 4.2920 7.6970 109.0918 63.7053 33.5594 176.8484 560 C 4.1031 8.3643 112.1506 59.9175 30.2426 173.6333 561 M 3.9737 7.5969 117.2748 56.1451 29.7299 175.5650 562 D 4.5886 7.6769 119.9079 56.6135 44.0299 175.2209 563 K 4.3303 7.6729 118.1575 55.7809 33.6587 175.5473 564 E 4.3923 8.5778 124.1591 55.8218 30.4018 176.8571 565 V 3.8582 8.0293 119.8512 62.3538 31.9314 176.1308 566 S 4.6784 9.0959 115.1355 56.8129 65.9139 172.9480 567 I 4.8159 7.5421 120.3291 59.6374 40.1588 174.6567 568 V 4.0374 8.6567 128.3888 62.3004 32.8493 175.3849 569 F 4.9838 9.0746 127.1376 57.6058 40.5188 174.2876 570 I 4.9292 8.8726 123.6178 59.2445 38.9304 174.5392 571 P 4.7561 0.0000 0.0000 62.6744 31.9613 176.0555 572 C 4.1293 7.9659 114.6883 59.4858 29.8831 175.2813 573 G 4.1152 8.3181 107.8624 45.9706 0.0000 173.0430 574 H 4.4522 7.8244 117.9386 55.3119 29.1778 174.6539 575 L 4.7747 8.5816 126.5877 52.6505 41.1405 175.7026 576 V 4.4804 7.5059 120.0628 60.4665 34.0553 175.5965 577 V 4.7597 7.1737 113.3195 59.4758 35.5327 174.2734 578 C 4.7330 8.2443 115.8324 56.6628 30.8595 174.7019 579 K 3.8853 8.7277 120.2882 60.4790 32.0352 178.6635 580 D 4.2186 8.0777 117.9073 57.0851 41.1432 177.6133 581 C 4.2365 8.1059 116.4473 62.3426 28.5174 175.4344 582 A 4.1209 7.5847 122.7008 55.0981 18.0224 177.7032 583 P 4.2292 0.0000 0.0000 65.9753 31.4300 177.7630 584 S 4.4490 7.8854 110.8344 58.9740 62.9023 173.7337 585 L 4.7900 8.0163 121.3278 53.0673 44.0489 176.2746 586 R 4.3715 8.5414 120.9362 57.2627 32.0272 176.3563 587 K 4.8074 7.6312 116.0187 53.9545 35.1451 176.0480 588 C 3.6386 8.6566 125.0488 58.9291 31.8049 173.0321 589 P 4.3745 0.0000 0.0000 65.0978 30.6283 176.7366 590 I 3.9759 7.0247 120.2662 62.1386 38.1297 174.7273 591 C 4.5238 7.4964 113.8063 57.3208 31.1741 174.9970 592 R 4.2510 8.4393 119.0818 56.2485 29.4308 176.3714 593 S 4.1311 7.9812 114.4782 59.1145 63.2451 173.4770 594 T 4.4166 8.3812 121.9398 61.9749 67.8886 173.8360 595 I 4.1298 8.5799 130.2905 61.1362 37.7028 176.1032 596 K 4.4852 9.7674 124.2571 55.0291 33.9408 175.7636 597 G 4.2130 7.2593 106.3428 46.6543 0.0000 171.7693 598 T 5.3046 8.3923 108.6685 60.0138 71.9957 173.3988 599 V 4.4631 9.0119 123.6900 61.2837 34.2371 174.5825 600 R 4.8941 8.6770 126.4908 55.5477 31.1993 175.6277 601 T 4.7520 8.9066 113.4008 60.1393 71.4969 173.7630 602 F 4.6532 8.9822 123.2078 55.9700 39.8715 174.1705 603 L 4.5095 8.2750 126.4317 54.8990 41.8044 177.7077 604 S 4.3164 8.2088 120.6004 59.0638 62.7165 174.3648 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 541 D 8.26 4.94 0.00 2.78 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 0.00 542 L 7.57 4.64 0.00 1.69 1.58 0.92 0.82 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 0.00 543 P 0.00 4.50 0.00 2.06 1.84 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 544 V 7.89 2.41 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 0.74 0.00 0.00 0.93 0.00 0.00 545 E 9.01 4.22 0.00 1.94 1.82 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 2.26 2.38 0.00 546 E 8.73 3.85 0.00 2.16 1.96 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 2.21 2.31 0.00 547 Q 8.51 4.14 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.08 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 548 L 8.38 5.33 0.00 1.73 1.67 1.08 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 549 R 7.15 3.89 0.00 2.09 1.91 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 550 R 7.91 3.96 0.00 1.89 1.95 0.00 3.26 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 551 L 7.90 3.93 0.00 1.61 1.74 0.92 0.72 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 0.00 552 Q 8.12 4.12 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 553 E 7.95 3.92 0.00 2.21 2.10 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 2.32 2.36 0.00 554 E 8.26 4.10 0.00 2.09 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 2.32 2.35 0.00 555 R 8.07 4.40 0.00 1.96 1.92 0.00 3.16 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.91 0.00 556 T 7.16 4.49 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 0.00 557 C 8.77 3.88 0.00 2.99 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 0.00 558 K 8.38 4.33 0.00 2.07 1.83 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.46 7.81 559 V 7.70 4.29 2.10 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 