NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3476 8.1233 123.5833 52.5665 19.4763 179.9111 2 T 3.6265 5.7900 118.8855 62.5736 69.4912 172.1267 3 K 4.6655 8.9264 122.5462 55.1134 36.9792 174.7385 4 K 5.2675 8.7097 124.6252 54.8631 36.6341 174.7318 5 A 5.0192 8.9426 123.6094 50.9780 23.5463 175.1005 6 V 5.0009 8.8481 117.0761 60.5736 35.3569 173.6393 7 A 5.0951 9.1727 123.5345 50.2991 22.5546 175.0133 8 V 4.5307 8.4066 121.8499 61.5748 33.6003 174.3301 9 L 4.9594 8.9854 128.5133 53.3920 43.7096 175.8659 10 K 4.9238 8.3463 121.4186 55.5175 37.2233 175.8814 11 G 4.2893 7.9641 107.7729 46.5127 0.0000 172.4623 12 N 4.6901 8.5130 115.6653 51.8702 38.3670 174.1924 13 S 4.5177 7.0869 111.4570 58.7152 65.6406 175.0457 14 N 4.6882 8.6691 118.1773 53.4402 38.6045 175.4971 15 V 4.2446 7.7382 119.8565 62.4753 32.3213 174.3866 16 E 5.4488 7.5500 123.2656 55.8348 33.3297 174.2786 17 G 4.0381 7.9867 106.1611 46.3359 0.0000 171.7613 18 V 5.0397 8.2261 118.5538 61.1553 35.3590 174.6198 19 V 5.0431 9.0477 127.2718 61.3547 34.5344 174.2013 20 T 5.1389 8.8192 117.8568 60.1298 71.7097 173.3958 21 L 5.3547 8.8631 122.5049 53.2752 46.2738 175.5561 22 S 5.0313 8.9257 116.7815 56.8888 66.0004 172.4472 23 Q 4.7755 8.9908 127.6085 54.7305 32.4758 173.5209 24 D 4.6446 8.8578 126.0036 53.1007 42.3997 177.1838 25 D 4.3678 8.9986 125.3399 55.6307 41.2249 173.6754 26 D 4.9166 9.0154 110.6055 53.6501 41.6595 175.5489 27 G 3.9931 7.9952 108.6528 43.5012 0.0000 172.3089 28 P 4.5021 0.0000 0.0000 63.2918 32.2434 176.2024 29 T 4.7271 8.9144 120.0273 62.3780 70.7629 173.6956 30 T 4.8376 8.9131 124.2211 62.4171 70.6943 174.0591 31 V 4.8188 9.1488 126.0038 61.3027 34.7077 173.6415 32 N 5.4070 9.1065 126.0013 51.5793 40.9358 174.0874 33 V 4.8077 8.9891 123.9853 61.0248 35.0374 174.4110 34 R 5.0112 8.7751 127.2453 55.0814 33.3025 173.5042 35 I 5.1517 8.9411 127.8178 59.6500 41.1212 174.9056 36 T 4.8304 8.8452 115.7868 60.5011 72.4273 174.8414 37 G 3.8499 8.8351 107.6342 45.7522 0.0000 173.8504 38 L 4.2150 7.5707 119.6463 53.5067 42.4965 176.3259 39 A 4.3362 8.3318 124.3444 51.2062 19.0131 176.0542 40 P 4.4045 0.0000 0.0000 64.0485 32.1745 174.8336 41 G 3.6984 8.5158 106.6003 43.7143 0.0000 172.5951 42 L 4.8373 8.1822 118.8277 54.9800 42.3939 176.7668 43 H 5.0653 9.3311 119.5045 53.7802 33.3526 173.3910 44 G 4.2147 9.0660 108.6726 46.5307 0.0000 172.9950 45 F 5.7673 8.6652 123.6427 57.4026 42.1902 172.7007 46 H 5.3264 9.2981 122.9591 53.8228 33.5101 172.9081 47 L 4.6892 8.8856 121.6778 54.9525 43.0526 175.9275 48 H 5.3231 9.2465 119.9535 53.7666 32.2726 174.5760 49 E 3.3424 8.9919 121.4612 58.4539 30.1723 176.6370 50 Y 4.6959 8.1247 116.7386 55.2085 41.1264 177.1130 51 G 4.3042 8.3013 113.2509 44.4460 0.0000 174.1686 52 D 4.8161 7.8436 117.0239 52.8851 42.9025 174.9081 53 T 5.0701 8.5620 116.1960 60.7622 69.1710 175.5816 54 T 4.0040 8.8015 115.5320 64.4550 68.9633 174.1746 55 N 4.8860 7.9503 120.8529 52.8386 39.8423 175.4694 56 G 3.8599 7.8945 107.2599 45.9308 0.0000 175.3215 57 C 4.4918 8.5480 115.0468 59.0838 34.5642 175.3941 58 M 3.9878 7.9660 120.9615 57.9508 31.4271 177.7052 59 S 4.4785 7.9047 111.9471 59.6781 63.8744 175.3589 60 T 4.6130 7.3053 115.2001 63.5000 68.9237 175.6866 61 G 4.0612 8.2168 109.8067 45.7581 0.0000 173.2957 62 A 4.3484 8.4022 121.7178 51.8025 19.9800 177.2797 63 H 4.0461 8.8502 116.4779 56.6632 29.5339 174.4904 64 F 4.7504 9.1675 125.0711 56.4042 41.6857 173.6795 65 N 4.9106 7.9586 124.5709 50.2661 39.0060 172.4854 66 P 3.8978 0.0000 0.0000 64.6609 31.8796 177.1854 67 N 4.8791 8.2433 115.7313 52.5509 39.0928 176.8998 68 K 3.7212 8.1144 121.5835 59.5002 32.1547 177.3664 