NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 605 S 4.4165 8.1933 116.8228 57.9716 64.2427 173.5078 606 K 3.8056 8.2095 124.4590 54.9136 32.4027 174.6713 607 C 4.4293 8.6042 121.3490 59.0610 32.8007 174.1211 608 R 3.8197 8.5944 128.1085 58.9369 30.0684 176.4292 609 K 4.2221 8.3509 118.5368 57.7200 34.1924 176.7660 610 A 3.6373 7.8804 125.4385 52.5365 20.5708 178.8881 611 G 4.0671 8.7450 110.3104 46.1879 0.0000 172.9977 612 C 4.3702 8.0100 119.5976 58.5086 32.7699 174.1644 613 V 3.6237 8.2436 125.7193 64.3234 31.5821 174.4698 614 Y 4.9886 7.3132 115.6023 57.1390 41.3436 174.0677 615 F 4.9964 9.1397 118.9674 56.1330 40.7756 177.0058 616 G 4.1825 8.4627 111.3627 46.2120 0.0000 172.3440 617 T 4.6140 8.2388 111.9387 60.5351 70.4758 172.5590 618 P 4.1675 0.0000 0.0000 66.0389 31.3961 178.1050 619 E 4.1672 8.1046 113.5695 57.9443 29.4996 176.9695 620 N 4.2337 7.9961 117.6865 53.0871 39.2224 175.0488 621 K 3.7240 9.2600 113.9248 57.3139 30.5987 176.1788 622 G 3.7581 8.2140 104.9657 45.2371 0.0000 173.6820 623 F 5.1807 8.0730 119.0421 55.6942 40.9426 175.3557 624 C 4.6460 8.5457 118.4888 57.8715 31.6586 174.8017 625 T 3.9204 8.3654 111.1513 65.2177 68.1485 176.4034 626 L 4.0623 7.8432 121.5049 57.3709 41.8130 178.9798 627 C 4.0450 8.0787 116.3528 62.6967 28.0290 175.7260 628 F 4.0995 8.5531 122.4718 61.1926 38.8611 177.3528 629 I 3.5510 7.5669 119.8309 63.9416 36.6765 177.7978 630 E 3.7891 7.9917 119.4546 59.3957 29.7318 177.8044 631 Y 3.9964 7.9367 119.7274 60.8830 38.7746 178.1486 632 R 3.5636 7.7664 119.3865 59.4702 29.8871 178.1365 633 E 3.9690 8.2021 116.9863 58.1688 29.5636 177.7944 634 N 4.6571 7.5301 114.8754 52.8185 39.4397 174.9438 635 K 3.9908 7.0907 124.2006 56.8009 32.9448 176.4821 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 605 S 8.19 4.42 0.00 3.92 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 0.00 606 K 8.21 3.81 0.00 1.64 1.51 0.00 1.50 0.00 0.00 1.40 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 1.19 7.81 607 C 8.60 4.43 0.00 3.21 2.88 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 0.00 608 R 8.59 3.82 0.00 1.51 1.31 0.00 3.08 0.00 0.00 2.75 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.45 0.00 609 K 8.35 4.22 0.00 2.13 1.84 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.46 7.81 610 A 7.88 3.64 1.16 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 0.00 611 G 8.74 4.07 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 0.00 0.00 0.00 612 C 8.01 4.37 0.00 3.19 2.86 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 0.00 0.00 0.00 613 V 8.24 3.62 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 0.53 0.00 0.00 0.78 0.00 0.00 614 Y 7.31 4.99 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 0.00 615 F 9.14 5.00 0.00 2.93 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 0.00 616 G 8.46 4.18 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 0.00 617 T 8.24 4.61 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 0.00 618 P 0.00 4.17 0.00 2.17 2.07 0.00 3.63 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 619 E 8.10 4.17 0.00 1.82 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 2.27 2.35 0.00 620 N 8.00 4.23 0.00 2.85 2.66 0.00 0.00 7.06 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 0.00 621 K 9.26 3.72 0.00 1.78 1.65 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.42 1.52 7.81 622 G 8.21 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 623 F 8.07 5.18 0.00 3.37 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 0.00 624 C 8.55 4.65 0.00 3.26 3.27 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 0.00 625 T 8.37 3.92 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 1.21 0.00 0.00 626 L 7.84 4.06 0.00 1.69 1.73 0.86 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 627 C 8.08 4.04 0.00 3.06 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 0.00 628 F 8.55 4.10 0.00 3.36 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 629 I 7.57 3.55 2.01 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.92 0.88 0.00 0.00 630 E 7.99 3.79 0.00 1.95 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 2.23 2.26 0.00 631 Y 7.94 4.00 0.00 2.35 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 R 7.77 3.56 0.00 1.52 1.77 0.00 3.16 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 633 E 8.20 3.97 0.00 1.99 1.91 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 2.54 2.42 0.00 634 N 7.53 4.66 0.00 2.49 2.72 0.00 0.00 6.95 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 635 K 7.09 3.99 0.00 1.78 1.29 0.00 1.46 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.25 7.81