NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.4552 8.1593 117.3753 63.7627 70.1648 172.6285 3 T 4.6981 8.5976 114.8993 58.7013 72.1922 173.2489 4 A 3.9740 8.8390 124.8819 55.3627 19.4243 181.2690 5 R 3.8808 8.1206 115.2401 59.6040 30.2149 177.6471 6 D 4.5030 7.8473 116.3695 56.5086 40.9476 177.1775 7 I 3.8611 7.3562 117.9846 61.9375 38.4178 175.8464 8 M 4.4314 7.9118 117.4886 55.2696 32.3424 176.2035 9 N 4.7715 8.9330 117.9888 52.1404 39.6449 174.5102 10 A 4.5665 8.6369 126.3859 51.6295 19.9440 176.8222 11 G 3.7914 8.6770 108.6337 46.6849 0.0000 174.8749 12 V 3.8324 7.6510 111.3932 60.3045 32.4764 176.5827 13 T 3.7654 8.1316 118.5142 64.1759 68.7282 174.2058 14 C 5.0752 8.2952 125.4730 54.4319 46.7255 173.4827 15 V 3.8473 8.4441 126.9433 61.1116 32.4822 176.1196 16 G 3.9835 9.5907 113.4492 45.8111 0.0000 174.3859 17 E 4.0044 8.9615 121.1221 59.1381 29.5350 178.2930 18 H 4.7527 7.8751 113.5106 55.7167 29.4953 175.0511 19 E 4.2921 8.0983 120.8519 55.9045 30.2928 176.6700 20 T 5.2548 8.0229 113.7472 60.7016 71.3130 175.7606 21 L 4.0701 8.3130 120.6209 58.0909 41.5870 179.8832 22 T 3.8573 8.1399 115.7903 66.3857 68.3338 176.5651 23 A 3.9056 7.7874 122.0434 54.9814 18.3371 179.4976 24 A 4.1629 8.0946 119.0617 55.3382 18.4968 179.5669 25 A 3.9379 8.3494 119.6573 55.5736 18.4120 179.8942 26 Q 3.8824 8.0288 116.3582 59.2826 28.6343 178.6759 27 Y 4.2862 7.5972 117.7425 61.4081 37.8946 178.5006 28 M 4.1177 8.4344 119.8486 58.2356 32.0281 178.9263 29 R 3.8473 8.0866 118.9019 59.2807 30.1319 177.8214 30 E 3.8342 8.2429 118.6356 59.5527 29.4974 177.3280 31 H 4.6882 8.3708 112.0636 54.8174 29.5696 174.3836 32 D 4.4362 7.7299 118.8327 55.4446 39.7756 172.4094 33 I 4.7112 7.8799 110.5728 59.3552 41.1253 175.8334 34 G 4.1646 8.4965 106.5093 46.2808 0.0000 172.7160 35 A 5.2812 7.6089 120.3020 50.7491 22.3039 175.8897 36 L 4.9471 9.0447 120.2972 52.1979 46.4395 174.5434 37 P 4.7988 0.0000 0.0000 62.7891 33.3545 174.7261 38 I 4.9757 8.8647 122.5105 59.9298 39.6494 174.1099 39 C 5.2257 9.1106 123.7500 55.2592 43.8041 174.2842 40 G 3.9267 8.3571 112.4781 44.7339 0.0000 173.4580 41 D 4.4060 8.4802 120.3007 55.4477 41.6632 175.5166 42 D 4.4348 9.3044 118.9106 55.9713 38.5837 173.6757 43 D 4.3680 8.0334 112.1445 55.2078 39.0002 173.8659 44 R 4.2766 7.6459 119.0370 55.4237 30.4409 176.0948 45 L 4.3975 8.3591 125.5900 55.4373 42.5994 175.9729 46 H 4.8239 10.4556 122.1879 54.5723 31.1299 174.8044 47 G 3.8172 6.6646 105.0514 45.5136 0.0000 170.4925 48 M 5.1948 7.8519 118.0260 53.3322 35.8740 175.0757 49 L 4.9942 8.9605 123.7828 53.6264 45.2591 175.8123 50 T 5.0610 9.0568 116.7556 60.0886 71.4049 175.5615 51 D 4.3641 8.9852 122.8011 56.7850 39.2847 178.8193 52 R 3.9331 7.9951 119.6263 58.9432 30.1024 177.9207 53 D 4.3733 8.2131 119.0064 57.5580 40.8205 178.7805 54 I 3.7337 7.5385 119.9854 64.3801 36.9952 178.7660 55 V 3.5571 7.5407 118.5787 66.0396 31.2202 178.1673 56 I 3.8191 8.3249 119.6423 64.0089 37.0733 178.0885 57 K 4.3240 8.4010 117.1770 57.8638 32.5074 177.6053 58 G 3.7680 8.0909 105.5018 45.6934 0.0000 175.4485 59 L 3.9778 7.7415 119.2577 57.2282 42.2553 179.5994 60 A 3.9921 8.2070 120.0725 54.6197 18.4315 177.9151 61 A 4.2708 7.3527 118.7130 52.1183 18.8594 178.1719 62 G 3.9318 8.0722 104.3638 45.6786 0.0000 174.1451 63 L 4.1947 7.5899 119.1559 53.8160 42.6285 176.3665 64 D 4.5921 8.4736 122.0475 52.5331 41.1696 175.3154 65 P 4.5664 0.0000 0.0000 65.3413 31.3230 177.5330 66 N 4.6190 8.5894 115.2865 54.4570 39.0547 175.1654 67 T 4.3426 7.6273 112.0090 64.8720 70.9326 174.6757 68 A 4.2609 8.3818 125.0730 52.6908 19.0007 176.7815 69 T 4.9628 9.0972 111.4233 59.5037 71.5608 175.7808 70 A 4.0179 8.8612 125.9021 55.2199 18.7165 180.5307 71 G 3.6974 8.2749 105.1892 48.7333 0.0000 175.6686 72 E 4.0497 7.9292 118.7357 58.3328 29.5334 177.5961 73 L 4.4093 7.4795 116.0076 54.4839 42.4606 176.5618 74 A 4.1702 7.2266 121.9891 51.3339 19.2516 176.6286 *78 I 3.9083 7.8881 118.8231 61.1091 38.8875 174.4394 79 Y 4.7152 7.1668 123.3147 55.9083 40.4451 173.0447 80 Y 4.7848 7.2566 118.2348 57.3645 40.4875 172.4448 81 V 4.6605 8.3221 111.2160 59.6437 36.5274 175.1967 82 D 5.1014 8.7703 121.8759 53.8665 42.2751 177.1123 83 A 4.0320 9.0010 128.0882 55.2425 