69 L 4.3517 7.5694 114.5827 54.9272 42.0520 176.9481 70 T 4.0007 7.5098 116.5560 64.0008 69.2602 175.1449 71 H 4.6899 8.2854 123.6802 54.9495 27.5397 175.0183 *80 H 4.6587 7.8018 115.2411 54.6057 31.2541 173.7047 81 A 4.1520 7.6250 123.7807 53.8124 18.8271 178.0709 82 G 4.1101 8.9776 109.3615 46.4015 0.0000 172.5296 83 D 4.6235 7.6961 119.0788 53.0344 40.7809 176.0742 84 L 4.0600 8.2337 127.4454 55.2727 42.1030 178.2662 85 G 4.0765 8.2171 106.1168 44.6603 0.0000 173.3691 86 N 4.9142 8.5203 118.6996 53.1943 39.3288 174.4440 87 I 4.5806 8.7407 115.8312 59.1326 41.0764 174.3422 88 V 4.7548 8.2185 123.0712 61.1645 33.1930 174.7204 89 A 4.6135 8.7860 130.8753 51.2595 20.0845 177.3384 90 N 4.9336 9.1460 120.7635 51.7987 38.7445 175.7298 91 A 4.2014 8.4228 120.0439 54.7052 18.3774 177.9029 92 D 4.5563 8.3555 114.4503 54.0260 41.3548 177.3412 93 G 4.0893 8.7200 108.6185 44.7614 0.0000 172.6799 94 V 4.7662 7.8141 119.0239 60.6587 34.1794 174.2310 95 A 5.0151 9.0829 129.8172 50.2249 21.2109 174.9017 96 E 5.0421 8.7741 123.3011 55.0944 31.8910 175.0374 97 V 4.6498 8.7285 125.8730 60.3860 35.6287 174.0173 98 T 5.1742 8.4953 117.6509 61.8884 71.1281 173.4682 99 L 4.9426 9.2494 125.6310 52.8158 45.9839 175.5882 100 V 4.8470 8.3617 120.4270 61.2558 33.9571 174.0746 101 D 4.8711 9.1954 127.8054 52.2854 44.1081 175.4310 102 N 4.9638 8.7725 122.2604 53.4255 38.8535 175.2985 103 Q 4.6504 8.4463 116.9281 55.6857 29.8386 176.6183 104 I 4.5277 7.5009 118.1847 58.5384 38.3873 172.6621 105 P 4.5673 0.0000 0.0000 62.4979 32.1780 177.7561 106 L 4.5642 9.0144 121.3130 54.7717 42.1955 176.0612 107 T 4.5619 7.4255 107.8713 60.3697 72.1975 173.7786 108 G 3.9469 8.5254 108.3499 44.1935 0.0000 172.6134 109 P 4.3101 0.0000 0.0000 64.8881 31.3322 177.4538 110 N 5.0457 7.9548 113.5409 52.7520 38.8625 174.6652 111 S 4.3543 7.6401 112.6870 59.2676 62.7902 174.9102 112 V 3.8638 8.4549 118.1859 61.7155 31.9144 176.5816 113 V 3.7805 7.4791 121.3374 64.3110 31.6298 176.2576 114 G 3.9600 9.6497 115.6379 45.4210 0.0000 172.9770 115 R 4.9067 7.7372 119.9973 54.8223 33.4586 174.9179 116 A 5.2387 8.1738 119.9653 51.1331 23.1779 175.5731 117 L 5.1595 8.5679 119.3452 53.0551 44.8054 176.0203 118 V 4.9001 8.8062 121.9840 61.2347 35.4399 173.9608 119 V 4.9763 8.7778 127.5435 61.9017 33.3487 174.0908 120 H 5.5418 9.1812 125.0849 53.8092 31.6885 173.4444 121 E 4.3230 9.3412 123.9873 55.4863 30.1123 177.3331 122 L 4.6465 8.0315 126.6266 53.9747 42.0051 177.2349 *142 G 3.8585 7.7036 107.3821 45.1270 0.0000 171.8714 143 R 4.5053 7.7811 118.4295 55.2761 28.9343 176.2876 144 L 4.2877 8.8735 125.6977 57.4212 42.8860 177.0809 145 A 4.8584 7.6712 117.9506 51.3811 22.9064 173.8815 146 C 5.6745 8.6085 112.3648 56.1299 44.7334 173.0131 147 G 4.7316 8.2158 104.8897 46.0707 0.0000 172.0412 148 V 4.6593 8.2121 121.2417 61.5634 33.1289 175.6293 149 V 4.0279 8.8551 128.6934 62.7118 32.2597 175.0677 150 G 4.5170 9.1049 115.4918 44.0053 0.0000 172.0615 151 L 4.6570 8.3683 120.2506 55.0152 42.4783 176.4217 152 T 4.7292 8.1305 115.2449 59.6384 70.9268 171.8322 153 P 4.2636 0.0000 0.0000 63.1868 31.9556 176.6423 154 I 3.9530 8.2811 121.7139 61.6997 37.0797 175.8718 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 1 A 8.12 4.35 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 2 T 5.79 3.63 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 K 8.93 4.67 0.00 1.82 1.59 0.00 1.57 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.42 7.81 4 K 8.71 5.27 0.00 1.86 1.63 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.41 7.81 5 A 8.94 5.02 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 6 V 8.85 5.00 2.09 