NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *19 K 4.2777 8.3144 122.1404 54.0609 33.7860 175.8329 20 E 3.9876 8.4346 122.0584 54.2163 30.0072 174.7520 21 I 4.4778 7.9648 118.1082 60.3670 39.9109 174.8485 22 G 4.0297 7.1281 107.0286 45.4457 0.0000 173.0734 23 N 5.0540 9.5194 117.8466 49.6395 38.8518 174.1239 24 G 4.6131 9.0905 118.0051 47.1061 0.0000 171.1819 25 G 3.7057 8.3584 114.3485 44.9158 0.0000 174.7190 26 W 4.0237 7.8610 119.0944 59.0603 29.2642 176.6272 27 D 4.7150 8.0364 115.6621 54.1250 39.3342 176.8783 28 Q 4.1098 7.6329 118.8201 57.1396 29.2645 176.4582 29 F 4.6379 7.4225 116.3755 57.6348 39.5400 175.2508 30 Q 4.1438 9.1092 123.3239 58.5562 29.3287 176.2712 31 F 5.0460 8.0912 115.3848 56.5598 44.1198 174.0448 32 L 4.8451 8.9935 121.1441 55.3442 43.4053 173.4574 33 F 4.8393 8.2192 120.3402 56.0249 41.6032 172.9221 34 F 5.4022 8.7661 118.2105 55.7198 40.9082 175.5625 35 D 4.6146 9.0972 122.5377 53.5842 41.7026 176.8036 36 P 4.3743 0.0000 0.0000 65.2257 31.4880 177.2951 37 N 4.7041 8.3933 113.7889 52.8485 38.5789 175.5075 38 G 3.6732 8.1326 105.6670 45.8941 0.0000 173.2839 39 Y 4.3273 8.0095 117.5506 57.0195 39.7689 174.3816 40 L 4.1999 9.2049 126.9835 54.9150 43.6681 175.1023 41 Y 5.0923 8.9864 124.0783 56.4018 41.0868 174.6283 42 A 4.9674 8.7242 122.7992 50.6196 23.3182 175.1626 43 V 5.0400 9.0152 122.2830 61.2874 34.2321 174.6638 44 S 4.8335 9.3237 122.3554 57.6219 66.1398 173.6692 45 N 3.9337 9.8022 124.2986 54.6133 35.7695 174.7790 46 D 4.7493 8.6381 115.6567 54.1444 40.7093 173.2563 47 K 4.6601 7.8403 117.1944 55.3967 35.2724 174.7955 48 L 5.4454 7.9434 122.5750 53.7292 44.9184 175.0288 49 Y 4.8937 9.1579 122.5450 56.2098 42.4852 174.5597 50 K 4.5788 8.3051 121.5809 55.2018 34.9883 174.8846 51 A 4.8031 8.6010 127.5006 50.7387 23.1888 175.4837 52 S 4.6329 8.8432 114.3738 57.5699 63.7812 172.6687 53 P 4.5420 0.0000 0.0000 61.6536 31.9348 174.3407 54 P 4.3135 0.0000 0.0000 64.0107 32.0927 176.1637 55 Q 3.4829 8.6371 119.0239 57.0600 25.6964 173.7325 56 S 4.3914 7.8663 110.8958 58.2396 64.3442 172.9038 57 D 5.0349 8.0152 119.9782 52.1260 43.7359 176.3993 58 T 3.9425 8.2567 117.4886 64.0034 68.9697 174.4365 59 D 4.3032 8.8436 125.6221 56.0334 41.5909 175.4735 60 N 4.1523 8.2363 114.4681 53.8382 36.7607 173.5094 61 W 3.9769 8.2256 130.9392 59.9586 31.7950 177.8800 62 I 3.5027 8.1239 117.9440 63.6514 37.7233 177.4762 63 A 3.9915 7.6682 122.5257 54.3170 18.2414 178.0996 64 R 4.2851 7.3585 110.1959 55.7426 29.7098 175.9900 65 A 4.0671 7.0884 121.1469 50.9729 20.2719 177.7818 66 T 4.0015 7.8740 117.0601 62.6269 68.6356 174.7584 67 E 4.0172 8.5850 128.6339 56.0626 30.1437 176.1842 68 I 4.4592 7.8509 116.9468 60.1344 39.0447 175.1574 69 G 3.9537 7.4506 107.2081 45.3042 0.0000 173.5082 70 S 4.2875 9.1894 116.4127 60.2965 63.8888 173.9743 71 G 3.9870 9.9904 118.5287 46.9566 0.0000 173.2830 72 G 3.7611 9.0851 114.2587 44.6652 0.0000 174.3296 73 W 4.4066 8.0438 119.8696 59.9889 29.1909 177.8970 74 S 4.5875 8.2178 111.8766 59.8393 62.5397 175.0880 75 G 3.5950 7.8637 109.1229 46.6851 0.0000 174.0868 76 F 4.5903 7.4732 118.7514 57.0153 39.6775 175.6291 77 K 4.0642 9.1693 127.8114 58.9248 32.5676 176.9709 78 F 5.2627 8.1911 116.4206 55.9415 43.8696 174.2715 79 L 5.0043 8.9058 123.0972 54.7114 44.4004 174.2283 80 F 4.8796 8.7995 120.3081 56.2858 41.5200 172.9380 81 F 5.3292 8.9262 118.3965 56.4831 40.8420 175.2540 82 H 4.6812 9.4660 122.0471 54.5356 30.7028 174.6438 83 P 4.4568 0.0000 0.0000 65.1218 31.2434 176.9469 84 N 4.5959 8.7703 113.7688 53.2606 37.6868 175.9722 85 G 3.9273 8.9072 108.2635 45.4646 0.0000 173.4381 86 Y 4.1733 9.0890 118.3731 57.6872 39.5370 174.6630 87 L 4.3931 8.9370 125.5493 54.0454 43.3748 174.8395 88 Y 4.5351 8.7335 125.1570 56.9344 40.0552 174.9104 89 A 5.1565 9.1673 123.9370 50.8326 23.3909 175.3180 90 V 5.2722 9.3221 115.5289 58.8340 34.6882 174.7707 91 R 4.8033 8.9555 125.5206 54.6675 32.9663 175.6758 92 G 3.8761 9.0647 115.8482 47.2214 0.0000 175.3716 93 Q 4.3815 9.1299 123.7102 55.4718 29.6453 175.1641 94 R 4.4643 7.8790 115.2713 54.4769 