NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 D 4.5597 8.3649 120.1852 53.5572 42.7624 175.0221 14 N 4.1990 8.2912 121.3665 52.7180 39.7048 173.2901 15 G 4.0000 9.2188 116.4513 47.0107 0.0000 172.7254 16 C 5.7278 8.9978 121.9267 55.0472 42.1507 173.9760 17 S 4.5080 8.9010 118.1756 58.1056 63.3527 172.7392 18 V 4.9169 8.5219 126.3825 61.0594 33.6008 174.3122 19 A 4.7236 9.0314 129.3147 50.1912 21.2963 174.4571 20 A 4.7155 8.5753 123.9698 51.2920 20.5307 175.9927 21 E 4.4329 8.8272 123.7349 55.2753 30.6426 176.6362 22 S 4.3403 8.5444 121.0801 57.8937 64.4797 173.1611 23 T 4.3336 7.7993 116.8638 61.5480 70.7279 173.3116 24 N 4.7553 8.2709 123.9080 51.9479 40.6830 173.7347 25 F 5.1207 8.1700 122.2409 55.7836 42.3348 175.0782 *40 I 3.9360 8.0589 120.3703 63.1240 36.6051 175.2868 41 G 3.9598 8.8647 113.8927 44.6649 0.0000 171.9520 42 A 4.2745 7.8708 122.3268 52.2501 19.3280 176.6181 43 T 5.2288 8.4240 111.7289 59.9848 71.9780 173.6819 44 T 4.4862 8.4198 113.5568 59.8186 70.7039 172.8317 45 P 4.3912 0.0000 0.0000 62.2744 31.9572 177.0854 46 V 4.0096 8.2226 115.1917 61.9467 32.4012 175.5979 47 V 4.6219 8.9645 124.6216 60.4020 33.8585 173.0922 48 P 4.8945 0.0000 0.0000 62.8042 32.3949 175.4432 49 F 5.3122 8.7398 116.0852 55.5181 41.7865 173.2661 50 R 5.1009 9.4222 116.4931 54.5255 33.0729 174.5694 51 I 4.8271 8.8649 121.2036 59.6412 40.1603 174.3082 52 L 4.6564 8.8544 130.6458 53.6057 43.8407 175.3143 53 L 5.0113 8.8317 128.1608 54.2607 42.6580 175.6557 54 S 4.7187 8.6456 115.0556 56.8025 66.2802 174.1650 55 P 4.6960 0.0000 0.0000 62.7056 33.2484 175.5470 56 C 5.5140 8.5392 117.0439 54.8236 40.3306 174.4580 57 G 4.5158 8.6891 109.5052 45.8753 0.0000 174.4865 58 N 4.5354 9.0343 118.1506 55.2608 38.7457 175.9907 59 A 4.6363 8.1898 119.3263 51.5862 19.4845 177.2338 60 V 3.9809 7.6843 110.5524 62.3272 32.4600 175.0718 61 S 4.6460 8.6669 114.8586 59.3985 65.0838 173.2923 62 A 5.2216 7.6704 121.0271 50.0961 22.8252 174.6779 63 V 5.1428 9.0495 111.9134 59.6686 36.5302 174.9035 64 K 4.3390 8.7085 123.8697 55.1493 33.2990 176.1051 65 V 4.9099 7.4881 117.9056 58.8496 34.6843 175.0261 66 G 4.1096 7.3599 108.8259 45.5091 0.0000 171.3810 67 F 5.5333 8.8420 118.4868 55.6473 42.0887 174.9167 68 T 5.0834 9.5876 112.9263 59.6787 72.3608 173.4004 69 G 4.0662 8.1874 109.0681 46.3209 0.0000 171.9585 70 V 4.0566 7.6641 119.7869 62.2400 32.3186 175.3456 71 A 4.6771 8.5724 130.3456 51.4515 19.2852 176.4364 72 D 4.4856 9.2234 122.1386 54.3327 41.8643 177.8742 73 S 4.1307 8.7943 119.5223 61.2534 63.2970 175.0031 74 H 4.4623 8.7164 117.6988 57.0708 29.2187 174.9701 75 N 4.7383 8.1125 118.2037 51.8277 40.8720 174.7604 76 A 4.0542 8.7547 129.5847 54.7806 18.7732 177.3849 77 N 4.7597 8.5558 111.9958 53.2877 39.2619 174.1142 78 L 4.9349 7.6404 119.7882 52.8603 44.2631 175.5207 79 L 4.4793 9.0166 125.7776 54.6106 43.1678 175.9693 80 A 4.4816 8.8191 129.1091 51.8365 19.0425 177.2315 81 L 4.3960 8.3458 120.8546 54.1172 42.8897 176.8910 82 E 4.0666 9.0668 124.5880 57.3666 30.2357 177.3980 83 N 4.7618 8.7663 121.3345 50.8930 38.4548 172.2680 84 T 4.8425 7.8906 114.0553 58.4482 72.2541 175.0685 85 V 3.6344 8.4924 119.8936 64.4042 31.3649 177.0729 86 S 4.6404 7.8070 113.1100 57.9020 63.1517 173.5854 87 A 4.7397 7.5029 122.0007 51.6944 18.9377 177.9343 88 A 4.7103 8.6430 121.9988 51.2527 20.1016 176.7068 89 S 4.4058 8.8463 112.6847 58.2469 66.4361 175.5459 90 G 3.9274 9.3190 107.7440 44.8540 0.0000 172.6589 91 L 4.8178 7.4963 117.7860 52.7499 45.4779 175.7687 92 G 4.2411 8.9200 108.3979 44.6145 0.0000 170.9842 93 I 4.7660 8.5330 121.0361 59.6824 39.1946 174.8878 94 Q 4.7937 9.0578 128.8788 54.5766 31.1862 173.9857 95 