NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 G 3.9505 8.3549 109.7413 44.9110 0.0000 173.7888 19 N 4.1917 8.3248 116.7921 52.3595 39.1072 172.4830 20 P 4.4565 0.0000 0.0000 62.9024 33.5885 174.8447 21 V 4.8182 8.3979 122.3757 61.3223 34.3077 174.7259 22 V 4.8827 8.9346 120.3080 59.8261 36.2271 173.7765 23 Y 5.2833 8.7163 118.6163 55.7010 41.8737 173.9017 24 F 5.7312 9.2062 119.2560 56.0823 42.5937 173.9178 25 D 5.4739 9.7158 123.7667 53.0301 43.0516 175.4817 26 I 5.2165 8.7632 123.6186 59.4707 40.5567 174.6793 27 S 5.2803 9.0120 120.2142 56.5878 66.3499 172.8848 28 I 4.7755 8.7336 123.1554 59.8082 40.0913 176.1235 29 G 4.0856 9.6471 118.0090 47.2403 0.0000 172.9378 30 Q 3.5481 8.3012 111.0788 56.6068 26.9194 173.7032 31 T 4.5735 7.7089 114.7457 60.7621 70.3197 172.4404 32 P 4.5899 0.0000 0.0000 63.1529 31.6464 175.9512 33 A 4.4965 9.2295 124.9952 51.1052 20.3199 174.8181 34 G 3.7338 8.0484 101.2826 44.0203 0.0000 171.9838 35 R 5.2065 8.4929 117.8742 54.5496 32.8597 174.6658 36 I 4.8816 9.0599 127.2678 59.7765 39.7566 174.4134 37 T 5.0044 8.8600 117.9984 60.1743 71.1734 173.3060 38 M 5.0558 9.0724 125.0335 53.2982 35.8315 174.2235 39 E 4.6976 8.8532 124.2809 55.4260 31.4531 174.7077 40 L 4.5934 8.3372 126.7348 52.2119 43.6640 177.7729 41 F 4.8847 8.3609 125.6265 56.7890 37.7980 176.8619 42 A 4.3010 8.0060 124.4029 55.0848 19.0271 179.1766 43 D 4.5779 8.3885 114.9593 55.4953 39.5759 177.3856 44 K 4.5416 8.2350 116.4419 56.2466 35.1256 176.4061 45 V 4.6977 8.3658 112.0036 58.5028 32.2138 174.4735 46 P 4.3457 0.0000 0.0000 66.0740 31.6312 178.8039 47 I 3.6992 8.3130 119.4200 64.5505 36.5737 178.5793 48 T 4.1096 8.4096 116.4050 66.5688 68.1823 176.8166 49 A 4.1157 8.3606 123.0124 55.0573 18.4423 179.3329 50 E 3.9049 8.2076 117.5223 58.9921 29.6852 178.2050 51 N 3.8799 7.9459 116.9386 56.6768 38.9199 176.5987 52 F 4.0050 7.8312 120.8787 61.3023 39.6308 176.8885 53 R 3.9211 8.4719 118.5326 59.4439 29.7348 178.2664 54 A 3.8472 7.9395 120.2764 55.2619 18.3757 179.7091 55 L 3.6418 7.5984 117.0816 57.5238 41.1676 179.7153 56 C 4.1547 7.5177 116.7216 62.9005 28.2178 175.7145 57 T 4.0632 7.5957 110.2380 62.5211 68.5415 175.6659 58 G 3.9321 7.9863 108.4264 45.1864 0.0000 174.4100 59 E 4.0348 7.8402 120.4538 58.5746 29.7333 177.7273 60 K 4.4798 7.9428 117.9153 57.4154 33.9736 179.9694 61 G 3.6577 7.5766 111.7083 46.7913 0.0000 177.5298 62 M 4.5631 8.8195 119.8116 53.7109 33.7271 174.7055 63 G 4.5742 7.7440 107.2690 42.3594 0.0000 174.0140 64 Q 4.1462 8.6950 117.6573 58.7470 28.7735 178.6409 65 S 4.2055 7.9446 110.8239 60.2593 63.3027 174.0561 66 G 3.7124 7.0067 111.1213 45.3571 0.0000 174.3518 67 K 4.5097 7.6549 118.0448 53.7728 33.8941 174.4700 68 P 4.4228 0.0000 0.0000 62.8188 32.1221 177.4845 69 L 3.8596 8.0332 121.8704 52.8407 40.0052 175.3339 70 C 4.5921 6.0119 118.9041 57.8136 35.1274 173.4336 71 Y 4.4594 8.4418 123.0379 60.4469 37.9645 176.4853 72 T 4.0376 7.6504 116.4106 65.2482 68.7274 174.3545 73 G 3.7503 9.3449 116.0035 45.0150 0.0000 173.6082 74 S 4.4390 7.6473 114.6819 57.3108 64.4611 172.8860 75 F 5.2162 8.2147 118.2796 55.4979 41.8946 175.8570 76 F 4.3576 9.0999 122.5728 57.1587 37.6339 175.6091 77 H 4.6906 8.5156 121.6954 56.7282 29.7682 175.5200 78 R 4.7635 7.7260 120.2788 54.9523 33.7171 173.7712 79 I 4.9589 9.0521 127.1811 59.7889 41.4614 174.3279 80 I 4.9056 8.5589 128.1899 58.6166 38.5610 173.8755 81 P 4.4710 0.0000 0.0000 64.0408 