NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 A 4.1914 8.1227 122.4454 52.1228 21.0176 175.1833 17 R 4.1106 8.4649 119.4800 54.3171 30.5911 172.0924 18 I 4.4414 9.3456 127.9796 59.0752 40.1715 174.3475 19 I 4.3320 8.3068 128.4712 61.0196 37.8393 175.4123 20 R 4.7915 8.3090 124.9804 54.6971 35.0473 173.5303 21 Y 5.6119 9.5556 117.7927 56.6535 40.8106 175.3396 22 F 5.6973 9.4765 116.8957 55.4610 41.8025 172.7617 23 Y 4.3958 10.0169 122.5853 57.1048 40.0861 173.8038 24 N 4.5758 8.1115 126.6713 51.8235 38.9725 175.0393 25 A 3.7808 8.6835 132.4639 55.6825 18.8813 179.5470 26 K 4.0762 8.1476 115.6417 57.6249 31.8875 180.1394 27 A 4.0640 7.9536 121.4162 52.6715 18.5598 178.1623 28 G 3.8844 8.8922 103.6497 45.3320 0.0000 172.8151 29 L 4.5562 6.8174 117.9123 54.6684 43.9076 174.2391 30 C 4.9835 8.5949 116.8575 56.3151 40.5937 173.2018 31 Q 4.8708 8.4696 121.1200 54.2278 33.1546 174.4373 32 T 4.9131 8.4191 110.5356 61.4447 70.6333 173.6713 33 F 4.9668 8.7826 116.6925 55.9920 42.0399 173.0550 34 V 4.2211 8.4340 119.8755 62.0990 32.0589 174.1621 35 Y 4.8030 8.7666 130.4465 55.8806 40.0503 176.9194 36 G 3.6362 8.5736 115.0525 46.7152 0.0000 174.3122 37 G 3.6614 6.1229 106.5821 45.0438 0.0000 173.0368 38 C 4.7967 6.5135 112.3340 57.3840 32.7113 173.2061 39 R 3.8389 8.8030 116.2841 57.0432 27.1316 176.8839 40 A 4.0815 8.2685 119.0703 52.4156 19.0395 178.3878 41 K 4.4269 8.1097 120.9847 54.9449 33.9390 177.2443 42 R 3.8595 8.2408 117.9497 58.9625 30.5034 177.5928 43 N 4.6278 7.7378 118.0220 51.0933 37.3342 173.5959 44 N 5.0035 6.4314 116.0703 52.7861 41.7525 173.1954 45 F 5.0383 9.4964 124.5764 55.7442 42.7724 176.0703 46 K 4.5658 8.8539 121.0476 57.6245 32.7183 177.6411 47 S 4.4523 7.6647 113.0809 55.7347 66.9619 174.7528 48 A 3.4680 7.5167 127.3444 55.5014 18.0763 180.7392 49 E 3.7740 7.7306 116.4609 61.3811 29.9117 181.4572 50 D 4.4129 7.8975 119.5184 56.9482 41.2411 177.5382 51 C 2.4500 7.6769 119.0161 59.3942 42.6993 175.5970 52 M 3.9392 8.0313 120.5670 58.0439 31.2195 178.7876 53 R 3.7673 7.6470 118.3950 59.6150 30.3246 178.3856 54 T 4.0893 7.4265 114.3197 65.7831 68.5708 175.9271 55 C 4.5010 8.0884 116.3602 59.1712 29.1846 176.0146 56 G 3.0345 7.7793 110.1540 46.5853 0.0000 174.7570 57 G 3.4726 6.8662 106.8807 44.2822 0.0000 173.4517 *58 A 4.0908 8.3386 121.0747 52.4638 18.8857 176.8022 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 16 A 8.12 4.19 1.21 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 17 R 8.46 4.11 0.00 1.84 1.80 0.00 3.18 0.00 0.00 3.20 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 18 I 9.35 4.44 1.99 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 1.08 0.80 0.97 0.00 0.00 19 I 8.31 4.33 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.69 0.73 0.00 0.00 20 R 8.31 4.79 0.00 0.97 1.93 0.00 3.43 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 21 Y 9.56 5.61 0.00 3.17 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 22 F 9.48 5.70 0.00 3.04 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 23 Y 10.02 4.40 0.00 3.07 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 24 N 8.11 4.58 0.00 2.28 2.46 0.00 0.00 6.63 8.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.68 3.78 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.15 4.08 0.00 1.79 1.74 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.01 7.81 27 A 7.95 4.06 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 28 G 8.89 3.88 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 0.00 0.00 0.00 29 L 6.82 4.56 0.00 1.69 1.72 0.81 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 30 C 8.59 4.98 0.00 2.88 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.47 4.87 0.00 1.52 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.84 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 32 T 8.42 4.91 4.04 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 0.60 0.00 0.00 33 F 8.78 4.97 0.00 2.98 3.10 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 0.00 0.00 0.00 34 V 8.43 4.22 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 0.73 0.00 0.00 0.91 0.00 0.00 35 Y 8.77 4.80 0.00 2.48 2.69 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 0.00 0.00 0.00 0.00 36 G 8.57 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.12 3.66 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 0.00 0.00 0.00 38 C 6.51 4.80 0.00 3.03 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.80 3.84 0.00 2.05 2.10 0.00 3.41 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 40 A 8.27 4.08 0.97 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 0.00 0.00 41 K 8.11 4.43 0.00 1.71 1.73 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.45 7.81 42 R 8.24 3.86 0.00 1.76 1.93 0.00 3.19 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 43 N 7.74 4.63 0.00 2.73 2.76 0.00 0.00 6.71 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 6.43 5.00 0.00 2.60 2.51 0.00 0.00 7.08 7.02 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 45 F 9.50 5.04 0.00 3.25 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 46 K 8.85 4.57 0.00 2.10 1.94 0.00 1.87 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.42 0.99 7.81 47 S 7.66 4.45 0.00 3.86 3.88 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 48 A 7.52 3.47 0.89 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 49 E 7.73 3.77 0.00 1.99 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 2.31 1.94 0.00 50 D 7.90 4.41 0.00 2.80 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 51 C 7.68 2.45 0.00 2.82 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 52 M 8.03 3.94 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.71 0.00 53 R 7.65 3.77 0.00 1.80 2.02 0.00 3.22 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 54 T 7.43 4.09 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 55 C 8.09 4.50 0.00 2.68 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 0.00 0.00 0.00 56 G 7.78 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 0.00 0.00 0.00 57 G 6.87 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *58 A 8.34 4.09 1.24 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 * Residues marked with a * may have inaccurate shift predictions.