18.5081 179.5304 84 N 4.8824 8.2575 111.1433 51.7651 38.2366 180.5579 85 A 4.3759 7.8601 122.6871 53.2167 19.1220 178.1252 86 S 4.8995 8.9484 116.9818 57.3661 65.7858 175.8490 87 I 3.6739 8.1231 122.3350 64.5772 36.8131 178.5096 88 Q 4.0010 8.0942 118.3226 59.2701 28.7143 178.9065 89 E 4.0066 8.1427 119.2833 59.5835 29.4360 179.4010 90 M 4.0967 8.2224 118.9446 58.4207 32.0190 178.8179 91 L 4.0273 8.3574 119.5588 57.7003 41.6801 179.3340 92 N 4.2947 8.2168 116.5556 56.3695 38.5398 177.6238 93 V 3.5850 7.6490 119.1212 66.2470 31.5176 178.0335 94 M 4.0058 8.0554 118.5481 58.3344 31.2780 178.6437 95 E 3.9360 8.3629 118.9018 59.3694 29.4237 179.2134 96 E 3.9497 8.2240 117.9029 58.8949 29.6077 178.0762 97 H 4.4772 7.9991 115.4859 54.7803 30.2121 175.2458 98 Q 3.4234 7.4267 117.9558 56.2005 25.6090 178.1155 99 V 4.6150 7.8882 110.9838 60.2464 36.0839 176.4946 100 R 4.6551 8.4459 117.5274 56.0950 31.7779 175.7014 101 R 5.1709 7.8921 117.5773 54.3895 33.8394 175.0434 102 V 4.7191 8.9151 122.3497 60.7868 35.4251 172.5648 103 P 4.8589 0.0000 0.0000 62.5361 32.9429 175.0874 104 V 4.9271 8.9837 123.7062 61.2931 33.9346 174.4827 105 I 5.0240 8.6817 128.0188 59.8290 40.9890 174.6147 106 S 4.6613 9.0025 118.9816 57.6655 66.1600 174.0768 107 E 3.7162 9.5038 126.5180 57.9764 26.8048 174.8910 108 H 4.0912 8.1804 110.6408 56.2455 26.8955 175.2013 109 R 4.7677 7.5076 118.3689 53.7264 33.0966 174.7852 110 L 4.3750 8.5996 123.7304 55.3525 42.5587 177.0971 111 V 4.3091 8.9461 117.9393 60.5460 34.5668 175.3116 112 G 4.3706 7.0080 106.0170 46.3932 0.0000 171.5154 113 I 5.2035 7.8987 119.3225 59.3747 41.3357 175.1402 114 V 4.7236 8.9464 126.0853 61.2811 34.4908 174.6020 115 T 5.0241 8.7290 117.2066 59.7645 71.6672 175.0762 116 E 3.9355 9.1766 122.9148 59.4235 29.5448 178.9627 117 A 4.0580 7.9690 120.4041 55.0239 18.2433 179.1578 118 D 4.3633 8.0125 116.9959 57.5987 41.2935 178.7219 119 I 3.8455 7.7141 119.6835 64.3295 36.8073 178.2480 120 A 4.0392 7.9993 121.8395 55.1704 18.0594 179.5063 121 R 4.1524 8.0989 112.0990 58.2414 29.9521 177.4530 122 H 4.5889 7.7354 115.0757 55.0489 29.6994 174.9888 123 L 4.3042 7.0269 120.9243 53.1967 42.3463 175.1727 124 P 4.4155 0.0000 0.0000 63.1223 31.2052 176.1104 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 T 8.16 4.46 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 3 T 8.60 4.70 4.38 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 1.21 0.00 0.00 4 A 8.84 3.97 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 5 R 8.12 3.88 0.00 1.89 1.98 0.00 3.26 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 6 D 7.85 4.50 0.00 2.87 2.72 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 7 I 7.36 3.86 1.79 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.63 0.70 0.00 0.00 8 M 7.91 4.43 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.70 0.00 9 N 8.93 4.77 0.00 2.65 2.79 0.00 0.00 7.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.64 4.57 1.20 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 0.00 0.00 11 G 8.68 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 12 V 7.65 3.83 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 0.76 0.00 0.00 0.88 0.00 0.00 13 T 8.13 3.77 4.12 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 0.00 0.00 0.64 0.00 0.00 14 C 8.30 5.08 0.00 2.84 2.83 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 15 V 8.44 3.85 2.14 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 0.72 0.00 0.00 1.12 0.00 0.00 16 G 9.59 3.98 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 0.00 0.00 0.00 17 E 8.96 4.00 0.00 2.08 2.17 0.00 0.00 0.00 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 1.79 0.00 18 H 7.88 4.75 0.00 3.19 3.37 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.10 4.29 0.00 2.23 1.95 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 2.40 2.41 0.00 20 T 8.02 5.25 4.48 0.00 0.00 0.00 0.00 0.00 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 21 L 8.31 4.07 0.00 1.84 1.77 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.14 3.86 4.21 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 1.16 0.00 0.00 23 A 7.79 3.91 1.26 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 0.00 0.00 24 A 8.09 4.16 