NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.7025 8.3349 116.7453 58.2092 64.5200 173.0909 2 K 3.9189 8.5343 123.1026 55.8267 33.2385 174.7561 3 R 4.6979 8.2112 122.8033 54.6649 34.5435 173.8246 4 Y 4.8561 8.4219 119.7021 56.1898 42.6585 173.8441 5 F 5.3166 9.5154 125.5593 56.6763 42.0268 174.3173 6 V 4.7343 7.9776 126.0203 61.4391 33.6456 174.3463 7 T 4.9552 8.8035 121.4625 60.2368 71.5007 171.9416 8 G 4.7089 8.4342 109.7058 44.2989 0.0000 173.0623 9 T 4.2892 8.5027 109.6777 63.9577 69.4332 173.7350 10 D 4.5332 7.6470 119.5645 53.3867 44.1070 174.9754 11 T 3.9776 8.6264 111.7185 63.9032 69.3616 174.8218 12 E 4.6013 7.9225 121.6202 54.8934 28.7756 175.5684 13 V 4.2072 7.6445 109.4040 60.8462 32.9944 176.6114 14 G 3.8329 8.0558 107.9664 46.8361 0.0000 176.2975 15 K 3.9334 8.2312 122.3116 59.6392 32.1642 177.7064 16 T 4.5041 7.8178 116.6591 65.5344 68.4399 176.8880 17 V 3.5571 7.8197 119.9453 66.0300 31.6015 177.7740 18 A 4.0481 7.8836 119.9608 55.2300 18.1292 179.7707 19 S 4.1281 8.2527 113.7222 62.0547 62.8543 176.7811 20 C 4.1735 8.4832 119.4380 62.6599 27.8472 176.0210 21 A 4.0377 8.1733 122.5084 55.0843 17.9399 179.7218 22 L 3.9599 8.1871 117.6305 57.9329 41.7403 179.7666 23 L 3.9513 8.2488 119.1306 57.7512 41.5691 179.5549 24 Q 3.9306 8.4772 118.2481 58.9752 28.6971 178.7863 25 A 3.9093 8.0010 121.5144 54.9458 18.3401 179.5884 26 A 3.5858 7.5588 119.4671 54.6713 18.0757 179.7936 27 K 3.7901 7.9167 118.0421 59.7175 32.1141 179.0349 28 A 3.9195 7.7379 119.3432 54.7058 18.3503 178.6531 29 A 4.1558 7.6757 117.0868 52.8169 18.6697 178.2000 30 G 3.8483 7.9653 106.1315 44.8144 0.0000 173.7407 31 Y 4.3409 7.4026 116.9813 57.7477 39.1401 176.0346 32 R 4.5009 9.5529 122.7285 55.8750 30.5364 175.7846 33 T 5.7613 9.3698 115.1100 59.5564 72.0591 173.5984 34 A 4.8586 8.5719 123.3771 50.6506 22.7554 175.1876 35 G 4.4722 8.9174 109.8624 45.0338 0.0000 172.7350 36 Y 5.0080 9.0484 123.9033 55.7363 42.4374 173.8018 37 K 4.7890 9.0847 128.2994 52.4029 33.3901 174.1617 38 P 3.8393 0.0000 0.0000 64.5715 32.3545 176.5420 39 V 5.0663 7.7522 117.9877 60.7611 34.3994 174.7733 40 A 5.0287 9.0051 128.1537 50.4443 22.7956 174.9797 41 S 4.9561 8.8697 114.7627 57.8801 66.4198 174.4669 42 G 4.0440 9.5648 110.2594 46.3828 0.0000 172.5593 43 S 4.9506 8.5984 118.4512 57.1876 67.5747 173.0562 44 E 4.8381 8.9253 121.4857 54.4473 32.0481 175.6403 45 K 4.5530 8.5122 122.2685 56.9707 34.1060 176.0054 46 T 4.7144 8.4093 112.0232 59.0796 72.0663 172.8503 47 P 4.2666 0.0000 0.0000 65.0774 31.2177 177.3269 48 E 4.3048 7.9322 115.5789 55.3140 30.2455 174.1441 49 G 3.6831 7.4461 104.9945 43.5616 0.0000 172.9967 50 L 4.6743 8.1770 118.7555 54.7463 42.6028 177.2685 51 R 4.2414 8.8509 121.0537 54.3647 34.2590 173.6486 52 N 5.1085 9.3231 123.3432 52.3321 40.4549 176.2423 53 S 4.2407 8.8296 120.9670 61.5700 63.2232 176.4548 54 D 4.3527 8.1519 121.8668 57.1859 40.5850 178.3771 55 A 4.0117 8.0386 120.7595 55.1681 18.3697 179.3784 56 L 4.0799 8.2667 117.3317 58.0236 41.7752 179.6926 57 A 4.0249 8.1126 120.6985 55.0977 18.1949 179.7500 58 L 3.9925 8.0228 117.6192 57.7835 41.4761 179.4245 59 Q 3.9849 8.2407 119.0923 59.2759 29.2316 178.4066 60 R 4.1416 8.2142 114.9484 58.1554 29.7319 177.2160 61 N 4.7080 7.6818 115.4127 52.5802 39.5097 175.4025 62 S 4.4132 7.3527 117.6544 58.3953 63.4829 174.7363 63 S 4.3485 8.8757 119.0881 60.2036 63.4286 174.8409 64 L 4.3446 7.2590 119.9637 53.7883 42.2371 176.4733 65 Q 4.2086 8.5309 121.1853 55.8193 29.0250 175.7725 66 L 4.9043 8.1828 122.2281 52.6383 45.4209 176.2019 67 D 4.6588 8.3424 120.6230 54.0545 41.9971 176.9483 68 Y 3.9347 8.9137 122.7332 61.1140 38.5797 178.7845 69 A 4.2457 8.0862 119.1672 55.1195 18.5338 179.2280 70 T 3.9673 7.4926 113.8777 66.6533 68.7298 176.7178 71 V 4.1456 7.4699 119.7965 64.4561 32.0489 174.4273 72 N 5.4644 7.7973 116.6971 50.0641 39.5267 171.6082 73 P 4.1266 0.0000 0.0000 64.4287 32.0148 