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 0.82 0.00 0.00 1.01 0.00 0.00 7 A 9.17 5.10 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 8 V 8.41 4.53 2.09 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 1.04 0.00 0.00 0.94 0.00 0.00 9 L 8.99 4.96 0.00 1.63 1.56 0.99 0.63 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 10 K 8.35 4.92 0.00 1.67 1.63 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.35 1.23 7.81 11 G 7.96 4.29 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 0.00 12 N 8.51 4.69 0.00 2.67 2.78 0.00 0.00 6.65 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 7.09 4.52 0.00 3.96 3.81 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 14 N 8.67 4.69 0.00 2.72 2.87 0.00 0.00 6.73 7.68 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 15 V 7.74 4.24 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 1.16 0.00 0.00 0.95 0.00 0.00 16 E 7.55 5.45 0.00 2.08 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 2.40 2.14 0.00 17 G 7.99 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 0.00 0.00 0.00 0.00 18 V 8.23 5.04 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 0.94 0.00 0.00 0.93 0.00 0.00 19 V 9.05 5.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.06 0.00 0.00 20 T 8.82 5.14 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 1.22 0.00 0.00 21 L 8.86 5.35 0.00 1.61 1.55 1.01 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.93 5.03 0.00 3.87 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 23 Q 8.99 4.78 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 24 D 8.86 4.64 0.00 2.72 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 25 D 9.00 4.37 0.00 2.77 1.80 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 26 D 9.02 4.92 0.00 2.62 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 27 G 8.00 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 0.00 0.00 0.00 28 P 0.00 4.50 0.00 1.95 2.01 0.00 3.65 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 2.03 2.24 0.00 29 T 8.91 4.73 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 1.27 0.00 0.00 30 T 8.91 4.84 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 1.23 0.00 0.00 31 V 9.15 4.82 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 1.09 0.00 0.00 0.96 0.00 0.00 32 N 9.11 5.41 0.00 2.69 2.71 0.00 0.00 5.97 7.20 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 33 V 8.99 4.81 2.07 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 0.67 0.00 0.00 0.96 0.00 0.00 34 R 8.78 5.01 0.00 1.87 1.69 0.00 3.43 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 35 I 8.94 5.15 1.73 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.44 0.87 0.00 0.00 36 T 8.85 4.83 4.22 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 1.19 0.00 0.00 37 G 8.84 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.57 4.22 0.00 1.83 1.45 0.74 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.33 4.34 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 40 P 0.00 4.40 0.00 2.06 2.10 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.21 0.00 41 G 8.52 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 42 L 8.18 4.84 0.00 1.53 1.61 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.33 5.07 0.00 3.00 3.27 0.00 5.61 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 44 G 9.07 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 0.00 0.00 0.00 0.00 45 F 8.67 5.77 0.00 3.02 3.11 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 0.00 0.00 0.00 46 H 9.30 5.33 0.00 3.25 3.13 0.00 5.66 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.89 4.69 0.00 1.76 1.69 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 