NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2229 8.3027 121.4690 56.0438 31.4972 175.4517 2 V 3.7368 7.4897 117.9472 62.0784 31.9514 173.4069 3 K 4.7475 10.2643 129.8992 54.9056 36.8605 174.2646 4 L 5.1470 8.4744 124.9486 53.1822 46.1590 175.1010 5 Q 4.5890 8.9798 124.7662 54.3566 31.6012 173.6558 6 E 5.3084 8.8902 124.8734 55.9821 31.5294 175.4721 7 S 4.5829 9.6525 115.3242 57.7676 66.9044 174.6999 8 G 3.9197 9.4305 107.4966 44.8302 0.0000 173.1245 9 G 3.7095 8.7956 106.3591 44.4287 0.0000 172.2562 10 D 4.6484 7.7283 118.0892 52.8980 45.9570 174.6782 11 L 4.6642 8.4198 125.8146 55.3615 42.9328 176.1795 12 V 4.6050 9.4226 119.2257 60.2745 36.9375 173.9648 13 Q 4.9563 8.3297 119.0000 53.6050 31.5632 174.2779 14 P 4.6907 0.0000 0.0000 63.7705 31.8835 177.9517 15 G 3.9128 9.0997 109.0483 46.1029 0.0000 174.0819 16 G 4.0744 7.7935 107.8406 46.0650 0.0000 172.4345 17 S 5.1557 7.9578 113.3791 56.8589 66.6234 173.0063 18 L 4.2545 8.1409 118.5506 54.2000 46.0260 172.8342 19 K 4.7621 8.5278 126.1818 54.5313 34.3399 175.5919 20 L 4.4795 8.4329 128.0574 54.7052 43.2594 176.2641 21 S 5.4741 9.2694 116.2916 57.3986 68.0163 172.5889 22 C 5.3629 9.5852 121.9815 55.3132 44.9164 172.3886 23 A 4.8413 8.8311 128.6756 50.6709 20.0105 175.5063 24 A 5.0904 8.2737 125.7665 50.5783 20.9736 176.4041 25 S 4.2062 9.2745 115.2860 57.2970 66.9440 174.8157 26 G 4.0007 10.4831 109.0034 46.1952 0.0000 172.6804 27 F 4.7127 6.7925 111.9923 55.6560 40.3163 174.4143 28 T 4.0870 8.5624 117.9018 63.1917 67.1374 174.9486 29 F 4.2431 8.8115 130.1833 61.3562 39.3243 176.9201 30 S 4.4271 8.1474 110.9203 59.0152 63.0042 174.4409 31 S 4.4712 8.2839 116.7043 59.1932 63.3096 173.4852 32 Y 4.7446 7.4533 117.7178 56.2057 40.4477 175.6536 33 T 4.4367 8.4398 119.0528 63.6204 70.3909 173.6328 34 M 5.0236 8.9366 123.1233 54.0872 36.9976 174.3234 35 S 5.2608 8.5281 115.7218 57.1118 68.5476 172.7647 36 W 5.3411 9.4490 121.1746 55.0801 31.9814 175.2288 37 V 5.0799 9.1701 124.1780 61.0335 34.3979 174.2808 38 R 5.0276 9.2557 123.8396 54.3555 32.8834 174.5510 39 Q 5.1897 8.9599 123.2466 54.3788 31.0537 175.3417 40 T 4.3962 8.6882 117.7391 60.6196 69.4800 173.4088 41 P 3.9156 0.0000 0.0000 66.1320 31.0080 177.5097 42 E 4.0271 8.0214 116.3261 57.4145 29.5137 177.4159 43 K 4.0542 8.8556 118.2374 56.6384 30.1443 175.9468 44 R 4.4708 7.7913 118.9392 55.6671 31.6517 174.9459 45 L 5.4752 8.4979 124.1052 53.1317 44.3575 175.7134 46 E 4.8082 9.2644 122.2676 54.3673 33.6795 174.3634 47 W 5.0753 9.1884 135.0000 56.9509 30.9387 175.8200 48 V 4.7130 9.1055 126.1415 62.2318 33.3485 175.6178 49 A 4.9145 8.4640 120.0059 51.5620 22.4662 175.0355 50 S 5.3235 8.6097 113.6637 57.4191 66.7417 172.8400 51 I 5.2734 9.1160 125.1207 59.7305 42.1873 174.9139 52 N 5.0859 8.6819 125.1198 51.2686 39.4915 175.1156 53 N 4.2889 8.9685 114.8883 56.8317 38.4757 176.8387 54 G 3.6860 8.0072 103.9466 46.3159 0.0000 174.5276 55 G 3.9985 8.0657 107.0285 45.2427 0.0000 174.4477 56 G 3.8464 7.8820 107.1604 46.4355 0.0000 174.0612 57 R 4.6903 8.5745 119.7620 54.4546 33.7871 174.5932 58 T 5.0235 8.1025 112.3938 60.1373 72.4487 172.6412 59 Y 4.7782 8.2941 118.8913 56.8097 42.5834 173.9519 60 Y 5.2512 8.3462 118.5804 55.8033 42.4194 173.3643 61 P 4.4828 0.0000 0.0000 62.3791 32.0931 177.1449 62 D 4.4252 8.7076 119.7546 57.5686 40.9019 179.0054 63 T 3.9526 7.8929 107.9992 63.9118 68.7929 174.8919 64 V 3.9294 7.7210 112.5014 59.7802 33.7705 175.2946 65 K 3.7243 7.2732 123.1169 57.6950 32.3620 177.6456 66 G 3.9372 8.5633 113.6989 45.5686 0.0000 174.1646 67 R 4.4274 7.3598 117.3496 57.8301 31.8118 176.3123 68 F 5.3734 8.1979 116.7491 56.5799 40.6654 175.4603 69 T 4.7740 9.1153 119.9835 61.8821 71.1228 172.8731 70 I 5.0928 9.2845 128.3241 60.2509 39.4511 174.7056 71 S 5.0649 9.1813 122.5837 57.3841 67.0614 172.5507 72 R 5.2173 8.6471 115.2060 54.5976 32.8145 174.4928 73 D 4.9771 9.4294 121.1001 52.8577 42.5848 176.1756 74 N 4.8184 9.1000 122.5940 54.2603 39.1013 176.2515 75 A 4.3367 8.3652 121.4428 53.3013 19.2681 178.3174 76 K 4.3426 7.9645 111.7493 55.4625 34.0896 175.1915 77 N 3.3297 8.5373 116.3272 54.0757 35.8752 173.7569 78 T 4.7090 6.8597 106.3121 59.6605 72.8984 172.9370 79 L 5.1439 8.6880 126.0715 53.6918 44.9802 174.6161 80 Y 5.6694 9.2180 121.9796 56.4598 42.7370 174.7507 81 L 4.5862 