NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4636 8.1076 122.4413 51.8664 20.4375 175.4109 3 Q 4.4109 8.4695 119.1621 52.9157 31.7588 169.2235 4 V 4.6470 7.8109 114.2063 59.8775 36.4731 175.0888 5 S 5.0152 8.7374 115.1065 57.1328 64.1097 174.4460 6 R 4.4726 8.3810 124.4964 56.6149 29.9508 176.3822 7 Q 4.3308 8.6544 118.2338 55.4014 28.2807 171.7030 *25 N 5.1930 8.0918 115.9855 54.9433 40.1386 172.8903 26 Y 5.0405 8.1963 115.1424 56.2736 40.9536 174.2129 27 F 4.6975 8.7736 117.0956 55.7629 40.3131 175.0509 28 N 3.9009 6.9851 111.9183 52.4671 39.1183 173.9377 29 I 4.1538 7.0727 116.5003 58.4933 40.2571 174.7817 30 N 4.4525 8.0810 119.2787 52.7776 39.0185 175.2073 31 Y 4.1046 8.3768 120.4432 58.8488 38.3569 175.3883 32 F 4.9621 7.6683 119.1601 55.4655 40.7170 176.4466 33 K 4.2779 8.9463 124.5206 57.8535 32.2441 176.0655 34 D 4.9938 7.8028 116.4528 52.6648 43.9138 175.7497 35 A 3.8835 8.4749 123.1372 55.9514 18.6870 179.8294 36 A 4.0246 8.0159 117.4504 55.2936 18.6585 179.1322 37 S 4.1597 7.4540 110.5362 61.4459 63.0840 175.0989 38 N 4.5435 7.6964 116.6870 53.1486 39.0885 176.7205 39 G 3.8938 8.2816 108.4973 45.2406 0.0000 173.3210 40 A 4.1706 8.3588 122.3291 51.8790 19.0261 178.0969 41 S 4.4478 8.3660 116.6619 58.3933 64.0042 172.5348 42 K 4.8253 8.1669 120.2618 54.9397 34.6774 176.6924 43 L 4.3726 8.2183 118.7094 55.6219 42.5248 176.5424 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 2 A 8.11 4.46 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 3 Q 8.47 4.41 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.67 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 4 V 7.81 4.65 2.16 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 0.79 0.00 0.00 0.90 0.00 0.00 5 S 8.74 5.02 0.00 3.91 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 R 8.38 4.47 0.00 1.85 1.68 0.00 3.22 0.00 0.00 3.22 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.40 0.00 7 Q 8.65 4.33 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.61 0.00 0.00 0.00 0.00 0.00 2.22 1.94 0.00 *25 N 8.09 5.19 0.00 2.69 2.94 0.00 0.00 7.09 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 8.20 5.04 0.00 3.10 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 27 F 8.77 4.70 0.00 2.95 2.91 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 28 N 6.99 3.90 0.00 2.79 2.83 0.00 0.00 6.77 7.69 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 29 I 7.07 4.15 1.45 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.49 0.59 0.00 0.00 30 N 8.08 4.45 0.00 2.65 2.91 0.00 0.00 6.97 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Y 8.38 4.10 0.00 2.31 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 7.67 4.96 0.00 3.20 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 33 K 8.95 4.28 0.00 1.78 1.93 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.44 7.81 34 D 7.80 4.99 0.00 2.79 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.47 3.88 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 36 A 8.02 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.45 4.16 0.00 4.16 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 38 N 7.70 4.54 0.00 2.70 2.80 0.00 0.00 6.96 8.99 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 39 G 8.28 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 40 A 8.36 4.17 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 41 S 8.37 4.45 0.00 3.89 3.87 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 42 K 8.17 4.83 0.00 1.73 1.77 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.44 7.81 43 L 8.22 4.37 0.00 1.56 1.50 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.