176.3195 74 Y 4.5322 7.8457 116.8590 56.4822 39.8935 175.3230 75 T 4.8837 8.0970 121.0089 61.6600 71.3975 173.6181 76 F 4.9925 9.0895 124.9522 55.6579 42.2215 176.5739 77 A 4.0275 8.8713 124.0091 55.0405 19.4461 177.6231 78 E 4.2759 8.1820 115.8398 55.3209 30.7224 175.9125 79 P 4.6371 0.0000 0.0000 62.4625 29.7624 173.8339 80 T 4.6768 7.0798 114.7068 60.5991 71.3206 172.3040 81 S 4.2361 8.4140 115.4471 57.7404 62.9901 173.5481 82 P 4.0614 0.0000 0.0000 65.9937 30.8886 178.4654 83 H 4.3147 8.0223 114.6433 57.7241 28.5372 177.7945 84 I 3.4296 7.2489 122.6762 64.3691 36.9488 178.2271 85 I 3.5948 7.3196 118.8749 63.6104 37.8984 177.5359 86 S 3.6384 7.6061 114.2035 61.2534 61.9373 176.1436 87 A 3.9486 7.3308 121.8121 55.0196 18.1550 179.0510 88 Q 4.0190 7.7998 117.1405 59.4290 29.3115 178.0272 89 E 4.2766 8.3155 117.3968 56.6216 29.7267 177.1807 90 G 3.7599 7.8965 106.6922 46.4946 0.0000 173.9725 91 R 4.4976 7.8687 120.0826 52.9410 30.8687 172.8012 92 P 4.2429 0.0000 0.0000 62.5133 31.9421 176.5284 93 I 3.3650 8.0208 123.2842 59.9339 37.5200 175.3037 94 E 4.4154 8.8822 127.3941 54.6490 31.2231 176.3162 95 S 4.2030 8.4840 120.6524 61.7459 62.3967 176.2298 96 L 4.0625 8.2554 121.5831 57.7619 41.3110 179.7452 97 V 3.6333 7.8230 117.7750 66.1670 31.4857 177.7644 98 M 4.1306 8.2681 118.4673 58.7617 31.7685 179.0396 99 S 4.6201 8.8264 115.1886 61.5599 62.9929 176.5542 100 A 4.1564 8.5467 123.9908 55.1277 18.2191 179.9101 101 G 3.7102 8.1929 105.6330 47.1974 0.0000 175.7100 102 L 3.5177 7.7864 122.5229 57.8958 41.9512 179.1947 103 R 4.0517 7.8137 116.5604 59.3388 30.3429 178.5836 104 A 4.1061 8.1205 120.5046 55.0711 18.2476 179.7393 105 L 3.9171 7.6392 117.0663 57.8928 41.5232 179.3347 106 E 4.0471 7.9385 116.7721 58.6066 29.3922 178.8855 107 Q 4.2005 7.7351 117.5528 57.8148 28.8272 176.6482 108 Q 4.4941 8.3404 114.8684 54.8798 30.3191 175.0725 109 A 4.8653 7.9829 120.7831 50.4669 21.5735 175.4093 110 D 4.9769 8.8985 119.3189 52.9111 41.4760 175.5498 111 W 5.1924 8.1684 129.6482 56.1355 33.8677 173.3975 112 V 4.9631 8.5539 128.1059 60.9078 33.9967 173.7680 113 L 5.0346 8.8925 129.7030 53.2897 44.5607 174.8014 114 V 4.9405 8.9703 126.9207 61.2363 34.1075 173.5741 115 E 4.4091 9.3101 129.7837 54.5627 31.5428 176.0692 116 G 3.4833 7.2937 114.3108 45.0207 0.0000 172.0424 117 A 4.7557 7.6151 121.9016 51.0636 21.8447 178.6456 118 G 3.7700 8.5401 109.8450 46.2724 0.0000 171.6883 119 G 4.1240 8.1525 109.9568 44.4668 0.0000 173.2320 120 W 4.3128 9.0158 128.5521 60.7128 30.7260 178.4343 121 F 4.8614 8.0634 114.2988 57.7448 38.8448 175.9084 122 T 3.9559 7.5565 117.6012 63.1656 68.5195 172.4068 123 P 4.4894 0.0000 0.0000 62.6235 32.2351 176.1535 124 L 4.3468 8.6162 122.3409 55.4385 43.2132 176.1399 125 S 4.5817 7.3486 110.0409 57.2645 65.5158 173.0308 126 D 4.5036 8.7075 118.8112 56.5769 40.7151 177.2275 127 T 4.6121 7.8943 107.4665 60.7881 69.4619 173.4234 128 F 5.1481 7.9508 124.1529 57.0597 42.6359 173.4036 129 T 4.7070 8.6213 117.0396 58.9654 71.7267 174.7726 130 F 3.5514 8.7674 123.6307 61.2692 39.1310 176.9261 131 A 2.8422 7.1099 119.9729 54.9113 17.9908 179.3577 132 D 4.3651 7.8209 117.0803 57.2128 40.7986 178.8442 133 W 4.2581 8.0179 128.5313 60.3859 30.4499 178.1269 134 V 3.0958 7.7838 118.2685 66.1064 30.9798 178.1731 135 T 3.8719 7.9471 115.5193 66.5320 68.0581 176.3043 136 Q 3.9098 7.7932 120.3729 59.3127 29.2078 177.9598 137 E 3.8796 7.8440 116.8394 56.1634 29.8647 176.4973 138 Q 3.4136 7.5088 116.6653 56.5475 27.0382 173.9964 139 L 4.1383 7.2202 116.4777 53.7003 42.6812 175.7651 140 P 4.6554 0.0000 0.0000 62.8975 32.9703 175.0061 141 V 5.1049 8.8222 121.8951 61.4006 34.4543 174.1490 142 I 4.9497 8.9556 128.4032 59.5334 39.7760 174.1002 143 L 4.9615 8.8297 129.7090 53.7138 43.9887 175.0415 144 V 4.6626 8.8148 127.1812 61.5983 33.4271 174.4160 145 V 4.5540 9.1279 129.0641 61.0789 33.2990 174.7682 146 G 4.0136 8.2867 115.4264 