48 H 9.25 5.32 0.00 2.97 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.99 3.34 0.00 1.87 1.52 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 1.47 1.66 0.00 50 Y 8.12 4.70 0.00 2.93 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 51 G 8.30 4.30 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 0.00 52 D 7.84 4.82 0.00 2.61 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 53 T 8.56 5.07 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 1.21 0.00 0.00 54 T 8.80 4.00 4.23 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 1.23 0.00 0.00 55 N 7.95 4.89 0.00 2.65 2.78 0.00 0.00 7.22 7.45 0.00 0.00 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 7.89 3.86 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 0.00 0.00 0.00 57 C 8.55 4.49 0.00 2.95 3.08 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 0.00 0.00 0.00 0.00 58 M 7.97 3.99 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 59 S 7.90 4.48 0.00 4.12 3.97 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 60 T 7.31 4.61 4.31 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 1.28 0.00 0.00 61 G 8.22 4.06 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 0.00 0.00 0.00 62 A 8.40 4.35 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.85 4.05 0.00 3.00 3.23 0.00 5.65 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 64 F 9.17 4.75 0.00 2.98 2.84 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 65 N 7.96 4.91 0.00 2.55 2.48 0.00 0.00 7.38 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 66 P 0.00 3.90 0.00 2.01 2.14 0.00 3.54 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 2.19 2.19 0.00 67 N 8.24 4.88 0.00 2.67 2.71 0.00 0.00 6.47 7.58 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 68 K 8.11 3.72 0.00 1.71 1.74 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.38 7.81 69 L 7.57 4.35 0.00 1.60 1.60 0.89 0.82 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 70 T 7.51 4.00 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 1.19 0.00 0.00 71 H 8.29 4.69 0.00 3.11 3.22 0.00 5.75 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *80 H 7.80 4.66 0.00 3.20 3.32 0.00 5.63 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 81 A 7.62 4.15 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 82 G 8.98 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 83 D 7.70 4.62 0.00 2.65 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 84 L 8.23 4.06 0.00 1.42 1.67 0.69 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.22 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.52 4.91 0.00 2.65 2.80 0.00 0.00 6.80 7.45 0.00 0.00 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 8.74 4.58 1.78 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.12 0.83 0.00 0.00 88 V 8.22 4.75 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 0.81 0.00 0.00 0.94 0.00 0.00 89 A 8.79 4.61 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 90 N 9.15 4.93 0.00 2.92 2.99 0.00 0.00 6.53 7.28 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 91 A 8.42 4.20 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 92 D 8.36 4.56 0.00 2.86 2.70 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 93 G 8.72 4.09 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 0.00 0.00 0.00 94 V 7.81 4.77 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 1.03 0.00 0.00 0.95 0.00 0.00 95 A 9.08 5.02 1.16 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 96 E 8.77 5.04 0.00 1.91 1.81 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 2.16 2.37 0.00 97 V 8.73 4.65 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 