NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8252 8.3549 109.7368 44.4669 0.0000 173.8033 3 R 3.6376 8.1904 115.7971 55.9717 27.5329 172.9642 4 E 4.3168 9.4865 121.6310 55.8655 32.2021 175.5808 5 L 4.9639 8.3785 126.5252 53.6180 43.5025 175.7914 6 S 4.4547 8.2778 115.8547 56.6237 67.3211 172.6538 7 F 5.0929 8.0318 117.6146 55.8300 43.2419 173.8457 8 F 4.9945 9.6258 121.3780 55.8291 42.1149 173.9326 9 L 5.1509 8.5988 124.0154 52.7070 43.6441 176.8973 10 Q 4.2936 8.8627 123.3608 56.2788 28.8674 176.2030 11 K 4.4750 9.3586 120.8711 58.2538 34.0302 178.2671 12 E 4.1428 8.1784 113.8914 57.6358 29.4458 176.0374 13 S 4.5459 7.3919 113.5162 58.1895 67.2695 174.1559 14 A 4.5255 8.5662 122.8835 53.4484 19.4737 178.1284 15 G 3.9849 7.7160 102.9256 46.7544 0.0000 172.7395 16 F 5.6935 7.7864 115.4257 55.6828 41.5857 173.1308 17 F 4.8835 9.9070 116.9424 55.6250 43.1461 173.8097 18 L 5.0116 8.7607 124.3322 53.3237 43.9221 175.4253 19 G 4.2532 8.9434 114.0687 44.1116 0.0000 171.9303 20 M 4.9437 8.4244 123.8606 53.6351 34.1728 175.1390 21 D 4.3150 8.8807 128.3217 55.0833 39.2360 174.4517 22 A 4.1100 7.8819 120.6182 51.2724 19.5590 176.5999 23 P 4.3189 0.0000 0.0000 62.0830 32.1344 175.9364 24 A 4.1102 8.4208 124.1867 53.9664 18.6708 178.0338 25 G 3.9462 8.8962 108.5310 45.8974 0.0000 174.1741 26 S 4.2792 7.6897 115.0630 58.8177 63.3501 173.8325 27 S 4.9761 8.0718 116.4027 56.7708 66.4903 173.1556 28 V 4.0610 8.6086 120.7057 60.9611 34.0456 173.8841 29 A 5.1237 8.4412 130.0337 50.5487 20.3351 176.0366 30 C 4.7075 8.9822 117.2971 57.9417 33.9577 173.9267 31 G 3.8515 8.3333 112.2943 47.2689 0.0000 174.2589 32 S 4.6015 8.8904 118.5462 57.7131 63.4860 173.3150 33 E 4.6669 8.2921 121.4790 54.8658 31.5199 174.7311 34 V 4.7802 8.1874 120.2861 61.2988 33.7845 174.4886 35 L 4.9013 9.1763 128.3341 53.2203 44.0934 175.9562 36 R 5.2909 8.4810 120.4205 53.7382 33.7676 175.3124 37 A 3.3467 8.4799 122.1493 52.2244 18.8563 177.8286 38 V 4.0471 8.0741 115.6845 59.8528 32.6650 174.7699 39 P 4.3475 0.0000 0.0000 62.8514 32.1884 175.7375 40 V 4.2190 8.1623 121.6347 60.9054 33.1007 175.6085 41 G 3.1026 7.9589 117.3491 45.1509 0.0000 173.7650 42 T 4.6063 8.3802 108.8761 60.4483 70.4421 174.0723 43 V 4.4933 7.8559 121.2140 60.9664 34.4494 175.8072 44 D 4.3661 8.4549 128.5750 53.6376 41.6773 174.8131 *49 K 3.9250 8.4163 122.0794 57.7689 32.6549 176.1061 50 H 4.3836 8.5888 123.0569 56.0416 29.6754 175.4311 51 I 3.9990 7.5478 121.1797 59.9603 37.1079 174.0477 52 P 4.5860 0.0000 0.0000 62.9606 32.2341 175.7099 53 V 4.3300 9.1464 123.1390 61.2124 33.6563 174.2038 54 V 5.0120 8.4814 128.0606 61.0592 33.3467 174.3676 55 E 4.7685 9.2264 125.6938 54.5080 32.7150 174.5513 56 V 4.8121 8.5516 123.1586 61.2898 33.9329 174.0837 57 H 4.8144 8.9985 127.1807 55.1112 33.3818 174.4456 58 G 3.7383 8.5399 116.2660 47.3824 0.0000 173.0184 59 H 5.0803 9.1337 118.7610 55.2748 30.6531 172.3023 60 E 5.1963 8.9528 118.9291 54.6489 32.6137 175.2754 61 V 4.8738 9.2581 122.7469 61.2797 34.5362 174.2116 62 K 5.0028 9.0988 128.3653 55.0470 34.2452 175.6996 63 V 4.9278 9.0270 125.2689 61.0807 34.0693 174.3600 64 K 5.0670 8.9280 126.7300 54.5775 35.9016 175.4950 65 V 4.2547 8.5338 124.1820 65.0928 33.2978 174.0078 66 G 4.7778 9.0865 118.0164 45.4137 0.0000 172.1565 67 S 4.1380 8.6616 121.8473 60.0855 63.3468 175.3378 68 V 4.1055 7.4952 120.8550 59.9946 32.6409 174.0702 69 A 4.3041 8.6692 128.7458 53.0358 18.4183 176.5855 70 H 4.2246 9.1616 123.5284 55.0909 30.7807 173.3095 71 P 4.2270 0.0000 0.0000 63.6609 32.5017 175.5432 