45.9081 0.0000 173.1662 147 V 4.2619 8.6756 127.3734 62.6064 31.7165 175.1436 148 K 4.2698 8.1929 125.8121 55.1893 35.0776 174.6646 149 L 4.1280 7.4533 121.1526 56.0476 42.2915 177.0229 150 G 4.0733 9.2347 114.0667 45.6000 0.0000 174.8460 151 C 4.3030 8.2598 115.1057 60.6338 29.7060 176.0007 152 I 3.5598 7.8247 122.5171 64.2295 36.7374 177.2967 153 N 4.2113 8.0836 117.2583 57.3423 38.8129 176.4677 154 H 4.3010 7.9513 116.8628 58.7272 28.7075 177.7807 155 A 3.9469 8.3506 123.1313 55.2415 18.1796 179.6592 156 M 3.9081 8.1706 117.4146 58.2904 32.0020 178.8930 157 L 3.9785 8.0035 119.1703 58.1902 41.8697 179.8246 158 T 3.6294 7.8135 115.2594 66.4043 68.4626 176.5981 159 A 3.8030 7.8851 122.6728 55.3945 18.3110 179.7982 160 Q 3.7759 8.0323 116.4314 58.8862 28.4983 179.0974 161 V 3.6081 7.3947 118.6378 65.8760 31.9461 177.9073 162 I 3.4136 7.2767 119.5635 64.3235 36.7739 178.4902 163 Q 3.9597 7.7749 118.6824 59.2188 28.2749 178.4640 164 H 4.2551 8.1501 116.3759 58.5439 28.8049 176.8631 165 A 4.4028 7.6990 119.7927 52.1522 18.4029 177.8352 166 G 3.8139 8.0822 105.6377 45.9851 0.0000 173.8005 167 L 4.6037 7.5629 117.9339 53.0562 43.6496 176.1596 168 T 4.1671 8.1570 117.7569 63.2328 69.8487 173.7417 169 L 4.6677 8.5041 129.0394 53.8692 41.5544 175.8471 170 A 4.2007 9.4147 130.5810 53.2880 19.3243 177.1126 171 G 4.1942 7.3022 101.6988 46.3306 0.0000 171.4262 172 W 5.8801 8.3779 115.8161 54.6369 32.1947 174.3874 173 V 4.5033 8.9605 120.3419 61.0221 34.2325 173.9743 174 A 5.1624 8.2757 129.3825 50.9109 20.6152 175.2024 175 N 4.9894 9.1235 122.3801 52.0300 41.0651 173.6502 176 D 5.0376 8.9660 127.1242 53.7097 40.7141 177.5964 177 V 4.0582 8.5140 117.1182 62.4891 32.2336 176.3053 178 T 4.4265 7.3363 108.3141 58.2893 71.7747 171.6046 179 P 3.6731 0.0000 0.0000 61.4315 31.6759 174.6418 180 P 3.9775 0.0000 0.0000 63.4082 31.4425 176.1180 181 G 4.1205 8.2390 110.5413 42.7903 0.0000 173.3892 182 K 3.8529 8.7413 119.9219 59.3537 32.1251 178.8455 183 R 5.1448 7.5654 117.9970 55.3988 31.5688 178.0327 184 H 4.1500 7.9667 120.4418 59.4420 29.9811 176.2507 185 A 4.0303 8.0095 122.1372 55.1986 18.1709 179.3386 186 E 3.9955 8.2031 116.7330 59.5797 29.2489 178.9942 187 Y 3.6561 8.3227 116.8959 61.2929 37.9363 178.4438 188 M 4.3205 8.3328 119.6812 58.7352 32.0598 179.0562 189 T 3.9183 8.0865 115.8110 66.8942 68.6167 176.8787 190 T 3.7953 8.0092 117.7285 66.7098 68.4608 176.6935 191 L 3.7287 8.0295 120.8748 57.9735 41.3298 179.7674 192 T 4.2591 8.0650 114.9684 66.5965 68.4728 176.4084 193 R 4.0252 7.8829 119.6101 59.7371 30.2612 178.0357 194 M 4.2443 7.8902 116.5097 55.8359 32.3819 176.6411 195 I 3.8930 6.9157 120.7995 59.7171 38.2535 175.1459 196 P 4.5703 0.0000 0.0000 60.7611 30.4057 175.3703 197 A 4.5622 7.1968 118.2187 50.9234 22.5246 174.6170 198 P 4.4786 0.0000 0.0000 62.5945 32.7494 175.3262 199 L 3.3809 8.3959 125.2863 54.9500 41.8939 176.6247 200 L 4.0788 8.9933 127.8409 55.3096 43.1321 177.5000 201 G 4.8030 6.6288 107.3976 44.5832 0.0000 170.2580 202 E 5.0109 8.0335 120.2521 54.2514 32.2577 174.7034 203 I 4.0162 8.5326 128.4885 58.9082 38.8150 173.9150 204 P 4.8646 0.0000 0.0000 61.4284 32.3380 175.9260 205 W 4.6889 8.6783 131.0754 57.4186 31.0317 175.1945 206 L 4.1250 7.9366 126.0046 52.7675 44.3138 176.1940 207 A 3.8379 7.5434 124.2364 52.9312 18.6139 177.6282 *213 A 4.1905 7.9131 119.7401 52.0059 20.3176 177.0765 214 A 4.5016 7.8698 119.0793 51.7682 17.8190 177.2441 215 T 4.7943 8.9112 111.5692 62.1134 69.8529 176.0072 216 G 3.7166 8.3765 109.5362 48.0575 0.0000 175.4923 217 K 3.9233 7.7141 119.1540 59.4366 32.8292 177.7905 218 Y 4.4126 7.7899 116.7839 57.7302 38.0884 174.5286 219 I 4.6527 7.2359 121.6759 59.4956 39.0816 175.2648 220 N 4.6332 8.7587 124.8517 51.7110 38.0047 175.0057 221 L 4.0368 8.1765 127.5384 57.0380 42.5536 178.4950 222 A 4.1998 7.9937 119.9930 54.1773 18.3215 177.6019 223 L 4.4715 7.7301 114.4463 54.5721 42.4258 