31.7478 176.4485 82 Q 3.6894 9.2584 119.3205 56.8391 26.3739 174.3422 83 F 5.3421 6.9908 117.0158 57.8527 42.2887 174.1091 84 M 4.8118 8.1258 112.7262 54.6911 35.4252 173.0611 85 I 4.8155 8.4238 113.1027 59.0477 40.2914 174.1902 86 Q 4.8317 9.3581 127.2936 54.3057 31.7317 173.5388 87 G 3.3909 7.6432 115.0700 47.4610 0.0000 173.9962 88 G 4.5557 8.8445 109.5887 46.8084 0.0000 173.6677 89 D 4.4155 7.6458 120.1950 53.5364 39.3774 175.3250 90 F 4.8455 7.5112 115.3750 56.2604 38.3811 177.2570 91 T 4.6361 7.6963 110.0390 62.0745 69.8158 175.1394 92 R 4.4147 8.9675 115.6362 56.2102 32.4966 175.4607 93 G 4.1537 8.3229 105.7730 46.5447 0.0000 173.7601 94 D 4.6605 8.0814 113.7686 52.1649 40.2860 176.5887 95 G 3.9511 8.6552 109.1809 45.3466 0.0000 174.4223 96 T 4.3772 7.6642 108.2740 61.4956 70.1698 175.3916 97 G 4.1245 8.0043 112.3245 46.8115 0.0000 173.5205 98 G 3.6949 10.3977 107.9164 47.0198 0.0000 172.5009 99 E 4.6691 7.3079 116.7534 54.3259 32.2325 175.2445 100 S 4.9044 8.5791 116.2174 57.7136 64.1167 174.8040 101 I 3.7569 8.5226 114.0718 62.5216 37.1755 176.1603 102 Y 4.5657 7.3435 118.0057 57.8563 37.9372 176.1890 103 G 3.7909 7.6858 106.9118 45.8038 0.0000 173.6620 *105 K 4.6672 7.6671 117.2965 56.7327 34.0413 174.2750 106 F 5.2114 9.1352 115.6352 55.0582 42.0101 173.9192 107 R 4.4543 8.7271 117.7928 55.6268 30.9114 176.4849 108 D 4.1691 8.9417 122.8270 54.7634 40.7864 176.5941 109 E 3.9711 8.7123 125.6785 58.0041 29.8998 176.1684 110 N 4.4477 6.9349 111.7121 52.5739 39.6253 173.2241 111 F 5.1402 8.1705 115.0552 57.0702 40.1914 176.8304 112 V 3.6245 8.3785 122.4217 65.5648 31.6091 175.5011 113 Y 4.7412 7.8325 115.9375 56.5082 39.3982 175.2053 114 T 4.6272 8.3274 113.7384 60.7293 71.7358 174.8670 115 H 4.5943 9.5503 121.1995 54.7146 27.1579 176.0947 116 D 4.7511 7.7315 116.0433 53.2686 40.6768 176.7493 117 A 4.6532 7.3212 121.3914 49.9907 22.1458 174.1692 118 P 4.1299 0.0000 0.0000 63.9449 32.0909 176.3110 119 F 4.1113 8.7030 116.6630 58.2061 36.8328 174.4786 120 L 4.5905 7.6351 121.1701 54.1964 43.0655 175.8078 121 L 4.4985 8.0556 123.7025 53.5637 43.1284 175.7956 122 S 4.9076 8.0525 117.2431 56.7211 66.5933 172.3466 123 M 5.0497 8.9115 123.7344 54.8074 32.4216 176.5849 124 A 4.7960 8.9165 125.6069 52.3506 19.8206 175.9693 125 N 4.7259 8.4653 115.1609 52.6849 39.8661 173.8228 126 A 4.6485 8.9481 120.2207 52.3809 19.2724 174.7871 127 G 3.7404 8.1204 105.8021 44.4413 0.0000 172.3887 128 P 4.3681 0.0000 0.0000 64.3001 31.9780 176.4627 129 N 4.3082 9.4352 119.6381 55.0004 36.3960 174.3107 130 T 4.7110 7.3131 99.9421 61.2643 70.0545 174.1552 131 N 4.4681 8.0032 120.2582 54.1016 40.6782 173.3966 132 G 4.2039 9.1652 108.3099 45.7677 0.0000 173.2950 133 S 4.9145 9.1921 121.0901 57.6233 65.1168 174.5365 134 Q 4.7642 8.0899 121.5180 56.1034 30.0486 175.0286 135 F 5.5520 8.7496 117.5276 55.7259 42.4921 172.7994 136 F 5.4964 9.5924 113.0250 55.3938 41.7636 173.4530 137 I 5.0984 8.8571 121.1761 59.7163 39.6802 175.6176 138 T 4.6840 8.8701 118.0721 61.8999 70.0433 175.0810 139 T 4.1902 8.8485 112.0041 61.5522 69.8860 173.7028 140 V 4.5824 7.4704 113.8438 59.0256 36.2777 172.9951 141 P 4.3681 0.0000 0.0000 62.3353 31.8957 176.9996 142 C 2.8533 8.1417 120.6545 57.3403 28.5402 173.9276 143 P 4.6237 0.0000 0.0000 64.4944 31.4104 178.6570 144 W 4.3861 7.9166 114.7895 58.2455 28.2206 176.4338 145 L 4.4445 7.5728 119.2010 54.7377 41.5439 176.1726 146 D 4.4711 7.7216 