72 M 4.8310 8.6132 122.0024 53.7398 32.1209 174.4626 73 T 4.7966 8.5847 113.1606 58.9128 72.4237 173.6905 74 P 4.5113 0.0000 0.0000 65.2430 31.4420 177.5955 75 E 4.2028 7.6425 116.2594 58.0438 30.1599 175.4327 76 H 4.8860 8.5566 119.3293 55.2470 32.6528 171.7907 77 Y 5.2592 8.4555 123.5216 55.8143 41.8574 174.0149 78 I 4.0987 8.2408 121.7376 60.9864 37.3802 175.9541 79 A 4.4622 8.9153 131.8922 54.5229 19.2305 176.5917 80 W 5.4969 7.0459 110.0524 55.9470 31.5654 173.7406 81 V 5.3107 9.3271 120.3698 61.4637 34.4545 173.5723 82 C 5.4495 10.0756 127.7923 57.5767 34.5104 171.9278 83 L 5.0413 8.6446 127.9431 53.1127 44.2866 174.5687 84 K 4.9255 9.4381 128.1447 55.1725 34.1737 175.1239 85 T 5.0925 8.6536 116.8498 59.5765 71.6951 174.2247 86 R 4.0461 9.1842 120.7991 58.6459 30.0230 178.2814 87 K 4.4140 7.9697 114.9711 56.2953 33.7027 176.3663 88 G 4.0353 7.1257 105.8063 45.3968 0.0000 171.9666 89 I 5.2112 8.3040 112.2847 59.4660 41.0711 174.7593 90 Q 4.7707 8.9988 120.6423 54.5184 33.5540 173.8977 91 L 5.3559 8.5482 122.5502 53.7390 45.5646 175.2530 92 K 4.7979 9.5156 124.8737 54.5694 35.6675 175.5743 93 E 4.8390 9.1351 124.7722 56.4339 30.4417 176.1426 94 L 4.6043 8.5542 123.8241 52.5587 43.4645 175.0440 95 P 4.2195 0.0000 0.0000 62.7022 31.5963 177.7273 96 V 3.5572 8.4165 123.3485 64.1704 31.2039 176.4914 97 D 4.7541 8.0138 118.1201 53.9768 41.7233 176.5311 98 G 4.2966 7.4654 109.1144 44.5358 0.0000 173.0247 99 A 4.2308 8.4018 124.6575 51.3199 20.0315 176.5410 100 P 4.6726 0.0000 0.0000 60.7879 30.2770 175.0108 101 E 5.3991 7.4635 116.2716 56.1260 32.9302 176.4685 102 V 4.5085 8.7240 119.9844 60.9708 35.1781 173.0043 103 T 5.1412 8.2383 118.3309 61.9657 71.0772 173.6427 104 F 5.0497 9.4636 123.1035 55.6587 42.6316 173.9902 105 A 5.2567 8.7889 123.0990 50.3502 21.0206 175.8890 106 L 4.9480 8.9894 121.6111 52.8883 44.9545 176.7608 107 T 4.1979 8.2924 110.4896 60.7806 69.9223 175.6212 108 A 3.5363 8.4041 125.3930 55.0708 18.4257 178.5363 109 D 4.5042 7.9622 112.8101 54.4758 40.1034 175.4506 110 D 5.1149 7.6532 120.0877 53.0386 43.4652 175.2245 111 Q 4.8008 8.2036 119.3867 54.2267 32.2948 174.2654 112 V 3.9793 8.4895 120.8870 62.4349 31.7899 174.9069 113 L 4.6302 8.5638 122.5882 55.9352 43.8982 176.4452 114 E 4.6933 7.7376 115.7829 55.2147 32.9008 173.7924 115 A 5.3038 8.4905 126.7604 50.5069 22.7893 174.9074 116 Y 5.3947 9.2343 116.4480 56.3565 42.8376 174.4001 117 E 5.0693 9.4205 120.3651 54.5001 33.6741 174.0687 118 F 4.9062 7.4823 124.1615 56.4859 41.4802 173.5950 119 C 4.3330 8.2522 127.6353 57.6452 32.2490 174.3607 120 N 3.5198 7.5171 123.9599 55.0340 37.0017 176.0697 121 L 4.1277 7.3122 117.4009 56.0284 42.3191 176.7865 122 H 4.8705 7.9669 111.7714 55.0543 30.5510 174.7774 123 G 3.9074 8.2025 107.4147 44.2181 0.0000 172.0224 124 V 4.8185 7.8941 117.9654 61.2501 33.9600 176.2490 125 W 5.6185 9.1065 125.8559 54.9659 33.3220 174.3310 126 S 5.1658 8.9416 118.1035 56.9901 65.4283 173.2826 127 G 4.1392 8.5525 106.2445 45.6583 0.0000 173.8546 128 K 4.2609 8.4940 119.1854 56.2882 32.5265 176.4996 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 G 8.35 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 0.00 0.00 0.00 3 R 8.19 3.64 0.00 2.03 1.98 0.00 3.20 0.00 0.00 3.19 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 4 E 9.49 4.32 0.00 2.04 1.79 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 2.27 2.31 0.00 5 L 8.38 4.96 0.00 1.04 0.76 0.74 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.28 4.45 0.00 3.46 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 