L 5.3449 8.4101 125.2424 53.1138 44.5108 175.2981 96 L 5.4345 9.0838 122.5716 52.9689 46.1598 176.7830 97 N 5.0883 8.9123 119.5284 51.8151 39.1277 175.3999 98 E 3.8510 8.4355 117.8021 59.2488 29.6615 177.4465 99 Q 4.3407 8.2386 115.3833 55.3737 28.8234 175.3753 100 Q 3.6778 8.3093 115.9870 56.9496 26.9877 173.2443 101 N 4.7727 8.2282 114.8202 51.9411 39.8184 174.6111 102 Q 4.4742 8.5198 123.2403 56.6200 29.8447 175.3951 103 I 4.3680 8.6663 127.8746 59.7765 38.4674 173.8313 104 P 4.8789 0.0000 0.0000 61.3893 31.6428 176.1984 105 L 4.1752 8.8101 127.5000 56.2089 42.6666 176.4308 106 N 4.4243 9.1659 121.6711 54.0006 36.6699 174.3848 107 A 4.1101 7.3246 121.2960 51.3863 19.1430 177.0216 108 P 4.4583 0.0000 0.0000 62.3269 32.4765 177.4877 109 S 4.0730 8.7517 116.2645 61.8728 62.8601 177.1976 110 S 4.0974 8.0352 113.0457 60.5276 62.7562 174.6633 111 A 4.3587 8.0426 122.5546 52.2516 19.2024 176.8699 112 L 4.4064 7.2841 116.2904 53.3829 42.8993 176.8546 113 S 4.5282 8.1239 118.3321 57.1227 64.4217 173.5132 114 W 4.4660 8.4390 121.6931 56.6757 30.0240 176.2165 115 T 4.5689 9.0968 121.9271 62.2770 69.5339 174.5233 116 T 4.4926 8.6808 123.8618 63.5840 69.2971 173.9520 117 L 4.9825 8.6606 125.2986 53.0829 44.8641 176.6524 118 T 4.1168 9.3964 120.0192 62.2684 68.5427 172.8820 119 P 4.2149 0.0000 0.0000 63.9664 31.7235 176.9706 120 G 4.2513 8.7984 110.4765 45.6387 0.0000 172.7761 121 K 4.8048 7.5143 117.5603 53.2680 36.2006 174.3667 122 P 4.6493 0.0000 0.0000 63.0518 32.2332 175.9221 123 N 5.0047 9.5871 120.7139 51.8812 42.0174 173.3139 124 T 4.8205 8.6285 120.4920 61.8029 70.7887 173.8626 125 L 4.5461 8.7663 126.2497 52.9695 44.1860 175.0126 126 N 4.8607 8.0895 120.9641 51.3926 40.7621 173.9510 127 F 4.7554 8.3319 120.9088 55.8754 44.1586 172.9536 128 Y 5.3760 9.0376 116.0516 56.3940 42.0306 174.8775 129 A 5.6389 9.3296 123.2860 50.6167 22.8559 175.2667 130 R 5.2082 9.0431 115.5591 55.4128 33.8673 173.4562 131 L 5.0103 8.9406 119.4185 53.3537 44.2080 175.6820 132 M 5.2231 8.8673 121.7607 53.4812 36.0086 174.2433 133 A 4.6356 9.0880 128.4475 52.3805 19.1704 177.9585 134 T 4.3706 9.9882 112.2149 62.1264 71.5963 174.7786 135 Q 4.5068 7.8436 119.3646 53.9573 32.6049 174.2554 136 V 4.4806 8.1818 115.2573 58.8852 33.9323 173.8254 137 P 4.4789 0.0000 0.0000 61.7904 32.1133 176.3473 138 V 3.9786 8.2371 122.7600 63.2637 32.4486 174.9520 139 T 4.6899 8.4981 117.0059 59.7332 70.8001 174.1366 140 A 4.3924 8.4617 126.2021 51.3664 20.2230 176.3356 141 G 4.1691 8.5088 106.5778 43.6431 0.0000 172.5101 142 H 4.2476 8.4840 117.9064 56.1626 29.8867 175.3184 143 I 4.6597 8.4278 122.8078 59.7697 38.8162 174.5642 144 N 5.2602 8.4997 123.4878 51.6176 42.8987 173.7694 145 A 4.8603 8.4183 123.2860 51.4558 22.2755 175.4923 146 T 4.6918 8.1321 108.3257 60.0763 71.7832 172.7538 147 A 4.8698 8.1896 122.9185 51.3467 23.0707 175.2888 148 T 4.6212 9.1266 115.6235 61.8104 71.8699 173.2101 149 F 4.7597 8.8920 128.7185 56.9581 40.8761 174.6304 150 T 4.3672 8.0130 123.3713 61.6726 70.8444 173.5325 151 L 4.5869 8.2261 125.6827 52.9143 43.8251 175.4014 152 E 4.5045 8.7432 126.9399 54.6999 31.0082 174.7393 153 Y 4.4885 8.8208 125.4101 57.5211 39.0062 175.5839 154 Q 4.2997 8.8981 124.1315 56.5046 28.6927 175.8020 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 13 D 8.36 4.56 0.00 2.62 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 14 N 8.29 4.20 0.00 2.75 2.70 0.00 0.00 6.83 6.77 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 15 G 9.22 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 16 C 9.00 5.73 0.00 3.07 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 17 S 8.90 4.51 0.00 3.95 3.97 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 18 V 8.52 4.92 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 0.95 0.00 0.00 1.11 0.00 0.00 19 A 9.03 4.72 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 20 A 8.58 4.