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.35 3.94 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 26 Q 8.03 3.88 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.58 0.00 27 Y 7.60 4.29 0.00 3.21 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.43 4.12 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.61 0.00 29 R 8.09 3.85 0.00 1.89 2.03 0.00 3.11 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 30 E 8.24 3.83 0.00 1.98 2.11 0.00 0.00 0.00 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 2.28 0.00 31 H 8.37 4.69 0.00 3.21 3.30 0.00 5.86 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 32 D 7.73 4.44 0.00 2.77 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.88 4.71 1.91 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 1.31 0.90 0.97 0.00 0.00 34 G 8.50 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 35 A 7.61 5.28 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 36 L 9.04 4.95 0.00 1.56 1.49 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.80 0.00 2.04 2.11 0.00 3.71 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 38 I 8.86 4.98 1.85 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 1.22 0.69 0.94 0.00 0.00 39 C 9.11 5.23 0.00 2.73 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.36 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 41 D 8.48 4.41 0.00 2.71 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.30 4.43 0.00 2.76 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 43 D 8.03 4.37 0.00 2.81 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 44 R 7.65 4.28 0.00 2.09 1.85 0.00 3.23 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 45 L 8.36 4.40 0.00 1.45 1.41 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 46 H 10.46 4.82 0.00 3.16 3.25 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 6.66 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 M 7.85 5.19 0.00 1.87 1.86 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.97 0.00 49 L 8.96 4.99 0.00 1.72 1.49 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 50 T 9.06 5.06 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 1.27 0.00 0.00 51 D 8.99 4.36 0.00 2.98 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 52 R 8.00 3.93 0.00 1.91 1.99 0.00 3.20 0.00 0.00 3.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 53 D 8.21 4.37 0.00 2.98 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 54 I 7.54 3.73 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.75 0.92 0.00 0.00 55 V 7.54 3.56 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.98 0.00 0.00 56 I 8.32 3.82 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.97 0.92 0.00 0.00 57 K 8.40 4.32 0.00 1.84 1.87 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.46 7.81 58 G 8.09 3.77 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 0.00 0.00 0.00 59 L 7.74 3.98 0.00 1.86 1.74 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 60 A 8.21 3.99 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 61 A 7.35 4.27 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 62 G 8.07 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 63 L 7.59 4.19 0.00 1.78 1.61 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.47 4.59 0.00 2.67 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.57 0.00 2.25 2.30 0.00 3.74 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 66 N 8.59 4.62 0.00 2.84 2.89 0.00 0.00 6.81 8.25 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 67 T 7.63 4.34 4.36 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 1.22 0.00 0.00 68 A 8.38 4.26 1.25 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 0.00 0.00 0.00 69 T 9.10 4.96 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 70 A 8.86 4.02 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 71 G 8.27 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 7.93 4.05 0.00 2.05 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 0.00 2.36 2.30 0.00 73 L 7.48 4.41 0.00 1.66 1.72 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.23 4.17 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *78 I 7.89 3.91 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.17 1.02 0.00 0.00 79 Y 7.17 4.72 0.00 2.78 