NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3853 0.0000 0.0000 62.3687 32.7907 175.0424 2 Q 4.3817 8.4928 120.3869 53.8350 31.1024 172.9884 3 I 4.4508 8.2242 126.3204 59.6455 40.2994 175.2469 4 T 4.4085 8.3879 115.5927 60.9849 70.2191 174.1372 5 L 4.6878 7.6376 118.1911 54.2437 42.3846 178.1593 6 W 4.2970 8.2217 121.7790 58.8725 29.0984 175.8711 7 Q 4.7648 7.7239 113.5313 53.3437 31.1903 175.0103 8 R 3.9207 8.5098 117.3910 56.4022 31.0132 176.4840 9 P 4.6890 0.0000 0.0000 62.3687 29.1728 175.1336 10 L 4.9774 7.5982 121.7891 54.8292 43.3497 177.9769 11 V 4.5953 8.6695 122.1485 60.0355 35.2631 174.7401 12 T 4.7825 8.5629 119.4488 63.4800 69.2430 173.8928 13 I 4.7820 8.9733 119.2495 58.8665 41.7676 174.1526 14 K 4.9748 8.9071 122.7593 54.7334 35.2584 174.5092 15 I 4.5577 8.6706 127.7272 59.5770 41.0791 175.5588 16 G 4.0820 9.8153 118.3019 46.6361 0.0000 174.3587 17 G 3.9914 8.2317 105.8317 45.4589 0.0000 174.0160 18 Q 4.2591 8.0594 120.5211 54.9952 29.4298 175.1086 19 L 4.7604 8.3772 123.6937 54.7516 42.7332 176.2663 20 K 4.5951 9.0169 121.5682 56.0685 36.7551 173.7095 21 E 5.2171 8.6739 120.1651 54.5018 31.7651 174.8368 22 A 4.8843 8.7668 126.8296 50.3206 23.5729 174.3581 23 L 4.7411 8.8264 123.0464 53.6444 43.8146 175.7266 24 L 4.4342 8.6258 127.3505 54.8908 42.3085 176.4243 25 D 4.7971 8.9871 124.8589 52.4552 42.9119 176.3059 26 T 4.0368 8.7367 116.8904 63.6776 69.2699 175.7935 27 G 3.6885 8.2417 109.5585 45.9200 0.0000 172.9604 28 A 4.5183 7.7584 123.6380 50.4173 19.8257 178.0680 29 D 4.3606 8.9302 123.3229 56.9055 42.3867 176.1703 30 D 5.0749 7.9570 116.1183 52.5457 45.6502 175.0087 31 T 4.4431 8.0288 117.0904 62.7308 70.2488 174.1570 32 V 4.8420 8.5608 126.3446 61.0246 34.6144 174.1987 33 L 5.1822 9.1938 127.7629 52.4837 45.1964 176.0789 34 E 4.3652 8.6928 121.6772 56.2293 30.4797 177.0361 35 E 3.8986 8.6305 120.8585 57.2484 29.8718 176.5749 36 M 4.2950 7.8060 118.5709 54.7618 33.3554 174.0930 37 S 4.3995 8.5240 116.0420 57.7213 63.5758 174.0081 38 L 4.6712 7.8850 125.0761 51.5807 44.2352 173.7203 39 P 4.2623 0.0000 0.0000 63.8455 31.4587 179.8225 40 G 4.2484 8.2157 113.7530 43.9291 0.0000 173.2804 41 R 4.4180 8.4190 119.1887 55.3659 31.2627 175.4314 42 W 5.1118 7.8171 116.1073 54.4617 31.3901 174.2322 43 K 4.6479 8.7284 119.9375 54.2851 35.6922 173.2494 44 P 5.3436 0.0000 0.0000 62.6433 32.7942 175.2457 45 K 4.7467 8.7450 121.9521 55.4759 36.1132 174.3648 46 M 5.4682 8.7546 125.2360 53.6317 34.7698 175.0800 47 I 4.8398 8.7807 115.0880 59.2687 41.7470 174.0150 48 G 3.5880 8.6325 110.2942 44.4477 0.0000 172.9781 49 G 4.3125 8.2750 112.2951 43.0770 0.0000 172.9024 50 I 3.5572 8.4911 118.2358 64.0299 37.7926 177.6424 51 G 3.6453 7.8854 106.8298 46.1933 0.0000 172.4657 52 G 3.7247 6.7817 105.7213 43.9945 0.0000 172.4836 53 F 5.1456 8.5892 118.5610 56.6700 40.4336 175.5805 54 I 4.8327 8.6931 114.3990 59.2057 41.3751 174.1010 55 K 4.9435 8.6280 122.3781 55.7302 33.3637 176.3646 56 V 4.6696 9.0287 116.5685 59.8031 36.8902 174.3720 57 R 4.4961 8.7633 121.5072 54.8533 31.8921 175.3375 58 Q 5.0157 9.3761 126.5418 54.9987 30.9406 173.7229 59 Y 5.1141 9.1391 124.0112 56.4075 41.1362 174.7936 60 D 5.1188 8.9050 122.5167 52.3065 43.8555 175.6725 61 Q 3.3808 8.2743 116.1234 57.2989 26.4390 174.3099 62 I 4.4314 7.8238 118.0684 59.6034 39.6829 176.3874 63 L 4.7745 8.5308 129.6426 54.7207 42.8500 175.7835 64 I 4.7779 9.0922 126.9954 59.4518 41.3806 173.8454 65 E 4.9992 9.0815 127.2048 54.2649 31.6182 176.3228 66 I 4.5305 9.0656 129.6371 61.2968 