NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5266 8.3349 117.1103 57.3703 64.0674 173.3751 3 L 4.0324 8.3325 122.9739 53.3760 42.0905 174.7882 4 P 4.3487 0.0000 0.0000 62.7589 32.6907 175.9452 5 M 4.4644 8.7321 123.6433 54.8333 34.0917 174.6255 6 L 5.0661 8.9234 122.1066 53.3840 44.8325 174.7161 7 Q 5.0497 8.9487 127.4859 54.1539 32.1945 174.1375 8 V 4.5712 8.2738 125.8706 60.3349 33.6187 174.6997 9 A 4.4590 8.3102 127.4507 51.0543 19.6003 177.6379 10 L 4.2491 8.7114 124.6962 53.2720 41.2536 177.2829 11 D 5.0122 7.7111 130.5436 53.2509 40.6499 175.7999 12 N 5.1458 7.4430 117.0126 51.8270 41.2004 176.6806 13 Q 4.1797 8.3795 118.7848 57.4797 29.8941 175.8567 14 T 4.8095 7.3109 107.3285 59.0241 73.2607 174.4455 15 M 3.6284 8.9716 122.5316 58.5025 32.0391 178.9524 16 D 4.2768 7.8065 118.7242 56.3600 39.7136 178.4142 17 S 4.0128 7.6233 113.2489 61.0699 62.3326 175.8423 18 A 4.0329 7.6225 122.9971 55.6329 18.0352 179.3101 19 Y 4.6716 7.8890 116.4252 60.6063 37.6422 178.3530 20 E 4.0213 8.0295 118.9040 59.4080 29.8316 179.2305 21 T 4.1649 7.4966 114.9902 66.6973 68.7613 177.3725 22 T 3.9017 8.2893 112.0615 64.5407 68.5452 176.5853 23 R 4.0901 8.2162 118.2292 58.5601 29.4383 178.3213 24 L 4.3459 7.7108 119.2983 56.1305 42.3596 177.3752 25 I 4.3853 7.3068 108.2978 60.0069 38.6258 176.6349 26 A 3.6069 7.8955 125.2171 55.3405 18.0286 178.5607 27 E 4.3910 7.9711 111.5771 56.6224 29.7966 176.3997 28 E 4.4737 8.1996 118.2707 56.2137 30.3296 175.7528 29 V 4.5337 7.2347 110.8058 59.5111 35.5524 174.8580 30 D 4.6025 8.7884 120.9409 55.9653 41.8768 177.6330 31 I 4.5057 7.4609 118.1057 59.2859 41.2712 174.6497 32 I 4.3750 8.4281 127.6130 59.6014 39.2001 174.1163 33 E 4.8197 8.8222 129.3716 54.7259 31.4779 175.1411 34 V 3.9969 8.9299 128.3302 61.9956 32.2071 175.7406 35 G 4.3822 8.6530 115.9524 45.2865 0.0000 173.6885 36 T 4.0013 8.6110 117.3095 66.6826 68.4063 176.9611 37 I 3.6777 7.6544 121.1840 64.2838 37.1060 178.0526 38 L 4.2084 7.6837 122.0115 57.5170 42.0440 178.5007 39 C 4.0658 8.2903 117.1205 62.7833 27.8153 176.1906 40 V 3.7784 7.8172 119.0198 65.4397 31.1745 178.1571 41 G 3.7555 7.8782 106.3726 46.4600 0.0000 174.7256 42 E 4.5860 8.2242 117.7921 54.8422 31.7698 177.1473 43 G 3.8586 8.2558 108.4645 44.7612 0.0000 174.3251 44 V 3.7019 8.0351 117.2643 63.6110 31.2306 177.9787 45 R 3.9411 8.0791 116.8886 59.3018 29.0103 178.3502 46 A 3.9517 8.1810 121.8567 54.9159 18.2067 179.8117 47 V 3.4572 7.6621 116.7486 66.0982 31.6915 178.0376 48 R 4.3170 7.8694 119.2618 59.0559 29.8527 178.0331 49 D 4.3421 8.4074 118.6894 57.4378 40.9492 178.8138 50 L 4.1416 8.0765 119.5408 57.6908 41.3459 179.4984 51 K 3.9741 8.4885 119.7724 59.3958 31.8788 178.7760 52 A 3.9651 7.8373 120.4068 54.9980 18.3094 179.3188 53 L 3.7232 7.5576 116.9392 56.7576 42.9870 177.3317 54 Y 4.9461 7.5530 115.0137 56.2417 38.3546 174.8191 55 P 4.5353 0.0000 0.0000 64.7464 32.2179 177.7254 56 H 4.4733 8.1842 113.2108 56.6442 29.1537 175.2944 57 K 4.3551 7.4336 119.8056 54.7343 33.5423 176.2344 58 I 3.7805 7.8619 122.7270 61.3384 38.2636 174.9375 59 V 4.5962 8.9399 127.4128 60.9305 34.0638 173.7164 60 L 4.9912 8.5294 130.0064 53.4624 44.2347 174.8704 61 A 4.6018 8.7669 128.9792 50.3499 19.8730 176.2850 62 D 4.8310 8.4260 125.7878 54.0283 38.2806 176.1676 63 A 4.0461 7.9514 122.9788 52.2080 20.0539 177.7741 64 K 3.7188 7.8215 114.5229 57.2177 30.1628 176.2636 65 I 3.6772 7.7494 119.2643 61.7758 37.8091 177.4054 66 A 4.4049 8.3096 126.8701 52.7831 20.7324 175.1798 67 D 4.3939 8.2743 111.6211 54.7557 44.4342 173.8421 68 A 3.7467 8.6019 121.3142 52.9311 16.0940 179.4822 69 G 3.6925 8.1246 110.0352 48.4649 0.0000 174.8177 70 K 4.0131 7.9891 121.6369 59.1644 32.3444 178.8902 71 I 3.7366 7.6438 119.5072 64.5203 37.1484 178.3389 72 L 3.9831 8.0829 119.9232 57.6010 41.3318 179.3710 73 S 4.0175 