NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 56 C 4.4247 8.3444 115.6399 57.9891 31.1823 172.4192 57 S 4.5717 8.0046 116.0369 55.2196 64.2509 172.6662 58 P 4.2707 0.0000 0.0000 65.0970 32.3217 176.8806 59 G 4.1500 8.0940 105.0847 45.2599 0.0000 172.2020 60 I 4.9611 7.4867 121.7753 59.7545 38.8830 174.9987 61 W 5.0930 9.4700 126.1883 54.9721 33.5489 174.1770 62 Q 5.1994 9.1480 121.2285 54.1248 31.0183 174.4561 63 L 5.3746 8.8489 124.8292 53.5837 45.6085 174.6135 64 D 4.7553 9.1195 123.6639 53.6534 45.4016 173.1331 65 C 5.3093 8.8223 119.4487 58.3416 30.6765 172.9917 66 T 4.8146 8.7875 116.8178 60.6236 71.2488 171.7302 67 H 5.5523 8.5636 118.7454 54.2383 32.8108 173.5861 68 L 4.5057 8.7699 120.1070 55.0179 45.8923 175.6741 69 E 3.9118 9.8412 121.5095 57.4202 27.1241 175.0975 70 G 3.9611 8.4625 102.4529 46.3461 0.0000 174.2297 71 K 4.6606 8.1854 118.6681 53.9756 35.2025 175.2893 72 V 4.5968 8.1182 120.6586 60.2268 33.6493 174.3678 73 I 4.7957 8.3252 126.5276 59.2854 39.5986 174.2534 74 L 4.6190 8.7783 130.3374 53.6916 43.5504 175.2001 75 V 4.9306 8.8253 126.3432 60.9849 34.7460 173.9061 76 A 5.4775 9.3084 128.7027 50.2224 22.2179 174.8419 77 V 4.8040 9.1784 122.6825 61.2730 34.8816 174.1868 78 H 3.3626 8.9418 128.8598 54.5528 29.2217 175.4655 79 V 3.3321 7.5226 126.1569 65.9375 31.4193 177.5793 80 A 4.0080 7.3935 120.8208 54.0166 18.4314 177.9352 81 S 4.3936 7.9406 108.4939 57.7073 64.6350 175.4187 82 G 3.8887 8.0428 108.3100 44.9641 0.0000 172.8685 83 Y 4.4983 7.5410 121.7956 57.5839 39.8827 174.5989 84 I 5.6981 7.4410 117.3427 58.4056 41.4206 174.1182 85 E 4.9100 8.6456 120.2622 55.0295 33.8564 174.3615 86 A 5.2944 8.6301 123.0225 51.2602 22.6527 175.0004 87 E 4.7437 9.0171 119.3766 54.9575 33.8469 174.3211 88 V 4.4256 8.5075 126.7360 62.5952 31.2318 174.9867 89 I 4.7131 8.7121 122.2590 58.2666 39.7528 175.2314 90 P 4.3515 0.0000 0.0000 65.4527 31.4442 176.1976 91 A 4.4393 6.9894 119.3664 51.2506 22.6978 176.1760 92 E 4.1812 8.5919 123.1957 55.5353 28.8763 175.9951 93 T 4.5920 7.1690 112.2779 60.1495 73.0377 175.5940 94 G 3.5536 8.3058 107.6034 47.5458 0.0000 175.6365 95 Q 3.9795 8.0032 121.4217 59.2481 29.1141 178.2876 96 E 4.0913 8.0146 119.1242 59.6693 29.3965 179.5430 97 T 3.8746 7.9208 115.5868 66.4752 68.4926 176.6903 98 A 4.0559 8.6287 123.1685 55.2864 18.4483 179.0404 99 Y 4.1425 8.2911 118.1250 60.8143 38.8887 178.0967 100 F 3.9782 8.3863 121.6201 61.2080 39.4616 177.0720 101 L 4.0064 8.3383 118.7571 57.8598 41.5102 179.5202 102 L 4.0175 7.9442 118.8564 57.5677 41.3116 179.7205 103 K 3.7014 7.5193 117.8995 59.2655 32.0897 179.1170 104 L 3.6421 7.5329 120.1885 58.0989 41.7589 178.9194 105 A 4.0802 8.0975 119.8712 54.8865 18.3278 179.4964 106 G 3.6369 7.8878 103.5015 46.7897 0.0000 174.6681 107 R 4.0861 7.1843 115.7486 55.9602 30.8268 176.4028 108 W 5.0874 7.5154 116.4013 53.8967 32.4036 174.3586 109 P 4.5470 0.0000 0.0000 62.1793 29.1074 173.9928 110 V 4.0408 7.8742 124.2350 63.1796 32.0939 174.9242 111 K 4.4857 9.1885 129.3731 57.9804 34.2993 176.3840 112 T 5.2264 7.8358 115.4272 61.9807 73.2198 173.3248 113 V 4.9598 8.9750 119.5144 59.9371 34.9266 174.2006 114 H 5.2776 9.3797 123.2514 54.5133 30.5670 174.2812 115 T 4.8476 8.3055 111.8683 59.3822 72.7699 173.1025 116 D 4.6892 7.8275 122.3794 52.4263 40.9918 175.2082 117 N 5.0047 8.6332 114.2730 53.2344 37.8273 176.2467 118 G 3.9536 8.3045 106.0348 45.3573 0.0000 174.7818 119 S 4.2842 9.0522 118.9792 60.7606 62.2560 176.7077 120 N 4.2683 8.0509 119.9395 55.7240 36.8850 177.0582 121 F 