31.5338 174.7524 95 F 5.2997 7.7623 119.4647 56.9703 42.1014 173.0232 96 Y 4.9494 9.7722 123.7659 55.8762 41.6976 174.6312 97 K 4.7733 8.5677 120.7570 53.9581 35.3022 174.9698 98 A 4.8671 8.1548 123.8819 50.3986 23.2318 174.8440 99 L 4.2563 8.4787 118.6045 53.7920 42.3434 176.1923 100 P 4.4125 0.0000 0.0000 61.9159 31.8278 174.3107 101 P 4.5789 0.0000 0.0000 63.1000 31.8593 176.2889 102 V 4.3454 7.6848 109.1753 61.0389 33.8656 176.3033 103 S 4.3393 7.8855 119.7939 59.3256 63.6810 176.2767 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 *19 K 8.31 4.28 0.00 1.49 1.63 0.00 1.53 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.47 7.81 20 E 8.43 3.99 0.00 1.98 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 2.25 2.34 0.00 21 I 7.96 4.48 1.89 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.51 0.85 0.00 0.00 22 G 7.13 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 23 N 9.52 5.05 0.00 2.83 2.75 0.00 0.00 6.89 7.98 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 24 G 9.09 4.61 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 0.00 25 G 8.36 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 26 W 7.86 4.02 0.00 3.41 3.53 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 27 D 8.04 4.72 0.00 2.81 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 28 Q 7.63 4.11 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.92 0.00 0.00 0.00 0.00 0.00 2.23 2.18 0.00 29 F 7.42 4.64 0.00 3.10 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 30 Q 9.11 4.14 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.66 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 31 F 8.09 5.05 0.00 3.34 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 32 L 8.99 4.85 0.00 1.69 1.67 0.68 0.85 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 33 F 8.22 4.84 0.00 3.18 3.12 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 34 F 8.77 5.40 0.00 3.05 3.01 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 35 D 9.10 4.61 0.00 3.39 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 36 P 0.00 4.37 0.00 2.09 2.15 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 37 N 8.39 4.70 0.00 2.97 2.96 0.00 0.00 6.98 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 38 G 8.13 3.67 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 0.00 0.00 0.00 39 Y 8.01 4.33 0.00 3.49 3.01 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 40 L 9.20 4.20 0.00 1.71 1.64 -0.01 0.73 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 41 Y 8.99 5.09 0.00 1.54 2.21 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 42 A 8.72 4.97 0.60 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 43 V 9.02 5.04 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 1.24 0.00 0.00 1.24 0.00 0.00 44 S 9.32 4.83 0.00 4.25 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 45 N 9.80 3.93 0.00 2.99 2.92 0.00 0.00 7.16 8.06 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 46 D 8.64 4.75 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 47 K 7.84 4.66 0.00 1.74 1.46 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.59 7.81 48 L 7.94 5.45 0.00 1.64 1.45 1.23 0.94 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 49 Y 9.16 4.89 0.00 2.81 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 50 K 8.31 4.58 0.00 0.81 1.29 0.00 1.25 0.00 0.00 1.29 0.00 0.00 2.13 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.00 1.07 7.81 51 A 8.60 4.80 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 52 S 8.84 4.63 0.00 3.83 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 53 P 0.00 4.54 0.00 2.27 2.25 0.00 3.78 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.42 0.00 54 P 0.00 4.31 0.00 2.36 2.22 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.62 0.00 55 Q 8.64 3.48 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.09 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 56 S 7.87 4.39 0.00 3.94 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 57 D 8.02 5.03 0.00 2.63 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 58 T 8.26 3.94 