NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7880 8.3549 109.7402 45.5060 0.0000 173.0831 *2 T 4.1586 8.2012 122.2185 62.6080 69.6061 174.4345 3 F 4.1154 9.0558 125.4111 57.4080 39.6831 174.9065 4 R 4.7439 8.3216 123.0472 54.4187 33.1418 175.3337 5 D 4.8057 8.2659 120.1939 53.4263 42.3148 177.9176 6 T 4.0245 8.3515 111.4096 63.7899 68.9102 176.2906 7 S 4.1780 7.9765 116.0717 60.4930 63.1627 175.1734 8 A 3.9772 7.8621 123.6341 54.1005 18.2599 177.2994 9 I 3.8834 7.3025 117.2859 60.0887 37.4908 175.6960 10 A 4.2440 8.7271 129.4099 54.8206 18.8815 177.0994 11 S 4.4438 7.3553 107.1740 57.7098 66.3463 174.1849 12 W 4.8249 8.4762 120.2223 55.0881 31.9648 174.9468 13 H 5.2424 8.7838 119.0393 53.9111 31.9719 172.5232 14 A 5.1136 9.3165 124.2719 50.4136 22.7594 174.9111 15 H 5.1574 9.1031 116.6854 54.0127 32.7976 172.9637 16 V 4.1059 8.3372 125.0139 62.4187 32.3676 174.5158 17 Y 5.6089 8.7576 126.5623 57.5621 39.3108 174.8237 18 F 5.0952 8.7235 117.3209 57.0519 41.6997 171.5063 19 D 3.5022 9.0636 116.5862 52.0485 41.7609 175.4467 20 A 4.2680 7.6090 120.7344 55.5650 18.4201 180.1109 21 S 4.2346 7.9028 109.7490 60.4460 63.4215 175.2202 22 S 4.8444 8.1702 115.1018 57.8218 63.3565 175.8828 23 R 4.2745 8.1983 123.3710 60.4672 29.7089 178.2621 24 D 4.4352 8.2679 117.9487 57.3819 40.8938 178.4556 25 A 4.0577 8.1582 120.6377 55.0981 18.4463 179.3822 26 A 4.1384 8.4218 119.4456 54.9986 18.3483 179.7427 27 W 3.6817 8.6527 127.0804 60.8299 30.8650 178.1734 28 T 3.8863 8.3000 115.9202 66.7514 67.8461 176.1803 29 L 4.0793 8.1908 122.0530 58.1663 42.1012 179.0168 30 R 3.7636 7.9233 118.6220 59.4642 29.9298 178.3231 31 E 3.6767 7.8886 118.6150 59.3573 29.3772 179.2077 32 Q 4.0854 8.1903 119.6497 58.9982 29.2074 178.2121 33 I 3.7337 8.2475 121.2898 64.3902 37.1861 177.8725 34 E 3.9014 8.3015 119.9370 59.2603 29.4299 178.8321 35 A 3.9374 8.1458 120.7214 55.4280 18.3045 179.1161 36 H 3.7953 8.5253 115.9550 58.3415 30.0362 176.5614 37 W 4.3326 8.0862 118.2710 55.0960 29.1962 176.3395 38 S 3.7112 8.7307 113.8231 59.7221 60.3584 173.5146 39 G 3.9330 8.3357 105.3319 46.0524 0.0000 175.4006 40 K 4.1787 8.1035 118.7682 57.5445 32.4982 177.1547 41 L 4.4260 7.5765 118.2689 53.8945 43.5246 176.3266 42 Q 4.3910 8.4691 119.4851 54.9241 29.8222 174.7110 43 L 5.0092 8.4709 126.9864 53.2528 43.9367 176.5392 44 G 4.1487 8.9761 114.8212 45.1521 0.0000 173.1780 45 R 4.2512 8.4739 118.3630 56.1560 30.9469 177.4881 46 F 4.6914 8.9125 124.8815 58.1476 39.6347 174.2971 47 H 4.7274 9.1645 124.9174 53.7782 29.8971 176.1437 48 E 3.3165 8.1266 127.3629 54.6461 29.7964 176.2634 49 R 4.3170 6.6376 113.1222 53.8717 32.4218 172.3777 50 P 4.3358 0.0000 0.0000 62.8729 32.0716 176.1311 51 V 4.4857 8.0228 114.8138 59.7799 36.0785 176.7729 52 G 3.6464 8.3445 110.6315 46.7980 0.0000 172.7514 53 P 4.6003 0.0000 0.0000 63.0551 31.6653 175.4170 54 H 4.8393 7.8439 117.2836 54.8837 29.4184 173.2481 55 P 4.4167 0.0000 0.0000 63.1606 31.5052 175.7160 *57 W 4.8420 7.9337 118.2335 57.4457 30.7449 174.1539 58 S 6.0860 8.7173 115.6861 58.9285 66.4124 172.8078 59 Y 5.5519 8.2557 117.2702 55.5918 41.7274 173.5518 60 Q 5.1108 8.9594 121.2655 54.6105 32.1501 174.0215 61 L 5.4756 9.1205 124.1460 52.9579 46.0105 175.3875 62 A 5.1516 8.9405 124.1970 50.4215 22.6996 174.8055 63 F 5.2069 8.1623 114.1464 56.5118 41.9869 173.5630 64 T 4.6826 9.1534 110.2269 60.2267 70.1108 175.6526 65 Q 4.2584 8.7543 122.8289 59.3797 29.0817 178.1729 66 E 4.2270 7.8661 114.4935 58.1308 29.8920 177.8517 67 Q 4.4770 8.0522 117.1578 56.1557 29.1551 177.3344 68 F 4.1083 7.9528 122.7640 61.2472 39.4185 176.7944 69 A 3.8439 8.0790 119.8494 55.0643 18.2254 178.9261 70 D 4.2892 8.0003 116.0431 57.4521 41.4522 178.1045 71 L 3.7741 7.8619 120.8781 58.1122 41.9030 179.0937 72 V 3.4180 7.5774 118.6929 65.5052 31.3957 178.1462 73 G 3.5974 8.0205 105.6252 47.5843 0.0000 175.4609 74 W 4.1248 8.4781 131.3658 60.1663 30.9085 178.0576 75 L 4.1058 8.6818 119.4167 58.1529 