NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.8004 8.3549 109.7376 45.1487 0.0000 174.0369 *2 K 4.0717 7.7836 118.1895 55.8179 33.1292 175.6321 3 L 4.2976 8.4316 122.2751 55.0751 42.3530 176.0577 4 Q 4.9063 8.2452 118.7318 54.1354 31.0025 176.0292 5 T 3.9452 8.7659 120.5470 64.5038 69.2378 173.8140 6 T 4.5970 8.8204 122.2459 61.9444 71.9103 172.8682 7 I 5.0501 8.4799 127.0078 59.6207 39.8165 175.2219 8 Q 4.6781 8.8631 123.6951 54.4896 33.1154 173.9049 9 H 5.1731 8.6249 117.6613 53.8118 32.6466 172.8810 10 E 4.2842 8.6639 122.5437 54.9194 30.8250 174.4817 11 P 4.5178 0.0000 0.0000 62.8028 32.2736 177.4757 12 K 3.9521 8.6415 120.4436 57.8060 31.9693 176.2596 13 D 4.5685 7.9039 119.5021 51.5989 39.2123 174.8399 14 G 4.0237 8.4841 109.6333 45.3465 0.0000 173.9653 15 S 4.4376 7.5126 113.8070 57.9523 64.4918 174.1279 16 G 3.9337 9.1140 108.5542 45.6101 0.0000 173.1246 17 F 4.6548 7.9471 117.6787 55.5959 40.8328 174.4767 18 D 4.9083 8.4321 123.1799 52.2874 43.6345 177.2025 19 R 4.1346 8.4022 128.4980 56.3558 27.4193 175.1355 *22 R 5.0131 7.0398 121.3024 56.7013 32.6776 176.7333 23 E 4.1028 8.2575 121.9299 59.2603 30.4011 178.3913 *24 F 4.3939 8.0078 116.1083 56.2863 38.1096 179.4480 25 F 5.4651 7.8083 118.8551 56.6549 42.9531 173.7905 26 E 5.0986 9.0619 117.6311 54.9887 33.6826 174.1158 27 Y 5.2651 8.5916 116.6969 56.2949 42.4998 174.1646 28 R 4.8819 9.1466 124.1695 54.5204 32.6663 173.9547 29 D 5.0873 8.8231 126.9112 54.0532 41.6748 176.3211 30 T 4.0425 8.6943 116.1096 62.9565 69.4840 175.8439 31 G 3.9864 9.2430 111.8383 45.5293 0.0000 175.5087 32 V 3.6042 7.7277 119.5590 65.6862 31.3510 177.2358 33 N 5.0200 8.1738 117.7995 56.4488 38.5039 176.4007 34 E 4.0057 8.2119 119.6759 59.0160 29.5605 178.3965 35 A 3.9111 8.1971 120.7179 54.1012 18.4417 178.0947 36 T 4.4077 7.6928 105.0533 60.7768 69.1101 174.4211 37 G 3.8406 8.5684 108.7202 46.9708 0.0000 173.9680 38 G 3.7098 8.0670 105.9074 46.1872 0.0000 173.1654 *40 F 4.8750 7.4986 119.4757 57.7640 41.5663 175.0683 41 G 4.7066 9.4847 106.5993 45.0053 0.0000 171.4763 42 A 5.3322 8.4479 121.4417 50.8813 22.7706 174.9559 43 H 5.2199 8.9296 116.2489 54.5544 32.6667 172.4631 44 V 4.6790 8.8965 120.5584 61.8069 33.3238 174.4743 45 I 4.7536 9.0597 128.9972 59.3656 39.6648 174.7720 46 R 5.1745 8.7964 122.9289 53.9833 32.5433 175.0012 47 A 4.1960 8.6651 123.6008 52.1555 19.3812 176.7260 48 I 4.3253 7.5436 121.1604 58.7743 39.1025 174.5411 49 P 4.1544 0.0000 0.0000 61.1433 30.2629 173.4479 *55 P 4.0320 0.0000 0.0000 62.9284 31.8792 176.1469 56 T 4.6182 8.1878 119.8413 60.8416 70.8498 174.3038 57 W 4.5882 8.8292 126.9038 57.7053 30.4002 174.9309 58 H 5.4354 9.1060 119.0639 55.1211 32.1280 172.0335 59 T 5.1578 8.9150 107.7188 60.3710 72.3010 172.4799 60 H 5.5500 8.6020 118.5908 53.8303 32.3725 174.0736 61 T 4.6624 8.5476 114.1427 60.9432 65.9952 174.2392 62 V 4.2077 7.4365 118.2434 61.6367 35.6220 176.8206 63 G 3.5955 9.3671 112.3180 48.2945 0.0000 174.5644 64 F 4.7779 9.0941 121.1961 57.5859 42.1110 174.5055 65 Q 4.3655 7.3643 126.1075 54.6057 32.3486 172.6736 66 L 4.9581 8.4352 128.1874 53.2222 45.9414 174.7623 67 F 5.2274 9.1301 124.1439 55.7980 42.3008 173.8223 68 Y 4.9427 9.1580 123.8274 55.6903 41.7756 174.3983 69 V 4.0368 8.5561 128.3922 63.0016 32.0704 176.3684 70 L 4.6259 9.1196 128.2863 56.5321 43.0404 176.9947 71 R 4.3844 8.0601 116.5687 56.5591 33.0239 176.3449 72 G 4.0324 9.6877 112.3678 44.7951 0.0000 171.8750 73 W 5.5884 7.9032 115.6782 55.4056 32.0311 174.5845 74 V 4.8342 8.8265 120.0298 60.3480 34.3331 173.4062 75 E 4.7567 9.2732 124.7548 54.5999 31.8810 174.8729 76 F 5.3598 8.8893 125.2137 55.8037 42.7503 174.0819 77 E 5.0564 8.7196 120.6922 54.7534 32.9881 173.8873 78 Y 5.3305 8.7725 123.3297 56.1560 41.3936 176.2053 79 E 3.9888 9.3789 124.4849 59.8251 29.5868 178.2172 80 D 4.5338 8.5322 117.5764 55.6628 39.7805 176.8473 81 I 4.3281 8.0644 109.4779 59.5972 39.2066 176.6257 82 G 3.8793 8.3630 109.1089 44.5978 0.0000 172.1666 83 A 4.6992 8.3590 121.4207 52.3061 19.5546 177.9477 84 V 4.3729 8.6975 120.1223 61.6496 35.8063 173.4460 *86 L 4.4170 8.3472 117.8871 55.1453 43.3534 176.6094 87 E 5.3852 8.6881 120.8466 52.9660 32.6966 174.7310 88 A 4.2315 8.4464 121.9512 54.6516 18.4714 178.1590 89 