8.0289 113.1624 61.5915 62.3592 176.3180 74 R 3.9482 8.1775 121.1924 59.6497 29.6679 178.2227 75 M 4.0405 8.0842 118.5311 58.6796 32.0405 178.6281 76 C 3.9820 7.7227 116.3612 62.8004 28.2379 176.2327 77 F 4.0289 8.0222 119.6852 60.3014 38.1029 177.6550 78 E 4.0727 8.2910 117.5839 58.6838 29.4901 178.1534 79 A 4.2960 7.5807 119.5650 51.8809 18.3014 177.7083 80 N 4.5304 8.0726 113.9859 53.8166 36.4786 174.5477 81 A 4.0203 7.4179 120.4633 53.0991 19.2200 178.3353 82 D 4.8208 9.0461 121.6846 56.2761 42.2113 176.7617 83 W 5.8350 8.0007 116.3974 55.0557 33.4676 174.9015 84 V 5.2090 8.8864 114.4192 58.7362 35.7939 174.6383 85 T 4.8833 8.2837 112.7514 60.2232 71.5381 173.3354 86 V 4.7999 8.1819 123.6579 60.8571 34.5693 174.6784 87 I 4.1035 8.5057 128.6877 60.7448 38.5353 176.7018 88 C 3.9312 8.3111 123.1177 61.0742 29.5210 174.4831 89 C 4.4290 8.0249 112.4490 58.5268 29.8775 173.6299 90 A 4.1099 7.6800 124.3461 51.8201 18.7662 176.7938 91 D 4.4309 8.7614 120.0354 54.7795 41.9265 177.7019 92 I 3.8504 8.6309 124.7092 64.5373 37.8376 177.8183 93 N 4.5325 8.8162 116.9761 55.8378 37.9512 177.6136 94 T 3.8496 7.9914 117.6124 66.5740 68.6022 176.3846 95 A 4.0576 8.0111 122.1478 55.1735 18.4614 179.6889 96 K 4.0923 8.2841 117.1522 59.4952 32.0823 179.8947 97 G 3.6156 8.4104 105.9726 47.7214 0.0000 175.6115 98 A 4.1013 8.1930 123.4095 54.8630 18.3969 179.5216 99 L 3.9262 8.1425 118.8637 58.2599 41.9191 178.8381 100 D 4.3605 8.0022 118.0780 57.4062 41.1965 178.7637 101 V 3.7743 7.7398 118.0242 65.8891 31.5367 177.6791 102 A 2.8193 8.1931 120.8508 55.0779 18.1117 179.7666 103 K 3.8982 8.1403 116.6730 59.6352 31.8384 179.3778 104 E 3.9245 7.8544 117.7803 58.4658 29.3225 178.3646 105 F 4.5314 7.6530 114.4798 55.7376 39.7845 174.9693 106 N 4.1578 7.6624 114.5938 54.3628 36.8545 173.8291 107 G 4.5257 7.8813 106.9207 45.3730 0.0000 172.9395 108 D 4.9697 9.0407 117.8462 53.0488 45.4612 175.1602 109 V 4.9120 8.2374 121.0658 61.1109 34.1886 174.4275 110 Q 4.6562 8.7154 126.1060 54.0349 31.8813 174.6221 111 I 4.0057 7.6998 124.2963 60.3947 38.8169 174.7667 112 Q 4.0897 8.7087 129.6806 54.7369 29.8813 175.9352 113 L 4.1660 8.1632 132.1264 53.5102 39.8794 176.3127 114 T 4.4179 7.5649 115.2244 63.0155 70.8055 175.8919 115 G 3.8459 8.7854 117.7460 46.3169 0.0000 172.2924 *116 Y 4.3908 8.2827 121.0771 55.4911 38.0554 171.7200 117 W 5.3242 7.7448 120.0878 54.0000 31.3423 173.8274 118 T 4.3235 8.3824 108.7298 58.9020 72.6706 175.0290 119 W 4.5318 8.4962 123.5461 60.2489 29.0943 179.3745 120 E 4.0352 8.2206 118.3415 61.1976 29.2332 183.2919 121 Q 3.8019 7.7320 119.0259 58.4434 28.6994 178.7266 122 A 3.3047 7.2036 121.2311 55.0662 18.3582 179.4809 123 Q 4.0070 8.0362 117.7751 59.3892 29.1002 178.4495 124 Q 3.9960 7.8911 119.0694 58.7215 28.7360 178.8429 125 W 4.4790 8.0140 119.9554 59.9108 29.1461 178.7272 126 R 3.9335 8.4367 117.9646 59.5885 29.3253 178.9518 127 D 4.4109 8.2938 117.1773 57.0906 40.8702 178.1483 128 A 4.3149 7.9289 119.6671 52.9868 18.6359 178.2005 129 G 3.9887 7.9178 105.5148 45.0148 0.0000 173.8490 130 I 3.8952 7.7641 121.2034 61.3361 37.5047 176.1083 131 G 4.2335 8.7599 110.4046 46.0696 0.0000 172.3157 132 Q 5.1710 7.8892 119.0131 54.1356 33.1461 174.4996 133 V 4.4433 8.3222 115.0271 59.3573 36.4729 175.0160 134 V 4.4613 8.1657 122.9630 61.2468 33.7743 174.0929 135 Y 4.4915 9.2494 131.6779 57.2868 39.6287 173.5549 136 H 5.5648 7.9704 126.5639 54.3401 32.5491 172.7832 137 R 3.9226 8.9069 127.1548 54.9311 30.8813 175.6505 138 S 3.8717 8.4707 121.6642 58.5579 62.9882 175.3491 139 R 4.0869 8.6387 123.8706 59.5804 28.9926 178.8285 140 D 4.3149 8.0419 118.8966 56.7385 40.8914 178.4177 141 A 3.8935 7.7893 121.1062 55.0222 18.2539 179.1003 142 Q 3.9855 8.3625 118.3869 59.6810 28.8522 178.9632 143 A 4.0184 8.0113 119.7052 54.6504 18.4020 178.4296 144 A 4.3751 7.3610 