7 F 8.03 5.09 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 8 F 9.63 4.99 0.00 3.14 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 9 L 8.60 5.15 0.00 1.43 1.39 0.10 1.04 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 10 Q 8.86 4.29 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.73 0.00 0.00 0.00 0.00 0.00 2.57 2.69 0.00 11 K 9.36 4.47 0.00 1.95 1.86 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.43 7.81 12 E 8.18 4.14 0.00 2.29 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 2.38 2.32 0.00 13 S 7.39 4.55 0.00 3.91 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 A 8.57 4.53 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 15 G 7.72 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 16 F 7.79 5.69 0.00 3.26 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 17 F 9.91 4.88 0.00 3.05 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 18 L 8.76 5.01 0.00 1.56 1.47 0.49 0.93 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 G 8.94 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 0.00 0.00 0.00 0.00 20 M 8.42 4.94 0.00 1.93 1.88 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 21 D 8.88 4.31 0.00 2.79 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 22 A 7.88 4.11 1.33 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 0.00 0.00 0.00 23 P 0.00 4.32 0.00 2.18 1.98 0.00 3.60 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 24 A 8.42 4.11 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 25 G 8.90 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 26 S 7.69 4.28 0.00 4.05 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 0.00 27 S 8.07 4.98 0.00 3.86 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 28 V 8.61 4.06 1.57 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 -0.23 0.00 0.00 -0.18 0.00 0.00 29 A 8.44 5.12 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 30 C 8.98 4.71 0.00 3.24 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 31 G 8.33 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 32 S 8.89 4.60 0.00 4.00 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 33 E 8.29 4.67 0.00 2.19 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 2.29 2.35 0.00 34 V 8.19 4.78 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 0.81 0.00 0.00 0.92 0.00 0.00 35 L 9.18 4.90 0.00 1.69 1.73 1.13 0.98 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 36 R 8.48 5.29 0.00 1.69 1.85 0.00 3.24 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 37 A 8.48 3.35 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 38 V 8.07 4.05 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 0.65 0.00 0.00 0.99 0.00 0.00 39 P 0.00 4.35 0.00 1.90 1.96 0.00 3.64 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 1.88 1.89 0.00 40 V 8.16 4.22 2.15 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 0.97 0.00 0.00 1.11 0.00 0.00 41 G 7.96 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 0.00 0.00 0.00 42 T 8.38 4.61 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 1.28 0.00 0.00 43 V 7.86 4.49 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 0.91 0.00 0.00 0.98 0.00 0.00 44 D 8.45 4.37 0.00 2.64 2.49 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 0.00 0.00 0.00 *49 K 8.42 3.92 0.00 1.62 1.77 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.34 7.81 50 H 8.59 4.38 0.00 1.69 1.86 0.00 5.90 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.55 4.00 1.92 0.00 0.00 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 1.69 