38.2034 177.1674 *68 G 4.1453 8.1961 107.3817 43.0739 0.0000 172.9572 69 H 4.6745 8.2797 118.9848 53.7081 29.3614 174.6449 70 K 4.5970 8.4438 124.7405 56.6876 32.8820 176.9242 71 V 4.5576 8.6106 122.9236 61.6529 35.5430 173.1564 72 I 5.0011 8.3071 127.6109 60.0437 40.2147 175.2120 73 G 4.0526 8.3498 112.7192 46.5556 0.0000 171.5986 74 T 4.9812 8.6761 116.6538 62.9115 69.7791 174.9720 75 V 4.4981 8.8034 125.0549 61.0766 35.2375 173.8436 76 L 5.2368 8.9682 127.6571 53.0643 44.3131 175.3348 77 V 4.5798 8.7853 125.0014 61.7491 33.2961 175.1841 78 G 4.0072 8.0889 114.0072 45.2980 0.0000 171.2242 79 P 4.5163 0.0000 0.0000 62.8816 30.0898 175.2155 80 T 4.6267 7.8566 117.9153 59.8045 70.3604 171.9634 81 P 4.5711 0.0000 0.0000 63.9054 32.0610 176.1597 82 T 4.7345 7.6739 115.5482 61.8945 72.6316 173.1640 83 N 4.6865 8.6970 123.1485 53.2002 40.1636 173.9789 84 V 4.7218 9.0302 123.6607 61.1475 34.6898 174.0641 85 I 4.4273 8.9708 129.6796 60.2185 38.8443 175.7961 86 G 4.2997 8.4001 115.3537 43.7045 0.0000 174.1693 87 R 4.0564 9.2324 118.5386 59.0487 30.2154 179.1558 88 N 4.3235 7.7188 113.5629 55.3830 37.4775 176.3255 89 L 4.4235 7.7685 117.4954 56.1960 42.6722 178.6150 90 L 4.0398 8.1101 119.4273 57.9057 41.0299 179.5759 91 T 3.9184 8.1295 109.8128 64.8798 68.3432 176.5159 92 Q 4.0981 7.7665 119.8023 57.8208 28.8477 177.3607 93 I 4.1944 7.6901 111.5562 60.3316 38.2267 175.9308 94 G 3.7870 7.6235 107.9860 46.4375 0.0000 173.3309 95 C 4.2588 7.8668 120.2536 58.9812 32.0137 172.9343 96 T 4.7098 8.1377 115.8151 59.6255 71.4328 172.9741 97 L 4.4978 8.3415 122.8100 53.8429 42.7737 176.1078 98 N 5.0006 8.5924 120.4024 51.3745 41.8595 174.3673 99 F 4.4835 7.9670 116.4719 57.3742 37.5741 173.9093 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 P 0.00 4.39 0.00 2.09 2.07 0.00 3.87 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 2 Q 8.49 4.38 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.25 2.46 0.00 3 I 8.22 4.45 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 1.49 0.80 0.92 0.00 0.00 4 T 8.39 4.41 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 1.34 0.00 0.00 5 L 7.64 4.69 0.00 1.30 1.49 0.81 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.22 4.30 0.00 3.30 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 7 Q 7.72 4.76 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 8 R 8.51 3.92 0.00 1.82 1.93 0.00 3.21 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 9 P 0.00 4.69 0.00 2.10 2.21 0.00 3.67 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.97 0.00 10 L 7.60 4.98 0.00 1.54 1.64 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.67 4.60 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 0.77 0.00 0.00 0.94 0.00 0.00 12 T 8.56 4.78 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 1.27 0.00 0.00 13 I 8.97 4.78 1.94 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 1.21 0.71 0.91 0.00 0.00 14 K 8.91 4.97 0.00 1.80 1.64 0.00 1.56 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.35 7.81 15 I 8.67 4.56 1.84 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 1.10 1.32 0.88 0.00 0.00 16 G 9.82 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 17 G 8.23 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 18 Q 8.06 4.26 0.00 2.23 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.96 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 19 L 8.38 4.76 0.00 1.52 1.59 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 20 K 9.02 4.60 0.00 1.75 1.87 0.00 1.22 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.37 