40.7871 179.6215 76 T 3.8661 7.9490 115.1832 66.5709 68.4194 176.2686 77 L 4.1851 7.5793 119.5956 56.3047 40.5730 177.4047 78 N 4.7013 7.4699 113.6263 52.7568 39.9137 175.7065 79 H 4.3190 8.3213 115.4073 56.1549 30.0483 176.8085 80 G 3.6147 6.6294 108.0849 47.1746 0.0000 174.1398 81 A 4.5240 8.7237 127.4168 51.5031 18.8532 176.6294 82 L 4.6093 7.6268 118.4969 54.4273 42.6572 176.5083 83 D 5.0208 8.7938 123.9287 54.3669 42.5453 175.3431 84 I 4.8187 8.7736 122.7854 59.4635 40.8523 174.1689 85 F 4.0797 8.4117 130.0444 56.8760 40.6026 174.4410 86 L 5.0556 8.3010 125.5474 53.3086 45.9070 175.1168 87 H 5.2586 8.5248 116.1436 53.6902 32.0332 171.2297 88 P 3.6888 0.0000 0.0000 62.2848 32.6059 175.1073 89 N 4.8858 8.5371 121.0284 52.3821 40.1232 174.8072 90 T 4.4291 9.5248 116.2357 61.2390 69.3020 175.3481 91 G 3.8805 8.8451 110.4897 45.5216 0.0000 173.8005 92 D 4.5748 7.6213 118.4351 50.9253 41.9394 175.2360 93 A 4.0212 8.4581 127.1831 54.6877 18.4913 178.7647 94 L 3.8442 7.7957 118.2132 58.2395 42.2147 178.8783 95 R 3.8661 8.1669 118.6345 59.6203 30.1209 178.1545 96 D 4.2933 8.4100 118.9535 57.8330 40.5965 178.5904 97 H 4.4397 8.2905 115.6250 58.5447 28.8203 177.6273 98 R 4.1179 8.3023 120.2248 58.9284 30.1527 176.8236 99 D 4.8635 8.3819 115.2720 54.1319 42.4781 176.5289 100 A 4.7434 7.7291 121.1337 51.4299 19.5631 175.8298 101 A 4.5749 8.3004 121.0615 53.7131 19.4141 178.2599 102 V 4.6698 8.7722 121.0830 60.9278 35.4337 174.4191 103 W 5.5667 8.7378 125.0016 55.1649 32.9509 174.5089 104 I 4.0809 8.9088 126.6480 62.1995 38.0084 175.1567 105 G 4.1629 9.4087 115.4260 44.5397 0.0000 175.7041 106 H 4.9509 7.5274 116.0259 53.3327 31.6998 173.6792 107 S 2.7900 8.0525 116.6562 57.6295 63.7975 173.0479 108 H 4.6319 5.2900 117.4279 53.4640 32.3148 173.3833 109 E 4.1771 8.4611 120.5653 56.4014 29.9863 176.6209 110 L 4.8670 8.1713 121.3590 53.1664 44.7065 177.4288 111 V 4.0308 8.1200 122.3132 61.3622 30.0372 176.5664 112 L 4.0382 7.9433 125.0474 56.9011 42.1004 179.6937 113 S 4.1030 8.0777 112.0375 60.8136 62.8699 175.3648 114 A 4.0792 7.8351 123.1720 54.2023 18.3889 177.2840 115 L 4.1330 7.6701 120.4535 55.0395 41.6426 176.7700 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 0 G 8.35 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *2 T 8.20 4.16 4.24 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 1.25 0.00 0.00 3 F 9.06 4.12 0.00 2.99 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 4 R 8.32 4.74 0.00 1.73 1.78 0.00 3.14 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.73 0.00 5 D 8.27 4.81 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.35 4.02 4.24 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 1.22 0.00 0.00 7 S 7.98 4.18 0.00 3.98 4.03 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 8 A 7.86 3.98 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 I 7.30 3.88 1.79 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.40 0.29 0.00 0.00 10 A 8.73 4.24 1.23 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 0.00 0.00 0.00 11 S 7.36 4.44 0.00 3.81 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 12 W 8.48 4.82 0.00 1.78 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 H 8.78 5.24 0.00 2.62 3.03 0.00 5.55 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 9.32 5.11 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 15 H 9.10 5.16 0.00 3.10 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.34 4.11 0.73 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 0.96 0.00 0.00 0.76 0.00 0.00 17 Y 8.76 5.61 0.00 3.10 2.76 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 18 F 8.72 5.10 0.00 3.17 3.14 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 19 D 9.06 3.50 0.00 2.10 2.24 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 20 A 7.61 4.27 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 7.90 4.23 0.00 3.97 3.99 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 22 S 8.17 4.84 0.00 4.17 4.16 