117.1875 52.3051 18.6660 178.0641 145 G 3.8599 8.0611 106.8455 45.4808 0.0000 174.1338 146 V 3.6432 7.5844 119.9745 62.2149 31.6639 175.5120 147 A 4.6615 8.1897 129.9358 50.0832 20.7894 176.4439 148 W 4.6939 8.6970 119.5932 57.0151 30.4393 177.3546 149 G 4.0712 8.9373 109.6187 45.7249 0.0000 174.2053 150 E 3.9913 8.7970 117.8755 61.5551 29.7183 175.3267 151 A 4.3629 8.1327 121.4362 54.9422 18.3313 179.4365 152 D 4.8899 8.1674 118.4049 57.2297 41.1606 178.6278 153 I 3.7988 7.7251 119.8433 64.8200 37.1387 178.5942 154 T 3.9302 8.0895 116.1435 66.7541 68.2536 176.6668 155 A 4.5970 8.2528 122.6220 55.3406 18.4629 179.7951 156 I 3.7064 8.1336 118.7318 64.4451 37.1095 178.8106 157 K 4.0810 8.3130 119.4391 59.4370 31.8988 179.4492 158 R 3.9157 8.2227 119.0278 59.3730 29.8848 178.4973 159 L 4.5328 8.7404 119.1919 58.1346 41.6510 179.4893 160 S 4.5936 8.3822 114.3927 61.1399 62.1427 176.0017 161 D 4.4136 8.2663 120.5960 57.3216 40.6264 178.1241 162 M 4.2530 7.9366 117.8929 56.0665 32.0729 177.0898 163 G 3.9924 7.8425 106.5518 44.7909 0.0000 173.8960 164 F 4.7764 7.8461 119.4158 56.8992 40.7263 175.0467 165 K 4.1922 9.1578 123.0181 56.2656 33.1186 175.9972 166 V 4.6665 8.3789 125.2182 61.5092 33.8598 174.3341 167 T 4.7521 8.7172 125.0176 62.2262 70.7794 173.7700 168 V 4.8996 8.0897 125.1307 61.5018 34.2579 174.2397 169 T 4.7759 9.0808 120.7793 61.6348 71.5283 170.4885 170 G 3.9217 10.1387 112.1228 46.6235 0.0000 173.8534 171 G 4.3749 8.4044 115.7492 46.2162 0.0000 171.6057 172 L 4.4225 7.6500 117.0229 54.4847 42.2925 176.8422 173 A 4.9756 9.1600 125.8703 49.7542 22.1973 176.8052 174 L 3.2887 8.3379 120.6809 58.6051 41.5844 179.4101 175 E 4.0347 7.9772 116.0092 58.9811 29.6963 178.4113 176 D 4.5062 8.1999 119.2271 56.6492 40.9091 178.3804 177 L 4.0711 7.7075 119.5458 57.5914 41.7696 177.7307 178 P 4.2096 0.0000 0.0000 65.1957 30.9503 178.1635 179 L 3.8100 7.5510 118.5433 57.1559 41.9354 177.3775 180 F 4.8308 7.9399 115.6145 56.7003 39.5801 175.5124 181 K 3.1243 7.4400 122.4712 57.7345 32.2136 177.1432 182 G 3.9524 8.4490 113.0148 45.2041 0.0000 173.0088 183 I 4.6034 7.4091 120.6188 58.8767 39.6587 175.0902 184 P 4.7408 0.0000 0.0000 61.8950 29.9553 176.3974 185 I 3.5688 7.2767 122.0528 62.3654 38.3474 177.0468 186 H 4.3351 9.0855 126.1547 58.9264 30.8875 175.2566 187 V 4.6797 7.1487 116.5322 61.3923 35.2075 172.8813 188 F 5.2196 8.9995 126.2416 55.9690 41.1738 174.6466 189 I 4.8244 8.3504 124.1167 59.7368 39.1359 175.1225 190 A 4.0576 8.7632 127.5302 51.3836 21.4661 175.0119 191 G 3.7218 9.0020 112.6179 46.4845 0.0000 175.5757 192 R 4.0365 8.7064 118.2452 59.1100 30.7197 178.6228 193 S 4.2740 8.1202 111.6602 60.6933 63.1325 175.8374 194 I 4.1321 7.5141 122.9688 63.8315 37.4158 178.0375 195 R 3.9521 8.0628 117.6097 58.7259 29.9849 177.9302 196 D 4.7185 7.9378 115.3159 53.1315 41.6099 176.7807 197 A 4.1799 7.0474 122.9286 51.6373 19.1063 177.7290 198 A 4.0491 8.7221 123.5799 54.6694 18.6699 178.3470 199 S 4.5318 7.7078 110.2427 55.1562 63.7454 171.9564 200 P 4.3615 0.0000 0.0000 65.5455 31.1873 178.3788 201 V 3.5700 7.6930 116.3104 66.0998 31.5149 177.6527 202 E 3.9921 8.2090 118.5195 58.8598 29.4142 178.5942 203 A 4.0376 8.3095 120.9881 55.0594 18.5320 179.3576 204 A 4.0146 8.1818 119.2905 55.5625 18.4072 180.0714 205 R 3.9483 8.1673 116.4938 59.4962 30.0679 179.3425 206 Q 3.9937 8.4939 118.1374 58.9345 28.6308 178.7892 207 F 3.8888 8.3581 118.7538 60.5665 38.9930 177.9241 208 K 4.0672 8.3101 117.9875 59.5370 31.8373 179.6893 209 R 3.9662 8.4046 118.7551 59.2960 29.9309 179.1120 210 S 4.1076 8.3009 113.0208 61.3589 62.3610 176.1917 211 I 4.1011 8.1809 122.5285 64.5953 36.7294 178.2871 212 A 4.1392 8.3087 121.5506 55.1173 17.7937 179.6586 213 E 3.9699 8.3321 117.1773 59.7430 29.4135 179.5988 214 L 3.7312 8.3563 117.9500 56.3282 41.7373 178.4639 215 