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 1.22 0.00 0.00 59 D 8.84 4.30 0.00 2.61 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 60 N 8.24 4.15 0.00 2.96 2.74 0.00 0.00 6.83 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 61 W 8.23 3.98 0.00 3.36 3.21 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 62 I 8.12 3.50 2.10 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.23 1.01 0.00 0.00 63 A 7.67 3.99 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 64 R 7.36 4.29 0.00 1.70 1.91 0.00 2.96 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.43 0.00 65 A 7.09 4.07 0.41 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 0.00 0.00 66 T 7.87 4.00 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 1.14 0.00 0.00 67 E 8.58 4.02 0.00 1.85 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 2.25 2.24 0.00 68 I 7.85 4.46 1.75 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.51 0.92 0.00 0.00 69 G 7.45 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 70 S 9.19 4.29 0.00 4.02 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 71 G 9.99 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 72 G 9.09 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 0.00 0.00 0.00 73 W 8.04 4.41 0.00 3.59 3.51 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 0.00 74 S 8.22 4.59 0.00 3.92 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 75 G 7.86 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 76 F 7.47 4.59 0.00 3.28 3.31 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 77 K 9.17 4.06 0.00 1.67 1.69 0.00 1.64 0.00 0.00 1.41 0.00 0.00 2.64 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.80 1.19 7.81 78 F 8.19 5.26 0.00 3.39 3.25 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 79 L 8.91 5.00 0.00 1.78 1.62 1.04 0.46 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 80 F 8.80 4.88 0.00 3.15 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 81 F 8.93 5.33 0.00 3.13 3.09 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 82 H 9.47 4.68 0.00 3.06 3.67 0.00 5.80 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.46 0.00 2.09 2.12 0.00 3.28 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 1.95 2.07 0.00 84 N 8.77 4.60 0.00 2.96 3.07 0.00 0.00 6.22 7.00 0.00 0.00 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 G 8.91 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 86 Y 9.09 4.17 0.00 3.19 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 87 L 8.94 4.39 0.00 1.58 1.61 0.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 8.73 4.54 0.00 2.02 2.35 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 0.00 89 A 9.17 5.16 0.88 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 90 V 9.32 5.27 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 1.19 0.00 0.00 1.10 0.00 0.00 91 R 8.96 4.80 0.00 2.22 2.14 0.00 2.77 0.00 0.00 2.30 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 92 G 9.06 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 93 Q 9.13 4.38 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 94 R 7.88 4.46 0.00 1.57 1.98 0.00 2.78 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.79 0.00 95 F 7.76 5.30 0.00 2.83 2.76 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 96 Y 9.77 4.95 0.00 2.86 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 97 K 8.57 4.77 0.00 1.07 0.74 0.00 0.74 0.00 0.00 0.61 0.00 0.00 2.42 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.39 0.64 7.81 98 A 8.15 4.87 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 99 L 8.48 4.26 0.00 1.49 1.50 0.85 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.41 0.00 2.25 2.36 0.00 3.70 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 101 P 0.00 4.58 0.00 2.38 2.23 0.00 3.63 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 102 V 7.68 4.35 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 0.75 0.00 0.00 0.92 0.00 0.00 103 S 7.89 4.34 0.00 3.78 3.67 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 * Residues marked with a * may have inaccurate shift predictions.