176.7799 224 L 4.2771 7.7584 124.3586 54.8546 41.6410 176.3215 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 S 8.33 4.70 0.00 3.71 3.84 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 2 K 8.53 3.92 0.00 1.47 1.28 0.00 1.83 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.50 7.81 3 R 8.21 4.70 0.00 1.31 1.54 0.00 3.34 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.47 0.00 4 Y 8.42 4.86 0.00 2.66 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 5 F 9.52 5.32 0.00 3.17 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 6 V 7.98 4.73 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.91 0.00 0.00 7 T 8.80 4.96 4.71 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 1.39 0.00 0.00 8 G 8.43 4.71 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 9 T 8.50 4.29 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 1.25 0.00 0.00 10 D 7.65 4.53 0.00 2.63 2.57 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 11 T 8.63 3.98 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 1.23 0.00 0.00 12 E 7.92 4.60 0.00 1.94 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 2.21 2.31 0.00 13 V 7.64 4.21 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 0.84 0.00 0.00 0.99 0.00 0.00 14 G 8.06 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 0.00 0.00 0.00 15 K 8.23 3.93 0.00 1.83 1.81 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.50 7.81 16 T 7.82 4.50 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 1.23 0.00 0.00 17 V 7.82 3.56 2.25 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 1.05 0.00 0.00 0.94 0.00 0.00 18 A 7.88 4.05 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 19 S 8.25 4.13 0.00 4.10 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 20 C 8.48 4.17 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.17 4.04 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 22 L 8.19 3.96 0.00 2.01 1.99 1.00 0.50 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 23 L 8.25 3.95 0.00 1.88 1.89 1.01 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 8.48 3.93 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 25 A 8.00 3.91 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 26 A 7.56 3.59 -0.21 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 0.00 0.00 27 K 7.92 3.79 0.00 1.86 1.94 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.44 7.81 28 A 7.74 3.92 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 29 A 7.68 4.16 1.33 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 0.00 0.00 30 G 7.97 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 31 Y 7.40 4.34 0.00 2.89 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 32 R 9.55 4.50 0.00 1.96 1.96 0.00 3.14 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 33 T 9.37 5.76 4.44 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 1.20 0.00 0.00 34 A 8.57 4.86 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 35 G 8.92 4.47 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 0.00 36 Y 9.05 5.01 0.00 2.99 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 37 K 9.08 4.79 0.00 1.77 1.54 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.29 7.81 38 P 0.00 3.84 0.00 1.81 1.72 0.00 3.71 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.56 0.00 39 V 7.75 5.07 2.25 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 0.96 0.00 0.00 0.76 0.00 0.00 40 A 9.01 5.03 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 41 S 8.87 4.96 0.00 4.19 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 42 G 9.56 4.04 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 0.00 0.00 0.00 43 S 8.60 4.95 0.00 3.83 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 44 E 8.93 4.84 0.00 1.83 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 2.24 2.37 0.00 45 K 8.51 4.55 0.00 1.74 1.79 0.00 1.53 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.37 7.81 46 T 8.41 4.71 