121.0941 55.6941 41.0880 177.2349 147 G 3.2528 9.0718 111.1619 45.3625 0.0000 173.9260 148 K 4.3990 7.4301 116.3891 55.4753 34.7550 176.3314 149 H 5.0247 8.1179 114.8068 53.7966 32.4742 172.8967 150 V 4.1281 8.6909 124.2570 62.3868 32.2275 175.0091 151 V 4.3274 8.6112 129.4247 62.8125 32.1318 175.5737 152 F 5.0087 8.6111 120.1287 56.0048 40.6766 173.8321 153 G 2.6247 6.4907 105.8867 46.0685 0.0000 172.1135 154 K 4.8904 7.4289 117.4201 55.1770 36.2181 175.6332 155 V 3.9140 8.7139 122.9722 63.3982 31.4700 175.4317 156 L 4.5108 9.2700 128.5139 56.1466 43.1090 176.6088 157 E 4.4426 8.1633 116.3456 55.1721 34.6108 176.3871 158 G 4.1642 8.6021 107.6717 47.8861 0.0000 175.4648 159 M 3.4176 7.8336 121.8158 58.1885 31.6775 178.3546 160 E 4.0469 7.9610 117.8656 59.0457 29.6066 179.3766 161 V 3.6253 7.5403 118.3128 65.7449 31.6052 177.9664 162 V 3.5726 7.8121 118.1397 66.0526 31.4570 178.2111 163 K 4.0599 8.3411 118.1756 59.4378 31.6151 179.5678 164 S 4.1439 7.9249 114.7651 61.6607 62.9884 176.4267 165 I 3.7789 7.8646 122.5365 64.3235 36.6637 177.9414 166 E 3.8863 8.4577 120.4273 59.3918 29.1906 179.0346 167 K 4.0684 7.7832 116.6965 59.0454 32.3374 177.4601 168 C 4.3894 8.2927 116.2143 59.9583 28.2039 173.5155 169 G 4.1754 7.4327 110.4501 44.1950 0.0000 172.5733 170 S 4.6842 8.1515 111.9466 56.7232 66.1089 175.1658 171 Q 3.9739 8.6657 119.7048 58.7411 28.4235 177.4221 172 N 4.5732 8.1393 112.5359 52.7766 38.0383 175.7242 173 G 3.9951 8.4065 109.3179 45.3481 0.0000 173.8685 174 K 4.2340 7.6779 119.1335 55.8419 32.2726 175.2104 175 P 4.6806 0.0000 0.0000 62.8879 31.8119 176.5426 176 T 4.3689 8.7838 112.1088 62.1762 69.6503 174.8095 177 K 4.7440 7.5064 120.1922 54.3710 36.5300 175.8398 178 S 4.2764 8.7056 118.0662 58.3558 63.7766 172.7570 179 V 4.8942 8.8237 127.0365 61.5344 33.7653 173.3550 180 C 4.9502 9.1035 128.8630 57.4206 34.8280 173.0249 181 I 4.5587 8.4075 127.5986 61.1749 36.7713 176.3549 182 T 4.2172 9.0448 118.5012 62.6796 69.8324 174.8367 183 A 4.8353 7.7723 122.8528 51.1292 22.6751 175.2619 184 S 5.0230 7.8136 112.9464 56.2786 66.6963 174.7035 185 G 3.6008 6.9500 105.8819 45.5430 0.0000 173.6172 186 V 4.5283 8.0033 114.2120 60.8463 31.8878 175.6331 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 18 G 8.35 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 19 N 8.32 4.19 0.00 2.88 2.99 0.00 0.00 7.11 7.13 0.00 0.00 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 P 0.00 4.46 0.00 2.10 2.00 0.00 3.81 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.12 0.00 21 V 8.40 4.82 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 1.07 0.00 0.00 0.93 0.00 0.00 22 V 8.93 4.88 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 0.70 0.00 0.00 1.00 0.00 0.00 23 Y 8.72 5.28 0.00 3.13 2.94 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 0.00 24 F 9.21 5.73 0.00 3.06 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 25 D 9.72 5.47 0.00 2.78 2.68 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 0.00 26 I 8.76 5.22 1.93 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.29 0.95 0.00 0.00 27 S 9.01 5.28 0.00 3.97 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 28 I 8.73 4.78 1.90 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 1.19 0.72 0.94 0.00 0.00 29 G 9.65 4.09 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 0.00 0.00 0.00 30 Q 8.30 3.55 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 31 T 7.71 