0.88 0.00 0.00 0.95 0.00 0.00 560 C 8.36 4.10 0.00 3.08 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 0.00 561 M 7.60 3.97 0.00 2.22 2.40 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 2.51 2.48 0.00 562 D 7.68 4.59 0.00 2.57 2.63 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 0.00 563 K 7.67 4.33 0.00 1.74 1.68 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.78 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.51 1.42 7.81 564 E 8.58 4.39 0.00 1.96 1.81 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 2.26 2.41 0.00 565 V 8.03 3.86 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 0.70 0.00 0.00 0.96 0.00 0.00 566 S 9.10 4.68 0.00 3.80 3.70 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 0.00 567 I 7.54 4.82 1.61 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 1.20 0.90 0.79 0.00 0.00 568 V 8.66 4.04 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 0.83 0.00 0.00 0.95 0.00 0.00 569 F 9.07 4.98 0.00 3.07 2.84 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 0.00 570 I 8.87 4.93 2.02 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.34 0.94 0.00 0.00 571 P 0.00 4.76 0.00 2.17 2.15 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.92 0.00 572 C 7.97 4.13 0.00 3.14 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 0.00 573 G 8.32 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 574 H 7.82 4.45 0.00 3.51 3.38 0.00 5.79 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 L 8.58 4.77 0.00 1.53 1.57 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 576 V 7.51 4.48 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 0.87 0.00 0.00 0.95 0.00 0.00 577 V 7.17 4.76 2.10 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 1.04 0.00 0.00 0.78 0.00 0.00 578 C 8.24 4.73 0.00 3.15 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 0.00 579 K 8.73 3.89 0.00 1.94 2.14 0.00 1.47 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.49 7.81 580 D 8.08 4.22 0.00 2.69 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 0.00 581 C 8.11 4.24 0.00 2.98 3.02 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 0.00 582 A 7.58 4.12 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 0.00 583 P 0.00 4.23 0.00 2.07 2.18 0.00 3.86 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 2.06 2.16 0.00 584 S 7.89 4.45 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 0.00 585 L 8.02 4.79 0.00 1.69 1.67 1.16 1.10 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 0.00 586 R 8.54 4.37 0.00 1.69 1.91 0.00 3.22 0.00 0.00 3.31 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 587 K 7.63 4.81 0.00 1.53 1.71 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.33 7.81 588 C 8.66 3.64 0.00 2.19 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 0.00 589 P 0.00 4.37 0.00 2.24 2.19 0.00 3.92 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 2.09 2.11 0.00 590 I 7.02 3.98 1.68 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 1.40 0.40 0.76 0.00 0.00 591 C 7.50 4.52 0.00 3.13 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 0.00 592 R 8.44 4.25 0.00 1.81 1.96 0.00 3.26 0.00 0.00 3.79 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 593 S 7.98 4.13 0.00 3.91 3.73 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 0.00 594 T 8.38 4.42 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 1.18 0.00 0.00 595 I 8.58 4.13 1.82 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.21 1.04 0.00 0.00 596 K 9.77 4.49 0.00 1.64 1.78 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.48 7.81 597 G 7.26 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 0.00 0.00 0.00 0.00 598 T 8.39 5.30 4.27 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 1.32 0.00 0.00 599 V 9.01 4.46 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 1.04 0.00 0.00 0.94 0.00 0.00 600 R 8.68 4.89 0.00 1.97 2.19 0.00 3.34 0.00 0.00 3.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 601 T 8.91 4.75 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 1.23 0.00 0.00 602 F 8.98 4.65 0.00 2.84 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 0.00 603 L 8.27 4.51 0.00 1.62 1.69 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 604 S 8.21 4.32 0.00 3.93 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