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.83 4.43 0.00 2.18 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 0.00 2.30 2.27 0.00 22 S 8.54 4.34 0.00 3.92 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 23 T 7.80 4.33 3.68 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 0.00 0.00 0.00 0.44 0.00 0.00 24 N 8.27 4.76 0.00 2.59 2.62 0.00 0.00 6.91 7.02 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 25 F 8.17 5.12 0.00 3.08 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 *40 I 8.06 3.94 1.85 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 1.44 0.45 0.90 0.00 0.00 41 G 8.86 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 0.00 0.00 0.00 42 A 7.87 4.27 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 43 T 8.42 5.23 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 1.26 0.00 0.00 44 T 8.42 4.49 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 1.22 0.00 0.00 45 P 0.00 4.39 0.00 2.09 2.03 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 46 V 8.22 4.01 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 0.48 0.00 0.00 0.59 0.00 0.00 47 V 8.96 4.62 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 1.04 0.00 0.00 0.98 0.00 0.00 48 P 0.00 4.89 0.00 2.00 1.80 0.00 3.60 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 2.02 2.23 0.00 49 F 8.74 5.31 0.00 3.05 3.04 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 50 R 9.42 5.10 0.00 1.91 1.98 0.00 2.71 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.59 0.00 51 I 8.86 4.83 1.79 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.80 0.75 0.00 0.00 52 L 8.85 4.66 0.00 1.77 1.55 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.83 5.01 0.00 1.89 1.69 1.04 0.54 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 54 S 8.65 4.72 0.00 3.82 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 55 P 0.00 4.70 0.00 2.13 1.98 0.00 3.61 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 56 C 8.54 5.51 0.00 3.00 2.98 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 57 G 8.69 4.52 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 0.00 0.00 0.00 58 N 9.03 4.54 0.00 2.73 2.91 0.00 0.00 6.78 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 59 A 8.19 4.64 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 60 V 7.68 3.98 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 0.91 0.00 0.00 1.03 0.00 0.00 61 S 8.67 4.65 0.00 3.76 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 62 A 7.67 5.22 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 63 V 9.05 5.14 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 0.11 0.00 0.00 0.95 0.00 0.00 64 K 8.71 4.34 0.00 1.08 1.22 0.00 0.90 0.00 0.00 1.08 0.00 0.00 2.34 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 65 V 7.49 4.91 1.50 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 0.63 0.00 0.00 1.11 0.00 0.00 66 G 7.36 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 67 F 8.84 5.53 0.00 2.97 2.98 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 68 T 9.59 5.08 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 1.20 0.00 0.00 69 G 8.19 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 70 V 7.66 4.06 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 1.01 0.00 0.00 0.93 0.00 0.00 71 A 8.57 4.68 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 72 D 9.22 4.49 0.00 2.77 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 73 S 8.79 4.13 0.00 3.90 