W 4.6585 8.3830 116.0114 56.1549 29.8825 176.0937 216 G 4.1407 7.6281 113.1705 45.1285 0.0000 173.8673 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 2 S 8.33 4.53 0.00 3.65 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 3 L 8.33 4.03 0.00 1.72 1.64 0.98 0.91 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 4 P 0.00 4.35 0.00 1.61 1.25 0.00 3.29 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 0.49 0.93 0.00 5 M 8.73 4.46 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 6 L 8.92 5.07 0.00 1.74 1.45 0.70 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.95 5.05 0.00 2.09 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.61 0.00 0.00 0.00 0.00 0.00 2.18 2.33 0.00 8 V 8.27 4.57 1.98 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 0.56 0.00 0.00 0.86 0.00 0.00 9 A 8.31 4.46 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 10 L 8.71 4.25 0.00 1.68 1.59 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.71 5.01 0.00 2.68 2.60 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 12 N 7.44 5.15 0.00 2.66 2.64 0.00 0.00 6.97 7.41 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 13 Q 8.38 4.18 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 14 T 7.31 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 1.17 0.00 0.00 15 M 8.97 3.63 0.00 1.45 1.96 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 16 D 7.81 4.28 0.00 2.89 2.93 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 17 S 7.62 4.01 0.00 3.97 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 18 A 7.62 4.03 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 19 Y 7.89 4.67 0.00 3.13 2.95 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 20 E 8.03 4.02 0.00 2.20 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 0.00 2.39 2.59 0.00 21 T 7.50 4.16 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 1.19 0.00 0.00 22 T 8.29 3.90 4.10 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 1.27 0.00 0.00 23 R 8.22 4.09 0.00 2.02 2.22 0.00 3.10 0.00 0.00 3.26 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.71 0.00 24 L 7.71 4.35 0.00 1.84 1.76 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.31 4.39 1.82 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 1.38 0.93 0.00 0.00 26 A 7.90 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.97 4.39 0.00 1.96 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 2.29 2.29 0.00 28 E 8.20 4.47 0.00 1.99 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 2.24 2.39 0.00 29 V 7.23 4.53 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 0.66 0.00 0.00 0.84 0.00 0.00 30 D 8.79 4.60 0.00 2.57 2.64 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 31 I 7.46 4.51 1.76 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 0.85 0.55 0.68 0.00 0.00 32 I 8.43 4.37 1.75 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 0.89 0.82 0.85 0.00 0.00 33 E 8.82 4.82 0.00 2.14 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 2.27 2.20 0.00 34 V 8.93 4.00 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 0.89 0.00 0.00 0.90 0.00 0.00 35 G 8.65 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 0.00 0.00 0.00 0.00 36 T 8.61 4.00 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 1.17 0.00 0.00 37 I 7.65 3.68 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.86 0.91 0.00 0.00 38 L 7.68 4.21 0.00 1.91 1.75 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 39 C 8.29 4.07 0.00 3.13 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 40 V 7.82 3.78 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 0.78 0.00 0.00 0.90 0.00 0.00 41 G 7.88 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 42 E 8.22 4.59 0.00 1.97 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 2.17 2.33 0.00 43 G 8.26 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 