4.57 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 1.23 0.00 0.00 32 P 0.00 4.59 0.00 2.06 2.03 0.00 3.64 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 2.05 2.12 0.00 33 A 9.23 4.50 1.28 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 0.00 0.00 34 G 8.05 3.73 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 0.00 0.00 0.00 35 R 8.49 5.21 0.00 2.06 1.77 0.00 2.98 0.00 0.00 2.96 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.98 0.00 36 I 9.06 4.88 2.03 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.68 0.92 0.00 0.00 37 T 8.86 5.00 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 1.18 0.00 0.00 38 M 9.07 5.06 0.00 1.58 1.73 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.21 0.00 39 E 8.85 4.70 0.00 2.01 1.73 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 2.32 2.33 0.00 40 L 8.34 4.59 0.00 1.57 1.60 1.15 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.36 4.88 0.00 3.09 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 42 A 8.01 4.30 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.39 4.58 0.00 2.86 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 44 K 8.24 4.54 0.00 1.94 1.80 0.00 1.62 0.00 0.00 1.48 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.39 7.81 45 V 8.37 4.70 2.31 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 0.93 0.00 0.00 1.37 0.00 0.00 46 P 0.00 4.35 0.00 2.27 2.46 0.00 3.85 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.08 0.00 47 I 8.31 3.70 2.09 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.86 0.49 0.00 0.00 48 T 8.41 4.11 4.34 0.00 0.00 0.00 0.00 0.00 0.00 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 49 A 8.36 4.12 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 50 E 8.21 3.90 0.00 2.21 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 0.00 2.35 2.34 0.00 51 N 7.95 3.88 0.00 2.65 2.96 0.00 0.00 6.80 7.24 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 52 F 7.83 4.00 0.00 3.07 3.19 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 53 R 8.47 3.92 0.00 2.06 1.94 0.00 3.16 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 54 A 7.94 3.85 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 55 L 7.60 3.64 0.00 1.06 0.36 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 56 C 7.52 4.15 0.00 3.06 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 57 T 7.60 4.06 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 1.22 0.00 0.00 58 G 7.99 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 59 E 7.84 4.03 0.00 2.08 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 2.20 2.20 0.00 60 K 7.94 4.48 0.00 1.64 1.77 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.23 7.81 61 G 7.58 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.82 4.56 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 63 G 7.74 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.70 4.15 0.00 2.27 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.05 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 65 S 7.94 4.21 0.00 4.05 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 66 G 7.01 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 67 K 7.65 4.51 0.00 2.10 1.78 0.00 1.63 0.00 0.00 1.74 0.00 0.00 3.22 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.48 7.81 68 P 0.00 4.42 0.00 1.82 1.85 0.00 3.58 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 1.93 2.03 0.00 69 L 8.03 3.86 0.00 1.49 1.38 