4.6115 7.9669 118.9937 59.6754 39.6546 176.7454 122 T 4.5741 8.2632 107.8654 60.7759 69.3163 174.9886 123 S 4.4516 7.2542 117.5017 58.7560 63.8608 175.5415 124 T 3.9059 8.5835 118.7394 67.1081 68.1198 176.7995 125 T 3.8304 7.8888 114.5278 65.2473 67.4557 176.1726 126 V 3.6407 7.6904 120.2244 65.7257 31.5646 177.8491 127 K 4.0073 8.3131 119.2793 59.5865 31.9767 178.6765 128 A 4.0795 8.4627 121.1062 55.0442 18.2178 179.4270 129 A 4.0279 8.3712 119.5683 55.6496 18.4558 179.7238 130 C 4.1751 8.3416 115.2666 62.6981 28.2296 175.9274 131 E 3.9258 8.3697 120.9862 59.1291 29.1037 178.6246 132 W 4.0434 8.3907 126.9787 60.3086 30.9233 177.0386 133 A 4.3568 8.5263 117.8317 51.6336 18.4627 177.1649 134 G 3.7577 7.7537 104.6681 46.6233 0.0000 173.5820 135 I 4.6559 8.0699 120.2891 59.1296 39.2256 175.9187 136 K 4.4259 9.1413 126.9303 55.7483 33.5732 175.7058 137 Q 4.9469 8.6308 123.3404 54.3446 30.9340 174.8311 138 E 4.6753 8.4766 121.9285 54.7360 32.6752 176.6386 139 F 4.7212 8.5128 120.2009 55.3818 41.5323 176.9633 140 G 3.9816 8.1681 108.8929 44.2750 0.0000 172.7622 141 I 3.9082 8.0974 119.0815 60.4842 37.9388 173.9902 142 P 4.3210 0.0000 0.0000 62.8784 30.4991 175.4066 *151 I 4.1309 7.4497 122.1786 60.6074 40.1346 177.0777 152 E 3.5830 8.1003 117.8564 59.3561 29.1563 178.3606 153 S 4.4054 8.0200 111.2664 59.1895 62.7716 173.9513 154 M 4.4637 8.6448 119.4935 57.6139 33.5018 177.2891 155 N 4.4620 7.9394 116.4809 55.8874 38.8668 177.3136 156 K 4.0360 7.8412 120.4819 59.7252 32.8360 179.0328 157 E 3.9119 8.0514 120.0587 58.9520 29.6482 178.3410 158 L 3.9687 8.3214 120.8301 58.2026 42.2883 179.1367 159 K 3.9827 8.0424 118.0735 58.9245 31.8599 179.4301 160 K 3.9337 7.8319 119.7695 59.7004 32.2391 179.0247 161 I 4.0300 7.6860 121.4167 63.9622 36.8384 178.5641 162 I 3.8964 8.1835 121.0745 64.0954 36.6256 178.7960 163 G 3.5758 7.7230 105.7102 47.8879 0.0000 175.4071 164 Q 4.2111 8.2872 120.7781 58.0962 28.6700 178.5626 165 V 4.4026 7.6311 110.5674 60.8490 31.9035 177.4143 166 R 3.8370 7.6963 121.0885 59.4275 29.8767 176.8790 167 D 4.6351 7.9488 113.8791 53.9439 39.7972 176.5896 168 Q 4.2289 8.2283 118.4710 56.8286 29.1453 175.2131 169 A 4.6213 7.2348 119.1413 50.7913 22.1310 175.9646 170 E 4.0153 8.7339 120.7549 58.5419 30.3913 177.4224 171 H 5.0100 7.6533 114.8140 53.5806 32.2638 175.1875 172 L 3.9931 8.4904 125.8135 58.2737 41.8403 179.4342 173 K 3.9333 8.1634 118.1997 60.5070 32.2584 179.1210 174 T 3.8962 7.8987 115.9504 66.3719 68.4871 176.4597 175 A 4.0271 7.9178 122.3919 55.0777 18.3119 179.7893 176 V 3.5567 8.1795 117.1072 66.4365 31.5756 178.3922 177 Q 4.0862 7.9395 117.8167 59.1855 28.4471 178.5873 178 M 4.0476 8.2637 119.6143 58.3530 31.9034 178.6843 179 A 4.0637 8.4613 121.3734 55.0143 18.4333 179.9031 180 V 3.5485 8.0154 116.9508 65.9740 31.6368 177.8733 181 F 4.0548 8.5046 120.4929 61.5310 39.3365 176.9696 182 I 3.8757 8.4042 119.6460 64.7597 36.7315 177.8039 183 H 4.0341 8.3625 117.8769 59.5951 30.0795 176.9165 184 N 4.4989 8.5510 118.1708 55.6578 38.1150 177.0999 185 K 4.0865 7.7392 118.5609 56.5098 32.6606 177.3521 186 K 4.0164 7.5474 121.1552 56.4830 32.8493 175.5474 187 R 4.6268 8.1765 123.7094 53.6380 32.5560 175.3446 188 K 3.9797 8.5740 122.7928 58.0041 32.2384 176.7801 189 G 3.7840 9.1985 113.8931 45.3606 0.0000 173.6761 190 G 4.1388 8.4398 105.5874 45.7577 0.0000 174.1462 191 I 4.2436 7.1516 119.2545 60.0817 40.0778 176.6712 192 G 3.7170 9.3140 116.4233 45.1611 0.0000 172.3260 193 G 3.8491 8.3801 107.2152 45.0194 0.0000 172.2355 194 Y 5.0442 8.6584 