0.00 0.00 0.00 44 V 8.04 3.70 2.03 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 0.82 0.00 0.00 0.90 0.00 0.00 45 R 8.08 3.94 0.00 2.05 2.24 0.00 2.96 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.69 0.00 46 A 8.18 3.95 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 47 V 7.66 3.46 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 1.02 0.00 0.00 0.85 0.00 0.00 48 R 7.87 4.32 0.00 1.90 2.06 0.00 3.27 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.59 0.00 49 D 8.41 4.34 0.00 2.86 2.83 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 50 L 8.08 4.14 0.00 1.88 1.86 1.02 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.49 3.97 0.00 1.90 1.80 0.00 1.51 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.50 7.81 52 A 7.84 3.97 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 53 L 7.56 3.72 0.00 1.02 0.13 0.37 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 7.55 4.95 0.00 2.91 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 55 P 0.00 4.54 0.00 2.19 2.24 0.00 3.42 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.91 0.00 56 H 8.18 4.47 0.00 3.30 3.46 0.00 5.51 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 7.43 4.36 0.00 1.78 1.60 0.00 1.54 0.00 0.00 1.58 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.08 1.30 7.81 58 I 7.86 3.78 1.38 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.39 -0.47 0.00 0.00 59 V 8.94 4.60 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 0.96 0.00 0.00 0.93 0.00 0.00 60 L 8.53 4.99 0.00 1.94 1.49 1.10 0.78 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 61 A 8.77 4.60 1.09 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 62 D 8.43 4.83 0.00 2.66 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 63 A 7.95 4.05 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 64 K 7.82 3.72 0.00 1.85 1.80 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.47 7.81 65 I 7.75 3.68 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.62 0.92 0.00 0.00 66 A 8.31 4.40 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 67 D 8.27 4.39 0.00 2.58 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.60 3.75 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 69 G 8.12 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 70 K 7.99 4.01 0.00 1.87 1.84 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.58 7.81 71 I 7.64 3.74 1.88 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 1.66 0.62 0.92 0.00 0.00 72 L 8.08 3.98 0.00 1.79 1.67 0.94 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.03 4.02 0.00 4.32 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 74 R 8.18 3.95 0.00 2.16 2.13 0.00 3.23 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.87 0.00 75 M 8.08 4.04 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.58 0.00 76 C 7.72 3.98 0.00 2.64 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 F 8.02 4.03 0.00 2.32 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 78 E 8.29 4.07 0.00 1.95 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 0.00 2.56 2.53 0.00 79 A 7.58 4.30 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 80 N 8.07 4.53 0.00 2.92 3.04 0.00 0.00 6.85 7.06 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 81 A 7.42 4.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.05 4.82 0.00 2.41 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.00 5.83 0.00 3.17 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 84 V 8.89 5.21 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 0.27 0.00 0.00 0.95 0.00 0.00 85 T 8.28 4.88 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 1.19 0.00 0.00 86 V 8.18 4.80 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 0.88 0.00 0.00 0.87 0.00 0.00 87 I 8.51 4.10 1.96 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.01 0.91 0.00 0.00 