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 23 R 8.20 4.27 0.00 2.47 2.22 0.00 3.24 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.25 0.00 24 D 8.27 4.44 0.00 2.81 2.78 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 25 A 8.16 4.06 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 26 A 8.42 4.14 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.65 3.68 0.00 3.34 3.20 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 0.00 28 T 8.30 3.89 4.47 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 1.26 0.00 0.00 29 L 8.19 4.08 0.00 1.96 2.03 1.11 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.92 3.76 0.00 1.22 1.30 0.00 2.21 0.00 0.00 2.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.11 0.00 31 E 7.89 3.68 0.00 1.96 1.84 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 1.47 2.15 0.00 32 Q 8.19 4.09 0.00 2.47 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.72 2.86 0.00 33 I 8.25 3.73 2.05 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.38 0.77 0.00 0.00 34 E 8.30 3.90 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 35 A 8.15 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.53 3.80 0.00 2.87 2.74 0.00 5.93 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 W 8.09 4.33 0.00 3.49 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 38 S 8.73 3.71 0.00 3.98 3.90 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 0.00 0.00 0.00 39 G 8.34 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 0.00 0.00 0.00 40 K 8.10 4.18 0.00 1.96 1.92 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.71 7.81 41 L 7.58 4.43 0.00 1.39 1.45 -0.17 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.47 4.39 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 43 L 8.47 5.01 0.00 1.59 1.53 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.98 4.15 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 0.00 0.00 0.00 45 R 8.47 4.25 0.00 1.54 1.84 0.00 3.20 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 46 F 8.91 4.69 0.00 3.03 3.20 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 0.00 47 H 9.16 4.73 0.00 3.36 3.28 0.00 5.66 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.13 3.32 0.00 1.37 1.12 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 2.17 2.27 0.00 49 R 6.64 4.32 0.00 1.85 1.75 0.00 2.91 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 50 P 0.00 4.34 0.00 2.19 2.17 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 51 V 8.02 4.49 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.91 0.00 0.00 52 G 8.34 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.60 0.00 2.10 2.19 0.00 3.46 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 1.65 1.83 0.00 54 H 7.84 4.84 0.00 3.21 3.02 0.00 5.65 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 55 P 0.00 4.42 0.00 2.09 2.09 0.00 3.57 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 1.71 2.22 0.00 *57 W 7.93 4.84 0.00 2.46 2.13 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 58 S 8.72 6.09 0.00 4.21 4.02 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 59 Y 8.26 5.55 0.00 3.24 3.31 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 0.00 60 Q 8.96 5.11 0.00 2.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 61 L 9.12 5.48 0.00 1.65 1.50 0.81 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.94 5.15 0.95 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 0.00 0.00 63 F 8.16 5.21 0.00 3.15 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 64 T 9.15 4.68 4.47 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 1.25 0.00 0.00 65 Q 8.75 4.26 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 66 E 7.87 4.23 0.00 2.11 2.05 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 0.00 2.39 2.38 0.00 67 Q 8.05 4.48 0.00 2.44 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 68 F 7.95 4.11 0.00 3.11 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.08 3.84 1.38 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 