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 1.12 0.00 0.00 47 P 0.00 4.27 0.00 2.04 2.15 0.00 3.62 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 2.01 2.09 0.00 48 E 7.93 4.30 0.00 1.89 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 0.00 2.24 2.20 0.00 49 G 7.45 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 0.00 0.00 0.00 0.00 50 L 8.18 4.67 0.00 1.52 1.59 0.93 0.82 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 51 R 8.85 4.24 0.00 1.49 1.47 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.39 0.00 52 N 9.32 5.11 0.00 2.94 2.84 0.00 0.00 6.59 8.35 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 53 S 8.83 4.24 0.00 4.11 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 54 D 8.15 4.35 0.00 2.74 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 55 A 8.04 4.01 1.34 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 0.00 0.00 0.00 56 L 8.27 4.08 0.00 2.00 1.81 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.11 4.02 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 58 L 8.02 3.99 0.00 1.91 1.77 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.24 3.98 0.00 2.07 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.98 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 60 R 8.21 4.14 0.00 2.01 2.08 0.00 3.12 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.73 0.00 61 N 7.68 4.71 0.00 2.92 2.92 0.00 0.00 7.00 7.18 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 62 S 7.35 4.41 0.00 4.03 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 63 S 8.88 4.35 0.00 3.97 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 64 L 7.26 4.34 0.00 1.73 1.66 1.01 0.94 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 65 Q 8.53 4.21 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 66 L 8.18 4.90 0.00 1.61 1.54 0.96 1.14 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 67 D 8.34 4.66 0.00 2.73 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.91 3.93 0.00 3.12 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 69 A 8.09 4.25 1.33 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 0.00 0.00 70 T 7.49 3.97 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 1.18 0.00 0.00 71 V 7.47 4.15 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 1.08 0.00 0.00 0.93 0.00 0.00 72 N 7.80 5.46 0.00 2.31 1.91 0.00 0.00 7.18 7.25 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 73 P 0.00 4.13 0.00 1.59 1.83 0.00 3.71 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 2.08 2.18 0.00 74 Y 7.85 4.53 0.00 3.04 2.66 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 75 T 8.10 4.88 4.20 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 1.29 0.00 0.00 76 F 9.09 4.99 0.00 2.97 2.90 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 0.00 0.00 0.00 0.00 77 A 8.87 4.03 1.33 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 0.00 0.00 78 E 8.18 4.28 0.00 1.97 1.89 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 2.29 2.30 0.00 79 P 0.00 4.64 0.00 2.24 2.11 0.00 3.78 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 2.00 1.97 0.00 80 T 7.08 4.68 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 1.19 0.00 0.00 81 S 8.41 4.24 0.00 3.92 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 82 P 0.00 4.06 0.00 2.11 2.06 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 83 H 8.02 4.31 0.00 3.27 3.44 0.00 5.62 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 84 I 7.25 3.43 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.44 0.81 0.00 0.00 85 I 7.32 3.59 1.71 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 1.52 1.46 0.35 0.00 0.00 86 S 7.61 3.64 0.00 3.44 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 87 A 7.33 3.95 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 Q 7.80 4.02 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.93 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 89 E 8.32 