8.4765 122.7096 53.7677 45.2359 174.7199 82 Q 4.4748 9.1786 129.9360 55.7248 30.2104 174.2724 83 M 4.8300 9.0562 127.1213 53.6225 34.5483 175.3121 84 S 4.7849 8.1334 115.7560 56.9967 66.7821 173.3612 85 S 3.8853 8.7213 113.7153 59.4599 60.2528 173.0226 86 L 4.3283 8.2173 119.8669 55.0635 41.9754 177.2614 87 K 4.8674 8.4111 120.9623 54.2675 35.5395 177.2317 88 S 4.4257 8.4711 113.0296 61.2731 63.4934 176.1100 89 E 3.9810 8.4778 119.8361 59.6819 29.1460 177.9700 90 D 4.7471 7.7731 115.9399 56.0524 41.0173 176.5167 91 T 4.4790 7.8282 110.9342 61.6160 69.5434 174.0038 92 A 4.4059 8.8483 125.2669 51.2610 23.8299 174.9817 93 M 4.4150 8.2257 119.8296 56.0136 33.3145 174.6784 94 Y 4.9928 9.3825 125.2840 56.8516 40.2599 174.4678 95 Y 5.4099 9.3840 121.6442 56.3680 41.7749 173.9774 96 C 3.9812 9.8500 124.1768 55.8691 41.9272 172.7432 97 V 4.6392 8.0217 117.9571 59.4473 35.7453 174.2137 98 R 4.5407 8.3752 123.9267 55.1766 31.9473 174.6799 99 H 5.2384 8.4698 122.8879 54.0925 30.1243 174.2729 100 E 4.3144 8.5136 121.1730 56.0281 32.9439 173.4453 101 Y 3.4190 8.3440 116.8704 59.3768 35.9933 170.9731 102 Y 3.5277 7.1619 124.7082 59.8157 36.1842 170.7688 103 Y 4.6705 9.0731 122.6867 58.4666 38.5954 175.0885 104 A 4.3336 7.7653 122.8295 52.5795 19.0302 177.7033 105 M 4.6832 8.3998 117.7654 52.1130 33.0498 175.4773 106 D 4.4871 8.4905 123.8666 55.5625 40.3198 176.8176 107 Y 4.8345 7.5558 116.6252 55.9593 42.2361 174.2529 108 W 5.0497 9.0500 122.7794 54.7845 32.6756 176.4976 109 G 4.1060 9.0124 111.2628 46.1847 0.0000 172.9815 110 Q 4.4870 9.1756 117.3296 56.2534 29.4099 177.1339 111 G 3.7769 9.0882 104.8517 45.5056 0.0000 172.7434 112 T 4.6509 8.9534 115.4168 60.0553 70.5456 173.0202 113 T 4.4122 8.6135 125.5738 63.5418 69.9006 173.3202 114 V 4.5867 8.8577 127.0214 61.3301 34.1225 174.2664 115 T 4.7467 8.6808 124.5852 61.8620 71.2582 173.3183 116 V 4.5283 8.5720 127.4823 61.5230 32.3635 174.3720 117 S 4.7381 8.6174 122.0925 55.5108 65.6654 173.9668 118 S 4.2348 8.4453 119.2861 58.7350 60.9680 174.7915 *119 A 4.1104 7.7505 125.6914 52.2916 18.6149 176.9261 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 E 8.30 4.22 0.00 1.98 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 2.26 2.24 0.00 2 V 7.49 3.74 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 -0.08 0.00 0.00 0.51 0.00 0.00 3 K 10.26 4.75 0.00 1.74 1.54 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.42 7.81 4 L 8.47 5.15 0.00 1.62 1.47 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.98 4.59 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 6 E 8.89 5.31 0.00 2.41 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 0.00 2.39 2.63 0.00 7 S 9.65 4.58 0.00 3.86 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 0.00 8 G 9.43 3.92 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 0.00 0.00 0.00 9 G 8.80 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.73 4.65 0.00 2.64 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.42 4.66 0.00 1.68 1.56 0.98 0.87 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 12 V 9.42 4.61 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 0.64 0.00 0.00 0.89 0.00 0.00 13 Q 8.33 4.96 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.07 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 14 P 0.00 4.69 0.00 2.04 1.99 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 15 G 9.10 3.91 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 0.00 0.00 0.00 16 G 7.79 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.96 5.16 0.00 3.99 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 18 L 8.14 4.25 0.00 1.60 1.26 0.87 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.53 4.76 0.00 1.81 1.57 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.45 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.23 1.25 7.81 20 L 8.43 4.48 0.00 0.70 1.09 0.28 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.27 5.47 0.00 3.83 3.83 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 22 C 9.59 5.36 0.00 2.85 2.88 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 23 A 8.83 4.84 1.17 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 0.00 0.00 0.00 0.00 0.00 24 A 8.27 5.09 0.93 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 25 S 9.27 4.21 0.00 3.68 3.76 