0.00 0.00 70 D 8.00 4.29 0.00 2.87 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 71 L 7.86 3.77 0.00 0.99 0.79 -0.41 -0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.58 3.42 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 -0.16 0.00 0.00 73 G 8.02 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 W 8.48 4.12 0.00 3.57 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.68 4.11 0.00 1.64 1.70 0.74 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.95 3.87 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 77 L 7.58 4.19 0.00 1.58 1.56 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 78 N 7.47 4.70 0.00 1.79 2.05 0.00 0.00 6.62 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 79 H 8.32 4.32 0.00 3.44 3.71 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 6.63 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.72 4.52 1.31 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 0.00 0.00 0.00 82 L 7.63 4.61 0.00 1.91 1.78 1.08 1.09 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 83 D 8.79 5.02 0.00 2.86 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 84 I 8.77 4.82 1.81 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 1.10 1.04 0.87 0.00 0.00 85 F 8.41 4.08 0.00 1.60 2.28 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 86 L 8.30 5.06 0.00 1.55 1.58 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.52 5.26 0.00 3.04 2.96 0.00 5.45 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 3.69 0.00 1.40 0.49 0.00 3.59 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.50 0.00 89 N 8.54 4.89 0.00 2.66 2.68 0.00 0.00 7.01 6.80 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 90 T 9.52 4.43 4.14 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 1.07 0.00 0.00 91 G 8.85 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 92 D 7.62 4.57 0.00 2.59 2.47 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 93 A 8.46 4.02 1.31 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 0.00 0.00 0.00 94 L 7.80 3.84 0.00 1.74 1.66 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.17 3.87 0.00 2.08 2.02 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 96 D 8.41 4.29 0.00 2.81 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 97 H 8.29 4.44 0.00 3.14 3.42 0.00 5.85 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.30 4.12 0.00 1.88 2.02 0.00 3.23 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 99 D 8.38 4.86 0.00 2.80 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 0.00 100 A 7.73 4.74 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 0.00 101 A 8.30 4.57 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 8.77 4.67 2.23 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 0.99 0.00 0.00 1.16 0.00 0.00 103 W 8.74 5.57 0.00 3.22 3.14 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 0.00 104 I 8.91 4.08 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.58 0.60 0.00 0.00 105 G 9.41 4.16 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 0.00 106 H 7.53 4.95 0.00 3.15 3.08 0.00 5.85 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.05 2.79 0.00 2.93 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 H 5.29 4.63 0.00 2.98 3.15 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.46 4.18 0.00 1.93 1.86 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 2.25 2.23 0.00 110 L 8.17 4.87 0.00 1.59 1.60 0.62 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.12 4.03 2.04 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 0.94 0.00 0.00 0.90 0.00 0.00 112 L 7.94 4.04 0.00 1.73 1.68 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.08 4.10 0.00 3.95 3.99 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 0.00 114 A 7.84 4.08 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.67 4.13 0.00 1.69 1.52 0.72 0.46 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 * Residues marked with a * may have inaccurate shift predictions.