4.28 0.00 2.20 2.12 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 2.42 2.38 0.00 90 G 7.90 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 91 R 7.87 4.50 0.00 1.89 2.16 0.00 3.43 0.00 0.00 3.41 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 92 P 0.00 4.24 0.00 2.10 1.96 0.00 3.79 0.00 0.00 3.90 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 93 I 8.02 3.36 1.66 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.31 0.39 0.00 0.00 94 E 8.88 4.42 0.00 2.11 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 2.29 2.55 0.00 95 S 8.48 4.20 0.00 3.53 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 0.00 96 L 8.26 4.06 0.00 1.94 1.74 0.93 0.86 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 97 V 7.82 3.63 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 0.93 0.00 0.00 0.99 0.00 0.00 98 M 8.27 4.13 0.00 1.17 1.87 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.37 0.00 99 S 8.83 4.62 0.00 4.07 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 0.00 100 A 8.55 4.16 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 0.00 101 G 8.19 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 0.00 102 L 7.79 3.52 0.00 2.03 2.04 0.97 1.47 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 0.00 103 R 7.81 4.05 0.00 1.93 1.98 0.00 3.39 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.81 0.00 104 A 8.12 4.11 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 0.00 105 L 7.64 3.92 0.00 1.71 1.65 0.67 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 106 E 7.94 4.05 0.00 2.10 2.00 0.00 0.00 0.00 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 2.31 0.00 107 Q 7.74 4.20 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 108 Q 8.34 4.49 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 109 A 7.98 4.87 1.35 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 0.00 0.00 110 D 8.90 4.98 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.17 5.19 0.00 3.10 2.97 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 0.00 112 V 8.55 4.96 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 0.97 0.00 0.00 0.93 0.00 0.00 113 L 8.89 5.03 0.00 1.91 1.66 0.97 0.68 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 0.00 114 V 8.97 4.94 2.48 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 1.46 0.00 0.00 1.31 0.00 0.00 115 E 9.31 4.41 0.00 1.94 1.68 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 2.05 2.08 0.00 116 G 7.29 3.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.62 4.76 1.35 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 0.00 0.00 118 G 8.54 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 0.00 0.00 0.00 119 G 8.15 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 0.00 120 W 9.02 4.31 0.00 3.16 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 0.00 121 F 8.06 4.86 0.00 3.18 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 0.00 122 T 7.56 3.96 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 1.31 0.00 0.00 123 P 0.00 4.49 0.00 1.64 1.74 0.00 3.64 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.00 0.00 124 L 8.62 4.35 0.00 1.23 1.41 -0.26 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 125 S 7.35 4.58 0.00 3.94 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 0.00 126 D 8.71 4.50 0.00 2.69 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 0.00 127 T 7.89 4.61 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 0.00 128 F 7.95 5.15 0.00 2.89 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 0.00 129 T 8.62 4.71 4.32 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 1.17 0.00 0.00 130 F 8.77 3.55 0.00 3.11 2.78 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 0.00 131 A 7.11 2.84 0.53 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 0.00 0.00 132 D 7.82 4.37 0.00 3.09 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 0.00 133 W 8.02 4.26 0.00 3.46 