88 C 8.31 3.93 0.00 3.33 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 89 C 8.02 4.43 0.00 3.16 3.15 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 90 A 7.68 4.11 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 91 D 8.76 4.43 0.00 2.79 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 92 I 8.63 3.85 1.96 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.15 0.96 0.00 0.00 93 N 8.82 4.53 0.00 2.93 2.88 0.00 0.00 6.94 6.58 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 94 T 7.99 3.85 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 1.21 0.00 0.00 95 A 8.01 4.06 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 96 K 8.28 4.09 0.00 2.02 1.90 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.66 7.81 97 G 8.41 3.62 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 98 A 8.19 4.10 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 99 L 8.14 3.93 0.00 1.95 1.84 0.92 1.21 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 0.00 100 D 8.00 4.36 0.00 2.93 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 0.00 101 V 7.74 3.77 2.34 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 1.23 0.00 0.00 1.04 0.00 0.00 102 A 8.19 2.82 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 0.00 103 K 8.14 3.90 0.00 1.95 1.84 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.59 7.81 104 E 7.85 3.92 0.00 2.04 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 2.27 2.55 0.00 105 F 7.65 4.53 0.00 2.41 2.93 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 0.00 106 N 7.66 4.16 0.00 2.83 2.89 0.00 0.00 6.74 8.78 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 0.00 107 G 7.88 4.53 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 0.00 108 D 9.04 4.97 0.00 2.86 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 0.00 0.00 0.00 109 V 8.24 4.91 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 0.80 0.00 0.00 1.02 0.00 0.00 110 Q 8.72 4.66 0.00 1.81 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.71 0.00 0.00 0.00 0.00 0.00 1.79 2.03 0.00 111 I 7.70 4.01 0.75 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 -0.36 -0.53 0.00 0.00 112 Q 8.71 4.09 0.00 1.96 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.09 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 113 L 8.16 4.17 0.00 1.31 0.91 0.33 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 114 T 7.56 4.42 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 1.21 0.00 0.00 115 G 8.79 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 *116 Y 8.28 4.39 0.00 2.34 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 0.00 0.00 0.00 0.00 117 W 7.74 5.32 0.00 3.62 3.13 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 0.00 118 T 8.38 4.32 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 1.15 0.00 0.00 119 W 8.50 4.53 0.00 3.45 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 0.00 120 E 8.22 4.04 0.00 1.97 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 2.31 1.97 0.00 121 Q 7.73 3.80 0.00 1.95 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 122 A 7.20 3.30 1.58 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 0.00 123 Q 8.04 4.01 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 124 Q 7.89 4.00 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 125 W 8.01 4.48 0.00 3.83 3.18 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 0.00 126 R 8.44 3.93 0.00 2.00 1.91 0.00 2.95 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.57 0.00 127 D 8.29 4.41 0.00 2.81 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 0.00 128 A 7.93 4.31 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 0.00 129 G 7.92 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.76 3.90 2.28 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.90 0.89 0.00 0.00 131 G 8.76 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 