114.8081 55.8345 40.0085 176.1620 195 S 4.9170 8.6906 118.2712 56.3025 66.4796 175.1251 196 A 4.0966 8.4453 123.6945 55.2883 17.6445 180.1509 197 G 3.7578 8.3797 104.2918 47.8935 0.0000 175.6926 198 E 3.9907 8.1300 120.2716 59.0009 29.7091 179.2827 199 R 3.8197 8.3822 118.6464 58.9966 30.0275 178.9818 200 I 3.3869 7.6660 118.4536 64.1579 37.8798 178.4922 201 V 3.7407 7.2728 112.9210 64.2101 31.2503 178.2070 202 D 4.2750 7.9573 117.5514 57.2976 41.1408 178.3460 203 I 3.6329 7.6688 120.2335 64.5757 37.1460 178.6167 204 I 3.7805 7.9157 120.4713 64.1193 36.6631 178.4811 205 A 4.0162 8.1121 121.4439 55.4047 18.3885 179.6517 206 T 3.9702 7.8854 106.8125 64.4764 68.9898 175.9634 207 D 4.4925 7.8916 121.2848 56.8312 41.1412 177.4993 208 I 4.0850 7.6294 111.1528 62.2422 37.5803 175.9256 209 Q 4.0699 7.7488 124.5723 56.6971 28.6291 174.4101 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 56 C 8.34 4.42 0.00 2.98 2.91 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 57 S 8.00 4.57 0.00 3.90 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 58 P 0.00 4.27 0.00 2.10 2.12 0.00 3.71 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 2.35 2.07 0.00 59 G 8.09 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 60 I 7.49 4.96 1.79 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 1.28 1.00 0.92 0.00 0.00 61 W 9.47 5.09 0.00 3.23 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 62 Q 9.15 5.20 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.20 0.00 63 L 8.85 5.37 0.00 1.77 1.36 1.27 1.20 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 64 D 9.12 4.76 0.00 2.77 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 65 C 8.82 5.31 0.00 2.95 2.77 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 66 T 8.79 4.81 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 1.19 0.00 0.00 67 H 8.56 5.55 0.00 3.02 3.14 0.00 5.77 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.77 4.51 0.00 1.68 1.51 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 69 E 9.84 3.91 0.00 2.09 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 2.23 2.29 0.00 70 G 8.46 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 71 K 8.19 4.66 0.00 1.89 1.68 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.55 1.49 7.81 72 V 8.12 4.60 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 0.98 0.00 0.00 0.82 0.00 0.00 73 I 8.33 4.80 1.83 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 1.10 0.75 0.89 0.00 0.00 74 L 8.78 4.62 0.00 1.39 0.85 0.86 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.83 4.93 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 0.95 0.00 0.00 76 A 9.31 5.48 1.66 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 77 V 9.18 4.80 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 0.93 0.00 0.00 78 H 8.94 3.36 0.00 1.40 2.53 0.00 5.68 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.52 3.33 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 0.66 0.00 0.00 0.84 0.00 0.00 80 A 7.39 4.01 1.11 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 81 S 7.94 4.39 0.00 3.88 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 82 G 8.04 3.89 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 0.00 0.00 0.00 83 Y 7.54 4.50 0.00 3.05 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.44 5.70 1.88 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 1.03 0.78 0.80 0.00 0.00 85 E 8.65 4.91 0.00 2.11 1.94 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 2.50 2.71 0.00 86 A 8.63 5.29 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 