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 0.00 134 V 7.78 3.10 1.63 0.00 0.00 0.00 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 -0.12 0.00 0.00 135 T 7.95 3.87 4.41 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 1.25 0.00 0.00 136 Q 7.79 3.91 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 137 E 7.84 3.88 0.00 1.34 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 1.47 1.47 0.00 138 Q 7.51 3.41 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 139 L 7.22 4.14 0.00 1.60 1.63 0.81 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 4.66 0.00 2.24 2.19 0.00 3.58 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.80 0.00 141 V 8.82 5.10 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 1.22 0.00 0.00 1.18 0.00 0.00 142 I 8.96 4.95 1.91 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.77 0.94 0.00 0.00 143 L 8.83 4.96 0.00 1.78 1.61 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.81 4.66 2.12 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 0.91 0.00 0.00 0.96 0.00 0.00 145 V 9.13 4.55 2.40 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 1.02 0.00 0.00 0.99 0.00 0.00 146 G 8.29 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 0.00 147 V 8.68 4.26 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 0.86 0.00 0.00 1.14 0.00 0.00 148 K 8.19 4.27 0.00 1.82 1.81 0.00 1.59 0.00 0.00 1.97 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.34 7.81 149 L 7.45 4.13 0.00 1.46 1.56 0.98 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 150 G 9.23 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 0.00 151 C 8.26 4.30 0.00 3.25 3.36 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 0.00 152 I 7.82 3.56 1.78 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.39 0.77 0.00 0.00 153 N 8.08 4.21 0.00 2.79 2.89 0.00 0.00 7.15 7.89 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 0.00 154 H 7.95 4.30 0.00 3.19 3.31 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 A 8.35 3.95 1.14 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 0.00 156 M 8.17 3.91 0.00 1.97 2.22 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.74 0.00 157 L 8.00 3.98 0.00 1.86 1.75 1.00 0.63 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 0.00 158 T 7.81 3.63 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 1.00 0.00 0.00 159 A 7.89 3.80 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 0.00 160 Q 8.03 3.78 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 161 V 7.39 3.61 2.05 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 0.68 0.00 0.00 1.10 0.00 0.00 162 I 7.28 3.41 1.46 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.33 0.65 0.00 0.00 163 Q 7.77 3.96 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 164 H 8.15 4.26 0.00 3.28 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 A 7.70 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 166 G 8.08 3.81 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 0.00 0.00 0.00 167 L 7.56 4.60 0.00 1.74 1.61 1.14 0.94 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 0.00 168 T 8.16 4.17 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 0.00 169 L 8.50 4.67 0.00 1.56 1.59 0.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 170 A 9.41 4.20 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 0.00 171 G 7.30 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 0.00 0.00 0.00 0.00 172 W 8.38 5.88 0.00 3.56 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 0.00 173 V 8.96 4.50 2.12 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 0.95 0.00 0.00 0.91 0.00 0.00 174 A 8.28 5.16 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 0.00 175 N 9.12 4.99 0.00 2.88 2.73 0.00 0.00 6.77 9.15 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 0.00 176 D 8.97 5.04 0.00 2.77 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 0.00 177 V 8.51 4.06 2.14 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 