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 74 H 8.72 4.46 0.00 3.19 3.40 0.00 5.83 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.11 4.74 0.00 2.62 2.63 0.00 0.00 6.93 7.93 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 76 A 8.75 4.05 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 77 N 8.56 4.76 0.00 2.79 2.85 0.00 0.00 6.75 6.48 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 78 L 7.64 4.93 0.00 1.74 1.54 0.91 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 79 L 9.02 4.48 0.00 1.71 1.62 1.06 1.18 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 80 A 8.82 4.48 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 81 L 8.35 4.40 0.00 1.52 1.57 0.84 0.85 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 82 E 9.07 4.07 0.00 1.83 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 2.35 2.39 0.00 83 N 8.77 4.76 0.00 2.72 2.63 0.00 0.00 6.53 7.71 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 84 T 7.89 4.84 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 85 V 8.49 3.63 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 0.75 0.00 0.00 0.94 0.00 0.00 86 S 7.81 4.64 0.00 4.00 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 87 A 7.50 4.74 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 88 A 8.64 4.71 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 89 S 8.85 4.41 0.00 3.87 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 90 G 9.32 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 91 L 7.50 4.82 0.00 1.41 1.43 0.85 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 92 G 8.92 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 0.00 0.00 0.00 0.00 93 I 8.53 4.77 1.81 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.36 0.98 0.00 0.00 94 Q 9.06 4.79 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 95 L 8.41 5.34 0.00 1.44 1.23 0.29 0.53 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 96 L 9.08 5.43 0.00 1.75 1.64 0.91 0.59 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 97 N 8.91 5.09 0.00 2.95 3.12 0.00 0.00 6.74 7.60 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 98 E 8.44 3.85 0.00 1.84 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 2.27 2.23 0.00 99 Q 8.24 4.34 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.67 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 100 Q 8.31 3.68 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 6.77 0.00 0.00 0.00 0.00 0.00 1.84 2.21 0.00 101 N 8.23 4.77 0.00 2.96 2.75 0.00 0.00 6.69 7.31 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 0.00 102 Q 8.52 4.47 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 103 I 8.67 4.37 2.02 0.00 0.00 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 1.43 0.90 1.15 0.00 0.00 104 P 0.00 4.88 0.00 1.96 2.03 0.00 3.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 105 L 8.81 4.18 0.00 1.75 1.70 1.03 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 106 N 9.17 4.42 0.00 2.91 2.90 0.00 0.00 6.97 7.81 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 0.00 107 A 7.32 4.11 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 0.00 108 P 0.00 4.46 0.00 2.20 2.17 0.00 3.71 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.97 0.00 109 S 8.75 4.07 0.00 3.84 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 0.00 110 S 8.04 4.10 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 0.00 111 A 8.04 4.36 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 0.00 112 L 7.28 4.41 0.00 1.52 1.37 0.77 0.89 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 0.00 113 S 8.12 4.53 0.00 3.85 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 0.00 114 W 8.44 4.47 0.00 3.20 