0.00 0.00 0.00 0.00 132 Q 7.89 5.17 0.00 1.66 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.75 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 133 V 8.32 4.44 1.54 0.00 0.00 0.00 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 0.63 0.00 0.00 134 V 8.17 4.46 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 1.00 0.00 0.00 0.79 0.00 0.00 135 Y 9.25 4.49 0.00 3.15 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 0.00 136 H 7.97 5.56 0.00 3.20 3.24 0.00 5.99 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 R 8.91 3.92 0.00 0.72 1.28 0.00 2.98 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.14 0.00 138 S 8.47 3.87 0.00 3.74 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 0.00 139 R 8.64 4.09 0.00 2.10 2.21 0.00 3.03 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 140 D 8.04 4.31 0.00 2.68 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 0.00 141 A 7.79 3.89 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 0.00 142 Q 8.36 3.99 0.00 2.09 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 143 A 8.01 4.02 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 0.00 144 A 7.36 4.38 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 0.00 145 G 8.06 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 0.00 0.00 0.00 146 V 7.58 3.64 1.98 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 0.65 0.00 0.00 0.93 0.00 0.00 147 A 8.19 4.66 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 0.00 148 W 8.70 4.69 0.00 3.37 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 0.00 149 G 8.94 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 0.00 150 E 8.80 3.99 0.00 1.98 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 2.32 1.96 0.00 151 A 8.13 4.36 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 0.00 152 D 8.17 4.89 0.00 3.26 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 0.00 153 I 7.73 3.80 2.07 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 1.68 1.16 0.96 0.00 0.00 154 T 8.09 3.93 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 1.27 0.00 0.00 155 A 8.25 4.60 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 0.00 0.00 0.00 0.00 0.00 156 I 8.13 3.71 1.94 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 -0.12 0.94 0.00 0.00 157 K 8.31 4.08 0.00 2.05 1.92 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.67 7.81 158 R 8.22 3.92 0.00 1.94 2.25 0.00 2.50 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.39 0.00 159 L 8.74 4.53 0.00 2.16 2.03 1.21 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.38 4.59 0.00 3.98 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 0.00 161 D 8.27 4.41 0.00 2.88 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 0.00 162 M 7.94 4.25 0.00 1.93 2.43 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.03 2.63 0.00 163 G 7.84 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 F 7.85 4.78 0.00 3.20 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 K 9.16 4.19 0.00 1.60 1.40 0.00 1.41 0.00 0.00 1.04 0.00 0.00 2.67 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.31 1.29 7.81 166 V 8.38 4.67 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 1.09 0.00 0.00 1.07 0.00 0.00 167 T 8.72 4.75 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 1.17 0.00 0.00 168 V 8.09 4.90 1.57 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 0.16 0.00 0.00 0.53 0.00 0.00 169 T 9.08 4.78 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 1.30 0.00 0.00 170 G 10.14 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 0.00 0.00 0.00 171 G 8.40 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 7.65 4.42 0.00 1.87 1.81 1.04 0.47 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 0.00 173 A 9.16 4.98 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 0.00 174 L 8.34 3.29 