0.78 0.00 0.00 0.95 0.00 0.00 178 T 7.34 4.43 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 1.12 0.00 0.00 179 P 0.00 3.67 0.00 1.55 1.23 0.00 3.16 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.44 0.00 180 P 0.00 3.98 0.00 1.96 1.98 0.00 3.49 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 2.03 2.08 0.00 181 G 8.24 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 0.00 182 K 8.74 3.85 0.00 1.70 1.86 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.49 7.81 183 R 7.57 5.14 0.00 1.91 2.06 0.00 3.68 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 184 H 7.97 4.15 0.00 3.23 3.31 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 A 8.01 4.03 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 0.00 186 E 8.20 4.00 0.00 2.16 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 2.42 2.48 0.00 187 Y 8.32 3.66 0.00 3.34 3.07 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 0.00 188 M 8.33 4.32 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.71 0.00 189 T 8.09 3.92 4.38 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 1.22 0.00 0.00 190 T 8.01 3.80 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 1.01 0.00 0.00 191 L 8.03 3.73 0.00 1.86 1.00 1.08 0.43 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 0.00 192 T 8.06 4.26 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 1.34 0.00 0.00 193 R 7.88 4.03 0.00 2.02 2.11 0.00 3.23 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 194 M 7.89 4.24 0.00 1.90 1.94 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.49 0.00 195 I 6.92 3.89 1.23 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.08 0.64 0.00 0.00 196 P 0.00 4.57 0.00 2.15 2.06 0.00 3.69 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 1.92 1.88 0.00 197 A 7.20 4.56 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 0.00 198 P 0.00 4.48 0.00 2.12 2.22 0.00 3.87 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 2.21 2.00 0.00 199 L 8.40 3.38 0.00 1.20 1.40 -0.37 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 200 L 8.99 4.08 0.00 1.48 1.61 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 201 G 6.63 4.80 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 0.00 0.00 0.00 0.00 0.00 0.00 202 E 8.03 5.01 0.00 1.86 1.76 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 2.11 2.29 0.00 203 I 8.53 4.02 1.94 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 1.32 0.48 0.80 0.00 0.00 204 P 0.00 4.86 0.00 1.97 1.87 0.00 2.36 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.25 0.00 205 W 8.68 4.69 0.00 3.39 3.22 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 0.00 206 L 7.94 4.12 0.00 1.41 1.28 0.86 0.74 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 0.00 207 A 7.54 3.84 0.99 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 *213 A 7.91 4.19 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 0.00 214 A 7.87 4.50 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 0.00 215 T 8.91 4.79 4.44 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 1.31 0.00 0.00 216 G 8.38 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 0.00 217 K 7.71 3.92 0.00 1.58 1.71 0.00 0.61 0.00 0.00 0.88 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.96 0.47 7.81 218 Y 7.79 4.41 0.00 3.15 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 0.00 219 I 7.24 4.65 1.93 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 1.21 0.83 0.88 0.00 0.00 220 N 8.76 4.63 0.00 2.68 2.68 0.00 0.00 6.53 6.20 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 0.00 221 L 8.18 4.04 0.00 1.72 1.66 0.83 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 222 A 7.99 4.20 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 0.00 223 L 7.73 4.47 0.00 1.64 1.71 0.94 1.02 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 0.00 224 L 7.76 4.28 0.00 1.85 1.61 0.47 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.