87 E 9.02 4.74 0.00 2.26 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 2.32 2.34 0.00 88 V 8.51 4.43 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 0.86 0.00 0.00 0.94 0.00 0.00 89 I 8.71 4.71 1.88 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 1.38 0.80 0.92 0.00 0.00 90 P 0.00 4.35 0.00 2.18 2.22 0.00 3.94 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 1.97 1.95 0.00 91 A 6.99 4.44 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 92 E 8.59 4.18 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 2.19 2.19 0.00 93 T 7.17 4.59 4.21 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 1.18 0.00 0.00 94 G 8.31 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.00 3.98 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 96 E 8.01 4.09 0.00 2.05 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 2.31 2.61 0.00 97 T 7.92 3.87 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 1.08 0.00 0.00 98 A 8.63 4.06 1.42 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 0.00 0.00 99 Y 8.29 4.14 0.00 3.14 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 0.00 100 F 8.39 3.98 0.00 3.27 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 0.00 101 L 8.34 4.01 0.00 1.96 1.75 1.04 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.94 4.02 0.00 1.74 1.61 0.79 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 103 K 7.52 3.70 0.00 1.62 1.47 0.00 1.20 0.00 0.00 0.62 0.00 0.00 2.59 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.21 1.13 7.81 104 L 7.53 3.64 0.00 1.31 1.51 0.43 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 105 A 8.10 4.08 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 0.00 106 G 7.89 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.18 4.09 0.00 1.22 1.69 0.00 3.03 0.00 0.00 2.99 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.28 0.00 108 W 7.52 5.09 0.00 3.25 3.27 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 0.00 109 P 0.00 4.55 0.00 2.28 2.18 0.00 4.20 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.09 0.00 110 V 7.87 4.04 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 0.70 0.00 0.00 0.59 0.00 0.00 111 K 9.19 4.49 0.00 2.00 1.83 0.00 1.55 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.47 7.81 112 T 7.84 5.23 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 1.21 0.00 0.00 113 V 8.98 4.96 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 0.87 0.00 0.00 0.95 0.00 0.00 114 H 9.38 5.28 0.00 3.03 3.14 0.00 5.78 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.31 4.85 2.70 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 0.90 0.00 0.00 116 D 7.83 4.69 0.00 2.83 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 0.00 117 N 8.63 5.00 0.00 2.81 3.00 0.00 0.00 5.95 7.01 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 0.00 118 G 8.30 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 0.00 119 S 9.05 4.28 0.00 4.06 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 0.00 120 N 8.05 4.27 0.00 2.77 3.15 0.00 0.00 5.19 7.37 0.00 0.00 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 F 7.97 4.61 0.00 3.48 3.29 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 0.00 122 T 8.26 4.57 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 1.20 0.00 0.00 123 S 7.25 4.45 0.00 4.02 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 0.00 124 T 8.58 3.91 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 1.24 0.00 0.00 125 T 7.89 3.83 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 1.26 