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 70 C 6.01 4.59 0.00 2.57 2.42 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 0.00 71 Y 8.44 4.46 0.00 2.97 2.59 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 72 T 7.65 4.04 4.13 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 73 G 9.34 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 7.65 4.44 0.00 4.08 4.13 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.21 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0.00 0.00 0.00 1.10 0.00 0.00 92 R 8.97 4.41 0.00 1.95 2.11 0.00 2.89 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.76 0.00 93 G 8.32 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 94 D 8.08 4.66 0.00 2.75 2.68 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 0.00 95 G 8.66 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 96 T 7.66 4.38 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 G 8.00 4.12 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 0.00 0.00 0.00 98 G 10.40 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 99 E 7.31 4.67 0.00 2.12 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 0.00 2.39 2.43 0.00 100 S 8.58 4.90 0.00 4.22 4.60 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 0.00 101 I 8.52 3.76 1.54 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 -0.36 0.73 0.00 0.00 102 Y 7.34 4.57 0.00 2.93 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 0.00 103 G 7.69 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 *105 K 7.67 4.67 0.00 1.94 1.92 0.00 1.57 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.41 7.81 106 F 9.14 5.21 0.00 3.02 3.20 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 0.00 107 R 8.73 4.45 0.00 2.04 1.92 0.00 3.34 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.23 0.00 108 D 8.94 4.17 0.00 2.70 2.33 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 0.00 109 E 8.71 3.97 0.00 1.99 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 2.28 2.30 0.00 110 N 6.93 4.45 0.00 2.72 2.68 0.00 0.00 5.78 7.43 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 0.00 111 F 8.17 5.14 0.00 3.07 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 0.00 112 V 8.38 3.62 1.93 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 0.14 0.00 0.00 0.86 0.00 0.00 113 Y 7.83 4.74 0.00 3.09 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 0.00 114 T 8.33 4.63 4.43 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 1.26 0.00 0.00 115 H 9.55 4.59 0.00 3.13 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 7.73 4.75 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 0.00 117 A 7.32 4.65 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 4.62 0.00 2.27 2.33 0.00 3.66 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 2.33 2.02 0.00 144 W 7.92 4.39 0.00 3.37 3.33 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 0.00 145 L 7.57 4.44 0.00 1.29 1.65 0.89 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 146 D 7.72 4.47 0.00 2.85 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 0.00 147 G 9.07 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 0.00 0.00 0.00 148 K 7.43 4.40 0.00 1.73 1.71 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.24 7.81 149 H 8.12 5.02 0.00 3.46 3.72 0.00 5.70 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 8.69 4.13 2.20 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 1.05 0.00 0.00 0.85 0.00 0.00 