G 4.2109 8.4389 111.3115 45.8750 0.0000 174.1593 90 G 3.9807 7.8773 107.8757 45.9537 0.0000 173.1520 91 S 5.4174 9.0353 115.7656 56.3109 67.2121 172.8424 92 A 5.0574 9.2017 122.9733 50.3903 22.1713 174.6670 93 F 4.7251 9.3112 126.4164 57.4713 40.9852 174.4602 94 Q 4.1633 7.6206 125.9389 53.1568 30.0116 174.0894 95 P 4.0853 0.0000 0.0000 61.4289 33.0037 174.2747 96 P 4.3700 0.0000 0.0000 63.5298 31.3699 176.6610 97 G 3.9535 8.9359 110.6913 44.7953 0.0000 173.4137 98 V 3.7783 7.5738 119.2529 61.7665 32.1070 176.1802 99 R 4.6112 8.7240 123.3787 56.5423 31.2690 175.2315 100 H 5.3417 9.2774 118.7325 55.1921 32.6378 172.1613 101 R 4.5870 8.1715 113.9561 55.0799 33.0459 173.2309 102 E 4.9292 8.4915 120.9940 54.9945 30.3635 175.4527 103 L 4.3426 9.0282 128.2130 57.0786 42.6488 177.1223 104 R 4.5578 7.6812 112.4584 56.3548 31.9610 172.9761 105 H 4.6103 8.1029 114.4772 53.9962 31.7314 173.1255 106 S 3.6420 7.0389 114.0201 57.6054 63.6367 175.2958 107 D 4.2548 8.5456 121.0012 56.8307 40.7472 177.1245 108 D 4.6982 7.6537 116.2897 52.5588 39.9526 175.8519 109 L 4.1448 7.3872 122.9349 56.2701 43.2208 175.5597 110 E 5.3350 9.3501 126.6394 54.4937 33.2262 174.3939 111 V 4.9870 8.9507 125.9767 60.0057 35.3111 173.9100 112 L 4.9219 9.1180 126.6082 54.1439 43.8217 174.5636 113 E 4.7574 9.1575 127.1503 54.2800 32.4910 174.3464 114 I 5.1646 8.3493 127.5283 59.4731 40.4923 174.9354 115 V 4.9849 8.9241 125.4337 60.4142 35.3514 173.3855 116 S 4.8625 9.1555 117.6299 55.8637 65.3784 172.0062 117 P 4.7005 0.0000 0.0000 61.9845 32.3051 176.0435 118 A 4.1471 8.8363 121.8706 53.9065 18.5391 179.4506 119 G 3.8197 7.5029 104.8733 44.4946 0.0000 173.5018 120 F 4.5985 7.4735 112.8101 56.7355 39.6022 176.6824 121 A 4.6456 9.0401 122.5850 51.4864 21.0208 176.2496 122 T 5.2102 8.4040 114.9519 61.9618 71.9735 173.8571 123 S 4.8442 8.9861 121.7174 56.4943 66.4461 173.7099 124 V 4.2934 8.4050 124.0359 62.6304 32.2800 175.5836 125 V 3.8220 8.7465 130.9318 63.2481 32.1614 176.3584 126 D 4.5390 8.8863 129.3473 53.5732 38.8264 173.6497 127 L 4.1909 8.3545 126.7720 56.1895 41.4886 174.8170 128 E 4.2063 8.0508 121.8459 56.5941 29.4102 176.5963 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 3.80 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 0.00 0.00 0.00 *2 K 7.78 4.07 0.00 2.06 1.81 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.04 7.81 3 L 8.43 4.30 0.00 1.80 1.81 1.13 0.94 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 4 Q 8.25 4.91 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.88 0.00 0.00 0.00 0.00 0.00 2.26 1.92 0.00 5 T 8.77 3.95 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 0.04 0.00 0.00 6 T 8.82 4.60 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 1.22 0.00 0.00 7 I 8.48 5.05 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 1.31 0.90 0.86 0.00 0.00 8 Q 8.86 4.68 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 9 H 8.62 5.17 0.00 3.00 3.15 0.00 5.69 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.66 4.28 0.00 2.11 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 2.47 2.47 0.00 11 P 0.00 4.52 0.00 2.41 1.99 0.00 3.79 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.13 0.00 12 K 8.64 3.95 0.00 1.76 1.88 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.48 7.81 13 D 7.90 4.57 0.00 2.77 2.79 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 14 G 8.48 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 0.00 0.00 0.00 15 S 7.51 4.44 0.00 4.05 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 16 G 9.11 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 17 F 7.95 4.65 0.00 3.00 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 18 D 8.43 4.91 0.00 2.58 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.40 4.13 0.00 1.84 1.88 0.00 3.33 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 *22 R 7.04 5.01 0.00 2.08 1.97 0.00 3.32 0.00 0.00 3.24 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 23 E 8.26 4.10 0.00 2.01 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 2.33 2.39 0.00 *24 F 8.01 4.39 0.00 2.20 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 0.00 0.00 0.00 0.00 25 F 7.81 5.47 0.00 2.84 2.53 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 0.00 26 E 9.06 5.10 