0.00 1.40 1.49 0.23 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 175 E 7.98 4.03 0.00 1.96 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 2.30 2.43 0.00 176 D 8.20 4.51 0.00 2.86 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 0.00 177 L 7.71 4.07 0.00 1.68 1.80 0.75 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.21 0.00 2.08 2.02 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 179 L 7.55 3.81 0.00 1.31 0.78 0.80 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 180 F 7.94 4.83 0.00 3.93 3.40 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 0.00 181 K 7.44 3.12 0.00 1.50 1.51 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.10 0.92 7.81 182 G 8.45 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 I 7.41 4.60 2.27 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 1.47 0.84 1.03 0.00 0.00 184 P 0.00 4.74 0.00 2.21 2.18 0.00 3.87 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 185 I 7.28 3.57 0.99 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.97 -0.17 0.00 0.00 186 H 9.09 4.34 0.00 3.09 3.28 0.00 5.59 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 7.15 4.68 1.98 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 0.94 0.00 0.00 0.82 0.00 0.00 188 F 9.00 5.22 0.00 2.96 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 0.00 189 I 8.35 4.82 1.88 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 1.23 0.52 0.98 0.00 0.00 190 A 8.76 4.06 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 G 9.00 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 0.00 192 R 8.71 4.04 0.00 1.91 2.05 0.00 3.17 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.73 0.00 193 S 8.12 4.27 0.00 4.27 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 0.00 194 I 7.51 4.13 1.80 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.48 0.88 0.00 0.00 195 R 8.06 3.95 0.00 1.76 1.99 0.00 3.13 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 196 D 7.94 4.72 0.00 2.81 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 0.00 197 A 7.05 4.18 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 0.00 198 A 8.72 4.05 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 0.00 199 S 7.71 4.53 0.00 3.86 3.74 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 0.00 200 P 0.00 4.36 0.00 2.20 2.19 0.00 3.67 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 2.13 2.27 0.00 201 V 7.69 3.57 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 1.04 0.00 0.00 0.99 0.00 0.00 202 E 8.21 3.99 0.00 2.18 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 2.38 0.00 203 A 8.31 4.04 1.48 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 0.00 204 A 8.18 4.01 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 0.00 205 R 8.17 3.95 0.00 2.11 2.02 0.00 3.28 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 206 Q 8.49 3.99 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 207 F 8.36 3.89 0.00 3.30 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 K 8.31 4.07 0.00 2.00 1.90 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.66 7.81 209 R 8.40 3.97 0.00 1.98 1.99 0.00 3.13 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 210 S 8.30 4.11 0.00 3.88 3.91 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 0.00 211 I 8.18 4.10 2.19 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 1.60 0.63 1.05 0.00 0.00 212 A 8.31 4.14 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.33 3.97 0.00 2.28 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 2.35 2.49 0.00 214 L 8.36 3.73 0.00 1.69 0.99 1.03 0.58 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 0.00 215 W 8.38 4.66 0.00 3.64 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 0.00 216 G 7.63 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 * Residues marked with a * may have inaccurate shift predictions.