151 V 8.61 4.33 2.36 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 0.85 0.00 0.00 0.66 0.00 0.00 152 F 8.61 5.01 0.00 3.09 3.19 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 0.00 153 G 6.49 2.62 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 0.00 0.00 0.00 0.00 0.00 0.00 154 K 7.43 4.89 0.00 1.86 1.83 0.00 1.37 0.00 0.00 1.74 0.00 0.00 3.28 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.36 7.81 155 V 8.71 3.91 1.99 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 0.67 0.00 0.00 0.97 0.00 0.00 156 L 9.27 4.51 0.00 1.54 1.64 0.86 0.80 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 0.00 157 E 8.16 4.44 0.00 1.86 1.70 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 2.17 2.23 0.00 158 G 8.60 4.16 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 0.00 0.00 0.00 159 M 7.83 3.42 0.00 0.87 1.67 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.75 0.00 160 E 7.96 4.05 0.00 1.94 1.99 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 2.37 2.30 0.00 161 V 7.54 3.63 2.24 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 1.12 0.00 0.00 1.07 0.00 0.00 162 V 7.81 3.57 2.47 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 1.25 0.00 0.00 1.04 0.00 0.00 163 K 8.34 4.06 0.00 2.06 1.91 0.00 1.97 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.92 1.77 7.81 164 S 7.92 4.14 0.00 4.04 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 0.00 165 I 7.86 3.78 1.80 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.69 0.52 0.00 0.00 166 E 8.46 3.89 0.00 2.16 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 2.33 2.37 0.00 167 K 7.78 4.07 0.00 2.00 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.70 7.81 168 C 8.29 4.39 0.00 3.15 2.96 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 0.00 169 G 7.43 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 0.00 0.00 0.00 0.00 170 S 8.15 4.68 0.00 4.00 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 0.00 171 Q 8.67 3.97 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.05 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 172 N 8.14 4.57 0.00 2.81 2.92 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 0.00 173 G 8.41 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 0.00 174 K 7.68 4.23 0.00 1.86 1.79 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.54 7.81 175 P 0.00 4.68 0.00 2.13 2.02 0.00 3.67 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 176 T 8.78 4.37 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 0.00 177 K 7.51 4.74 0.00 1.60 1.72 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.49 7.81 178 S 8.71 4.28 0.00 3.86 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 0.00 179 V 8.82 4.89 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 1.09 0.00 0.00 1.06 0.00 0.00 180 C 9.10 4.95 0.00 3.07 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 0.00 181 I 8.41 4.56 1.71 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.48 0.66 0.00 0.00 182 T 9.04 4.22 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 1.21 0.00 0.00 183 A 7.77 4.84 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 S 7.81 5.02 0.00 4.01 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 0.00 185 G 6.95 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 0.00 186 V 8.00 4.53 2.13 0.00 0.00 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 0.97 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.