NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 605 S 4.4074 8.1933 116.8212 57.9514 64.2492 173.4927 606 K 3.7663 8.1974 124.3773 54.9307 32.3482 174.6814 607 C 4.4260 8.6482 121.3652 59.0740 32.7911 174.2203 608 R 3.8226 8.5769 127.9797 58.7843 30.1164 176.4325 609 K 4.2323 8.3120 118.7924 57.7155 34.1350 176.7569 610 A 3.6614 7.8789 125.8065 52.6205 20.4885 178.8945 611 G 4.0660 8.7195 109.9982 46.3304 0.0000 172.9105 612 C 4.3838 7.9801 119.4418 58.4595 32.8069 174.2199 613 V 3.4095 8.2269 125.7959 64.4271 31.5875 174.6422 614 Y 4.9673 7.2560 116.6553 57.1849 41.0878 174.0846 615 F 4.9171 9.1462 119.0621 56.2402 40.6545 177.0685 616 G 4.2845 8.4134 111.3502 46.2782 0.0000 172.3355 617 T 4.5859 8.2590 111.8563 60.5854 70.4483 172.6169 618 P 4.1715 0.0000 0.0000 66.0231 31.4019 178.1189 619 E 4.1422 8.1075 113.8745 58.0588 29.4879 177.0224 620 N 4.2142 8.1226 117.7856 52.8689 39.1680 175.0811 621 K 3.8515 9.2497 114.1246 57.3094 30.5353 176.2979 622 G 3.7193 8.2276 104.8191 45.2985 0.0000 173.7248 623 F 5.1396 7.9408 118.8380 55.7265 40.9719 175.3579 624 C 5.0193 8.5379 118.4810 57.7421 31.9772 174.7710 625 T 3.9308 8.3625 110.9249 65.2697 68.1224 176.3859 626 L 4.0776 7.8469 121.7092 57.3439 41.7945 179.0083 627 C 4.0437 8.0952 116.3215 62.7216 28.0198 175.7737 628 F 4.1395 8.5133 122.3624 61.1304 38.8689 177.3904 629 I 3.5290 7.6960 119.2885 63.9401 36.6594 177.8131 630 E 3.7839 7.9810 119.4296 59.4080 29.7512 177.8084 631 Y 3.9862 7.9336 119.7196 60.8718 38.5452 178.0367 632 R 3.5478 7.5328 118.1855 59.5521 30.1689 177.9815 633 E 4.0315 8.1623 116.6573 58.0773 29.4725 177.7658 634 N 4.4479 7.3845 115.3244 54.3041 40.3842 174.7027 635 K 4.0229 7.1927 122.4951 56.5035 32.1575 174.1362 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 4.41 0.00 3.92 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 0.00 606 K 8.20 3.77 0.00 1.64 1.51 0.00 1.51 0.00 0.00 1.40 0.00 0.00 2.33 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.20 7.81 607 C 8.65 4.43 0.00 3.19 2.87 0.00 0.00 0.00 0.00 0.00 0.00 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 8.58 3.82 0.00 1.51 1.27 0.00 3.08 0.00 0.00 2.76 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.43 0.00 609 K 8.31 4.23 0.00 2.15 1.85 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.47 7.81 610 A 7.88 3.66 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 611 G 8.72 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 7.98 4.38 0.00 3.18 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 8.23 3.41 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 0.53 0.00 0.00 0.78 0.00 0.00 614 Y 7.26 4.97 0.00 3.17 2.99 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 0.00 0.00 0.00 615 F 9.15 4.92 0.00 2.93 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 0.00 616 G 8.41 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 0.00 0.00 0.00 0.00 617 T 8.26 4.59 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 1.21 0.00 0.00 618 P 0.00 4.17 0.00 2.17 2.08 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 8.11 4.14 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 8.12 4.21 0.00 2.82 2.62 0.00 0.00 7.01 8.05 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 0.00 621 K 9.25 3.85 0.00 1.81 1.66 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.41 1.50 7.81 622 G 8.23 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 0.00 623 F 7.94 5.14 0.00 3.41 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 0.00 624 C 8.54 5.02 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 8.36 3.93 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 1.21 0.00 0.00 626 L 7.85 4.08 0.00 1.69 1.74 0.86 0.95 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 0.00 627 C 8.10 4.04 0.00 3.08 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 8.51 4.14 0.00 3.38 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 3.53 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 0.87 0.00 0.00 630 E 7.98 3.78 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 7.93 3.99 0.00 2.33 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 7.53 3.55 0.00 1.40 1.79 0.00 3.32 0.00 0.00 3.09 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 8.16 4.03 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 2.52 2.42 0.00 634 N 7.38 4.45 0.00 2.58 2.70 0.00 0.00 7.18 7.18 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 0.00 635 K 7.19 4.02 0.00 1.62 1.88 0.00 1.45 0.00 0.00 1.55 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 0.93 7.81