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 26 G 10.48 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 0.00 0.00 0.00 0.00 27 F 6.79 4.71 0.00 3.04 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 28 T 8.56 4.09 4.42 0.00 0.00 0.00 0.00 0.00 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 29 F 8.81 4.24 0.00 2.68 3.06 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 30 S 8.15 4.43 0.00 4.03 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 31 S 8.28 4.47 0.00 4.11 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 32 Y 7.45 4.74 0.00 2.71 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 33 T 8.44 4.44 4.27 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 1.45 0.00 0.00 34 M 8.94 5.02 0.00 1.78 1.82 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 2.12 2.59 0.00 35 S 8.53 5.26 0.00 3.33 3.63 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 0.00 0.00 0.00 0.00 36 W 9.45 5.34 0.00 3.44 3.28 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 37 V 9.17 5.08 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 1.24 0.00 0.00 0.45 0.00 0.00 38 R 9.26 5.03 0.00 1.11 0.98 0.00 2.57 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.44 0.00 39 Q 8.96 5.19 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.91 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 40 T 8.69 4.40 4.46 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 0.00 0.00 0.00 1.25 0.00 0.00 41 P 0.00 3.92 0.00 2.22 2.28 0.00 3.81 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 42 E 8.02 4.03 0.00 1.99 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 0.00 2.34 2.42 0.00 43 K 8.86 4.05 0.00 1.88 2.05 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.51 7.81 44 R 7.79 4.47 0.00 1.96 1.82 0.00 3.22 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 45 L 8.50 5.48 0.00 1.66 1.73 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.26 4.81 0.00 1.95 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 2.29 0.00 47 W 9.19 5.08 0.00 3.42 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 48 V 9.11 4.71 2.39 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 1.26 0.00 0.00 1.16 0.00 0.00 49 A 8.46 4.91 1.61 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 50 S 8.61 5.32 0.00 4.58 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 51 I 9.12 5.27 1.98 0.00 0.00 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 1.34 1.40 1.08 0.00 0.00 52 N 8.68 5.09 0.00 3.00 3.13 0.00 0.00 6.87 7.10 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 53 N 8.97 4.29 0.00 2.71 3.09 0.00 0.00 6.74 7.65 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 54 G 8.01 3.69 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 0.00 0.00 0.00 55 G 8.07 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 0.00 0.00 0.00 0.00 56 G 7.88 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 57 R 8.57 4.69 0.00 1.72 1.65 0.00 3.18 0.00 0.00 2.86 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 58 T 8.10 5.02 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 1.24 0.00 0.00 59 Y 8.29 4.78 0.00 2.60 2.61 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 60 Y 8.35 5.25 0.00 2.81 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 61 P 0.00 4.48 0.00 2.22 2.17 0.00 4.06 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 62 D 8.71 4.43 0.00 2.71 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.89 3.95 4.18 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 1.20 0.00 0.00 64 V 7.72 3.93 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 1.01 0.00 0.00 65 K 7.27 3.72 0.00 2.03 1.61 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.38 1.31 7.81 66 G 8.56 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 67 R 7.36 4.43 0.00 1.72 2.28 0.00 3.24 0.00 0.00 3.13 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.50 0.00 68 F 8.20 5.37 0.00 2.82 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 69 T 9.12 4.77 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 1.33 0.00 0.00 70 I 9.28 5.09 2.22 0.00 0.00 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 1.59 1.50 1.05 0.00 0.00 71 S 9.18 5.06 0.00 4.09 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 72 R 8.65 5.22 0.00 2.09 2.05 0.00 2.98 0.00 0.00 3.34 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 