0.00 2.06 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 2.31 2.25 0.00 27 Y 8.59 5.27 0.00 2.91 2.86 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 28 R 9.15 4.88 0.00 1.89 1.82 0.00 3.11 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 29 D 8.82 5.09 0.00 2.79 2.60 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 30 T 8.69 4.04 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 31 G 9.24 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 32 V 7.73 3.60 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 1.10 0.00 0.00 0.94 0.00 0.00 33 N 8.17 5.02 0.00 2.94 2.85 0.00 0.00 7.32 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 34 E 8.21 4.01 0.00 2.09 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 2.39 2.39 0.00 35 A 8.20 3.91 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 36 T 7.69 4.41 4.41 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 1.34 0.00 0.00 37 G 8.57 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 0.00 0.00 0.00 38 G 8.07 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 *40 F 7.50 4.88 0.00 3.10 3.07 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 41 G 9.48 4.71 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 42 A 8.45 5.33 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 43 H 8.93 5.22 0.00 3.44 3.49 0.00 5.25 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 44 V 8.90 4.68 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 1.13 0.00 0.00 0.99 0.00 0.00 45 I 9.06 4.75 1.76 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.78 0.26 0.00 0.00 46 R 8.80 5.17 0.00 1.90 1.97 0.00 2.76 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 47 A 8.67 4.20 1.15 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 48 I 7.54 4.33 1.81 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 1.23 0.59 0.84 0.00 0.00 49 P 0.00 4.15 0.00 2.10 2.04 0.00 3.48 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.00 0.00 *55 P 0.00 4.03 0.00 2.03 2.30 0.00 3.42 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.06 0.00 56 T 8.19 4.62 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 1.27 0.00 0.00 57 W 8.83 4.59 0.00 3.28 3.05 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 0.00 0.00 0.00 58 H 9.11 5.44 0.00 3.28 3.37 0.00 5.21 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.92 5.16 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 1.30 0.00 0.00 60 H 8.60 5.55 0.00 2.91 3.05 0.00 5.61 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.55 4.66 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 1.27 0.00 0.00 62 V 7.44 4.21 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 0.34 0.00 0.00 0.73 0.00 0.00 63 G 9.37 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 64 F 9.09 4.78 0.00 3.29 3.07 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 65 Q 7.36 4.37 0.00 1.72 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.64 0.00 0.00 0.00 0.00 0.00 1.89 1.83 0.00 66 L 8.44 4.96 0.00 1.44 1.31 1.09 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 67 F 9.13 5.23 0.00 3.10 3.07 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 68 Y 9.16 4.94 0.00 3.04 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 69 V 8.56 4.04 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 0.99 0.00 0.00 0.96 0.00 0.00 70 L 9.12 4.63 0.00 1.72 1.79 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.06 4.38 0.00 1.88 1.72 0.00 3.23 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 72 G 9.69 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 0.00 0.00 0.00 73 W 7.90 5.59 0.00 3.42 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 74 V 8.83 4.83 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 0.22 0.00 0.00 0.29 0.00 0.00 75 E 9.27 4.76 0.00 2.07 1.85 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 2.16 2.37 0.00 76 F 8.89 5.36 0.00 2.93 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 0.00 0.00 0.00 0.00 77 E 8.72 5.06 0.00 1.77 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 2.35 2.31 0.00 78 Y 8.77 5.33 0.00 3.04 3.05 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 0.00 0.00 0.00 79 E 9.38 3.99 0.00 2.12 2.03 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 2.26 2.03 0.00 80 D 8.53 