0.73 0.00 0.00 0.94 0.00 0.00 98 T 8.50 5.17 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 1.28 0.00 0.00 99 L 9.25 4.94 0.00 1.57 1.56 1.13 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 100 V 8.36 4.85 2.09 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 0.79 0.00 0.00 0.94 0.00 0.00 101 D 9.20 4.87 0.00 2.70 2.44 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 0.00 102 N 8.77 4.96 0.00 2.75 2.80 0.00 0.00 6.83 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 0.00 103 Q 8.45 4.65 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.17 7.07 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 104 I 7.50 4.53 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.73 0.91 0.00 0.00 105 P 0.00 4.57 0.00 2.38 2.19 0.00 3.72 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.00 0.00 106 L 9.01 4.56 0.00 1.70 1.74 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 107 T 7.43 4.56 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 1.22 0.00 0.00 108 G 8.53 3.95 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 0.00 109 P 0.00 4.31 0.00 2.08 2.14 0.00 3.67 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 2.03 2.11 0.00 110 N 7.95 5.05 0.00 2.75 2.97 0.00 0.00 6.82 7.57 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 0.00 111 S 7.64 4.35 0.00 3.95 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 0.00 112 V 8.45 3.86 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 0.81 0.00 0.00 0.98 0.00 0.00 113 V 7.48 3.78 2.07 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 0.73 0.00 0.00 0.93 0.00 0.00 114 G 9.65 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.74 4.91 0.00 1.67 1.80 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.42 0.00 116 A 8.17 5.24 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.57 5.16 0.00 1.70 1.72 1.02 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.81 4.90 2.02 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 0.74 0.00 0.00 0.79 0.00 0.00 119 V 8.78 4.98 2.09 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 0.94 0.00 0.00 0.91 0.00 0.00 120 H 9.18 5.54 0.00 3.18 3.23 0.00 5.67 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.34 4.32 0.00 1.98 1.89 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 2.34 2.31 0.00 122 L 8.03 4.65 0.00 1.60 1.60 1.01 0.98 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 *142 G 7.70 3.86 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 0.00 0.00 0.00 143 R 7.78 4.51 0.00 1.68 1.85 0.00 3.22 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.67 0.00 144 L 8.87 4.29 0.00 1.73 1.70 1.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.67 4.86 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 0.00 146 C 8.61 5.67 0.00 3.02 3.11 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 0.00 0.00 0.00 147 G 8.22 4.73 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 0.00 0.00 0.00 148 V 8.21 4.66 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 0.83 0.00 0.00 0.99 0.00 0.00 149 V 8.86 4.03 2.25 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 0.86 0.00 0.00 0.92 0.00 0.00 150 G 9.10 4.52 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 0.00 0.00 0.00 151 L 8.37 4.66 0.00 1.55 1.61 0.92 0.76 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 0.00 152 T 8.13 4.73 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 1.26 0.00 0.00 153 P 0.00 4.26 0.00 2.08 2.00 0.00 3.73 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 2.03 2.13 0.00 154 I 8.28 3.95 1.87 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 1.28 0.47 0.98 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.