0.78 0.99 0.00 0.00 52 P 0.00 4.59 0.00 2.09 2.10 0.00 3.85 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 2.13 2.01 0.00 53 V 9.15 4.33 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 0.93 0.00 0.00 0.95 0.00 0.00 54 V 8.48 5.01 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 0.92 0.00 0.00 0.93 0.00 0.00 55 E 9.23 4.77 0.00 2.06 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 2.34 2.25 0.00 56 V 8.55 4.81 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 0.83 0.00 0.00 0.97 0.00 0.00 57 H 9.00 4.81 0.00 3.25 3.14 0.00 5.98 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 58 G 8.54 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 0.00 0.00 0.00 59 H 9.13 5.08 0.00 3.08 3.48 0.00 5.59 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.95 5.20 0.00 1.92 1.90 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 2.49 2.29 0.00 61 V 9.26 4.87 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 1.06 0.00 0.00 1.00 0.00 0.00 62 K 9.10 5.00 0.00 1.79 1.75 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.40 7.81 63 V 9.03 4.93 2.32 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 1.08 0.00 0.00 1.16 0.00 0.00 64 K 8.93 5.07 0.00 1.73 1.64 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.34 1.36 7.81 65 V 8.53 4.25 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 0.78 0.00 0.00 0.92 0.00 0.00 66 G 9.09 4.78 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 67 S 8.66 4.14 0.00 3.96 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 68 V 7.50 4.11 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 0.94 0.00 0.00 0.88 0.00 0.00 69 A 8.67 4.30 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 70 H 9.16 4.22 0.00 3.20 3.13 0.00 5.79 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 71 P 0.00 4.23 0.00 1.83 1.93 0.00 2.81 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 72 M 8.61 4.83 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.44 0.00 73 T 8.58 4.80 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 1.28 0.00 0.00 74 P 0.00 4.51 0.00 2.10 2.17 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 75 E 7.64 4.20 0.00 1.94 2.00 0.00 0.00 0.00 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 2.26 0.00 76 H 8.56 4.89 0.00 3.15 3.09 0.00 5.66 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 8.46 5.26 0.00 2.99 3.17 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 78 I 8.24 4.10 1.81 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.62 0.85 0.00 0.00 79 A 8.92 4.46 1.48 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 0.00 0.00 0.00 80 W 7.05 5.50 0.00 3.62 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 81 V 9.33 5.31 2.48 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 1.32 0.00 0.00 1.10 0.00 0.00 82 C 10.08 5.45 0.00 3.18 3.22 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 83 L 8.64 5.04 0.00 0.63 0.92 0.85 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 84 K 9.44 4.93 0.00 2.12 1.92 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.43 7.81 85 T 8.65 5.09 4.51 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 0.00 0.00 0.00 1.19 0.00 0.00 86 R 9.18 4.05 0.00 1.78 2.05 0.00 3.31 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 87 K 7.97 4.41 0.00 1.91 1.84 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.54 1.69 7.81 88 G 7.13 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 89 I 8.30 5.21 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.76 0.90 0.00 0.00 90 Q 9.00 4.77 0.00 1.77 