7.81 21 E 8.67 5.22 0.00 1.95 1.82 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 2.17 2.27 0.00 22 A 8.77 4.88 1.19 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 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.83 4.74 0.00 1.74 1.63 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.63 4.43 0.00 1.66 1.61 0.91 0.81 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 25 D 8.99 4.80 0.00 2.67 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 26 T 8.74 4.04 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 27 G 8.24 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 28 A 7.76 4.52 1.36 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 0.00 0.00 29 D 8.93 4.36 0.00 2.62 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 30 D 7.96 5.07 0.00 2.56 2.52 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 31 T 8.03 4.44 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 1.25 0.00 0.00 32 V 8.56 4.84 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 0.93 0.00 0.00 0.93 0.00 0.00 33 L 9.19 5.18 0.00 1.50 1.54 0.86 0.24 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 34 E 8.69 4.37 0.00 1.92 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 2.53 2.29 0.00 35 E 8.63 3.90 0.00 1.91 1.86 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 2.27 2.21 0.00 36 M 7.81 4.29 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.53 0.00 37 S 8.52 4.40 0.00 3.84 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 38 L 7.89 4.67 0.00 0.59 0.94 0.72 0.37 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 39 P 0.00 4.26 0.00 2.22 2.00 0.00 3.68 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 40 G 8.22 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 41 R 8.42 4.42 0.00 1.78 1.75 0.00 3.12 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 42 W 7.82 5.11 0.00 2.74 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 0.00 0.00 0.00 43 K 8.73 4.65 0.00 1.78 1.82 0.00 1.30 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.29 1.37 7.81 44 P 0.00 5.34 0.00 2.19 2.26 0.00 3.72 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 45 K 8.74 4.75 0.00 1.82 1.68 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.47 7.81 46 M 8.75 5.47 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 47 I 8.78 4.84 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 1.20 0.94 0.96 0.00 0.00 48 G 8.63 3.59 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 0.00 0.00 0.00 49 G 8.27 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 0.00 0.00 0.00 0.00 50 I 8.49 3.56 1.83 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 1.32 0.69 0.87 0.00 0.00 51 G 7.89 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 0.00 0.00 0.00 52 G 6.78 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 0.00 0.00 0.00 53 F 8.59 5.15 0.00 2.95 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 54 I 8.69 4.83 1.89 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 1.24 0.79 0.93 0.00 0.00 55 K 8.63 4.94 0.00 1.69 1.82 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.50 7.81 56 V 9.03 4.67 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 0.89 0.00 0.00 1.01 0.00 0.00 57 R 8.76 4.50 0.00 1.58 0.96 0.00 2.21 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 58 Q 9.38 5.02 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 59 Y 9.14 5.11 0.00 2.97 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 60 D 8.91 5.12 0.00 2.59 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 