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 80 Y 7.26 4.78 0.00 3.09 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 81 V 8.32 4.66 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 0.72 0.00 0.00 0.99 0.00 0.00 82 D 8.77 5.10 0.00 2.89 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 9.00 4.03 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 84 N 8.26 4.88 0.00 2.77 2.70 0.00 0.00 6.96 6.79 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 85 A 7.86 4.38 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 86 S 8.95 4.90 0.00 4.19 4.01 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 0.00 0.00 0.00 87 I 8.12 3.67 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.62 0.91 0.00 0.00 88 Q 8.09 4.00 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 89 E 8.14 4.01 0.00 2.27 1.99 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 2.32 2.35 0.00 90 M 8.22 4.10 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.60 0.00 91 L 8.36 4.03 0.00 1.81 1.71 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.22 4.29 0.00 2.90 2.84 0.00 0.00 6.61 7.07 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 93 V 7.65 3.59 2.20 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 1.03 0.00 0.00 0.91 0.00 0.00 94 M 8.06 4.01 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.57 0.00 95 E 8.36 3.94 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.59 0.00 96 E 8.22 3.95 0.00 2.01 1.88 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 2.29 2.47 0.00 97 H 8.00 4.48 0.00 2.80 2.76 0.00 5.81 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 7.43 3.42 0.00 2.22 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.71 0.00 0.00 0.00 0.00 0.00 2.22 2.18 0.00 99 V 7.89 4.61 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 0.79 0.00 0.00 0.67 0.00 0.00 100 R 8.45 4.66 0.00 1.71 1.91 0.00 3.47 0.00 0.00 3.33 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 101 R 7.89 5.17 0.00 1.71 1.86 0.00 3.20 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 102 V 8.92 4.72 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 1.19 0.00 0.00 1.01 0.00 0.00 103 P 0.00 4.86 0.00 2.13 1.90 0.00 3.80 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 104 V 8.98 4.93 2.08 0.00 0.00 0.00 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 0.95 0.00 0.00 105 I 8.68 5.02 1.66 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.18 0.79 0.00 0.00 106 S 9.00 4.66 0.00 3.81 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 0.00 107 E 9.50 3.72 0.00 2.07 1.94 0.00 0.00 0.00 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 2.22 0.00 108 H 8.18 4.09 0.00 3.29 3.37 0.00 5.64 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.51 4.77 0.00 1.79 1.72 0.00 3.10 0.00 0.00 3.06 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.74 0.00 110 L 8.60 4.38 0.00 1.47 1.50 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.95 4.31 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 0.66 0.00 0.00 0.94 0.00 0.00 112 G 7.01 4.37 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 0.00 113 I 7.90 5.20 1.86 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 1.09 0.97 0.93 0.00 0.00 114 V 8.95 4.72 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 1.09 0.00 0.00 0.95 0.00 0.00 115 T 8.73 5.02 4.26 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 1.23 0.00 0.00 116 E 9.18 3.94 0.00 2.04 1.99 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 2.31 2.33 0.00 117 A 7.97 4.06 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 0.00 118 D 8.01 4.36 0.00 2.95 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 0.00 119 I 7.71 3.85 2.03 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 1.45 1.12 0.92 0.00 0.00 120 A 8.00 4.04 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 0.00 121 R 8.10 4.15 0.00 1.96 2.07 0.00 3.06 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.66 0.00 122 H 7.74 4.59 0.00 3.21 3.40 0.00 5.84 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.03 4.30 0.00 1.84 1.60 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.42 0.00 2.17 2.04 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 * Residues marked with a * may have inaccurate shift predictions.