73 D 9.43 4.98 0.00 2.97 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 74 N 9.10 4.82 0.00 2.85 2.94 0.00 0.00 7.09 7.35 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 75 A 8.37 4.34 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 76 K 7.96 4.34 0.00 1.68 1.78 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.73 7.81 77 N 8.54 3.33 0.00 2.53 2.41 0.00 0.00 6.38 6.68 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 78 T 6.86 4.71 3.72 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 1.07 0.00 0.00 79 L 8.69 5.14 0.00 1.91 1.47 1.13 0.23 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 80 Y 9.22 5.67 0.00 3.04 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 81 L 8.48 4.59 0.00 0.48 0.45 1.03 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 9.18 4.47 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 83 M 9.06 4.83 0.00 1.41 1.60 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.81 0.00 84 S 8.13 4.78 0.00 3.66 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 85 S 8.72 3.89 0.00 4.06 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 86 L 8.22 4.33 0.00 1.78 1.63 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.41 4.87 0.00 1.78 1.73 0.00 1.68 0.00 0.00 1.95 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.60 7.81 88 S 8.47 4.43 0.00 4.03 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 0.00 89 E 8.48 3.98 0.00 1.99 2.12 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 2.34 2.45 0.00 90 D 7.77 4.75 0.00 3.03 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 91 T 7.83 4.48 4.39 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 1.36 0.00 0.00 92 A 8.85 4.41 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 0.00 0.00 0.00 0.00 0.00 93 M 8.23 4.41 0.00 2.17 1.97 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.43 0.00 94 Y 9.38 4.99 0.00 3.05 3.06 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 95 Y 9.38 5.41 0.00 3.18 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 96 C 9.85 3.98 0.00 2.52 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 97 V 8.02 4.64 1.05 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 -0.76 0.00 0.00 0.16 0.00 0.00 98 R 8.38 4.54 0.00 1.53 1.62 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.04 0.00 99 H 8.47 5.24 0.00 3.25 3.36 0.00 5.87 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 0.00 100 E 8.51 4.31 0.00 1.74 1.49 0.00 0.00 0.00 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 1.47 0.00 101 Y 8.34 3.42 0.00 3.25 2.94 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 0.00 0.00 0.00 102 Y 7.16 3.53 0.00 3.15 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 0.00 0.00 0.00 103 Y 9.07 4.67 0.00 3.18 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 0.00 104 A 7.77 4.33 1.56 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 0.00 0.00 105 M 8.40 4.68 0.00 1.19 1.86 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.69 0.00 106 D 8.49 4.49 0.00 2.56 2.89 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 0.00 107 Y 7.56 4.83 0.00 2.70 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 0.00 108 W 9.05 5.05 0.00 2.94 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 0.00 109 G 9.01 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 0.00 110 Q 9.18 4.49 0.00 2.16 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.38 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 111 G 9.09 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 0.00 0.00 0.00 112 T 8.95 4.65 4.33 0.00 0.00 0.00 0.00 0.00 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 0.00 113 T 8.61 4.41 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 1.24 0.00 0.00 114 V 8.86 4.59 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 0.91 0.00 0.00 0.49 0.00 0.00 115 T 8.68 4.75 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 0.00 116 V 8.57 4.53 2.31 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 0.82 0.00 0.00 1.00 0.00 0.00 117 S 8.62 4.74 0.00 3.89 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 0.00 118 S 8.45 4.23 0.00 3.90 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 *119 A 7.75 4.11 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 * Residues marked with a * may have inaccurate shift predictions.