4.53 0.00 2.85 2.81 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 81 I 8.06 4.33 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.91 0.96 0.00 0.00 82 G 8.36 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 83 A 8.36 4.70 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 84 V 8.70 4.37 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 1.21 0.00 0.00 1.26 0.00 0.00 *86 L 8.35 4.42 0.00 1.67 1.65 1.14 0.88 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 87 E 8.69 5.39 0.00 2.03 1.92 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 2.34 2.23 0.00 88 A 8.45 4.23 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 89 G 8.44 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 90 G 7.88 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 91 S 9.04 5.42 0.00 4.06 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 92 A 9.20 5.06 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 93 F 9.31 4.73 0.00 3.12 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 94 Q 7.62 4.16 0.00 1.72 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.67 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 95 P 0.00 4.09 0.00 1.99 1.98 0.00 3.34 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 96 P 0.00 4.37 0.00 2.04 2.17 0.00 3.86 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.28 0.00 97 G 8.94 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 98 V 7.57 3.78 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 0.72 0.00 0.00 1.02 0.00 0.00 99 R 8.72 4.61 0.00 1.93 1.98 0.00 3.22 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 100 H 9.28 5.34 0.00 2.74 3.40 0.00 5.28 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.17 4.59 0.00 1.48 1.49 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 0.50 0.89 0.00 102 E 8.49 4.93 0.00 2.15 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 2.34 2.34 0.00 103 L 9.03 4.34 0.00 1.58 1.67 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.68 4.56 0.00 1.97 2.03 0.00 3.12 0.00 0.00 3.57 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.83 0.00 105 H 8.10 4.61 0.00 2.93 3.18 0.00 5.52 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 S 7.04 3.64 0.00 3.44 2.63 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 0.00 107 D 8.55 4.25 0.00 2.60 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 0.00 108 D 7.65 4.70 0.00 2.74 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 0.00 109 L 7.39 4.14 0.00 1.71 1.52 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 110 E 9.35 5.33 0.00 2.03 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 111 V 8.95 4.99 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 0.75 0.00 0.00 1.21 0.00 0.00 112 L 9.12 4.92 0.00 1.89 1.84 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 113 E 9.16 4.76 0.00 2.10 1.67 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 1.90 1.47 0.00 114 I 8.35 5.16 2.05 0.00 0.00 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 1.33 0.59 1.13 0.00 0.00 115 V 8.92 4.98 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 1.04 0.00 0.00 0.55 0.00 0.00 116 S 9.16 4.86 0.00 2.98 3.55 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.70 0.00 2.13 2.02 0.00 3.97 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 118 A 8.84 4.15 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.50 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 0.00 120 F 7.47 4.60 0.00 3.15 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 0.00 121 A 9.04 4.65 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 0.00 122 T 8.40 5.21 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 1.33 0.00 0.00 123 S 8.99 4.84 0.00 3.76 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.41 4.29 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 0.83 0.00 0.00 0.96 0.00 0.00 125 V 8.75 3.82 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 0.68 0.00 0.00 0.98 0.00 0.00 126 D 8.89 4.54 0.00 2.74 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 L 8.35 4.19 0.00 1.66 1.61 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.05 4.21 0.00 1.95 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 2.32 2.25 0.00 * Residues marked with a * may have inaccurate shift predictions.