0.00 0.00 126 V 7.69 3.64 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 1.10 0.00 0.00 1.04 0.00 0.00 127 K 8.31 4.01 0.00 2.11 2.07 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.56 7.81 128 A 8.46 4.08 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 0.00 0.00 129 A 8.37 4.03 1.44 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 0.00 0.00 130 C 8.34 4.18 0.00 3.26 3.29 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 0.00 131 E 8.37 3.93 0.00 2.34 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 2.36 2.52 0.00 132 W 8.39 4.04 0.00 3.41 3.41 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 0.00 133 A 8.53 4.36 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.75 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 0.00 135 I 8.07 4.66 1.91 0.00 0.00 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 1.43 0.86 0.93 0.00 0.00 136 K 9.14 4.43 0.00 1.78 1.72 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.43 7.81 137 Q 8.63 4.95 0.00 1.94 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.82 0.00 0.00 0.00 0.00 0.00 2.16 2.37 0.00 138 E 8.48 4.68 0.00 1.40 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 139 F 8.51 4.72 0.00 2.95 3.06 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 0.00 0.00 0.00 0.00 140 G 8.17 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 0.00 141 I 8.10 3.91 1.89 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 1.43 0.60 0.92 0.00 0.00 142 P 0.00 4.32 0.00 2.04 2.07 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 *151 I 7.45 4.13 1.84 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 1.46 1.35 0.88 0.00 0.00 152 E 8.10 3.58 0.00 2.15 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 0.00 2.37 2.28 0.00 153 S 8.02 4.41 0.00 3.84 3.89 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 0.00 154 M 8.64 4.46 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 155 N 7.94 4.46 0.00 2.99 2.85 0.00 0.00 7.00 6.92 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 0.00 156 K 7.84 4.04 0.00 1.93 2.06 0.00 1.32 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.59 7.81 157 E 8.05 3.91 0.00 2.11 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 0.00 2.45 2.48 0.00 158 L 8.32 3.97 0.00 1.86 1.64 0.91 0.74 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 0.00 159 K 8.04 3.98 0.00 2.12 1.85 0.00 1.73 0.00 0.00 1.58 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.56 7.81 160 K 7.83 3.93 0.00 2.00 2.00 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 161 I 7.69 4.03 1.91 0.00 0.00 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 1.57 1.05 0.96 0.00 0.00 162 I 8.18 3.90 2.02 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 1.48 1.62 0.93 0.00 0.00 163 G 7.72 3.58 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 0.00 0.00 0.00 164 Q 8.29 4.21 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 165 V 7.63 4.40 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 0.82 0.00 0.00 0.95 0.00 0.00 166 R 7.70 3.84 0.00 1.97 1.99 0.00 3.31 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 167 D 7.95 4.64 0.00 2.82 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 0.00 168 Q 8.23 4.23 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 169 A 7.23 4.62 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 0.00 170 E 8.73 4.02 0.00 1.84 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 2.07 2.23 0.00 171 H 7.65 5.01 0.00 3.27 3.18 0.00 5.88 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 8.49 3.99 0.00 1.92 1.69 1.