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 91 L 8.55 5.36 0.00 1.60 1.50 0.37 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 92 K 9.52 4.80 0.00 1.71 1.65 0.00 1.01 0.00 0.00 1.44 0.00 0.00 2.79 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.50 7.81 93 E 9.14 4.84 0.00 1.98 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 2.64 2.55 0.00 94 L 8.55 4.60 0.00 1.73 1.62 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.22 0.00 2.16 1.99 0.00 3.61 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 96 V 8.42 3.56 1.77 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 0.61 0.00 0.00 0.56 0.00 0.00 97 D 8.01 4.75 0.00 2.66 2.71 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 98 G 7.47 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 99 A 8.40 4.23 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 0.00 100 P 0.00 4.67 0.00 2.45 2.20 0.00 3.44 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 2.05 2.20 0.00 101 E 7.46 5.40 0.00 1.95 1.91 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 2.18 2.30 0.00 102 V 8.72 4.51 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 0.76 0.00 0.00 0.74 0.00 0.00 103 T 8.24 5.14 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 1.29 0.00 0.00 104 F 9.46 5.05 0.00 2.99 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 0.00 105 A 8.79 5.26 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 0.00 106 L 8.99 4.95 0.00 1.61 1.56 0.99 0.87 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 0.00 107 T 8.29 4.20 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 1.22 0.00 0.00 108 A 8.40 3.54 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 0.00 109 D 7.96 4.50 0.00 2.79 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 0.00 110 D 7.65 5.11 0.00 2.70 2.65 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 0.00 111 Q 8.20 4.80 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 112 V 8.49 3.98 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 0.74 0.00 0.00 0.92 0.00 0.00 113 L 8.56 4.63 0.00 1.69 1.74 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 114 E 7.74 4.69 0.00 1.96 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 0.00 1.47 2.12 0.00 115 A 8.49 5.30 1.21 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 0.00 116 Y 9.23 5.39 0.00 3.13 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 0.00 117 E 9.42 5.07 0.00 1.96 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 2.22 2.34 0.00 118 F 7.48 4.91 0.00 1.51 1.45 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 0.00 0.00 0.00 0.00 119 C 8.25 4.33 0.00 2.85 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 0.00 120 N 7.52 3.52 0.00 2.54 2.00 0.00 0.00 7.00 7.95 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 0.00 121 L 7.31 4.13 0.00 1.15 1.38 0.72 0.90 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 0.00 122 H 7.97 4.87 0.00 3.06 3.33 0.00 5.71 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 0.00 123 G 8.20 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 0.00 124 V 7.89 4.82 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 0.78 0.00 0.00 0.76 0.00 0.00 125 W 9.11 5.62 0.00 3.36 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 0.00 126 S 8.94 5.17 0.00 3.52 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 0.00 127 G 8.55 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 0.00 0.00 0.00 128 K 8.49 4.26 0.00 1.71 1.68 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.35 7.81 * Residues marked with a * may have inaccurate shift predictions.