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 0.00 115 T 9.10 4.57 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 1.25 0.00 0.00 116 T 8.68 4.49 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 1.22 0.00 0.00 117 L 8.66 4.98 0.00 1.60 1.58 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 118 T 9.40 4.12 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 1.22 0.00 0.00 119 P 0.00 4.21 0.00 2.04 2.13 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.22 0.00 120 G 8.80 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 0.00 121 K 7.51 4.80 0.00 1.56 1.69 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.53 7.81 122 P 0.00 4.65 0.00 1.94 1.99 0.00 3.62 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 123 N 9.59 5.00 0.00 2.57 2.70 0.00 0.00 6.76 6.91 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 0.00 124 T 8.63 4.82 4.19 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 1.16 0.00 0.00 125 L 8.77 4.55 0.00 1.75 1.44 1.22 0.67 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 0.00 126 N 8.09 4.86 0.00 2.40 2.31 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 0.00 127 F 8.33 4.76 0.00 1.51 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.04 5.38 0.00 2.87 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 0.00 129 A 9.33 5.64 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 R 9.04 5.21 0.00 2.07 2.11 0.00 2.88 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 131 L 8.94 5.01 0.00 1.51 1.46 0.76 0.19 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 0.00 132 M 8.87 5.22 0.00 1.99 1.82 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 133 A 9.09 4.64 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 0.00 134 T 9.99 4.37 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 1.23 0.00 0.00 135 Q 7.84 4.51 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 136 V 8.18 4.48 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 0.72 0.00 0.00 0.91 0.00 0.00 137 P 0.00 4.48 0.00 2.03 1.96 0.00 3.66 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 138 V 8.24 3.98 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 0.82 0.00 0.00 1.03 0.00 0.00 139 T 8.50 4.69 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 0.00 140 A 8.46 4.39 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 0.00 141 G 8.51 4.17 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 0.00 142 H 8.48 4.25 0.00 3.16 3.26 0.00 5.76 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 I 8.43 4.66 1.87 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.69 0.00 0.00 144 N 8.50 5.26 0.00 2.67 2.65 0.00 0.00 6.71 7.92 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 0.00 145 A 8.42 4.86 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 0.00 146 T 8.13 4.69 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 1.27 0.00 0.00 147 A 8.19 4.87 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 148 T 9.13 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 1.21 0.00 0.00 149 F 8.89 4.76 0.00 2.65 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 0.00 150 T 8.01 4.37 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 1.06 0.00 0.00 151 L 8.23 4.59 0.00 1.33 1.22 1.03 0.95 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 0.00 152 E 8.74 4.50 0.00 1.90 1.62 0.00 0.00 0.00 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 2.32 0.00 153 Y 8.82 4.49 0.00 2.96 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 0.00 154 Q 8.90 4.30 0.00 1.42 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.55 0.00 0.00 0.00 0.00 0.00 2.11 1.70 0.00 * Residues marked with a * may have inaccurate shift predictions.