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 173 K 8.16 3.93 0.00 2.05 2.09 0.00 1.52 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.57 7.81 174 T 7.90 3.90 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 1.23 0.00 0.00 175 A 7.92 4.03 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 0.00 176 V 8.18 3.56 2.30 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 1.06 0.00 0.00 0.99 0.00 0.00 177 Q 7.94 4.09 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.65 0.00 0.00 0.00 0.00 0.00 2.66 2.60 0.00 178 M 8.26 4.05 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.48 0.00 179 A 8.46 4.06 1.41 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 0.00 180 V 8.02 3.55 2.30 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 1.09 0.00 0.00 0.99 0.00 0.00 181 F 8.50 4.05 0.00 3.25 3.23 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 0.00 182 I 8.40 3.88 2.11 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 1.56 1.23 0.98 0.00 0.00 183 H 8.36 4.03 0.00 3.22 3.49 0.00 5.75 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 N 8.55 4.50 0.00 2.73 2.93 0.00 0.00 6.87 8.04 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 0.00 185 K 7.74 4.09 0.00 1.64 1.74 0.00 1.47 0.00 0.00 1.39 0.00 0.00 2.37 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 0.58 7.81 186 K 7.55 4.02 0.00 1.90 1.83 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.41 7.81 187 R 8.18 4.63 0.00 1.87 2.00 0.00 3.16 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 188 K 8.57 3.98 0.00 1.72 1.75 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.45 7.81 189 G 9.20 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 0.00 0.00 0.00 190 G 8.44 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 0.00 191 I 7.15 4.24 1.87 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 0.64 0.90 0.00 0.00 192 G 9.31 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 0.00 193 G 8.38 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 0.00 194 Y 8.66 5.04 0.00 2.87 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 0.00 195 S 8.69 4.92 0.00 4.26 4.06 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 0.00 0.00 0.00 0.00 196 A 8.45 4.10 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 8.38 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 0.00 198 E 8.13 3.99 0.00 2.43 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 0.00 2.37 2.39 0.00 199 R 8.38 3.82 0.00 1.93 1.88 0.00 3.04 0.00 0.00 3.05 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.82 0.00 200 I 7.67 3.39 1.36 0.00 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.48 0.29 0.00 0.00 201 V 7.27 3.74 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 0.94 0.00 0.00 1.01 0.00 0.00 202 D 7.96 4.28 0.00 2.85 2.74 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 0.00 203 I 7.67 3.63 1.81 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 1.43 0.80 0.86 0.00 0.00 204 I 7.92 3.78 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.60 1.03 0.00 0.00 205 A 8.11 4.02 1.41 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 0.00 206 T 7.89 3.97 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 1.29 0.00 0.00 207 D 7.89 4.49 0.00 3.02 2.85 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 0.00 208 I 7.63 4.09 1.88 0.00 0.00 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 1.83 0.72 1.04 0.00 0.00 209 Q 7.75 4.07 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 * Residues marked with a * may have inaccurate shift predictions.