61 Q 8.27 3.38 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.72 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 62 I 7.82 4.43 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.97 0.89 0.00 0.00 63 L 8.53 4.77 0.00 1.66 1.58 0.93 1.01 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 64 I 9.09 4.78 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.52 0.94 0.00 0.00 65 E 9.08 5.00 0.00 2.02 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 2.23 2.29 0.00 66 I 9.07 4.53 1.89 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 1.23 0.71 0.92 0.00 0.00 *68 G 8.20 4.15 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 0.00 69 H 8.28 4.67 0.00 3.42 3.27 0.00 5.82 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.44 4.60 0.00 1.65 1.75 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.44 7.81 71 V 8.61 4.56 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 0.80 0.00 0.00 0.94 0.00 0.00 72 I 8.31 5.00 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 1.17 0.80 0.97 0.00 0.00 73 G 8.35 4.05 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 0.00 0.00 0.00 74 T 8.68 4.98 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 1.33 0.00 0.00 75 V 8.80 4.50 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 0.95 0.00 0.00 0.93 0.00 0.00 76 L 8.97 5.24 0.00 1.70 1.58 0.95 1.02 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 77 V 8.79 4.58 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 1.00 0.00 0.00 0.78 0.00 0.00 78 G 8.09 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 0.00 0.00 0.00 79 P 0.00 4.52 0.00 2.18 2.12 0.00 3.79 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 80 T 7.86 4.63 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 1.25 0.00 0.00 81 P 0.00 4.57 0.00 2.21 2.13 0.00 3.76 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 1.96 1.97 0.00 82 T 7.67 4.73 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 1.20 0.00 0.00 83 N 8.70 4.69 0.00 2.79 2.72 0.00 0.00 6.53 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 84 V 9.03 4.72 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 1.00 0.00 0.00 0.97 0.00 0.00 85 I 8.97 4.43 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.07 0.91 0.00 0.00 86 G 8.40 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 87 R 9.23 4.06 0.00 1.84 2.00 0.00 3.14 0.00 0.00 3.35 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 88 N 7.72 4.32 0.00 2.88 3.10 0.00 0.00 6.94 7.67 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 89 L 7.77 4.42 0.00 1.70 1.74 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.11 4.04 0.00 1.68 1.71 0.91 0.46 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 91 T 8.13 3.92 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 1.23 0.00 0.00 92 Q 7.77 4.10 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 93 I 7.69 4.19 1.66 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 1.64 0.50 0.90 0.00 0.00 94 G 7.62 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 95 C 7.87 4.26 0.00 2.95 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 96 T 8.14 4.71 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 1.20 0.00 0.00 97 L 8.34 4.50 0.00 1.71 1.76 0.96 0.97 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 98 N 8.59 5.00 0.00 2.65 2.66 0.00 0.00 6.89 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 99 F 7.97 4.48 0.00 3.09 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 * Residues marked with a * may have inaccurate shift predictions.